*HEADER    TRANSPORT PROTEIN                       07-DEC-18   6NBN              
*TITLE     STRUCTURE OF AEDES AEGYPTI OBP22 IN THE COMPLEX WITH ARACHIDONIC ACID 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: AAEL005772-PA;                                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: ODORANT BINDING PROTEIN;                                    
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: AEDES AEGYPTI;                                  
*SOURCE   3 ORGANISM_COMMON: YELLOWFEVER MOSQUITO;                               
*SOURCE   4 ORGANISM_TAXID: 7159;                                                
*SOURCE   5 TISSUE: ANTENNAL CDNA;                                               
*SOURCE   6 GENE: 5567053, AAEL005772;                                           
*SOURCE   7 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
*SOURCE   8 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET1A                                     
*KEYWDS    ODORANT BINDING PROTEIN CHEMO-SENSORY SIGNALING LIPID BINDING,        
*KEYWDS   2 TRANSPORT PROTEIN                                                    
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    30                                                                    
*AUTHOR    D.N.JONES,J.WANG                                                      
*REVDAT   1   19-DEC-18 6NBN    0                                                
# Restraints file 1: o22_run25c_distance_restraints.tbl
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   (( segid "   A" and resid 9    and name  HA  ))
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   (( segid "   A" and resid 113  and name  HA  ))
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   (( segid "   A" and resid 30   and name  H   ))
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 or   
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   (( segid "   A" and resid 30   and name  HG2 ))
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   (( segid "   A" and resid 11   and name  H   ))
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   (  segid "   A" and resid 64   and name  HD2*)
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   (( segid "   A" and resid 85   and name  HA  ))
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   (( segid "   A" and resid 29   and name  HB  ))
   (  segid "   A" and resid 29   and name  HG1*)

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 or   
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   (( segid "   A" and resid 84   and name  HG3 ))
   (( segid "   A" and resid 84   and name  HB3 ))

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   (( segid "   A" and resid 87   and name  HB3 ))
   (( segid "   A" and resid 87   and name  HG3 ))

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   (( segid "   A" and resid 64   and name  HB3 ))
   (  segid "   A" and resid 64   and name  HD1*)

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   (( segid "   A" and resid 59   and name  HB2 ))
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   (( segid "   A" and resid 59   and name  H   ))
   (( segid "   A" and resid 59   and name  HB3 ))

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   (  segid "   A" and resid 89   and name  HG2*)
   (( segid "   A" and resid 63   and name  HG3 ))

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   (  segid "   A" and resid 64   and name  HD2*)
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   (  segid "   A" and resid 108  and name  HE* )
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   (( segid "   A" and resid 9    and name  HA  ))
   (( segid "   A" and resid 9    and name  HG3 ))

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   (( segid "   A" and resid 117  and name  HB3 ))
   (( segid "   A" and resid 117  and name  HD2 ))
 or   
   (( segid "   A" and resid 117  and name  HB2 ))
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 assi 
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 assi 
   (( segid "   A" and resid 89   and name  HB  ))
   (( segid "   A" and resid 89   and name  HA  ))
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 or   
   (( segid "   A" and resid 89   and name  HB  ))
   (( segid "   A" and resid 86   and name  HA  ))

 assi 
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 or   
   (( segid "   A" and resid 69   and name  HA  ))
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 assi 
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 or   
   (( segid "   A" and resid 86   and name  HB3 ))
   (  segid "   A" and resid 86   and name  HD1*)

 assi 
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 or   
   (( segid "   A" and resid 59   and name  HA  ))
   (( segid "   A" and resid 59   and name  HB3 ))

 assi 
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 or   
   (( segid "   A" and resid 79   and name  HA  ))
   (( segid "   A" and resid 79   and name  HB3 ))

 assi 
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 or   
   (( segid "   A" and resid 89   and name  HB  ))
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 assi 
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 assi 
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 or   
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 assi 
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 assi 
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 assi 
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 or   
   (( segid "   A" and resid 9    and name  H   ))
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 assi 
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 or   
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 assi 
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 assi 
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 or   
   (( segid "   A" and resid 115  and name  HB2 ))
   (  segid "   A" and resid 115  and name  HD2*)

 assi 
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 or   
   (( segid "   A" and resid 117  and name  HG2 ))
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 assi 
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   (( segid "   A" and resid 81   and name  HA  ))
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 assi 
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 or   
   (( segid "   A" and resid 115  and name  H   ))
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 assi 
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 or   
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 or   
   (( segid "   A" and resid 9    and name  HB2 ))
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 or   
   (( segid "   A" and resid 9    and name  HB2 ))
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 assi 
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 or   
   (( segid "   A" and resid 21   and name  H   ))
   (( segid "   A" and resid 21   and name  HB3 ))

 assi 
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 assi 
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 or   
   (( segid "   A" and resid 15   and name  HB3 ))
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 assi 
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 or   
   (( segid "   A" and resid 15   and name  HG2 ))
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 assi 
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 assi 
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 assi 
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   (( segid "   A" and resid 81   and name  HB  ))
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 or   
   (( segid "   A" and resid 87   and name  H   ))
   (( segid "   A" and resid 87   and name  HB2 ))

 assi 
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 assi 
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 or   
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
   (( segid "   A" and resid 73   and name  HA  ))
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 assi 
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 assi 
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 assi 
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 assi 
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   (( segid "   A" and resid 19   and name  HB  ))
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 assi 
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   (( segid "   A" and resid 37   and name  HA  ))
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
   (( segid "   A" and resid 22   and name  HA  ))
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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   (( segid "   A" and resid 47   and name  HB  ))
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 assi 
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   (( segid "   A" and resid 35   and name  HA  ))
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 assi 
   (( segid "   A" and resid 63   and name  HA  ))
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 assi 
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 or   
   (( segid "   A" and resid 31   and name  HD2 ))
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 assi 
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   (  segid "   A" and resid 50   and name  HG2*)
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 assi 
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 assi 
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   (( segid "   A" and resid 67   and name  HA  ))
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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   (( segid "   A" and resid 60   and name  HB  ))
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 assi 
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   (  segid "   A" and resid 120  and name  HD1*)
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 assi 
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 assi 
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 assi 
   (( segid "   A" and resid 90   and name  H   ))
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 assi 
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 or   
   (( segid "   A" and resid 31   and name  HD3 ))
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 assi 
   (( segid "   A" and resid 64   and name  H   ))
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 assi 
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 assi 
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 or   
   (( segid "   A" and resid 2    and name  HA  ))
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 assi 
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 assi 
   (  segid "   A" and resid 50   and name  HG2*)
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 assi 
   (( segid "   A" and resid 50   and name  HB  ))
   (  segid "   A" and resid 50   and name  HG2*)
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 assi 
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   (( segid "   A" and resid 2    and name  HB2 ))
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 assi 
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   (( segid "   A" and resid 114  and name  HA  ))
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 assi 
   (( segid "   A" and resid 62   and name  H   ))
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 assi 
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 or   
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   (( segid "   A" and resid 84   and name  HB3 ))

 assi 
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 assi 
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   (  segid "   A" and resid 81   and name  HG1*)
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 assi 
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 assi 
   (( segid "   A" and resid 90   and name  H   ))
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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   (( segid "   A" and resid 59   and name  HA  ))
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 assi 
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   (( segid "   A" and resid 8    and name  HA  ))
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 assi 
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   (( segid "   A" and resid 82   and name  HB3 ))
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 assi 
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 assi 
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 assi 
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   (( segid "   A" and resid 66   and name  HA  ))
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 assi 
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 assi 
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   (( segid "   A" and resid 81   and name  HA  ))
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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   (( segid "   A" and resid 65   and name  HA  ))
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 assi 
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 assi 
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 assi 
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 or   
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 or   
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 or   
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 or   
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 or   
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 or   
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 or   
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 or   
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 or   
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 assi 
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 or   
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 or   
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 assi 
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 or   
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 or   
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 or   
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 assi 
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 assi 
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 or   
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 assi 
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 assi 
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 or   
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 or   
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 or   
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 or   
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 assi 
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 assi 
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 assi 
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 or   
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 or   
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 assi 
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 or   
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 assi 
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 or   
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 or   
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 or   
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 or   
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 or   
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 assi 
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 assi 
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 or   
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 or   
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 or   
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 or   
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 or   
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
   (( segid "   A" and resid 48   and name  H   ))
   (( segid "   A" and resid 49   and name  HB2 ))
      4.385     2.404     2.404
 or   
   (( segid "   A" and resid 48   and name  H   ))
   (( segid "   A" and resid 46   and name  HB3 ))

 assi 
   (( segid "   A" and resid 100  and name  HE1 ))
   (( segid "   A" and resid 92   and name  HB2 ))
      4.682     2.740     2.740

 assi 
   (( segid "   A" and resid 53   and name  H   ))
   (( segid "   A" and resid 49   and name  HA  ))
      4.392     2.412     2.412

 assi 
   (( segid "   A" and resid 110  and name  HB2 ))
   (( segid "   A" and resid 110  and name  HG3 ))
      2.622     0.859     0.859

 assi 
   (  segid "   A" and resid 11   and name  HD2*)
   (( segid "   A" and resid 8    and name  HA  ))
      2.313     0.669     0.669
 or   
   (( segid "   A" and resid 8    and name  HA  ))
   (  segid "   A" and resid 120  and name  HD1*)

 assi 
   (( segid "   A" and resid 101  and name  H   ))
   (  segid "   A" and resid 97   and name  HB* )
      4.194     2.198     2.198

 assi 
   (  segid "   A" and resid 44   and name  HE* )
   (( segid "   A" and resid 39   and name  HA  ))
      2.780     0.966     0.966

 assi 
   (( segid "   A" and resid 44   and name  HG2 ))
   (  segid "   A" and resid 44   and name  HE* )
      2.415     0.729     0.729

# Restraints file 2: o22_run25c_dihedral_restraints.tbl
 ASSIGN  (segid "   A" and resid 2    and name C   ) (segid "   A" and resid 3    and name N   )
         (segid "   A" and resid 3    and name CA  ) (segid "   A" and resid 3    and name C   )  1.00 -79.22 50.78 2

 ASSIGN  (segid "   A" and resid 3    and name N   ) (segid "   A" and resid 3    and name CA  )
         (segid "   A" and resid 3    and name C   ) (segid "   A" and resid 4    and name N   )  1.00 131.05 31.05 2

 ASSIGN  (segid "   A" and resid 3    and name C   ) (segid "   A" and resid 4    and name N   )
         (segid "   A" and resid 4    and name CA  ) (segid "   A" and resid 4    and name C   )  1.00 -134.48 35.52 2

 ASSIGN  (segid "   A" and resid 4    and name N   ) (segid "   A" and resid 4    and name CA  )
         (segid "   A" and resid 4    and name C   ) (segid "   A" and resid 5    and name N   )  1.00 148.64 38.64 2

 ASSIGN  (segid "   A" and resid 4    and name C   ) (segid "   A" and resid 5    and name N   )
         (segid "   A" and resid 5    and name CA  ) (segid "   A" and resid 5    and name C   )  1.00 -110.31 39.69 2

 ASSIGN  (segid "   A" and resid 5    and name N   ) (segid "   A" and resid 5    and name CA  )
         (segid "   A" and resid 5    and name C   ) (segid "   A" and resid 6    and name N   )  1.00 127.05 37.05 2

 ASSIGN  (segid "   A" and resid 5    and name C   ) (segid "   A" and resid 6    and name N   )
         (segid "   A" and resid 6    and name CA  ) (segid "   A" and resid 6    and name C   )  1.00 -74.40 85.60 2

 ASSIGN  (segid "   A" and resid 6    and name N   ) (segid "   A" and resid 6    and name CA  )
         (segid "   A" and resid 6    and name C   ) (segid "   A" and resid 7    and name N   )  1.00 134.42 44.42 2

 ASSIGN  (segid "   A" and resid 6    and name C   ) (segid "   A" and resid 7    and name N   )
         (segid "   A" and resid 7    and name CA  ) (segid "   A" and resid 7    and name C   )  1.00 -85.00 25.00 2

 ASSIGN  (segid "   A" and resid 7    and name N   ) (segid "   A" and resid 7    and name CA  )
         (segid "   A" and resid 7    and name C   ) (segid "   A" and resid 8    and name N   )  1.00 165.00 25.00 2

 ASSIGN  (segid "   A" and resid 7    and name C   ) (segid "   A" and resid 8    and name N   )
         (segid "   A" and resid 8    and name CA  ) (segid "   A" and resid 8    and name C   )  1.00 -62.81 17.19 2

 ASSIGN  (segid "   A" and resid 8    and name N   ) (segid "   A" and resid 8    and name CA  )
         (segid "   A" and resid 8    and name C   ) (segid "   A" and resid 9    and name N   )  1.00 -36.01 23.99 2

 ASSIGN  (segid "   A" and resid 8    and name C   ) (segid "   A" and resid 9    and name N   )
         (segid "   A" and resid 9    and name CA  ) (segid "   A" and resid 9    and name C   )  1.00 -64.95 25.05 2

 ASSIGN  (segid "   A" and resid 9    and name N   ) (segid "   A" and resid 9    and name CA  )
         (segid "   A" and resid 9    and name C   ) (segid "   A" and resid 10   and name N   )  1.00 -44.00 26.00 2

 ASSIGN  (segid "   A" and resid 9    and name C   ) (segid "   A" and resid 10   and name N   )
         (segid "   A" and resid 10   and name CA  ) (segid "   A" and resid 10   and name C   )  1.00 -64.58 15.42 2

 ASSIGN  (segid "   A" and resid 10   and name N   ) (segid "   A" and resid 10   and name CA  )
         (segid "   A" and resid 10   and name C   ) (segid "   A" and resid 11   and name N   )  1.00 -44.85 25.15 2

 ASSIGN  (segid "   A" and resid 10   and name C   ) (segid "   A" and resid 11   and name N   )
         (segid "   A" and resid 11   and name CA  ) (segid "   A" and resid 11   and name C   )  1.00 -63.22 26.78 2

 ASSIGN  (segid "   A" and resid 11   and name N   ) (segid "   A" and resid 11   and name CA  )
         (segid "   A" and resid 11   and name C   ) (segid "   A" and resid 12   and name N   )  1.00 -43.09 26.91 2

 ASSIGN  (segid "   A" and resid 11   and name C   ) (segid "   A" and resid 12   and name N   )
         (segid "   A" and resid 12   and name CA  ) (segid "   A" and resid 12   and name C   )  1.00 -64.29 25.71 2

 ASSIGN  (segid "   A" and resid 12   and name N   ) (segid "   A" and resid 12   and name CA  )
         (segid "   A" and resid 12   and name C   ) (segid "   A" and resid 13   and name N   )  1.00 -44.74 25.26 2

 ASSIGN  (segid "   A" and resid 12   and name C   ) (segid "   A" and resid 13   and name N   )
         (segid "   A" and resid 13   and name CA  ) (segid "   A" and resid 13   and name C   )  1.00 -62.20 27.80 2

 ASSIGN  (segid "   A" and resid 13   and name N   ) (segid "   A" and resid 13   and name CA  )
         (segid "   A" and resid 13   and name C   ) (segid "   A" and resid 14   and name N   )  1.00 -40.40 29.60 2

 ASSIGN  (segid "   A" and resid 13   and name C   ) (segid "   A" and resid 14   and name N   )
         (segid "   A" and resid 14   and name CA  ) (segid "   A" and resid 14   and name C   )  1.00 -64.94 25.06 2

 ASSIGN  (segid "   A" and resid 14   and name N   ) (segid "   A" and resid 14   and name CA  )
         (segid "   A" and resid 14   and name C   ) (segid "   A" and resid 15   and name N   )  1.00 -42.98 27.02 2

 ASSIGN  (segid "   A" and resid 14   and name C   ) (segid "   A" and resid 15   and name N   )
         (segid "   A" and resid 15   and name CA  ) (segid "   A" and resid 15   and name C   )  1.00 -60.54 29.46 2

 ASSIGN  (segid "   A" and resid 15   and name N   ) (segid "   A" and resid 15   and name CA  )
         (segid "   A" and resid 15   and name C   ) (segid "   A" and resid 16   and name N   )  1.00 -44.09 25.91 2

 ASSIGN  (segid "   A" and resid 15   and name C   ) (segid "   A" and resid 16   and name N   )
         (segid "   A" and resid 16   and name CA  ) (segid "   A" and resid 16   and name C   )  1.00 -61.83 18.17 2

 ASSIGN  (segid "   A" and resid 16   and name N   ) (segid "   A" and resid 16   and name CA  )
         (segid "   A" and resid 16   and name C   ) (segid "   A" and resid 17   and name N   )  1.00 -41.26 28.74 2

 ASSIGN  (segid "   A" and resid 16   and name C   ) (segid "   A" and resid 17   and name N   )
         (segid "   A" and resid 17   and name CA  ) (segid "   A" and resid 17   and name C   )  1.00 -64.43 25.57 2

 ASSIGN  (segid "   A" and resid 17   and name N   ) (segid "   A" and resid 17   and name CA  )
         (segid "   A" and resid 17   and name C   ) (segid "   A" and resid 18   and name N   )  1.00 -36.23 33.77 2

 ASSIGN  (segid "   A" and resid 17   and name C   ) (segid "   A" and resid 18   and name N   )
         (segid "   A" and resid 18   and name CA  ) (segid "   A" and resid 18   and name C   )  1.00 -65.02 24.98 2

 ASSIGN  (segid "   A" and resid 18   and name N   ) (segid "   A" and resid 18   and name CA  )
         (segid "   A" and resid 18   and name C   ) (segid "   A" and resid 19   and name N   )  1.00 -44.79 15.21 2

 ASSIGN  (segid "   A" and resid 18   and name C   ) (segid "   A" and resid 19   and name N   )
         (segid "   A" and resid 19   and name CA  ) (segid "   A" and resid 19   and name C   )  1.00 -61.67 18.33 2

 ASSIGN  (segid "   A" and resid 19   and name N   ) (segid "   A" and resid 19   and name CA  )
         (segid "   A" and resid 19   and name C   ) (segid "   A" and resid 20   and name N   )  1.00 -43.96 26.04 2

 ASSIGN  (segid "   A" and resid 19   and name C   ) (segid "   A" and resid 20   and name N   )
         (segid "   A" and resid 20   and name CA  ) (segid "   A" and resid 20   and name C   )  1.00 -64.90 25.10 2

 ASSIGN  (segid "   A" and resid 20   and name N   ) (segid "   A" and resid 20   and name CA  )
         (segid "   A" and resid 20   and name C   ) (segid "   A" and resid 21   and name N   )  1.00 -41.51 28.49 2

 ASSIGN  (segid "   A" and resid 20   and name C   ) (segid "   A" and resid 21   and name N   )
         (segid "   A" and resid 21   and name CA  ) (segid "   A" and resid 21   and name C   )  1.00 -64.36 25.64 2

 ASSIGN  (segid "   A" and resid 21   and name N   ) (segid "   A" and resid 21   and name CA  )
         (segid "   A" and resid 21   and name C   ) (segid "   A" and resid 22   and name N   )  1.00 -26.43 33.57 2

 ASSIGN  (segid "   A" and resid 21   and name C   ) (segid "   A" and resid 22   and name N   )
         (segid "   A" and resid 22   and name CA  ) (segid "   A" and resid 22   and name C   )  1.00 -94.88 25.12 2

 ASSIGN  (segid "   A" and resid 22   and name N   ) (segid "   A" and resid 22   and name CA  )
         (segid "   A" and resid 22   and name C   ) (segid "   A" and resid 23   and name N   )  1.00   3.91 23.91 2

 ASSIGN  (segid "   A" and resid 22   and name C   ) (segid "   A" and resid 23   and name N   )
         (segid "   A" and resid 23   and name CA  ) (segid "   A" and resid 23   and name C   )  1.00  61.22 21.22 2

 ASSIGN  (segid "   A" and resid 23   and name N   ) (segid "   A" and resid 23   and name CA  )
         (segid "   A" and resid 23   and name C   ) (segid "   A" and resid 24   and name N   )  1.00  36.66 46.66 2

 ASSIGN  (segid "   A" and resid 23   and name C   ) (segid "   A" and resid 24   and name N   )
         (segid "   A" and resid 24   and name CA  ) (segid "   A" and resid 24   and name C   )  1.00 -87.98 72.02 2

 ASSIGN  (segid "   A" and resid 24   and name N   ) (segid "   A" and resid 24   and name CA  )
         (segid "   A" and resid 24   and name C   ) (segid "   A" and resid 25   and name N   )  1.00 129.81 39.81 2

 ASSIGN  (segid "   A" and resid 24   and name C   ) (segid "   A" and resid 25   and name N   )
         (segid "   A" and resid 25   and name CA  ) (segid "   A" and resid 25   and name C   )  1.00 -58.97 31.03 2

 ASSIGN  (segid "   A" and resid 25   and name N   ) (segid "   A" and resid 25   and name CA  )
         (segid "   A" and resid 25   and name C   ) (segid "   A" and resid 26   and name N   )  1.00 145.01 25.01 2

 ASSIGN  (segid "   A" and resid 25   and name C   ) (segid "   A" and resid 26   and name N   )
         (segid "   A" and resid 26   and name CA  ) (segid "   A" and resid 26   and name C   )  1.00 -55.78 24.22 2

 ASSIGN  (segid "   A" and resid 26   and name N   ) (segid "   A" and resid 26   and name CA  )
         (segid "   A" and resid 26   and name C   ) (segid "   A" and resid 27   and name N   )  1.00 -47.63 22.37 2

 ASSIGN  (segid "   A" and resid 26   and name C   ) (segid "   A" and resid 27   and name N   )
         (segid "   A" and resid 27   and name CA  ) (segid "   A" and resid 27   and name C   )  1.00 -64.79 25.21 2

 ASSIGN  (segid "   A" and resid 27   and name N   ) (segid "   A" and resid 27   and name CA  )
         (segid "   A" and resid 27   and name C   ) (segid "   A" and resid 28   and name N   )  1.00 -38.53 21.47 2

 ASSIGN  (segid "   A" and resid 27   and name C   ) (segid "   A" and resid 28   and name N   )
         (segid "   A" and resid 28   and name CA  ) (segid "   A" and resid 28   and name C   )  1.00 -64.58 25.42 2

 ASSIGN  (segid "   A" and resid 28   and name N   ) (segid "   A" and resid 28   and name CA  )
         (segid "   A" and resid 28   and name C   ) (segid "   A" and resid 29   and name N   )  1.00 -44.74 25.26 2

 ASSIGN  (segid "   A" and resid 28   and name C   ) (segid "   A" and resid 29   and name N   )
         (segid "   A" and resid 29   and name CA  ) (segid "   A" and resid 29   and name C   )  1.00 -64.80 25.20 2

 ASSIGN  (segid "   A" and resid 29   and name N   ) (segid "   A" and resid 29   and name CA  )
         (segid "   A" and resid 29   and name C   ) (segid "   A" and resid 30   and name N   )  1.00 -44.52 25.48 2

 ASSIGN  (segid "   A" and resid 29   and name C   ) (segid "   A" and resid 30   and name N   )
         (segid "   A" and resid 30   and name CA  ) (segid "   A" and resid 30   and name C   )  1.00 -58.09 21.91 2

 ASSIGN  (segid "   A" and resid 30   and name N   ) (segid "   A" and resid 30   and name CA  )
         (segid "   A" and resid 30   and name C   ) (segid "   A" and resid 31   and name N   )  1.00 -44.38 25.62 2

 ASSIGN  (segid "   A" and resid 30   and name C   ) (segid "   A" and resid 31   and name N   )
         (segid "   A" and resid 31   and name CA  ) (segid "   A" and resid 31   and name C   )  1.00 -65.11 24.89 2

 ASSIGN  (segid "   A" and resid 31   and name N   ) (segid "   A" and resid 31   and name CA  )
         (segid "   A" and resid 31   and name C   ) (segid "   A" and resid 32   and name N   )  1.00 -44.38 25.62 2

 ASSIGN  (segid "   A" and resid 31   and name C   ) (segid "   A" and resid 32   and name N   )
         (segid "   A" and resid 32   and name CA  ) (segid "   A" and resid 32   and name C   )  1.00 -63.31 26.69 2

 ASSIGN  (segid "   A" and resid 32   and name N   ) (segid "   A" and resid 32   and name CA  )
         (segid "   A" and resid 32   and name C   ) (segid "   A" and resid 33   and name N   )  1.00 -40.47 29.53 2

 ASSIGN  (segid "   A" and resid 32   and name C   ) (segid "   A" and resid 33   and name N   )
         (segid "   A" and resid 33   and name CA  ) (segid "   A" and resid 33   and name C   )  1.00 -64.84 15.16 2

 ASSIGN  (segid "   A" and resid 33   and name N   ) (segid "   A" and resid 33   and name CA  )
         (segid "   A" and resid 33   and name C   ) (segid "   A" and resid 34   and name N   )  1.00 -24.93 35.07 2

 ASSIGN  (segid "   A" and resid 33   and name C   ) (segid "   A" and resid 34   and name N   )
         (segid "   A" and resid 34   and name CA  ) (segid "   A" and resid 34   and name C   )  1.00 -92.29 27.71 2

 ASSIGN  (segid "   A" and resid 34   and name N   ) (segid "   A" and resid 34   and name CA  )
         (segid "   A" and resid 34   and name C   ) (segid "   A" and resid 35   and name N   )  1.00   1.46 31.46 2

 ASSIGN  (segid "   A" and resid 34   and name C   ) (segid "   A" and resid 35   and name N   )
         (segid "   A" and resid 35   and name CA  ) (segid "   A" and resid 35   and name C   )  1.00  55.08 15.08 2

 ASSIGN  (segid "   A" and resid 35   and name N   ) (segid "   A" and resid 35   and name CA  )
         (segid "   A" and resid 35   and name C   ) (segid "   A" and resid 36   and name N   )  1.00  43.72 23.72 2

 ASSIGN  (segid "   A" and resid 35   and name C   ) (segid "   A" and resid 36   and name N   )
         (segid "   A" and resid 36   and name CA  ) (segid "   A" and resid 36   and name C   )  1.00 -128.18 51.82 2

 ASSIGN  (segid "   A" and resid 36   and name N   ) (segid "   A" and resid 36   and name CA  )
         (segid "   A" and resid 36   and name C   ) (segid "   A" and resid 37   and name N   )  1.00 152.99 42.99 2

 ASSIGN  (segid "   A" and resid 36   and name C   ) (segid "   A" and resid 37   and name N   )
         (segid "   A" and resid 37   and name CA  ) (segid "   A" and resid 37   and name C   )  1.00 -132.15 17.85 2

 ASSIGN  (segid "   A" and resid 37   and name N   ) (segid "   A" and resid 37   and name CA  )
         (segid "   A" and resid 37   and name C   ) (segid "   A" and resid 38   and name N   )  1.00  78.27 28.27 2

 ASSIGN  (segid "   A" and resid 37   and name C   ) (segid "   A" and resid 38   and name N   )
         (segid "   A" and resid 38   and name CA  ) (segid "   A" and resid 38   and name C   )  1.00 -65.02 24.98 2

 ASSIGN  (segid "   A" and resid 38   and name N   ) (segid "   A" and resid 38   and name CA  )
         (segid "   A" and resid 38   and name C   ) (segid "   A" and resid 39   and name N   )  1.00 145.97 25.97 2

 ASSIGN  (segid "   A" and resid 39   and name C   ) (segid "   A" and resid 40   and name N   )
         (segid "   A" and resid 40   and name CA  ) (segid "   A" and resid 40   and name C   )  1.00 -132.81 47.19 2

 ASSIGN  (segid "   A" and resid 40   and name N   ) (segid "   A" and resid 40   and name CA  )
         (segid "   A" and resid 40   and name C   ) (segid "   A" and resid 41   and name N   )  1.00 157.88 57.88 2

 ASSIGN  (segid "   A" and resid 40   and name C   ) (segid "   A" and resid 41   and name N   )
         (segid "   A" and resid 41   and name CA  ) (segid "   A" and resid 41   and name C   )  1.00 -55.18 24.82 2

 ASSIGN  (segid "   A" and resid 41   and name N   ) (segid "   A" and resid 41   and name CA  )
         (segid "   A" and resid 41   and name C   ) (segid "   A" and resid 42   and name N   )  1.00 -42.19 27.81 2

 ASSIGN  (segid "   A" and resid 41   and name C   ) (segid "   A" and resid 42   and name N   )
         (segid "   A" and resid 42   and name CA  ) (segid "   A" and resid 42   and name C   )  1.00 -63.97 26.03 2

 ASSIGN  (segid "   A" and resid 42   and name N   ) (segid "   A" and resid 42   and name CA  )
         (segid "   A" and resid 42   and name C   ) (segid "   A" and resid 43   and name N   )  1.00 -42.83 27.17 2

 ASSIGN  (segid "   A" and resid 42   and name C   ) (segid "   A" and resid 43   and name N   )
         (segid "   A" and resid 43   and name CA  ) (segid "   A" and resid 43   and name C   )  1.00 -64.86 25.14 2

 ASSIGN  (segid "   A" and resid 43   and name N   ) (segid "   A" and resid 43   and name CA  )
         (segid "   A" and resid 43   and name C   ) (segid "   A" and resid 44   and name N   )  1.00 -44.80 25.20 2

 ASSIGN  (segid "   A" and resid 43   and name C   ) (segid "   A" and resid 44   and name N   )
         (segid "   A" and resid 44   and name CA  ) (segid "   A" and resid 44   and name C   )  1.00 -64.39 15.61 2

 ASSIGN  (segid "   A" and resid 44   and name N   ) (segid "   A" and resid 44   and name CA  )
         (segid "   A" and resid 44   and name C   ) (segid "   A" and resid 45   and name N   )  1.00 -44.66 25.34 2

 ASSIGN  (segid "   A" and resid 44   and name C   ) (segid "   A" and resid 45   and name N   )
         (segid "   A" and resid 45   and name CA  ) (segid "   A" and resid 45   and name C   )  1.00 -67.51 32.49 2

 ASSIGN  (segid "   A" and resid 45   and name N   ) (segid "   A" and resid 45   and name CA  )
         (segid "   A" and resid 45   and name C   ) (segid "   A" and resid 46   and name N   )  1.00 -40.43 29.57 2

 ASSIGN  (segid "   A" and resid 45   and name C   ) (segid "   A" and resid 46   and name N   )
         (segid "   A" and resid 46   and name CA  ) (segid "   A" and resid 46   and name C   )  1.00 -64.59 25.41 2

 ASSIGN  (segid "   A" and resid 46   and name N   ) (segid "   A" and resid 46   and name CA  )
         (segid "   A" and resid 46   and name C   ) (segid "   A" and resid 47   and name N   )  1.00 -43.43 26.57 2

 ASSIGN  (segid "   A" and resid 46   and name C   ) (segid "   A" and resid 47   and name N   )
         (segid "   A" and resid 47   and name CA  ) (segid "   A" and resid 47   and name C   )  1.00 -65.10 24.90 2

 ASSIGN  (segid "   A" and resid 47   and name N   ) (segid "   A" and resid 47   and name CA  )
         (segid "   A" and resid 47   and name C   ) (segid "   A" and resid 48   and name N   )  1.00 -35.09 34.91 2

 ASSIGN  (segid "   A" and resid 47   and name C   ) (segid "   A" and resid 48   and name N   )
         (segid "   A" and resid 48   and name CA  ) (segid "   A" and resid 48   and name C   )  1.00 -62.20 17.80 2

 ASSIGN  (segid "   A" and resid 48   and name N   ) (segid "   A" and resid 48   and name CA  )
         (segid "   A" and resid 48   and name C   ) (segid "   A" and resid 49   and name N   )  1.00 -42.57 27.43 2

 ASSIGN  (segid "   A" and resid 48   and name C   ) (segid "   A" and resid 49   and name N   )
         (segid "   A" and resid 49   and name CA  ) (segid "   A" and resid 49   and name C   )  1.00 -64.71 25.29 2

 ASSIGN  (segid "   A" and resid 49   and name N   ) (segid "   A" and resid 49   and name CA  )
         (segid "   A" and resid 49   and name C   ) (segid "   A" and resid 50   and name N   )  1.00 -44.39 15.61 2

 ASSIGN  (segid "   A" and resid 49   and name C   ) (segid "   A" and resid 50   and name N   )
         (segid "   A" and resid 50   and name CA  ) (segid "   A" and resid 50   and name C   )  1.00 -64.74 25.26 2

 ASSIGN  (segid "   A" and resid 50   and name N   ) (segid "   A" and resid 50   and name CA  )
         (segid "   A" and resid 50   and name C   ) (segid "   A" and resid 51   and name N   )  1.00 -44.55 15.45 2

 ASSIGN  (segid "   A" and resid 50   and name C   ) (segid "   A" and resid 51   and name N   )
         (segid "   A" and resid 51   and name CA  ) (segid "   A" and resid 51   and name C   )  1.00 -64.81 25.19 2

 ASSIGN  (segid "   A" and resid 51   and name N   ) (segid "   A" and resid 51   and name CA  )
         (segid "   A" and resid 51   and name C   ) (segid "   A" and resid 52   and name N   )  1.00 -35.87 24.13 2

 ASSIGN  (segid "   A" and resid 51   and name C   ) (segid "   A" and resid 52   and name N   )
         (segid "   A" and resid 52   and name CA  ) (segid "   A" and resid 52   and name C   )  1.00 -65.03 24.97 2

 ASSIGN  (segid "   A" and resid 52   and name N   ) (segid "   A" and resid 52   and name CA  )
         (segid "   A" and resid 52   and name C   ) (segid "   A" and resid 53   and name N   )  1.00 -36.89 33.11 2

 ASSIGN  (segid "   A" and resid 52   and name C   ) (segid "   A" and resid 53   and name N   )
         (segid "   A" and resid 53   and name CA  ) (segid "   A" and resid 53   and name C   )  1.00 -64.16 25.84 2

 ASSIGN  (segid "   A" and resid 53   and name N   ) (segid "   A" and resid 53   and name CA  )
         (segid "   A" and resid 53   and name C   ) (segid "   A" and resid 54   and name N   )  1.00 -24.98 35.02 2

 ASSIGN  (segid "   A" and resid 53   and name C   ) (segid "   A" and resid 54   and name N   )
         (segid "   A" and resid 54   and name CA  ) (segid "   A" and resid 54   and name C   )  1.00 -86.61 33.39 2

 ASSIGN  (segid "   A" and resid 54   and name N   ) (segid "   A" and resid 54   and name CA  )
         (segid "   A" and resid 54   and name C   ) (segid "   A" and resid 55   and name N   )  1.00  -3.90 26.10 2

 ASSIGN  (segid "   A" and resid 54   and name C   ) (segid "   A" and resid 55   and name N   )
         (segid "   A" and resid 55   and name CA  ) (segid "   A" and resid 55   and name C   )  1.00  55.00 15.00 2

 ASSIGN  (segid "   A" and resid 55   and name N   ) (segid "   A" and resid 55   and name CA  )
         (segid "   A" and resid 55   and name C   ) (segid "   A" and resid 56   and name N   )  1.00  44.79 24.79 2

 ASSIGN  (segid "   A" and resid 55   and name C   ) (segid "   A" and resid 56   and name N   )
         (segid "   A" and resid 56   and name CA  ) (segid "   A" and resid 56   and name C   )  1.00 -103.00 37.00 2

 ASSIGN  (segid "   A" and resid 56   and name N   ) (segid "   A" and resid 56   and name CA  )
         (segid "   A" and resid 56   and name C   ) (segid "   A" and resid 57   and name N   )  1.00 -10.00 30.00 2

 ASSIGN  (segid "   A" and resid 56   and name C   ) (segid "   A" and resid 57   and name N   )
         (segid "   A" and resid 57   and name CA  ) (segid "   A" and resid 57   and name C   )  1.00 -90.97 89.03 2

 ASSIGN  (segid "   A" and resid 57   and name N   ) (segid "   A" and resid 57   and name CA  )
         (segid "   A" and resid 57   and name C   ) (segid "   A" and resid 58   and name N   )  1.00 133.53 43.53 2

 ASSIGN  (segid "   A" and resid 57   and name C   ) (segid "   A" and resid 58   and name N   )
         (segid "   A" and resid 58   and name CA  ) (segid "   A" and resid 58   and name C   )  1.00 -96.85 73.15 2

 ASSIGN  (segid "   A" and resid 58   and name N   ) (segid "   A" and resid 58   and name CA  )
         (segid "   A" and resid 58   and name C   ) (segid "   A" and resid 59   and name N   )  1.00 134.52 54.52 2

 ASSIGN  (segid "   A" and resid 58   and name C   ) (segid "   A" and resid 59   and name N   )
         (segid "   A" and resid 59   and name CA  ) (segid "   A" and resid 59   and name C   )  1.00 -56.61 33.39 2

 ASSIGN  (segid "   A" and resid 59   and name N   ) (segid "   A" and resid 59   and name CA  )
         (segid "   A" and resid 59   and name C   ) (segid "   A" and resid 60   and name N   )  1.00 -24.00 26.00 2

 ASSIGN  (segid "   A" and resid 60   and name C   ) (segid "   A" and resid 61   and name N   )
         (segid "   A" and resid 61   and name CA  ) (segid "   A" and resid 61   and name C   )  1.00 -91.56 28.44 2

 ASSIGN  (segid "   A" and resid 61   and name N   ) (segid "   A" and resid 61   and name CA  )
         (segid "   A" and resid 61   and name C   ) (segid "   A" and resid 62   and name N   )  1.00  -6.77 33.23 2

 ASSIGN  (segid "   A" and resid 62   and name C   ) (segid "   A" and resid 63   and name N   )
         (segid "   A" and resid 63   and name CA  ) (segid "   A" and resid 63   and name C   )  1.00 -63.50 26.50 2

 ASSIGN  (segid "   A" and resid 63   and name N   ) (segid "   A" and resid 63   and name CA  )
         (segid "   A" and resid 63   and name C   ) (segid "   A" and resid 64   and name N   )  1.00 148.13 28.13 2

 ASSIGN  (segid "   A" and resid 64   and name C   ) (segid "   A" and resid 65   and name N   )
         (segid "   A" and resid 65   and name CA  ) (segid "   A" and resid 65   and name C   )  1.00 -55.20 24.80 2

 ASSIGN  (segid "   A" and resid 65   and name N   ) (segid "   A" and resid 65   and name CA  )
         (segid "   A" and resid 65   and name C   ) (segid "   A" and resid 66   and name N   )  1.00 -46.11 23.89 2

 ASSIGN  (segid "   A" and resid 65   and name C   ) (segid "   A" and resid 66   and name N   )
         (segid "   A" and resid 66   and name CA  ) (segid "   A" and resid 66   and name C   )  1.00 -62.61 27.39 2

 ASSIGN  (segid "   A" and resid 66   and name N   ) (segid "   A" and resid 66   and name CA  )
         (segid "   A" and resid 66   and name C   ) (segid "   A" and resid 67   and name N   )  1.00 -42.04 27.96 2

 ASSIGN  (segid "   A" and resid 66   and name C   ) (segid "   A" and resid 67   and name N   )
         (segid "   A" and resid 67   and name CA  ) (segid "   A" and resid 67   and name C   )  1.00 -64.45 25.55 2

 ASSIGN  (segid "   A" and resid 67   and name N   ) (segid "   A" and resid 67   and name CA  )
         (segid "   A" and resid 67   and name C   ) (segid "   A" and resid 68   and name N   )  1.00 -43.27 26.73 2

 ASSIGN  (segid "   A" and resid 67   and name C   ) (segid "   A" and resid 68   and name N   )
         (segid "   A" and resid 68   and name CA  ) (segid "   A" and resid 68   and name C   )  1.00 -64.94 25.06 2

 ASSIGN  (segid "   A" and resid 68   and name N   ) (segid "   A" and resid 68   and name CA  )
         (segid "   A" and resid 68   and name C   ) (segid "   A" and resid 69   and name N   )  1.00 -44.55 15.45 2

 ASSIGN  (segid "   A" and resid 68   and name C   ) (segid "   A" and resid 69   and name N   )
         (segid "   A" and resid 69   and name CA  ) (segid "   A" and resid 69   and name C   )  1.00 -64.64 15.36 2

 ASSIGN  (segid "   A" and resid 69   and name N   ) (segid "   A" and resid 69   and name CA  )
         (segid "   A" and resid 69   and name C   ) (segid "   A" and resid 70   and name N   )  1.00 -44.79 25.21 2

 ASSIGN  (segid "   A" and resid 69   and name C   ) (segid "   A" and resid 70   and name N   )
         (segid "   A" and resid 70   and name CA  ) (segid "   A" and resid 70   and name C   )  1.00 -60.90 19.10 2

 ASSIGN  (segid "   A" and resid 70   and name N   ) (segid "   A" and resid 70   and name CA  )
         (segid "   A" and resid 70   and name C   ) (segid "   A" and resid 71   and name N   )  1.00 -39.18 30.82 2

 ASSIGN  (segid "   A" and resid 70   and name C   ) (segid "   A" and resid 71   and name N   )
         (segid "   A" and resid 71   and name CA  ) (segid "   A" and resid 71   and name C   )  1.00 -65.02 24.98 2

 ASSIGN  (segid "   A" and resid 71   and name N   ) (segid "   A" and resid 71   and name CA  )
         (segid "   A" and resid 71   and name C   ) (segid "   A" and resid 72   and name N   )  1.00 -36.31 23.69 2

 ASSIGN  (segid "   A" and resid 71   and name C   ) (segid "   A" and resid 72   and name N   )
         (segid "   A" and resid 72   and name CA  ) (segid "   A" and resid 72   and name C   )  1.00 -74.17 15.83 2

 ASSIGN  (segid "   A" and resid 72   and name N   ) (segid "   A" and resid 72   and name CA  )
         (segid "   A" and resid 72   and name C   ) (segid "   A" and resid 73   and name N   )  1.00 -34.22 25.78 2

 ASSIGN  (segid "   A" and resid 72   and name C   ) (segid "   A" and resid 73   and name N   )
         (segid "   A" and resid 73   and name CA  ) (segid "   A" and resid 73   and name C   )  1.00 -91.61 58.39 2

 ASSIGN  (segid "   A" and resid 73   and name N   ) (segid "   A" and resid 73   and name CA  )
         (segid "   A" and resid 73   and name C   ) (segid "   A" and resid 74   and name N   )  1.00  -4.14 35.86 2

 ASSIGN  (segid "   A" and resid 74   and name C   ) (segid "   A" and resid 75   and name N   )
         (segid "   A" and resid 75   and name CA  ) (segid "   A" and resid 75   and name C   )  1.00  85.00 15.00 2

 ASSIGN  (segid "   A" and resid 75   and name N   ) (segid "   A" and resid 75   and name CA  )
         (segid "   A" and resid 75   and name C   ) (segid "   A" and resid 76   and name N   )  1.00   1.00 -49.00 2

 ASSIGN  (segid "   A" and resid 77   and name C   ) (segid "   A" and resid 78   and name N   )
         (segid "   A" and resid 78   and name CA  ) (segid "   A" and resid 78   and name C   )  1.00 -60.89 29.11 2

 ASSIGN  (segid "   A" and resid 78   and name N   ) (segid "   A" and resid 78   and name CA  )
         (segid "   A" and resid 78   and name C   ) (segid "   A" and resid 79   and name N   )  1.00 -36.33 33.67 2

 ASSIGN  (segid "   A" and resid 78   and name C   ) (segid "   A" and resid 79   and name N   )
         (segid "   A" and resid 79   and name CA  ) (segid "   A" and resid 79   and name C   )  1.00 -64.95 15.05 2

 ASSIGN  (segid "   A" and resid 79   and name N   ) (segid "   A" and resid 79   and name CA  )
         (segid "   A" and resid 79   and name C   ) (segid "   A" and resid 80   and name N   )  1.00 -43.67 16.33 2

 ASSIGN  (segid "   A" and resid 79   and name C   ) (segid "   A" and resid 80   and name N   )
         (segid "   A" and resid 80   and name CA  ) (segid "   A" and resid 80   and name C   )  1.00 -65.00 25.00 2

 ASSIGN  (segid "   A" and resid 80   and name N   ) (segid "   A" and resid 80   and name CA  )
         (segid "   A" and resid 80   and name C   ) (segid "   A" and resid 81   and name N   )  1.00 -44.83 25.17 2

 ASSIGN  (segid "   A" and resid 80   and name C   ) (segid "   A" and resid 81   and name N   )
         (segid "   A" and resid 81   and name CA  ) (segid "   A" and resid 81   and name C   )  1.00 -64.88 25.12 2

 ASSIGN  (segid "   A" and resid 81   and name N   ) (segid "   A" and resid 81   and name CA  )
         (segid "   A" and resid 81   and name C   ) (segid "   A" and resid 82   and name N   )  1.00 -42.11 27.89 2

 ASSIGN  (segid "   A" and resid 81   and name C   ) (segid "   A" and resid 82   and name N   )
         (segid "   A" and resid 82   and name CA  ) (segid "   A" and resid 82   and name C   )  1.00 -57.15 22.85 2

 ASSIGN  (segid "   A" and resid 82   and name N   ) (segid "   A" and resid 82   and name CA  )
         (segid "   A" and resid 82   and name C   ) (segid "   A" and resid 83   and name N   )  1.00 -44.07 25.93 2

 ASSIGN  (segid "   A" and resid 82   and name C   ) (segid "   A" and resid 83   and name N   )
         (segid "   A" and resid 83   and name CA  ) (segid "   A" and resid 83   and name C   )  1.00 -64.89 25.11 2

 ASSIGN  (segid "   A" and resid 83   and name N   ) (segid "   A" and resid 83   and name CA  )
         (segid "   A" and resid 83   and name C   ) (segid "   A" and resid 84   and name N   )  1.00 -43.74 16.26 2

 ASSIGN  (segid "   A" and resid 83   and name C   ) (segid "   A" and resid 84   and name N   )
         (segid "   A" and resid 84   and name CA  ) (segid "   A" and resid 84   and name C   )  1.00 -64.45 15.55 2

 ASSIGN  (segid "   A" and resid 84   and name N   ) (segid "   A" and resid 84   and name CA  )
         (segid "   A" and resid 84   and name C   ) (segid "   A" and resid 85   and name N   )  1.00 -43.97 26.03 2

 ASSIGN  (segid "   A" and resid 84   and name C   ) (segid "   A" and resid 85   and name N   )
         (segid "   A" and resid 85   and name CA  ) (segid "   A" and resid 85   and name C   )  1.00 -65.00 25.00 2

 ASSIGN  (segid "   A" and resid 85   and name N   ) (segid "   A" and resid 85   and name CA  )
         (segid "   A" and resid 85   and name C   ) (segid "   A" and resid 86   and name N   )  1.00 -44.76 15.24 2

 ASSIGN  (segid "   A" and resid 85   and name C   ) (segid "   A" and resid 86   and name N   )
         (segid "   A" and resid 86   and name CA  ) (segid "   A" and resid 86   and name C   )  1.00 -60.38 29.62 2

 ASSIGN  (segid "   A" and resid 86   and name N   ) (segid "   A" and resid 86   and name CA  )
         (segid "   A" and resid 86   and name C   ) (segid "   A" and resid 87   and name N   )  1.00 -40.74 29.26 2

 ASSIGN  (segid "   A" and resid 86   and name C   ) (segid "   A" and resid 87   and name N   )
         (segid "   A" and resid 87   and name CA  ) (segid "   A" and resid 87   and name C   )  1.00 -60.53 29.47 2

 ASSIGN  (segid "   A" and resid 87   and name N   ) (segid "   A" and resid 87   and name CA  )
         (segid "   A" and resid 87   and name C   ) (segid "   A" and resid 88   and name N   )  1.00 -29.86 30.14 2

 ASSIGN  (segid "   A" and resid 87   and name C   ) (segid "   A" and resid 88   and name N   )
         (segid "   A" and resid 88   and name CA  ) (segid "   A" and resid 88   and name C   )  1.00 -95.84 24.16 2

 ASSIGN  (segid "   A" and resid 88   and name N   ) (segid "   A" and resid 88   and name CA  )
         (segid "   A" and resid 88   and name C   ) (segid "   A" and resid 89   and name N   )  1.00   4.94 34.94 2

 ASSIGN  (segid "   A" and resid 88   and name C   ) (segid "   A" and resid 89   and name N   )
         (segid "   A" and resid 89   and name CA  ) (segid "   A" and resid 89   and name C   )  1.00 -71.89 38.11 2

 ASSIGN  (segid "   A" and resid 89   and name N   ) (segid "   A" and resid 89   and name CA  )
         (segid "   A" and resid 89   and name C   ) (segid "   A" and resid 90   and name N   )  1.00 129.83 29.83 2

 ASSIGN  (segid "   A" and resid 89   and name C   ) (segid "   A" and resid 90   and name N   )
         (segid "   A" and resid 90   and name CA  ) (segid "   A" and resid 90   and name C   )  1.00 -142.37 37.63 2

 ASSIGN  (segid "   A" and resid 90   and name N   ) (segid "   A" and resid 90   and name CA  )
         (segid "   A" and resid 90   and name C   ) (segid "   A" and resid 91   and name N   )  1.00 150.18 50.18 2

 ASSIGN  (segid "   A" and resid 90   and name C   ) (segid "   A" and resid 91   and name N   )
         (segid "   A" and resid 91   and name CA  ) (segid "   A" and resid 91   and name C   )  1.00 -74.95 25.05 2

 ASSIGN  (segid "   A" and resid 91   and name N   ) (segid "   A" and resid 91   and name CA  )
         (segid "   A" and resid 91   and name C   ) (segid "   A" and resid 92   and name N   )  1.00 151.59 41.59 2

 ASSIGN  (segid "   A" and resid 92   and name C   ) (segid "   A" and resid 93   and name N   )
         (segid "   A" and resid 93   and name CA  ) (segid "   A" and resid 93   and name C   )  1.00 -65.00 25.00 2

 ASSIGN  (segid "   A" and resid 93   and name N   ) (segid "   A" and resid 93   and name CA  )
         (segid "   A" and resid 93   and name C   ) (segid "   A" and resid 94   and name N   )  1.00 -23.73 26.27 2

 ASSIGN  (segid "   A" and resid 93   and name C   ) (segid "   A" and resid 94   and name N   )
         (segid "   A" and resid 94   and name CA  ) (segid "   A" and resid 94   and name C   )  1.00 -89.69 40.31 2

 ASSIGN  (segid "   A" and resid 94   and name N   ) (segid "   A" and resid 94   and name CA  )
         (segid "   A" and resid 94   and name C   ) (segid "   A" and resid 95   and name N   )  1.00  -2.40 27.60 2

 ASSIGN  (segid "   A" and resid 94   and name C   ) (segid "   A" and resid 95   and name N   )
         (segid "   A" and resid 95   and name CA  ) (segid "   A" and resid 95   and name C   )  1.00  55.00 10.00 2

 ASSIGN  (segid "   A" and resid 95   and name N   ) (segid "   A" and resid 95   and name CA  )
         (segid "   A" and resid 95   and name C   ) (segid "   A" and resid 96   and name N   )  1.00  39.00 19.00 2

 ASSIGN  (segid "   A" and resid 96   and name C   ) (segid "   A" and resid 97   and name N   )
         (segid "   A" and resid 97   and name CA  ) (segid "   A" and resid 97   and name C   )  1.00 -56.11 33.89 2

 ASSIGN  (segid "   A" and resid 97   and name N   ) (segid "   A" and resid 97   and name CA  )
         (segid "   A" and resid 97   and name C   ) (segid "   A" and resid 98   and name N   )  1.00 -44.36 25.64 2

 ASSIGN  (segid "   A" and resid 97   and name C   ) (segid "   A" and resid 98   and name N   )
         (segid "   A" and resid 98   and name CA  ) (segid "   A" and resid 98   and name C   )  1.00 -59.26 20.74 2

 ASSIGN  (segid "   A" and resid 98   and name N   ) (segid "   A" and resid 98   and name CA  )
         (segid "   A" and resid 98   and name C   ) (segid "   A" and resid 99   and name N   )  1.00 -44.48 25.52 2

 ASSIGN  (segid "   A" and resid 98   and name C   ) (segid "   A" and resid 99   and name N   )
         (segid "   A" and resid 99   and name CA  ) (segid "   A" and resid 99   and name C   )  1.00 -62.78 27.22 2

 ASSIGN  (segid "   A" and resid 99   and name N   ) (segid "   A" and resid 99   and name CA  )
         (segid "   A" and resid 99   and name C   ) (segid "   A" and resid 100  and name N   )  1.00 -39.33 30.67 2

 ASSIGN  (segid "   A" and resid 99   and name C   ) (segid "   A" and resid 100  and name N   )
         (segid "   A" and resid 100  and name CA  ) (segid "   A" and resid 100  and name C   )  1.00 -64.87 25.13 2

 ASSIGN  (segid "   A" and resid 100  and name N   ) (segid "   A" and resid 100  and name CA  )
         (segid "   A" and resid 100  and name C   ) (segid "   A" and resid 101  and name N   )  1.00 -37.85 32.15 2

 ASSIGN  (segid "   A" and resid 100  and name C   ) (segid "   A" and resid 101  and name N   )
         (segid "   A" and resid 101  and name CA  ) (segid "   A" and resid 101  and name C   )  1.00 -64.44 25.56 2

 ASSIGN  (segid "   A" and resid 101  and name N   ) (segid "   A" and resid 101  and name CA  )
         (segid "   A" and resid 101  and name C   ) (segid "   A" and resid 102  and name N   )  1.00 -39.63 30.37 2

 ASSIGN  (segid "   A" and resid 101  and name C   ) (segid "   A" and resid 102  and name N   )
         (segid "   A" and resid 102  and name CA  ) (segid "   A" and resid 102  and name C   )  1.00 -64.69 15.31 2

 ASSIGN  (segid "   A" and resid 102  and name N   ) (segid "   A" and resid 102  and name CA  )
         (segid "   A" and resid 102  and name C   ) (segid "   A" and resid 103  and name N   )  1.00 -44.91 25.09 2

 ASSIGN  (segid "   A" and resid 102  and name C   ) (segid "   A" and resid 103  and name N   )
         (segid "   A" and resid 103  and name CA  ) (segid "   A" and resid 103  and name C   )  1.00 -62.69 27.31 2

 ASSIGN  (segid "   A" and resid 103  and name N   ) (segid "   A" and resid 103  and name CA  )
         (segid "   A" and resid 103  and name C   ) (segid "   A" and resid 104  and name N   )  1.00 -39.40 30.60 2

 ASSIGN  (segid "   A" and resid 103  and name C   ) (segid "   A" and resid 104  and name N   )
         (segid "   A" and resid 104  and name CA  ) (segid "   A" and resid 104  and name C   )  1.00 -64.99 25.01 2

 ASSIGN  (segid "   A" and resid 104  and name N   ) (segid "   A" and resid 104  and name CA  )
         (segid "   A" and resid 104  and name C   ) (segid "   A" and resid 105  and name N   )  1.00 -38.94 31.06 2

 ASSIGN  (segid "   A" and resid 104  and name C   ) (segid "   A" and resid 105  and name N   )
         (segid "   A" and resid 105  and name CA  ) (segid "   A" and resid 105  and name C   )  1.00 -64.77 15.23 2

 ASSIGN  (segid "   A" and resid 105  and name N   ) (segid "   A" and resid 105  and name CA  )
         (segid "   A" and resid 105  and name C   ) (segid "   A" and resid 106  and name N   )  1.00 -44.28 25.72 2

 ASSIGN  (segid "   A" and resid 105  and name C   ) (segid "   A" and resid 106  and name N   )
         (segid "   A" and resid 106  and name CA  ) (segid "   A" and resid 106  and name C   )  1.00 -64.16 25.84 2

 ASSIGN  (segid "   A" and resid 106  and name N   ) (segid "   A" and resid 106  and name CA  )
         (segid "   A" and resid 106  and name C   ) (segid "   A" and resid 107  and name N   )  1.00 -37.83 32.17 2

 ASSIGN  (segid "   A" and resid 106  and name C   ) (segid "   A" and resid 107  and name N   )
         (segid "   A" and resid 107  and name CA  ) (segid "   A" and resid 107  and name C   )  1.00 -65.15 24.85 2

 ASSIGN  (segid "   A" and resid 107  and name N   ) (segid "   A" and resid 107  and name CA  )
         (segid "   A" and resid 107  and name C   ) (segid "   A" and resid 108  and name N   )  1.00 -43.98 26.02 2

 ASSIGN  (segid "   A" and resid 107  and name C   ) (segid "   A" and resid 108  and name N   )
         (segid "   A" and resid 108  and name CA  ) (segid "   A" and resid 108  and name C   )  1.00 -63.99 26.01 2

 ASSIGN  (segid "   A" and resid 108  and name N   ) (segid "   A" and resid 108  and name CA  )
         (segid "   A" and resid 108  and name C   ) (segid "   A" and resid 109  and name N   )  1.00 -41.24 28.76 2

 ASSIGN  (segid "   A" and resid 108  and name C   ) (segid "   A" and resid 109  and name N   )
         (segid "   A" and resid 109  and name CA  ) (segid "   A" and resid 109  and name C   )  1.00 -64.29 25.71 2

 ASSIGN  (segid "   A" and resid 109  and name N   ) (segid "   A" and resid 109  and name CA  )
         (segid "   A" and resid 109  and name C   ) (segid "   A" and resid 110  and name N   )  1.00 -26.08 33.92 2

 ASSIGN  (segid "   A" and resid 109  and name C   ) (segid "   A" and resid 110  and name N   )
         (segid "   A" and resid 110  and name CA  ) (segid "   A" and resid 110  and name C   )  1.00 -60.58 29.42 2

 ASSIGN  (segid "   A" and resid 110  and name N   ) (segid "   A" and resid 110  and name CA  )
         (segid "   A" and resid 110  and name C   ) (segid "   A" and resid 111  and name N   )  1.00 -36.70 33.30 2

 ASSIGN  (segid "   A" and resid 110  and name C   ) (segid "   A" and resid 111  and name N   )
         (segid "   A" and resid 111  and name CA  ) (segid "   A" and resid 111  and name C   )  1.00 -80.54 49.46 2

 ASSIGN  (segid "   A" and resid 111  and name N   ) (segid "   A" and resid 111  and name CA  )
         (segid "   A" and resid 111  and name C   ) (segid "   A" and resid 112  and name N   )  1.00 -29.91 40.09 2

 ASSIGN  (segid "   A" and resid 112  and name C   ) (segid "   A" and resid 113  and name N   )
         (segid "   A" and resid 113  and name CA  ) (segid "   A" and resid 113  and name C   )  1.00 -56.49 33.51 2

 ASSIGN  (segid "   A" and resid 113  and name N   ) (segid "   A" and resid 113  and name CA  )
         (segid "   A" and resid 113  and name C   ) (segid "   A" and resid 114  and name N   )  1.00 -35.52 24.48 2

 ASSIGN  (segid "   A" and resid 113  and name C   ) (segid "   A" and resid 114  and name N   )
         (segid "   A" and resid 114  and name CA  ) (segid "   A" and resid 114  and name C   )  1.00 -63.16 26.84 2

 ASSIGN  (segid "   A" and resid 114  and name N   ) (segid "   A" and resid 114  and name CA  )
         (segid "   A" and resid 114  and name C   ) (segid "   A" and resid 115  and name N   )  1.00 -40.86 29.14 2

 ASSIGN  (segid "   A" and resid 114  and name C   ) (segid "   A" and resid 115  and name N   )
         (segid "   A" and resid 115  and name CA  ) (segid "   A" and resid 115  and name C   )  1.00 -64.96 25.04 2

 ASSIGN  (segid "   A" and resid 115  and name N   ) (segid "   A" and resid 115  and name CA  )
         (segid "   A" and resid 115  and name C   ) (segid "   A" and resid 116  and name N   )  1.00 -44.79 25.21 2

 ASSIGN  (segid "   A" and resid 115  and name C   ) (segid "   A" and resid 116  and name N   )
         (segid "   A" and resid 116  and name CA  ) (segid "   A" and resid 116  and name C   )  1.00 -64.70 25.30 2

 ASSIGN  (segid "   A" and resid 116  and name N   ) (segid "   A" and resid 116  and name CA  )
         (segid "   A" and resid 116  and name C   ) (segid "   A" and resid 117  and name N   )  1.00 -44.18 25.82 2

 ASSIGN  (segid "   A" and resid 116  and name C   ) (segid "   A" and resid 117  and name N   )
         (segid "   A" and resid 117  and name CA  ) (segid "   A" and resid 117  and name C   )  1.00 -64.34 15.66 2

 ASSIGN  (segid "   A" and resid 117  and name N   ) (segid "   A" and resid 117  and name CA  )
         (segid "   A" and resid 117  and name C   ) (segid "   A" and resid 118  and name N   )  1.00 -44.90 25.10 2

 ASSIGN  (segid "   A" and resid 117  and name C   ) (segid "   A" and resid 118  and name N   )
         (segid "   A" and resid 118  and name CA  ) (segid "   A" and resid 118  and name C   )  1.00 -62.56 27.44 2

 ASSIGN  (segid "   A" and resid 118  and name N   ) (segid "   A" and resid 118  and name CA  )
         (segid "   A" and resid 118  and name C   ) (segid "   A" and resid 119  and name N   )  1.00 -40.63 29.37 2

 ASSIGN  (segid "   A" and resid 118  and name C   ) (segid "   A" and resid 119  and name N   )
         (segid "   A" and resid 119  and name CA  ) (segid "   A" and resid 119  and name C   )  1.00 -61.78 28.22 2

 ASSIGN  (segid "   A" and resid 119  and name N   ) (segid "   A" and resid 119  and name CA  )
         (segid "   A" and resid 119  and name C   ) (segid "   A" and resid 120  and name N   )  1.00 -29.31 30.69 2

 ASSIGN  (segid "   A" and resid 119  and name C   ) (segid "   A" and resid 120  and name N   )
         (segid "   A" and resid 120  and name CA  ) (segid "   A" and resid 120  and name C   )  1.00 -102.92 17.08 2

 ASSIGN  (segid "   A" and resid 120  and name N   ) (segid "   A" and resid 120  and name CA  )
         (segid "   A" and resid 120  and name C   ) (segid "   A" and resid 121  and name N   )  1.00   3.25 33.25 2

 ASSIGN  (segid "   A" and resid 120  and name C   ) (segid "   A" and resid 121  and name N   )
         (segid "   A" and resid 121  and name CA  ) (segid "   A" and resid 121  and name C   )  1.00 -65.59 24.41 2

 ASSIGN  (segid "   A" and resid 121  and name N   ) (segid "   A" and resid 121  and name CA  )
         (segid "   A" and resid 121  and name C   ) (segid "   A" and resid 122  and name N   )  1.00 151.83 31.83 2


assign ( segid "   A" and resid  11 and name CA )
       ( segid "   A" and resid 11 and name CB )
       ( segid "   A" and resid 11 and name CG )
       ( segid "   A" and resid 11 and name CD2 )  50.0 180.0 15 2 

assign ( segid "   A" and resid 56 and name CA )
       ( segid "   A" and resid 56 and name CB )
       ( segid "   A" and resid 56 and name CG )
       ( segid "   A" and resid 56 and name CD1 )  50.0 180.0 15 2 
 
assign ( segid "   A" and resid  68 and name CA )
       ( segid "   A" and resid 68 and name CB )
       ( segid "   A" and resid 68 and name CG )
       ( segid "   A" and resid 68 and name CD1 )  50.0 160.0 15 2 

assign ( segid "   A" and resid  72 and name CA )
       ( segid "   A" and resid 72 and name CB )
       ( segid "   A" and resid 72 and name CG )
       ( segid "   A" and resid 72 and name CD1 )  50.0 175.0 15 2 

assign ( segid "   A" and resid  86 and name CA )
       ( segid "   A" and resid 86 and name CB )
       ( segid "   A" and resid 86 and name CG )
       ( segid "   A" and resid 86 and name CD1 )  50.0 180.0 15 2 

assign ( segid "   A" and resid  113 and name CA )
       ( segid "   A" and resid 113 and name CB )
       ( segid "   A" and resid 113 and name CG )
       ( segid "   A" and resid 113 and name CD2 )  50.0 180.0 15 2 

assign ( segid "   A" and resid  115 and name CA )
       ( segid "   A" and resid 115 and name CB )
       ( segid "   A" and resid 115 and name CG )
       ( segid "   A" and resid 115 and name CD2 )  50.0 180.0 15 2 
# Restraints file 3: o22-jcoupling-restraints.tbl
REMARK CYS  JHAHB Karplus Coefficient A, B, C = 7.23, -1.37, 1.71 

assign ( segid "   A" and resid 18 and name ha ) ( segid "   A" and resid 18 and name ca )
        ( segid "   A" and resid 18 and name cb ) ( segid "   A" and resid 18 and name Hb2 )  9.708 1.002 
 
 assign ( segid "   A" and resid 18 and name ha ) ( segid "   A" and resid 18 and name ca )
        ( segid "   A" and resid 18 and name cb ) ( segid "   A" and resid 18 and name Hb1 )  2.450 1.065 
 
 assign ( segid "   A" and resid 49 and name ha ) ( segid "   A" and resid 49 and name ca )
        ( segid "   A" and resid 49 and name cb ) ( segid "   A" and resid 49 and name Hb2 )  5.254 1.031 
 
 assign ( segid "   A" and resid 49 and name ha ) ( segid "   A" and resid 49 and name ca )
        ( segid "   A" and resid 49 and name cb ) ( segid "   A" and resid 49 and name Hb1 )  9.809 1.006 
 
 assign ( segid "   A" and resid 88 and name ha ) ( segid "   A" and resid 88 and name ca )
        ( segid "   A" and resid 88 and name cb ) ( segid "   A" and resid 88 and name Hb2 )  7.354 1.010 
 
 assign ( segid "   A" and resid 88 and name ha ) ( segid "   A" and resid 88 and name ca )
        ( segid "   A" and resid 88 and name cb ) ( segid "   A" and resid 88 and name Hb1 )  0.246 5.383 
 
 assign ( segid "   A" and resid 98 and name ha ) ( segid "   A" and resid 98 and name ca )
        ( segid "   A" and resid 98 and name cb ) ( segid "   A" and resid 98 and name Hb2 ) 13.662 1.015 
 
 assign ( segid "   A" and resid 98 and name ha ) ( segid "   A" and resid 98 and name ca )
        ( segid "   A" and resid 98 and name cb ) ( segid "   A" and resid 98 and name Hb1 )  4.225 1.358 
 
 assign ( segid "   A" and resid 107 and name ha ) ( segid "   A" and resid 107 and name ca )
        ( segid "   A" and resid 107 and name cb ) ( segid "   A" and resid 107 and name Hb2 )  5.174 1.013 
 
 assign ( segid "   A" and resid 107 and name ha ) ( segid "   A" and resid 107 and name ca )
        ( segid "   A" and resid 107 and name cb ) ( segid "   A" and resid 107 and name Hb1 )  8.843 1.003 
 
 REMARK General JHAHB - Karplus Coefficient A, B, C = 7.23, -1.37, 2.22 

assign ( segid "   A" and resid 3 and name ha ) ( segid "   A" and resid 3 and name ca )
        ( segid "   A" and resid 3 and name cb ) ( segid "   A" and resid 3 and name Hb2 ) 4.104 1.002 
 
 assign ( segid "   A" and resid 3 and name ha ) ( segid "   A" and resid 3 and name ca )
        ( segid "   A" and resid 3 and name cb ) ( segid "   A" and resid 3 and name Hb1 ) 11.762 1.000 
 
 assign ( segid "   A" and resid 10 and name ha ) ( segid "   A" and resid 10 and name ca )
        ( segid "   A" and resid 10 and name cb ) ( segid "   A" and resid 10 and name Hb2 ) 10.887 1.002 
 
 assign ( segid "   A" and resid 10 and name ha ) ( segid "   A" and resid 10 and name ca )
        ( segid "   A" and resid 10 and name cb ) ( segid "   A" and resid 10 and name Hb1 )  3.980 1.034 
 
 assign ( segid "   A" and resid 11 and name ha ) ( segid "   A" and resid 11 and name ca )
        ( segid "   A" and resid 11 and name cb ) ( segid "   A" and resid 11 and name Hb2 )  4.679 1.040 
 
 assign ( segid "   A" and resid 11 and name ha ) ( segid "   A" and resid 11 and name ca )
        ( segid "   A" and resid 11 and name cb ) ( segid "   A" and resid 11 and name Hb1 ) 10.464 1.004 
 
 assign ( segid "   A" and resid 14 and name ha ) ( segid "   A" and resid 14 and name ca )
        ( segid "   A" and resid 14 and name cb ) ( segid "   A" and resid 14 and name Hb2 )  9.900 1.015 
 
 assign ( segid "   A" and resid 14 and name ha ) ( segid "   A" and resid 14 and name ca )
        ( segid "   A" and resid 14 and name cb ) ( segid "   A" and resid 14 and name Hb1 )  4.153 1.143 
 
 assign ( segid "   A" and resid 15 and name ha ) ( segid "   A" and resid 15 and name ca )
        ( segid "   A" and resid 15 and name cb ) ( segid "   A" and resid 15 and name Hb2 )  8.107 1.031 
 
 assign ( segid "   A" and resid 15 and name ha ) ( segid "   A" and resid 15 and name ca )
        ( segid "   A" and resid 15 and name cb ) ( segid "   A" and resid 15 and name Hb1 )  5.075 1.103 
 
 assign ( segid "   A" and resid 17 and name ha ) ( segid "   A" and resid 17 and name ca )
        ( segid "   A" and resid 17 and name cb ) ( segid "   A" and resid 17 and name Hb2 )  8.043 1.003 
 
 assign ( segid "   A" and resid 17 and name ha ) ( segid "   A" and resid 17 and name ca )
        ( segid "   A" and resid 17 and name cb ) ( segid "   A" and resid 17 and name Hb1 )  5.735 1.006 
 
 assign ( segid "   A" and resid 22 and name ha ) ( segid "   A" and resid 22 and name ca )
        ( segid "   A" and resid 22 and name cb ) ( segid "   A" and resid 22 and name Hb2 )  9.107 1.002 
 
 assign ( segid "   A" and resid 22 and name ha ) ( segid "   A" and resid 22 and name ca )
        ( segid "   A" and resid 22 and name cb ) ( segid "   A" and resid 22 and name Hb1 )  3.091 1.033 
 
 !assign ( segid "   A" and resid 23 and name ha ) ( segid "   A" and resid 23 and name ca )
 !       ( segid "   A" and resid 23 and name cb ) ( segid "   A" and resid 23 and name HB2 )  5.299 1.007 
 
! assign ( segid "   A" and resid 23 and name ha ) ( segid "   A" and resid 23 and name ca )
!        ( segid "   A" and resid 23 and name cb ) ( segid "   A" and resid 23 and name HB1 )  4.531 1.011 
 
 assign ( segid "   A" and resid 28 and name ha ) ( segid "   A" and resid 28 and name ca )
        ( segid "   A" and resid 28 and name cb ) ( segid "   A" and resid 28 and name Hb2 )  8.706 1.003 
 
 assign ( segid "   A" and resid 28 and name ha ) ( segid "   A" and resid 28 and name ca )
        ( segid "   A" and resid 28 and name cb ) ( segid "   A" and resid 28 and name Hb1 )  1.827 1.101 
 
 assign ( segid "   A" and resid 30 and name ha ) ( segid "   A" and resid 30 and name ca )
        ( segid "   A" and resid 30 and name cb ) ( segid "   A" and resid 30 and name HB2 ) 10.031 1.002 
 
 assign ( segid "   A" and resid 30 and name ha ) ( segid "   A" and resid 30 and name ca )
        ( segid "   A" and resid 30 and name cb ) ( segid "   A" and resid 30 and name HB1 )  6.195 1.009 
 
 assign ( segid "   A" and resid 31 and name ha ) ( segid "   A" and resid 31 and name ca )
        ( segid "   A" and resid 31 and name cb ) ( segid "   A" and resid 31 and name Hb2 ) 11.221 1.004 
 
 assign ( segid "   A" and resid 31 and name ha ) ( segid "   A" and resid 31 and name ca )
        ( segid "   A" and resid 31 and name cb ) ( segid "   A" and resid 31 and name Hb1 )  3.479 1.091 
 
 assign ( segid "   A" and resid 32 and name ha ) ( segid "   A" and resid 32 and name ca )
        ( segid "   A" and resid 32 and name cb ) ( segid "   A" and resid 32 and name Hb2 ) 11.173 1.009 
 
 assign ( segid "   A" and resid 32 and name ha ) ( segid "   A" and resid 32 and name ca )
        ( segid "   A" and resid 32 and name cb ) ( segid "   A" and resid 32 and name Hb1 )  4.215 1.123 
 
 assign ( segid "   A" and resid 33 and name ha ) ( segid "   A" and resid 33 and name ca )
        ( segid "   A" and resid 33 and name cb ) ( segid "   A" and resid 33 and name Hb2 )  3.402 1.029 
 
 assign ( segid "   A" and resid 33 and name ha ) ( segid "   A" and resid 33 and name ca )
        ( segid "   A" and resid 33 and name cb ) ( segid "   A" and resid 33 and name Hb1 )  8.959 1.003 
 
 assign ( segid "   A" and resid 34 and name ha ) ( segid "   A" and resid 34 and name ca )
        ( segid "   A" and resid 34 and name cb ) ( segid "   A" and resid 34 and name Hb2 )  8.791 1.005 
 
 assign ( segid "   A" and resid 34 and name ha ) ( segid "   A" and resid 34 and name ca )
        ( segid "   A" and resid 34 and name cb ) ( segid "   A" and resid 34 and name Hb1 )  2.442 1.104 
 
 !assign ( segid "   A" and resid 35 and name ha ) ( segid "   A" and resid 35 and name ca )
 !       ( segid "   A" and resid 35 and name cb ) ( segid "   A" and resid 35 and name Hb2 )  4.678 1.113 
 
 !assign ( segid "   A" and resid 35 and name ha ) ( segid "   A" and resid 35 and name ca )
 !       ( segid "   A" and resid 35 and name cb ) ( segid "   A" and resid 35 and name Hb1 )  6.660 1.048 
 
 !assign ( segid "   A" and resid 41 and name ha ) ( segid "   A" and resid 41 and name ca )
 !       ( segid "   A" and resid 41 and name cb ) ( segid "   A" and resid 41 and name Hb2 )  8.412 1.004 
 
! assign ( segid "   A" and resid 41 and name ha ) ( segid "   A" and resid 41 and name ca )
!        ( segid "   A" and resid 41 and name cb ) ( segid "   A" and resid 41 and name Hb1 )  3.081 1.045 
 
 assign ( segid "   A" and resid 44 and name ha ) ( segid "   A" and resid 44 and name ca )
        ( segid "   A" and resid 44 and name cb ) ( segid "   A" and resid 44 and name Hb2 ) 10.468 1.061 
 
 assign ( segid "   A" and resid 44 and name ha ) ( segid "   A" and resid 44 and name ca )
        ( segid "   A" and resid 44 and name cb ) ( segid "   A" and resid 44 and name Hb1 )  3.193 1.929 
 
 assign ( segid "   A" and resid 46 and name ha ) ( segid "   A" and resid 46 and name ca )
        ( segid "   A" and resid 46 and name cb ) ( segid "   A" and resid 46 and name Hb2 )  6.535 1.054 
 
 assign ( segid "   A" and resid 46 and name ha ) ( segid "   A" and resid 46 and name ca )
        ( segid "   A" and resid 46 and name cb ) ( segid "   A" and resid 46 and name Hb1 ) 10.208 1.015 
 
 assign ( segid "   A" and resid 48 and name ha ) ( segid "   A" and resid 48 and name ca )
        ( segid "   A" and resid 48 and name cb ) ( segid "   A" and resid 48 and name Hb2 )  2.928 1.515 
 
 assign ( segid "   A" and resid 48 and name ha ) ( segid "   A" and resid 48 and name ca )
        ( segid "   A" and resid 48 and name cb ) ( segid "   A" and resid 48 and name Hb1 ) 10.895 1.022 
 
 assign ( segid "   A" and resid 51 and name ha ) ( segid "   A" and resid 51 and name ca )
        ( segid "   A" and resid 51 and name cb ) ( segid "   A" and resid 51 and name Hb2 )  7.703 1.011 
 
 assign ( segid "   A" and resid 51 and name ha ) ( segid "   A" and resid 51 and name ca )
        ( segid "   A" and resid 51 and name cb ) ( segid "   A" and resid 51 and name Hb1 )  4.118 1.054 
 
 assign ( segid "   A" and resid 53 and name ha ) ( segid "   A" and resid 53 and name ca )
        ( segid "   A" and resid 53 and name cb ) ( segid "   A" and resid 53 and name Hb2 )  9.086 1.005 
 
 assign ( segid "   A" and resid 53 and name ha ) ( segid "   A" and resid 53 and name ca )
        ( segid "   A" and resid 53 and name cb ) ( segid "   A" and resid 53 and name Hb1 )  1.982 1.167 
 
 assign ( segid "   A" and resid 54 and name ha ) ( segid "   A" and resid 54 and name ca )
        ( segid "   A" and resid 54 and name cb ) ( segid "   A" and resid 54 and name Hb2 )  8.888 1.014 
 
 assign ( segid "   A" and resid 54 and name ha ) ( segid "   A" and resid 54 and name ca )
        ( segid "   A" and resid 54 and name cb ) ( segid "   A" and resid 54 and name Hb1 )  2.718 1.223 
 
 assign ( segid "   A" and resid 55 and name ha ) ( segid "   A" and resid 55 and name ca )
        ( segid "   A" and resid 55 and name cb ) ( segid "   A" and resid 55 and name Hb2 )  8.119 1.018 
 
 assign ( segid "   A" and resid 55 and name ha ) ( segid "   A" and resid 55 and name ca )
        ( segid "   A" and resid 55 and name cb ) ( segid "   A" and resid 55 and name Hb1 )  3.413 1.143 
 
 assign ( segid "   A" and resid 56 and name ha ) ( segid "   A" and resid 56 and name ca )
        ( segid "   A" and resid 56 and name cb ) ( segid "   A" and resid 56 and name Hb2 )  4.309 1.005 
 
 assign ( segid "   A" and resid 56 and name ha ) ( segid "   A" and resid 56 and name ca )
        ( segid "   A" and resid 56 and name cb ) ( segid "   A" and resid 56 and name Hb1 )  1.740 1.032 
 
 assign ( segid "   A" and resid 57 and name ha ) ( segid "   A" and resid 57 and name ca )
        ( segid "   A" and resid 57 and name cb ) ( segid "   A" and resid 57 and name Hb2 )  4.108 1.228 
 
 assign ( segid "   A" and resid 57 and name ha ) ( segid "   A" and resid 57 and name ca )
        ( segid "   A" and resid 57 and name cb ) ( segid "   A" and resid 57 and name Hb1 )  9.772 1.025 
 
 assign ( segid "   A" and resid 61 and name ha ) ( segid "   A" and resid 61 and name ca )
        ( segid "   A" and resid 61 and name cb ) ( segid "   A" and resid 61 and name HB2 )  8.485 1.003 
 
 assign ( segid "   A" and resid 61 and name ha ) ( segid "   A" and resid 61 and name ca )
        ( segid "   A" and resid 61 and name cb ) ( segid "   A" and resid 61 and name HB1 )  4.890 1.011 
 
 assign ( segid "   A" and resid 64 and name ha ) ( segid "   A" and resid 64 and name ca )
        ( segid "   A" and resid 64 and name cb ) ( segid "   A" and resid 64 and name Hb2 )  9.923 1.009 
 
 assign ( segid "   A" and resid 64 and name ha ) ( segid "   A" and resid 64 and name ca )
        ( segid "   A" and resid 64 and name cb ) ( segid "   A" and resid 64 and name Hb1 )  4.602 1.070 
 
 assign ( segid "   A" and resid 67 and name ha ) ( segid "   A" and resid 67 and name ca )
        ( segid "   A" and resid 67 and name cb ) ( segid "   A" and resid 67 and name Hb2 ) 10.042 1.004 
 
 assign ( segid "   A" and resid 67 and name ha ) ( segid "   A" and resid 67 and name ca )
        ( segid "   A" and resid 67 and name cb ) ( segid "   A" and resid 67 and name Hb1 )  2.031 1.180 
 
 assign ( segid "   A" and resid 68 and name ha ) ( segid "   A" and resid 68 and name ca )
        ( segid "   A" and resid 68 and name cb ) ( segid "   A" and resid 68 and name Hb2 )  8.489 1.013 
 
 assign ( segid "   A" and resid 68 and name ha ) ( segid "   A" and resid 68 and name ca )
        ( segid "   A" and resid 68 and name cb ) ( segid "   A" and resid 68 and name Hb1 )  1.871 1.378 
 
 assign ( segid "   A" and resid 71 and name ha ) ( segid "   A" and resid 71 and name ca )
        ( segid "   A" and resid 71 and name cb ) ( segid "   A" and resid 71 and name Hb2 )  3.072 1.089 
 
 assign ( segid "   A" and resid 71 and name ha ) ( segid "   A" and resid 71 and name ca )
        ( segid "   A" and resid 71 and name cb ) ( segid "   A" and resid 71 and name Hb1 )  8.299 1.008 
 
 assign ( segid "   A" and resid 72 and name ha ) ( segid "   A" and resid 72 and name ca )
        ( segid "   A" and resid 72 and name cb ) ( segid "   A" and resid 72 and name Hb2 )  9.502 1.012 
 
 assign ( segid "   A" and resid 72 and name ha ) ( segid "   A" and resid 72 and name ca )
        ( segid "   A" and resid 72 and name cb ) ( segid "   A" and resid 72 and name Hb1 )  1.774 1.530 
 
 !assign ( segid "   A" and resid 74 and name ha ) ( segid "   A" and resid 74 and name ca )
 !       ( segid "   A" and resid 74 and name cb ) ( segid "   A" and resid 74 and name HB2 )  6.647 1.007 
 
 !assign ( segid "   A" and resid 74 and name ha ) ( segid "   A" and resid 74 and name ca )
 !       ( segid "   A" and resid 74 and name cb ) ( segid "   A" and resid 74 and name HB1 )  5.707 1.010 
 
 assign ( segid "   A" and resid 76 and name ha ) ( segid "   A" and resid 76 and name ca )
        ( segid "   A" and resid 76 and name cb ) ( segid "   A" and resid 76 and name Hb2 )  8.031 1.002 
 
 assign ( segid "   A" and resid 76 and name ha ) ( segid "   A" and resid 76 and name ca )
        ( segid "   A" and resid 76 and name cb ) ( segid "   A" and resid 76 and name Hb1 )  3.710 1.015 
 
 assign ( segid "   A" and resid 82 and name ha ) ( segid "   A" and resid 82 and name ca )
        ( segid "   A" and resid 82 and name cb ) ( segid "   A" and resid 82 and name Hb2 )  3.636 1.143 
 
 assign ( segid "   A" and resid 82 and name ha ) ( segid "   A" and resid 82 and name ca )
        ( segid "   A" and resid 82 and name cb ) ( segid "   A" and resid 82 and name Hb1 )  9.550 1.013 
 
 assign ( segid "   A" and resid 86 and name ha ) ( segid "   A" and resid 86 and name ca )
        ( segid "   A" and resid 86 and name cb ) ( segid "   A" and resid 86 and name Hb2 )  9.733 1.004 
 
 assign ( segid "   A" and resid 86 and name ha ) ( segid "   A" and resid 86 and name ca )
        ( segid "   A" and resid 86 and name cb ) ( segid "   A" and resid 86 and name Hb1 )  2.601 1.096 
 
 assign ( segid "   A" and resid 91 and name ha ) ( segid "   A" and resid 91 and name ca )
        ( segid "   A" and resid 91 and name cb ) ( segid "   A" and resid 91 and name HB1 )  5.648 1.023 
 
 assign ( segid "   A" and resid 92 and name ha ) ( segid "   A" and resid 92 and name ca )
        ( segid "   A" and resid 92 and name cb ) ( segid "   A" and resid 92 and name Hb2 )  1.611 2.152 
 
 assign ( segid "   A" and resid 92 and name ha ) ( segid "   A" and resid 92 and name ca )
        ( segid "   A" and resid 92 and name cb ) ( segid "   A" and resid 92 and name Hb1 ) 10.161 1.022 
 
! assign ( segid "   A" and resid 95 and name ha ) ( segid "   A" and resid 95 and name ca )
!        ( segid "   A" and resid 95 and name cb ) ( segid "   A" and resid 95 and name HB2 )  5.240 1.010 
 
! assign ( segid "   A" and resid 95 and name ha ) ( segid "   A" and resid 95 and name ca )
!        ( segid "   A" and resid 95 and name cb ) ( segid "   A" and resid 95 and name HB1 )  5.303 1.010 
 
 assign ( segid "   A" and resid 96 and name ha ) ( segid "   A" and resid 96 and name ca )
        ( segid "   A" and resid 96 and name cb ) ( segid "   A" and resid 96 and name Hb2 )  5.407 1.049 
 
 assign ( segid "   A" and resid 96 and name ha ) ( segid "   A" and resid 96 and name ca )
        ( segid "   A" and resid 96 and name cb ) ( segid "   A" and resid 96 and name Hb1 ) 10.474 1.008 
 
 assign ( segid "   A" and resid 100 and name ha ) ( segid "   A" and resid 100 and name ca )
        ( segid "   A" and resid 100 and name cb ) ( segid "   A" and resid 100 and name Hb2 )  4.303 1.164 
 
 assign ( segid "   A" and resid 100 and name ha ) ( segid "   A" and resid 100 and name ca )
        ( segid "   A" and resid 100 and name cb ) ( segid "   A" and resid 100 and name Hb1 ) 10.537 1.015 
 
 assign ( segid "   A" and resid 102 and name ha ) ( segid "   A" and resid 102 and name ca )
        ( segid "   A" and resid 102 and name cb ) ( segid "   A" and resid 102 and name Hb2 )  4.212 1.165 
 
 assign ( segid "   A" and resid 102 and name ha ) ( segid "   A" and resid 102 and name ca )
        ( segid "   A" and resid 102 and name cb ) ( segid "   A" and resid 102 and name Hb1 ) 10.683 1.014 
 
 assign ( segid "   A" and resid 105 and name ha ) ( segid "   A" and resid 105 and name ca )
        ( segid "   A" and resid 105 and name cb ) ( segid "   A" and resid 105 and name Hb2 )  5.360 1.100 
 
 assign ( segid "   A" and resid 105 and name ha ) ( segid "   A" and resid 105 and name ca )
        ( segid "   A" and resid 105 and name cb ) ( segid "   A" and resid 105 and name Hb1 )  9.157 1.024 
 
 assign ( segid "   A" and resid 106 and name ha ) ( segid "   A" and resid 106 and name ca )
        ( segid "   A" and resid 106 and name cb ) ( segid "   A" and resid 106 and name HB2 )  6.617 1.016 
 
 assign ( segid "   A" and resid 106 and name ha ) ( segid "   A" and resid 106 and name ca )
        ( segid "   A" and resid 106 and name cb ) ( segid "   A" and resid 106 and name HB1 )  7.896 1.010 
 
 assign ( segid "   A" and resid 108 and name ha ) ( segid "   A" and resid 108 and name ca )
        ( segid "   A" and resid 108 and name cb ) ( segid "   A" and resid 108 and name Hb2 )  3.572 1.059 
 
 assign ( segid "   A" and resid 108 and name ha ) ( segid "   A" and resid 108 and name ca )
        ( segid "   A" and resid 108 and name cb ) ( segid "   A" and resid 108 and name Hb1 )  9.896 1.004 
 
! assign ( segid "   A" and resid 109 and name ha ) ( segid "   A" and resid 109 and name ca )
!        ( segid "   A" and resid 109 and name cb ) ( segid "   A" and resid 109 and name HB2 )  4.570 1.031 
 
! assign ( segid "   A" and resid 109 and name ha ) ( segid "   A" and resid 109 and name ca )
!        ( segid "   A" and resid 109 and name cb ) ( segid "   A" and resid 109 and name HB1 )  5.335 1.022 
 
 assign ( segid "   A" and resid 111 and name ha ) ( segid "   A" and resid 111 and name ca )
        ( segid "   A" and resid 111 and name cb ) ( segid "   A" and resid 111 and name Hb2 )  9.138 1.001 
 
 assign ( segid "   A" and resid 111 and name ha ) ( segid "   A" and resid 111 and name ca )
        ( segid "   A" and resid 111 and name cb ) ( segid "   A" and resid 111 and name Hb1 )  3.582 1.015 
 
 assign ( segid "   A" and resid 112 and name ha ) ( segid "   A" and resid 112 and name ca )
        ( segid "   A" and resid 112 and name cb ) ( segid "   A" and resid 112 and name Hb2 )  9.540 1.002 
 
 assign ( segid "   A" and resid 112 and name ha ) ( segid "   A" and resid 112 and name ca )
        ( segid "   A" and resid 112 and name cb ) ( segid "   A" and resid 112 and name Hb1 )  2.830 1.042 
 
 assign ( segid "   A" and resid 113 and name ha ) ( segid "   A" and resid 113 and name ca )
        ( segid "   A" and resid 113 and name cb ) ( segid "   A" and resid 113 and name Hb2 )  4.343 1.041 
 
 assign ( segid "   A" and resid 113 and name ha ) ( segid "   A" and resid 113 and name ca )
        ( segid "   A" and resid 113 and name cb ) ( segid "   A" and resid 113 and name Hb1 )  9.699 1.005 
 
 assign ( segid "   A" and resid 122 and name ha ) ( segid "   A" and resid 122 and name ca )
        ( segid "   A" and resid 122 and name cb ) ( segid "   A" and resid 122 and name HB2 )  5.467 1.001 
 
 assign ( segid "   A" and resid 122 and name ha ) ( segid "   A" and resid 122 and name ca )
        ( segid "   A" and resid 122 and name cb ) ( segid "   A" and resid 122 and name HB1 )  6.339 1.001 
 
 
REMARK Ile  JHAHB Karplus Coefficient A, B, C = 7.23, -1.37, 1.79 
REMARK Phase Offset of +120 in Karplus Parameters

assign ( segid "   A" and resid 24 and name ha ) ( segid "   A" and resid 24 and name ca )
        ( segid "   A" and resid 24 and name cb ) ( segid "   A" and resid 24 and name Hb  ) 10.191 1.013 
 
 assign ( segid "   A" and resid 47 and name ha ) ( segid "   A" and resid 47 and name ca )
        ( segid "   A" and resid 47 and name cb ) ( segid "   A" and resid 47 and name Hb  )  9.692 1.011 
 
 assign ( segid "   A" and resid 116 and name ha ) ( segid "   A" and resid 116 and name ca )
        ( segid "   A" and resid 116 and name cb ) ( segid "   A" and resid 116 and name Hb  )  9.745 1.010 
 
 REMARK SER  JHAHB Karplus Coefficient A, B, C = 7.23, -1.37, 1.43 

assign ( segid "   A" and resid 6 and name ha ) ( segid "   A" and resid 6 and name ca )
        ( segid "   A" and resid 6 and name cb ) ( segid "   A" and resid 6 and name HB2 )  7.449 1.033 
 
 assign ( segid "   A" and resid 6 and name ha ) ( segid "   A" and resid 6 and name ca )
        ( segid "   A" and resid 6 and name cb ) ( segid "   A" and resid 6 and name HB1 ) 12.522 1.007 
 
 REMARK THR  JHAHB Karplus Coefficient A, B, C = 7.23, -1.37, 0.81 
REMARK Phase Offset of +120 in Karplus Parameters

 assign ( segid "   A" and resid 4 and name ha ) ( segid "   A" and resid 4 and name ca )
        ( segid "   A" and resid 4 and name cb ) ( segid "   A" and resid 4 and name Hb  )  4.788 1.003 
 
 !assign ( segid "   A" and resid 8 and name ha ) ( segid "   A" and resid 8 and name ca )
 !       ( segid "   A" and resid 8 and name cb ) ( segid "   A" and resid 8 and name Hb  )  4.740 1.005 
 
 assign ( segid "   A" and resid 16 and name ha ) ( segid "   A" and resid 16 and name ca )
        ( segid "   A" and resid 16 and name cb ) ( segid "   A" and resid 16 and name Hb  )  7.157 1.003 
 
 assign ( segid "   A" and resid 43 and name ha ) ( segid "   A" and resid 43 and name ca )
        ( segid "   A" and resid 43 and name cb ) ( segid "   A" and resid 43 and name Hb  )  8.440 1.006 
 
 assign ( segid "   A" and resid 60 and name ha ) ( segid "   A" and resid 60 and name ca )
        ( segid "   A" and resid 60 and name cb ) ( segid "   A" and resid 60 and name Hb  )  7.733 1.002 
 
 assign ( segid "   A" and resid 83 and name ha ) ( segid "   A" and resid 83 and name ca )
        ( segid "   A" and resid 83 and name cb ) ( segid "   A" and resid 83 and name Hb  )  6.808 1.002 
 
 assign ( segid "   A" and resid 93 and name ha ) ( segid "   A" and resid 93 and name ca )
        ( segid "   A" and resid 93 and name cb ) ( segid "   A" and resid 93 and name Hb  )  2.451 1.012 
 
 
REMARK VAL  JHAHB Karplus Coefficient A, B, C = 7.23, -1.37, 1.79 

assign ( segid "   A" and resid 5 and name ha ) ( segid "   A" and resid 5 and name ca )
        ( segid "   A" and resid 5 and name cb ) ( segid "   A" and resid 5 and name Hb  )  8.799 1.004 
 
 assign ( segid "   A" and resid 19 and name ha ) ( segid "   A" and resid 19 and name ca )
        ( segid "   A" and resid 19 and name cb ) ( segid "   A" and resid 19 and name Hb  )  9.171 1.017 
 
 assign ( segid "   A" and resid 29 and name ha ) ( segid "   A" and resid 29 and name ca )
        ( segid "   A" and resid 29 and name cb ) ( segid "   A" and resid 29 and name Hb  ) 10.949 1.005 
 
 assign ( segid "   A" and resid 50 and name ha ) ( segid "   A" and resid 50 and name ca )
        ( segid "   A" and resid 50 and name cb ) ( segid "   A" and resid 50 and name Hb  )  8.645 1.011 
 
 assign ( segid "   A" and resid 65 and name ha ) ( segid "   A" and resid 65 and name ca )
        ( segid "   A" and resid 65 and name cb ) ( segid "   A" and resid 65 and name Hb  ) 10.361 1.000 
 
 assign ( segid "   A" and resid 69 and name ha ) ( segid "   A" and resid 69 and name ca )
        ( segid "   A" and resid 69 and name cb ) ( segid "   A" and resid 69 and name Hb  ) 10.595 1.005 
 
 assign ( segid "   A" and resid 81 and name ha ) ( segid "   A" and resid 81 and name ca )
        ( segid "   A" and resid 81 and name cb ) ( segid "   A" and resid 81 and name Hb  )  8.727 1.004 
 
 assign ( segid "   A" and resid 85 and name ha ) ( segid "   A" and resid 85 and name ca )
        ( segid "   A" and resid 85 and name cb ) ( segid "   A" and resid 85 and name Hb  )  9.196 1.009 
 
 assign ( segid "   A" and resid 89 and name ha ) ( segid "   A" and resid 89 and name ca )
        ( segid "   A" and resid 89 and name cb ) ( segid "   A" and resid 89 and name Hb  )  9.104 1.006 
 
 # Restraints file 4: o22_run25c_hbonds.tbl
 assi 
   (( segid "   A" and resid 14   and name  H   ))
   (( segid "   A" and resid 10   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 15   and name  H   ))
   (( segid "   A" and resid 11   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 18   and name  H   ))
   (( segid "   A" and resid 14   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 19   and name  H   ))
   (( segid "   A" and resid 15   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 29   and name  H   ))
   (( segid "   A" and resid 25   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 36   and name  H   ))
   (( segid "   A" and resid 31   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 40   and name  H   ))
   (( segid "   A" and resid 38   and name  O   ))
      2.200     0.470     0.800

 assi 
   (( segid "   A" and resid 43   and name  H   ))
   (( segid "   A" and resid 40   and name  OD1 ))
      2.700     0.970     0.500

 assi 
   (( segid "   A" and resid 44   and name  H   ))
   (( segid "   A" and resid 40   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 46   and name  H   ))
   (( segid "   A" and resid 42   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 47   and name  H   ))
   (( segid "   A" and resid 43   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 48   and name  H   ))
   (( segid "   A" and resid 44   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 49   and name  H   ))
   (( segid "   A" and resid 45   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 50   and name  H   ))
   (( segid "   A" and resid 46   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 51   and name  H   ))
   (( segid "   A" and resid 47   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 52   and name  H   ))
   (( segid "   A" and resid 48   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 53   and name  H   ))
   (( segid "   A" and resid 49   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 54   and name  H   ))
   (( segid "   A" and resid 50   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 55   and name  H   ))
   (( segid "   A" and resid 52   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 56   and name  H   ))
   (( segid "   A" and resid 51   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 57   and name  H   ))
   (( segid "   A" and resid 51   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 58   and name  H   ))
   (( segid "   A" and resid 62   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 62   and name  H   ))
   (( segid "   A" and resid 58   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 64   and name  H   ))
   (( segid "   A" and resid 56   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 68   and name  H   ))
   (( segid "   A" and resid 64   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 71   and name  H   ))
   (( segid "   A" and resid 67   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 72   and name  H   ))
   (( segid "   A" and resid 68   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 69   and name  H   ))
   (( segid "   A" and resid 65   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 73   and name  H   ))
   (( segid "   A" and resid 69   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 85   and name  H   ))
   (( segid "   A" and resid 81   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 86   and name  H   ))
   (( segid "   A" and resid 82   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 100  and name  H   ))
   (( segid "   A" and resid 96   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 100  and name  HE1 ))
   (( segid "   A" and resid 90   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 101  and name  H   ))
   (( segid "   A" and resid 97   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 102  and name  H   ))
   (( segid "   A" and resid 98   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 105  and name  H   ))
   (( segid "   A" and resid 101  and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 106  and name  H   ))
   (( segid "   A" and resid 102  and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 107  and name  H   ))
   (( segid "   A" and resid 103  and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 108  and name  H   ))
   (( segid "   A" and resid 104  and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 109  and name  H   ))
   (( segid "   A" and resid 105  and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 32   and name  H   ))
   (( segid "   A" and resid 28   and name  O   ))
      2.200     0.470     0.500

 assi 
   (( segid "   A" and resid 36   and name  H   ))
   (( segid "   A" and resid 31   and name  O   ))
      2.200     0.470     0.500

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1          1H        MET   1  16.894   7.988 -16.011
    2    H2   MET   1          2H        MET   1  15.873   9.021 -16.875
    3    H3   MET   1          3H        MET   1  16.320   7.526 -17.534
    4    HA   MET   1           HA       MET   1  14.071   7.474 -16.703
    5    HB2  MET   1          1HB       MET   1  14.309   5.502 -15.202
    6    HB3  MET   1          2HB       MET   1  15.270   5.385 -16.667
    7    HG2  MET   1          1HG       MET   1  17.259   6.079 -15.368
    8    HG3  MET   1          2HG       MET   1  16.270   6.072 -13.910
    9    HE1  MET   1          1HE       MET   1  15.318   2.292 -13.582
   10    HE2  MET   1          2HE       MET   1  14.387   3.532 -14.420
   11    HE3  MET   1          3HE       MET   1  15.167   3.903 -12.882
   12    H    GLU   2           H        GLU   2  13.071   9.104 -15.702
   13    HA   GLU   2           HA       GLU   2  14.135  10.101 -13.190
   14    HB2  GLU   2          1HB       GLU   2  11.951  11.162 -14.974
   15    HB3  GLU   2          2HB       GLU   2  12.473  11.919 -13.480
   16    HG2  GLU   2          1HG       GLU   2  13.485  13.073 -15.295
   17    HG3  GLU   2          2HG       GLU   2  14.742  12.162 -14.468
   18    H    PHE   3           H        PHE   3  13.513   9.192 -11.421
   19    HA   PHE   3           HA       PHE   3  10.799   8.114 -11.181
   20    HB2  PHE   3          1HB       PHE   3  12.582   6.561 -10.622
   21    HB3  PHE   3          2HB       PHE   3  13.261   7.710  -9.465
   22    HD1  PHE   3           HD1      PHE   3  12.530   7.739  -7.249
   23    HD2  PHE   3           HD2      PHE   3  10.301   5.610 -10.170
   24    HE1  PHE   3           HE1      PHE   3  11.155   6.743  -5.465
   25    HE2  PHE   3           HE2      PHE   3   8.917   4.607  -8.398
   26    HZ   PHE   3           HZ       PHE   3   9.344   5.175  -6.041
   27    H    THR   4           H        THR   4   9.339   9.331 -10.231
   28    HA   THR   4           HA       THR   4  10.214  11.436  -8.378
   29    HB   THR   4           HB       THR   4   7.382  11.450  -9.079
   30    HG1  THR   4           HG1      THR   4   7.639  11.104 -11.158
   31   HG21  THR   4          1HG2      THR   4   9.631  13.436  -9.346
   32   HG22  THR   4          2HG2      THR   4   8.489  13.308  -8.010
   33   HG23  THR   4          3HG2      THR   4   7.926  13.796  -9.607
   34    H    VAL   5           H        VAL   5  10.159  10.870  -6.334
   35    HA   VAL   5           HA       VAL   5   8.570   8.695  -5.357
   36    HB   VAL   5           HB       VAL   5   9.690   8.868  -3.393
   37   HG11  VAL   5          1HG1      VAL   5  11.472  10.688  -4.974
   38   HG12  VAL   5          2HG1      VAL   5  11.398   8.936  -5.141
   39   HG13  VAL   5          3HG1      VAL   5  11.929   9.654  -3.623
   40   HG21  VAL   5          1HG2      VAL   5  10.308  10.934  -2.234
   41   HG22  VAL   5          2HG2      VAL   5   8.590  10.894  -2.624
   42   HG23  VAL   5          3HG2      VAL   5   9.689  11.876  -3.591
   43    H    SER   6           H        SER   6   6.704   8.718  -4.221
   44    HA   SER   6           HA       SER   6   5.066  11.069  -4.669
   45    HB2  SER   6          1HB       SER   6   3.227   9.512  -3.870
   46    HB3  SER   6          2HB       SER   6   4.075   9.010  -5.332
   47    HG   SER   6           HG       SER   6   4.934   8.123  -2.801
   48    H    THR   7           H        THR   7   5.240  12.622  -3.154
   49    HA   THR   7           HA       THR   7   5.677  11.957  -0.377
   50    HB   THR   7           HB       THR   7   5.591  14.389   0.018
   51    HG1  THR   7           HG1      THR   7   4.925  14.448  -2.764
   52   HG21  THR   7          1HG2      THR   7   7.570  14.998  -1.300
   53   HG22  THR   7          2HG2      THR   7   7.304  13.598  -2.341
   54   HG23  THR   7          3HG2      THR   7   7.709  13.368  -0.640
   55    H    THR   8           H        THR   8   4.196  13.447   1.175
   56    HA   THR   8           HA       THR   8   1.707  12.173   1.241
   57    HB   THR   8           HB       THR   8   2.332  14.779   2.619
   58    HG1  THR   8           HG1      THR   8   3.746  12.557   2.770
   59   HG21  THR   8          1HG2      THR   8   0.591  12.420   3.338
   60   HG22  THR   8          2HG2      THR   8   0.042  14.029   2.870
   61   HG23  THR   8          3HG2      THR   8   0.903  13.801   4.389
   62    H    GLU   9           H        GLU   9   2.675  15.285  -0.071
   63    HA   GLU   9           HA       GLU   9   0.090  16.309  -0.509
   64    HB2  GLU   9          1HB       GLU   9   2.601  16.942  -2.058
   65    HB3  GLU   9          2HB       GLU   9   1.157  17.938  -1.939
   66    HG2  GLU   9          1HG       GLU   9   3.080  17.276   0.276
   67    HG3  GLU   9          2HG       GLU   9   2.872  18.834  -0.521
   68    H    ASP  10           H        ASP  10   2.312  14.458  -2.542
   69    HA   ASP  10           HA       ASP  10   0.684  14.450  -4.862
   70    HB2  ASP  10          1HB       ASP  10   2.696  12.335  -4.061
   71    HB3  ASP  10          2HB       ASP  10   2.100  12.684  -5.682
   72    H    LEU  11           H        LEU  11   0.958  12.406  -2.046
   73    HA   LEU  11           HA       LEU  11  -0.607  10.270  -2.938
   74    HB2  LEU  11          1HB       LEU  11   0.867  10.044  -1.051
   75    HB3  LEU  11          2HB       LEU  11  -0.062  11.236  -0.133
   76    HG   LEU  11           HG       LEU  11  -1.995   9.662  -0.210
   77   HD11  LEU  11          1HD1      LEU  11  -1.635   7.367  -0.848
   78   HD12  LEU  11          2HD1      LEU  11   0.037   7.720  -1.285
   79   HD13  LEU  11          3HD1      LEU  11  -1.285   8.427  -2.212
   80   HD21  LEU  11          1HD2      LEU  11  -0.435   9.811   1.711
   81   HD22  LEU  11          2HD2      LEU  11   0.501   8.491   1.007
   82   HD23  LEU  11          3HD2      LEU  11  -1.161   8.218   1.523
   83    H    GLN  12           H        GLN  12  -1.457  13.310  -1.387
   84    HA   GLN  12           HA       GLN  12  -4.157  12.622  -0.830
   85    HB2  GLN  12          1HB       GLN  12  -2.802  15.299  -1.135
   86    HB3  GLN  12          2HB       GLN  12  -4.490  15.121  -0.687
   87    HG2  GLN  12          1HG       GLN  12  -3.774  13.833   1.305
   88    HG3  GLN  12          2HG       GLN  12  -2.100  14.170   0.867
   89   HE21  GLN  12          1HE2      GLN  12  -1.288  16.240   1.126
   90   HE22  GLN  12          2HE2      GLN  12  -2.112  17.452   2.042
   91    H    ARG  13           H        ARG  13  -2.493  13.513  -3.660
   92    HA   ARG  13           HA       ARG  13  -4.813  14.464  -5.084
   93    HB2  ARG  13          1HB       ARG  13  -2.051  13.726  -6.055
   94    HB3  ARG  13          2HB       ARG  13  -3.303  14.463  -7.046
   95    HG2  ARG  13          1HG       ARG  13  -3.284  16.450  -5.703
   96    HG3  ARG  13          2HG       ARG  13  -2.149  15.707  -4.559
   97    HD2  ARG  13          1HD       ARG  13  -0.507  15.524  -6.404
   98    HD3  ARG  13          2HD       ARG  13  -1.630  16.394  -7.447
   99    HE   ARG  13           HE       ARG  13  -1.388  18.106  -5.425
  100   HH11  ARG  13          1HH1      ARG  13   1.047  16.310  -7.185
  101   HH12  ARG  13          2HH1      ARG  13   2.288  17.495  -6.937
  102   HH21  ARG  13          1HH2      ARG  13   0.246  19.676  -5.095
  103   HH22  ARG  13          2HH2      ARG  13   1.827  19.417  -5.757
  104    H    TYR  14           H        TYR  14  -2.679  11.619  -5.371
  105    HA   TYR  14           HA       TYR  14  -4.160  10.209  -7.266
  106    HB2  TYR  14          1HB       TYR  14  -2.608   8.977  -4.979
  107    HB3  TYR  14          2HB       TYR  14  -3.027   8.209  -6.500
  108    HD1  TYR  14           HD1      TYR  14  -0.302   9.165  -4.888
  109    HD2  TYR  14           HD2      TYR  14  -2.291  10.138  -8.520
  110    HE1  TYR  14           HE1      TYR  14   1.834   9.894  -5.855
  111    HE2  TYR  14           HE2      TYR  14  -0.153  10.864  -9.499
  112    HH   TYR  14           HH       TYR  14   2.854  10.176  -8.059
  113    H    ARG  15           H        ARG  15  -4.397  10.203  -3.752
  114    HA   ARG  15           HA       ARG  15  -6.242   8.089  -3.555
  115    HB2  ARG  15          1HB       ARG  15  -5.520   8.293  -1.461
  116    HB3  ARG  15          2HB       ARG  15  -4.832   9.869  -1.819
  117    HG2  ARG  15          1HG       ARG  15  -6.934  10.944  -1.253
  118    HG3  ARG  15          2HG       ARG  15  -7.684   9.367  -0.981
  119    HD2  ARG  15          1HD       ARG  15  -6.090   8.915   0.820
  120    HD3  ARG  15          2HD       ARG  15  -5.332  10.481   0.556
  121    HE   ARG  15           HE       ARG  15  -7.819  11.233   1.060
  122   HH11  ARG  15          1HH1      ARG  15  -5.843   8.808   2.629
  123   HH12  ARG  15          2HH1      ARG  15  -6.551   9.058   4.192
  124   HH21  ARG  15          1HH2      ARG  15  -8.776  11.564   3.113
  125   HH22  ARG  15          2HH2      ARG  15  -8.248  10.613   4.463
  126    H    THR  16           H        THR  16  -6.633  11.559  -3.873
  127    HA   THR  16           HA       THR  16  -9.391  11.700  -3.369
  128    HB   THR  16           HB       THR  16  -7.510  13.422  -4.965
  129    HG1  THR  16           HG1      THR  16  -7.123  13.851  -2.912
  130   HG21  THR  16          1HG2      THR  16  -9.275  15.119  -5.081
  131   HG22  THR  16          2HG2      THR  16 -10.418  13.971  -4.380
  132   HG23  THR  16          3HG2      THR  16  -9.717  13.659  -5.969
  133    H    GLU  17           H        GLU  17  -7.585  11.391  -6.417
  134    HA   GLU  17           HA       GLU  17  -9.855  11.332  -8.100
  135    HB2  GLU  17          1HB       GLU  17  -7.243   9.963  -8.743
  136    HB3  GLU  17          2HB       GLU  17  -8.410  10.663  -9.848
  137    HG2  GLU  17          1HG       GLU  17  -6.753  12.249  -7.908
  138    HG3  GLU  17          2HG       GLU  17  -6.408  12.049  -9.632
  139    H    CYS  18           H        CYS  18  -8.081   8.743  -6.466
  140    HA   CYS  18           HA       CYS  18  -9.515   6.623  -7.659
  141    HB2  CYS  18          1HB       CYS  18  -8.072   6.776  -5.005
  142    HB3  CYS  18          2HB       CYS  18  -8.765   5.292  -5.678
  143    H    VAL  19           H        VAL  19 -10.134   8.662  -4.876
  144    HA   VAL  19           HA       VAL  19 -12.303   7.224  -3.829
  145    HB   VAL  19           HB       VAL  19 -11.378  10.060  -3.555
  146   HG11  VAL  19          1HG1      VAL  19 -13.206  10.544  -2.027
  147   HG12  VAL  19          2HG1      VAL  19 -13.930   8.971  -2.365
  148   HG13  VAL  19          3HG1      VAL  19 -13.825  10.186  -3.642
  149   HG21  VAL  19          1HG2      VAL  19 -10.246   8.371  -2.261
  150   HG22  VAL  19          2HG2      VAL  19 -11.783   7.760  -1.648
  151   HG23  VAL  19          3HG2      VAL  19 -11.224   9.368  -1.183
  152    H    SER  20           H        SER  20 -12.209  10.037  -5.986
  153    HA   SER  20           HA       SER  20 -15.007  10.178  -6.334
  154    HB2  SER  20          1HB       SER  20 -13.478  12.068  -6.707
  155    HB3  SER  20          2HB       SER  20 -12.810  11.249  -8.116
  156    HG   SER  20           HG       SER  20 -15.170  11.223  -8.805
  157    H    SER  21           H        SER  21 -12.636   8.127  -7.813
  158    HA   SER  21           HA       SER  21 -14.293   7.629 -10.151
  159    HB2  SER  21          1HB       SER  21 -11.660   6.410  -9.297
  160    HB3  SER  21          2HB       SER  21 -12.448   6.165 -10.857
  161    HG   SER  21           HG       SER  21 -11.058   8.365  -9.872
  162    H    LEU  22           H        LEU  22 -13.129   5.859  -7.280
  163    HA   LEU  22           HA       LEU  22 -14.608   3.498  -8.071
  164    HB2  LEU  22          1HB       LEU  22 -12.887   4.133  -5.680
  165    HB3  LEU  22          2HB       LEU  22 -13.694   2.579  -5.911
  166    HG   LEU  22           HG       LEU  22 -11.721   3.731  -7.878
  167   HD11  LEU  22          1HD1      LEU  22 -10.124   2.116  -6.911
  168   HD12  LEU  22          2HD1      LEU  22 -11.291   1.762  -5.636
  169   HD13  LEU  22          3HD1      LEU  22 -10.589   3.374  -5.766
  170   HD21  LEU  22          1HD2      LEU  22 -11.663   1.478  -8.743
  171   HD22  LEU  22          2HD2      LEU  22 -13.324   2.073  -8.734
  172   HD23  LEU  22          3HD2      LEU  22 -12.785   0.941  -7.492
  173    H    ASN  23           H        ASN  23 -15.758   6.210  -7.036
  174    HA   ASN  23           HA       ASN  23 -17.553   6.956  -5.856
  175    HB2  ASN  23          1HB       ASN  23 -18.588   5.181  -7.294
  176    HB3  ASN  23          2HB       ASN  23 -18.477   4.086  -5.932
  177   HD21  ASN  23          1HD2      ASN  23 -19.260   7.513  -5.849
  178   HD22  ASN  23          2HD2      ASN  23 -20.871   7.310  -5.248
  179    H    ILE  24           H        ILE  24 -15.272   6.212  -4.304
  180    HA   ILE  24           HA       ILE  24 -15.965   4.710  -2.015
  181    HB   ILE  24           HB       ILE  24 -13.886   6.894  -2.159
  182   HG12  ILE  24          1HG1      ILE  24 -13.579   5.302  -4.027
  183   HG13  ILE  24          2HG1      ILE  24 -12.285   5.169  -2.839
  184   HG21  ILE  24          1HG2      ILE  24 -14.123   4.434  -0.428
  185   HG22  ILE  24          2HG2      ILE  24 -14.376   6.102   0.087
  186   HG23  ILE  24          3HG2      ILE  24 -12.772   5.567  -0.418
  187   HD11  ILE  24          1HD1      ILE  24 -14.637   3.313  -3.119
  188   HD12  ILE  24          2HD1      ILE  24 -13.355   3.174  -1.914
  189   HD13  ILE  24          3HD1      ILE  24 -12.980   2.988  -3.628
  190    HA   PRO  25           HA       PRO  25 -18.696   7.721  -0.128
  191    HB2  PRO  25          1HB       PRO  25 -18.295   6.044   2.254
  192    HB3  PRO  25          2HB       PRO  25 -19.787   6.471   1.414
  193    HG2  PRO  25          1HG       PRO  25 -18.735   4.007   1.295
  194    HG3  PRO  25          2HG       PRO  25 -19.615   4.735  -0.060
  195    HD2  PRO  25          1HD       PRO  25 -16.674   4.371   0.319
  196    HD3  PRO  25          2HD       PRO  25 -17.652   4.271  -1.169
  197    H    ALA  26           H        ALA  26 -18.364   9.483   1.021
  198    HA   ALA  26           HA       ALA  26 -15.790  10.371   1.623
  199    HB1  ALA  26          1HB       ALA  26 -18.412  11.408   2.680
  200    HB2  ALA  26          2HB       ALA  26 -17.682  11.844   1.136
  201    HB3  ALA  26          3HB       ALA  26 -16.885  12.288   2.647
  202    H    ASP  27           H        ASP  27 -18.221   8.844   3.637
  203    HA   ASP  27           HA       ASP  27 -17.165   9.285   6.168
  204    HB2  ASP  27          1HB       ASP  27 -19.329   8.219   5.771
  205    HB3  ASP  27          2HB       ASP  27 -18.520   6.785   5.144
  206    H    TYR  28           H        TYR  28 -16.403   6.663   3.874
  207    HA   TYR  28           HA       TYR  28 -14.489   5.375   5.454
  208    HB2  TYR  28          1HB       TYR  28 -15.016   5.466   2.497
  209    HB3  TYR  28          2HB       TYR  28 -13.625   4.582   3.128
  210    HD1  TYR  28           HD1      TYR  28 -13.911   2.383   3.966
  211    HD2  TYR  28           HD2      TYR  28 -17.318   4.851   3.355
  212    HE1  TYR  28           HE1      TYR  28 -15.379   0.459   4.404
  213    HE2  TYR  28           HE2      TYR  28 -18.794   2.937   3.790
  214    HH   TYR  28           HH       TYR  28 -18.746   0.534   3.742
  215    H    VAL  29           H        VAL  29 -14.261   8.041   3.179
  216    HA   VAL  29           HA       VAL  29 -11.480   8.228   2.964
  217    HB   VAL  29           HB       VAL  29 -13.496  10.457   2.809
  218   HG11  VAL  29          1HG1      VAL  29 -11.794  11.486   1.313
  219   HG12  VAL  29          2HG1      VAL  29 -10.678  10.203   1.782
  220   HG13  VAL  29          3HG1      VAL  29 -11.271  11.342   2.990
  221   HG21  VAL  29          1HG2      VAL  29 -14.100   8.678   1.309
  222   HG22  VAL  29          2HG2      VAL  29 -12.447   8.582   0.704
  223   HG23  VAL  29          3HG2      VAL  29 -13.423  10.015   0.377
  224    H    GLU  30           H        GLU  30 -13.740   9.656   5.283
  225    HA   GLU  30           HA       GLU  30 -11.925  11.217   6.764
  226    HB2  GLU  30          1HB       GLU  30 -14.217   9.719   8.022
  227    HB3  GLU  30          2HB       GLU  30 -13.511  11.257   8.488
  228    HG2  GLU  30          1HG       GLU  30 -15.036  10.820   5.945
  229    HG3  GLU  30          2HG       GLU  30 -15.720  11.470   7.431
  230    H    LYS  31           H        LYS  31 -12.766   7.787   7.016
  231    HA   LYS  31           HA       LYS  31 -11.250   7.193   9.311
  232    HB2  LYS  31          1HB       LYS  31 -11.902   5.406   6.958
  233    HB3  LYS  31          2HB       LYS  31 -11.262   4.863   8.514
  234    HG2  LYS  31          1HG       LYS  31 -13.299   5.746   9.608
  235    HG3  LYS  31          2HG       LYS  31 -13.938   6.149   8.012
  236    HD2  LYS  31          1HD       LYS  31 -13.781   3.785   7.361
  237    HD3  LYS  31          2HD       LYS  31 -13.179   3.391   8.984
  238    HE2  LYS  31          1HE       LYS  31 -15.855   4.671   8.425
  239    HE3  LYS  31          2HE       LYS  31 -15.616   2.943   8.680
  240    HZ1  LYS  31          1HZ       LYS  31 -14.685   3.486  10.880
  241    HZ2  LYS  31          2HZ       LYS  31 -16.302   3.957  10.715
  242    HZ3  LYS  31          3HZ       LYS  31 -15.074   5.114  10.626
  243    H    PHE  32           H        PHE  32 -10.463   6.962   5.872
  244    HA   PHE  32           HA       PHE  32  -7.887   5.957   6.079
  245    HB2  PHE  32          1HB       PHE  32  -8.892   7.863   3.967
  246    HB3  PHE  32          2HB       PHE  32  -7.540   6.749   3.817
  247    HD1  PHE  32           HD1      PHE  32  -8.976   4.412   5.230
  248    HD2  PHE  32           HD2      PHE  32 -10.099   7.048   2.087
  249    HE1  PHE  32           HE1      PHE  32 -10.480   2.694   4.327
  250    HE2  PHE  32           HE2      PHE  32 -11.613   5.331   1.188
  251    HZ   PHE  32           HZ       PHE  32 -11.801   3.147   2.303
  252    H    LYS  33           H        LYS  33  -9.044   9.247   6.400
  253    HA   LYS  33           HA       LYS  33  -6.525  10.541   6.183
  254    HB2  LYS  33          1HB       LYS  33  -8.992  11.493   6.154
  255    HB3  LYS  33          2HB       LYS  33  -8.708  11.661   7.883
  256    HG2  LYS  33          1HG       LYS  33  -6.759  13.037   7.474
  257    HG3  LYS  33          2HG       LYS  33  -6.963  12.834   5.727
  258    HD2  LYS  33          1HD       LYS  33  -9.214  13.901   5.952
  259    HD3  LYS  33          2HD       LYS  33  -8.827  14.238   7.640
  260    HE2  LYS  33          1HE       LYS  33  -7.304  15.227   5.233
  261    HE3  LYS  33          2HE       LYS  33  -8.394  16.183   6.234
  262    HZ1  LYS  33          1HZ       LYS  33  -6.907  15.829   8.110
  263    HZ2  LYS  33          2HZ       LYS  33  -6.092  16.570   6.829
  264    HZ3  LYS  33          3HZ       LYS  33  -5.859  14.926   7.138
  265    H    LYS  34           H        LYS  34  -8.199   8.930   8.778
  266    HA   LYS  34           HA       LYS  34  -6.148   9.745  10.699
  267    HB2  LYS  34          1HB       LYS  34  -8.864   8.560  10.914
  268    HB3  LYS  34          2HB       LYS  34  -7.707   8.189  12.178
  269    HG2  LYS  34          1HG       LYS  34  -9.089  10.062  12.812
  270    HG3  LYS  34          2HG       LYS  34  -7.416  10.577  12.615
  271    HD2  LYS  34          1HD       LYS  34  -7.929  11.524  10.447
  272    HD3  LYS  34          2HD       LYS  34  -9.584  10.915  10.544
  273    HE2  LYS  34          1HE       LYS  34  -9.434  13.309  11.092
  274    HE3  LYS  34          2HE       LYS  34 -10.036  12.347  12.440
  275    HZ1  LYS  34          1HZ       LYS  34  -7.250  13.329  12.128
  276    HZ2  LYS  34          2HZ       LYS  34  -7.831  12.414  13.423
  277    HZ3  LYS  34          3HZ       LYS  34  -8.415  13.978  13.169
  278    H    TRP  35           H        TRP  35  -5.726   7.895   8.410
  279    HA   TRP  35           HA       TRP  35  -4.875   5.878   7.846
  280    HB2  TRP  35          1HB       TRP  35  -3.619   6.301  10.553
  281    HB3  TRP  35          2HB       TRP  35  -3.115   5.030   9.431
  282    HD1  TRP  35           HD1      TRP  35  -3.067   8.836   9.867
  283    HE1  TRP  35           HE1      TRP  35  -1.302   9.831   8.274
  284    HE3  TRP  35           HE3      TRP  35  -1.889   4.616   7.231
  285    HZ2  TRP  35           HZ2      TRP  35   0.358   8.939   6.184
  286    HZ3  TRP  35           HZ3      TRP  35  -0.206   4.775   5.451
  287    HH2  TRP  35           HH2      TRP  35   0.899   6.883   4.935
  288    H    GLU  36           H        GLU  36  -7.428   5.520   8.662
  289    HA   GLU  36           HA       GLU  36  -7.294   2.950  10.083
  290    HB2  GLU  36          1HB       GLU  36  -9.529   4.979  10.023
  291    HB3  GLU  36          2HB       GLU  36  -9.685   3.361  10.693
  292    HG2  GLU  36          1HG       GLU  36  -8.021   3.858  12.364
  293    HG3  GLU  36          2HG       GLU  36  -7.743   5.438  11.644
  294    H    PHE  37           H        PHE  37  -7.398   1.393   8.638
  295    HA   PHE  37           HA       PHE  37  -9.144   1.767   6.291
  296    HB2  PHE  37          1HB       PHE  37  -6.728  -0.054   6.510
  297    HB3  PHE  37          2HB       PHE  37  -7.653   0.293   5.052
  298    HD1  PHE  37           HD1      PHE  37  -5.330   1.717   7.539
  299    HD2  PHE  37           HD2      PHE  37  -7.208   2.236   3.751
  300    HE1  PHE  37           HE1      PHE  37  -3.824   3.596   7.052
  301    HE2  PHE  37           HE2      PHE  37  -5.704   4.121   3.265
  302    HZ   PHE  37           HZ       PHE  37  -4.007   4.801   4.915
  303    HA   PRO  38           HA       PRO  38 -11.316  -1.570   8.442
  304    HB2  PRO  38          1HB       PRO  38 -13.581  -1.383   6.965
  305    HB3  PRO  38          2HB       PRO  38 -13.221  -0.292   8.316
  306    HG2  PRO  38          1HG       PRO  38 -12.874   0.142   5.375
  307    HG3  PRO  38          2HG       PRO  38 -13.531   1.251   6.595
  308    HD2  PRO  38          1HD       PRO  38 -10.971   1.450   5.691
  309    HD3  PRO  38          2HD       PRO  38 -11.415   1.860   7.368
  310    H    GLU  39           H        GLU  39 -11.774  -3.656   7.906
  311    HA   GLU  39           HA       GLU  39 -10.563  -4.625   5.489
  312    HB2  GLU  39          1HB       GLU  39 -10.338  -5.729   7.720
  313    HB3  GLU  39          2HB       GLU  39 -12.035  -6.172   7.624
  314    HG2  GLU  39          1HG       GLU  39 -11.628  -7.590   5.751
  315    HG3  GLU  39          2HG       GLU  39  -9.970  -7.007   5.607
  316    H    ASP  40           H        ASP  40 -11.901  -3.720   3.932
  317    HA   ASP  40           HA       ASP  40 -14.377  -5.151   3.407
  318    HB2  ASP  40          1HB       ASP  40 -15.784  -3.503   3.989
  319    HB3  ASP  40          2HB       ASP  40 -14.428  -2.584   4.625
  320    H    ASP  41           H        ASP  41 -15.087  -4.917   1.234
  321    HA   ASP  41           HA       ASP  41 -12.868  -5.049  -0.525
  322    HB2  ASP  41          1HB       ASP  41 -14.472  -5.553  -2.281
  323    HB3  ASP  41          2HB       ASP  41 -14.865  -6.462  -0.828
  324    H    THR  42           H        THR  42 -15.097  -2.497   0.249
  325    HA   THR  42           HA       THR  42 -14.697  -0.848  -2.006
  326    HB   THR  42           HB       THR  42 -15.167   0.078   0.827
  327    HG1  THR  42           HG1      THR  42 -16.818  -1.280   0.574
  328   HG21  THR  42          1HG2      THR  42 -15.865   1.238  -1.864
  329   HG22  THR  42          2HG2      THR  42 -14.696   1.874  -0.705
  330   HG23  THR  42          3HG2      THR  42 -16.416   1.885  -0.319
  331    H    THR  43           H        THR  43 -13.233  -0.686   1.231
  332    HA   THR  43           HA       THR  43 -11.244   1.179   0.724
  333    HB   THR  43           HB       THR  43 -11.080  -1.183   2.603
  334    HG1  THR  43           HG1      THR  43 -12.967   0.029   3.021
  335   HG21  THR  43          1HG2      THR  43  -9.599   0.293   3.922
  336   HG22  THR  43          2HG2      THR  43  -9.693   1.502   2.640
  337   HG23  THR  43          3HG2      THR  43  -8.937  -0.058   2.325
  338    H    MET  44           H        MET  44 -11.333  -2.256   0.036
  339    HA   MET  44           HA       MET  44  -8.559  -2.632  -0.300
  340    HB2  MET  44          1HB       MET  44 -10.860  -4.211  -1.443
  341    HB3  MET  44          2HB       MET  44  -9.183  -4.737  -1.437
  342    HG2  MET  44          1HG       MET  44  -9.181  -4.717   0.999
  343    HG3  MET  44          2HG       MET  44 -10.848  -4.161   0.999
  344    HE1  MET  44          1HE       MET  44  -9.877  -6.661   2.662
  345    HE2  MET  44          2HE       MET  44 -11.208  -7.776   2.346
  346    HE3  MET  44          3HE       MET  44 -11.536  -6.063   2.616
  347    H    CYS  45           H        CYS  45 -11.145  -2.129  -2.718
  348    HA   CYS  45           HA       CYS  45  -9.355  -2.095  -4.916
  349    HB2  CYS  45          1HB       CYS  45 -12.154  -0.980  -4.648
  350    HB3  CYS  45          2HB       CYS  45 -11.246  -0.979  -6.153
  351    H    TYR  46           H        TYR  46 -10.445   0.339  -2.675
  352    HA   TYR  46           HA       TYR  46  -9.542   2.632  -3.979
  353    HB2  TYR  46          1HB       TYR  46 -10.855   2.999  -2.081
  354    HB3  TYR  46          2HB       TYR  46  -9.923   1.871  -1.100
  355    HD1  TYR  46           HD1      TYR  46  -9.463   5.114  -2.929
  356    HD2  TYR  46           HD2      TYR  46  -8.497   2.742   0.474
  357    HE1  TYR  46           HE1      TYR  46  -8.191   6.993  -1.980
  358    HE2  TYR  46           HE2      TYR  46  -7.224   4.614   1.426
  359    HH   TYR  46           HH       TYR  46  -6.209   6.633   0.870
  360    H    ILE  47           H        ILE  47  -7.881   0.504  -1.675
  361    HA   ILE  47           HA       ILE  47  -5.412   1.804  -1.698
  362    HB   ILE  47           HB       ILE  47  -6.088  -1.081  -1.168
  363   HG12  ILE  47          1HG1      ILE  47  -7.067   0.485   0.425
  364   HG13  ILE  47          2HG1      ILE  47  -5.776  -0.423   1.204
  365   HG21  ILE  47          1HG2      ILE  47  -3.778  -1.014  -1.831
  366   HG22  ILE  47          2HG2      ILE  47  -3.860  -1.231  -0.081
  367   HG23  ILE  47          3HG2      ILE  47  -3.467   0.350  -0.757
  368   HD11  ILE  47          1HD1      ILE  47  -5.608   1.830   1.913
  369   HD12  ILE  47          2HD1      ILE  47  -5.712   2.428   0.259
  370   HD13  ILE  47          3HD1      ILE  47  -4.278   1.545   0.789
  371    H    LYS  48           H        LYS  48  -6.726  -0.706  -3.808
  372    HA   LYS  48           HA       LYS  48  -4.336  -1.339  -5.133
  373    HB2  LYS  48          1HB       LYS  48  -6.493  -2.648  -5.229
  374    HB3  LYS  48          2HB       LYS  48  -7.094  -1.441  -6.357
  375    HG2  LYS  48          1HG       LYS  48  -5.252  -1.968  -7.891
  376    HG3  LYS  48          2HG       LYS  48  -4.676  -3.192  -6.760
  377    HD2  LYS  48          1HD       LYS  48  -5.903  -4.395  -8.343
  378    HD3  LYS  48          2HD       LYS  48  -7.004  -4.228  -6.977
  379    HE2  LYS  48          1HE       LYS  48  -8.250  -3.787  -8.954
  380    HE3  LYS  48          2HE       LYS  48  -7.997  -2.244  -8.139
  381    HZ1  LYS  48          1HZ       LYS  48  -6.254  -1.711  -9.672
  382    HZ2  LYS  48          2HZ       LYS  48  -7.619  -2.158 -10.561
  383    HZ3  LYS  48          3HZ       LYS  48  -6.329  -3.245 -10.387
  384    H    CYS  49           H        CYS  49  -6.961   0.905  -6.003
  385    HA   CYS  49           HA       CYS  49  -5.865   1.877  -8.361
  386    HB2  CYS  49          1HB       CYS  49  -8.118   2.385  -7.868
  387    HB3  CYS  49          2HB       CYS  49  -7.704   3.193  -6.358
  388    H    VAL  50           H        VAL  50  -5.505   3.139  -5.044
  389    HA   VAL  50           HA       VAL  50  -3.983   5.381  -5.689
  390    HB   VAL  50           HB       VAL  50  -4.096   3.768  -3.143
  391   HG11  VAL  50          1HG1      VAL  50  -2.885   6.484  -3.641
  392   HG12  VAL  50          2HG1      VAL  50  -2.025   5.017  -3.165
  393   HG13  VAL  50          3HG1      VAL  50  -3.165   5.775  -2.051
  394   HG21  VAL  50          1HG2      VAL  50  -5.505   5.681  -2.402
  395   HG22  VAL  50          2HG2      VAL  50  -6.209   4.710  -3.695
  396   HG23  VAL  50          3HG2      VAL  50  -5.475   6.268  -4.065
  397    H    PHE  51           H        PHE  51  -3.007   2.144  -4.669
  398    HA   PHE  51           HA       PHE  51  -0.244   2.608  -4.645
  399    HB2  PHE  51          1HB       PHE  51  -2.022   0.227  -4.613
  400    HB3  PHE  51          2HB       PHE  51  -0.330  -0.040  -5.025
  401    HD1  PHE  51           HD1      PHE  51   0.175  -1.335  -3.087
  402    HD2  PHE  51           HD2      PHE  51  -1.466   2.574  -2.693
  403    HE1  PHE  51           HE1      PHE  51   0.716  -1.350  -0.688
  404    HE2  PHE  51           HE2      PHE  51  -0.925   2.564  -0.296
  405    HZ   PHE  51           HZ       PHE  51   0.169   0.600   0.710
  406    H    ASN  52           H        ASN  52  -2.475   1.985  -7.184
  407    HA   ASN  52           HA       ASN  52  -0.516   1.097  -9.097
  408    HB2  ASN  52          1HB       ASN  52  -2.793   0.296  -9.301
  409    HB3  ASN  52          2HB       ASN  52  -3.401   1.952  -9.429
  410   HD21  ASN  52          1HD2      ASN  52  -1.460  -0.501 -11.003
  411   HD22  ASN  52          2HD2      ASN  52  -1.642   0.118 -12.605
  412    H    LYS  53           H        LYS  53  -2.264   4.103  -8.427
  413    HA   LYS  53           HA       LYS  53  -1.146   5.489 -10.663
  414    HB2  LYS  53          1HB       LYS  53  -2.778   6.264  -8.287
  415    HB3  LYS  53          2HB       LYS  53  -1.968   7.527  -9.199
  416    HG2  LYS  53          1HG       LYS  53  -4.266   7.255  -9.938
  417    HG3  LYS  53          2HG       LYS  53  -3.152   6.807 -11.231
  418    HD2  LYS  53          1HD       LYS  53  -3.444   4.435 -10.593
  419    HD3  LYS  53          2HD       LYS  53  -4.629   4.935  -9.387
  420    HE2  LYS  53          1HE       LYS  53  -4.838   5.377 -12.363
  421    HE3  LYS  53          2HE       LYS  53  -5.708   4.153 -11.442
  422    HZ1  LYS  53          1HZ       LYS  53  -5.968   7.089 -11.087
  423    HZ2  LYS  53          2HZ       LYS  53  -6.813   5.914 -10.212
  424    HZ3  LYS  53          3HZ       LYS  53  -7.083   6.088 -11.872
  425    H    MET  54           H        MET  54  -0.067   4.737  -7.518
  426    HA   MET  54           HA       MET  54   2.021   6.753  -7.529
  427    HB2  MET  54          1HB       MET  54   1.317   4.516  -5.633
  428    HB3  MET  54          2HB       MET  54   2.738   5.538  -5.423
  429    HG2  MET  54          1HG       MET  54   1.434   7.445  -5.065
  430    HG3  MET  54          2HG       MET  54  -0.024   6.668  -5.672
  431    HE1  MET  54          1HE       MET  54   2.341   7.314  -2.787
  432    HE2  MET  54          2HE       MET  54   2.730   5.597  -2.895
  433    HE3  MET  54          3HE       MET  54   1.832   6.216  -1.509
  434    H    GLN  55           H        GLN  55   1.519   4.010  -9.155
  435    HA   GLN  55           HA       GLN  55   2.704   2.425 -10.187
  436    HB2  GLN  55          1HB       GLN  55   4.591   4.703 -10.012
  437    HB3  GLN  55          2HB       GLN  55   5.217   3.155 -10.590
  438    HG2  GLN  55          1HG       GLN  55   3.544   3.128 -12.344
  439    HG3  GLN  55          2HG       GLN  55   2.852   4.623 -11.728
  440   HE21  GLN  55          1HE2      GLN  55   3.182   5.690 -13.660
  441   HE22  GLN  55          2HE2      GLN  55   4.750   6.198 -14.182
  442    H    LEU  56           H        LEU  56   2.328   1.715  -7.700
  443    HA   LEU  56           HA       LEU  56   4.908   0.733  -6.745
  444    HB2  LEU  56          1HB       LEU  56   2.747   2.161  -5.374
  445    HB3  LEU  56          2HB       LEU  56   3.328   0.743  -4.491
  446    HG   LEU  56           HG       LEU  56   5.015   3.055  -5.460
  447   HD11  LEU  56          1HD1      LEU  56   3.500   3.710  -3.658
  448   HD12  LEU  56          2HD1      LEU  56   5.172   3.669  -3.104
  449   HD13  LEU  56          3HD1      LEU  56   4.071   2.361  -2.684
  450   HD21  LEU  56          1HD2      LEU  56   6.726   2.056  -3.971
  451   HD22  LEU  56          2HD2      LEU  56   6.329   1.046  -5.362
  452   HD23  LEU  56          3HD2      LEU  56   5.675   0.653  -3.773
  453    H    PHE  57           H        PHE  57   1.773  -0.037  -7.792
  454    HA   PHE  57           HA       PHE  57   2.214  -2.857  -7.160
  455    HB2  PHE  57          1HB       PHE  57   0.722  -2.119  -5.381
  456    HB3  PHE  57          2HB       PHE  57  -0.347  -1.347  -6.543
  457    HD1  PHE  57           HD1      PHE  57  -1.992  -2.597  -7.727
  458    HD2  PHE  57           HD2      PHE  57   0.833  -4.583  -5.234
  459    HE1  PHE  57           HE1      PHE  57  -3.322  -4.659  -7.870
  460    HE2  PHE  57           HE2      PHE  57  -0.495  -6.647  -5.376
  461    HZ   PHE  57           HZ       PHE  57  -2.573  -6.685  -6.693
  462    H    ASP  58           H        ASP  58   1.475  -4.237  -8.700
  463    HA   ASP  58           HA       ASP  58   0.066  -3.086 -11.014
  464    HB2  ASP  58          1HB       ASP  58   2.367  -3.437 -11.684
  465    HB3  ASP  58          2HB       ASP  58   2.364  -5.063 -11.008
  466    H    ASP  59           H        ASP  59  -1.412  -4.478 -12.058
  467    HA   ASP  59           HA       ASP  59  -2.746  -6.224 -10.221
  468    HB2  ASP  59          1HB       ASP  59  -3.342  -5.585 -13.111
  469    HB3  ASP  59          2HB       ASP  59  -4.391  -6.502 -12.051
  470    H    THR  60           H        THR  60  -0.323  -6.695 -12.542
  471    HA   THR  60           HA       THR  60  -0.946  -9.540 -12.787
  472    HB   THR  60           HB       THR  60   0.972  -7.748 -14.256
  473    HG1  THR  60           HG1      THR  60  -0.897  -7.650 -15.299
  474   HG21  THR  60          1HG2      THR  60   1.721  -9.677 -15.532
  475   HG22  THR  60          2HG2      THR  60   0.724 -10.744 -14.544
  476   HG23  THR  60          3HG2      THR  60   2.092  -9.897 -13.822
  477    H    GLU  61           H        GLU  61   2.021  -7.596 -12.215
  478    HA   GLU  61           HA       GLU  61   3.374  -9.845 -11.050
  479    HB2  GLU  61          1HB       GLU  61   4.313  -6.999 -10.862
  480    HB3  GLU  61          2HB       GLU  61   5.260  -8.477 -10.915
  481    HG2  GLU  61          1HG       GLU  61   4.470  -8.818 -13.246
  482    HG3  GLU  61          2HG       GLU  61   3.741  -7.216 -13.170
  483    H    GLY  62           H        GLY  62   1.257  -7.509  -9.787
  484    HA2  GLY  62          1HA       GLY  62   0.530  -7.238  -7.604
  485    HA3  GLY  62          2HA       GLY  62   1.752  -8.402  -7.093
  486    HA   PRO  63           HA       PRO  63   3.276  -4.491  -5.374
  487    HB2  PRO  63          1HB       PRO  63   5.000  -5.663  -3.600
  488    HB3  PRO  63          2HB       PRO  63   3.275  -5.428  -3.286
  489    HG2  PRO  63          1HG       PRO  63   4.730  -7.868  -4.190
  490    HG3  PRO  63          2HG       PRO  63   3.417  -7.723  -3.015
  491    HD2  PRO  63          1HD       PRO  63   3.051  -8.572  -5.557
  492    HD3  PRO  63          2HD       PRO  63   1.797  -7.681  -4.656
  493    H    LEU  64           H        LEU  64   4.740  -3.351  -6.403
  494    HA   LEU  64           HA       LEU  64   6.892  -4.635  -7.859
  495    HB2  LEU  64          1HB       LEU  64   6.361  -1.675  -7.586
  496    HB3  LEU  64          2HB       LEU  64   7.329  -2.477  -8.805
  497    HG   LEU  64           HG       LEU  64   4.341  -2.780  -8.532
  498   HD11  LEU  64          1HD1      LEU  64   4.220  -1.444 -10.563
  499   HD12  LEU  64          2HD1      LEU  64   5.968  -1.226 -10.539
  500   HD13  LEU  64          3HD1      LEU  64   4.974  -0.532  -9.258
  501   HD21  LEU  64          1HD2      LEU  64   5.516  -4.741  -9.455
  502   HD22  LEU  64          2HD2      LEU  64   6.212  -3.706 -10.703
  503   HD23  LEU  64          3HD2      LEU  64   4.464  -3.953 -10.633
  504    H    VAL  65           H        VAL  65   8.251  -5.417  -6.389
  505    HA   VAL  65           HA       VAL  65   9.009  -4.452  -3.955
  506    HB   VAL  65           HB       VAL  65  10.641  -6.065  -5.899
  507   HG11  VAL  65          1HG1      VAL  65  11.080  -5.640  -2.946
  508   HG12  VAL  65          2HG1      VAL  65  12.115  -5.056  -4.252
  509   HG13  VAL  65          3HG1      VAL  65  11.953  -6.789  -3.961
  510   HG21  VAL  65          1HG2      VAL  65   8.581  -7.145  -5.321
  511   HG22  VAL  65          2HG2      VAL  65   8.844  -6.823  -3.609
  512   HG23  VAL  65          3HG2      VAL  65   9.897  -7.950  -4.466
  513    H    ASP  66           H        ASP  66  10.586  -3.772  -7.074
  514    HA   ASP  66           HA       ASP  66  12.831  -2.457  -6.075
  515    HB2  ASP  66          1HB       ASP  66  12.652  -3.174  -8.383
  516    HB3  ASP  66          2HB       ASP  66  11.373  -2.004  -8.679
  517    H    ASN  67           H        ASN  67   9.841  -0.959  -7.331
  518    HA   ASN  67           HA       ASN  67  10.515   1.659  -6.563
  519    HB2  ASN  67          1HB       ASN  67   7.865   0.356  -7.140
  520    HB3  ASN  67          2HB       ASN  67   8.005   2.053  -6.709
  521   HD21  ASN  67          1HD2      ASN  67   7.231   2.774  -8.645
  522   HD22  ASN  67          2HD2      ASN  67   8.127   2.659 -10.121
  523    H    LEU  68           H        LEU  68   9.023  -0.991  -4.881
  524    HA   LEU  68           HA       LEU  68   7.858   0.408  -2.765
  525    HB2  LEU  68          1HB       LEU  68   8.737  -2.412  -3.169
  526    HB3  LEU  68          2HB       LEU  68   8.289  -1.884  -1.555
  527    HG   LEU  68           HG       LEU  68   6.472  -1.505  -3.923
  528   HD11  LEU  68          1HD1      LEU  68   6.985  -3.895  -3.674
  529   HD12  LEU  68          2HD1      LEU  68   5.312  -3.528  -3.257
  530   HD13  LEU  68          3HD1      LEU  68   6.498  -3.811  -1.982
  531   HD21  LEU  68          1HD2      LEU  68   6.017  -0.141  -1.954
  532   HD22  LEU  68          2HD2      LEU  68   5.984  -1.591  -0.952
  533   HD23  LEU  68          3HD2      LEU  68   4.758  -1.352  -2.196
  534    H    VAL  69           H        VAL  69  11.095  -1.107  -2.939
  535    HA   VAL  69           HA       VAL  69  11.762  -0.117  -0.310
  536    HB   VAL  69           HB       VAL  69  13.534  -1.457  -0.344
  537   HG11  VAL  69          1HG1      VAL  69  11.848  -2.864  -1.394
  538   HG12  VAL  69          2HG1      VAL  69  13.493  -3.318  -1.828
  539   HG13  VAL  69          3HG1      VAL  69  12.496  -2.434  -2.978
  540   HG21  VAL  69          1HG2      VAL  69  14.843   0.132  -1.689
  541   HG22  VAL  69          2HG2      VAL  69  14.244  -0.643  -3.157
  542   HG23  VAL  69          3HG2      VAL  69  15.257  -1.547  -2.031
  543    H    HIS  70           H        HIS  70  12.176   1.014  -3.594
  544    HA   HIS  70           HA       HIS  70  14.048   3.061  -3.002
  545    HB2  HIS  70          1HB       HIS  70  12.019   2.758  -5.211
  546    HB3  HIS  70          2HB       HIS  70  13.098   4.143  -5.108
  547    HD1  HIS  70           HD1      HIS  70  13.767   3.044  -7.546
  548    HD2  HIS  70           HD2      HIS  70  15.039   1.051  -4.128
  549    HE1  HIS  70           HE1      HIS  70  15.640   1.547  -8.295
  550    HE2  HIS  70           HE2      HIS  70  16.287   0.239  -6.244
  551    H    GLN  71           H        GLN  71  10.618   2.796  -2.621
  552    HA   GLN  71           HA       GLN  71  10.266   5.636  -2.095
  553    HB2  GLN  71          1HB       GLN  71   8.564   4.233  -3.322
  554    HB3  GLN  71          2HB       GLN  71   8.261   3.397  -1.805
  555    HG2  GLN  71          1HG       GLN  71   6.590   5.122  -2.250
  556    HG3  GLN  71          2HG       GLN  71   7.494   5.422  -0.769
  557   HE21  GLN  71          1HE2      GLN  71   8.842   7.175  -0.638
  558   HE22  GLN  71          2HE2      GLN  71   8.841   8.448  -1.802
  559    H    LEU  72           H        LEU  72   9.607   2.622  -0.344
  560    HA   LEU  72           HA       LEU  72   8.955   3.827   2.072
  561    HB2  LEU  72          1HB       LEU  72   9.892   1.040   1.465
  562    HB3  LEU  72          2HB       LEU  72   9.387   1.547   3.063
  563    HG   LEU  72           HG       LEU  72   7.635   1.664   0.610
  564   HD11  LEU  72          1HD1      LEU  72   7.705  -0.347   2.863
  565   HD12  LEU  72          2HD1      LEU  72   8.167  -0.647   1.186
  566   HD13  LEU  72          3HD1      LEU  72   6.488  -0.276   1.587
  567   HD21  LEU  72          1HD2      LEU  72   7.086   2.106   3.542
  568   HD22  LEU  72          2HD2      LEU  72   5.833   1.905   2.317
  569   HD23  LEU  72          3HD2      LEU  72   6.934   3.279   2.231
  570    H    ALA  73           H        ALA  73  12.087   2.548   0.977
  571    HA   ALA  73           HA       ALA  73  13.354   2.825   3.503
  572    HB1  ALA  73          1HB       ALA  73  15.372   2.240   2.381
  573    HB2  ALA  73          2HB       ALA  73  14.669   2.641   0.814
  574    HB3  ALA  73          3HB       ALA  73  14.056   1.261   1.726
  575    H    HIS  74           H        HIS  74  12.074   5.266   2.667
  576    HA   HIS  74           HA       HIS  74  14.044   7.188   1.898
  577    HB2  HIS  74          1HB       HIS  74  11.573   7.495   1.572
  578    HB3  HIS  74          2HB       HIS  74  11.400   7.640   3.318
  579    HD1  HIS  74           HD1      HIS  74  11.523   9.945   4.222
  580    HD2  HIS  74           HD2      HIS  74  13.260   9.658   0.454
  581    HE1  HIS  74           HE1      HIS  74  12.112  12.298   3.565
  582    HE2  HIS  74           HE2      HIS  74  13.246  12.089   1.327
  583    H    GLY  75           H        GLY  75  15.782   6.837   3.319
  584    HA2  GLY  75          1HA       GLY  75  16.903   7.907   5.135
  585    HA3  GLY  75          2HA       GLY  75  15.367   8.004   5.985
  586    H    ARG  76           H        ARG  76  16.013   5.012   4.456
  587    HA   ARG  76           HA       ARG  76  17.227   3.870   6.844
  588    HB2  ARG  76          1HB       ARG  76  14.484   3.251   5.866
  589    HB3  ARG  76          2HB       ARG  76  15.439   1.936   6.550
  590    HG2  ARG  76          1HG       ARG  76  15.768   3.497   8.549
  591    HG3  ARG  76          2HG       ARG  76  14.442   4.439   7.867
  592    HD2  ARG  76          1HD       ARG  76  13.128   2.270   7.831
  593    HD3  ARG  76          2HD       ARG  76  14.407   1.596   8.831
  594    HE   ARG  76           HE       ARG  76  13.446   4.013   9.954
  595   HH11  ARG  76          1HH1      ARG  76  12.581   0.648   9.513
  596   HH12  ARG  76          2HH1      ARG  76  11.598   0.581  10.939
  597   HH21  ARG  76          1HH2      ARG  76  12.127   3.946  11.815
  598   HH22  ARG  76          2HH2      ARG  76  11.325   2.468  12.245
  599    H    ASP  77           H        ASP  77  17.907   1.580   6.464
  600    HA   ASP  77           HA       ASP  77  19.322   1.376   4.037
  601    HB2  ASP  77          1HB       ASP  77  20.132   0.354   6.100
  602    HB3  ASP  77          2HB       ASP  77  18.763  -0.755   6.102
  603    H    ALA  78           H        ALA  78  18.648   0.820   2.154
  604    HA   ALA  78           HA       ALA  78  16.001   0.087   1.595
  605    HB1  ALA  78          1HB       ALA  78  17.429   1.341   0.065
  606    HB2  ALA  78          2HB       ALA  78  16.730  -0.079  -0.708
  607    HB3  ALA  78          3HB       ALA  78  18.416  -0.098  -0.189
  608    H    GLU  79           H        GLU  79  18.910  -1.839   1.958
  609    HA   GLU  79           HA       GLU  79  17.946  -4.185   0.709
  610    HB2  GLU  79          1HB       GLU  79  20.087  -3.808   2.799
  611    HB3  GLU  79          2HB       GLU  79  19.756  -5.339   1.999
  612    HG2  GLU  79          1HG       GLU  79  20.163  -4.135  -0.181
  613    HG3  GLU  79          2HG       GLU  79  20.789  -2.799   0.782
  614    H    GLU  80           H        GLU  80  18.010  -3.165   4.115
  615    HA   GLU  80           HA       GLU  80  16.682  -5.447   5.114
  616    HB2  GLU  80          1HB       GLU  80  17.882  -3.979   6.599
  617    HB3  GLU  80          2HB       GLU  80  16.835  -2.630   6.181
  618    HG2  GLU  80          1HG       GLU  80  15.018  -3.546   7.329
  619    HG3  GLU  80          2HG       GLU  80  15.764  -5.134   7.417
  620    H    VAL  81           H        VAL  81  15.499  -2.278   4.048
  621    HA   VAL  81           HA       VAL  81  12.786  -2.620   4.533
  622    HB   VAL  81           HB       VAL  81  14.148  -1.085   2.326
  623   HG11  VAL  81          1HG1      VAL  81  11.293  -0.928   3.283
  624   HG12  VAL  81          2HG1      VAL  81  11.833  -1.491   1.701
  625   HG13  VAL  81          3HG1      VAL  81  12.057   0.200   2.161
  626   HG21  VAL  81          1HG2      VAL  81  13.130  -0.337   5.047
  627   HG22  VAL  81          2HG2      VAL  81  13.657   0.824   3.827
  628   HG23  VAL  81          3HG2      VAL  81  14.802  -0.342   4.486
  629    H    ARG  82           H        ARG  82  14.636  -3.439   1.586
  630    HA   ARG  82           HA       ARG  82  12.627  -4.530   0.030
  631    HB2  ARG  82          1HB       ARG  82  15.004  -4.180  -0.647
  632    HB3  ARG  82          2HB       ARG  82  15.438  -5.602   0.283
  633    HG2  ARG  82          1HG       ARG  82  14.020  -6.979  -1.120
  634    HG3  ARG  82          2HG       ARG  82  13.552  -5.560  -2.051
  635    HD2  ARG  82          1HD       ARG  82  15.935  -5.220  -2.626
  636    HD3  ARG  82          2HD       ARG  82  16.312  -6.732  -1.806
  637    HE   ARG  82           HE       ARG  82  14.695  -7.747  -3.493
  638   HH11  ARG  82          1HH1      ARG  82  16.665  -4.927  -4.174
  639   HH12  ARG  82          2HH1      ARG  82  16.758  -5.249  -5.874
  640   HH21  ARG  82          1HH2      ARG  82  14.817  -8.174  -5.729
  641   HH22  ARG  82          2HH2      ARG  82  15.713  -7.102  -6.761
  642    H    THR  83           H        THR  83  14.539  -6.027   2.580
  643    HA   THR  83           HA       THR  83  13.603  -8.652   2.337
  644    HB   THR  83           HB       THR  83  14.737  -7.082   4.644
  645    HG1  THR  83           HG1      THR  83  16.236  -7.580   3.079
  646   HG21  THR  83          1HG2      THR  83  13.295  -8.794   5.614
  647   HG22  THR  83          2HG2      THR  83  14.994  -9.191   5.872
  648   HG23  THR  83          3HG2      THR  83  14.073 -10.028   4.622
  649    H    GLU  84           H        GLU  84  12.568  -6.073   4.579
  650    HA   GLU  84           HA       GLU  84  10.502  -7.458   5.822
  651    HB2  GLU  84          1HB       GLU  84  10.605  -4.480   5.335
  652    HB3  GLU  84          2HB       GLU  84   9.733  -5.318   6.611
  653    HG2  GLU  84          1HG       GLU  84  11.961  -6.161   7.412
  654    HG3  GLU  84          2HG       GLU  84  12.699  -5.021   6.290
  655    H    VAL  85           H        VAL  85  10.413  -5.415   2.913
  656    HA   VAL  85           HA       VAL  85   7.664  -5.515   2.417
  657    HB   VAL  85           HB       VAL  85  10.034  -5.271   0.569
  658   HG11  VAL  85          1HG1      VAL  85   7.114  -5.121  -0.173
  659   HG12  VAL  85          2HG1      VAL  85   8.267  -6.347  -0.704
  660   HG13  VAL  85          3HG1      VAL  85   8.460  -4.669  -1.223
  661   HG21  VAL  85          1HG2      VAL  85   9.579  -3.392   2.044
  662   HG22  VAL  85          2HG2      VAL  85   7.914  -3.322   1.458
  663   HG23  VAL  85          3HG2      VAL  85   9.252  -2.964   0.363
  664    H    LEU  86           H        LEU  86  10.260  -7.682   1.303
  665    HA   LEU  86           HA       LEU  86   8.706  -9.375  -0.266
  666    HB2  LEU  86          1HB       LEU  86  11.260  -9.867   1.254
  667    HB3  LEU  86          2HB       LEU  86  10.547 -11.047   0.156
  668    HG   LEU  86           HG       LEU  86  11.288  -8.266  -0.714
  669   HD11  LEU  86          1HD1      LEU  86  13.342  -9.226  -1.608
  670   HD12  LEU  86          2HD1      LEU  86  12.944 -10.776  -0.869
  671   HD13  LEU  86          3HD1      LEU  86  13.280  -9.375   0.148
  672   HD21  LEU  86          1HD2      LEU  86  11.288  -9.333  -2.936
  673   HD22  LEU  86          2HD2      LEU  86   9.713  -9.399  -2.146
  674   HD23  LEU  86          3HD2      LEU  86  10.738 -10.834  -2.187
  675    H    LYS  87           H        LYS  87   9.163  -9.271   3.193
  676    HA   LYS  87           HA       LYS  87   8.093 -11.869   3.736
  677    HB2  LYS  87          1HB       LYS  87   8.474  -9.438   5.482
  678    HB3  LYS  87          2HB       LYS  87   7.860 -10.973   6.081
  679    HG2  LYS  87          1HG       LYS  87   9.938 -12.070   5.401
  680    HG3  LYS  87          2HG       LYS  87  10.560 -10.515   4.824
  681    HD2  LYS  87          1HD       LYS  87  10.384  -9.616   7.097
  682    HD3  LYS  87          2HD       LYS  87   9.777 -11.175   7.663
  683    HE2  LYS  87          1HE       LYS  87  11.891 -12.216   6.883
  684    HE3  LYS  87          2HE       LYS  87  12.492 -10.609   6.481
  685    HZ1  LYS  87          1HZ       LYS  87  11.744 -11.590   9.180
  686    HZ2  LYS  87          2HZ       LYS  87  12.202 -10.001   8.835
  687    HZ3  LYS  87          3HZ       LYS  87  13.307 -11.263   8.624
  688    H    CYS  88           H        CYS  88   6.707  -9.084   2.608
  689    HA   CYS  88           HA       CYS  88   4.062  -9.904   3.585
  690    HB2  CYS  88          1HB       CYS  88   5.228  -7.205   3.055
  691    HB3  CYS  88          2HB       CYS  88   3.478  -7.447   2.871
  692    H    VAL  89           H        VAL  89   6.072  -9.815   0.906
  693    HA   VAL  89           HA       VAL  89   4.014  -9.470  -1.081
  694    HB   VAL  89           HB       VAL  89   6.832 -10.514  -1.369
  695   HG11  VAL  89          1HG1      VAL  89   6.459 -10.029  -3.789
  696   HG12  VAL  89          2HG1      VAL  89   4.752  -9.773  -3.415
  697   HG13  VAL  89          3HG1      VAL  89   5.484 -11.355  -3.157
  698   HG21  VAL  89          1HG2      VAL  89   6.786  -8.187  -0.661
  699   HG22  VAL  89          2HG2      VAL  89   5.670  -7.794  -1.969
  700   HG23  VAL  89          3HG2      VAL  89   7.316  -8.312  -2.337
  701    H    ASP  90           H        ASP  90   2.712 -10.982  -1.795
  702    HA   ASP  90           HA       ASP  90   3.426 -13.794  -1.508
  703    HB2  ASP  90          1HB       ASP  90   1.127 -14.308  -0.665
  704    HB3  ASP  90          2HB       ASP  90   2.083 -13.350   0.466
  705    H    LYS  91           H        LYS  91   1.341 -15.063  -2.472
  706    HA   LYS  91           HA       LYS  91   1.098 -14.024  -5.202
  707    HB2  LYS  91          1HB       LYS  91   1.728 -16.562  -4.165
  708    HB3  LYS  91          2HB       LYS  91   0.107 -16.713  -4.822
  709    HG2  LYS  91          1HG       LYS  91   0.928 -15.804  -6.957
  710    HG3  LYS  91          2HG       LYS  91   2.558 -15.770  -6.286
  711    HD2  LYS  91          1HD       LYS  91   2.475 -18.191  -5.966
  712    HD3  LYS  91          2HD       LYS  91   0.841 -18.224  -6.632
  713    HE2  LYS  91          1HE       LYS  91   1.678 -17.374  -8.758
  714    HE3  LYS  91          2HE       LYS  91   3.310 -17.297  -8.096
  715    HZ1  LYS  91          1HZ       LYS  91   2.932 -19.282  -9.453
  716    HZ2  LYS  91          2HZ       LYS  91   1.717 -19.783  -8.390
  717    HZ3  LYS  91          3HZ       LYS  91   3.314 -19.675  -7.854
  718    H    ASN  92           H        ASN  92  -0.936 -14.176  -6.285
  719    HA   ASN  92           HA       ASN  92  -3.079 -13.289  -4.568
  720    HB2  ASN  92          1HB       ASN  92  -2.465 -12.274  -6.822
  721    HB3  ASN  92          2HB       ASN  92  -3.188 -13.699  -7.551
  722   HD21  ASN  92          1HD2      ASN  92  -4.458 -12.234  -4.645
  723   HD22  ASN  92          2HD2      ASN  92  -5.891 -11.601  -5.366
  724    H    THR  93           H        THR  93  -2.973 -15.585  -3.614
  725    HA   THR  93           HA       THR  93  -4.238 -17.690  -5.077
  726    HB   THR  93           HB       THR  93  -2.681 -18.203  -3.257
  727    HG1  THR  93           HG1      THR  93  -4.236 -19.780  -3.686
  728   HG21  THR  93          1HG2      THR  93  -3.436 -17.941  -0.898
  729   HG22  THR  93          2HG2      THR  93  -4.765 -16.939  -1.483
  730   HG23  THR  93          3HG2      THR  93  -3.096 -16.418  -1.714
  731    H    ASP  94           H        ASP  94  -5.323 -15.008  -3.289
  732    HA   ASP  94           HA       ASP  94  -7.975 -15.998  -2.736
  733    HB2  ASP  94          1HB       ASP  94  -8.393 -13.575  -2.138
  734    HB3  ASP  94          2HB       ASP  94  -7.093 -14.360  -1.231
  735    H    ASN  95           H        ASN  95  -6.317 -14.541  -5.325
  736    HA   ASN  95           HA       ASN  95  -6.844 -14.200  -7.472
  737    HB2  ASN  95          1HB       ASN  95  -9.424 -15.577  -6.749
  738    HB3  ASN  95          2HB       ASN  95  -8.903 -15.209  -8.382
  739   HD21  ASN  95          1HD2      ASN  95  -6.117 -15.811  -7.902
  740   HD22  ASN  95          2HD2      ASN  95  -6.007 -17.540  -7.766
  741    H    ASN  96           H        ASN  96  -7.884 -12.280  -5.235
  742    HA   ASN  96           HA       ASN  96  -9.345 -10.644  -7.209
  743    HB2  ASN  96          1HB       ASN  96  -9.719  -9.627  -4.530
  744    HB3  ASN  96          2HB       ASN  96 -10.924 -10.088  -5.723
  745   HD21  ASN  96          1HD2      ASN  96 -11.718 -12.220  -5.723
  746   HD22  ASN  96          2HD2      ASN  96 -11.616 -13.202  -4.305
  747    H    ALA  97           H        ALA  97  -8.441  -8.805  -7.777
  748    HA   ALA  97           HA       ALA  97  -5.729  -8.369  -7.055
  749    HB1  ALA  97          1HB       ALA  97  -5.757  -6.586  -8.669
  750    HB2  ALA  97          2HB       ALA  97  -7.518  -6.582  -8.692
  751    HB3  ALA  97          3HB       ALA  97  -6.633  -7.970  -9.318
  752    H    CYS  98           H        CYS  98  -8.748  -6.671  -6.290
  753    HA   CYS  98           HA       CYS  98  -7.568  -4.443  -5.011
  754    HB2  CYS  98          1HB       CYS  98 -10.243  -5.728  -4.424
  755    HB3  CYS  98          2HB       CYS  98  -9.738  -4.126  -3.910
  756    H    HIS  99           H        HIS  99  -8.444  -7.648  -3.859
  757    HA   HIS  99           HA       HIS  99  -7.864  -7.008  -1.121
  758    HB2  HIS  99          1HB       HIS  99  -9.571  -8.656  -1.616
  759    HB3  HIS  99          2HB       HIS  99  -8.415  -9.640  -2.504
  760    HD1  HIS  99           HD1      HIS  99  -7.076 -11.293  -1.218
  761    HD2  HIS  99           HD2      HIS  99  -9.183  -8.689   1.248
  762    HE1  HIS  99           HE1      HIS  99  -6.833 -12.212   1.116
  763    HE2  HIS  99           HE2      HIS  99  -8.302 -10.745   2.542
  764    H    TRP 100           H        TRP 100  -6.143  -8.319  -3.834
  765    HA   TRP 100           HA       TRP 100  -3.987  -9.499  -2.455
  766    HB2  TRP 100          1HB       TRP 100  -4.498  -9.833  -4.885
  767    HB3  TRP 100          2HB       TRP 100  -3.900  -8.202  -5.195
  768    HD1  TRP 100           HD1      TRP 100  -1.783  -9.861  -2.649
  769    HE1  TRP 100           HE1      TRP 100   0.382 -10.750  -3.707
  770    HE3  TRP 100           HE3      TRP 100  -3.052  -9.411  -7.581
  771    HZ2  TRP 100           HZ2      TRP 100   1.421 -11.200  -6.295
  772    HZ3  TRP 100           HZ3      TRP 100  -1.417 -10.094  -9.282
  773    HH2  TRP 100           HH2      TRP 100   0.770 -10.975  -8.660
  774    H    ALA 101           H        ALA 101  -4.240  -6.308  -4.021
  775    HA   ALA 101           HA       ALA 101  -1.817  -5.253  -3.089
  776    HB1  ALA 101          1HB       ALA 101  -4.372  -3.798  -3.759
  777    HB2  ALA 101          2HB       ALA 101  -3.103  -4.240  -4.898
  778    HB3  ALA 101          3HB       ALA 101  -2.775  -3.064  -3.625
  779    H    PHE 102           H        PHE 102  -5.015  -5.374  -1.689
  780    HA   PHE 102           HA       PHE 102  -4.529  -3.608   0.447
  781    HB2  PHE 102          1HB       PHE 102  -6.767  -4.152  -0.351
  782    HB3  PHE 102          2HB       PHE 102  -6.583  -5.807   0.220
  783    HD1  PHE 102           HD1      PHE 102  -7.250  -6.358   2.391
  784    HD2  PHE 102           HD2      PHE 102  -6.566  -2.280   1.378
  785    HE1  PHE 102           HE1      PHE 102  -8.136  -5.669   4.578
  786    HE2  PHE 102           HE2      PHE 102  -7.449  -1.585   3.565
  787    HZ   PHE 102           HZ       PHE 102  -8.238  -3.278   5.169
  788    H    ARG 103           H        ARG 103  -4.019  -7.050  -0.001
  789    HA   ARG 103           HA       ARG 103  -3.642  -7.620   2.780
  790    HB2  ARG 103          1HB       ARG 103  -4.351  -9.320   1.081
  791    HB3  ARG 103          2HB       ARG 103  -2.719  -9.263   0.431
  792    HG2  ARG 103          1HG       ARG 103  -1.800 -10.054   2.498
  793    HG3  ARG 103          2HG       ARG 103  -3.379  -9.977   3.269
  794    HD2  ARG 103          1HD       ARG 103  -2.737 -12.268   2.617
  795    HD3  ARG 103          2HD       ARG 103  -4.211 -11.718   1.828
  796    HE   ARG 103           HE       ARG 103  -1.625 -11.562   0.428
  797   HH11  ARG 103          1HH1      ARG 103  -4.833 -12.941   0.719
  798   HH12  ARG 103          2HH1      ARG 103  -4.888 -13.463  -0.935
  799   HH21  ARG 103          1HH2      ARG 103  -1.675 -12.311  -1.725
  800   HH22  ARG 103          2HH2      ARG 103  -3.109 -13.121  -2.314
  801    H    GLY 104           H        GLY 104  -1.543  -6.885   0.041
  802    HA2  GLY 104          1HA       GLY 104   0.936  -7.278   1.355
  803    HA3  GLY 104          2HA       GLY 104   0.664  -6.220  -0.035
  804    H    PHE 105           H        PHE 105  -1.118  -4.420   0.981
  805    HA   PHE 105           HA       PHE 105   0.556  -2.620   2.337
  806    HB2  PHE 105          1HB       PHE 105  -1.101  -1.727   0.905
  807    HB3  PHE 105          2HB       PHE 105  -2.380  -2.624   1.705
  808    HD1  PHE 105           HD1      PHE 105  -3.867  -1.084   2.586
  809    HD2  PHE 105           HD2      PHE 105   0.318  -0.430   3.038
  810    HE1  PHE 105           HE1      PHE 105  -4.330   0.881   3.984
  811    HE2  PHE 105           HE2      PHE 105  -0.147   1.542   4.432
  812    HZ   PHE 105           HZ       PHE 105  -2.468   2.198   4.909
  813    H    LYS 106           H        LYS 106  -2.219  -4.523   3.414
  814    HA   LYS 106           HA       LYS 106  -2.338  -3.505   6.020
  815    HB2  LYS 106          1HB       LYS 106  -4.286  -4.544   5.409
  816    HB3  LYS 106          2HB       LYS 106  -3.472  -5.896   4.631
  817    HG2  LYS 106          1HG       LYS 106  -2.872  -6.723   6.904
  818    HG3  LYS 106          2HG       LYS 106  -3.864  -5.424   7.575
  819    HD2  LYS 106          1HD       LYS 106  -5.815  -6.308   6.364
  820    HD3  LYS 106          2HD       LYS 106  -4.817  -7.622   5.738
  821    HE2  LYS 106          1HE       LYS 106  -4.373  -8.323   8.080
  822    HE3  LYS 106          2HE       LYS 106  -5.501  -7.084   8.625
  823    HZ1  LYS 106          1HZ       LYS 106  -6.172  -9.370   6.856
  824    HZ2  LYS 106          2HZ       LYS 106  -7.261  -8.191   7.393
  825    HZ3  LYS 106          3HZ       LYS 106  -6.544  -9.250   8.499
  826    H    CYS 107           H        CYS 107  -0.674  -6.314   4.666
  827    HA   CYS 107           HA       CYS 107   0.239  -7.442   7.043
  828    HB2  CYS 107          1HB       CYS 107   0.370  -8.730   5.062
  829    HB3  CYS 107          2HB       CYS 107   1.309  -7.507   4.219
  830    H    PHE 108           H        PHE 108   1.664  -4.979   4.946
  831    HA   PHE 108           HA       PHE 108   4.168  -4.951   6.310
  832    HB2  PHE 108          1HB       PHE 108   3.764  -4.361   3.889
  833    HB3  PHE 108          2HB       PHE 108   3.097  -2.831   4.462
  834    HD1  PHE 108           HD1      PHE 108   6.117  -4.867   4.106
  835    HD2  PHE 108           HD2      PHE 108   4.547  -1.108   5.337
  836    HE1  PHE 108           HE1      PHE 108   8.389  -3.938   4.160
  837    HE2  PHE 108           HE2      PHE 108   6.819  -0.173   5.389
  838    HZ   PHE 108           HZ       PHE 108   8.744  -1.589   4.796
  839    H    GLN 109           H        GLN 109   1.370  -2.742   6.225
  840    HA   GLN 109           HA       GLN 109   2.496  -0.784   7.889
  841    HB2  GLN 109          1HB       GLN 109   0.279   0.131   8.087
  842    HB3  GLN 109          2HB       GLN 109   0.548  -0.389   6.433
  843    HG2  GLN 109          1HG       GLN 109  -1.480  -1.299   6.640
  844    HG3  GLN 109          2HG       GLN 109  -0.631  -2.592   7.493
  845   HE21  GLN 109          1HE2      GLN 109  -3.378  -1.687   7.769
  846   HE22  GLN 109          2HE2      GLN 109  -3.571  -1.248   9.430
  847    H    LYS 110           H        LYS 110   0.961  -3.807   8.627
  848    HA   LYS 110           HA       LYS 110   0.235  -3.208  11.307
  849    HB2  LYS 110          1HB       LYS 110  -0.712  -5.041   9.889
  850    HB3  LYS 110          2HB       LYS 110   0.801  -5.913  10.090
  851    HG2  LYS 110          1HG       LYS 110   0.420  -5.864  12.536
  852    HG3  LYS 110          2HG       LYS 110  -1.150  -5.123  12.230
  853    HD2  LYS 110          1HD       LYS 110  -1.786  -7.084  10.871
  854    HD3  LYS 110          2HD       LYS 110  -0.241  -7.837  11.272
  855    HE2  LYS 110          1HE       LYS 110  -0.825  -7.885  13.615
  856    HE3  LYS 110          2HE       LYS 110  -2.315  -6.997  13.295
  857    HZ1  LYS 110          1HZ       LYS 110  -3.077  -8.866  11.958
  858    HZ2  LYS 110          2HZ       LYS 110  -2.752  -9.342  13.546
  859    HZ3  LYS 110          3HZ       LYS 110  -1.662  -9.718  12.309
  860    H    ASN 111           H        ASN 111   3.217  -3.798   9.810
  861    HA   ASN 111           HA       ASN 111   4.446  -4.346  12.432
  862    HB2  ASN 111          1HB       ASN 111   5.358  -5.260   9.698
  863    HB3  ASN 111          2HB       ASN 111   6.324  -5.400  11.167
  864   HD21  ASN 111          1HD2      ASN 111   3.463  -6.526   9.500
  865   HD22  ASN 111          2HD2      ASN 111   3.239  -7.943  10.463
  866    H    ASN 112           H        ASN 112   4.497  -2.489   9.488
  867    HA   ASN 112           HA       ASN 112   6.525  -0.713  10.643
  868    HB2  ASN 112          1HB       ASN 112   6.645  -2.046   7.942
  869    HB3  ASN 112          2HB       ASN 112   7.540  -0.569   8.314
  870   HD21  ASN 112          1HD2      ASN 112   8.231  -3.475   7.740
  871   HD22  ASN 112          2HD2      ASN 112   9.408  -3.844   8.960
  872    H    LEU 113           H        LEU 113   4.334   0.390  10.939
  873    HA   LEU 113           HA       LEU 113   3.241   1.569   8.531
  874    HB2  LEU 113          1HB       LEU 113   1.665   0.963  10.218
  875    HB3  LEU 113          2HB       LEU 113   2.522   1.885  11.437
  876    HG   LEU 113           HG       LEU 113   1.913   3.964  10.205
  877   HD11  LEU 113          1HD1      LEU 113   0.166   2.130   8.580
  878   HD12  LEU 113          2HD1      LEU 113   1.640   2.896   7.996
  879   HD13  LEU 113          3HD1      LEU 113   0.257   3.886   8.461
  880   HD21  LEU 113          1HD2      LEU 113  -0.361   2.176  11.043
  881   HD22  LEU 113          2HD2      LEU 113  -0.456   3.928  10.870
  882   HD23  LEU 113          3HD2      LEU 113   0.591   3.215  12.099
  883    H    SER 114           H        SER 114   5.397   2.420  11.107
  884    HA   SER 114           HA       SER 114   5.296   5.239  10.840
  885    HB2  SER 114          1HB       SER 114   6.318   4.008  12.784
  886    HB3  SER 114          2HB       SER 114   7.679   3.588  11.742
  887    HG   SER 114           HG       SER 114   8.164   5.443  12.927
  888    H    LEU 115           H        LEU 115   7.171   2.738   9.220
  889    HA   LEU 115           HA       LEU 115   8.904   4.443   7.794
  890    HB2  LEU 115          1HB       LEU 115   9.212   2.002   8.097
  891    HB3  LEU 115          2HB       LEU 115   7.879   1.728   6.993
  892    HG   LEU 115           HG       LEU 115   9.179   2.903   5.220
  893   HD11  LEU 115          1HD1      LEU 115  10.624   4.264   6.516
  894   HD12  LEU 115          2HD1      LEU 115  11.638   3.105   5.653
  895   HD13  LEU 115          3HD1      LEU 115  11.277   2.867   7.364
  896   HD21  LEU 115          1HD2      LEU 115   9.145   0.484   5.313
  897   HD22  LEU 115          2HD2      LEU 115  10.466   0.485   6.479
  898   HD23  LEU 115          3HD2      LEU 115  10.745   1.047   4.832
  899    H    ILE 116           H        ILE 116   5.667   3.263   7.204
  900    HA   ILE 116           HA       ILE 116   5.472   4.010   4.492
  901    HB   ILE 116           HB       ILE 116   3.289   3.677   6.563
  902   HG12  ILE 116          1HG1      ILE 116   4.431   1.759   4.515
  903   HG13  ILE 116          2HG1      ILE 116   4.610   1.650   6.272
  904   HG21  ILE 116          1HG2      ILE 116   1.786   3.374   4.650
  905   HG22  ILE 116          2HG2      ILE 116   3.110   3.764   3.555
  906   HG23  ILE 116          3HG2      ILE 116   2.499   4.989   4.671
  907   HD11  ILE 116          1HD1      ILE 116   2.114   1.439   6.391
  908   HD12  ILE 116          2HD1      ILE 116   2.958   0.091   5.631
  909   HD13  ILE 116          3HD1      ILE 116   2.124   1.280   4.635
  910    H    LYS 117           H        LYS 117   4.648   5.635   7.511
  911    HA   LYS 117           HA       LYS 117   3.583   7.973   6.326
  912    HB2  LYS 117          1HB       LYS 117   4.698   7.405   9.064
  913    HB3  LYS 117          2HB       LYS 117   4.010   8.962   8.620
  914    HG2  LYS 117          1HG       LYS 117   1.872   7.923   8.164
  915    HG3  LYS 117          2HG       LYS 117   2.541   6.328   8.495
  916    HD2  LYS 117          1HD       LYS 117   2.959   6.967  10.809
  917    HD3  LYS 117          2HD       LYS 117   2.350   8.591  10.488
  918    HE2  LYS 117          1HE       LYS 117   0.144   7.720  10.031
  919    HE3  LYS 117          2HE       LYS 117   0.731   6.066  10.183
  920    HZ1  LYS 117          1HZ       LYS 117  -0.391   6.751  12.189
  921    HZ2  LYS 117          2HZ       LYS 117   0.630   8.088  12.352
  922    HZ3  LYS 117          3HZ       LYS 117   1.253   6.527  12.509
  923    H    ALA 118           H        ALA 118   6.793   7.007   7.358
  924    HA   ALA 118           HA       ALA 118   8.015   9.564   7.058
  925    HB1  ALA 118          1HB       ALA 118   9.257   6.827   7.111
  926    HB2  ALA 118          2HB       ALA 118   8.892   7.821   8.521
  927    HB3  ALA 118          3HB       ALA 118  10.097   8.359   7.352
  928    H    SER 119           H        SER 119   7.568   6.799   4.937
  929    HA   SER 119           HA       SER 119   9.463   7.485   2.993
  930    HB2  SER 119          1HB       SER 119   8.291   5.934   1.523
  931    HB3  SER 119          2HB       SER 119   8.407   5.265   3.148
  932    HG   SER 119           HG       SER 119   6.230   5.994   3.482
  933    H    ILE 120           H        ILE 120   6.102   8.443   3.379
  934    HA   ILE 120           HA       ILE 120   6.162   9.966   0.901
  935    HB   ILE 120           HB       ILE 120   3.816  10.543   1.461
  936   HG12  ILE 120          1HG1      ILE 120   4.110   8.612   3.757
  937   HG13  ILE 120          2HG1      ILE 120   4.185  10.361   3.959
  938   HG21  ILE 120          1HG2      ILE 120   4.265   8.608   0.090
  939   HG22  ILE 120          2HG2      ILE 120   2.902   8.275   1.159
  940   HG23  ILE 120          3HG2      ILE 120   4.494   7.612   1.528
  941   HD11  ILE 120          1HD1      ILE 120   1.920  10.549   3.077
  942   HD12  ILE 120          2HD1      ILE 120   1.987   9.509   4.497
  943   HD13  ILE 120          3HD1      ILE 120   1.849   8.801   2.890
  944    H    LYS 121           H        LYS 121   7.212  10.458   3.977
  945    HA   LYS 121           HA       LYS 121   6.367  13.227   4.231
  946    HB2  LYS 121          1HB       LYS 121   6.460  11.734   6.209
  947    HB3  LYS 121          2HB       LYS 121   8.193  11.564   5.974
  948    HG2  LYS 121          1HG       LYS 121   8.408  14.028   6.278
  949    HG3  LYS 121          2HG       LYS 121   6.692  14.070   6.687
  950    HD2  LYS 121          1HD       LYS 121   7.144  12.458   8.519
  951    HD3  LYS 121          2HD       LYS 121   8.865  12.572   8.149
  952    HE2  LYS 121          1HE       LYS 121   8.268  14.013  10.024
  953    HE3  LYS 121          2HE       LYS 121   8.818  14.960   8.642
  954    HZ1  LYS 121          1HZ       LYS 121   6.539  15.467   8.099
  955    HZ2  LYS 121          2HZ       LYS 121   6.841  15.906   9.702
  956    HZ3  LYS 121          3HZ       LYS 121   5.975  14.496   9.362
  957    H    LYS 122           H        LYS 122   7.571  14.907   3.558
  958    HA   LYS 122           HA       LYS 122  10.232  14.543   2.526
  959    HB2  LYS 122          1HB       LYS 122   9.455  17.277   3.279
  960    HB3  LYS 122          2HB       LYS 122  10.096  16.667   1.780
  961    HG2  LYS 122          1HG       LYS 122   7.866  15.774   1.198
  962    HG3  LYS 122          2HG       LYS 122   7.226  16.532   2.657
  963    HD2  LYS 122          1HD       LYS 122   7.852  18.718   1.844
  964    HD3  LYS 122          2HD       LYS 122   8.626  18.003   0.430
  965    HE2  LYS 122          1HE       LYS 122   6.456  17.125  -0.301
  966    HE3  LYS 122          2HE       LYS 122   5.691  17.865   1.104
  967    HZ1  LYS 122          1HZ       LYS 122   6.273  20.025   0.291
  968    HZ2  LYS 122          2HZ       LYS 122   5.469  19.192  -0.939
  969    HZ3  LYS 122          3HZ       LYS 122   7.149  19.369  -0.998
  970    H    ASP 123           H        ASP 123  11.880  14.159   3.763
  971    HA   ASP 123           HA       ASP 123  11.745  14.461   6.593
  972    HB2  ASP 123          1HB       ASP 123  12.920  12.593   5.419
  973    HB3  ASP 123          2HB       ASP 123  14.151  13.742   4.913
  974    H21  ACD 201           H21      ACD   1  -4.757   4.806   1.349
  975    H22  ACD 201           H22      ACD   1  -3.694   4.920   2.755
  976    H31  ACD 201           H31      ACD   1  -2.210   6.478   1.486
  977    H32  ACD 201           H32      ACD   1  -3.259   6.326   0.078
  978    H41  ACD 201           H41      ACD   1  -2.817   3.835   0.081
  979    H42  ACD 201           H42      ACD   1  -1.366   4.808  -0.203
  980    H5   ACD 201           H5       ACD   1  -2.007   3.218   2.344
  981    H6   ACD 201           H6       ACD   1   0.281   3.733   2.828
  982    H71  ACD 201           H71      ACD   1   0.747   4.789   0.177
  983    H72  ACD 201           H72      ACD   1  -0.134   6.079   0.994
  984    H8   ACD 201           H8       ACD   1   1.736   6.380   2.628
  985    H9   ACD 201           H9       ACD   1   3.838   5.468   1.971
  986   H101  ACD 201          H101      ACD   1   2.758   4.666  -0.602
  987   H102  ACD 201          H102      ACD   1   2.291   3.368   0.502
  988    H11  ACD 201           H11      ACD   1   5.255   4.245   0.366
  989    H12  ACD 201           H12      ACD   1   5.578   1.909   0.062
  990   H131  ACD 201          H131      ACD   1   2.602   1.930  -0.627
  991   H132  ACD 201          H132      ACD   1   3.699   0.549  -0.722
  992    H14  ACD 201           H14      ACD   1   2.566   1.627   1.960
  993    H15  ACD 201           H15      ACD   1   2.497  -0.704   2.442
  994   H161  ACD 201          H161      ACD   1   2.707  -1.447  -0.346
  995   H162  ACD 201          H162      ACD   1   4.360  -1.007   0.099
  996   H171  ACD 201          H171      ACD   1   4.435  -2.661   1.847
  997   H172  ACD 201          H172      ACD   1   2.699  -2.955   1.733
  998   H181  ACD 201          H181      ACD   1   4.712  -3.550  -0.474
  999   H182  ACD 201          H182      ACD   1   2.979  -3.889  -0.538
 1000   H191  ACD 201          H191      ACD   1   4.985  -5.090   1.424
 1001   H192  ACD 201          H192      ACD   1   3.242  -5.363   1.498
 1002   H201  ACD 201          H201      ACD   1   5.013  -6.065  -0.852
 1003   H202  ACD 201          H202      ACD   1   3.311  -6.363  -0.743
 1004   H203  ACD 201          H203      ACD   1   4.403  -7.186   0.317
  Start of MODEL    2
    1    H1   MET   1          1H        MET   1  17.957  16.229 -13.846
    2    H2   MET   1          2H        MET   1  16.599  17.233 -13.841
    3    H3   MET   1          3H        MET   1  17.095  16.493 -15.277
    4    HA   MET   1           HA       MET   1  15.162  15.399 -14.336
    5    HB2  MET   1          1HB       MET   1  16.718  14.062 -15.662
    6    HB3  MET   1          2HB       MET   1  17.716  13.778 -14.243
    7    HG2  MET   1          1HG       MET   1  15.857  12.564 -13.197
    8    HG3  MET   1          2HG       MET   1  14.896  12.812 -14.651
    9    HE1  MET   1          1HE       MET   1  18.764  11.993 -14.414
   10    HE2  MET   1          2HE       MET   1  18.723  10.232 -14.480
   11    HE3  MET   1          3HE       MET   1  18.039  11.079 -13.094
   12    H    GLU   2           H        GLU   2  14.225  15.825 -12.436
   13    HA   GLU   2           HA       GLU   2  15.607  15.008  -9.980
   14    HB2  GLU   2          1HB       GLU   2  13.224  16.811 -10.376
   15    HB3  GLU   2          2HB       GLU   2  13.917  16.379  -8.820
   16    HG2  GLU   2          1HG       GLU   2  15.419  17.788 -10.999
   17    HG3  GLU   2          2HG       GLU   2  14.599  18.606  -9.671
   18    H    PHE   3           H        PHE   3  15.005  13.204  -9.034
   19    HA   PHE   3           HA       PHE   3  12.667  11.789  -9.961
   20    HB2  PHE   3          1HB       PHE   3  14.703  10.537  -9.479
   21    HB3  PHE   3          2HB       PHE   3  14.665  11.083  -7.799
   22    HD1  PHE   3           HD1      PHE   3  12.718   9.177 -10.316
   23    HD2  PHE   3           HD2      PHE   3  13.569   9.816  -6.202
   24    HE1  PHE   3           HE1      PHE   3  11.349   7.214  -9.734
   25    HE2  PHE   3           HE2      PHE   3  12.204   7.856  -5.607
   26    HZ   PHE   3           HZ       PHE   3  11.090   6.553  -7.374
   27    H    THR   4           H        THR   4  10.735  12.155  -9.188
   28    HA   THR   4           HA       THR   4  10.468  13.510  -6.603
   29    HB   THR   4           HB       THR   4   8.021  13.111  -8.166
   30    HG1  THR   4           HG1      THR   4   9.294  13.442  -9.965
   31   HG21  THR   4          1HG2      THR   4   7.767  15.491  -7.692
   32   HG22  THR   4          2HG2      THR   4   9.411  15.541  -7.056
   33   HG23  THR   4          3HG2      THR   4   8.178  14.583  -6.241
   34    H    VAL   5           H        VAL   5  10.244  12.210  -4.960
   35    HA   VAL   5           HA       VAL   5   8.927   9.628  -5.191
   36    HB   VAL   5           HB       VAL   5   9.694   9.129  -3.087
   37   HG11  VAL   5          1HG1      VAL   5  11.620   9.666  -4.423
   38   HG12  VAL   5          2HG1      VAL   5  11.908  10.013  -2.721
   39   HG13  VAL   5          3HG1      VAL   5  11.582  11.331  -3.846
   40   HG21  VAL   5          1HG2      VAL   5  10.013  10.659  -1.243
   41   HG22  VAL   5          2HG2      VAL   5   8.407  10.897  -1.931
   42   HG23  VAL   5          3HG2      VAL   5   9.700  12.039  -2.295
   43    H    SER   6           H        SER   6   7.008   9.064  -4.181
   44    HA   SER   6           HA       SER   6   5.021  11.105  -4.361
   45    HB2  SER   6          1HB       SER   6   4.731   8.263  -3.355
   46    HB3  SER   6          2HB       SER   6   3.433   9.320  -3.913
   47    HG   SER   6           HG       SER   6   5.328   7.895  -5.366
   48    H    THR   7           H        THR   7   5.235  12.623  -2.773
   49    HA   THR   7           HA       THR   7   5.533  11.829  -0.001
   50    HB   THR   7           HB       THR   7   5.512  14.252   0.476
   51    HG1  THR   7           HG1      THR   7   4.919  14.383  -2.309
   52   HG21  THR   7          1HG2      THR   7   7.623  13.146  -0.078
   53   HG22  THR   7          2HG2      THR   7   7.602  14.808  -0.667
   54   HG23  THR   7          3HG2      THR   7   7.348  13.473  -1.788
   55    H    THR   8           H        THR   8   4.070  13.340   1.520
   56    HA   THR   8           HA       THR   8   1.496  12.332   1.542
   57    HB   THR   8           HB       THR   8   2.486  14.930   2.726
   58    HG1  THR   8           HG1      THR   8   3.656  13.354   3.676
   59   HG21  THR   8          1HG2      THR   8   0.040  13.277   3.338
   60   HG22  THR   8          2HG2      THR   8   0.078  14.913   2.673
   61   HG23  THR   8          3HG2      THR   8   0.619  14.621   4.326
   62    H    GLU   9           H        GLU   9   2.667  15.395   0.237
   63    HA   GLU   9           HA       GLU   9   0.233  16.535  -0.466
   64    HB2  GLU   9          1HB       GLU   9   2.598  17.547  -0.485
   65    HB3  GLU   9          2HB       GLU   9   2.748  16.865  -2.093
   66    HG2  GLU   9          1HG       GLU   9   0.540  18.743  -1.323
   67    HG3  GLU   9          2HG       GLU   9   2.099  19.295  -1.928
   68    H    ASP  10           H        ASP  10   2.375  14.423  -2.361
   69    HA   ASP  10           HA       ASP  10   0.767  14.398  -4.698
   70    HB2  ASP  10          1HB       ASP  10   2.740  12.277  -3.812
   71    HB3  ASP  10          2HB       ASP  10   2.129  12.546  -5.444
   72    H    LEU  11           H        LEU  11   0.956  12.342  -1.853
   73    HA   LEU  11           HA       LEU  11  -0.637  10.261  -2.811
   74    HB2  LEU  11          1HB       LEU  11   0.779   9.992  -0.875
   75    HB3  LEU  11          2HB       LEU  11  -0.189  11.162   0.034
   76    HG   LEU  11           HG       LEU  11  -2.114   9.597  -0.149
   77   HD11  LEU  11          1HD1      LEU  11  -1.697   7.294  -0.841
   78   HD12  LEU  11          2HD1      LEU  11  -0.059   7.735  -1.321
   79   HD13  LEU  11          3HD1      LEU  11  -1.444   8.425  -2.166
   80   HD21  LEU  11          1HD2      LEU  11  -0.621   9.639   1.820
   81   HD22  LEU  11          2HD2      LEU  11   0.345   8.361   1.081
   82   HD23  LEU  11          3HD2      LEU  11  -1.332   8.052   1.529
   83    H    GLN  12           H        GLN  12  -1.452  13.316  -1.318
   84    HA   GLN  12           HA       GLN  12  -4.160  12.778  -0.741
   85    HB2  GLN  12          1HB       GLN  12  -2.737  15.365  -1.349
   86    HB3  GLN  12          2HB       GLN  12  -4.422  15.283  -0.860
   87    HG2  GLN  12          1HG       GLN  12  -3.748  14.246   1.252
   88    HG3  GLN  12          2HG       GLN  12  -2.060  14.370   0.760
   89   HE21  GLN  12          1HE2      GLN  12  -1.574  15.674   2.525
   90   HE22  GLN  12          2HE2      GLN  12  -2.052  17.331   2.596
   91    H    ARG  13           H        ARG  13  -2.520  13.860  -3.635
   92    HA   ARG  13           HA       ARG  13  -4.728  14.519  -5.214
   93    HB2  ARG  13          1HB       ARG  13  -2.554  15.064  -6.016
   94    HB3  ARG  13          2HB       ARG  13  -2.020  13.393  -5.909
   95    HG2  ARG  13          1HG       ARG  13  -3.655  12.811  -7.682
   96    HG3  ARG  13          2HG       ARG  13  -4.011  14.539  -7.850
   97    HD2  ARG  13          1HD       ARG  13  -1.760  14.990  -8.523
   98    HD3  ARG  13          2HD       ARG  13  -1.266  13.338  -8.152
   99    HE   ARG  13           HE       ARG  13  -3.232  13.020 -10.002
  100   HH11  ARG  13          1HH1      ARG  13  -0.239  14.838  -9.893
  101   HH12  ARG  13          2HH1      ARG  13   0.025  14.756 -11.606
  102   HH21  ARG  13          1HH2      ARG  13  -2.890  12.925 -12.266
  103   HH22  ARG  13          2HH2      ARG  13  -1.480  13.666 -12.954
  104    H    TYR  14           H        TYR  14  -2.998  11.440  -4.893
  105    HA   TYR  14           HA       TYR  14  -4.526  10.098  -6.842
  106    HB2  TYR  14          1HB       TYR  14  -2.918   8.868  -4.599
  107    HB3  TYR  14          2HB       TYR  14  -3.427   8.084  -6.086
  108    HD1  TYR  14           HD1      TYR  14  -0.599   9.124  -4.654
  109    HD2  TYR  14           HD2      TYR  14  -2.820   9.936  -8.188
  110    HE1  TYR  14           HE1      TYR  14   1.452   9.901  -5.755
  111    HE2  TYR  14           HE2      TYR  14  -0.768  10.701  -9.305
  112    HH   TYR  14           HH       TYR  14   2.340  10.164  -8.017
  113    H    ARG  15           H        ARG  15  -4.991  10.509  -3.383
  114    HA   ARG  15           HA       ARG  15  -6.929   8.511  -3.026
  115    HB2  ARG  15          1HB       ARG  15  -7.116  11.176  -1.644
  116    HB3  ARG  15          2HB       ARG  15  -7.634   9.609  -1.069
  117    HG2  ARG  15          1HG       ARG  15  -5.201   8.942  -1.008
  118    HG3  ARG  15          2HG       ARG  15  -4.831  10.652  -1.254
  119    HD2  ARG  15          1HD       ARG  15  -6.244  11.169   0.747
  120    HD3  ARG  15          2HD       ARG  15  -6.389   9.437   1.028
  121    HE   ARG  15           HE       ARG  15  -3.742  10.700   0.956
  122   HH11  ARG  15          1HH1      ARG  15  -6.151   8.781   2.601
  123   HH12  ARG  15          2HH1      ARG  15  -5.191   8.538   4.021
  124   HH21  ARG  15          1HH2      ARG  15  -2.458  10.385   2.845
  125   HH22  ARG  15          2HH2      ARG  15  -3.098   9.474   4.170
  126    H    THR  16           H        THR  16  -7.175  11.823  -4.216
  127    HA   THR  16           HA       THR  16  -9.993  11.976  -4.245
  128    HB   THR  16           HB       THR  16  -8.336  13.454  -6.246
  129    HG1  THR  16           HG1      THR  16  -7.168  14.368  -4.735
  130   HG21  THR  16          1HG2      THR  16  -9.825  15.290  -5.606
  131   HG22  THR  16          2HG2      THR  16 -10.598  14.244  -4.416
  132   HG23  THR  16          3HG2      THR  16 -10.727  13.871  -6.135
  133    H    GLU  17           H        GLU  17  -7.641  11.138  -6.783
  134    HA   GLU  17           HA       GLU  17  -9.554  10.832  -8.844
  135    HB2  GLU  17          1HB       GLU  17  -6.995   9.250  -8.810
  136    HB3  GLU  17          2HB       GLU  17  -7.854   9.933 -10.172
  137    HG2  GLU  17          1HG       GLU  17  -7.254  12.195  -9.392
  138    HG3  GLU  17          2HG       GLU  17  -6.255  11.458  -8.138
  139    H    CYS  18           H        CYS  18  -8.276   8.575  -6.462
  140    HA   CYS  18           HA       CYS  18  -9.616   6.325  -7.632
  141    HB2  CYS  18          1HB       CYS  18  -8.264   6.678  -4.956
  142    HB3  CYS  18          2HB       CYS  18  -8.940   5.152  -5.545
  143    H    VAL  19           H        VAL  19 -10.369   8.697  -5.187
  144    HA   VAL  19           HA       VAL  19 -12.507   7.302  -3.986
  145    HB   VAL  19           HB       VAL  19 -11.631  10.162  -3.972
  146   HG11  VAL  19          1HG1      VAL  19 -13.530  10.774  -2.569
  147   HG12  VAL  19          2HG1      VAL  19 -14.238   9.177  -2.814
  148   HG13  VAL  19          3HG1      VAL  19 -14.061  10.285  -4.180
  149   HG21  VAL  19          1HG2      VAL  19 -11.561   9.734  -1.543
  150   HG22  VAL  19          2HG2      VAL  19 -10.562   8.604  -2.459
  151   HG23  VAL  19          3HG2      VAL  19 -12.131   8.090  -1.836
  152    H    SER  20           H        SER  20 -12.404   9.845  -6.422
  153    HA   SER  20           HA       SER  20 -15.183   9.909  -6.880
  154    HB2  SER  20          1HB       SER  20 -14.460  11.114  -9.006
  155    HB3  SER  20          2HB       SER  20 -13.899  11.804  -7.481
  156    HG   SER  20           HG       SER  20 -11.900  11.302  -7.965
  157    H    SER  21           H        SER  21 -12.572   8.053  -8.367
  158    HA   SER  21           HA       SER  21 -14.120   7.102 -10.563
  159    HB2  SER  21          1HB       SER  21 -11.645   7.214 -10.590
  160    HB3  SER  21          2HB       SER  21 -11.588   5.961  -9.354
  161    HG   SER  21           HG       SER  21 -11.318   5.219 -11.564
  162    H    LEU  22           H        LEU  22 -13.137   5.655  -7.447
  163    HA   LEU  22           HA       LEU  22 -14.646   3.257  -8.049
  164    HB2  LEU  22          1HB       LEU  22 -12.972   4.076  -5.680
  165    HB3  LEU  22          2HB       LEU  22 -13.797   2.519  -5.803
  166    HG   LEU  22           HG       LEU  22 -11.751   3.474  -7.800
  167   HD11  LEU  22          1HD1      LEU  22 -10.703   3.272  -5.617
  168   HD12  LEU  22          2HD1      LEU  22 -10.200   1.942  -6.661
  169   HD13  LEU  22          3HD1      LEU  22 -11.413   1.671  -5.409
  170   HD21  LEU  22          1HD2      LEU  22 -12.863   0.737  -7.218
  171   HD22  LEU  22          2HD2      LEU  22 -11.710   1.163  -8.485
  172   HD23  LEU  22          3HD2      LEU  22 -13.363   1.774  -8.555
  173    H    ASN  23           H        ASN  23 -15.710   6.116  -7.252
  174    HA   ASN  23           HA       ASN  23 -17.536   6.984  -6.207
  175    HB2  ASN  23          1HB       ASN  23 -18.451   4.113  -6.321
  176    HB3  ASN  23          2HB       ASN  23 -19.482   5.488  -5.979
  177   HD21  ASN  23          1HD2      ASN  23 -20.015   6.913  -7.625
  178   HD22  ASN  23          2HD2      ASN  23 -19.782   6.509  -9.296
  179    H    ILE  24           H        ILE  24 -15.356   6.215  -4.512
  180    HA   ILE  24           HA       ILE  24 -16.145   4.865  -2.181
  181    HB   ILE  24           HB       ILE  24 -14.086   7.065  -2.373
  182   HG12  ILE  24          1HG1      ILE  24 -13.713   5.340  -4.122
  183   HG13  ILE  24          2HG1      ILE  24 -12.440   5.348  -2.905
  184   HG21  ILE  24          1HG2      ILE  24 -13.017   5.891  -0.512
  185   HG22  ILE  24          2HG2      ILE  24 -14.333   4.716  -0.498
  186   HG23  ILE  24          3HG2      ILE  24 -14.655   6.404  -0.101
  187   HD11  ILE  24          1HD1      ILE  24 -13.430   3.390  -1.851
  188   HD12  ILE  24          2HD1      ILE  24 -13.067   3.090  -3.551
  189   HD13  ILE  24          3HD1      ILE  24 -14.727   3.398  -3.046
  190    HA   PRO  25           HA       PRO  25 -18.843   7.993  -0.384
  191    HB2  PRO  25          1HB       PRO  25 -18.553   6.355   2.028
  192    HB3  PRO  25          2HB       PRO  25 -20.007   6.773   1.122
  193    HG2  PRO  25          1HG       PRO  25 -18.963   4.293   1.118
  194    HG3  PRO  25          2HG       PRO  25 -19.818   4.979  -0.275
  195    HD2  PRO  25          1HD       PRO  25 -16.883   4.620   0.164
  196    HD3  PRO  25          2HD       PRO  25 -17.837   4.464  -1.333
  197    H    ALA  26           H        ALA  26 -18.550   9.696   0.914
  198    HA   ALA  26           HA       ALA  26 -15.962  10.596   1.431
  199    HB1  ALA  26          1HB       ALA  26 -17.922  12.033   1.070
  200    HB2  ALA  26          2HB       ALA  26 -17.019  12.473   2.519
  201    HB3  ALA  26          3HB       ALA  26 -18.528  11.573   2.660
  202    H    ASP  27           H        ASP  27 -18.251   8.935   3.496
  203    HA   ASP  27           HA       ASP  27 -17.138   9.311   5.997
  204    HB2  ASP  27          1HB       ASP  27 -19.220   8.114   5.680
  205    HB3  ASP  27          2HB       ASP  27 -18.380   6.798   4.869
  206    H    TYR  28           H        TYR  28 -16.329   6.751   3.644
  207    HA   TYR  28           HA       TYR  28 -14.248   5.613   5.093
  208    HB2  TYR  28          1HB       TYR  28 -14.989   5.656   2.202
  209    HB3  TYR  28          2HB       TYR  28 -13.446   4.950   2.683
  210    HD1  TYR  28           HD1      TYR  28 -17.110   4.684   3.032
  211    HD2  TYR  28           HD2      TYR  28 -13.360   2.823   3.784
  212    HE1  TYR  28           HE1      TYR  28 -18.268   2.593   3.609
  213    HE2  TYR  28           HE2      TYR  28 -14.507   0.730   4.362
  214    HH   TYR  28           HH       TYR  28 -17.791   0.186   3.703
  215    H    VAL  29           H        VAL  29 -14.280   8.369   2.910
  216    HA   VAL  29           HA       VAL  29 -11.528   8.707   2.555
  217    HB   VAL  29           HB       VAL  29 -13.661  10.831   2.660
  218   HG11  VAL  29          1HG1      VAL  29 -10.879  10.855   1.504
  219   HG12  VAL  29          2HG1      VAL  29 -11.470  11.823   2.856
  220   HG13  VAL  29          3HG1      VAL  29 -12.091  12.107   1.231
  221   HG21  VAL  29          1HG2      VAL  29 -14.200   9.138   1.041
  222   HG22  VAL  29          2HG2      VAL  29 -12.566   9.197   0.385
  223   HG23  VAL  29          3HG2      VAL  29 -13.643  10.584   0.200
  224    H    GLU  30           H        GLU  30 -13.693  10.014   5.065
  225    HA   GLU  30           HA       GLU  30 -11.759  11.511   6.479
  226    HB2  GLU  30          1HB       GLU  30 -14.058  10.128   7.834
  227    HB3  GLU  30          2HB       GLU  30 -13.313  11.680   8.204
  228    HG2  GLU  30          1HG       GLU  30 -14.196  12.594   6.124
  229    HG3  GLU  30          2HG       GLU  30 -15.000  11.063   5.805
  230    H    LYS  31           H        LYS  31 -12.613   8.127   6.540
  231    HA   LYS  31           HA       LYS  31 -11.130   7.416   8.842
  232    HB2  LYS  31          1HB       LYS  31 -11.861   5.731   6.439
  233    HB3  LYS  31          2HB       LYS  31 -11.222   5.113   7.967
  234    HG2  LYS  31          1HG       LYS  31 -13.207   6.098   9.103
  235    HG3  LYS  31          2HG       LYS  31 -13.859   6.477   7.511
  236    HD2  LYS  31          1HD       LYS  31 -13.730   4.078   6.926
  237    HD3  LYS  31          2HD       LYS  31 -13.171   3.737   8.578
  238    HE2  LYS  31          1HE       LYS  31 -15.812   5.010   7.835
  239    HE3  LYS  31          2HE       LYS  31 -15.586   3.334   8.342
  240    HZ1  LYS  31          1HZ       LYS  31 -16.332   4.704  10.172
  241    HZ2  LYS  31          2HZ       LYS  31 -15.014   5.745   9.985
  242    HZ3  LYS  31          3HZ       LYS  31 -14.765   4.146  10.475
  243    H    PHE  32           H        PHE  32 -10.361   7.149   5.381
  244    HA   PHE  32           HA       PHE  32  -7.805   6.089   5.627
  245    HB2  PHE  32          1HB       PHE  32  -8.764   7.944   3.448
  246    HB3  PHE  32          2HB       PHE  32  -7.447   6.783   3.332
  247    HD1  PHE  32           HD1      PHE  32 -10.044   7.113   1.631
  248    HD2  PHE  32           HD2      PHE  32  -8.912   4.532   4.816
  249    HE1  PHE  32           HE1      PHE  32 -11.622   5.413   0.813
  250    HE2  PHE  32           HE2      PHE  32 -10.489   2.832   4.005
  251    HZ   PHE  32           HZ       PHE  32 -11.843   3.267   1.996
  252    H    LYS  33           H        LYS  33  -8.890   9.412   5.749
  253    HA   LYS  33           HA       LYS  33  -6.427  10.727   5.582
  254    HB2  LYS  33          1HB       LYS  33  -8.964  11.553   5.743
  255    HB3  LYS  33          2HB       LYS  33  -8.535  11.740   7.433
  256    HG2  LYS  33          1HG       LYS  33  -7.018  13.021   5.164
  257    HG3  LYS  33          2HG       LYS  33  -8.318  13.809   6.065
  258    HD2  LYS  33          1HD       LYS  33  -7.005  13.484   8.143
  259    HD3  LYS  33          2HD       LYS  33  -5.691  12.816   7.174
  260    HE2  LYS  33          1HE       LYS  33  -6.837  15.593   6.895
  261    HE3  LYS  33          2HE       LYS  33  -5.337  15.188   7.726
  262    HZ1  LYS  33          1HZ       LYS  33  -4.907  15.981   5.496
  263    HZ2  LYS  33          2HZ       LYS  33  -5.891  14.778   4.837
  264    HZ3  LYS  33          3HZ       LYS  33  -4.458  14.356   5.626
  265    H    LYS  34           H        LYS  34  -8.072   9.172   8.286
  266    HA   LYS  34           HA       LYS  34  -5.918   9.974  10.097
  267    HB2  LYS  34          1HB       LYS  34  -8.577   8.647  10.622
  268    HB3  LYS  34          2HB       LYS  34  -7.384   8.966  11.874
  269    HG2  LYS  34          1HG       LYS  34  -7.544  11.391  11.273
  270    HG3  LYS  34          2HG       LYS  34  -8.890  10.971  10.212
  271    HD2  LYS  34          1HD       LYS  34  -8.744  10.563  13.198
  272    HD3  LYS  34          2HD       LYS  34  -9.742  11.736  12.341
  273    HE2  LYS  34          1HE       LYS  34  -9.977   8.738  12.110
  274    HE3  LYS  34          2HE       LYS  34 -11.025   9.773  13.077
  275    HZ1  LYS  34          1HZ       LYS  34 -10.712   9.949  10.128
  276    HZ2  LYS  34          2HZ       LYS  34 -11.760  10.874  11.079
  277    HZ3  LYS  34          3HZ       LYS  34 -12.002   9.207  10.931
  278    H    TRP  35           H        TRP  35  -5.576   7.954   7.972
  279    HA   TRP  35           HA       TRP  35  -4.677   5.913   7.600
  280    HB2  TRP  35          1HB       TRP  35  -3.747   6.350  10.438
  281    HB3  TRP  35          2HB       TRP  35  -3.161   5.040   9.405
  282    HD1  TRP  35           HD1      TRP  35  -2.948   8.828   9.869
  283    HE1  TRP  35           HE1      TRP  35  -0.959   9.728   8.507
  284    HE3  TRP  35           HE3      TRP  35  -1.711   4.564   7.323
  285    HZ2  TRP  35           HZ2      TRP  35   0.883   8.760   6.618
  286    HZ3  TRP  35           HZ3      TRP  35   0.176   4.643   5.757
  287    HH2  TRP  35           HH2      TRP  35   1.451   6.690   5.406
  288    H    GLU  36           H        GLU  36  -7.385   5.819   8.325
  289    HA   GLU  36           HA       GLU  36  -7.560   3.307   9.839
  290    HB2  GLU  36          1HB       GLU  36  -9.710   5.274   9.072
  291    HB3  GLU  36          2HB       GLU  36 -10.009   3.748   9.880
  292    HG2  GLU  36          1HG       GLU  36  -8.638   4.547  11.771
  293    HG3  GLU  36          2HG       GLU  36  -8.492   6.100  10.952
  294    H    PHE  37           H        PHE  37  -7.452   1.587   8.558
  295    HA   PHE  37           HA       PHE  37  -8.871   1.714   5.981
  296    HB2  PHE  37          1HB       PHE  37  -6.388   0.071   6.544
  297    HB3  PHE  37          2HB       PHE  37  -7.187   0.273   4.988
  298    HD1  PHE  37           HD1      PHE  37  -4.941   1.760   7.438
  299    HD2  PHE  37           HD2      PHE  37  -6.964   2.372   3.743
  300    HE1  PHE  37           HE1      PHE  37  -3.492   3.686   6.968
  301    HE2  PHE  37           HE2      PHE  37  -5.518   4.300   3.269
  302    HZ   PHE  37           HZ       PHE  37  -3.776   4.961   4.883
  303    HA   PRO  38           HA       PRO  38 -10.933  -1.554   8.548
  304    HB2  PRO  38          1HB       PRO  38 -13.071  -0.793   6.637
  305    HB3  PRO  38          2HB       PRO  38 -13.149  -1.026   8.392
  306    HG2  PRO  38          1HG       PRO  38 -13.230   1.421   7.382
  307    HG3  PRO  38          2HG       PRO  38 -12.275   1.083   8.838
  308    HD2  PRO  38          1HD       PRO  38 -11.329   1.390   5.996
  309    HD3  PRO  38          2HD       PRO  38 -10.625   2.053   7.503
  310    H    GLU  39           H        GLU  39 -11.380  -3.635   7.999
  311    HA   GLU  39           HA       GLU  39 -10.432  -4.564   5.466
  312    HB2  GLU  39          1HB       GLU  39 -10.045  -5.806   7.565
  313    HB3  GLU  39          2HB       GLU  39 -11.771  -6.103   7.696
  314    HG2  GLU  39          1HG       GLU  39 -11.744  -7.440   5.703
  315    HG3  GLU  39          2HG       GLU  39 -10.051  -7.039   5.411
  316    H    ASP  40           H        ASP  40 -11.874  -3.451   4.129
  317    HA   ASP  40           HA       ASP  40 -14.427  -4.817   3.697
  318    HB2  ASP  40          1HB       ASP  40 -14.930  -2.788   5.038
  319    HB3  ASP  40          2HB       ASP  40 -14.123  -1.800   3.825
  320    H    ASP  41           H        ASP  41 -15.093  -4.781   1.551
  321    HA   ASP  41           HA       ASP  41 -12.968  -4.987  -0.273
  322    HB2  ASP  41          1HB       ASP  41 -14.655  -5.457  -1.966
  323    HB3  ASP  41          2HB       ASP  41 -15.033  -6.314  -0.479
  324    H    THR  42           H        THR  42 -15.089  -2.336   0.492
  325    HA   THR  42           HA       THR  42 -14.648  -0.733  -1.791
  326    HB   THR  42           HB       THR  42 -15.055   0.254   1.031
  327    HG1  THR  42           HG1      THR  42 -16.721  -1.111   0.802
  328   HG21  THR  42          1HG2      THR  42 -16.291   2.066  -0.137
  329   HG22  THR  42          2HG2      THR  42 -15.763   1.378  -1.674
  330   HG23  THR  42          3HG2      THR  42 -14.575   2.014  -0.536
  331    H    THR  43           H        THR  43 -13.120  -0.598   1.421
  332    HA   THR  43           HA       THR  43 -11.083   1.200   0.887
  333    HB   THR  43           HB       THR  43 -10.947  -1.181   2.743
  334    HG1  THR  43           HG1      THR  43 -11.621   0.684   4.239
  335   HG21  THR  43          1HG2      THR  43  -9.449   0.305   4.067
  336   HG22  THR  43          2HG2      THR  43  -9.491   1.464   2.737
  337   HG23  THR  43          3HG2      THR  43  -8.787  -0.131   2.491
  338    H    MET  44           H        MET  44 -11.302  -2.230   0.219
  339    HA   MET  44           HA       MET  44  -8.556  -2.723  -0.148
  340    HB2  MET  44          1HB       MET  44 -10.950  -4.192  -1.241
  341    HB3  MET  44          2HB       MET  44  -9.303  -4.808  -1.256
  342    HG2  MET  44          1HG       MET  44  -9.250  -4.813   1.155
  343    HG3  MET  44          2HG       MET  44 -10.848  -4.080   1.217
  344    HE1  MET  44          1HE       MET  44 -10.158  -6.625   2.875
  345    HE2  MET  44          2HE       MET  44 -11.590  -7.612   2.580
  346    HE3  MET  44          3HE       MET  44 -11.754  -5.872   2.828
  347    H    CYS  45           H        CYS  45 -11.142  -2.248  -2.571
  348    HA   CYS  45           HA       CYS  45  -9.374  -2.245  -4.776
  349    HB2  CYS  45          1HB       CYS  45 -12.125  -1.002  -4.531
  350    HB3  CYS  45          2HB       CYS  45 -11.250  -1.231  -6.039
  351    H    TYR  46           H        TYR  46 -10.444   0.249  -2.570
  352    HA   TYR  46           HA       TYR  46  -9.555   2.502  -3.942
  353    HB2  TYR  46          1HB       TYR  46 -10.877   2.877  -2.041
  354    HB3  TYR  46          2HB       TYR  46  -9.865   1.853  -1.022
  355    HD1  TYR  46           HD1      TYR  46  -9.852   5.067  -2.910
  356    HD2  TYR  46           HD2      TYR  46  -8.200   2.819   0.306
  357    HE1  TYR  46           HE1      TYR  46  -8.656   7.063  -2.127
  358    HE2  TYR  46           HE2      TYR  46  -6.993   4.813   1.088
  359    HH   TYR  46           HH       TYR  46  -6.249   6.922   0.384
  360    H    ILE  47           H        ILE  47  -7.872   0.431  -1.604
  361    HA   ILE  47           HA       ILE  47  -5.402   1.734  -1.672
  362    HB   ILE  47           HB       ILE  47  -6.087  -1.129  -1.048
  363   HG12  ILE  47          1HG1      ILE  47  -7.006   0.510   0.516
  364   HG13  ILE  47          2HG1      ILE  47  -5.716  -0.403   1.295
  365   HG21  ILE  47          1HG2      ILE  47  -3.838  -1.283  -0.012
  366   HG22  ILE  47          2HG2      ILE  47  -3.438   0.276  -0.735
  367   HG23  ILE  47          3HG2      ILE  47  -3.788  -1.110  -1.766
  368   HD11  ILE  47          1HD1      ILE  47  -5.595   2.415   0.250
  369   HD12  ILE  47          2HD1      ILE  47  -4.184   1.512   0.798
  370   HD13  ILE  47          3HD1      ILE  47  -5.489   1.876   1.924
  371    H    LYS  48           H        LYS  48  -6.728  -0.832  -3.713
  372    HA   LYS  48           HA       LYS  48  -4.354  -1.477  -5.061
  373    HB2  LYS  48          1HB       LYS  48  -6.671  -2.655  -5.077
  374    HB3  LYS  48          2HB       LYS  48  -7.045  -1.571  -6.405
  375    HG2  LYS  48          1HG       LYS  48  -4.803  -3.587  -6.317
  376    HG3  LYS  48          2HG       LYS  48  -6.310  -3.752  -7.208
  377    HD2  LYS  48          1HD       LYS  48  -4.334  -1.532  -7.705
  378    HD3  LYS  48          2HD       LYS  48  -4.274  -3.077  -8.550
  379    HE2  LYS  48          1HE       LYS  48  -6.675  -1.255  -8.533
  380    HE3  LYS  48          2HE       LYS  48  -5.441  -1.248  -9.792
  381    HZ1  LYS  48          1HZ       LYS  48  -5.954  -3.631 -10.167
  382    HZ2  LYS  48          2HZ       LYS  48  -7.248  -2.595 -10.511
  383    HZ3  LYS  48          3HZ       LYS  48  -7.247  -3.489  -9.078
  384    H    CYS  49           H        CYS  49  -7.035   0.671  -6.002
  385    HA   CYS  49           HA       CYS  49  -5.964   1.709  -8.323
  386    HB2  CYS  49          1HB       CYS  49  -8.218   2.178  -7.829
  387    HB3  CYS  49          2HB       CYS  49  -7.821   2.947  -6.293
  388    H    VAL  50           H        VAL  50  -5.614   3.011  -5.006
  389    HA   VAL  50           HA       VAL  50  -4.079   5.233  -5.692
  390    HB   VAL  50           HB       VAL  50  -4.326   3.692  -3.122
  391   HG11  VAL  50          1HG1      VAL  50  -3.198   5.601  -2.032
  392   HG12  VAL  50          2HG1      VAL  50  -2.796   6.244  -3.621
  393   HG13  VAL  50          3HG1      VAL  50  -2.122   4.699  -3.096
  394   HG21  VAL  50          1HG2      VAL  50  -5.608   5.637  -2.427
  395   HG22  VAL  50          2HG2      VAL  50  -6.278   4.928  -3.897
  396   HG23  VAL  50          3HG2      VAL  50  -5.306   6.398  -3.990
  397    H    PHE  51           H        PHE  51  -3.124   1.987  -4.676
  398    HA   PHE  51           HA       PHE  51  -0.359   2.442  -4.635
  399    HB2  PHE  51          1HB       PHE  51  -2.142   0.082  -4.609
  400    HB3  PHE  51          2HB       PHE  51  -0.493  -0.205  -5.143
  401    HD1  PHE  51           HD1      PHE  51  -1.463   2.311  -2.622
  402    HD2  PHE  51           HD2      PHE  51   0.188  -1.550  -3.320
  403    HE1  PHE  51           HE1      PHE  51  -0.743   2.194  -0.274
  404    HE2  PHE  51           HE2      PHE  51   0.907  -1.672  -0.971
  405    HZ   PHE  51           HZ       PHE  51   0.441   0.203   0.555
  406    H    ASN  52           H        ASN  52  -2.578   1.825  -7.205
  407    HA   ASN  52           HA       ASN  52  -0.530   1.133  -9.129
  408    HB2  ASN  52          1HB       ASN  52  -2.777   0.137  -9.268
  409    HB3  ASN  52          2HB       ASN  52  -3.473   1.743  -9.516
  410   HD21  ASN  52          1HD2      ASN  52  -1.221  -0.601 -10.877
  411   HD22  ASN  52          2HD2      ASN  52  -1.449  -0.132 -12.525
  412    H    LYS  53           H        LYS  53  -2.489   3.912  -8.272
  413    HA   LYS  53           HA       LYS  53  -1.665   5.632 -10.365
  414    HB2  LYS  53          1HB       LYS  53  -2.812   6.065  -7.623
  415    HB3  LYS  53          2HB       LYS  53  -2.349   7.429  -8.629
  416    HG2  LYS  53          1HG       LYS  53  -4.237   5.332  -9.637
  417    HG3  LYS  53          2HG       LYS  53  -4.802   6.645  -8.605
  418    HD2  LYS  53          1HD       LYS  53  -3.879   8.268 -10.225
  419    HD3  LYS  53          2HD       LYS  53  -3.413   6.923 -11.271
  420    HE2  LYS  53          1HE       LYS  53  -5.720   6.260 -11.517
  421    HE3  LYS  53          2HE       LYS  53  -6.232   7.482 -10.357
  422    HZ1  LYS  53          1HZ       LYS  53  -6.609   8.150 -12.668
  423    HZ2  LYS  53          2HZ       LYS  53  -4.947   8.064 -12.969
  424    HZ3  LYS  53          3HZ       LYS  53  -5.550   9.205 -11.870
  425    H    MET  54           H        MET  54  -0.315   4.677  -7.328
  426    HA   MET  54           HA       MET  54   1.717   6.749  -7.314
  427    HB2  MET  54          1HB       MET  54   1.143   4.423  -5.475
  428    HB3  MET  54          2HB       MET  54   2.493   5.524  -5.249
  429    HG2  MET  54          1HG       MET  54  -0.091   6.856  -5.543
  430    HG3  MET  54          2HG       MET  54   0.008   5.784  -4.148
  431    HE1  MET  54          1HE       MET  54   1.327   6.233  -2.024
  432    HE2  MET  54          2HE       MET  54   2.727   7.306  -1.939
  433    HE3  MET  54          3HE       MET  54   2.771   5.878  -2.974
  434    H    GLN  55           H        GLN  55   1.316   4.051  -9.035
  435    HA   GLN  55           HA       GLN  55   2.552   2.488 -10.050
  436    HB2  GLN  55          1HB       GLN  55   4.531   4.723  -9.785
  437    HB3  GLN  55          2HB       GLN  55   4.923   3.231 -10.654
  438    HG2  GLN  55          1HG       GLN  55   3.065   3.607 -12.153
  439    HG3  GLN  55          2HG       GLN  55   2.610   5.052 -11.262
  440   HE21  GLN  55          1HE2      GLN  55   3.319   4.738 -14.055
  441   HE22  GLN  55          2HE2      GLN  55   4.665   5.790 -14.337
  442    H    LEU  56           H        LEU  56   2.203   1.627  -7.668
  443    HA   LEU  56           HA       LEU  56   4.822   0.804  -6.684
  444    HB2  LEU  56          1HB       LEU  56   2.611   2.141  -5.291
  445    HB3  LEU  56          2HB       LEU  56   3.284   0.759  -4.412
  446    HG   LEU  56           HG       LEU  56   4.787   3.184  -5.407
  447   HD11  LEU  56          1HD1      LEU  56   5.023   3.749  -3.048
  448   HD12  LEU  56          2HD1      LEU  56   4.048   2.351  -2.609
  449   HD13  LEU  56          3HD1      LEU  56   3.323   3.677  -3.510
  450   HD21  LEU  56          1HD2      LEU  56   6.291   1.344  -5.450
  451   HD22  LEU  56          2HD2      LEU  56   5.691   0.746  -3.903
  452   HD23  LEU  56          3HD2      LEU  56   6.616   2.245  -3.967
  453    H    PHE  57           H        PHE  57   1.680  -0.081  -7.664
  454    HA   PHE  57           HA       PHE  57   2.289  -2.886  -7.111
  455    HB2  PHE  57          1HB       PHE  57   0.791  -2.269  -5.283
  456    HB3  PHE  57          2HB       PHE  57  -0.350  -1.559  -6.418
  457    HD1  PHE  57           HD1      PHE  57  -1.907  -2.908  -7.616
  458    HD2  PHE  57           HD2      PHE  57   1.071  -4.715  -5.167
  459    HE1  PHE  57           HE1      PHE  57  -3.085  -5.058  -7.778
  460    HE2  PHE  57           HE2      PHE  57  -0.104  -6.868  -5.329
  461    HZ   PHE  57           HZ       PHE  57  -2.183  -7.043  -6.636
  462    H    ASP  58           H        ASP  58   1.812  -4.180  -8.756
  463    HA   ASP  58           HA       ASP  58   0.150  -3.117 -10.945
  464    HB2  ASP  58          1HB       ASP  58   2.508  -3.228 -11.627
  465    HB3  ASP  58          2HB       ASP  58   2.582  -4.918 -11.143
  466    H    ASP  59           H        ASP  59  -1.247  -4.596 -11.943
  467    HA   ASP  59           HA       ASP  59  -2.348  -6.470 -10.087
  468    HB2  ASP  59          1HB       ASP  59  -3.101  -5.952 -12.964
  469    HB3  ASP  59          2HB       ASP  59  -4.064  -6.819 -11.786
  470    H    THR  60           H        THR  60  -0.075  -6.692 -12.594
  471    HA   THR  60           HA       THR  60  -0.467  -9.563 -12.921
  472    HB   THR  60           HB       THR  60   1.221  -7.539 -14.369
  473    HG1  THR  60           HG1      THR  60  -0.498  -7.482 -15.559
  474   HG21  THR  60          1HG2      THR  60   1.135 -10.520 -14.820
  475   HG22  THR  60          2HG2      THR  60   2.513  -9.594 -14.220
  476   HG23  THR  60          3HG2      THR  60   1.930  -9.342 -15.865
  477    H    GLU  61           H        GLU  61   2.353  -7.402 -12.453
  478    HA   GLU  61           HA       GLU  61   4.023  -9.497 -11.502
  479    HB2  GLU  61          1HB       GLU  61   4.528  -6.590 -10.990
  480    HB3  GLU  61          2HB       GLU  61   5.683  -7.883 -11.252
  481    HG2  GLU  61          1HG       GLU  61   4.971  -8.033 -13.590
  482    HG3  GLU  61          2HG       GLU  61   3.870  -6.686 -13.323
  483    H    GLY  62           H        GLY  62   1.767  -7.396  -9.957
  484    HA2  GLY  62          1HA       GLY  62   1.036  -7.512  -7.736
  485    HA3  GLY  62          2HA       GLY  62   2.436  -8.526  -7.359
  486    HA   PRO  63           HA       PRO  63   3.383  -4.498  -5.336
  487    HB2  PRO  63          1HB       PRO  63   5.188  -6.364  -3.892
  488    HB3  PRO  63          2HB       PRO  63   4.082  -5.139  -3.252
  489    HG2  PRO  63          1HG       PRO  63   3.524  -7.761  -3.083
  490    HG3  PRO  63          2HG       PRO  63   2.254  -6.550  -3.345
  491    HD2  PRO  63          1HD       PRO  63   3.521  -8.433  -5.297
  492    HD3  PRO  63          2HD       PRO  63   1.832  -7.873  -5.193
  493    H    LEU  64           H        LEU  64   4.746  -3.270  -6.442
  494    HA   LEU  64           HA       LEU  64   6.934  -4.423  -7.931
  495    HB2  LEU  64          1HB       LEU  64   6.245  -1.500  -7.597
  496    HB3  LEU  64          2HB       LEU  64   7.277  -2.212  -8.820
  497    HG   LEU  64           HG       LEU  64   4.330  -2.791  -8.592
  498   HD11  LEU  64          1HD1      LEU  64   5.791  -0.940 -10.469
  499   HD12  LEU  64          2HD1      LEU  64   4.688  -0.453  -9.181
  500   HD13  LEU  64          3HD1      LEU  64   4.083  -1.367 -10.562
  501   HD21  LEU  64          1HD2      LEU  64   6.325  -3.384 -10.766
  502   HD22  LEU  64          2HD2      LEU  64   4.608  -3.792 -10.775
  503   HD23  LEU  64          3HD2      LEU  64   5.694  -4.554  -9.608
  504    H    VAL  65           H        VAL  65   8.270  -5.218  -6.408
  505    HA   VAL  65           HA       VAL  65   9.057  -4.194  -4.011
  506    HB   VAL  65           HB       VAL  65  10.660  -5.870  -5.926
  507   HG11  VAL  65          1HG1      VAL  65  12.162  -4.822  -4.325
  508   HG12  VAL  65          2HG1      VAL  65  11.992  -6.544  -3.982
  509   HG13  VAL  65          3HG1      VAL  65  11.138  -5.360  -2.992
  510   HG21  VAL  65          1HG2      VAL  65   8.889  -6.545  -3.593
  511   HG22  VAL  65          2HG2      VAL  65   9.928  -7.703  -4.425
  512   HG23  VAL  65          3HG2      VAL  65   8.608  -6.921  -5.292
  513    H    ASP  66           H        ASP  66  10.597  -3.570  -7.161
  514    HA   ASP  66           HA       ASP  66  12.840  -2.227  -6.135
  515    HB2  ASP  66          1HB       ASP  66  12.715  -3.110  -8.414
  516    HB3  ASP  66          2HB       ASP  66  11.530  -1.878  -8.831
  517    H    ASN  67           H        ASN  67   9.800  -0.881  -7.461
  518    HA   ASN  67           HA       ASN  67  10.426   1.806  -6.853
  519    HB2  ASN  67          1HB       ASN  67   7.776   0.433  -7.297
  520    HB3  ASN  67          2HB       ASN  67   7.923   2.158  -7.011
  521   HD21  ASN  67          1HD2      ASN  67   7.073   2.675  -9.019
  522   HD22  ASN  67          2HD2      ASN  67   7.971   2.449 -10.483
  523    H    LEU  68           H        LEU  68   8.940  -0.786  -5.052
  524    HA   LEU  68           HA       LEU  68   7.887   0.672  -2.910
  525    HB2  LEU  68          1HB       LEU  68   8.762  -2.159  -3.284
  526    HB3  LEU  68          2HB       LEU  68   8.352  -1.590  -1.675
  527    HG   LEU  68           HG       LEU  68   6.464  -1.291  -3.997
  528   HD11  LEU  68          1HD1      LEU  68   7.033  -3.669  -3.721
  529   HD12  LEU  68          2HD1      LEU  68   5.363  -3.325  -3.274
  530   HD13  LEU  68          3HD1      LEU  68   6.582  -3.566  -2.019
  531   HD21  LEU  68          1HD2      LEU  68   6.058  -1.344  -1.012
  532   HD22  LEU  68          2HD2      LEU  68   4.800  -1.125  -2.229
  533   HD23  LEU  68          3HD2      LEU  68   6.056   0.095  -2.030
  534    H    VAL  69           H        VAL  69  11.057  -0.861  -3.302
  535    HA   VAL  69           HA       VAL  69  12.067  -0.059  -0.775
  536    HB   VAL  69           HB       VAL  69  13.554  -0.823  -3.282
  537   HG11  VAL  69          1HG1      VAL  69  14.454  -0.650  -0.416
  538   HG12  VAL  69          2HG1      VAL  69  15.006   0.354  -1.758
  539   HG13  VAL  69          3HG1      VAL  69  15.395  -1.367  -1.724
  540   HG21  VAL  69          1HG2      VAL  69  11.988  -2.542  -2.466
  541   HG22  VAL  69          2HG2      VAL  69  12.796  -2.504  -0.896
  542   HG23  VAL  69          3HG2      VAL  69  13.672  -3.041  -2.331
  543    H    HIS  70           H        HIS  70  12.149   1.390  -4.001
  544    HA   HIS  70           HA       HIS  70  13.931   3.498  -3.357
  545    HB2  HIS  70          1HB       HIS  70  11.814   3.244  -5.493
  546    HB3  HIS  70          2HB       HIS  70  12.864   4.650  -5.355
  547    HD1  HIS  70           HD1      HIS  70  13.406   3.644  -7.890
  548    HD2  HIS  70           HD2      HIS  70  14.966   1.631  -4.608
  549    HE1  HIS  70           HE1      HIS  70  15.267   2.224  -8.793
  550    HE2  HIS  70           HE2      HIS  70  16.043   0.859  -6.823
  551    H    GLN  71           H        GLN  71  10.494   3.094  -2.985
  552    HA   GLN  71           HA       GLN  71  10.001   5.866  -2.343
  553    HB2  GLN  71          1HB       GLN  71   8.355   4.348  -3.502
  554    HB3  GLN  71          2HB       GLN  71   8.169   3.495  -1.974
  555    HG2  GLN  71          1HG       GLN  71   6.370   5.110  -2.362
  556    HG3  GLN  71          2HG       GLN  71   7.301   5.457  -0.910
  557   HE21  GLN  71          1HE2      GLN  71   8.459   7.318  -0.770
  558   HE22  GLN  71          2HE2      GLN  71   8.367   8.580  -1.937
  559    H    LEU  72           H        LEU  72   9.601   2.818  -0.554
  560    HA   LEU  72           HA       LEU  72   9.160   4.037   1.930
  561    HB2  LEU  72          1HB       LEU  72  10.105   1.260   1.239
  562    HB3  LEU  72          2HB       LEU  72   9.710   1.761   2.868
  563    HG   LEU  72           HG       LEU  72   7.767   1.788   0.557
  564   HD11  LEU  72          1HD1      LEU  72   6.788  -0.198   1.598
  565   HD12  LEU  72          2HD1      LEU  72   8.070  -0.205   2.809
  566   HD13  LEU  72          3HD1      LEU  72   8.457  -0.498   1.113
  567   HD21  LEU  72          1HD2      LEU  72   7.444   2.240   3.518
  568   HD22  LEU  72          2HD2      LEU  72   6.098   1.929   2.422
  569   HD23  LEU  72          3HD2      LEU  72   7.095   3.368   2.206
  570    H    ALA  73           H        ALA  73  12.092   2.477   0.631
  571    HA   ALA  73           HA       ALA  73  13.612   3.237   2.959
  572    HB1  ALA  73          1HB       ALA  73  14.562   1.877   0.461
  573    HB2  ALA  73          2HB       ALA  73  13.861   1.054   1.846
  574    HB3  ALA  73          3HB       ALA  73  15.374   1.937   2.026
  575    H    HIS  74           H        HIS  74  12.683   5.478   1.250
  576    HA   HIS  74           HA       HIS  74  14.932   6.376  -0.256
  577    HB2  HIS  74          1HB       HIS  74  13.812   8.490  -0.501
  578    HB3  HIS  74          2HB       HIS  74  12.597   7.229  -0.639
  579    HD1  HIS  74           HD1      HIS  74  13.072  10.416   0.803
  580    HD2  HIS  74           HD2      HIS  74  11.258   6.912   2.112
  581    HE1  HIS  74           HE1      HIS  74  11.506  11.114   2.637
  582    HE2  HIS  74           HE2      HIS  74  10.328   9.001   3.334
  583    H    GLY  75           H        GLY  75  16.835   6.735   0.633
  584    HA2  GLY  75          1HA       GLY  75  18.454   7.547   2.056
  585    HA3  GLY  75          2HA       GLY  75  17.225   8.588   2.766
  586    H    ARG  76           H        ARG  76  17.191   5.070   2.538
  587    HA   ARG  76           HA       ARG  76  17.502   4.803   5.414
  588    HB2  ARG  76          1HB       ARG  76  14.922   4.477   3.947
  589    HB3  ARG  76          2HB       ARG  76  15.236   3.435   5.336
  590    HG2  ARG  76          1HG       ARG  76  15.482   5.352   6.760
  591    HG3  ARG  76          2HG       ARG  76  15.348   6.448   5.387
  592    HD2  ARG  76          1HD       ARG  76  13.058   5.631   4.997
  593    HD3  ARG  76          2HD       ARG  76  13.204   4.612   6.429
  594    HE   ARG  76           HE       ARG  76  12.793   6.446   7.723
  595   HH11  ARG  76          1HH1      ARG  76  13.852   7.584   4.570
  596   HH12  ARG  76          2HH1      ARG  76  13.495   9.244   4.915
  597   HH21  ARG  76          1HH2      ARG  76  12.311   8.632   8.157
  598   HH22  ARG  76          2HH2      ARG  76  12.612   9.840   6.948
  599    H    ASP  77           H        ASP  77  17.234   2.361   6.001
  600    HA   ASP  77           HA       ASP  77  19.103   0.922   4.465
  601    HB2  ASP  77          1HB       ASP  77  17.197  -0.026   6.602
  602    HB3  ASP  77          2HB       ASP  77  18.461  -1.023   5.897
  603    H    ALA  78           H        ALA  78  18.467   0.730   2.393
  604    HA   ALA  78           HA       ALA  78  15.991  -0.074   1.423
  605    HB1  ALA  78          1HB       ALA  78  18.691  -0.550   0.185
  606    HB2  ALA  78          2HB       ALA  78  17.760   0.942   0.067
  607    HB3  ALA  78          3HB       ALA  78  17.140  -0.543  -0.654
  608    H    GLU  79           H        GLU  79  18.757  -1.973   2.450
  609    HA   GLU  79           HA       GLU  79  17.904  -4.463   1.458
  610    HB2  GLU  79          1HB       GLU  79  19.726  -3.756   3.747
  611    HB3  GLU  79          2HB       GLU  79  19.460  -5.405   3.199
  612    HG2  GLU  79          1HG       GLU  79  20.282  -4.759   0.969
  613    HG3  GLU  79          2HG       GLU  79  20.631  -3.148   1.590
  614    H    GLU  80           H        GLU  80  17.508  -2.992   4.683
  615    HA   GLU  80           HA       GLU  80  16.051  -5.151   5.781
  616    HB2  GLU  80          1HB       GLU  80  16.101  -2.236   6.543
  617    HB3  GLU  80          2HB       GLU  80  15.327  -3.496   7.494
  618    HG2  GLU  80          1HG       GLU  80  17.593  -4.611   7.587
  619    HG3  GLU  80          2HG       GLU  80  18.243  -3.114   6.936
  620    H    VAL  81           H        VAL  81  15.067  -2.100   4.282
  621    HA   VAL  81           HA       VAL  81  12.314  -2.339   4.581
  622    HB   VAL  81           HB       VAL  81  13.957  -0.965   2.474
  623   HG11  VAL  81          1HG1      VAL  81  11.807  -1.353   1.474
  624   HG12  VAL  81          2HG1      VAL  81  11.884   0.334   1.985
  625   HG13  VAL  81          3HG1      VAL  81  10.984  -0.841   2.947
  626   HG21  VAL  81          1HG2      VAL  81  14.289  -0.074   4.647
  627   HG22  VAL  81          2HG2      VAL  81  12.558  -0.064   4.972
  628   HG23  VAL  81          3HG2      VAL  81  13.235   1.045   3.777
  629    H    ARG  82           H        ARG  82  14.303  -3.254   1.751
  630    HA   ARG  82           HA       ARG  82  12.358  -4.437   0.178
  631    HB2  ARG  82          1HB       ARG  82  14.718  -3.982  -0.465
  632    HB3  ARG  82          2HB       ARG  82  15.213  -5.360   0.508
  633    HG2  ARG  82          1HG       ARG  82  13.985  -6.862  -0.905
  634    HG3  ARG  82          2HG       ARG  82  13.332  -5.508  -1.825
  635    HD2  ARG  82          1HD       ARG  82  15.225  -6.638  -2.954
  636    HD3  ARG  82          2HD       ARG  82  15.513  -4.929  -2.634
  637    HE   ARG  82           HE       ARG  82  16.578  -7.022  -0.855
  638   HH11  ARG  82          1HH1      ARG  82  17.060  -4.230  -2.907
  639   HH12  ARG  82          2HH1      ARG  82  18.720  -4.023  -2.455
  640   HH21  ARG  82          1HH2      ARG  82  18.764  -6.749  -0.249
  641   HH22  ARG  82          2HH2      ARG  82  19.691  -5.459  -0.945
  642    H    THR  83           H        THR  83  14.290  -5.802   2.785
  643    HA   THR  83           HA       THR  83  13.526  -8.483   2.552
  644    HB   THR  83           HB       THR  83  14.507  -6.810   4.855
  645    HG1  THR  83           HG1      THR  83  16.121  -7.167   3.445
  646   HG21  THR  83          1HG2      THR  83  13.175  -8.643   5.798
  647   HG22  THR  83          2HG2      THR  83  14.896  -8.855   6.123
  648   HG23  THR  83          3HG2      THR  83  14.115  -9.804   4.859
  649    H    GLU  84           H        GLU  84  12.264  -5.939   4.706
  650    HA   GLU  84           HA       GLU  84  10.201  -7.440   5.851
  651    HB2  GLU  84          1HB       GLU  84  10.599  -4.489   5.500
  652    HB3  GLU  84          2HB       GLU  84   9.147  -5.133   6.251
  653    HG2  GLU  84          1HG       GLU  84  11.970  -5.558   7.170
  654    HG3  GLU  84          2HG       GLU  84  10.760  -4.532   7.937
  655    H    VAL  85           H        VAL  85  10.179  -5.392   2.946
  656    HA   VAL  85           HA       VAL  85   7.477  -5.577   2.306
  657    HB   VAL  85           HB       VAL  85   9.932  -5.376   0.567
  658   HG11  VAL  85          1HG1      VAL  85   8.250  -6.515  -0.754
  659   HG12  VAL  85          2HG1      VAL  85   8.440  -4.851  -1.320
  660   HG13  VAL  85          3HG1      VAL  85   7.052  -5.293  -0.321
  661   HG21  VAL  85          1HG2      VAL  85   7.760  -3.417   1.293
  662   HG22  VAL  85          2HG2      VAL  85   9.126  -3.088   0.225
  663   HG23  VAL  85          3HG2      VAL  85   9.405  -3.443   1.932
  664    H    LEU  86           H        LEU  86  10.150  -7.751   1.445
  665    HA   LEU  86           HA       LEU  86   8.730  -9.501  -0.180
  666    HB2  LEU  86          1HB       LEU  86  11.176  -9.925   1.526
  667    HB3  LEU  86          2HB       LEU  86  10.555 -11.138   0.407
  668    HG   LEU  86           HG       LEU  86  11.337  -8.365  -0.458
  669   HD11  LEU  86          1HD1      LEU  86  13.449  -9.285  -1.173
  670   HD12  LEU  86          2HD1      LEU  86  12.997 -10.876  -0.561
  671   HD13  LEU  86          3HD1      LEU  86  13.251  -9.539   0.562
  672   HD21  LEU  86          1HD2      LEU  86  10.861 -10.947  -1.932
  673   HD22  LEU  86          2HD2      LEU  86  11.468  -9.462  -2.665
  674   HD23  LEU  86          3HD2      LEU  86   9.847  -9.505  -1.973
  675    H    LYS  87           H        LYS  87   8.940  -9.356   3.317
  676    HA   LYS  87           HA       LYS  87   7.906 -11.939   3.878
  677    HB2  LYS  87          1HB       LYS  87   7.897  -9.367   5.457
  678    HB3  LYS  87          2HB       LYS  87   7.180 -10.850   6.073
  679    HG2  LYS  87          1HG       LYS  87   9.371 -11.958   5.857
  680    HG3  LYS  87          2HG       LYS  87  10.067 -10.409   5.347
  681    HD2  LYS  87          1HD       LYS  87   9.396  -9.413   7.474
  682    HD3  LYS  87          2HD       LYS  87   8.689 -10.949   7.979
  683    HE2  LYS  87          1HE       LYS  87  10.818 -10.796   9.013
  684    HE3  LYS  87          2HE       LYS  87  10.967 -11.969   7.706
  685    HZ1  LYS  87          1HZ       LYS  87  11.792  -9.118   7.557
  686    HZ2  LYS  87          2HZ       LYS  87  11.981 -10.282   6.332
  687    HZ3  LYS  87          3HZ       LYS  87  12.838 -10.435   7.780
  688    H    CYS  88           H        CYS  88   6.481  -9.073   2.708
  689    HA   CYS  88           HA       CYS  88   3.798  -9.965   3.473
  690    HB2  CYS  88          1HB       CYS  88   4.977  -7.284   2.835
  691    HB3  CYS  88          2HB       CYS  88   3.221  -7.539   2.722
  692    H    VAL  89           H        VAL  89   5.931  -9.857   0.874
  693    HA   VAL  89           HA       VAL  89   3.968  -9.643  -1.220
  694    HB   VAL  89           HB       VAL  89   6.824 -10.622  -1.349
  695   HG11  VAL  89          1HG1      VAL  89   6.589 -10.144  -3.773
  696   HG12  VAL  89          2HG1      VAL  89   4.868  -9.857  -3.505
  697   HG13  VAL  89          3HG1      VAL  89   5.551 -11.454  -3.210
  698   HG21  VAL  89          1HG2      VAL  89   6.811  -8.334  -0.644
  699   HG22  VAL  89          2HG2      VAL  89   5.636  -7.907  -1.887
  700   HG23  VAL  89          3HG2      VAL  89   7.271  -8.386  -2.344
  701    H    ASP  90           H        ASP  90   2.845 -11.246  -2.097
  702    HA   ASP  90           HA       ASP  90   3.687 -13.988  -1.932
  703    HB2  ASP  90          1HB       ASP  90   2.468 -13.460   0.250
  704    HB3  ASP  90          2HB       ASP  90   1.018 -13.257  -0.735
  705    H    LYS  91           H        LYS  91   1.908 -15.390  -3.024
  706    HA   LYS  91           HA       LYS  91   1.532 -14.202  -5.609
  707    HB2  LYS  91          1HB       LYS  91   0.447 -16.879  -4.788
  708    HB3  LYS  91          2HB       LYS  91   1.025 -16.352  -6.364
  709    HG2  LYS  91          1HG       LYS  91   3.307 -16.234  -5.437
  710    HG3  LYS  91          2HG       LYS  91   2.687 -16.918  -3.936
  711    HD2  LYS  91          1HD       LYS  91   1.890 -18.883  -5.235
  712    HD3  LYS  91          2HD       LYS  91   2.684 -18.208  -6.659
  713    HE2  LYS  91          1HE       LYS  91   3.983 -19.085  -4.087
  714    HE3  LYS  91          2HE       LYS  91   4.138 -19.842  -5.670
  715    HZ1  LYS  91          1HZ       LYS  91   5.213 -17.801  -6.464
  716    HZ2  LYS  91          2HZ       LYS  91   6.071 -18.524  -5.199
  717    HZ3  LYS  91          3HZ       LYS  91   5.130 -17.151  -4.904
  718    H    ASN  92           H        ASN  92  -0.451 -14.234  -6.792
  719    HA   ASN  92           HA       ASN  92  -2.617 -13.066  -5.325
  720    HB2  ASN  92          1HB       ASN  92  -1.994 -12.343  -7.614
  721    HB3  ASN  92          2HB       ASN  92  -2.490 -13.915  -8.216
  722   HD21  ASN  92          1HD2      ASN  92  -3.959 -12.874  -9.590
  723   HD22  ASN  92          2HD2      ASN  92  -5.476 -12.278  -9.008
  724    H    THR  93           H        THR  93  -2.798 -15.050  -3.963
  725    HA   THR  93           HA       THR  93  -4.379 -17.196  -5.108
  726    HB   THR  93           HB       THR  93  -4.412 -18.059  -2.773
  727    HG1  THR  93           HG1      THR  93  -4.234 -16.227  -1.524
  728   HG21  THR  93          1HG2      THR  93  -2.646 -18.738  -4.286
  729   HG22  THR  93          2HG2      THR  93  -2.011 -18.560  -2.652
  730   HG23  THR  93          3HG2      THR  93  -1.702 -17.311  -3.858
  731    H    ASP  94           H        ASP  94  -5.000 -14.116  -4.188
  732    HA   ASP  94           HA       ASP  94  -7.517 -14.579  -2.833
  733    HB2  ASP  94          1HB       ASP  94  -6.302 -12.005  -3.872
  734    HB3  ASP  94          2HB       ASP  94  -7.747 -12.124  -2.863
  735    H    ASN  95           H        ASN  95  -6.347 -14.187  -6.008
  736    HA   ASN  95           HA       ASN  95  -7.275 -14.151  -8.057
  737    HB2  ASN  95          1HB       ASN  95  -8.463 -16.124  -7.235
  738    HB3  ASN  95          2HB       ASN  95  -9.727 -15.113  -6.568
  739   HD21  ASN  95          1HD2      ASN  95  -8.232 -16.235  -9.522
  740   HD22  ASN  95          2HD2      ASN  95  -9.610 -15.966 -10.543
  741    H    ASN  96           H        ASN  96  -7.479 -11.862  -6.137
  742    HA   ASN  96           HA       ASN  96  -9.254 -10.194  -7.705
  743    HB2  ASN  96          1HB       ASN  96 -10.813 -10.959  -6.059
  744    HB3  ASN  96          2HB       ASN  96  -9.649 -10.737  -4.755
  745   HD21  ASN  96          1HD2      ASN  96 -11.807  -9.159  -6.981
  746   HD22  ASN  96          2HD2      ASN  96 -11.875  -7.646  -6.145
  747    H    ALA  97           H        ALA  97  -8.119  -8.440  -8.150
  748    HA   ALA  97           HA       ALA  97  -5.573  -7.949  -7.098
  749    HB1  ALA  97          1HB       ALA  97  -7.332  -6.033  -8.619
  750    HB2  ALA  97          2HB       ALA  97  -6.295  -7.262  -9.342
  751    HB3  ALA  97          3HB       ALA  97  -5.581  -5.930  -8.433
  752    H    CYS  98           H        CYS  98  -8.717  -6.603  -6.247
  753    HA   CYS  98           HA       CYS  98  -7.818  -4.413  -4.735
  754    HB2  CYS  98          1HB       CYS  98 -10.308  -6.066  -4.247
  755    HB3  CYS  98          2HB       CYS  98 -10.002  -4.443  -3.643
  756    H    HIS  99           H        HIS  99  -8.389  -7.800  -3.783
  757    HA   HIS  99           HA       HIS  99  -7.756  -7.184  -1.023
  758    HB2  HIS  99          1HB       HIS  99  -9.444  -8.958  -1.839
  759    HB3  HIS  99          2HB       HIS  99  -8.033  -9.962  -2.156
  760    HD1  HIS  99           HD1      HIS  99  -6.972 -11.146  -0.172
  761    HD2  HIS  99           HD2      HIS  99  -9.877  -8.380   0.945
  762    HE1  HIS  99           HE1      HIS  99  -7.299 -11.457   2.301
  763    HE2  HIS  99           HE2      HIS  99  -9.190  -9.912   2.908
  764    H    TRP 100           H        TRP 100  -6.121  -8.305  -3.833
  765    HA   TRP 100           HA       TRP 100  -3.933  -9.592  -2.582
  766    HB2  TRP 100          1HB       TRP 100  -4.536  -9.815  -5.004
  767    HB3  TRP 100          2HB       TRP 100  -3.942  -8.175  -5.264
  768    HD1  TRP 100           HD1      TRP 100  -1.729  -9.977  -2.884
  769    HE1  TRP 100           HE1      TRP 100   0.385 -10.819  -4.086
  770    HE3  TRP 100           HE3      TRP 100  -3.192  -9.236  -7.727
  771    HZ2  TRP 100           HZ2      TRP 100   1.307 -11.142  -6.733
  772    HZ3  TRP 100           HZ3      TRP 100  -1.641  -9.838  -9.530
  773    HH2  TRP 100           HH2      TRP 100   0.562 -10.774  -9.053
  774    H    ALA 101           H        ALA 101  -4.238  -6.324  -3.976
  775    HA   ALA 101           HA       ALA 101  -1.757  -5.369  -3.032
  776    HB1  ALA 101          1HB       ALA 101  -2.940  -4.278  -4.843
  777    HB2  ALA 101          2HB       ALA 101  -2.669  -3.135  -3.525
  778    HB3  ALA 101          3HB       ALA 101  -4.262  -3.857  -3.757
  779    H    PHE 102           H        PHE 102  -4.989  -5.411  -1.684
  780    HA   PHE 102           HA       PHE 102  -4.477  -3.708   0.492
  781    HB2  PHE 102          1HB       PHE 102  -6.731  -4.215  -0.314
  782    HB3  PHE 102          2HB       PHE 102  -6.566  -5.874   0.250
  783    HD1  PHE 102           HD1      PHE 102  -7.279  -6.418   2.405
  784    HD2  PHE 102           HD2      PHE 102  -6.456  -2.353   1.439
  785    HE1  PHE 102           HE1      PHE 102  -8.149  -5.725   4.598
  786    HE2  PHE 102           HE2      PHE 102  -7.321  -1.655   3.635
  787    HZ   PHE 102           HZ       PHE 102  -8.167  -3.338   5.217
  788    H    ARG 103           H        ARG 103  -3.996  -7.129  -0.045
  789    HA   ARG 103           HA       ARG 103  -3.627  -7.870   2.679
  790    HB2  ARG 103          1HB       ARG 103  -4.100  -9.435   0.714
  791    HB3  ARG 103          2HB       ARG 103  -2.399  -9.262   0.307
  792    HG2  ARG 103          1HG       ARG 103  -2.257  -9.881   2.936
  793    HG3  ARG 103          2HG       ARG 103  -3.687 -10.784   2.441
  794    HD2  ARG 103          1HD       ARG 103  -0.955 -10.937   1.167
  795    HD3  ARG 103          2HD       ARG 103  -1.671 -12.147   2.225
  796    HE   ARG 103           HE       ARG 103  -3.290 -11.614  -0.072
  797   HH11  ARG 103          1HH1      ARG 103  -0.566 -13.404   1.161
  798   HH12  ARG 103          2HH1      ARG 103  -0.593 -14.584  -0.109
  799   HH21  ARG 103          1HH2      ARG 103  -3.371 -13.175  -1.735
  800   HH22  ARG 103          2HH2      ARG 103  -2.191 -14.461  -1.751
  801    H    GLY 104           H        GLY 104  -1.475  -6.906   0.050
  802    HA2  GLY 104          1HA       GLY 104   0.972  -7.278   1.417
  803    HA3  GLY 104          2HA       GLY 104   0.709  -6.198   0.043
  804    H    PHE 105           H        PHE 105  -1.130  -4.456   1.074
  805    HA   PHE 105           HA       PHE 105   0.539  -2.670   2.470
  806    HB2  PHE 105          1HB       PHE 105  -1.075  -1.806   0.945
  807    HB3  PHE 105          2HB       PHE 105  -2.390  -2.608   1.789
  808    HD1  PHE 105           HD1      PHE 105  -3.798  -1.012   2.700
  809    HD2  PHE 105           HD2      PHE 105   0.417  -0.431   2.910
  810    HE1  PHE 105           HE1      PHE 105  -4.149   1.046   3.992
  811    HE2  PHE 105           HE2      PHE 105   0.062   1.631   4.202
  812    HZ   PHE 105           HZ       PHE 105  -2.218   2.371   4.745
  813    H    LYS 106           H        LYS 106  -2.262  -4.593   3.443
  814    HA   LYS 106           HA       LYS 106  -2.461  -3.596   6.065
  815    HB2  LYS 106          1HB       LYS 106  -4.403  -4.619   5.433
  816    HB3  LYS 106          2HB       LYS 106  -3.586  -5.934   4.593
  817    HG2  LYS 106          1HG       LYS 106  -3.055  -6.952   6.760
  818    HG3  LYS 106          2HG       LYS 106  -3.875  -5.616   7.574
  819    HD2  LYS 106          1HD       LYS 106  -5.978  -6.229   6.609
  820    HD3  LYS 106          2HD       LYS 106  -5.206  -7.430   5.574
  821    HE2  LYS 106          1HE       LYS 106  -5.236  -7.529   8.586
  822    HE3  LYS 106          2HE       LYS 106  -6.360  -8.403   7.547
  823    HZ1  LYS 106          1HZ       LYS 106  -3.416  -8.760   7.675
  824    HZ2  LYS 106          2HZ       LYS 106  -4.419  -9.512   6.539
  825    HZ3  LYS 106          3HZ       LYS 106  -4.598  -9.859   8.182
  826    H    CYS 107           H        CYS 107  -0.778  -6.369   4.699
  827    HA   CYS 107           HA       CYS 107   0.121  -7.519   7.082
  828    HB2  CYS 107          1HB       CYS 107   0.250  -8.831   5.133
  829    HB3  CYS 107          2HB       CYS 107   1.114  -7.589   4.238
  830    H    PHE 108           H        PHE 108   1.470  -4.985   5.045
  831    HA   PHE 108           HA       PHE 108   4.022  -5.032   6.315
  832    HB2  PHE 108          1HB       PHE 108   3.532  -4.395   3.915
  833    HB3  PHE 108          2HB       PHE 108   2.944  -2.856   4.538
  834    HD1  PHE 108           HD1      PHE 108   4.487  -1.195   5.360
  835    HD2  PHE 108           HD2      PHE 108   5.884  -4.985   4.028
  836    HE1  PHE 108           HE1      PHE 108   6.784  -0.325   5.309
  837    HE2  PHE 108           HE2      PHE 108   8.182  -4.121   3.980
  838    HZ   PHE 108           HZ       PHE 108   8.635  -1.791   4.614
  839    H    GLN 109           H        GLN 109   1.235  -2.794   6.414
  840    HA   GLN 109           HA       GLN 109   2.485  -0.909   8.109
  841    HB2  GLN 109          1HB       GLN 109   0.372   0.123   8.356
  842    HB3  GLN 109          2HB       GLN 109   0.428  -0.492   6.711
  843    HG2  GLN 109          1HG       GLN 109  -1.000  -2.325   7.286
  844    HG3  GLN 109          2HG       GLN 109  -0.917  -1.913   9.002
  845   HE21  GLN 109          1HE2      GLN 109  -3.120  -1.631   9.250
  846   HE22  GLN 109          2HE2      GLN 109  -3.983  -0.320   8.529
  847    H    LYS 110           H        LYS 110   1.061  -3.961   8.738
  848    HA   LYS 110           HA       LYS 110   0.149  -3.611  11.363
  849    HB2  LYS 110          1HB       LYS 110  -0.325  -5.564   9.901
  850    HB3  LYS 110          2HB       LYS 110   1.331  -6.104  10.133
  851    HG2  LYS 110          1HG       LYS 110   0.858  -6.204  12.576
  852    HG3  LYS 110          2HG       LYS 110  -0.824  -5.850  12.206
  853    HD2  LYS 110          1HD       LYS 110  -0.813  -7.863  10.697
  854    HD3  LYS 110          2HD       LYS 110   0.764  -8.265  11.378
  855    HE2  LYS 110          1HE       LYS 110  -1.002  -9.492  12.516
  856    HE3  LYS 110          2HE       LYS 110  -0.229  -8.352  13.615
  857    HZ1  LYS 110          1HZ       LYS 110  -2.065  -6.849  13.354
  858    HZ2  LYS 110          2HZ       LYS 110  -2.660  -8.367  13.799
  859    HZ3  LYS 110          3HZ       LYS 110  -2.784  -7.849  12.196
  860    H    ASN 111           H        ASN 111   3.351  -4.232  10.063
  861    HA   ASN 111           HA       ASN 111   4.391  -4.205  12.822
  862    HB2  ASN 111          1HB       ASN 111   5.505  -5.707  10.449
  863    HB3  ASN 111          2HB       ASN 111   6.250  -5.608  12.045
  864   HD21  ASN 111          1HD2      ASN 111   5.109  -7.872  10.409
  865   HD22  ASN 111          2HD2      ASN 111   4.036  -8.670  11.502
  866    H    ASN 112           H        ASN 112   4.476  -2.684   9.759
  867    HA   ASN 112           HA       ASN 112   6.686  -1.003  10.702
  868    HB2  ASN 112          1HB       ASN 112   6.561  -2.237   7.937
  869    HB3  ASN 112          2HB       ASN 112   7.667  -0.946   8.411
  870   HD21  ASN 112          1HD2      ASN 112   7.218  -4.266   8.187
  871   HD22  ASN 112          2HD2      ASN 112   8.602  -4.768   9.096
  872    H    LEU 113           H        LEU 113   4.609   0.255  11.137
  873    HA   LEU 113           HA       LEU 113   3.448   1.456   8.755
  874    HB2  LEU 113          1HB       LEU 113   1.908   0.911  10.500
  875    HB3  LEU 113          2HB       LEU 113   2.832   1.810  11.684
  876    HG   LEU 113           HG       LEU 113   2.264   3.903  10.441
  877   HD11  LEU 113          1HD1      LEU 113   0.401   2.104   8.901
  878   HD12  LEU 113          2HD1      LEU 113   1.868   2.838   8.255
  879   HD13  LEU 113          3HD1      LEU 113   0.523   3.858   8.769
  880   HD21  LEU 113          1HD2      LEU 113  -0.065   3.981  11.204
  881   HD22  LEU 113          2HD2      LEU 113   0.987   3.212  12.394
  882   HD23  LEU 113          3HD2      LEU 113  -0.060   2.224  11.376
  883    H    SER 114           H        SER 114   5.658   2.276  11.334
  884    HA   SER 114           HA       SER 114   5.679   5.075  10.991
  885    HB2  SER 114          1HB       SER 114   7.952   3.320  11.954
  886    HB3  SER 114          2HB       SER 114   7.764   5.049  12.245
  887    HG   SER 114           HG       SER 114   6.506   2.891  13.449
  888    H    LEU 115           H        LEU 115   7.396   2.480   9.363
  889    HA   LEU 115           HA       LEU 115   9.191   4.107   7.897
  890    HB2  LEU 115          1HB       LEU 115   9.486   1.688   8.193
  891    HB3  LEU 115          2HB       LEU 115   8.055   1.398   7.227
  892    HG   LEU 115           HG       LEU 115   9.217   2.482   5.295
  893   HD11  LEU 115          1HD1      LEU 115  11.655   2.709   5.417
  894   HD12  LEU 115          2HD1      LEU 115  11.593   2.334   7.140
  895   HD13  LEU 115          3HD1      LEU 115  10.832   3.804   6.531
  896   HD21  LEU 115          1HD2      LEU 115  10.611   0.084   6.479
  897   HD22  LEU 115          2HD2      LEU 115  10.586   0.553   4.779
  898   HD23  LEU 115          3HD2      LEU 115   9.098   0.045   5.575
  899    H    ILE 116           H        ILE 116   5.888   3.055   7.384
  900    HA   ILE 116           HA       ILE 116   5.690   3.845   4.669
  901    HB   ILE 116           HB       ILE 116   3.470   3.572   6.712
  902   HG12  ILE 116          1HG1      ILE 116   4.591   1.559   4.739
  903   HG13  ILE 116          2HG1      ILE 116   4.741   1.494   6.503
  904   HG21  ILE 116          1HG2      ILE 116   2.757   4.842   4.782
  905   HG22  ILE 116          2HG2      ILE 116   2.035   3.231   4.736
  906   HG23  ILE 116          3HG2      ILE 116   3.408   3.610   3.699
  907   HD11  ILE 116          1HD1      ILE 116   3.030  -0.016   5.917
  908   HD12  ILE 116          2HD1      ILE 116   2.273   1.146   4.832
  909   HD13  ILE 116          3HD1      ILE 116   2.221   1.405   6.577
  910    H    LYS 117           H        LYS 117   4.885   5.400   7.737
  911    HA   LYS 117           HA       LYS 117   3.889   7.809   6.701
  912    HB2  LYS 117          1HB       LYS 117   5.232   7.127   9.308
  913    HB3  LYS 117          2HB       LYS 117   4.615   8.736   8.962
  914    HG2  LYS 117          1HG       LYS 117   2.374   7.870   8.732
  915    HG3  LYS 117          2HG       LYS 117   2.950   6.218   8.935
  916    HD2  LYS 117          1HD       LYS 117   3.599   6.664  11.207
  917    HD3  LYS 117          2HD       LYS 117   3.249   8.382  11.019
  918    HE2  LYS 117          1HE       LYS 117   1.164   6.233  10.705
  919    HE3  LYS 117          2HE       LYS 117   1.509   7.013  12.246
  920    HZ1  LYS 117          1HZ       LYS 117   0.915   9.130  11.302
  921    HZ2  LYS 117          2HZ       LYS 117  -0.356   8.040  11.070
  922    HZ3  LYS 117          3HZ       LYS 117   0.663   8.438   9.780
  923    H    ALA 118           H        ALA 118   7.140   6.740   7.522
  924    HA   ALA 118           HA       ALA 118   8.467   9.198   7.059
  925    HB1  ALA 118          1HB       ALA 118  10.491   7.864   7.067
  926    HB2  ALA 118          2HB       ALA 118   9.533   6.390   6.913
  927    HB3  ALA 118          3HB       ALA 118   9.414   7.370   8.373
  928    H    SER 119           H        SER 119   7.576   6.508   5.015
  929    HA   SER 119           HA       SER 119   9.170   6.976   2.803
  930    HB2  SER 119          1HB       SER 119   7.755   4.974   3.143
  931    HB3  SER 119          2HB       SER 119   6.325   5.948   2.809
  932    HG   SER 119           HG       SER 119   8.490   5.603   1.009
  933    H    ILE 120           H        ILE 120   5.953   8.305   3.529
  934    HA   ILE 120           HA       ILE 120   6.093   9.960   1.124
  935    HB   ILE 120           HB       ILE 120   3.757  10.555   1.631
  936   HG12  ILE 120          1HG1      ILE 120   3.960   8.580   3.906
  937   HG13  ILE 120          2HG1      ILE 120   4.007  10.329   4.122
  938   HG21  ILE 120          1HG2      ILE 120   2.781   8.345   1.223
  939   HG22  ILE 120          2HG2      ILE 120   4.318   7.599   1.659
  940   HG23  ILE 120          3HG2      ILE 120   4.213   8.629   0.232
  941   HD11  ILE 120          1HD1      ILE 120   1.781  10.510   3.166
  942   HD12  ILE 120          2HD1      ILE 120   1.793   9.434   4.559
  943   HD13  ILE 120          3HD1      ILE 120   1.732   8.766   2.929
  944    H    LYS 121           H        LYS 121   7.258  10.235   4.121
  945    HA   LYS 121           HA       LYS 121   6.336  12.865   4.815
  946    HB2  LYS 121          1HB       LYS 121   6.963  11.211   6.517
  947    HB3  LYS 121          2HB       LYS 121   8.620  11.236   5.930
  948    HG2  LYS 121          1HG       LYS 121   8.761  13.628   6.529
  949    HG3  LYS 121          2HG       LYS 121   7.127  13.529   7.189
  950    HD2  LYS 121          1HD       LYS 121   9.500  11.916   8.126
  951    HD3  LYS 121          2HD       LYS 121   8.836  13.332   8.942
  952    HE2  LYS 121          1HE       LYS 121   6.720  12.161   9.269
  953    HE3  LYS 121          2HE       LYS 121   7.360  10.753   8.423
  954    HZ1  LYS 121          1HZ       LYS 121   9.000  10.481  10.142
  955    HZ2  LYS 121          2HZ       LYS 121   7.461  10.514  10.835
  956    HZ3  LYS 121          3HZ       LYS 121   8.463  11.872  10.938
  957    H    LYS 122           H        LYS 122   7.049  14.663   3.970
  958    HA   LYS 122           HA       LYS 122   9.088  14.882   2.090
  959    HB2  LYS 122          1HB       LYS 122   7.196  16.595   3.339
  960    HB3  LYS 122          2HB       LYS 122   8.746  17.400   3.393
  961    HG2  LYS 122          1HG       LYS 122   7.413  16.306   0.919
  962    HG3  LYS 122          2HG       LYS 122   7.461  18.003   1.401
  963    HD2  LYS 122          1HD       LYS 122   9.891  17.997   1.214
  964    HD3  LYS 122          2HD       LYS 122   9.866  16.289   0.777
  965    HE2  LYS 122          1HE       LYS 122   8.598  16.808  -1.236
  966    HE3  LYS 122          2HE       LYS 122   8.568  18.515  -0.791
  967    HZ1  LYS 122          1HZ       LYS 122  10.986  18.546  -0.946
  968    HZ2  LYS 122          2HZ       LYS 122  10.286  18.081  -2.413
  969    HZ3  LYS 122          3HZ       LYS 122  10.991  16.920  -1.409
  970    H    ASP 123           H        ASP 123  11.224  15.177   2.202
  971    HA   ASP 123           HA       ASP 123  12.502  14.853   4.754
  972    HB2  ASP 123          1HB       ASP 123  14.562  14.635   3.527
  973    HB3  ASP 123          2HB       ASP 123  13.321  13.721   2.680
  974    H21  ACD 201           H21      ACD   1  -4.398   4.177   1.152
  975    H22  ACD 201           H22      ACD   1  -3.555   4.787   2.583
  976    H31  ACD 201           H31      ACD   1  -2.080   6.142   1.240
  977    H32  ACD 201           H32      ACD   1  -3.026   5.861  -0.213
  978    H41  ACD 201           H41      ACD   1  -2.445   3.409  -0.061
  979    H42  ACD 201           H42      ACD   1  -1.039   4.458  -0.303
  980    H5   ACD 201           H5       ACD   1  -1.714   2.884   2.229
  981    H6   ACD 201           H6       ACD   1   0.418   3.712   2.938
  982    H71  ACD 201           H71      ACD   1   0.853   4.872   0.264
  983    H72  ACD 201           H72      ACD   1  -0.072   6.057   1.189
  984    H8   ACD 201           H8       ACD   1   1.818   6.369   2.770
  985    H9   ACD 201           H9       ACD   1   3.926   5.462   2.123
  986   H101  ACD 201          H101      ACD   1   2.845   4.679  -0.461
  987   H102  ACD 201          H102      ACD   1   2.394   3.369   0.634
  988    H11  ACD 201           H11      ACD   1   5.347   4.276   0.492
  989    H12  ACD 201           H12      ACD   1   5.692   1.947   0.173
  990   H131  ACD 201          H131      ACD   1   2.715   1.946  -0.501
  991   H132  ACD 201          H132      ACD   1   3.823   0.576  -0.610
  992    H14  ACD 201           H14      ACD   1   2.718   1.623   2.096
  993    H15  ACD 201           H15      ACD   1   2.608  -0.717   2.527
  994   H161  ACD 201          H161      ACD   1   2.791  -1.365  -0.300
  995   H162  ACD 201          H162      ACD   1   4.456  -1.028   0.188
  996   H171  ACD 201          H171      ACD   1   4.394  -2.740   1.897
  997   H172  ACD 201          H172      ACD   1   2.657  -2.962   1.692
  998   H181  ACD 201          H181      ACD   1   4.740  -3.538  -0.456
  999   H182  ACD 201          H182      ACD   1   3.003  -3.825  -0.595
 1000   H191  ACD 201          H191      ACD   1   4.919  -5.163   1.365
 1001   H192  ACD 201          H192      ACD   1   3.168  -5.366   1.418
 1002   H201  ACD 201          H201      ACD   1   4.951  -6.090  -0.921
 1003   H202  ACD 201          H202      ACD   1   3.232  -6.282  -0.880
 1004   H203  ACD 201          H203      ACD   1   4.231  -7.207   0.188
  Start of MODEL    3
    1    H1   MET   1          1H        MET   1  19.073  12.874 -14.665
    2    H2   MET   1          2H        MET   1  17.586  13.671 -14.714
    3    H3   MET   1          3H        MET   1  18.184  12.917 -16.103
    4    HA   MET   1           HA       MET   1  16.441  11.604 -15.107
    5    HB2  MET   1          1HB       MET   1  19.211  10.427 -14.850
    6    HB3  MET   1          2HB       MET   1  17.731   9.482 -14.804
    7    HG2  MET   1          1HG       MET   1  18.728  11.127 -17.114
    8    HG3  MET   1          2HG       MET   1  18.750   9.371 -16.989
    9    HE1  MET   1          1HE       MET   1  14.916   8.530 -17.020
   10    HE2  MET   1          2HE       MET   1  15.930   8.816 -15.608
   11    HE3  MET   1          3HE       MET   1  16.548   7.868 -16.958
   12    H    GLU   2           H        GLU   2  15.521  12.400 -13.222
   13    HA   GLU   2           HA       GLU   2  16.651  11.256 -10.766
   14    HB2  GLU   2          1HB       GLU   2  15.485  14.027 -10.989
   15    HB3  GLU   2          2HB       GLU   2  16.026  13.256  -9.508
   16    HG2  GLU   2          1HG       GLU   2  18.305  13.165 -10.436
   17    HG3  GLU   2          2HG       GLU   2  17.727  14.041 -11.852
   18    H    PHE   3           H        PHE   3  15.228   9.682 -10.459
   19    HA   PHE   3           HA       PHE   3  12.491   9.761 -11.057
   20    HB2  PHE   3          1HB       PHE   3  13.629   7.648 -10.718
   21    HB3  PHE   3          2HB       PHE   3  13.980   8.068  -9.039
   22    HD1  PHE   3           HD1      PHE   3  11.305   7.181 -11.411
   23    HD2  PHE   3           HD2      PHE   3  12.379   7.725  -7.336
   24    HE1  PHE   3           HE1      PHE   3   9.194   6.121 -10.716
   25    HE2  PHE   3           HE2      PHE   3  10.275   6.669  -6.627
   26    HZ   PHE   3           HZ       PHE   3   8.676   5.864  -8.322
   27    H    THR   4           H        THR   4  10.855  10.706 -10.117
   28    HA   THR   4           HA       THR   4  11.241  11.954  -7.495
   29    HB   THR   4           HB       THR   4   8.705  12.504  -8.827
   30    HG1  THR   4           HG1      THR   4  11.165  13.191 -10.117
   31   HG21  THR   4          1HG2      THR   4   9.614  13.740  -6.922
   32   HG22  THR   4          2HG2      THR   4   9.346  14.790  -8.315
   33   HG23  THR   4          3HG2      THR   4  10.978  14.256  -7.913
   34    H    VAL   5           H        VAL   5  10.248  11.270  -5.762
   35    HA   VAL   5           HA       VAL   5   8.539   8.899  -5.961
   36    HB   VAL   5           HB       VAL   5   9.025   8.440  -3.753
   37   HG11  VAL   5          1HG1      VAL   5  11.036   8.283  -5.021
   38   HG12  VAL   5          2HG1      VAL   5  11.400   8.810  -3.377
   39   HG13  VAL   5          3HG1      VAL   5  11.415   9.975  -4.700
   40   HG21  VAL   5          1HG2      VAL   5   8.225  10.567  -2.805
   41   HG22  VAL   5          2HG2      VAL   5   9.742  11.336  -3.271
   42   HG23  VAL   5          3HG2      VAL   5   9.738  10.049  -2.064
   43    H    SER   6           H        SER   6   6.489   8.777  -5.252
   44    HA   SER   6           HA       SER   6   4.939  11.157  -5.391
   45    HB2  SER   6          1HB       SER   6   4.128   8.355  -4.561
   46    HB3  SER   6          2HB       SER   6   3.022   9.662  -4.985
   47    HG   SER   6           HG       SER   6   4.618   9.577  -6.994
   48    H    THR   7           H        THR   7   5.063  12.592  -3.799
   49    HA   THR   7           HA       THR   7   5.581  11.814  -1.074
   50    HB   THR   7           HB       THR   7   5.603  14.210  -0.605
   51    HG1  THR   7           HG1      THR   7   4.823  14.516  -3.350
   52   HG21  THR   7          1HG2      THR   7   7.029  13.568  -3.189
   53   HG22  THR   7          2HG2      THR   7   7.614  13.181  -1.572
   54   HG23  THR   7          3HG2      THR   7   7.441  14.864  -2.068
   55    H    THR   8           H        THR   8   4.231  13.321   0.556
   56    HA   THR   8           HA       THR   8   1.708  12.221   0.849
   57    HB   THR   8           HB       THR   8   2.718  14.853   1.933
   58    HG1  THR   8           HG1      THR   8   3.921  12.815   2.406
   59   HG21  THR   8          1HG2      THR   8   0.442  13.083   2.810
   60   HG22  THR   8          2HG2      THR   8   0.322  14.713   2.145
   61   HG23  THR   8          3HG2      THR   8   1.059  14.458   3.728
   62    H    GLU   9           H        GLU   9   2.629  15.350  -0.551
   63    HA   GLU   9           HA       GLU   9   0.014  16.257  -0.999
   64    HB2  GLU   9          1HB       GLU   9   2.030  17.704  -1.032
   65    HB3  GLU   9          2HB       GLU   9   2.479  16.991  -2.576
   66    HG2  GLU   9          1HG       GLU   9   0.389  17.818  -3.545
   67    HG3  GLU   9          2HG       GLU   9  -0.015  18.566  -2.002
   68    H    ASP  10           H        ASP  10   2.257  14.457  -3.075
   69    HA   ASP  10           HA       ASP  10   0.580  14.372  -5.359
   70    HB2  ASP  10          1HB       ASP  10   2.656  12.327  -4.543
   71    HB3  ASP  10          2HB       ASP  10   1.975  12.555  -6.150
   72    H    LEU  11           H        LEU  11   0.982  12.290  -2.568
   73    HA   LEU  11           HA       LEU  11  -0.661  10.185  -3.374
   74    HB2  LEU  11          1HB       LEU  11   0.866   9.949  -1.539
   75    HB3  LEU  11          2HB       LEU  11   0.027  11.200  -0.616
   76    HG   LEU  11           HG       LEU  11  -1.956   9.687  -0.539
   77   HD11  LEU  11          1HD1      LEU  11  -1.711   7.366  -1.118
   78   HD12  LEU  11          2HD1      LEU  11  -0.041   7.631  -1.621
   79   HD13  LEU  11          3HD1      LEU  11  -1.363   8.357  -2.533
   80   HD21  LEU  11          1HD2      LEU  11  -1.135   8.430   1.271
   81   HD22  LEU  11          2HD2      LEU  11  -0.121   9.869   1.222
   82   HD23  LEU  11          3HD2      LEU  11   0.484   8.341   0.583
   83    H    GLN  12           H        GLN  12  -1.398  13.285  -1.927
   84    HA   GLN  12           HA       GLN  12  -4.074  12.754  -1.193
   85    HB2  GLN  12          1HB       GLN  12  -2.669  15.322  -1.909
   86    HB3  GLN  12          2HB       GLN  12  -4.344  15.263  -1.378
   87    HG2  GLN  12          1HG       GLN  12  -3.683  14.362   0.753
   88    HG3  GLN  12          2HG       GLN  12  -2.007  14.254   0.224
   89   HE21  GLN  12          1HE2      GLN  12  -2.134  16.840  -1.171
   90   HE22  GLN  12          2HE2      GLN  12  -2.083  18.037   0.077
   91    H    ARG  13           H        ARG  13  -2.595  13.862  -4.181
   92    HA   ARG  13           HA       ARG  13  -4.923  14.371  -5.653
   93    HB2  ARG  13          1HB       ARG  13  -2.804  15.036  -6.563
   94    HB3  ARG  13          2HB       ARG  13  -2.204  13.382  -6.527
   95    HG2  ARG  13          1HG       ARG  13  -4.054  12.804  -8.143
   96    HG3  ARG  13          2HG       ARG  13  -4.308  14.549  -8.323
   97    HD2  ARG  13          1HD       ARG  13  -2.187  14.855  -9.284
   98    HD3  ARG  13          2HD       ARG  13  -1.621  13.278  -8.732
   99    HE   ARG  13           HE       ARG  13  -3.847  13.010 -10.483
  100   HH11  ARG  13          1HH1      ARG  13  -0.402  13.693 -10.487
  101   HH12  ARG  13          2HH1      ARG  13  -0.144  12.997 -12.054
  102   HH21  ARG  13          1HH2      ARG  13  -3.484  12.070 -12.530
  103   HH22  ARG  13          2HH2      ARG  13  -1.888  12.065 -13.207
  104    H    TYR  14           H        TYR  14  -2.887  11.446  -5.676
  105    HA   TYR  14           HA       TYR  14  -4.548   9.948  -7.354
  106    HB2  TYR  14          1HB       TYR  14  -2.615   8.922  -5.267
  107    HB3  TYR  14          2HB       TYR  14  -3.273   8.001  -6.613
  108    HD1  TYR  14           HD1      TYR  14  -3.041   9.588  -8.919
  109    HD2  TYR  14           HD2      TYR  14  -0.361   9.391  -5.623
  110    HE1  TYR  14           HE1      TYR  14  -1.206  10.320 -10.375
  111    HE2  TYR  14           HE2      TYR  14   1.481  10.131  -7.072
  112    HH   TYR  14           HH       TYR  14   2.030  10.087  -9.521
  113    H    ARG  15           H        ARG  15  -4.499  10.198  -3.838
  114    HA   ARG  15           HA       ARG  15  -6.290   8.089  -3.363
  115    HB2  ARG  15          1HB       ARG  15  -5.520   8.544  -1.320
  116    HB3  ARG  15          2HB       ARG  15  -4.961  10.131  -1.822
  117    HG2  ARG  15          1HG       ARG  15  -7.102  11.104  -1.310
  118    HG3  ARG  15          2HG       ARG  15  -7.796   9.510  -0.999
  119    HD2  ARG  15          1HD       ARG  15  -6.286   9.208   0.898
  120    HD3  ARG  15          2HD       ARG  15  -5.556  10.782   0.584
  121    HE   ARG  15           HE       ARG  15  -8.067  11.509   0.909
  122   HH11  ARG  15          1HH1      ARG  15  -6.236   9.140   2.740
  123   HH12  ARG  15          2HH1      ARG  15  -7.067   9.480   4.226
  124   HH21  ARG  15          1HH2      ARG  15  -9.170  11.933   2.853
  125   HH22  ARG  15          2HH2      ARG  15  -8.762  11.046   4.283
  126    H    THR  16           H        THR  16  -6.735  11.514  -3.979
  127    HA   THR  16           HA       THR  16  -9.502  11.652  -3.519
  128    HB   THR  16           HB       THR  16  -7.633  13.289  -5.224
  129    HG1  THR  16           HG1      THR  16  -7.236  13.710  -3.134
  130   HG21  THR  16          1HG2      THR  16 -10.544  13.826  -4.630
  131   HG22  THR  16          2HG2      THR  16  -9.842  13.473  -6.212
  132   HG23  THR  16          3HG2      THR  16  -9.428  14.972  -5.374
  133    H    GLU  17           H        GLU  17  -7.637  11.221  -6.522
  134    HA   GLU  17           HA       GLU  17  -9.843  11.074  -8.256
  135    HB2  GLU  17          1HB       GLU  17  -7.346   9.508  -8.830
  136    HB3  GLU  17          2HB       GLU  17  -8.361  10.415  -9.928
  137    HG2  GLU  17          1HG       GLU  17  -7.545  12.509  -9.009
  138    HG3  GLU  17          2HG       GLU  17  -6.513  11.621  -7.884
  139    H    CYS  18           H        CYS  18  -8.166   8.580  -6.400
  140    HA   CYS  18           HA       CYS  18  -9.626   6.410  -7.514
  141    HB2  CYS  18          1HB       CYS  18  -8.080   6.635  -4.927
  142    HB3  CYS  18          2HB       CYS  18  -8.796   5.136  -5.539
  143    H    VAL  19           H        VAL  19 -10.124   8.552  -4.782
  144    HA   VAL  19           HA       VAL  19 -12.247   7.149  -3.591
  145    HB   VAL  19           HB       VAL  19 -11.279   9.975  -3.430
  146   HG11  VAL  19          1HG1      VAL  19 -13.077  10.562  -1.900
  147   HG12  VAL  19          2HG1      VAL  19 -13.853   9.007  -2.190
  148   HG13  VAL  19          3HG1      VAL  19 -13.717  10.183  -3.501
  149   HG21  VAL  19          1HG2      VAL  19 -11.713   7.739  -1.455
  150   HG22  VAL  19          2HG2      VAL  19 -11.178   9.361  -1.014
  151   HG23  VAL  19          3HG2      VAL  19 -10.172   8.356  -2.057
  152    H    SER  20           H        SER  20 -12.229   9.892  -5.818
  153    HA   SER  20           HA       SER  20 -15.023  10.027  -6.132
  154    HB2  SER  20          1HB       SER  20 -13.395  11.846  -6.646
  155    HB3  SER  20          2HB       SER  20 -12.881  10.939  -8.066
  156    HG   SER  20           HG       SER  20 -15.482  11.962  -7.549
  157    H    SER  21           H        SER  21 -12.526   8.250  -7.910
  158    HA   SER  21           HA       SER  21 -14.190   7.470 -10.079
  159    HB2  SER  21          1HB       SER  21 -11.741   7.489 -10.240
  160    HB3  SER  21          2HB       SER  21 -11.642   6.223  -9.023
  161    HG   SER  21           HG       SER  21 -12.798   6.027 -11.608
  162    H    LEU  22           H        LEU  22 -13.155   5.786  -7.101
  163    HA   LEU  22           HA       LEU  22 -14.713   3.462  -7.832
  164    HB2  LEU  22          1HB       LEU  22 -12.979   4.099  -5.451
  165    HB3  LEU  22          2HB       LEU  22 -13.838   2.568  -5.645
  166    HG   LEU  22           HG       LEU  22 -11.848   3.596  -7.657
  167   HD11  LEU  22          1HD1      LEU  22 -11.412   1.683  -5.369
  168   HD12  LEU  22          2HD1      LEU  22 -10.726   3.301  -5.513
  169   HD13  LEU  22          3HD1      LEU  22 -10.249   2.038  -6.648
  170   HD21  LEU  22          1HD2      LEU  22 -13.499   1.933  -8.418
  171   HD22  LEU  22          2HD2      LEU  22 -12.955   0.843  -7.140
  172   HD23  LEU  22          3HD2      LEU  22 -11.847   1.313  -8.432
  173    H    ASN  23           H        ASN  23 -15.690   6.284  -6.760
  174    HA   ASN  23           HA       ASN  23 -17.437   7.119  -5.567
  175    HB2  ASN  23          1HB       ASN  23 -18.575   5.454  -7.073
  176    HB3  ASN  23          2HB       ASN  23 -18.566   4.327  -5.733
  177   HD21  ASN  23          1HD2      ASN  23 -19.863   7.307  -6.958
  178   HD22  ASN  23          2HD2      ASN  23 -21.203   7.404  -5.861
  179    H    ILE  24           H        ILE  24 -15.269   6.392  -4.016
  180    HA   ILE  24           HA       ILE  24 -15.996   4.807  -1.774
  181    HB   ILE  24           HB       ILE  24 -13.848   6.923  -1.899
  182   HG12  ILE  24          1HG1      ILE  24 -13.610   5.303  -3.763
  183   HG13  ILE  24          2HG1      ILE  24 -12.311   5.149  -2.583
  184   HG21  ILE  24          1HG2      ILE  24 -12.781   5.541  -0.163
  185   HG22  ILE  24          2HG2      ILE  24 -14.198   4.491  -0.152
  186   HG23  ILE  24          3HG2      ILE  24 -14.344   6.176   0.345
  187   HD11  ILE  24          1HD1      ILE  24 -14.718   3.355  -2.804
  188   HD12  ILE  24          2HD1      ILE  24 -13.405   3.185  -1.637
  189   HD13  ILE  24          3HD1      ILE  24 -13.086   2.981  -3.361
  190    HA   PRO  25           HA       PRO  25 -18.714   7.834   0.105
  191    HB2  PRO  25          1HB       PRO  25 -18.434   6.064   2.439
  192    HB3  PRO  25          2HB       PRO  25 -19.882   6.563   1.567
  193    HG2  PRO  25          1HG       PRO  25 -18.894   4.079   1.385
  194    HG3  PRO  25          2HG       PRO  25 -19.709   4.884   0.033
  195    HD2  PRO  25          1HD       PRO  25 -16.793   4.415   0.485
  196    HD3  PRO  25          2HD       PRO  25 -17.725   4.411  -1.034
  197    H    ALA  26           H        ALA  26 -18.517   9.476   1.497
  198    HA   ALA  26           HA       ALA  26 -15.994  10.457   2.135
  199    HB1  ALA  26          1HB       ALA  26 -18.625  11.197   3.397
  200    HB2  ALA  26          2HB       ALA  26 -18.013  11.820   1.866
  201    HB3  ALA  26          3HB       ALA  26 -17.163  12.184   3.368
  202    H    ASP  27           H        ASP  27 -18.196   8.520   4.052
  203    HA   ASP  27           HA       ASP  27 -17.132   8.770   6.595
  204    HB2  ASP  27          1HB       ASP  27 -18.213   6.297   5.228
  205    HB3  ASP  27          2HB       ASP  27 -17.867   6.394   6.949
  206    H    TYR  28           H        TYR  28 -16.203   6.353   4.139
  207    HA   TYR  28           HA       TYR  28 -14.061   5.253   5.516
  208    HB2  TYR  28          1HB       TYR  28 -14.755   5.454   2.605
  209    HB3  TYR  28          2HB       TYR  28 -13.239   4.706   3.103
  210    HD1  TYR  28           HD1      TYR  28 -13.220   2.493   4.013
  211    HD2  TYR  28           HD2      TYR  28 -16.916   4.474   3.318
  212    HE1  TYR  28           HE1      TYR  28 -14.416   0.376   4.372
  213    HE2  TYR  28           HE2      TYR  28 -18.121   2.364   3.664
  214    HH   TYR  28           HH       TYR  28 -16.400  -0.608   4.590
  215    H    VAL  29           H        VAL  29 -14.213   8.042   3.369
  216    HA   VAL  29           HA       VAL  29 -11.507   8.491   2.944
  217    HB   VAL  29           HB       VAL  29 -13.709  10.531   3.161
  218   HG11  VAL  29          1HG1      VAL  29 -10.970  10.693   1.925
  219   HG12  VAL  29          2HG1      VAL  29 -11.559  11.609   3.312
  220   HG13  VAL  29          3HG1      VAL  29 -12.241  11.897   1.711
  221   HG21  VAL  29          1HG2      VAL  29 -13.783  10.326   0.708
  222   HG22  VAL  29          2HG2      VAL  29 -14.204   8.822   1.526
  223   HG23  VAL  29          3HG2      VAL  29 -12.604   9.016   0.806
  224    H    GLU  30           H        GLU  30 -13.584   9.670   5.602
  225    HA   GLU  30           HA       GLU  30 -11.596  11.207   6.897
  226    HB2  GLU  30          1HB       GLU  30 -13.716   9.743   8.438
  227    HB3  GLU  30          2HB       GLU  30 -12.985  11.309   8.752
  228    HG2  GLU  30          1HG       GLU  30 -14.108  12.170   6.725
  229    HG3  GLU  30          2HG       GLU  30 -14.974  10.638   6.622
  230    H    LYS  31           H        LYS  31 -12.516   7.820   7.167
  231    HA   LYS  31           HA       LYS  31 -10.940   7.168   9.397
  232    HB2  LYS  31          1HB       LYS  31 -11.802   5.383   7.117
  233    HB3  LYS  31          2HB       LYS  31 -11.166   4.837   8.663
  234    HG2  LYS  31          1HG       LYS  31 -13.068   5.959   9.786
  235    HG3  LYS  31          2HG       LYS  31 -13.731   6.331   8.192
  236    HD2  LYS  31          1HD       LYS  31 -13.775   3.902   7.687
  237    HD3  LYS  31          2HD       LYS  31 -13.228   3.580   9.346
  238    HE2  LYS  31          1HE       LYS  31 -15.237   4.709  10.214
  239    HE3  LYS  31          2HE       LYS  31 -15.779   5.016   8.568
  240    HZ1  LYS  31          1HZ       LYS  31 -15.360   2.324   9.742
  241    HZ2  LYS  31          2HZ       LYS  31 -15.973   2.661   8.201
  242    HZ3  LYS  31          3HZ       LYS  31 -16.857   3.092   9.576
  243    H    PHE  32           H        PHE  32 -10.266   6.917   5.928
  244    HA   PHE  32           HA       PHE  32  -7.742   5.759   6.092
  245    HB2  PHE  32          1HB       PHE  32  -8.676   7.739   4.014
  246    HB3  PHE  32          2HB       PHE  32  -7.357   6.589   3.842
  247    HD1  PHE  32           HD1      PHE  32  -9.858   6.968   2.086
  248    HD2  PHE  32           HD2      PHE  32  -8.907   4.295   5.255
  249    HE1  PHE  32           HE1      PHE  32 -11.418   5.310   1.157
  250    HE2  PHE  32           HE2      PHE  32 -10.465   2.638   4.331
  251    HZ   PHE  32           HZ       PHE  32 -11.721   3.140   2.276
  252    H    LYS  33           H        LYS  33  -8.734   9.106   6.415
  253    HA   LYS  33           HA       LYS  33  -6.176  10.293   6.213
  254    HB2  LYS  33          1HB       LYS  33  -8.492  11.430   6.180
  255    HB3  LYS  33          2HB       LYS  33  -8.395  11.369   7.939
  256    HG2  LYS  33          1HG       LYS  33  -7.651  13.518   7.276
  257    HG3  LYS  33          2HG       LYS  33  -6.225  12.598   7.784
  258    HD2  LYS  33          1HD       LYS  33  -5.725  12.105   5.429
  259    HD3  LYS  33          2HD       LYS  33  -7.131  13.046   4.937
  260    HE2  LYS  33          1HE       LYS  33  -5.162  14.395   4.680
  261    HE3  LYS  33          2HE       LYS  33  -6.121  15.032   6.013
  262    HZ1  LYS  33          1HZ       LYS  33  -4.629  13.918   7.564
  263    HZ2  LYS  33          2HZ       LYS  33  -3.772  14.977   6.564
  264    HZ3  LYS  33          3HZ       LYS  33  -3.711  13.313   6.278
  265    H    LYS  34           H        LYS  34  -7.938   8.864   8.912
  266    HA   LYS  34           HA       LYS  34  -5.817   9.579  10.769
  267    HB2  LYS  34          1HB       LYS  34  -8.433   8.120  11.129
  268    HB3  LYS  34          2HB       LYS  34  -7.241   8.226  12.414
  269    HG2  LYS  34          1HG       LYS  34  -8.680   9.949  12.919
  270    HG3  LYS  34          2HG       LYS  34  -7.418  10.782  12.012
  271    HD2  LYS  34          1HD       LYS  34  -8.764  10.781  10.026
  272    HD3  LYS  34          2HD       LYS  34  -9.981   9.766  10.799
  273    HE2  LYS  34          1HE       LYS  34 -10.341  11.596  12.456
  274    HE3  LYS  34          2HE       LYS  34  -9.261  12.606  11.498
  275    HZ1  LYS  34          1HZ       LYS  34 -11.813  11.406  10.571
  276    HZ2  LYS  34          2HZ       LYS  34 -10.769  12.328   9.613
  277    HZ3  LYS  34          3HZ       LYS  34 -11.552  13.037  10.930
  278    H    TRP  35           H        TRP  35  -5.450   7.713   8.475
  279    HA   TRP  35           HA       TRP  35  -4.522   5.736   7.918
  280    HB2  TRP  35          1HB       TRP  35  -3.348   6.109  10.672
  281    HB3  TRP  35          2HB       TRP  35  -2.798   4.873   9.529
  282    HD1  TRP  35           HD1      TRP  35  -2.520   8.559  10.313
  283    HE1  TRP  35           HE1      TRP  35  -0.838   9.656   8.703
  284    HE3  TRP  35           HE3      TRP  35  -1.902   4.689   7.034
  285    HZ2  TRP  35           HZ2      TRP  35   0.565   8.968   6.353
  286    HZ3  TRP  35           HZ3      TRP  35  -0.379   4.989   5.131
  287    HH2  TRP  35           HH2      TRP  35   0.833   7.075   4.794
  288    H    GLU  36           H        GLU  36  -7.105   5.399   8.699
  289    HA   GLU  36           HA       GLU  36  -7.021   2.778  10.025
  290    HB2  GLU  36          1HB       GLU  36  -9.191   4.871  10.111
  291    HB3  GLU  36          2HB       GLU  36  -9.407   3.218  10.665
  292    HG2  GLU  36          1HG       GLU  36  -7.650   3.547  12.324
  293    HG3  GLU  36          2HG       GLU  36  -7.441   5.202  11.761
  294    H    PHE  37           H        PHE  37  -7.247   1.263   8.564
  295    HA   PHE  37           HA       PHE  37  -8.955   1.800   6.221
  296    HB2  PHE  37          1HB       PHE  37  -6.551  -0.040   6.385
  297    HB3  PHE  37          2HB       PHE  37  -7.487   0.309   4.940
  298    HD1  PHE  37           HD1      PHE  37  -5.137   1.697   7.399
  299    HD2  PHE  37           HD2      PHE  37  -7.120   2.311   3.681
  300    HE1  PHE  37           HE1      PHE  37  -3.663   3.608   6.928
  301    HE2  PHE  37           HE2      PHE  37  -5.656   4.227   3.213
  302    HZ   PHE  37           HZ       PHE  37  -3.924   4.879   4.836
  303    HA   PRO  38           HA       PRO  38 -11.351  -1.504   8.333
  304    HB2  PRO  38          1HB       PRO  38 -13.113  -0.715   6.066
  305    HB3  PRO  38          2HB       PRO  38 -13.509  -0.992   7.774
  306    HG2  PRO  38          1HG       PRO  38 -13.385   1.481   6.845
  307    HG3  PRO  38          2HG       PRO  38 -12.696   1.086   8.430
  308    HD2  PRO  38          1HD       PRO  38 -11.285   1.497   5.814
  309    HD3  PRO  38          2HD       PRO  38 -10.831   2.055   7.443
  310    H    GLU  39           H        GLU  39 -11.701  -3.578   7.787
  311    HA   GLU  39           HA       GLU  39 -10.366  -4.497   5.387
  312    HB2  GLU  39          1HB       GLU  39  -9.893  -5.426   7.666
  313    HB3  GLU  39          2HB       GLU  39 -11.504  -6.124   7.659
  314    HG2  GLU  39          1HG       GLU  39 -10.916  -7.462   5.710
  315    HG3  GLU  39          2HG       GLU  39  -9.303  -6.751   5.707
  316    H    ASP  40           H        ASP  40 -12.050  -3.712   3.976
  317    HA   ASP  40           HA       ASP  40 -13.875  -5.839   3.335
  318    HB2  ASP  40          1HB       ASP  40 -15.923  -4.615   3.350
  319    HB3  ASP  40          2HB       ASP  40 -15.190  -4.393   4.931
  320    H    ASP  41           H        ASP  41 -15.128  -5.216   1.260
  321    HA   ASP  41           HA       ASP  41 -13.232  -5.122  -0.732
  322    HB2  ASP  41          1HB       ASP  41 -16.155  -4.384  -0.991
  323    HB3  ASP  41          2HB       ASP  41 -15.081  -4.780  -2.328
  324    H    THR  42           H        THR  42 -15.245  -2.413   0.379
  325    HA   THR  42           HA       THR  42 -14.712  -0.575  -1.615
  326    HB   THR  42           HB       THR  42 -14.824   0.432   1.180
  327    HG1  THR  42           HG1      THR  42 -16.270  -1.156   1.500
  328   HG21  THR  42          1HG2      THR  42 -16.567   1.880   0.162
  329   HG22  THR  42          2HG2      THR  42 -16.283   1.072  -1.380
  330   HG23  THR  42          3HG2      THR  42 -14.995   2.013  -0.627
  331    H    THR  43           H        THR  43 -13.034  -0.832   1.511
  332    HA   THR  43           HA       THR  43 -11.049   1.074   0.991
  333    HB   THR  43           HB       THR  43 -10.830  -1.319   2.817
  334    HG1  THR  43           HG1      THR  43 -11.695   0.211   4.392
  335   HG21  THR  43          1HG2      THR  43  -8.724  -0.174   2.572
  336   HG22  THR  43          2HG2      THR  43  -9.405   0.234   4.150
  337   HG23  THR  43          3HG2      THR  43  -9.498   1.389   2.821
  338    H    MET  44           H        MET  44 -11.262  -2.343   0.265
  339    HA   MET  44           HA       MET  44  -8.508  -2.813  -0.137
  340    HB2  MET  44          1HB       MET  44 -10.905  -4.285  -1.226
  341    HB3  MET  44          2HB       MET  44  -9.249  -4.878  -1.291
  342    HG2  MET  44          1HG       MET  44  -9.169  -4.859   1.160
  343    HG3  MET  44          2HG       MET  44 -10.838  -4.301   1.198
  344    HE1  MET  44          1HE       MET  44  -9.829  -6.860   2.793
  345    HE2  MET  44          2HE       MET  44 -11.199  -7.931   2.492
  346    HE3  MET  44          3HE       MET  44 -11.471  -6.214   2.806
  347    H    CYS  45           H        CYS  45 -11.142  -2.174  -2.456
  348    HA   CYS  45           HA       CYS  45  -9.403  -2.164  -4.704
  349    HB2  CYS  45          1HB       CYS  45 -12.191  -1.039  -4.367
  350    HB3  CYS  45          2HB       CYS  45 -11.326  -1.086  -5.898
  351    H    TYR  46           H        TYR  46 -10.414   0.280  -2.423
  352    HA   TYR  46           HA       TYR  46  -9.570   2.561  -3.790
  353    HB2  TYR  46          1HB       TYR  46 -10.813   2.946  -1.847
  354    HB3  TYR  46          2HB       TYR  46  -9.820   1.856  -0.880
  355    HD1  TYR  46           HD1      TYR  46  -8.309   2.791   0.593
  356    HD2  TYR  46           HD2      TYR  46  -9.504   5.050  -2.814
  357    HE1  TYR  46           HE1      TYR  46  -7.001   4.705   1.410
  358    HE2  TYR  46           HE2      TYR  46  -8.194   6.966  -2.001
  359    HH   TYR  46           HH       TYR  46  -6.061   6.721   0.755
  360    H    ILE  47           H        ILE  47  -7.811   0.517  -1.478
  361    HA   ILE  47           HA       ILE  47  -5.343   1.807  -1.654
  362    HB   ILE  47           HB       ILE  47  -6.000  -1.059  -1.005
  363   HG12  ILE  47          1HG1      ILE  47  -6.912   0.554   0.579
  364   HG13  ILE  47          2HG1      ILE  47  -5.585  -0.328   1.331
  365   HG21  ILE  47          1HG2      ILE  47  -3.720  -1.001  -1.780
  366   HG22  ILE  47          2HG2      ILE  47  -3.732  -1.191  -0.026
  367   HG23  ILE  47          3HG2      ILE  47  -3.365   0.379  -0.739
  368   HD11  ILE  47          1HD1      ILE  47  -4.115   1.630   0.785
  369   HD12  ILE  47          2HD1      ILE  47  -5.386   1.941   1.963
  370   HD13  ILE  47          3HD1      ILE  47  -5.575   2.497   0.301
  371    H    LYS  48           H        LYS  48  -6.754  -0.783  -3.561
  372    HA   LYS  48           HA       LYS  48  -4.566  -1.559  -5.077
  373    HB2  LYS  48          1HB       LYS  48  -6.789  -2.675  -5.044
  374    HB3  LYS  48          2HB       LYS  48  -7.440  -1.341  -5.984
  375    HG2  LYS  48          1HG       LYS  48  -5.561  -1.954  -7.671
  376    HG3  LYS  48          2HG       LYS  48  -5.558  -3.497  -6.811
  377    HD2  LYS  48          1HD       LYS  48  -7.892  -3.830  -7.288
  378    HD3  LYS  48          2HD       LYS  48  -8.016  -2.222  -8.001
  379    HE2  LYS  48          1HE       LYS  48  -6.318  -4.477  -9.050
  380    HE3  LYS  48          2HE       LYS  48  -7.881  -3.991  -9.699
  381    HZ1  LYS  48          1HZ       LYS  48  -5.525  -2.196  -9.564
  382    HZ2  LYS  48          2HZ       LYS  48  -6.982  -1.908 -10.366
  383    HZ3  LYS  48          3HZ       LYS  48  -5.930  -3.117 -10.923
  384    H    CYS  49           H        CYS  49  -7.081   0.815  -5.899
  385    HA   CYS  49           HA       CYS  49  -6.000   1.691  -8.302
  386    HB2  CYS  49          1HB       CYS  49  -8.243   2.225  -7.808
  387    HB3  CYS  49          2HB       CYS  49  -7.819   3.037  -6.303
  388    H    VAL  50           H        VAL  50  -5.520   2.999  -5.023
  389    HA   VAL  50           HA       VAL  50  -4.027   5.241  -5.771
  390    HB   VAL  50           HB       VAL  50  -4.103   3.710  -3.177
  391   HG11  VAL  50          1HG1      VAL  50  -2.019   4.926  -3.270
  392   HG12  VAL  50          2HG1      VAL  50  -3.125   5.738  -2.162
  393   HG13  VAL  50          3HG1      VAL  50  -2.859   6.391  -3.780
  394   HG21  VAL  50          1HG2      VAL  50  -6.213   4.674  -3.739
  395   HG22  VAL  50          2HG2      VAL  50  -5.453   6.216  -4.130
  396   HG23  VAL  50          3HG2      VAL  50  -5.479   5.645  -2.461
  397    H    PHE  51           H        PHE  51  -3.044   2.013  -4.743
  398    HA   PHE  51           HA       PHE  51  -0.275   2.534  -4.713
  399    HB2  PHE  51          1HB       PHE  51  -2.019   0.132  -4.540
  400    HB3  PHE  51          2HB       PHE  51  -0.328  -0.135  -4.959
  401    HD1  PHE  51           HD1      PHE  51  -1.485   2.573  -2.745
  402    HD2  PHE  51           HD2      PHE  51   0.229  -1.316  -2.968
  403    HE1  PHE  51           HE1      PHE  51  -0.924   2.686  -0.354
  404    HE2  PHE  51           HE2      PHE  51   0.792  -1.207  -0.579
  405    HZ   PHE  51           HZ       PHE  51   0.218   0.796   0.733
  406    H    ASN  52           H        ASN  52  -2.511   1.730  -7.201
  407    HA   ASN  52           HA       ASN  52  -0.530   0.803  -9.078
  408    HB2  ASN  52          1HB       ASN  52  -2.853  -0.022  -9.143
  409    HB3  ASN  52          2HB       ASN  52  -3.419   1.612  -9.507
  410   HD21  ASN  52          1HD2      ASN  52  -0.496   0.170 -10.840
  411   HD22  ASN  52          2HD2      ASN  52  -1.071   0.091 -12.467
  412    H    LYS  53           H        LYS  53  -2.355   3.760  -8.479
  413    HA   LYS  53           HA       LYS  53  -1.463   5.181 -10.752
  414    HB2  LYS  53          1HB       LYS  53  -2.722   5.925  -8.151
  415    HB3  LYS  53          2HB       LYS  53  -2.060   7.197  -9.169
  416    HG2  LYS  53          1HG       LYS  53  -3.570   6.624 -10.952
  417    HG3  LYS  53          2HG       LYS  53  -4.123   5.191 -10.079
  418    HD2  LYS  53          1HD       LYS  53  -5.143   6.539  -8.380
  419    HD3  LYS  53          2HD       LYS  53  -4.434   8.010  -9.050
  420    HE2  LYS  53          1HE       LYS  53  -6.329   6.267 -10.603
  421    HE3  LYS  53          2HE       LYS  53  -6.880   7.587  -9.571
  422    HZ1  LYS  53          1HZ       LYS  53  -5.537   9.119 -10.882
  423    HZ2  LYS  53          2HZ       LYS  53  -6.662   8.307 -11.856
  424    HZ3  LYS  53          3HZ       LYS  53  -5.035   7.847 -11.885
  425    H    MET  54           H        MET  54  -0.056   4.632  -7.606
  426    HA   MET  54           HA       MET  54   1.987   6.646  -8.060
  427    HB2  MET  54          1HB       MET  54   1.315   4.838  -5.767
  428    HB3  MET  54          2HB       MET  54   2.867   5.670  -5.826
  429    HG2  MET  54          1HG       MET  54   1.586   7.809  -6.082
  430    HG3  MET  54          2HG       MET  54   0.123   6.881  -5.762
  431    HE1  MET  54          1HE       MET  54  -0.129   5.376  -3.568
  432    HE2  MET  54          2HE       MET  54   0.894   5.531  -2.143
  433    HE3  MET  54          3HE       MET  54   1.522   4.756  -3.597
  434    H    GLN  55           H        GLN  55   1.570   3.833  -9.416
  435    HA   GLN  55           HA       GLN  55   2.791   2.165 -10.265
  436    HB2  GLN  55          1HB       GLN  55   4.652   4.473 -10.248
  437    HB3  GLN  55          2HB       GLN  55   5.288   2.892 -10.710
  438    HG2  GLN  55          1HG       GLN  55   2.997   4.372 -11.972
  439    HG3  GLN  55          2HG       GLN  55   4.599   4.131 -12.657
  440   HE21  GLN  55          1HE2      GLN  55   5.185   2.056 -13.371
  441   HE22  GLN  55          2HE2      GLN  55   3.992   0.862 -13.744
  442    H    LEU  56           H        LEU  56   2.410   1.730  -7.671
  443    HA   LEU  56           HA       LEU  56   4.994   0.770  -6.690
  444    HB2  LEU  56          1HB       LEU  56   2.810   2.231  -5.382
  445    HB3  LEU  56          2HB       LEU  56   3.399   0.851  -4.445
  446    HG   LEU  56           HG       LEU  56   5.065   3.150  -5.479
  447   HD11  LEU  56          1HD1      LEU  56   3.578   3.884  -3.712
  448   HD12  LEU  56          2HD1      LEU  56   5.230   3.789  -3.105
  449   HD13  LEU  56          3HD1      LEU  56   4.070   2.526  -2.700
  450   HD21  LEU  56          1HD2      LEU  56   6.795   2.216  -3.972
  451   HD22  LEU  56          2HD2      LEU  56   6.404   1.159  -5.329
  452   HD23  LEU  56          3HD2      LEU  56   5.763   0.807  -3.724
  453    H    PHE  57           H        PHE  57   1.903  -0.021  -7.745
  454    HA   PHE  57           HA       PHE  57   2.333  -2.839  -7.132
  455    HB2  PHE  57          1HB       PHE  57   0.806  -2.195  -5.369
  456    HB3  PHE  57          2HB       PHE  57  -0.202  -1.302  -6.496
  457    HD1  PHE  57           HD1      PHE  57   0.823  -4.679  -5.435
  458    HD2  PHE  57           HD2      PHE  57  -1.899  -2.368  -7.755
  459    HE1  PHE  57           HE1      PHE  57  -0.596  -6.665  -5.747
  460    HE2  PHE  57           HE2      PHE  57  -3.320  -4.350  -8.069
  461    HZ   PHE  57           HZ       PHE  57  -2.670  -6.498  -7.064
  462    H    ASP  58           H        ASP  58   1.685  -4.167  -8.738
  463    HA   ASP  58           HA       ASP  58   0.384  -2.947 -11.083
  464    HB2  ASP  58          1HB       ASP  58   2.743  -3.305 -11.565
  465    HB3  ASP  58          2HB       ASP  58   2.640  -4.968 -11.004
  466    H    ASP  59           H        ASP  59  -1.126  -4.199 -12.159
  467    HA   ASP  59           HA       ASP  59  -2.629  -5.969 -10.544
  468    HB2  ASP  59          1HB       ASP  59  -2.806  -5.246 -13.456
  469    HB3  ASP  59          2HB       ASP  59  -3.900  -6.388 -12.713
  470    H    THR  60           H        THR  60  -0.003  -6.544 -12.640
  471    HA   THR  60           HA       THR  60  -0.663  -9.395 -12.823
  472    HB   THR  60           HB       THR  60   1.205  -7.654 -14.407
  473    HG1  THR  60           HG1      THR  60  -1.238  -8.990 -14.876
  474   HG21  THR  60          1HG2      THR  60   0.881 -10.650 -14.589
  475   HG22  THR  60          2HG2      THR  60   2.312  -9.792 -14.014
  476   HG23  THR  60          3HG2      THR  60   1.812  -9.640 -15.698
  477    H    GLU  61           H        GLU  61   2.294  -7.396 -12.413
  478    HA   GLU  61           HA       GLU  61   3.736  -9.582 -11.259
  479    HB2  GLU  61          1HB       GLU  61   4.574  -6.701 -11.113
  480    HB3  GLU  61          2HB       GLU  61   5.574  -8.142 -11.147
  481    HG2  GLU  61          1HG       GLU  61   4.826  -8.557 -13.464
  482    HG3  GLU  61          2HG       GLU  61   3.978  -7.015 -13.421
  483    H    GLY  62           H        GLY  62   1.528  -7.377  -9.956
  484    HA2  GLY  62          1HA       GLY  62   0.813  -7.155  -7.763
  485    HA3  GLY  62          2HA       GLY  62   2.070  -8.303  -7.292
  486    HA   PRO  63           HA       PRO  63   3.405  -4.388  -5.324
  487    HB2  PRO  63          1HB       PRO  63   5.088  -6.381  -3.909
  488    HB3  PRO  63          2HB       PRO  63   4.072  -5.091  -3.252
  489    HG2  PRO  63          1HG       PRO  63   3.345  -7.670  -3.096
  490    HG3  PRO  63          2HG       PRO  63   2.159  -6.373  -3.329
  491    HD2  PRO  63          1HD       PRO  63   3.255  -8.326  -5.308
  492    HD3  PRO  63          2HD       PRO  63   1.616  -7.637  -5.182
  493    H    LEU  64           H        LEU  64   4.906  -3.216  -6.297
  494    HA   LEU  64           HA       LEU  64   7.059  -4.503  -7.769
  495    HB2  LEU  64          1HB       LEU  64   6.497  -1.547  -7.515
  496    HB3  LEU  64          2HB       LEU  64   7.489  -2.344  -8.718
  497    HG   LEU  64           HG       LEU  64   4.501  -2.649  -8.474
  498   HD11  LEU  64          1HD1      LEU  64   5.130  -0.446  -9.301
  499   HD12  LEU  64          2HD1      LEU  64   4.427  -1.424 -10.589
  500   HD13  LEU  64          3HD1      LEU  64   6.173  -1.189 -10.514
  501   HD21  LEU  64          1HD2      LEU  64   5.613  -4.666  -9.275
  502   HD22  LEU  64          2HD2      LEU  64   6.427  -3.719 -10.520
  503   HD23  LEU  64          3HD2      LEU  64   4.672  -3.892 -10.551
  504    H    VAL  65           H        VAL  65   8.446  -5.271  -6.327
  505    HA   VAL  65           HA       VAL  65   9.034  -4.336  -3.826
  506    HB   VAL  65           HB       VAL  65  10.775  -5.955  -5.664
  507   HG11  VAL  65          1HG1      VAL  65  11.933  -6.699  -3.629
  508   HG12  VAL  65          2HG1      VAL  65  11.009  -5.528  -2.687
  509   HG13  VAL  65          3HG1      VAL  65  12.143  -4.972  -3.919
  510   HG21  VAL  65          1HG2      VAL  65   8.668  -7.011  -5.236
  511   HG22  VAL  65          2HG2      VAL  65   8.810  -6.695  -3.508
  512   HG23  VAL  65          3HG2      VAL  65   9.908  -7.834  -4.290
  513    H    ASP  66           H        ASP  66  10.834  -3.604  -6.827
  514    HA   ASP  66           HA       ASP  66  12.960  -2.284  -5.564
  515    HB2  ASP  66          1HB       ASP  66  13.093  -3.001  -7.876
  516    HB3  ASP  66          2HB       ASP  66  11.855  -1.838  -8.335
  517    H    ASN  67           H        ASN  67  10.098  -0.844  -7.168
  518    HA   ASN  67           HA       ASN  67  10.626   1.796  -6.387
  519    HB2  ASN  67          1HB       ASN  67   8.055   0.405  -7.110
  520    HB3  ASN  67          2HB       ASN  67   8.117   2.112  -6.702
  521   HD21  ASN  67          1HD2      ASN  67   7.385   2.652  -8.769
  522   HD22  ASN  67          2HD2      ASN  67   8.433   2.582 -10.147
  523    H    LEU  68           H        LEU  68   9.037  -0.843  -4.764
  524    HA   LEU  68           HA       LEU  68   7.884   0.553  -2.633
  525    HB2  LEU  68          1HB       LEU  68   8.759  -2.270  -3.062
  526    HB3  LEU  68          2HB       LEU  68   8.278  -1.751  -1.454
  527    HG   LEU  68           HG       LEU  68   6.514  -1.366  -3.859
  528   HD11  LEU  68          1HD1      LEU  68   6.529  -3.678  -1.922
  529   HD12  LEU  68          2HD1      LEU  68   7.000  -3.750  -3.620
  530   HD13  LEU  68          3HD1      LEU  68   5.331  -3.386  -3.184
  531   HD21  LEU  68          1HD2      LEU  68   5.970  -1.439  -0.900
  532   HD22  LEU  68          2HD2      LEU  68   4.765  -1.212  -2.167
  533   HD23  LEU  68          3HD2      LEU  68   6.016   0.002  -1.912
  534    H    VAL  69           H        VAL  69  11.063  -0.994  -2.903
  535    HA   VAL  69           HA       VAL  69  11.956  -0.236  -0.317
  536    HB   VAL  69           HB       VAL  69  13.551  -0.964  -2.763
  537   HG11  VAL  69          1HG1      VAL  69  15.314  -1.539  -1.109
  538   HG12  VAL  69          2HG1      VAL  69  14.323  -0.781   0.140
  539   HG13  VAL  69          3HG1      VAL  69  14.956   0.185  -1.192
  540   HG21  VAL  69          1HG2      VAL  69  12.711  -2.672  -0.433
  541   HG22  VAL  69          2HG2      VAL  69  13.623  -3.188  -1.853
  542   HG23  VAL  69          3HG2      VAL  69  11.944  -2.681  -2.022
  543    H    HIS  70           H        HIS  70  12.337   1.185  -3.539
  544    HA   HIS  70           HA       HIS  70  14.166   3.198  -2.786
  545    HB2  HIS  70          1HB       HIS  70  12.254   2.928  -5.090
  546    HB3  HIS  70          2HB       HIS  70  13.203   4.393  -4.869
  547    HD1  HIS  70           HD1      HIS  70  15.297   4.385  -6.160
  548    HD2  HIS  70           HD2      HIS  70  14.150   0.536  -5.120
  549    HE1  HIS  70           HE1      HIS  70  16.989   2.866  -7.227
  550    HE2  HIS  70           HE2      HIS  70  16.140   0.542  -6.759
  551    H    GLN  71           H        GLN  71  10.728   2.947  -2.470
  552    HA   GLN  71           HA       GLN  71  10.434   5.755  -1.782
  553    HB2  GLN  71          1HB       GLN  71   8.672   4.642  -3.083
  554    HB3  GLN  71          2HB       GLN  71   8.414   3.507  -1.771
  555    HG2  GLN  71          1HG       GLN  71   6.707   5.227  -1.793
  556    HG3  GLN  71          2HG       GLN  71   7.675   5.295  -0.324
  557   HE21  GLN  71          1HE2      GLN  71   6.016   7.327  -1.632
  558   HE22  GLN  71          2HE2      GLN  71   7.056   8.677  -1.898
  559    H    LEU  72           H        LEU  72   9.677   2.666  -0.180
  560    HA   LEU  72           HA       LEU  72   9.052   3.804   2.286
  561    HB2  LEU  72          1HB       LEU  72   9.898   1.011   1.573
  562    HB3  LEU  72          2HB       LEU  72   9.409   1.472   3.190
  563    HG   LEU  72           HG       LEU  72   7.660   1.713   0.741
  564   HD11  LEU  72          1HD1      LEU  72   6.451  -0.212   1.686
  565   HD12  LEU  72          2HD1      LEU  72   7.676  -0.350   2.948
  566   HD13  LEU  72          3HD1      LEU  72   8.114  -0.626   1.262
  567   HD21  LEU  72          1HD2      LEU  72   7.108   2.103   3.680
  568   HD22  LEU  72          2HD2      LEU  72   5.858   1.971   2.443
  569   HD23  LEU  72          3HD2      LEU  72   7.000   3.313   2.398
  570    H    ALA  73           H        ALA  73  12.115   2.428   1.134
  571    HA   ALA  73           HA       ALA  73  13.449   2.743   3.637
  572    HB1  ALA  73          1HB       ALA  73  14.056   1.060   1.937
  573    HB2  ALA  73          2HB       ALA  73  15.420   2.040   2.485
  574    HB3  ALA  73          3HB       ALA  73  14.672   2.365   0.920
  575    H    HIS  74           H        HIS  74  12.205   5.152   2.742
  576    HA   HIS  74           HA       HIS  74  14.009   7.029   1.661
  577    HB2  HIS  74          1HB       HIS  74  11.444   7.165   1.976
  578    HB3  HIS  74          2HB       HIS  74  11.818   7.689   3.612
  579    HD1  HIS  74           HD1      HIS  74  10.679   9.190   0.804
  580    HD2  HIS  74           HD2      HIS  74  14.056   9.925   3.110
  581    HE1  HIS  74           HE1      HIS  74  11.308  11.576   0.336
  582    HE2  HIS  74           HE2      HIS  74  13.206  12.057   1.920
  583    H    GLY  75           H        GLY  75  16.006   6.747   2.736
  584    HA2  GLY  75          1HA       GLY  75  17.544   7.664   4.229
  585    HA3  GLY  75          2HA       GLY  75  16.207   8.260   5.202
  586    H    ARG  76           H        ARG  76  16.382   4.928   4.185
  587    HA   ARG  76           HA       ARG  76  17.360   4.116   6.802
  588    HB2  ARG  76          1HB       ARG  76  14.579   3.776   5.855
  589    HB3  ARG  76          2HB       ARG  76  15.292   2.404   6.701
  590    HG2  ARG  76          1HG       ARG  76  15.878   3.999   8.550
  591    HG3  ARG  76          2HG       ARG  76  14.902   5.210   7.721
  592    HD2  ARG  76          1HD       ARG  76  12.965   3.740   7.868
  593    HD3  ARG  76          2HD       ARG  76  13.937   2.536   8.708
  594    HE   ARG  76           HE       ARG  76  13.987   5.074  10.014
  595   HH11  ARG  76          1HH1      ARG  76  12.130   2.130   9.634
  596   HH12  ARG  76          2HH1      ARG  76  11.276   2.331  11.130
  597   HH21  ARG  76          1HH2      ARG  76  12.877   5.336  11.983
  598   HH22  ARG  76          2HH2      ARG  76  11.710   4.150  12.473
  599    H    ASP  77           H        ASP  77  17.497   1.639   6.905
  600    HA   ASP  77           HA       ASP  77  19.194   0.730   4.890
  601    HB2  ASP  77          1HB       ASP  77  17.657  -0.842   6.956
  602    HB3  ASP  77          2HB       ASP  77  18.958  -1.494   5.968
  603    H    ALA  78           H        ALA  78  18.551   0.553   2.877
  604    HA   ALA  78           HA       ALA  78  16.025  -0.119   1.914
  605    HB1  ALA  78          1HB       ALA  78  17.116  -0.436  -0.227
  606    HB2  ALA  78          2HB       ALA  78  18.688  -0.510   0.570
  607    HB3  ALA  78          3HB       ALA  78  17.755   0.986   0.595
  608    H    GLU  79           H        GLU  79  18.805  -2.164   2.645
  609    HA   GLU  79           HA       GLU  79  17.870  -4.550   1.514
  610    HB2  GLU  79          1HB       GLU  79  19.725  -4.032   3.825
  611    HB3  GLU  79          2HB       GLU  79  19.364  -5.652   3.251
  612    HG2  GLU  79          1HG       GLU  79  20.159  -4.897   0.984
  613    HG3  GLU  79          2HG       GLU  79  20.756  -3.441   1.782
  614    H    GLU  80           H        GLU  80  17.493  -3.273   4.796
  615    HA   GLU  80           HA       GLU  80  16.059  -5.473   5.828
  616    HB2  GLU  80          1HB       GLU  80  15.999  -2.578   6.679
  617    HB3  GLU  80          2HB       GLU  80  15.427  -3.940   7.633
  618    HG2  GLU  80          1HG       GLU  80  18.260  -3.496   6.742
  619    HG3  GLU  80          2HG       GLU  80  17.629  -3.159   8.345
  620    H    VAL  81           H        VAL  81  15.068  -2.386   4.424
  621    HA   VAL  81           HA       VAL  81  12.308  -2.639   4.682
  622    HB   VAL  81           HB       VAL  81  13.961  -1.215   2.604
  623   HG11  VAL  81          1HG1      VAL  81  11.752  -1.596   1.675
  624   HG12  VAL  81          2HG1      VAL  81  11.934   0.101   2.130
  625   HG13  VAL  81          3HG1      VAL  81  11.005  -0.997   3.157
  626   HG21  VAL  81          1HG2      VAL  81  12.574  -0.324   5.112
  627   HG22  VAL  81          2HG2      VAL  81  13.352   0.751   3.954
  628   HG23  VAL  81          3HG2      VAL  81  14.312  -0.432   4.837
  629    H    ARG  82           H        ARG  82  14.406  -3.577   1.945
  630    HA   ARG  82           HA       ARG  82  12.470  -4.657   0.274
  631    HB2  ARG  82          1HB       ARG  82  14.878  -4.269  -0.276
  632    HB3  ARG  82          2HB       ARG  82  15.270  -5.720   0.636
  633    HG2  ARG  82          1HG       ARG  82  13.798  -7.008  -0.860
  634    HG3  ARG  82          2HG       ARG  82  13.554  -5.551  -1.817
  635    HD2  ARG  82          1HD       ARG  82  16.016  -5.439  -2.140
  636    HD3  ARG  82          2HD       ARG  82  16.142  -7.001  -1.335
  637    HE   ARG  82           HE       ARG  82  14.299  -7.133  -3.481
  638   HH11  ARG  82          1HH1      ARG  82  17.726  -6.994  -2.798
  639   HH12  ARG  82          2HH1      ARG  82  18.179  -7.845  -4.242
  640   HH21  ARG  82          1HH2      ARG  82  14.887  -8.240  -5.392
  641   HH22  ARG  82          2HH2      ARG  82  16.560  -8.558  -5.717
  642    H    THR  83           H        THR  83  14.290  -6.173   2.891
  643    HA   THR  83           HA       THR  83  13.430  -8.814   2.482
  644    HB   THR  83           HB       THR  83  14.336  -7.405   5.000
  645    HG1  THR  83           HG1      THR  83  16.095  -7.434   3.777
  646   HG21  THR  83          1HG2      THR  83  14.832  -9.635   5.885
  647   HG22  THR  83          2HG2      THR  83  14.114 -10.368   4.450
  648   HG23  THR  83          3HG2      THR  83  13.109  -9.443   5.567
  649    H    GLU  84           H        GLU  84  12.231  -6.310   4.727
  650    HA   GLU  84           HA       GLU  84  10.153  -7.877   5.793
  651    HB2  GLU  84          1HB       GLU  84  10.395  -4.870   5.655
  652    HB3  GLU  84          2HB       GLU  84   9.270  -5.761   6.674
  653    HG2  GLU  84          1HG       GLU  84  11.174  -6.826   7.801
  654    HG3  GLU  84          2HG       GLU  84  12.272  -5.850   6.830
  655    H    VAL  85           H        VAL  85  10.199  -5.598   3.063
  656    HA   VAL  85           HA       VAL  85   7.485  -5.644   2.420
  657    HB   VAL  85           HB       VAL  85   9.948  -5.360   0.705
  658   HG11  VAL  85          1HG1      VAL  85   7.078  -5.164  -0.203
  659   HG12  VAL  85          2HG1      VAL  85   8.240  -6.398  -0.688
  660   HG13  VAL  85          3HG1      VAL  85   8.491  -4.715  -1.160
  661   HG21  VAL  85          1HG2      VAL  85   7.788  -3.435   1.551
  662   HG22  VAL  85          2HG2      VAL  85   9.162  -3.045   0.513
  663   HG23  VAL  85          3HG2      VAL  85   9.430  -3.518   2.191
  664    H    LEU  86           H        LEU  86  10.099  -7.813   1.368
  665    HA   LEU  86           HA       LEU  86   8.617  -9.375  -0.398
  666    HB2  LEU  86          1HB       LEU  86  11.082  -9.997   1.220
  667    HB3  LEU  86          2HB       LEU  86  10.416 -11.090   0.009
  668    HG   LEU  86           HG       LEU  86  11.263  -8.269  -0.607
  669   HD11  LEU  86          1HD1      LEU  86  13.179  -9.511   0.222
  670   HD12  LEU  86          2HD1      LEU  86  13.311  -9.253  -1.520
  671   HD13  LEU  86          3HD1      LEU  86  12.824 -10.828  -0.893
  672   HD21  LEU  86          1HD2      LEU  86  10.650 -10.677  -2.305
  673   HD22  LEU  86          2HD2      LEU  86  11.330  -9.168  -2.913
  674   HD23  LEU  86          3HD2      LEU  86   9.717  -9.186  -2.202
  675    H    LYS  87           H        LYS  87   8.889  -9.526   3.081
  676    HA   LYS  87           HA       LYS  87   7.778 -12.131   3.410
  677    HB2  LYS  87          1HB       LYS  87   7.979  -9.766   5.276
  678    HB3  LYS  87          2HB       LYS  87   7.290 -11.310   5.759
  679    HG2  LYS  87          1HG       LYS  87   9.404 -12.416   5.298
  680    HG3  LYS  87          2HG       LYS  87  10.104 -10.871   4.778
  681    HD2  LYS  87          1HD       LYS  87   9.728  -9.959   7.014
  682    HD3  LYS  87          2HD       LYS  87   9.032 -11.495   7.528
  683    HE2  LYS  87          1HE       LYS  87  11.853 -11.060   6.567
  684    HE3  LYS  87          2HE       LYS  87  11.354 -11.283   8.243
  685    HZ1  LYS  87          1HZ       LYS  87  12.200 -13.332   7.327
  686    HZ2  LYS  87          2HZ       LYS  87  11.080 -13.279   6.061
  687    HZ3  LYS  87          3HZ       LYS  87  10.548 -13.494   7.652
  688    H    CYS  88           H        CYS  88   6.479  -9.119   2.576
  689    HA   CYS  88           HA       CYS  88   3.770  -9.918   3.355
  690    HB2  CYS  88          1HB       CYS  88   5.066  -7.280   2.781
  691    HB3  CYS  88          2HB       CYS  88   3.311  -7.442   2.680
  692    H    VAL  89           H        VAL  89   5.824 -10.040   0.769
  693    HA   VAL  89           HA       VAL  89   3.846  -9.553  -1.289
  694    HB   VAL  89           HB       VAL  89   6.670 -10.597  -1.504
  695   HG11  VAL  89          1HG1      VAL  89   5.377 -11.335  -3.388
  696   HG12  VAL  89          2HG1      VAL  89   6.416 -10.006  -3.905
  697   HG13  VAL  89          3HG1      VAL  89   4.702  -9.721  -3.604
  698   HG21  VAL  89          1HG2      VAL  89   6.637  -8.319  -0.693
  699   HG22  VAL  89          2HG2      VAL  89   5.544  -7.846  -1.994
  700   HG23  VAL  89          3HG2      VAL  89   7.192  -8.352  -2.367
  701    H    ASP  90           H        ASP  90   2.313 -11.055  -1.417
  702    HA   ASP  90           HA       ASP  90   3.142 -13.875  -1.578
  703    HB2  ASP  90          1HB       ASP  90   0.433 -12.749  -0.834
  704    HB3  ASP  90          2HB       ASP  90   0.806 -14.464  -0.986
  705    H    LYS  91           H        LYS  91   1.677 -15.181  -3.046
  706    HA   LYS  91           HA       LYS  91   1.444 -13.859  -5.608
  707    HB2  LYS  91          1HB       LYS  91   0.521 -16.655  -4.978
  708    HB3  LYS  91          2HB       LYS  91   1.023 -15.985  -6.522
  709    HG2  LYS  91          1HG       LYS  91   3.315 -15.782  -5.640
  710    HG3  LYS  91          2HG       LYS  91   2.778 -16.604  -4.177
  711    HD2  LYS  91          1HD       LYS  91   3.835 -18.183  -5.696
  712    HD3  LYS  91          2HD       LYS  91   2.117 -18.549  -5.524
  713    HE2  LYS  91          1HE       LYS  91   1.661 -17.415  -7.638
  714    HE3  LYS  91          2HE       LYS  91   3.368 -17.017  -7.802
  715    HZ1  LYS  91          1HZ       LYS  91   3.845 -19.405  -7.872
  716    HZ2  LYS  91          2HZ       LYS  91   2.826 -18.925  -9.132
  717    HZ3  LYS  91          3HZ       LYS  91   2.189 -19.742  -7.795
  718    H    ASN  92           H        ASN  92  -0.492 -13.978  -6.909
  719    HA   ASN  92           HA       ASN  92  -2.824 -13.155  -5.421
  720    HB2  ASN  92          1HB       ASN  92  -2.116 -12.060  -7.553
  721    HB3  ASN  92          2HB       ASN  92  -2.500 -13.553  -8.397
  722   HD21  ASN  92          1HD2      ASN  92  -3.928 -12.246  -9.655
  723   HD22  ASN  92          2HD2      ASN  92  -5.513 -11.865  -9.066
  724    H    THR  93           H        THR  93  -2.866 -15.340  -4.370
  725    HA   THR  93           HA       THR  93  -4.035 -17.482  -5.924
  726    HB   THR  93           HB       THR  93  -4.221 -18.609  -3.692
  727    HG1  THR  93           HG1      THR  93  -3.085 -17.507  -1.955
  728   HG21  THR  93          1HG2      THR  93  -1.808 -18.888  -3.381
  729   HG22  THR  93          2HG2      THR  93  -1.522 -17.474  -4.396
  730   HG23  THR  93          3HG2      THR  93  -2.255 -18.922  -5.086
  731    H    ASP  94           H        ASP  94  -5.127 -14.736  -4.282
  732    HA   ASP  94           HA       ASP  94  -7.733 -15.731  -3.583
  733    HB2  ASP  94          1HB       ASP  94  -6.586 -12.934  -3.650
  734    HB3  ASP  94          2HB       ASP  94  -8.222 -13.317  -3.096
  735    H    ASN  95           H        ASN  95  -6.233 -14.437  -6.331
  736    HA   ASN  95           HA       ASN  95  -6.897 -14.038  -8.439
  737    HB2  ASN  95          1HB       ASN  95  -9.368 -15.510  -7.537
  738    HB3  ASN  95          2HB       ASN  95  -9.042 -15.056  -9.201
  739   HD21  ASN  95          1HD2      ASN  95  -9.335 -17.680  -7.895
  740   HD22  ASN  95          2HD2      ASN  95  -7.886 -18.551  -8.292
  741    H    ASN  96           H        ASN  96  -7.533 -12.176  -6.209
  742    HA   ASN  96           HA       ASN  96  -9.265 -10.431  -7.781
  743    HB2  ASN  96          1HB       ASN  96 -10.791 -11.216  -6.119
  744    HB3  ASN  96          2HB       ASN  96  -9.595 -11.040  -4.837
  745   HD21  ASN  96          1HD2      ASN  96 -11.788  -9.368  -6.973
  746   HD22  ASN  96          2HD2      ASN  96 -11.809  -7.878  -6.094
  747    H    ALA  97           H        ALA  97  -8.294  -8.552  -8.117
  748    HA   ALA  97           HA       ALA  97  -5.649  -8.206  -7.138
  749    HB1  ALA  97          1HB       ALA  97  -7.297  -6.289  -8.766
  750    HB2  ALA  97          2HB       ALA  97  -6.342  -7.616  -9.422
  751    HB3  ALA  97          3HB       ALA  97  -5.544  -6.286  -8.581
  752    H    CYS  98           H        CYS  98  -8.745  -6.702  -6.323
  753    HA   CYS  98           HA       CYS  98  -7.692  -4.530  -4.852
  754    HB2  CYS  98          1HB       CYS  98 -10.301  -5.994  -4.385
  755    HB3  CYS  98          2HB       CYS  98  -9.866  -4.433  -3.707
  756    H    HIS  99           H        HIS  99  -8.486  -7.861  -3.868
  757    HA   HIS  99           HA       HIS  99  -7.869  -7.338  -1.110
  758    HB2  HIS  99          1HB       HIS  99  -9.452  -9.140  -1.938
  759    HB3  HIS  99          2HB       HIS  99  -8.031 -10.048  -2.438
  760    HD1  HIS  99           HD1      HIS  99  -8.091 -11.960  -0.788
  761    HD2  HIS  99           HD2      HIS  99  -8.424  -8.241   1.056
  762    HE1  HIS  99           HE1      HIS  99  -7.958 -12.409   1.677
  763    HE2  HIS  99           HE2      HIS  99  -8.176 -10.156   2.778
  764    H    TRP 100           H        TRP 100  -6.128  -8.409  -3.903
  765    HA   TRP 100           HA       TRP 100  -3.899  -9.555  -2.591
  766    HB2  TRP 100          1HB       TRP 100  -4.476  -9.897  -4.997
  767    HB3  TRP 100          2HB       TRP 100  -3.962  -8.240  -5.322
  768    HD1  TRP 100           HD1      TRP 100  -1.712  -9.921  -2.864
  769    HE1  TRP 100           HE1      TRP 100   0.461 -10.663  -4.021
  770    HE3  TRP 100           HE3      TRP 100  -3.102  -9.241  -7.739
  771    HZ2  TRP 100           HZ2      TRP 100   1.453 -10.944  -6.645
  772    HZ3  TRP 100           HZ3      TRP 100  -1.486  -9.767  -9.505
  773    HH2  TRP 100           HH2      TRP 100   0.741 -10.607  -8.982
  774    H    ALA 101           H        ALA 101  -4.316  -6.360  -4.112
  775    HA   ALA 101           HA       ALA 101  -1.875  -5.259  -3.271
  776    HB1  ALA 101          1HB       ALA 101  -3.197  -4.279  -5.057
  777    HB2  ALA 101          2HB       ALA 101  -2.912  -3.088  -3.785
  778    HB3  ALA 101          3HB       ALA 101  -4.480  -3.883  -3.914
  779    H    PHE 102           H        PHE 102  -5.072  -5.300  -1.811
  780    HA   PHE 102           HA       PHE 102  -4.506  -3.545   0.302
  781    HB2  PHE 102          1HB       PHE 102  -6.780  -4.044  -0.372
  782    HB3  PHE 102          2HB       PHE 102  -6.587  -5.723   0.121
  783    HD1  PHE 102           HD1      PHE 102  -6.417  -2.253   1.451
  784    HD2  PHE 102           HD2      PHE 102  -7.240  -6.351   2.267
  785    HE1  PHE 102           HE1      PHE 102  -7.203  -1.647   3.702
  786    HE2  PHE 102           HE2      PHE 102  -8.029  -5.749   4.514
  787    HZ   PHE 102           HZ       PHE 102  -8.011  -3.394   5.238
  788    H    ARG 103           H        ARG 103  -4.007  -6.991  -0.121
  789    HA   ARG 103           HA       ARG 103  -3.548  -7.556   2.638
  790    HB2  ARG 103          1HB       ARG 103  -4.197  -9.297   0.991
  791    HB3  ARG 103          2HB       ARG 103  -2.611  -9.128   0.249
  792    HG2  ARG 103          1HG       ARG 103  -1.520  -9.862   2.242
  793    HG3  ARG 103          2HG       ARG 103  -3.044  -9.875   3.119
  794    HD2  ARG 103          1HD       ARG 103  -2.364 -12.125   2.461
  795    HD3  ARG 103          2HD       ARG 103  -3.867 -11.650   1.684
  796    HE   ARG 103           HE       ARG 103  -1.389 -11.287   0.185
  797   HH11  ARG 103          1HH1      ARG 103  -4.312 -13.085   0.761
  798   HH12  ARG 103          2HH1      ARG 103  -4.307 -13.884  -0.781
  799   HH21  ARG 103          1HH2      ARG 103  -1.328 -12.367  -1.853
  800   HH22  ARG 103          2HH2      ARG 103  -2.567 -13.512  -2.246
  801    H    GLY 104           H        GLY 104  -1.482  -6.766  -0.120
  802    HA2  GLY 104          1HA       GLY 104   1.005  -7.125   1.164
  803    HA3  GLY 104          2HA       GLY 104   0.705  -6.041  -0.200
  804    H    PHE 105           H        PHE 105  -1.115  -4.308   0.910
  805    HA   PHE 105           HA       PHE 105   0.573  -2.538   2.311
  806    HB2  PHE 105          1HB       PHE 105  -1.070  -1.614   0.872
  807    HB3  PHE 105          2HB       PHE 105  -2.362  -2.492   1.677
  808    HD1  PHE 105           HD1      PHE 105  -3.799  -0.952   2.648
  809    HD2  PHE 105           HD2      PHE 105   0.408  -0.351   2.952
  810    HE1  PHE 105           HE1      PHE 105  -4.186   1.003   4.082
  811    HE2  PHE 105           HE2      PHE 105   0.019   1.610   4.385
  812    HZ   PHE 105           HZ       PHE 105  -2.276   2.288   4.953
  813    H    LYS 106           H        LYS 106  -2.219  -4.462   3.291
  814    HA   LYS 106           HA       LYS 106  -2.392  -3.514   5.923
  815    HB2  LYS 106          1HB       LYS 106  -4.327  -4.537   5.284
  816    HB3  LYS 106          2HB       LYS 106  -3.509  -5.843   4.437
  817    HG2  LYS 106          1HG       LYS 106  -2.942  -6.835   6.634
  818    HG3  LYS 106          2HG       LYS 106  -3.861  -5.541   7.411
  819    HD2  LYS 106          1HD       LYS 106  -5.882  -6.258   6.276
  820    HD3  LYS 106          2HD       LYS 106  -4.980  -7.502   5.408
  821    HE2  LYS 106          1HE       LYS 106  -5.260  -7.365   8.405
  822    HE3  LYS 106          2HE       LYS 106  -6.265  -8.359   7.358
  823    HZ1  LYS 106          1HZ       LYS 106  -4.310  -9.567   6.662
  824    HZ2  LYS 106          2HZ       LYS 106  -4.439  -9.610   8.346
  825    HZ3  LYS 106          3HZ       LYS 106  -3.316  -8.585   7.612
  826    H    CYS 107           H        CYS 107  -0.708  -6.291   4.538
  827    HA   CYS 107           HA       CYS 107   0.160  -7.468   6.909
  828    HB2  CYS 107          1HB       CYS 107   0.321  -8.727   4.915
  829    HB3  CYS 107          2HB       CYS 107   1.255  -7.482   4.096
  830    H    PHE 108           H        PHE 108   1.594  -4.940   4.907
  831    HA   PHE 108           HA       PHE 108   4.071  -4.935   6.340
  832    HB2  PHE 108          1HB       PHE 108   3.755  -4.369   3.899
  833    HB3  PHE 108          2HB       PHE 108   3.074  -2.833   4.431
  834    HD1  PHE 108           HD1      PHE 108   6.106  -4.874   4.200
  835    HD2  PHE 108           HD2      PHE 108   4.492  -1.101   5.334
  836    HE1  PHE 108           HE1      PHE 108   8.376  -3.940   4.316
  837    HE2  PHE 108           HE2      PHE 108   6.763  -0.162   5.445
  838    HZ   PHE 108           HZ       PHE 108   8.705  -1.582   4.933
  839    H    GLN 109           H        GLN 109   1.300  -2.688   6.131
  840    HA   GLN 109           HA       GLN 109   2.354  -0.712   7.816
  841    HB2  GLN 109          1HB       GLN 109   0.133   0.183   7.948
  842    HB3  GLN 109          2HB       GLN 109   0.404  -0.394   6.313
  843    HG2  GLN 109          1HG       GLN 109  -1.616  -1.311   6.557
  844    HG3  GLN 109          2HG       GLN 109  -0.750  -2.570   7.444
  845   HE21  GLN 109          1HE2      GLN 109  -3.508  -1.746   7.721
  846   HE22  GLN 109          2HE2      GLN 109  -3.705  -1.237   9.362
  847    H    LYS 110           H        LYS 110   0.883  -3.752   8.526
  848    HA   LYS 110           HA       LYS 110   0.031  -3.271  11.169
  849    HB2  LYS 110          1HB       LYS 110  -0.650  -5.185   9.745
  850    HB3  LYS 110          2HB       LYS 110   0.963  -5.853   9.904
  851    HG2  LYS 110          1HG       LYS 110  -0.414  -7.008  11.414
  852    HG3  LYS 110          2HG       LYS 110   0.574  -5.913  12.375
  853    HD2  LYS 110          1HD       LYS 110  -1.269  -4.338  12.522
  854    HD3  LYS 110          2HD       LYS 110  -2.265  -5.390  11.516
  855    HE2  LYS 110          1HE       LYS 110  -2.826  -5.659  13.870
  856    HE3  LYS 110          2HE       LYS 110  -2.135  -7.140  13.214
  857    HZ1  LYS 110          1HZ       LYS 110  -0.672  -5.133  14.837
  858    HZ2  LYS 110          2HZ       LYS 110  -0.021  -6.566  14.221
  859    HZ3  LYS 110          3HZ       LYS 110  -1.237  -6.625  15.393
  860    H    ASN 111           H        ASN 111   3.138  -3.925   9.750
  861    HA   ASN 111           HA       ASN 111   4.309  -4.254  12.435
  862    HB2  ASN 111          1HB       ASN 111   5.590  -4.945   9.786
  863    HB3  ASN 111          2HB       ASN 111   6.198  -5.319  11.391
  864   HD21  ASN 111          1HD2      ASN 111   5.616  -7.092   9.174
  865   HD22  ASN 111          2HD2      ASN 111   4.464  -8.237   9.759
  866    H    ASN 112           H        ASN 112   4.378  -2.388   9.479
  867    HA   ASN 112           HA       ASN 112   6.373  -0.575  10.650
  868    HB2  ASN 112          1HB       ASN 112   6.510  -1.807   7.888
  869    HB3  ASN 112          2HB       ASN 112   7.519  -0.470   8.445
  870   HD21  ASN 112          1HD2      ASN 112   7.916  -3.393   7.631
  871   HD22  ASN 112          2HD2      ASN 112   8.989  -3.992   8.852
  872    H    LEU 113           H        LEU 113   4.233   0.621  10.901
  873    HA   LEU 113           HA       LEU 113   3.221   1.690   8.401
  874    HB2  LEU 113          1HB       LEU 113   1.550   1.110  10.005
  875    HB3  LEU 113          2HB       LEU 113   2.308   2.096  11.239
  876    HG   LEU 113           HG       LEU 113   1.783   4.105   9.837
  877   HD11  LEU 113          1HD1      LEU 113   0.049   2.213   8.275
  878   HD12  LEU 113          2HD1      LEU 113   1.603   2.816   7.705
  879   HD13  LEU 113          3HD1      LEU 113   0.276   3.939   8.004
  880   HD21  LEU 113          1HD2      LEU 113  -0.545   2.385  10.673
  881   HD22  LEU 113          2HD2      LEU 113  -0.606   4.126  10.396
  882   HD23  LEU 113          3HD2      LEU 113   0.368   3.474  11.715
  883    H    SER 114           H        SER 114   5.206   2.664  11.085
  884    HA   SER 114           HA       SER 114   5.120   5.458  10.664
  885    HB2  SER 114          1HB       SER 114   7.393   3.817  11.813
  886    HB3  SER 114          2HB       SER 114   7.133   5.547  12.035
  887    HG   SER 114           HG       SER 114   4.891   4.431  12.753
  888    H    LEU 115           H        LEU 115   7.070   2.890   9.252
  889    HA   LEU 115           HA       LEU 115   8.878   4.499   7.819
  890    HB2  LEU 115          1HB       LEU 115   9.066   2.045   8.210
  891    HB3  LEU 115          2HB       LEU 115   7.786   1.803   7.039
  892    HG   LEU 115           HG       LEU 115   9.255   2.898   5.325
  893   HD11  LEU 115          1HD1      LEU 115  10.696   4.143   6.801
  894   HD12  LEU 115          2HD1      LEU 115  11.658   3.005   5.855
  895   HD13  LEU 115          3HD1      LEU 115  11.272   2.650   7.539
  896   HD21  LEU 115          1HD2      LEU 115  10.677   0.941   5.008
  897   HD22  LEU 115          2HD2      LEU 115   9.045   0.468   5.480
  898   HD23  LEU 115          3HD2      LEU 115  10.352   0.427   6.663
  899    H    ILE 116           H        ILE 116   5.644   3.345   7.152
  900    HA   ILE 116           HA       ILE 116   5.492   4.113   4.446
  901    HB   ILE 116           HB       ILE 116   3.356   3.624   6.521
  902   HG12  ILE 116          1HG1      ILE 116   4.253   2.017   4.116
  903   HG13  ILE 116          2HG1      ILE 116   4.740   1.699   5.785
  904   HG21  ILE 116          1HG2      ILE 116   2.989   4.101   3.569
  905   HG22  ILE 116          2HG2      ILE 116   2.484   5.194   4.858
  906   HG23  ILE 116          3HG2      ILE 116   1.731   3.605   4.699
  907   HD11  ILE 116          1HD1      ILE 116   2.964   0.201   5.049
  908   HD12  ILE 116          2HD1      ILE 116   1.929   1.588   4.720
  909   HD13  ILE 116          3HD1      ILE 116   2.424   1.233   6.371
  910    H    LYS 117           H        LYS 117   4.604   5.727   7.462
  911    HA   LYS 117           HA       LYS 117   3.492   8.047   6.329
  912    HB2  LYS 117          1HB       LYS 117   4.831   7.588   8.990
  913    HB3  LYS 117          2HB       LYS 117   4.032   9.092   8.559
  914    HG2  LYS 117          1HG       LYS 117   1.919   7.874   8.274
  915    HG3  LYS 117          2HG       LYS 117   2.721   6.377   8.746
  916    HD2  LYS 117          1HD       LYS 117   3.246   7.361  10.938
  917    HD3  LYS 117          2HD       LYS 117   2.434   8.852  10.461
  918    HE2  LYS 117          1HE       LYS 117   0.332   7.608  10.211
  919    HE3  LYS 117          2HE       LYS 117   1.151   6.135  10.716
  920    HZ1  LYS 117          1HZ       LYS 117  -0.035   7.118  12.553
  921    HZ2  LYS 117          2HZ       LYS 117   0.793   8.581  12.357
  922    HZ3  LYS 117          3HZ       LYS 117   1.629   7.194  12.848
  923    H    ALA 118           H        ALA 118   6.775   7.261   7.365
  924    HA   ALA 118           HA       ALA 118   7.871   9.839   6.909
  925    HB1  ALA 118          1HB       ALA 118  10.010   8.748   7.247
  926    HB2  ALA 118          2HB       ALA 118   9.237   7.169   7.097
  927    HB3  ALA 118          3HB       ALA 118   8.836   8.223   8.453
  928    H    SER 119           H        SER 119   7.592   6.951   4.919
  929    HA   SER 119           HA       SER 119   9.480   7.591   2.974
  930    HB2  SER 119          1HB       SER 119   8.352   5.968   1.547
  931    HB3  SER 119          2HB       SER 119   8.444   5.368   3.201
  932    HG   SER 119           HG       SER 119   6.257   6.071   3.466
  933    H    ILE 120           H        ILE 120   6.091   8.514   3.221
  934    HA   ILE 120           HA       ILE 120   6.178   9.873   0.655
  935    HB   ILE 120           HB       ILE 120   3.806  10.450   1.138
  936   HG12  ILE 120          1HG1      ILE 120   4.054   8.616   3.518
  937   HG13  ILE 120          2HG1      ILE 120   4.155  10.368   3.658
  938   HG21  ILE 120          1HG2      ILE 120   2.954   8.125   0.966
  939   HG22  ILE 120          2HG2      ILE 120   4.583   7.550   1.323
  940   HG23  ILE 120          3HG2      ILE 120   4.280   8.482  -0.144
  941   HD11  ILE 120          1HD1      ILE 120   1.812   8.824   2.584
  942   HD12  ILE 120          2HD1      ILE 120   1.912  10.574   2.747
  943   HD13  ILE 120          3HD1      ILE 120   1.929   9.554   4.183
  944    H    LYS 121           H        LYS 121   7.183  10.643   3.695
  945    HA   LYS 121           HA       LYS 121   6.204  13.363   3.755
  946    HB2  LYS 121          1HB       LYS 121   6.594  12.058   5.835
  947    HB3  LYS 121          2HB       LYS 121   8.315  12.043   5.470
  948    HG2  LYS 121          1HG       LYS 121   8.267  14.537   5.511
  949    HG3  LYS 121          2HG       LYS 121   6.601  14.438   6.077
  950    HD2  LYS 121          1HD       LYS 121   7.315  13.225   8.051
  951    HD3  LYS 121          2HD       LYS 121   8.982  13.228   7.473
  952    HE2  LYS 121          1HE       LYS 121   7.331  15.640   8.213
  953    HE3  LYS 121          2HE       LYS 121   8.672  14.967   9.136
  954    HZ1  LYS 121          1HZ       LYS 121   8.826  16.208   6.444
  955    HZ2  LYS 121          2HZ       LYS 121  10.125  15.461   7.227
  956    HZ3  LYS 121          3HZ       LYS 121   9.427  16.849   7.889
  957    H    LYS 122           H        LYS 122   7.193  15.073   2.895
  958    HA   LYS 122           HA       LYS 122  10.030  14.927   2.216
  959    HB2  LYS 122          1HB       LYS 122   8.001  14.559   0.288
  960    HB3  LYS 122          2HB       LYS 122   8.617  16.174   0.048
  961    HG2  LYS 122          1HG       LYS 122  10.343  13.713   0.157
  962    HG3  LYS 122          2HG       LYS 122   9.741  14.449  -1.329
  963    HD2  LYS 122          1HD       LYS 122  10.896  16.543  -0.721
  964    HD3  LYS 122          2HD       LYS 122  11.551  15.742   0.708
  965    HE2  LYS 122          1HE       LYS 122  13.193  15.750  -1.074
  966    HE3  LYS 122          2HE       LYS 122  12.666  14.103  -0.735
  967    HZ1  LYS 122          1HZ       LYS 122  12.796  14.483  -3.102
  968    HZ2  LYS 122          2HZ       LYS 122  11.744  15.802  -2.989
  969    HZ3  LYS 122          3HZ       LYS 122  11.179  14.245  -2.660
  970    H    ASP 123           H        ASP 123  10.749  16.573   3.369
  971    HA   ASP 123           HA       ASP 123   9.190  19.036   3.523
  972    HB2  ASP 123          1HB       ASP 123  10.119  17.998   5.599
  973    HB3  ASP 123          2HB       ASP 123  11.738  18.327   4.987
  974    H21  ACD 201           H21      ACD   1  -4.671   5.388   1.839
  975    H22  ACD 201           H22      ACD   1  -3.332   5.504   2.990
  976    H31  ACD 201           H31      ACD   1  -1.974   6.672   1.244
  977    H32  ACD 201           H32      ACD   1  -3.293   6.478   0.095
  978    H41  ACD 201           H41      ACD   1  -3.114   4.006   0.302
  979    H42  ACD 201           H42      ACD   1  -1.580   4.716  -0.212
  980    H5   ACD 201           H5       ACD   1  -2.146   3.399   2.480
  981    H6   ACD 201           H6       ACD   1   0.184   3.801   2.840
  982    H71  ACD 201           H71      ACD   1   0.705   4.669   0.170
  983    H72  ACD 201           H72      ACD   1  -0.205   6.028   0.820
  984    H8   ACD 201           H8       ACD   1   1.599   6.451   2.531
  985    H9   ACD 201           H9       ACD   1   3.737   5.580   1.943
  986   H101  ACD 201          H101      ACD   1   2.726   4.643  -0.609
  987   H102  ACD 201          H102      ACD   1   2.273   3.378   0.538
  988    H11  ACD 201           H11      ACD   1   5.213   4.326   0.460
  989    H12  ACD 201           H12      ACD   1   5.605   2.003   0.175
  990   H131  ACD 201          H131      ACD   1   2.647   1.959  -0.594
  991   H132  ACD 201          H132      ACD   1   3.781   0.608  -0.683
  992    H14  ACD 201           H14      ACD   1   2.605   1.633   2.000
  993    H15  ACD 201           H15      ACD   1   2.518  -0.705   2.435
  994   H161  ACD 201          H161      ACD   1   2.744  -1.387  -0.368
  995   H162  ACD 201          H162      ACD   1   4.394  -0.978   0.109
  996   H171  ACD 201          H171      ACD   1   4.428  -2.670   1.819
  997   H172  ACD 201          H172      ACD   1   2.694  -2.952   1.669
  998   H181  ACD 201          H181      ACD   1   4.751  -3.502  -0.511
  999   H182  ACD 201          H182      ACD   1   3.018  -3.818  -0.633
 1000   H191  ACD 201          H191      ACD   1   4.963  -5.104   1.332
 1001   H192  ACD 201          H192      ACD   1   3.215  -5.347   1.376
 1002   H201  ACD 201          H201      ACD   1   5.018  -6.029  -0.957
 1003   H202  ACD 201          H202      ACD   1   3.306  -6.268  -0.912
 1004   H203  ACD 201          H203      ACD   1   4.332  -7.164   0.153
  Start of MODEL    4
    1    H1   MET   1          1H        MET   1  16.341  12.536 -14.868
    2    H2   MET   1          2H        MET   1  15.361  13.084 -13.604
    3    H3   MET   1          3H        MET   1  16.131  11.585 -13.487
    4    HA   MET   1           HA       MET   1  18.274  12.628 -13.479
    5    HB2  MET   1          1HB       MET   1  18.264  15.167 -13.091
    6    HB3  MET   1          2HB       MET   1  18.022  14.585 -14.729
    7    HG2  MET   1          1HG       MET   1  16.515  16.380 -14.350
    8    HG3  MET   1          2HG       MET   1  15.577  14.892 -14.416
    9    HE1  MET   1          1HE       MET   1  13.567  17.075 -11.866
   10    HE2  MET   1          2HE       MET   1  13.488  16.133 -13.355
   11    HE3  MET   1          3HE       MET   1  14.418  17.631 -13.308
   12    H    GLU   2           H        GLU   2  15.366  12.675 -11.782
   13    HA   GLU   2           HA       GLU   2  16.694  12.183  -9.320
   14    HB2  GLU   2          1HB       GLU   2  16.824  14.610  -9.254
   15    HB3  GLU   2          2HB       GLU   2  15.099  14.732  -9.561
   16    HG2  GLU   2          1HG       GLU   2  14.622  13.683  -7.436
   17    HG3  GLU   2          2HG       GLU   2  16.346  13.488  -7.126
   18    H    PHE   3           H        PHE   3  15.586  10.437  -8.837
   19    HA   PHE   3           HA       PHE   3  12.918   9.911  -9.497
   20    HB2  PHE   3          1HB       PHE   3  14.449   8.119  -8.910
   21    HB3  PHE   3          2HB       PHE   3  14.607   8.754  -7.268
   22    HD1  PHE   3           HD1      PHE   3  13.070   8.164  -5.596
   23    HD2  PHE   3           HD2      PHE   3  12.253   7.211  -9.658
   24    HE1  PHE   3           HE1      PHE   3  11.176   6.766  -4.879
   25    HE2  PHE   3           HE2      PHE   3  10.356   5.810  -8.953
   26    HZ   PHE   3           HZ       PHE   3   9.814   5.586  -6.561
   27    H    THR   4           H        THR   4  11.131  10.768  -8.768
   28    HA   THR   4           HA       THR   4  11.178  12.251  -6.245
   29    HB   THR   4           HB       THR   4   8.698  12.403  -7.763
   30    HG1  THR   4           HG1      THR   4  11.176  13.042  -9.018
   31   HG21  THR   4          1HG2      THR   4   9.313  13.943  -5.986
   32   HG22  THR   4          2HG2      THR   4   9.118  14.803  -7.512
   33   HG23  THR   4          3HG2      THR   4  10.734  14.451  -6.899
   34    H    VAL   5           H        VAL   5  10.427  11.325  -4.512
   35    HA   VAL   5           HA       VAL   5   8.797   8.925  -4.636
   36    HB   VAL   5           HB       VAL   5   9.223   8.619  -2.397
   37   HG11  VAL   5          1HG1      VAL   5  11.332   8.662  -3.542
   38   HG12  VAL   5          2HG1      VAL   5  11.505   9.220  -1.879
   39   HG13  VAL   5          3HG1      VAL   5  11.507  10.383  -3.202
   40   HG21  VAL   5          1HG2      VAL   5   9.627  10.356  -0.740
   41   HG22  VAL   5          2HG2      VAL   5   8.127  10.677  -1.608
   42   HG23  VAL   5          3HG2      VAL   5   9.585  11.590  -1.998
   43    H    SER   6           H        SER   6   6.734   8.710  -3.805
   44    HA   SER   6           HA       SER   6   5.052  10.986  -4.324
   45    HB2  SER   6          1HB       SER   6   4.255   8.266  -3.253
   46    HB3  SER   6          2HB       SER   6   3.211   9.445  -4.048
   47    HG   SER   6           HG       SER   6   5.005   7.640  -5.134
   48    H    THR   7           H        THR   7   5.132  12.537  -2.770
   49    HA   THR   7           HA       THR   7   5.439  11.869   0.008
   50    HB   THR   7           HB       THR   7   5.295  14.296   0.411
   51    HG1  THR   7           HG1      THR   7   4.629  14.322  -2.364
   52   HG21  THR   7          1HG2      THR   7   7.092  13.509  -1.880
   53   HG22  THR   7          2HG2      THR   7   7.449  13.337  -0.163
   54   HG23  THR   7          3HG2      THR   7   7.295  14.943  -0.876
   55    H    THR   8           H        THR   8   3.940  13.156   1.599
   56    HA   THR   8           HA       THR   8   1.421  12.015   1.603
   57    HB   THR   8           HB       THR   8   2.057  14.645   2.929
   58    HG1  THR   8           HG1      THR   8   3.181  13.549   4.459
   59   HG21  THR   8          1HG2      THR   8   0.295  12.317   3.693
   60   HG22  THR   8          2HG2      THR   8  -0.239  13.915   3.170
   61   HG23  THR   8          3HG2      THR   8   0.603  13.726   4.708
   62    H    GLU   9           H        GLU   9   2.473  15.125   0.349
   63    HA   GLU   9           HA       GLU   9  -0.096  16.171  -0.145
   64    HB2  GLU   9          1HB       GLU   9   2.543  16.884  -1.424
   65    HB3  GLU   9          2HB       GLU   9   1.076  17.857  -1.472
   66    HG2  GLU   9          1HG       GLU   9   1.136  18.040   0.973
   67    HG3  GLU   9          2HG       GLU   9   2.638  17.120   0.991
   68    H    ASP  10           H        ASP  10   2.212  14.398  -2.178
   69    HA   ASP  10           HA       ASP  10   0.647  14.391  -4.537
   70    HB2  ASP  10          1HB       ASP  10   2.590  12.256  -3.602
   71    HB3  ASP  10          2HB       ASP  10   1.938  12.433  -5.229
   72    H    LEU  11           H        LEU  11   0.764  12.347  -1.708
   73    HA   LEU  11           HA       LEU  11  -0.817  10.253  -2.664
   74    HB2  LEU  11          1HB       LEU  11   0.634  10.041  -0.737
   75    HB3  LEU  11          2HB       LEU  11  -0.373  11.174   0.175
   76    HG   LEU  11           HG       LEU  11  -2.239   9.537  -0.021
   77   HD11  LEU  11          1HD1      LEU  11  -1.467   8.390  -2.026
   78   HD12  LEU  11          2HD1      LEU  11  -1.725   7.260  -0.702
   79   HD13  LEU  11          3HD1      LEU  11  -0.086   7.749  -1.135
   80   HD21  LEU  11          1HD2      LEU  11   0.229   8.355   1.237
   81   HD22  LEU  11          2HD2      LEU  11  -1.449   8.116   1.725
   82   HD23  LEU  11          3HD2      LEU  11  -0.685   9.689   1.941
   83    H    GLN  12           H        GLN  12  -1.640  13.290  -1.116
   84    HA   GLN  12           HA       GLN  12  -4.365  12.702  -0.616
   85    HB2  GLN  12          1HB       GLN  12  -2.922  15.327  -0.982
   86    HB3  GLN  12          2HB       GLN  12  -4.621  15.212  -0.551
   87    HG2  GLN  12          1HG       GLN  12  -4.024  14.027   1.496
   88    HG3  GLN  12          2HG       GLN  12  -2.321  14.131   1.058
   89   HE21  GLN  12          1HE2      GLN  12  -3.752  15.157   3.383
   90   HE22  GLN  12          2HE2      GLN  12  -3.436  16.856   3.420
   91    H    ARG  13           H        ARG  13  -2.630  13.862  -3.409
   92    HA   ARG  13           HA       ARG  13  -4.942  14.661  -4.873
   93    HB2  ARG  13          1HB       ARG  13  -2.708  15.569  -5.339
   94    HB3  ARG  13          2HB       ARG  13  -2.176  13.980  -5.871
   95    HG2  ARG  13          1HG       ARG  13  -2.635  15.181  -7.832
   96    HG3  ARG  13          2HG       ARG  13  -4.016  14.095  -7.605
   97    HD2  ARG  13          1HD       ARG  13  -3.934  17.012  -6.843
   98    HD3  ARG  13          2HD       ARG  13  -4.690  16.355  -8.290
   99    HE   ARG  13           HE       ARG  13  -5.870  15.008  -6.223
  100   HH11  ARG  13          1HH1      ARG  13  -5.563  18.350  -7.200
  101   HH12  ARG  13          2HH1      ARG  13  -6.996  18.860  -6.367
  102   HH21  ARG  13          1HH2      ARG  13  -7.755  15.671  -5.113
  103   HH22  ARG  13          2HH2      ARG  13  -8.248  17.338  -5.194
  104    H    TYR  14           H        TYR  14  -2.952  11.732  -4.755
  105    HA   TYR  14           HA       TYR  14  -4.253  10.401  -6.892
  106    HB2  TYR  14          1HB       TYR  14  -2.753   9.201  -4.556
  107    HB3  TYR  14          2HB       TYR  14  -3.186   8.370  -6.040
  108    HD1  TYR  14           HD1      TYR  14  -0.413   9.229  -4.571
  109    HD2  TYR  14           HD2      TYR  14  -2.512  10.394  -8.082
  110    HE1  TYR  14           HE1      TYR  14   1.702   9.953  -5.588
  111    HE2  TYR  14           HE2      TYR  14  -0.399  11.114  -9.109
  112    HH   TYR  14           HH       TYR  14   2.644  10.316  -7.817
  113    H    ARG  15           H        ARG  15  -4.871  10.590  -3.440
  114    HA   ARG  15           HA       ARG  15  -6.711   8.505  -3.271
  115    HB2  ARG  15          1HB       ARG  15  -6.495   9.077  -1.132
  116    HB3  ARG  15          2HB       ARG  15  -5.794  10.625  -1.569
  117    HG2  ARG  15          1HG       ARG  15  -7.826  11.728  -1.448
  118    HG3  ARG  15          2HG       ARG  15  -8.758  10.239  -1.644
  119    HD2  ARG  15          1HD       ARG  15  -8.869  11.077   0.660
  120    HD3  ARG  15          2HD       ARG  15  -8.084   9.505   0.574
  121    HE   ARG  15           HE       ARG  15  -6.714  12.073   1.017
  122   HH11  ARG  15          1HH1      ARG  15  -6.791   8.580   1.171
  123   HH12  ARG  15          2HH1      ARG  15  -5.345   8.447   2.130
  124   HH21  ARG  15          1HH2      ARG  15  -4.826  11.913   2.323
  125   HH22  ARG  15          2HH2      ARG  15  -4.243  10.346   2.789
  126    H    THR  16           H        THR  16  -7.150  11.901  -4.146
  127    HA   THR  16           HA       THR  16  -9.940  11.971  -4.261
  128    HB   THR  16           HB       THR  16  -8.366  13.419  -6.344
  129    HG1  THR  16           HG1      THR  16  -8.170  13.820  -3.526
  130   HG21  THR  16          1HG2      THR  16  -9.858  15.250  -5.690
  131   HG22  THR  16          2HG2      THR  16 -10.552  14.227  -4.432
  132   HG23  THR  16          3HG2      THR  16 -10.758  13.800  -6.131
  133    H    GLU  17           H        GLU  17  -7.579  11.136  -6.775
  134    HA   GLU  17           HA       GLU  17  -9.338  10.721  -8.886
  135    HB2  GLU  17          1HB       GLU  17  -6.575  10.016  -8.263
  136    HB3  GLU  17          2HB       GLU  17  -7.352   8.841  -9.295
  137    HG2  GLU  17          1HG       GLU  17  -7.923  10.596 -10.890
  138    HG3  GLU  17          2HG       GLU  17  -7.158  11.797  -9.845
  139    H    CYS  18           H        CYS  18  -8.112   8.393  -6.516
  140    HA   CYS  18           HA       CYS  18  -9.546   6.197  -7.600
  141    HB2  CYS  18          1HB       CYS  18  -8.217   6.571  -4.915
  142    HB3  CYS  18          2HB       CYS  18  -8.875   5.040  -5.514
  143    H    VAL  19           H        VAL  19 -10.255   8.580  -5.151
  144    HA   VAL  19           HA       VAL  19 -12.408   7.225  -3.960
  145    HB   VAL  19           HB       VAL  19 -11.523  10.080  -3.965
  146   HG11  VAL  19          1HG1      VAL  19 -13.397  10.679  -2.520
  147   HG12  VAL  19          2HG1      VAL  19 -14.100   9.078  -2.759
  148   HG13  VAL  19          3HG1      VAL  19 -13.956  10.192  -4.124
  149   HG21  VAL  19          1HG2      VAL  19 -11.966   7.998  -1.826
  150   HG22  VAL  19          2HG2      VAL  19 -11.407   9.647  -1.535
  151   HG23  VAL  19          3HG2      VAL  19 -10.414   8.532  -2.474
  152    H    SER  20           H        SER  20 -12.297   9.759  -6.417
  153    HA   SER  20           HA       SER  20 -15.081   9.817  -6.858
  154    HB2  SER  20          1HB       SER  20 -13.581  11.658  -7.455
  155    HB3  SER  20          2HB       SER  20 -12.816  10.648  -8.679
  156    HG   SER  20           HG       SER  20 -14.431  11.002  -9.986
  157    H    SER  21           H        SER  21 -12.489   7.901  -8.327
  158    HA   SER  21           HA       SER  21 -14.100   7.008 -10.522
  159    HB2  SER  21          1HB       SER  21 -11.479   5.950  -9.441
  160    HB3  SER  21          2HB       SER  21 -12.198   5.505 -10.990
  161    HG   SER  21           HG       SER  21 -11.114   7.985 -10.171
  162    H    LEU  22           H        LEU  22 -13.009   5.516  -7.461
  163    HA   LEU  22           HA       LEU  22 -14.461   3.093  -8.100
  164    HB2  LEU  22          1HB       LEU  22 -12.741   3.903  -5.765
  165    HB3  LEU  22          2HB       LEU  22 -13.562   2.342  -5.860
  166    HG   LEU  22           HG       LEU  22 -11.586   3.316  -7.917
  167   HD11  LEU  22          1HD1      LEU  22  -9.992   1.795  -6.848
  168   HD12  LEU  22          2HD1      LEU  22 -11.172   1.460  -5.578
  169   HD13  LEU  22          3HD1      LEU  22 -10.494   3.078  -5.746
  170   HD21  LEU  22          1HD2      LEU  22 -12.701   0.579  -7.334
  171   HD22  LEU  22          2HD2      LEU  22 -11.567   1.003  -8.618
  172   HD23  LEU  22          3HD2      LEU  22 -13.214   1.629  -8.655
  173    H    ASN  23           H        ASN  23 -15.654   5.853  -7.301
  174    HA   ASN  23           HA       ASN  23 -17.456   6.672  -6.168
  175    HB2  ASN  23          1HB       ASN  23 -18.287   3.769  -6.229
  176    HB3  ASN  23          2HB       ASN  23 -19.344   5.121  -5.873
  177   HD21  ASN  23          1HD2      ASN  23 -19.512   3.154  -7.996
  178   HD22  ASN  23          2HD2      ASN  23 -19.506   4.051  -9.481
  179    H    ILE  24           H        ILE  24 -15.211   6.081  -4.537
  180    HA   ILE  24           HA       ILE  24 -15.905   4.708  -2.170
  181    HB   ILE  24           HB       ILE  24 -13.889   6.937  -2.426
  182   HG12  ILE  24          1HG1      ILE  24 -13.506   5.225  -4.179
  183   HG13  ILE  24          2HG1      ILE  24 -12.224   5.226  -2.969
  184   HG21  ILE  24          1HG2      ILE  24 -14.112   4.608  -0.528
  185   HG22  ILE  24          2HG2      ILE  24 -14.362   6.313  -0.149
  186   HG23  ILE  24          3HG2      ILE  24 -12.756   5.736  -0.595
  187   HD11  ILE  24          1HD1      ILE  24 -12.831   2.969  -3.607
  188   HD12  ILE  24          2HD1      ILE  24 -14.505   3.271  -3.143
  189   HD13  ILE  24          3HD1      ILE  24 -13.239   3.263  -1.915
  190    HA   PRO  25           HA       PRO  25 -18.748   7.765  -0.493
  191    HB2  PRO  25          1HB       PRO  25 -18.344   6.147   1.939
  192    HB3  PRO  25          2HB       PRO  25 -19.837   6.562   1.093
  193    HG2  PRO  25          1HG       PRO  25 -18.808   4.097   1.011
  194    HG3  PRO  25          2HG       PRO  25 -19.655   4.815  -0.372
  195    HD2  PRO  25          1HD       PRO  25 -16.722   4.437   0.070
  196    HD3  PRO  25          2HD       PRO  25 -17.671   4.310  -1.432
  197    H    ALA  26           H        ALA  26 -18.511   9.543   0.692
  198    HA   ALA  26           HA       ALA  26 -16.016  10.583   1.318
  199    HB1  ALA  26          1HB       ALA  26 -18.044  11.913   0.937
  200    HB2  ALA  26          2HB       ALA  26 -17.214  12.375   2.424
  201    HB3  ALA  26          3HB       ALA  26 -18.671  11.380   2.497
  202    H    ASP  27           H        ASP  27 -18.292   8.852   3.365
  203    HA   ASP  27           HA       ASP  27 -17.254   9.176   5.880
  204    HB2  ASP  27          1HB       ASP  27 -19.188   7.863   5.661
  205    HB3  ASP  27          2HB       ASP  27 -18.421   6.756   4.530
  206    H    TYR  28           H        TYR  28 -16.182   6.743   3.496
  207    HA   TYR  28           HA       TYR  28 -14.106   5.691   5.023
  208    HB2  TYR  28          1HB       TYR  28 -14.699   5.759   2.090
  209    HB3  TYR  28          2HB       TYR  28 -13.184   5.063   2.665
  210    HD1  TYR  28           HD1      TYR  28 -16.863   4.775   2.786
  211    HD2  TYR  28           HD2      TYR  28 -13.152   2.912   3.715
  212    HE1  TYR  28           HE1      TYR  28 -18.043   2.669   3.254
  213    HE2  TYR  28           HE2      TYR  28 -14.322   0.805   4.188
  214    HH   TYR  28           HH       TYR  28 -17.514   0.230   3.301
  215    H    VAL  29           H        VAL  29 -14.215   8.448   2.862
  216    HA   VAL  29           HA       VAL  29 -11.463   8.928   2.607
  217    HB   VAL  29           HB       VAL  29 -13.704  10.938   2.553
  218   HG11  VAL  29          1HG1      VAL  29 -11.555  12.018   2.757
  219   HG12  VAL  29          2HG1      VAL  29 -12.147  12.214   1.107
  220   HG13  VAL  29          3HG1      VAL  29 -10.898  11.019   1.462
  221   HG21  VAL  29          1HG2      VAL  29 -12.490   9.249   0.382
  222   HG22  VAL  29          2HG2      VAL  29 -13.606  10.587   0.106
  223   HG23  VAL  29          3HG2      VAL  29 -14.140   9.161   0.997
  224    H    GLU  30           H        GLU  30 -13.833  10.068   4.996
  225    HA   GLU  30           HA       GLU  30 -12.100  11.737   6.481
  226    HB2  GLU  30          1HB       GLU  30 -14.290  10.149   7.784
  227    HB3  GLU  30          2HB       GLU  30 -13.734  11.782   8.130
  228    HG2  GLU  30          1HG       GLU  30 -14.670  12.536   6.004
  229    HG3  GLU  30          2HG       GLU  30 -15.294  10.917   5.722
  230    H    LYS  31           H        LYS  31 -12.711   8.299   6.542
  231    HA   LYS  31           HA       LYS  31 -11.316   7.725   8.941
  232    HB2  LYS  31          1HB       LYS  31 -11.913   5.914   6.595
  233    HB3  LYS  31          2HB       LYS  31 -11.355   5.389   8.188
  234    HG2  LYS  31          1HG       LYS  31 -13.406   6.399   9.165
  235    HG3  LYS  31          2HG       LYS  31 -13.974   6.715   7.525
  236    HD2  LYS  31          1HD       LYS  31 -13.791   4.282   7.041
  237    HD3  LYS  31          2HD       LYS  31 -13.364   4.016   8.744
  238    HE2  LYS  31          1HE       LYS  31 -15.527   5.027   9.407
  239    HE3  LYS  31          2HE       LYS  31 -15.952   5.192   7.704
  240    HZ1  LYS  31          1HZ       LYS  31 -15.394   2.623   9.086
  241    HZ2  LYS  31          2HZ       LYS  31 -15.869   2.801   7.474
  242    HZ3  LYS  31          3HZ       LYS  31 -16.931   3.221   8.718
  243    H    PHE  32           H        PHE  32 -10.373   7.487   5.525
  244    HA   PHE  32           HA       PHE  32  -7.789   6.511   5.908
  245    HB2  PHE  32          1HB       PHE  32  -8.735   8.315   3.681
  246    HB3  PHE  32          2HB       PHE  32  -7.319   7.270   3.646
  247    HD1  PHE  32           HD1      PHE  32  -9.897   7.406   1.833
  248    HD2  PHE  32           HD2      PHE  32  -8.604   4.869   4.993
  249    HE1  PHE  32           HE1      PHE  32 -11.266   5.575   0.922
  250    HE2  PHE  32           HE2      PHE  32  -9.971   3.040   4.091
  251    HZ   PHE  32           HZ       PHE  32 -11.302   3.385   2.049
  252    H    LYS  33           H        LYS  33  -9.054   9.746   6.086
  253    HA   LYS  33           HA       LYS  33  -6.681  11.230   6.037
  254    HB2  LYS  33          1HB       LYS  33  -9.124  12.041   6.026
  255    HB3  LYS  33          2HB       LYS  33  -9.038  11.896   7.780
  256    HG2  LYS  33          1HG       LYS  33  -7.195  13.466   7.855
  257    HG3  LYS  33          2HG       LYS  33  -7.227  13.605   6.090
  258    HD2  LYS  33          1HD       LYS  33  -9.504  14.497   6.208
  259    HD3  LYS  33          2HD       LYS  33  -9.475  14.350   7.966
  260    HE2  LYS  33          1HE       LYS  33  -9.026  16.642   7.282
  261    HE3  LYS  33          2HE       LYS  33  -7.617  15.934   8.069
  262    HZ1  LYS  33          1HZ       LYS  33  -6.619  15.565   5.921
  263    HZ2  LYS  33          2HZ       LYS  33  -7.040  17.195   6.070
  264    HZ3  LYS  33          3HZ       LYS  33  -7.992  16.161   5.133
  265    H    LYS  34           H        LYS  34  -8.003   9.147   8.476
  266    HA   LYS  34           HA       LYS  34  -5.939  10.079  10.350
  267    HB2  LYS  34          1HB       LYS  34  -8.719   9.060  10.855
  268    HB3  LYS  34          2HB       LYS  34  -7.490   8.986  12.115
  269    HG2  LYS  34          1HG       LYS  34  -7.219  11.403  11.991
  270    HG3  LYS  34          2HG       LYS  34  -8.417  11.479  10.698
  271    HD2  LYS  34          1HD       LYS  34 -10.094  10.532  12.243
  272    HD3  LYS  34          2HD       LYS  34  -8.888  10.555  13.532
  273    HE2  LYS  34          1HE       LYS  34  -8.716  12.968  13.364
  274    HE3  LYS  34          2HE       LYS  34  -9.842  12.975  12.009
  275    HZ1  LYS  34          1HZ       LYS  34 -10.440  12.213  14.809
  276    HZ2  LYS  34          2HZ       LYS  34 -11.525  12.037  13.527
  277    HZ3  LYS  34          3HZ       LYS  34 -11.003  13.576  13.986
  278    H    TRP  35           H        TRP  35  -5.753   8.080   8.212
  279    HA   TRP  35           HA       TRP  35  -4.911   6.018   7.796
  280    HB2  TRP  35          1HB       TRP  35  -3.858   6.423  10.597
  281    HB3  TRP  35          2HB       TRP  35  -3.340   5.110   9.532
  282    HD1  TRP  35           HD1      TRP  35  -2.998   8.871  10.057
  283    HE1  TRP  35           HE1      TRP  35  -1.079   9.757   8.591
  284    HE3  TRP  35           HE3      TRP  35  -2.041   4.647   7.328
  285    HZ2  TRP  35           HZ2      TRP  35   0.611   8.794   6.568
  286    HZ3  TRP  35           HZ3      TRP  35  -0.254   4.721   5.644
  287    HH2  TRP  35           HH2      TRP  35   1.049   6.746   5.269
  288    H    GLU  36           H        GLU  36  -7.563   5.863   8.463
  289    HA   GLU  36           HA       GLU  36  -7.674   3.366  10.006
  290    HB2  GLU  36          1HB       GLU  36  -8.928   5.222  11.040
  291    HB3  GLU  36          2HB       GLU  36  -9.882   5.376   9.576
  292    HG2  GLU  36          1HG       GLU  36 -10.769   3.150   9.901
  293    HG3  GLU  36          2HG       GLU  36  -9.790   2.955  11.349
  294    H    PHE  37           H        PHE  37  -7.740   1.724   8.679
  295    HA   PHE  37           HA       PHE  37  -9.205   1.999   6.132
  296    HB2  PHE  37          1HB       PHE  37  -6.898   0.132   6.753
  297    HB3  PHE  37          2HB       PHE  37  -7.679   0.327   5.191
  298    HD1  PHE  37           HD1      PHE  37  -5.547   1.984   7.701
  299    HD2  PHE  37           HD2      PHE  37  -7.066   2.094   3.723
  300    HE1  PHE  37           HE1      PHE  37  -3.937   3.754   7.137
  301    HE2  PHE  37           HE2      PHE  37  -5.468   3.872   3.160
  302    HZ   PHE  37           HZ       PHE  37  -3.898   4.704   4.865
  303    HA   PRO  38           HA       PRO  38 -11.803  -1.103   8.302
  304    HB2  PRO  38          1HB       PRO  38 -13.459  -0.409   5.940
  305    HB3  PRO  38          2HB       PRO  38 -13.915  -0.552   7.648
  306    HG2  PRO  38          1HG       PRO  38 -13.701   1.845   6.538
  307    HG3  PRO  38          2HG       PRO  38 -13.087   1.556   8.178
  308    HD2  PRO  38          1HD       PRO  38 -11.554   1.710   5.592
  309    HD3  PRO  38          2HD       PRO  38 -11.159   2.419   7.188
  310    H    GLU  39           H        GLU  39 -12.027  -3.210   7.844
  311    HA   GLU  39           HA       GLU  39 -10.703  -4.215   5.495
  312    HB2  GLU  39          1HB       GLU  39 -10.378  -5.255   7.708
  313    HB3  GLU  39          2HB       GLU  39 -12.074  -5.711   7.737
  314    HG2  GLU  39          1HG       GLU  39 -11.786  -7.240   5.958
  315    HG3  GLU  39          2HG       GLU  39 -10.178  -6.619   5.593
  316    H    ASP  40           H        ASP  40 -12.053  -3.468   3.887
  317    HA   ASP  40           HA       ASP  40 -14.433  -5.057   3.389
  318    HB2  ASP  40          1HB       ASP  40 -15.408  -3.191   4.617
  319    HB3  ASP  40          2HB       ASP  40 -14.553  -2.031   3.606
  320    H    ASP  41           H        ASP  41 -15.063  -5.037   1.173
  321    HA   ASP  41           HA       ASP  41 -13.008  -5.109  -0.657
  322    HB2  ASP  41          1HB       ASP  41 -15.908  -4.499  -1.285
  323    HB3  ASP  41          2HB       ASP  41 -14.709  -5.111  -2.418
  324    H    THR  42           H        THR  42 -15.179  -2.417   0.036
  325    HA   THR  42           HA       THR  42 -14.544  -0.646  -1.985
  326    HB   THR  42           HB       THR  42 -15.069   0.043   0.907
  327    HG1  THR  42           HG1      THR  42 -16.734  -1.261   0.241
  328   HG21  THR  42          1HG2      THR  42 -16.090   2.076  -0.064
  329   HG22  THR  42          2HG2      THR  42 -15.492   1.581  -1.648
  330   HG23  THR  42          3HG2      THR  42 -14.356   1.965  -0.355
  331    H    THR  43           H        THR  43 -13.080  -0.719   1.265
  332    HA   THR  43           HA       THR  43 -11.054   1.147   0.809
  333    HB   THR  43           HB       THR  43 -10.926  -1.216   2.684
  334    HG1  THR  43           HG1      THR  43 -11.775   0.527   4.167
  335   HG21  THR  43          1HG2      THR  43  -9.577   1.484   2.683
  336   HG22  THR  43          2HG2      THR  43  -8.806  -0.098   2.557
  337   HG23  THR  43          3HG2      THR  43  -9.581   0.391   4.066
  338    H    MET  44           H        MET  44 -11.223  -2.286   0.139
  339    HA   MET  44           HA       MET  44  -8.430  -2.699  -0.114
  340    HB2  MET  44          1HB       MET  44 -10.720  -4.333  -1.200
  341    HB3  MET  44          2HB       MET  44  -9.049  -4.868  -1.102
  342    HG2  MET  44          1HG       MET  44  -9.136  -4.681   1.332
  343    HG3  MET  44          2HG       MET  44 -10.807  -4.142   1.227
  344    HE1  MET  44          1HE       MET  44  -9.869  -6.570   3.062
  345    HE2  MET  44          2HE       MET  44 -11.210  -7.678   2.759
  346    HE3  MET  44          3HE       MET  44 -11.516  -5.948   2.935
  347    H    CYS  45           H        CYS  45 -11.027  -2.315  -2.517
  348    HA   CYS  45           HA       CYS  45  -9.297  -2.382  -4.758
  349    HB2  CYS  45          1HB       CYS  45 -12.034  -1.115  -4.504
  350    HB3  CYS  45          2HB       CYS  45 -11.202  -1.454  -6.015
  351    H    TYR  46           H        TYR  46 -10.290   0.123  -2.565
  352    HA   TYR  46           HA       TYR  46  -9.439   2.376  -3.978
  353    HB2  TYR  46          1HB       TYR  46 -10.735   2.769  -2.067
  354    HB3  TYR  46          2HB       TYR  46  -9.741   1.722  -1.061
  355    HD1  TYR  46           HD1      TYR  46  -9.667   4.966  -2.903
  356    HD2  TYR  46           HD2      TYR  46  -8.093   2.642   0.297
  357    HE1  TYR  46           HE1      TYR  46  -8.453   6.937  -2.071
  358    HE2  TYR  46           HE2      TYR  46  -6.872   4.603   1.132
  359    HH   TYR  46           HH       TYR  46  -6.107   6.708   0.503
  360    H    ILE  47           H        ILE  47  -7.731   0.227  -1.752
  361    HA   ILE  47           HA       ILE  47  -5.310   1.600  -1.669
  362    HB   ILE  47           HB       ILE  47  -5.920  -1.313  -1.246
  363   HG12  ILE  47          1HG1      ILE  47  -6.906   0.210   0.395
  364   HG13  ILE  47          2HG1      ILE  47  -5.614  -0.726   1.142
  365   HG21  ILE  47          1HG2      ILE  47  -3.311   0.128  -0.787
  366   HG22  ILE  47          2HG2      ILE  47  -3.607  -1.195  -1.914
  367   HG23  ILE  47          3HG2      ILE  47  -3.691  -1.482  -0.177
  368   HD11  ILE  47          1HD1      ILE  47  -5.445   1.505   1.925
  369   HD12  ILE  47          2HD1      ILE  47  -5.545   2.158   0.292
  370   HD13  ILE  47          3HD1      ILE  47  -4.115   1.255   0.794
  371    H    LYS  48           H        LYS  48  -6.374  -0.967  -3.927
  372    HA   LYS  48           HA       LYS  48  -3.811  -1.249  -5.059
  373    HB2  LYS  48          1HB       LYS  48  -5.239  -2.120  -7.103
  374    HB3  LYS  48          2HB       LYS  48  -4.983  -3.097  -5.680
  375    HG2  LYS  48          1HG       LYS  48  -7.196  -2.406  -4.856
  376    HG3  LYS  48          2HG       LYS  48  -7.410  -1.408  -6.294
  377    HD2  LYS  48          1HD       LYS  48  -7.048  -4.401  -6.252
  378    HD3  LYS  48          2HD       LYS  48  -8.567  -3.549  -6.518
  379    HE2  LYS  48          1HE       LYS  48  -6.133  -3.317  -8.283
  380    HE3  LYS  48          2HE       LYS  48  -7.502  -4.372  -8.601
  381    HZ1  LYS  48          1HZ       LYS  48  -8.930  -2.427  -8.712
  382    HZ2  LYS  48          2HZ       LYS  48  -7.677  -2.315  -9.837
  383    HZ3  LYS  48          3HZ       LYS  48  -7.612  -1.410  -8.414
  384    H    CYS  49           H        CYS  49  -6.651   0.654  -5.951
  385    HA   CYS  49           HA       CYS  49  -5.705   1.737  -8.333
  386    HB2  CYS  49          1HB       CYS  49  -7.978   2.044  -7.821
  387    HB3  CYS  49          2HB       CYS  49  -7.631   2.810  -6.274
  388    H    VAL  50           H        VAL  50  -5.451   3.040  -5.015
  389    HA   VAL  50           HA       VAL  50  -4.043   5.351  -5.638
  390    HB   VAL  50           HB       VAL  50  -4.128   3.698  -3.122
  391   HG11  VAL  50          1HG1      VAL  50  -3.155   5.627  -1.964
  392   HG12  VAL  50          2HG1      VAL  50  -2.895   6.424  -3.517
  393   HG13  VAL  50          3HG1      VAL  50  -2.030   4.933  -3.131
  394   HG21  VAL  50          1HG2      VAL  50  -6.215   4.722  -3.740
  395   HG22  VAL  50          2HG2      VAL  50  -5.423   6.284  -3.932
  396   HG23  VAL  50          3HG2      VAL  50  -5.541   5.547  -2.334
  397    H    PHE  51           H        PHE  51  -2.920   2.153  -4.694
  398    HA   PHE  51           HA       PHE  51  -0.179   2.690  -4.685
  399    HB2  PHE  51          1HB       PHE  51  -1.898   0.275  -4.758
  400    HB3  PHE  51          2HB       PHE  51  -0.214   0.063  -5.226
  401    HD1  PHE  51           HD1      PHE  51  -1.311   2.523  -2.716
  402    HD2  PHE  51           HD2      PHE  51   0.342  -1.344  -3.381
  403    HE1  PHE  51           HE1      PHE  51  -0.716   2.368  -0.333
  404    HE2  PHE  51           HE2      PHE  51   0.937  -1.502  -1.002
  405    HZ   PHE  51           HZ       PHE  51   0.410   0.356   0.525
  406    H    ASN  52           H        ASN  52  -2.408   2.140  -7.251
  407    HA   ASN  52           HA       ASN  52  -0.383   1.471  -9.202
  408    HB2  ASN  52          1HB       ASN  52  -2.609   0.477  -9.391
  409    HB3  ASN  52          2HB       ASN  52  -3.328   2.086  -9.547
  410   HD21  ASN  52          1HD2      ASN  52  -1.129  -0.203 -11.060
  411   HD22  ASN  52          2HD2      ASN  52  -1.352   0.376 -12.673
  412    H    LYS  53           H        LYS  53  -2.377   4.264  -8.357
  413    HA   LYS  53           HA       LYS  53  -1.460   5.963 -10.429
  414    HB2  LYS  53          1HB       LYS  53  -2.841   6.357  -7.819
  415    HB3  LYS  53          2HB       LYS  53  -2.084   7.754  -8.562
  416    HG2  LYS  53          1HG       LYS  53  -4.463   7.613  -9.097
  417    HG3  LYS  53          2HG       LYS  53  -3.472   7.475 -10.546
  418    HD2  LYS  53          1HD       LYS  53  -3.822   5.116 -10.643
  419    HD3  LYS  53          2HD       LYS  53  -4.595   5.111  -9.056
  420    HE2  LYS  53          1HE       LYS  53  -6.252   4.954 -10.849
  421    HE3  LYS  53          2HE       LYS  53  -6.439   6.446  -9.934
  422    HZ1  LYS  53          1HZ       LYS  53  -4.946   6.298 -12.485
  423    HZ2  LYS  53          2HZ       LYS  53  -5.468   7.689 -11.669
  424    HZ3  LYS  53          3HZ       LYS  53  -6.593   6.660 -12.403
  425    H    MET  54           H        MET  54  -0.103   4.921  -7.448
  426    HA   MET  54           HA       MET  54   1.929   6.999  -7.423
  427    HB2  MET  54          1HB       MET  54   1.316   4.690  -5.588
  428    HB3  MET  54          2HB       MET  54   2.710   5.744  -5.370
  429    HG2  MET  54          1HG       MET  54   1.359   7.601  -4.932
  430    HG3  MET  54          2HG       MET  54  -0.086   6.801  -5.535
  431    HE1  MET  54          1HE       MET  54   1.849   6.282  -1.414
  432    HE2  MET  54          2HE       MET  54   2.274   7.469  -2.646
  433    HE3  MET  54          3HE       MET  54   2.756   5.783  -2.844
  434    H    GLN  55           H        GLN  55   1.479   4.275  -9.116
  435    HA   GLN  55           HA       GLN  55   2.705   2.768 -10.210
  436    HB2  GLN  55          1HB       GLN  55   4.661   5.004  -9.884
  437    HB3  GLN  55          2HB       GLN  55   5.126   3.519 -10.729
  438    HG2  GLN  55          1HG       GLN  55   3.306   3.850 -12.297
  439    HG3  GLN  55          2HG       GLN  55   2.795   5.286 -11.419
  440   HE21  GLN  55          1HE2      GLN  55   3.579   5.036 -14.189
  441   HE22  GLN  55          2HE2      GLN  55   4.921   6.106 -14.419
  442    H    LEU  56           H        LEU  56   2.332   1.863  -7.830
  443    HA   LEU  56           HA       LEU  56   4.927   0.950  -6.838
  444    HB2  LEU  56          1HB       LEU  56   2.713   2.284  -5.463
  445    HB3  LEU  56          2HB       LEU  56   3.287   0.836  -4.625
  446    HG   LEU  56           HG       LEU  56   4.959   3.214  -5.436
  447   HD11  LEU  56          1HD1      LEU  56   3.912   2.343  -2.746
  448   HD12  LEU  56          2HD1      LEU  56   3.434   3.784  -3.639
  449   HD13  LEU  56          3HD1      LEU  56   5.070   3.638  -3.011
  450   HD21  LEU  56          1HD2      LEU  56   5.622   0.715  -3.897
  451   HD22  LEU  56          2HD2      LEU  56   6.649   2.147  -3.955
  452   HD23  LEU  56          3HD2      LEU  56   6.320   1.239  -5.431
  453    H    PHE  57           H        PHE  57   1.755   0.127  -7.857
  454    HA   PHE  57           HA       PHE  57   2.267  -2.692  -7.238
  455    HB2  PHE  57          1HB       PHE  57   0.744  -1.995  -5.479
  456    HB3  PHE  57          2HB       PHE  57  -0.313  -1.214  -6.645
  457    HD1  PHE  57           HD1      PHE  57   0.897  -4.486  -5.433
  458    HD2  PHE  57           HD2      PHE  57  -1.993  -2.423  -7.782
  459    HE1  PHE  57           HE1      PHE  57  -0.435  -6.547  -5.604
  460    HE2  PHE  57           HE2      PHE  57  -3.325  -4.480  -7.959
  461    HZ   PHE  57           HZ       PHE  57  -2.548  -6.546  -6.868
  462    H    ASP  58           H        ASP  58   1.678  -4.071  -8.796
  463    HA   ASP  58           HA       ASP  58   0.254  -2.981 -11.138
  464    HB2  ASP  58          1HB       ASP  58   2.638  -3.481 -11.602
  465    HB3  ASP  58          2HB       ASP  58   2.393  -5.134 -11.062
  466    H    ASP  59           H        ASP  59  -1.437  -4.205 -11.926
  467    HA   ASP  59           HA       ASP  59  -2.731  -5.848  -9.999
  468    HB2  ASP  59          1HB       ASP  59  -3.441  -5.343 -12.891
  469    HB3  ASP  59          2HB       ASP  59  -4.482  -6.116 -11.714
  470    H    THR  60           H        THR  60  -0.549  -6.510 -12.516
  471    HA   THR  60           HA       THR  60  -1.316  -9.323 -12.643
  472    HB   THR  60           HB       THR  60   0.552  -7.640 -14.298
  473    HG1  THR  60           HG1      THR  60  -1.002  -7.856 -15.830
  474   HG21  THR  60          1HG2      THR  60   0.931  -9.607 -15.691
  475   HG22  THR  60          2HG2      THR  60  -0.007 -10.593 -14.569
  476   HG23  THR  60          3HG2      THR  60   1.517  -9.871 -14.047
  477    H    GLU  61           H        GLU  61   1.730  -7.459 -12.368
  478    HA   GLU  61           HA       GLU  61   3.151  -9.748 -11.362
  479    HB2  GLU  61          1HB       GLU  61   4.164  -6.917 -11.415
  480    HB3  GLU  61          2HB       GLU  61   5.084  -8.415 -11.442
  481    HG2  GLU  61          1HG       GLU  61   4.306  -8.922 -13.652
  482    HG3  GLU  61          2HG       GLU  61   3.267  -7.498 -13.642
  483    H    GLY  62           H        GLY  62   1.183  -7.472  -9.878
  484    HA2  GLY  62          1HA       GLY  62   0.649  -7.344  -7.623
  485    HA3  GLY  62          2HA       GLY  62   1.992  -8.439  -7.284
  486    HA   PRO  63           HA       PRO  63   3.221  -4.390  -5.436
  487    HB2  PRO  63          1HB       PRO  63   4.889  -6.282  -3.877
  488    HB3  PRO  63          2HB       PRO  63   3.834  -4.978  -3.313
  489    HG2  PRO  63          1HG       PRO  63   3.168  -7.570  -3.045
  490    HG3  PRO  63          2HG       PRO  63   1.958  -6.306  -3.331
  491    HD2  PRO  63          1HD       PRO  63   3.087  -8.326  -5.223
  492    HD3  PRO  63          2HD       PRO  63   1.443  -7.646  -5.140
  493    H    LEU  64           H        LEU  64   4.731  -3.288  -6.479
  494    HA   LEU  64           HA       LEU  64   6.897  -4.664  -7.843
  495    HB2  LEU  64          1HB       LEU  64   6.335  -1.698  -7.752
  496    HB3  LEU  64          2HB       LEU  64   7.358  -2.550  -8.889
  497    HG   LEU  64           HG       LEU  64   4.371  -2.909  -8.701
  498   HD11  LEU  64          1HD1      LEU  64   6.032  -1.396 -10.712
  499   HD12  LEU  64          2HD1      LEU  64   4.922  -0.692  -9.537
  500   HD13  LEU  64          3HD1      LEU  64   4.301  -1.709 -10.837
  501   HD21  LEU  64          1HD2      LEU  64   6.338  -3.901 -10.753
  502   HD22  LEU  64          2HD2      LEU  64   4.597  -4.192 -10.728
  503   HD23  LEU  64          3HD2      LEU  64   5.627  -4.881  -9.472
  504    H    VAL  65           H        VAL  65   8.283  -5.355  -6.359
  505    HA   VAL  65           HA       VAL  65   8.910  -4.259  -3.928
  506    HB   VAL  65           HB       VAL  65  10.612  -6.010  -5.678
  507   HG11  VAL  65          1HG1      VAL  65  10.884  -5.395  -2.736
  508   HG12  VAL  65          2HG1      VAL  65  12.003  -4.908  -4.011
  509   HG13  VAL  65          3HG1      VAL  65  11.803  -6.617  -3.617
  510   HG21  VAL  65          1HG2      VAL  65   9.753  -7.792  -4.201
  511   HG22  VAL  65          2HG2      VAL  65   8.485  -6.998  -5.130
  512   HG23  VAL  65          3HG2      VAL  65   8.704  -6.603  -3.426
  513    H    ASP  66           H        ASP  66  10.613  -3.744  -7.011
  514    HA   ASP  66           HA       ASP  66  12.827  -2.387  -5.990
  515    HB2  ASP  66          1HB       ASP  66  12.663  -3.219  -8.293
  516    HB3  ASP  66          2HB       ASP  66  11.490  -1.962  -8.664
  517    H    ASN  67           H        ASN  67   9.853  -0.974  -7.373
  518    HA   ASN  67           HA       ASN  67  10.467   1.688  -6.710
  519    HB2  ASN  67          1HB       ASN  67   7.848   0.304  -7.255
  520    HB3  ASN  67          2HB       ASN  67   7.958   2.026  -6.922
  521   HD21  ASN  67          1HD2      ASN  67   7.139   2.512  -8.957
  522   HD22  ASN  67          2HD2      ASN  67   8.102   2.356 -10.388
  523    H    LEU  68           H        LEU  68   8.919  -0.899  -4.955
  524    HA   LEU  68           HA       LEU  68   7.829   0.578  -2.843
  525    HB2  LEU  68          1HB       LEU  68   8.646  -2.271  -3.201
  526    HB3  LEU  68          2HB       LEU  68   8.199  -1.696  -1.603
  527    HG   LEU  68           HG       LEU  68   6.397  -1.319  -3.979
  528   HD11  LEU  68          1HD1      LEU  68   5.206  -3.327  -3.302
  529   HD12  LEU  68          2HD1      LEU  68   6.406  -3.634  -2.046
  530   HD13  LEU  68          3HD1      LEU  68   6.868  -3.713  -3.746
  531   HD21  LEU  68          1HD2      LEU  68   5.903  -1.404  -1.010
  532   HD22  LEU  68          2HD2      LEU  68   4.685  -1.136  -2.258
  533   HD23  LEU  68          3HD2      LEU  68   5.967   0.048  -2.008
  534    H    VAL  69           H        VAL  69  11.018  -0.925  -3.199
  535    HA   VAL  69           HA       VAL  69  11.978  -0.150  -0.638
  536    HB   VAL  69           HB       VAL  69  13.523  -0.798  -3.143
  537   HG11  VAL  69          1HG1      VAL  69  14.930   0.385  -1.602
  538   HG12  VAL  69          2HG1      VAL  69  15.348  -1.327  -1.536
  539   HG13  VAL  69          3HG1      VAL  69  14.363  -0.607  -0.259
  540   HG21  VAL  69          1HG2      VAL  69  12.797  -2.553  -0.808
  541   HG22  VAL  69          2HG2      VAL  69  13.722  -3.026  -2.234
  542   HG23  VAL  69          3HG2      VAL  69  12.019  -2.594  -2.391
  543    H    HIS  70           H        HIS  70  12.248   1.299  -3.877
  544    HA   HIS  70           HA       HIS  70  13.922   3.441  -3.117
  545    HB2  HIS  70          1HB       HIS  70  12.047   3.020  -5.424
  546    HB3  HIS  70          2HB       HIS  70  12.863   4.564  -5.198
  547    HD1  HIS  70           HD1      HIS  70  15.340   4.689  -5.765
  548    HD2  HIS  70           HD2      HIS  70  13.771   0.857  -6.102
  549    HE1  HIS  70           HE1      HIS  70  17.113   3.332  -6.914
  550    HE2  HIS  70           HE2      HIS  70  16.079   1.060  -7.245
  551    H    GLN  71           H        GLN  71  10.566   2.909  -2.715
  552    HA   GLN  71           HA       GLN  71   9.961   5.690  -2.129
  553    HB2  GLN  71          1HB       GLN  71   8.357   4.258  -3.345
  554    HB3  GLN  71          2HB       GLN  71   8.253   3.198  -1.954
  555    HG2  GLN  71          1HG       GLN  71   6.329   4.706  -2.155
  556    HG3  GLN  71          2HG       GLN  71   7.204   4.904  -0.643
  557   HE21  GLN  71          1HE2      GLN  71   8.118   6.816  -0.170
  558   HE22  GLN  71          2HE2      GLN  71   7.953   8.233  -1.141
  559    H    LEU  72           H        LEU  72   9.644   2.600  -0.393
  560    HA   LEU  72           HA       LEU  72   9.030   3.818   2.064
  561    HB2  LEU  72          1HB       LEU  72   9.878   1.013   1.396
  562    HB3  LEU  72          2HB       LEU  72   9.438   1.520   3.015
  563    HG   LEU  72           HG       LEU  72   7.611   1.697   0.621
  564   HD11  LEU  72          1HD1      LEU  72   7.695  -0.321   2.867
  565   HD12  LEU  72          2HD1      LEU  72   8.094  -0.629   1.177
  566   HD13  LEU  72          3HD1      LEU  72   6.440  -0.211   1.631
  567   HD21  LEU  72          1HD2      LEU  72   7.168   2.148   3.568
  568   HD22  LEU  72          2HD2      LEU  72   5.872   1.988   2.384
  569   HD23  LEU  72          3HD2      LEU  72   7.010   3.330   2.267
  570    H    ALA  73           H        ALA  73  12.087   2.500   0.819
  571    HA   ALA  73           HA       ALA  73  13.476   2.794   3.286
  572    HB1  ALA  73          1HB       ALA  73  14.108   1.175   1.550
  573    HB2  ALA  73          2HB       ALA  73  15.450   2.204   2.052
  574    HB3  ALA  73          3HB       ALA  73  14.624   2.514   0.524
  575    H    HIS  74           H        HIS  74  12.157   5.217   2.445
  576    HA   HIS  74           HA       HIS  74  14.114   7.110   1.570
  577    HB2  HIS  74          1HB       HIS  74  11.674   7.469   1.248
  578    HB3  HIS  74          2HB       HIS  74  11.468   7.562   2.995
  579    HD1  HIS  74           HD1      HIS  74  11.413   9.852   3.895
  580    HD2  HIS  74           HD2      HIS  74  13.495   9.668   0.296
  581    HE1  HIS  74           HE1      HIS  74  12.015  12.227   3.337
  582    HE2  HIS  74           HE2      HIS  74  13.104  12.103   1.072
  583    H    GLY  75           H        GLY  75  15.854   6.610   2.999
  584    HA2  GLY  75          1HA       GLY  75  17.098   7.683   4.728
  585    HA3  GLY  75          2HA       GLY  75  15.593   7.971   5.588
  586    H    ARG  76           H        ARG  76  16.270   4.858   4.183
  587    HA   ARG  76           HA       ARG  76  17.321   3.806   6.678
  588    HB2  ARG  76          1HB       ARG  76  14.602   3.223   5.670
  589    HB3  ARG  76          2HB       ARG  76  15.525   1.848   6.263
  590    HG2  ARG  76          1HG       ARG  76  15.914   3.309   8.347
  591    HG3  ARG  76          2HG       ARG  76  14.560   4.261   7.741
  592    HD2  ARG  76          1HD       ARG  76  13.264   2.102   7.624
  593    HD3  ARG  76          2HD       ARG  76  14.582   1.358   8.519
  594    HE   ARG  76           HE       ARG  76  13.739   3.645   9.896
  595   HH11  ARG  76          1HH1      ARG  76  12.633   0.417   9.130
  596   HH12  ARG  76          2HH1      ARG  76  11.585   0.313  10.507
  597   HH21  ARG  76          1HH2      ARG  76  12.372   3.515  11.711
  598   HH22  ARG  76          2HH2      ARG  76  11.434   2.078  11.980
  599    H    ASP  77           H        ASP  77  18.021   1.547   6.463
  600    HA   ASP  77           HA       ASP  77  19.516   1.055   4.148
  601    HB2  ASP  77          1HB       ASP  77  18.674  -0.824   6.361
  602    HB3  ASP  77          2HB       ASP  77  19.866  -1.213   5.123
  603    H    ALA  78           H        ALA  78  18.794   0.606   2.259
  604    HA   ALA  78           HA       ALA  78  16.192  -0.107   1.585
  605    HB1  ALA  78          1HB       ALA  78  17.775   1.017   0.098
  606    HB2  ALA  78          2HB       ALA  78  17.046  -0.399  -0.657
  607    HB3  ALA  78          3HB       ALA  78  18.696  -0.480  -0.040
  608    H    GLU  79           H        GLU  79  19.046  -2.121   2.056
  609    HA   GLU  79           HA       GLU  79  18.098  -4.519   0.980
  610    HB2  GLU  79          1HB       GLU  79  20.048  -3.985   3.216
  611    HB3  GLU  79          2HB       GLU  79  19.718  -5.603   2.609
  612    HG2  GLU  79          1HG       GLU  79  20.432  -4.864   0.365
  613    HG3  GLU  79          2HG       GLU  79  20.857  -3.297   1.047
  614    H    GLU  80           H        GLU  80  17.807  -3.240   4.271
  615    HA   GLU  80           HA       GLU  80  16.408  -5.461   5.326
  616    HB2  GLU  80          1HB       GLU  80  17.551  -3.864   6.760
  617    HB3  GLU  80          2HB       GLU  80  16.480  -2.577   6.226
  618    HG2  GLU  80          1HG       GLU  80  14.604  -3.645   7.273
  619    HG3  GLU  80          2HG       GLU  80  15.578  -5.047   7.681
  620    H    VAL  81           H        VAL  81  15.375  -2.349   4.006
  621    HA   VAL  81           HA       VAL  81  12.630  -2.583   4.395
  622    HB   VAL  81           HB       VAL  81  14.126  -1.161   2.196
  623   HG11  VAL  81          1HG1      VAL  81  11.820  -1.449   1.520
  624   HG12  VAL  81          2HG1      VAL  81  12.091   0.229   1.994
  625   HG13  VAL  81          3HG1      VAL  81  11.261  -0.877   3.091
  626   HG21  VAL  81          1HG2      VAL  81  14.795  -0.384   4.324
  627   HG22  VAL  81          2HG2      VAL  81  13.127  -0.318   4.893
  628   HG23  VAL  81          3HG2      VAL  81  13.683   0.804   3.652
  629    H    ARG  82           H        ARG  82  14.554  -3.474   1.519
  630    HA   ARG  82           HA       ARG  82  12.562  -4.499  -0.101
  631    HB2  ARG  82          1HB       ARG  82  14.980  -4.193  -0.683
  632    HB3  ARG  82          2HB       ARG  82  15.328  -5.659   0.223
  633    HG2  ARG  82          1HG       ARG  82  13.717  -6.845  -1.293
  634    HG3  ARG  82          2HG       ARG  82  13.704  -5.383  -2.275
  635    HD2  ARG  82          1HD       ARG  82  16.156  -5.547  -2.482
  636    HD3  ARG  82          2HD       ARG  82  16.102  -7.068  -1.599
  637    HE   ARG  82           HE       ARG  82  14.468  -6.921  -3.997
  638   HH11  ARG  82          1HH1      ARG  82  17.480  -7.946  -2.532
  639   HH12  ARG  82          2HH1      ARG  82  17.866  -9.058  -3.808
  640   HH21  ARG  82          1HH2      ARG  82  14.971  -8.391  -5.667
  641   HH22  ARG  82          2HH2      ARG  82  16.442  -9.307  -5.592
  642    H    THR  83           H        THR  83  14.362  -6.043   2.493
  643    HA   THR  83           HA       THR  83  13.416  -8.659   2.133
  644    HB   THR  83           HB       THR  83  14.534  -7.201   4.521
  645    HG1  THR  83           HG1      THR  83  16.176  -7.510   3.186
  646   HG21  THR  83          1HG2      THR  83  13.154  -9.023   5.362
  647   HG22  THR  83          2HG2      THR  83  14.866  -9.400   5.572
  648   HG23  THR  83          3HG2      THR  83  13.950 -10.154   4.266
  649    H    GLU  84           H        GLU  84  12.411  -6.144   4.459
  650    HA   GLU  84           HA       GLU  84  10.306  -7.522   5.635
  651    HB2  GLU  84          1HB       GLU  84  10.461  -4.540   5.187
  652    HB3  GLU  84          2HB       GLU  84   9.507  -5.371   6.405
  653    HG2  GLU  84          1HG       GLU  84  11.773  -6.298   7.201
  654    HG3  GLU  84          2HG       GLU  84  12.456  -4.964   6.270
  655    H    VAL  85           H        VAL  85  10.283  -5.434   2.756
  656    HA   VAL  85           HA       VAL  85   7.538  -5.506   2.235
  657    HB   VAL  85           HB       VAL  85   9.924  -5.245   0.411
  658   HG11  VAL  85          1HG1      VAL  85   7.008  -5.071  -0.337
  659   HG12  VAL  85          2HG1      VAL  85   8.163  -6.281  -0.897
  660   HG13  VAL  85          3HG1      VAL  85   8.356  -4.590  -1.370
  661   HG21  VAL  85          1HG2      VAL  85   7.816  -3.307   1.351
  662   HG22  VAL  85          2HG2      VAL  85   9.135  -2.930   0.240
  663   HG23  VAL  85          3HG2      VAL  85   9.490  -3.389   1.905
  664    H    LEU  86           H        LEU  86  10.129  -7.641   1.033
  665    HA   LEU  86           HA       LEU  86   8.592  -9.286  -0.582
  666    HB2  LEU  86          1HB       LEU  86  11.121  -9.837   0.960
  667    HB3  LEU  86          2HB       LEU  86  10.415 -10.984  -0.178
  668    HG   LEU  86           HG       LEU  86  11.179  -8.187  -0.967
  669   HD11  LEU  86          1HD1      LEU  86  12.834 -10.699  -1.161
  670   HD12  LEU  86          2HD1      LEU  86  13.153  -9.328  -0.098
  671   HD13  LEU  86          3HD1      LEU  86  13.248  -9.128  -1.848
  672   HD21  LEU  86          1HD2      LEU  86  11.228  -9.228  -3.213
  673   HD22  LEU  86          2HD2      LEU  86   9.633  -9.256  -2.463
  674   HD23  LEU  86          3HD2      LEU  86  10.617 -10.719  -2.495
  675    H    LYS  87           H        LYS  87   9.053  -9.350   2.880
  676    HA   LYS  87           HA       LYS  87   8.006 -11.971   3.300
  677    HB2  LYS  87          1HB       LYS  87   8.412  -9.619   5.145
  678    HB3  LYS  87          2HB       LYS  87   7.766 -11.161   5.693
  679    HG2  LYS  87          1HG       LYS  87   9.800 -12.289   5.025
  680    HG3  LYS  87          2HG       LYS  87  10.451 -10.773   4.379
  681    HD2  LYS  87          1HD       LYS  87  10.449  -9.803   6.602
  682    HD3  LYS  87          2HD       LYS  87   9.713 -11.265   7.264
  683    HE2  LYS  87          1HE       LYS  87  12.407 -11.128   5.916
  684    HE3  LYS  87          2HE       LYS  87  12.145 -11.156   7.659
  685    HZ1  LYS  87          1HZ       LYS  87  11.133 -13.328   7.450
  686    HZ2  LYS  87          2HZ       LYS  87  12.686 -13.349   6.780
  687    HZ3  LYS  87          3HZ       LYS  87  11.330 -13.300   5.770
  688    H    CYS  88           H        CYS  88   6.585  -9.015   2.527
  689    HA   CYS  88           HA       CYS  88   3.968  -9.906   3.520
  690    HB2  CYS  88          1HB       CYS  88   5.120  -7.198   2.966
  691    HB3  CYS  88          2HB       CYS  88   3.361  -7.432   2.915
  692    H    VAL  89           H        VAL  89   5.858  -9.801   0.786
  693    HA   VAL  89           HA       VAL  89   3.781  -9.330  -1.144
  694    HB   VAL  89           HB       VAL  89   6.558 -10.463  -1.486
  695   HG11  VAL  89          1HG1      VAL  89   6.209  -9.963  -3.887
  696   HG12  VAL  89          2HG1      VAL  89   4.521  -9.600  -3.527
  697   HG13  VAL  89          3HG1      VAL  89   5.144 -11.230  -3.279
  698   HG21  VAL  89          1HG2      VAL  89   7.069  -8.256  -2.452
  699   HG22  VAL  89          2HG2      VAL  89   6.610  -8.163  -0.753
  700   HG23  VAL  89          3HG2      VAL  89   5.452  -7.709  -2.006
  701    H    ASP  90           H        ASP  90   2.174 -10.750  -1.005
  702    HA   ASP  90           HA       ASP  90   2.801 -13.612  -0.981
  703    HB2  ASP  90          1HB       ASP  90   0.348 -12.064  -0.201
  704    HB3  ASP  90          2HB       ASP  90   0.240 -13.785  -0.578
  705    H    LYS  91           H        LYS  91   1.103 -14.933  -2.211
  706    HA   LYS  91           HA       LYS  91   1.127 -13.959  -4.967
  707    HB2  LYS  91          1HB       LYS  91   0.319 -16.714  -4.065
  708    HB3  LYS  91          2HB       LYS  91   0.935 -16.200  -5.633
  709    HG2  LYS  91          1HG       LYS  91   3.100 -15.675  -4.518
  710    HG3  LYS  91          2HG       LYS  91   2.468 -16.457  -3.072
  711    HD2  LYS  91          1HD       LYS  91   2.155 -18.530  -4.342
  712    HD3  LYS  91          2HD       LYS  91   2.799 -17.740  -5.781
  713    HE2  LYS  91          1HE       LYS  91   4.919 -17.351  -4.569
  714    HE3  LYS  91          2HE       LYS  91   4.266 -18.240  -3.195
  715    HZ1  LYS  91          1HZ       LYS  91   5.678 -19.630  -4.579
  716    HZ2  LYS  91          2HZ       LYS  91   4.683 -19.350  -5.916
  717    HZ3  LYS  91          3HZ       LYS  91   4.086 -20.199  -4.584
  718    H    ASN  92           H        ASN  92  -0.737 -14.333  -6.331
  719    HA   ASN  92           HA       ASN  92  -3.103 -13.283  -5.075
  720    HB2  ASN  92          1HB       ASN  92  -2.278 -12.541  -7.321
  721    HB3  ASN  92          2HB       ASN  92  -2.707 -14.126  -7.946
  722   HD21  ASN  92          1HD2      ASN  92  -4.075 -13.022  -9.426
  723   HD22  ASN  92          2HD2      ASN  92  -5.641 -12.464  -8.940
  724    H    THR  93           H        THR  93  -3.272 -15.264  -3.710
  725    HA   THR  93           HA       THR  93  -4.423 -17.593  -4.989
  726    HB   THR  93           HB       THR  93  -4.687 -18.437  -2.672
  727    HG1  THR  93           HG1      THR  93  -4.967 -16.586  -1.467
  728   HG21  THR  93          1HG2      THR  93  -2.283 -18.573  -2.146
  729   HG22  THR  93          2HG2      THR  93  -1.972 -17.324  -3.353
  730   HG23  THR  93          3HG2      THR  93  -2.630 -18.886  -3.845
  731    H    ASP  94           H        ASP  94  -5.484 -14.628  -3.655
  732    HA   ASP  94           HA       ASP  94  -8.134 -15.514  -2.950
  733    HB2  ASP  94          1HB       ASP  94  -7.034 -12.712  -3.283
  734    HB3  ASP  94          2HB       ASP  94  -8.624 -13.108  -2.623
  735    H    ASN  95           H        ASN  95  -6.539 -14.642  -5.775
  736    HA   ASN  95           HA       ASN  95  -7.135 -14.331  -7.922
  737    HB2  ASN  95          1HB       ASN  95  -8.401 -16.421  -7.486
  738    HB3  ASN  95          2HB       ASN  95  -9.802 -15.459  -7.062
  739   HD21  ASN  95          1HD2      ASN  95 -11.018 -16.405  -8.669
  740   HD22  ASN  95          2HD2      ASN  95 -10.789 -16.026 -10.348
  741    H    ASN  96           H        ASN  96  -7.523 -12.249  -5.944
  742    HA   ASN  96           HA       ASN  96  -9.315 -10.533  -7.456
  743    HB2  ASN  96          1HB       ASN  96 -10.827 -11.351  -5.791
  744    HB3  ASN  96          2HB       ASN  96  -9.643 -11.122  -4.505
  745   HD21  ASN  96          1HD2      ASN  96 -11.870  -9.566  -6.673
  746   HD22  ASN  96          2HD2      ASN  96 -11.927  -8.051  -5.839
  747    H    ALA  97           H        ALA  97  -8.226  -8.753  -7.870
  748    HA   ALA  97           HA       ALA  97  -5.664  -8.260  -6.827
  749    HB1  ALA  97          1HB       ALA  97  -6.344  -7.605  -9.078
  750    HB2  ALA  97          2HB       ALA  97  -5.710  -6.230  -8.173
  751    HB3  ALA  97          3HB       ALA  97  -7.449  -6.412  -8.399
  752    H    CYS  98           H        CYS  98  -8.823  -7.035  -5.899
  753    HA   CYS  98           HA       CYS  98  -7.885  -4.790  -4.441
  754    HB2  CYS  98          1HB       CYS  98 -10.451  -6.338  -4.028
  755    HB3  CYS  98          2HB       CYS  98 -10.094  -4.737  -3.388
  756    H    HIS  99           H        HIS  99  -8.630  -8.129  -3.428
  757    HA   HIS  99           HA       HIS  99  -7.947  -7.550  -0.691
  758    HB2  HIS  99          1HB       HIS  99  -9.566  -9.370  -1.460
  759    HB3  HIS  99          2HB       HIS  99  -8.151 -10.295  -1.942
  760    HD1  HIS  99           HD1      HIS  99  -6.843 -11.506  -0.120
  761    HD2  HIS  99           HD2      HIS  99  -9.871  -9.054   1.371
  762    HE1  HIS  99           HE1      HIS  99  -7.020 -12.042   2.331
  763    HE2  HIS  99           HE2      HIS  99  -8.774 -10.479   3.232
  764    H    TRP 100           H        TRP 100  -6.297  -8.631  -3.522
  765    HA   TRP 100           HA       TRP 100  -4.041  -9.807  -2.292
  766    HB2  TRP 100          1HB       TRP 100  -4.669 -10.156  -4.666
  767    HB3  TRP 100          2HB       TRP 100  -4.216  -8.487  -5.015
  768    HD1  TRP 100           HD1      TRP 100  -1.800 -10.016  -2.651
  769    HE1  TRP 100           HE1      TRP 100   0.337 -10.719  -3.884
  770    HE3  TRP 100           HE3      TRP 100  -3.462  -9.576  -7.460
  771    HZ2  TRP 100           HZ2      TRP 100   1.205 -11.068  -6.549
  772    HZ3  TRP 100           HZ3      TRP 100  -1.923 -10.119  -9.295
  773    HH2  TRP 100           HH2      TRP 100   0.363 -10.849  -8.855
  774    H    ALA 101           H        ALA 101  -4.423  -6.606  -3.817
  775    HA   ALA 101           HA       ALA 101  -1.929  -5.589  -3.019
  776    HB1  ALA 101          1HB       ALA 101  -2.883  -3.386  -3.569
  777    HB2  ALA 101          2HB       ALA 101  -4.481  -4.126  -3.677
  778    HB3  ALA 101          3HB       ALA 101  -3.217  -4.590  -4.815
  779    H    PHE 102           H        PHE 102  -5.069  -5.643  -1.490
  780    HA   PHE 102           HA       PHE 102  -4.484  -3.835   0.588
  781    HB2  PHE 102          1HB       PHE 102  -6.759  -4.417  -0.114
  782    HB3  PHE 102          2HB       PHE 102  -6.546  -6.042   0.525
  783    HD1  PHE 102           HD1      PHE 102  -6.436  -2.470   1.537
  784    HD2  PHE 102           HD2      PHE 102  -7.196  -6.487   2.719
  785    HE1  PHE 102           HE1      PHE 102  -7.262  -1.669   3.713
  786    HE2  PHE 102           HE2      PHE 102  -8.022  -5.696   4.896
  787    HZ   PHE 102           HZ       PHE 102  -8.053  -3.282   5.397
  788    H    ARG 103           H        ARG 103  -4.022  -7.280   0.163
  789    HA   ARG 103           HA       ARG 103  -3.484  -7.924   2.877
  790    HB2  ARG 103          1HB       ARG 103  -4.082  -9.617   1.157
  791    HB3  ARG 103          2HB       ARG 103  -2.529  -9.328   0.385
  792    HG2  ARG 103          1HG       ARG 103  -1.349 -10.133   2.313
  793    HG3  ARG 103          2HG       ARG 103  -2.859 -10.296   3.204
  794    HD2  ARG 103          1HD       ARG 103  -3.611 -12.034   1.700
  795    HD3  ARG 103          2HD       ARG 103  -2.194 -11.813   0.676
  796    HE   ARG 103           HE       ARG 103  -1.085 -12.419   3.042
  797   HH11  ARG 103          1HH1      ARG 103  -3.692 -13.924   1.264
  798   HH12  ARG 103          2HH1      ARG 103  -3.321 -15.523   1.811
  799   HH21  ARG 103          1HH2      ARG 103  -0.590 -14.532   3.773
  800   HH22  ARG 103          2HH2      ARG 103  -1.556 -15.870   3.240
  801    H    GLY 104           H        GLY 104  -1.450  -7.056   0.117
  802    HA2  GLY 104          1HA       GLY 104   1.051  -7.349   1.393
  803    HA3  GLY 104          2HA       GLY 104   0.723  -6.312  -0.001
  804    H    PHE 105           H        PHE 105  -1.003  -4.482   0.974
  805    HA   PHE 105           HA       PHE 105   0.691  -2.685   2.307
  806    HB2  PHE 105          1HB       PHE 105  -0.951  -1.764   0.884
  807    HB3  PHE 105          2HB       PHE 105  -2.241  -2.660   1.666
  808    HD1  PHE 105           HD1      PHE 105  -3.724  -1.199   2.674
  809    HD2  PHE 105           HD2      PHE 105   0.454  -0.408   2.917
  810    HE1  PHE 105           HE1      PHE 105  -4.182   0.754   4.088
  811    HE2  PHE 105           HE2      PHE 105  -0.006   1.555   4.330
  812    HZ   PHE 105           HZ       PHE 105  -2.322   2.136   4.919
  813    H    LYS 106           H        LYS 106  -2.065  -4.591   3.417
  814    HA   LYS 106           HA       LYS 106  -2.204  -3.478   5.995
  815    HB2  LYS 106          1HB       LYS 106  -4.162  -4.493   5.417
  816    HB3  LYS 106          2HB       LYS 106  -3.378  -5.867   4.647
  817    HG2  LYS 106          1HG       LYS 106  -2.797  -6.697   6.920
  818    HG3  LYS 106          2HG       LYS 106  -3.752  -5.365   7.589
  819    HD2  LYS 106          1HD       LYS 106  -5.732  -6.183   6.438
  820    HD3  LYS 106          2HD       LYS 106  -4.794  -7.484   5.709
  821    HE2  LYS 106          1HE       LYS 106  -4.304  -8.322   8.005
  822    HE3  LYS 106          2HE       LYS 106  -5.407  -7.097   8.636
  823    HZ1  LYS 106          1HZ       LYS 106  -6.475  -9.257   8.376
  824    HZ2  LYS 106          2HZ       LYS 106  -6.145  -9.238   6.718
  825    HZ3  LYS 106          3HZ       LYS 106  -7.201  -8.094   7.383
  826    H    CYS 107           H        CYS 107  -0.617  -6.386   4.744
  827    HA   CYS 107           HA       CYS 107   0.310  -7.449   7.142
  828    HB2  CYS 107          1HB       CYS 107   0.446  -8.801   5.206
  829    HB3  CYS 107          2HB       CYS 107   1.347  -7.587   4.308
  830    H    PHE 108           H        PHE 108   1.683  -5.012   5.003
  831    HA   PHE 108           HA       PHE 108   4.204  -4.930   6.325
  832    HB2  PHE 108          1HB       PHE 108   3.714  -4.343   3.904
  833    HB3  PHE 108          2HB       PHE 108   3.085  -2.811   4.510
  834    HD1  PHE 108           HD1      PHE 108   4.591  -1.136   5.430
  835    HD2  PHE 108           HD2      PHE 108   6.061  -4.856   3.971
  836    HE1  PHE 108           HE1      PHE 108   6.878  -0.231   5.429
  837    HE2  PHE 108           HE2      PHE 108   8.344  -3.955   3.971
  838    HZ   PHE 108           HZ       PHE 108   8.757  -1.642   4.695
  839    H    GLN 109           H        GLN 109   1.454  -2.656   6.175
  840    HA   GLN 109           HA       GLN 109   2.556  -0.755   7.914
  841    HB2  GLN 109          1HB       GLN 109   0.347   0.206   8.036
  842    HB3  GLN 109          2HB       GLN 109   0.678  -0.295   6.385
  843    HG2  GLN 109          1HG       GLN 109  -1.352  -1.205   6.473
  844    HG3  GLN 109          2HG       GLN 109  -0.577  -2.492   7.404
  845   HE21  GLN 109          1HE2      GLN 109  -3.321  -1.547   7.503
  846   HE22  GLN 109          2HE2      GLN 109  -3.603  -1.054   9.134
  847    H    LYS 110           H        LYS 110   0.919  -3.737   8.536
  848    HA   LYS 110           HA       LYS 110  -0.030  -3.275  11.134
  849    HB2  LYS 110          1HB       LYS 110  -0.266  -5.316   9.435
  850    HB3  LYS 110          2HB       LYS 110   1.051  -5.960  10.391
  851    HG2  LYS 110          1HG       LYS 110  -1.609  -5.106  11.489
  852    HG3  LYS 110          2HG       LYS 110  -1.133  -6.758  11.113
  853    HD2  LYS 110          1HD       LYS 110   0.642  -6.639  12.773
  854    HD3  LYS 110          2HD       LYS 110   0.212  -4.964  13.127
  855    HE2  LYS 110          1HE       LYS 110  -1.540  -7.383  13.535
  856    HE3  LYS 110          2HE       LYS 110  -0.721  -6.469  14.799
  857    HZ1  LYS 110          1HZ       LYS 110  -3.055  -5.853  14.595
  858    HZ2  LYS 110          2HZ       LYS 110  -2.815  -5.391  12.989
  859    HZ3  LYS 110          3HZ       LYS 110  -2.048  -4.544  14.236
  860    H    ASN 111           H        ASN 111   3.116  -4.174   9.897
  861    HA   ASN 111           HA       ASN 111   4.158  -4.345  12.643
  862    HB2  ASN 111          1HB       ASN 111   5.358  -5.399  10.073
  863    HB3  ASN 111          2HB       ASN 111   6.055  -5.566  11.682
  864   HD21  ASN 111          1HD2      ASN 111   3.523  -6.622   9.528
  865   HD22  ASN 111          2HD2      ASN 111   3.043  -7.997  10.462
  866    H    ASN 112           H        ASN 112   4.273  -2.542   9.710
  867    HA   ASN 112           HA       ASN 112   6.433  -0.862  10.769
  868    HB2  ASN 112          1HB       ASN 112   6.384  -2.183   8.050
  869    HB3  ASN 112          2HB       ASN 112   7.434  -0.817   8.456
  870   HD21  ASN 112          1HD2      ASN 112   7.793  -3.784   7.801
  871   HD22  ASN 112          2HD2      ASN 112   8.937  -4.301   8.993
  872    H    LEU 113           H        LEU 113   4.287   0.377  11.093
  873    HA   LEU 113           HA       LEU 113   3.305   1.609   8.653
  874    HB2  LEU 113          1HB       LEU 113   1.649   1.061  10.289
  875    HB3  LEU 113          2HB       LEU 113   2.500   1.948  11.534
  876    HG   LEU 113           HG       LEU 113   2.026   4.047  10.259
  877   HD11  LEU 113          1HD1      LEU 113   0.277   2.229   8.614
  878   HD12  LEU 113          2HD1      LEU 113   1.750   3.017   8.057
  879   HD13  LEU 113          3HD1      LEU 113   0.346   3.988   8.504
  880   HD21  LEU 113          1HD2      LEU 113  -0.330   4.152  10.908
  881   HD22  LEU 113          2HD2      LEU 113   0.637   3.347  12.144
  882   HD23  LEU 113          3HD2      LEU 113  -0.368   2.394  11.054
  883    H    SER 114           H        SER 114   5.426   2.294  11.293
  884    HA   SER 114           HA       SER 114   5.570   5.093  11.111
  885    HB2  SER 114          1HB       SER 114   7.800   3.199  11.899
  886    HB3  SER 114          2HB       SER 114   7.637   4.894  12.357
  887    HG   SER 114           HG       SER 114   5.754   4.344  13.516
  888    H    LEU 115           H        LEU 115   7.305   2.538   9.377
  889    HA   LEU 115           HA       LEU 115   9.106   4.218   8.007
  890    HB2  LEU 115          1HB       LEU 115   9.374   1.783   8.187
  891    HB3  LEU 115          2HB       LEU 115   7.971   1.556   7.162
  892    HG   LEU 115           HG       LEU 115   9.164   2.678   5.313
  893   HD11  LEU 115          1HD1      LEU 115  11.635   2.967   5.590
  894   HD12  LEU 115          2HD1      LEU 115  11.388   2.760   7.326
  895   HD13  LEU 115          3HD1      LEU 115  10.640   4.115   6.486
  896   HD21  LEU 115          1HD2      LEU 115  10.702   0.861   4.827
  897   HD22  LEU 115          2HD2      LEU 115   9.214   0.238   5.537
  898   HD23  LEU 115          3HD2      LEU 115  10.673   0.361   6.517
  899    H    ILE 116           H        ILE 116   5.818   3.218   7.381
  900    HA   ILE 116           HA       ILE 116   5.663   4.079   4.695
  901    HB   ILE 116           HB       ILE 116   3.465   3.729   6.749
  902   HG12  ILE 116          1HG1      ILE 116   4.570   1.857   4.637
  903   HG13  ILE 116          2HG1      ILE 116   4.736   1.680   6.390
  904   HG21  ILE 116          1HG2      ILE 116   1.950   3.541   4.838
  905   HG22  ILE 116          2HG2      ILE 116   3.285   3.901   3.744
  906   HG23  ILE 116          3HG2      ILE 116   2.729   5.126   4.885
  907   HD11  ILE 116          1HD1      ILE 116   2.251   1.430   4.730
  908   HD12  ILE 116          2HD1      ILE 116   2.237   1.520   6.489
  909   HD13  ILE 116          3HD1      ILE 116   3.053   0.182   5.680
  910    H    LYS 117           H        LYS 117   4.961   5.615   7.784
  911    HA   LYS 117           HA       LYS 117   3.931   8.036   6.782
  912    HB2  LYS 117          1HB       LYS 117   5.224   7.277   9.388
  913    HB3  LYS 117          2HB       LYS 117   4.636   8.905   9.078
  914    HG2  LYS 117          1HG       LYS 117   2.390   8.104   8.803
  915    HG3  LYS 117          2HG       LYS 117   2.921   6.427   8.899
  916    HD2  LYS 117          1HD       LYS 117   3.543   6.692  11.201
  917    HD3  LYS 117          2HD       LYS 117   3.263   8.429  11.130
  918    HE2  LYS 117          1HE       LYS 117   1.127   6.343  10.716
  919    HE3  LYS 117          2HE       LYS 117   1.450   7.138  12.255
  920    HZ1  LYS 117          1HZ       LYS 117  -0.357   8.212  11.100
  921    HZ2  LYS 117          2HZ       LYS 117   0.616   8.488   9.746
  922    HZ3  LYS 117          3HZ       LYS 117   0.961   9.266  11.206
  923    H    ALA 118           H        ALA 118   7.201   7.031   7.693
  924    HA   ALA 118           HA       ALA 118   8.437   9.546   7.186
  925    HB1  ALA 118          1HB       ALA 118   9.632   6.790   7.290
  926    HB2  ALA 118          2HB       ALA 118   9.395   7.865   8.667
  927    HB3  ALA 118          3HB       ALA 118  10.521   8.311   7.384
  928    H    SER 119           H        SER 119   7.744   6.730   5.263
  929    HA   SER 119           HA       SER 119   9.386   7.145   3.069
  930    HB2  SER 119          1HB       SER 119   8.090   5.093   3.430
  931    HB3  SER 119          2HB       SER 119   6.594   5.975   3.132
  932    HG   SER 119           HG       SER 119   8.715   5.580   1.286
  933    H    ILE 120           H        ILE 120   6.116   8.375   3.678
  934    HA   ILE 120           HA       ILE 120   6.155   9.844   1.165
  935    HB   ILE 120           HB       ILE 120   3.826  10.479   1.777
  936   HG12  ILE 120          1HG1      ILE 120   4.144   8.523   4.048
  937   HG13  ILE 120          2HG1      ILE 120   4.245  10.269   4.264
  938   HG21  ILE 120          1HG2      ILE 120   4.221   8.556   0.381
  939   HG22  ILE 120          2HG2      ILE 120   2.887   8.218   1.486
  940   HG23  ILE 120          3HG2      ILE 120   4.487   7.548   1.804
  941   HD11  ILE 120          1HD1      ILE 120   1.867   8.764   3.207
  942   HD12  ILE 120          2HD1      ILE 120   1.972  10.507   3.446
  943   HD13  ILE 120          3HD1      ILE 120   2.045   9.423   4.831
  944    H    LYS 121           H        LYS 121   7.352  10.409   4.153
  945    HA   LYS 121           HA       LYS 121   6.451  13.106   4.547
  946    HB2  LYS 121          1HB       LYS 121   7.143  11.652   6.418
  947    HB3  LYS 121          2HB       LYS 121   8.784  11.639   5.788
  948    HG2  LYS 121          1HG       LYS 121   8.871  14.095   6.089
  949    HG3  LYS 121          2HG       LYS 121   7.266  14.026   6.817
  950    HD2  LYS 121          1HD       LYS 121   8.122  12.557   8.573
  951    HD3  LYS 121          2HD       LYS 121   9.729  12.620   7.847
  952    HE2  LYS 121          1HE       LYS 121   8.184  14.935   9.004
  953    HE3  LYS 121          2HE       LYS 121   9.596  14.159   9.714
  954    HZ1  LYS 121          1HZ       LYS 121   9.540  15.654   7.150
  955    HZ2  LYS 121          2HZ       LYS 121  10.895  14.884   7.798
  956    HZ3  LYS 121          3HZ       LYS 121  10.207  16.198   8.602
  957    H    LYS 122           H        LYS 122   7.141  14.787   3.439
  958    HA   LYS 122           HA       LYS 122   9.433  14.607   1.731
  959    HB2  LYS 122          1HB       LYS 122   8.634  17.288   1.817
  960    HB3  LYS 122          2HB       LYS 122   8.247  16.113   0.575
  961    HG2  LYS 122          1HG       LYS 122   6.205  17.072   1.229
  962    HG3  LYS 122          2HG       LYS 122   6.246  15.489   2.003
  963    HD2  LYS 122          1HD       LYS 122   5.448  17.056   3.617
  964    HD3  LYS 122          2HD       LYS 122   7.095  16.620   4.073
  965    HE2  LYS 122          1HE       LYS 122   6.898  18.972   4.338
  966    HE3  LYS 122          2HE       LYS 122   7.870  18.698   2.897
  967    HZ1  LYS 122          1HZ       LYS 122   6.340  20.377   2.357
  968    HZ2  LYS 122          2HZ       LYS 122   5.040  19.552   3.049
  969    HZ3  LYS 122          3HZ       LYS 122   5.730  18.984   1.613
  970    H    ASP 123           H        ASP 123  11.427  15.365   2.073
  971    HA   ASP 123           HA       ASP 123  12.240  16.142   4.673
  972    HB2  ASP 123          1HB       ASP 123  13.751  14.982   3.113
  973    HB3  ASP 123          2HB       ASP 123  13.756  16.399   2.068
  974    H21  ACD 201           H21      ACD   1  -4.647   4.643   1.187
  975    H22  ACD 201           H22      ACD   1  -3.626   4.641   2.631
  976    H31  ACD 201           H31      ACD   1  -2.046   6.198   1.447
  977    H32  ACD 201           H32      ACD   1  -3.030   6.054  -0.003
  978    H41  ACD 201           H41      ACD   1  -2.644   3.542   0.078
  979    H42  ACD 201           H42      ACD   1  -1.187   4.506  -0.225
  980    H5   ACD 201           H5       ACD   1  -1.805   2.907   2.298
  981    H6   ACD 201           H6       ACD   1   0.382   3.651   2.940
  982    H71  ACD 201           H71      ACD   1   0.782   4.861   0.304
  983    H72  ACD 201           H72      ACD   1  -0.135   6.040   1.236
  984    H8   ACD 201           H8       ACD   1   1.759   6.333   2.824
  985    H9   ACD 201           H9       ACD   1   3.874   5.489   2.115
  986   H101  ACD 201          H101      ACD   1   2.798   4.772  -0.477
  987   H102  ACD 201          H102      ACD   1   2.337   3.430   0.577
  988    H11  ACD 201           H11      ACD   1   5.297   4.333   0.448
  989    H12  ACD 201           H12      ACD   1   5.625   2.002   0.117
  990   H131  ACD 201          H131      ACD   1   2.650   2.015  -0.556
  991   H132  ACD 201          H132      ACD   1   3.747   0.633  -0.642
  992    H14  ACD 201           H14      ACD   1   2.627   1.729   2.038
  993    H15  ACD 201           H15      ACD   1   2.532  -0.603   2.518
  994   H161  ACD 201          H161      ACD   1   2.743  -1.301  -0.293
  995   H162  ACD 201          H162      ACD   1   4.400  -0.936   0.199
  996   H171  ACD 201          H171      ACD   1   4.366  -2.628   1.911
  997   H172  ACD 201          H172      ACD   1   2.621  -2.856   1.743
  998   H181  ACD 201          H181      ACD   1   4.659  -3.447  -0.448
  999   H182  ACD 201          H182      ACD   1   2.923  -3.757  -0.531
 1000   H191  ACD 201          H191      ACD   1   4.904  -5.043   1.400
 1001   H192  ACD 201          H192      ACD   1   3.156  -5.284   1.474
 1002   H201  ACD 201          H201      ACD   1   4.231  -7.104   0.241
 1003   H202  ACD 201          H202      ACD   1   4.934  -5.982  -0.875
 1004   H203  ACD 201          H203      ACD   1   3.218  -6.197  -0.830
  Start of MODEL    5
    1    H1   MET   1          1H        MET   1  12.898  12.073 -18.015
    2    H2   MET   1          2H        MET   1  11.496  12.982 -18.262
    3    H3   MET   1          3H        MET   1  11.850  11.683 -19.281
    4    HA   MET   1           HA       MET   1  10.126  11.082 -17.744
    5    HB2  MET   1          1HB       MET   1  12.800   9.769 -17.257
    6    HB3  MET   1          2HB       MET   1  11.282   9.121 -16.654
    7    HG2  MET   1          1HG       MET   1  10.469   8.954 -18.969
    8    HG3  MET   1          2HG       MET   1  12.032   9.532 -19.538
    9    HE1  MET   1          1HE       MET   1  11.312   7.065 -16.521
   10    HE2  MET   1          2HE       MET   1  11.361   5.517 -17.364
   11    HE3  MET   1          3HE       MET   1  10.088   6.681 -17.729
   12    H    GLU   2           H        GLU   2  13.118  11.236 -15.822
   13    HA   GLU   2           HA       GLU   2  13.556  11.898 -13.706
   14    HB2  GLU   2          1HB       GLU   2  11.043  13.525 -14.033
   15    HB3  GLU   2          2HB       GLU   2  12.110  13.616 -12.641
   16    HG2  GLU   2          1HG       GLU   2  12.913  14.214 -15.471
   17    HG3  GLU   2          2HG       GLU   2  12.481  15.423 -14.261
   18    H    PHE   3           H        PHE   3  13.467  10.236 -12.388
   19    HA   PHE   3           HA       PHE   3  11.103   8.767 -11.854
   20    HB2  PHE   3          1HB       PHE   3  13.327   7.745 -11.640
   21    HB3  PHE   3          2HB       PHE   3  13.688   8.811 -10.276
   22    HD1  PHE   3           HD1      PHE   3  12.907   8.294  -8.095
   23    HD2  PHE   3           HD2      PHE   3  11.570   6.030 -11.435
   24    HE1  PHE   3           HE1      PHE   3  11.910   6.642  -6.566
   25    HE2  PHE   3           HE2      PHE   3  10.567   4.372  -9.917
   26    HZ   PHE   3           HZ       PHE   3  10.737   4.678  -7.478
   27    H    THR   4           H        THR   4   9.458   9.641 -10.871
   28    HA   THR   4           HA       THR   4   9.917  11.664  -8.802
   29    HB   THR   4           HB       THR   4   7.142  11.231  -9.576
   30    HG1  THR   4           HG1      THR   4   9.126  11.603 -11.555
   31   HG21  THR   4          1HG2      THR   4   9.017  13.586  -9.664
   32   HG22  THR   4          2HG2      THR   4   7.884  13.181  -8.374
   33   HG23  THR   4          3HG2      THR   4   7.281  13.664  -9.960
   34    H    VAL   5           H        VAL   5   9.776  11.087  -6.774
   35    HA   VAL   5           HA       VAL   5   8.289   8.683  -6.025
   36    HB   VAL   5           HB       VAL   5   9.448   8.623  -4.063
   37   HG11  VAL   5          1HG1      VAL   5  11.292  10.364  -5.665
   38   HG12  VAL   5          2HG1      VAL   5  11.105   8.619  -5.820
   39   HG13  VAL   5          3HG1      VAL   5  11.747   9.308  -4.330
   40   HG21  VAL   5          1HG2      VAL   5  10.297  10.562  -2.809
   41   HG22  VAL   5          2HG2      VAL   5   8.562  10.666  -3.101
   42   HG23  VAL   5          3HG2      VAL   5   9.677  11.633  -4.067
   43    H    SER   6           H        SER   6   6.448   8.678  -4.881
   44    HA   SER   6           HA       SER   6   4.875  11.069  -5.084
   45    HB2  SER   6          1HB       SER   6   3.109   9.459  -4.078
   46    HB3  SER   6          2HB       SER   6   3.706   9.156  -5.709
   47    HG   SER   6           HG       SER   6   4.698   7.403  -5.044
   48    H    THR   7           H        THR   7   5.285  12.590  -3.594
   49    HA   THR   7           HA       THR   7   5.751  11.926  -0.821
   50    HB   THR   7           HB       THR   7   5.842  14.370  -0.478
   51    HG1  THR   7           HG1      THR   7   5.034  14.389  -3.217
   52   HG21  THR   7          1HG2      THR   7   7.820  14.808  -1.856
   53   HG22  THR   7          2HG2      THR   7   7.419  13.424  -2.872
   54   HG23  THR   7          3HG2      THR   7   7.859  13.178  -1.182
   55    H    THR   8           H        THR   8   4.436  13.603   0.709
   56    HA   THR   8           HA       THR   8   1.875  12.592   1.027
   57    HB   THR   8           HB       THR   8   2.928  15.269   1.954
   58    HG1  THR   8           HG1      THR   8   3.923  13.053   2.574
   59   HG21  THR   8          1HG2      THR   8   0.576  13.627   2.880
   60   HG22  THR   8          2HG2      THR   8   0.522  15.206   2.093
   61   HG23  THR   8          3HG2      THR   8   1.201  15.050   3.715
   62    H    GLU   9           H        GLU   9   2.849  15.667  -0.473
   63    HA   GLU   9           HA       GLU   9   0.285  16.594  -1.046
   64    HB2  GLU   9          1HB       GLU   9   2.352  17.967  -1.135
   65    HB3  GLU   9          2HB       GLU   9   2.800  17.144  -2.622
   66    HG2  GLU   9          1HG       GLU   9   0.967  18.079  -3.793
   67    HG3  GLU   9          2HG       GLU   9   0.244  18.682  -2.303
   68    H    ASP  10           H        ASP  10   2.446  14.518  -2.911
   69    HA   ASP  10           HA       ASP  10   0.813  14.344  -5.224
   70    HB2  ASP  10          1HB       ASP  10   2.784  12.292  -4.183
   71    HB3  ASP  10          2HB       ASP  10   2.098  12.355  -5.805
   72    H    LEU  11           H        LEU  11   1.065  12.403  -2.282
   73    HA   LEU  11           HA       LEU  11  -0.653  10.356  -3.063
   74    HB2  LEU  11          1HB       LEU  11   0.812  10.139  -1.146
   75    HB3  LEU  11          2HB       LEU  11  -0.093  11.383  -0.273
   76    HG   LEU  11           HG       LEU  11  -2.079   9.861  -0.359
   77   HD11  LEU  11          1HD1      LEU  11  -1.455   8.533  -2.282
   78   HD12  LEU  11          2HD1      LEU  11  -1.701   7.500  -0.876
   79   HD13  LEU  11          3HD1      LEU  11  -0.066   7.889  -1.409
   80   HD21  LEU  11          1HD2      LEU  11   0.381   8.717   0.957
   81   HD22  LEU  11          2HD2      LEU  11  -1.291   8.349   1.384
   82   HD23  LEU  11          3HD2      LEU  11  -0.654   9.980   1.626
   83    H    GLN  12           H        GLN  12  -1.285  13.500  -1.642
   84    HA   GLN  12           HA       GLN  12  -3.952  13.227  -0.911
   85    HB2  GLN  12          1HB       GLN  12  -2.389  15.568  -1.946
   86    HB3  GLN  12          2HB       GLN  12  -4.086  15.717  -1.529
   87    HG2  GLN  12          1HG       GLN  12  -3.610  15.076   0.756
   88    HG3  GLN  12          2HG       GLN  12  -1.913  14.827   0.349
   89   HE21  GLN  12          1HE2      GLN  12  -3.221  16.654   2.261
   90   HE22  GLN  12          2HE2      GLN  12  -2.656  18.234   1.845
   91    H    ARG  13           H        ARG  13  -2.574  13.912  -4.077
   92    HA   ARG  13           HA       ARG  13  -5.021  14.440  -5.387
   93    HB2  ARG  13          1HB       ARG  13  -2.863  15.121  -6.318
   94    HB3  ARG  13          2HB       ARG  13  -2.397  13.437  -6.505
   95    HG2  ARG  13          1HG       ARG  13  -3.087  14.409  -8.631
   96    HG3  ARG  13          2HG       ARG  13  -4.186  13.110  -8.134
   97    HD2  ARG  13          1HD       ARG  13  -5.388  15.048  -9.032
   98    HD3  ARG  13          2HD       ARG  13  -5.790  14.743  -7.344
   99    HE   ARG  13           HE       ARG  13  -3.695  16.690  -7.801
  100   HH11  ARG  13          1HH1      ARG  13  -7.119  16.148  -7.317
  101   HH12  ARG  13          2HH1      ARG  13  -7.424  17.763  -6.758
  102   HH21  ARG  13          1HH2      ARG  13  -4.092  18.813  -7.060
  103   HH22  ARG  13          2HH2      ARG  13  -5.703  19.277  -6.611
  104    H    TYR  14           H        TYR  14  -3.134  11.506  -4.866
  105    HA   TYR  14           HA       TYR  14  -4.704   9.902  -6.621
  106    HB2  TYR  14          1HB       TYR  14  -2.911   8.927  -4.394
  107    HB3  TYR  14          2HB       TYR  14  -3.435   8.033  -5.812
  108    HD1  TYR  14           HD1      TYR  14  -0.551   8.845  -4.689
  109    HD2  TYR  14           HD2      TYR  14  -3.017  10.190  -7.885
  110    HE1  TYR  14           HE1      TYR  14   1.443   9.614  -5.898
  111    HE2  TYR  14           HE2      TYR  14  -1.026  10.951  -9.105
  112    HH   TYR  14           HH       TYR  14   1.287  11.650  -8.591
  113    H    ARG  15           H        ARG  15  -4.724  10.455  -3.116
  114    HA   ARG  15           HA       ARG  15  -6.640   8.500  -2.468
  115    HB2  ARG  15          1HB       ARG  15  -6.662  11.140  -1.039
  116    HB3  ARG  15          2HB       ARG  15  -6.928   9.533  -0.401
  117    HG2  ARG  15          1HG       ARG  15  -4.525   9.040  -0.705
  118    HG3  ARG  15          2HG       ARG  15  -4.287  10.714  -1.213
  119    HD2  ARG  15          1HD       ARG  15  -3.756  10.823   1.048
  120    HD3  ARG  15          2HD       ARG  15  -5.462  11.279   1.053
  121    HE   ARG  15           HE       ARG  15  -5.000   8.453   1.380
  122   HH11  ARG  15          1HH1      ARG  15  -5.396  11.516   3.052
  123   HH12  ARG  15          2HH1      ARG  15  -5.700  10.769   4.583
  124   HH21  ARG  15          1HH2      ARG  15  -5.408   7.481   3.355
  125   HH22  ARG  15          2HH2      ARG  15  -5.715   8.467   4.765
  126    H    THR  16           H        THR  16  -6.958  11.903  -3.295
  127    HA   THR  16           HA       THR  16  -9.720  12.135  -3.061
  128    HB   THR  16           HB       THR  16  -7.732  13.634  -4.759
  129    HG1  THR  16           HG1      THR  16  -7.332  13.997  -2.624
  130   HG21  THR  16          1HG2      THR  16  -9.959  13.899  -5.718
  131   HG22  THR  16          2HG2      THR  16  -9.419  15.397  -4.958
  132   HG23  THR  16          3HG2      THR  16 -10.594  14.366  -4.139
  133    H    GLU  17           H        GLU  17  -7.734  11.501  -5.957
  134    HA   GLU  17           HA       GLU  17  -9.976  11.487  -7.676
  135    HB2  GLU  17          1HB       GLU  17  -8.236  11.928  -9.025
  136    HB3  GLU  17          2HB       GLU  17  -7.086  11.135  -7.964
  137    HG2  GLU  17          1HG       GLU  17  -7.589   8.999  -8.956
  138    HG3  GLU  17          2HG       GLU  17  -8.922   9.706  -9.874
  139    H    CYS  18           H        CYS  18  -8.057   8.824  -6.257
  140    HA   CYS  18           HA       CYS  18  -9.456   6.739  -7.512
  141    HB2  CYS  18          1HB       CYS  18  -7.976   6.789  -4.883
  142    HB3  CYS  18          2HB       CYS  18  -8.685   5.327  -5.578
  143    H    VAL  19           H        VAL  19 -10.139   8.569  -4.585
  144    HA   VAL  19           HA       VAL  19 -12.276   7.013  -3.661
  145    HB   VAL  19           HB       VAL  19 -11.468   9.861  -3.250
  146   HG11  VAL  19          1HG1      VAL  19 -13.933   9.877  -3.435
  147   HG12  VAL  19          2HG1      VAL  19 -13.346  10.301  -1.827
  148   HG13  VAL  19          3HG1      VAL  19 -14.006   8.696  -2.127
  149   HG21  VAL  19          1HG2      VAL  19 -10.343   8.177  -1.964
  150   HG22  VAL  19          2HG2      VAL  19 -11.878   7.491  -1.440
  151   HG23  VAL  19          3HG2      VAL  19 -11.399   9.100  -0.897
  152    H    SER  20           H        SER  20 -12.282   9.932  -5.670
  153    HA   SER  20           HA       SER  20 -15.062   9.980  -6.086
  154    HB2  SER  20          1HB       SER  20 -12.786  11.169  -7.676
  155    HB3  SER  20          2HB       SER  20 -14.485  11.596  -7.894
  156    HG   SER  20           HG       SER  20 -12.728  12.517  -6.084
  157    H    SER  21           H        SER  21 -12.511   8.220  -7.721
  158    HA   SER  21           HA       SER  21 -14.104   7.699 -10.074
  159    HB2  SER  21          1HB       SER  21 -11.464   6.522  -9.185
  160    HB3  SER  21          2HB       SER  21 -12.177   6.359 -10.791
  161    HG   SER  21           HG       SER  21 -11.168   8.687  -9.524
  162    H    LEU  22           H        LEU  22 -12.980   5.842  -7.244
  163    HA   LEU  22           HA       LEU  22 -14.343   3.466  -8.152
  164    HB2  LEU  22          1HB       LEU  22 -12.754   4.166  -5.703
  165    HB3  LEU  22          2HB       LEU  22 -13.579   2.613  -5.864
  166    HG   LEU  22           HG       LEU  22 -11.539   3.624  -7.837
  167   HD11  LEU  22          1HD1      LEU  22  -9.987   2.060  -6.737
  168   HD12  LEU  22          2HD1      LEU  22 -11.198   1.769  -5.485
  169   HD13  LEU  22          3HD1      LEU  22 -10.483   3.370  -5.667
  170   HD21  LEU  22          1HD2      LEU  22 -13.121   1.951  -8.664
  171   HD22  LEU  22          2HD2      LEU  22 -12.682   0.887  -7.328
  172   HD23  LEU  22          3HD2      LEU  22 -11.484   1.309  -8.552
  173    H    ASN  23           H        ASN  23 -15.596   6.153  -7.080
  174    HA   ASN  23           HA       ASN  23 -17.466   6.834  -5.999
  175    HB2  ASN  23          1HB       ASN  23 -18.359   5.016  -7.538
  176    HB3  ASN  23          2HB       ASN  23 -18.403   3.973  -6.131
  177   HD21  ASN  23          1HD2      ASN  23 -19.733   6.783  -7.659
  178   HD22  ASN  23          2HD2      ASN  23 -21.152   6.906  -6.670
  179    H    ILE  24           H        ILE  24 -15.242   6.091  -4.372
  180    HA   ILE  24           HA       ILE  24 -16.051   4.583  -2.117
  181    HB   ILE  24           HB       ILE  24 -13.931   6.726  -2.211
  182   HG12  ILE  24          1HG1      ILE  24 -13.554   5.063  -3.995
  183   HG13  ILE  24          2HG1      ILE  24 -12.333   4.944  -2.732
  184   HG21  ILE  24          1HG2      ILE  24 -14.322   4.365  -0.381
  185   HG22  ILE  24          2HG2      ILE  24 -14.517   6.068   0.036
  186   HG23  ILE  24          3HG2      ILE  24 -12.922   5.438  -0.373
  187   HD11  ILE  24          1HD1      ILE  24 -14.706   3.131  -3.098
  188   HD12  ILE  24          2HD1      ILE  24 -13.522   3.017  -1.793
  189   HD13  ILE  24          3HD1      ILE  24 -13.022   2.751  -3.463
  190    HA   PRO  25           HA       PRO  25 -18.917   7.578  -0.460
  191    HB2  PRO  25          1HB       PRO  25 -18.614   5.922   1.963
  192    HB3  PRO  25          2HB       PRO  25 -20.069   6.343   1.056
  193    HG2  PRO  25          1HG       PRO  25 -19.025   3.888   0.971
  194    HG3  PRO  25          2HG       PRO  25 -19.800   4.631  -0.440
  195    HD2  PRO  25          1HD       PRO  25 -16.894   4.261   0.158
  196    HD3  PRO  25          2HD       PRO  25 -17.757   4.153  -1.398
  197    H    ALA  26           H        ALA  26 -18.772   9.341   0.747
  198    HA   ALA  26           HA       ALA  26 -16.331  10.421   1.499
  199    HB1  ALA  26          1HB       ALA  26 -19.054  11.168   2.545
  200    HB2  ALA  26          2HB       ALA  26 -18.361  11.715   1.018
  201    HB3  ALA  26          3HB       ALA  26 -17.615  12.190   2.545
  202    H    ASP  27           H        ASP  27 -18.660   8.617   3.411
  203    HA   ASP  27           HA       ASP  27 -17.723   9.036   5.976
  204    HB2  ASP  27          1HB       ASP  27 -19.720   7.767   5.574
  205    HB3  ASP  27          2HB       ASP  27 -18.812   6.508   4.741
  206    H    TYR  28           H        TYR  28 -16.603   6.602   3.628
  207    HA   TYR  28           HA       TYR  28 -14.604   5.525   5.266
  208    HB2  TYR  28          1HB       TYR  28 -15.133   5.477   2.324
  209    HB3  TYR  28          2HB       TYR  28 -13.646   4.774   2.964
  210    HD1  TYR  28           HD1      TYR  28 -13.691   2.681   4.145
  211    HD2  TYR  28           HD2      TYR  28 -17.331   4.569   3.001
  212    HE1  TYR  28           HE1      TYR  28 -14.925   0.638   4.724
  213    HE2  TYR  28           HE2      TYR  28 -18.575   2.524   3.572
  214    HH   TYR  28           HH       TYR  28 -17.213  -0.002   5.373
  215    H    VAL  29           H        VAL  29 -14.625   8.231   3.050
  216    HA   VAL  29           HA       VAL  29 -11.876   8.678   2.817
  217    HB   VAL  29           HB       VAL  29 -14.080  10.730   2.803
  218   HG11  VAL  29          1HG1      VAL  29 -11.274  10.793   1.713
  219   HG12  VAL  29          2HG1      VAL  29 -11.914  11.770   3.034
  220   HG13  VAL  29          3HG1      VAL  29 -12.507  12.014   1.391
  221   HG21  VAL  29          1HG2      VAL  29 -14.536   8.988   1.211
  222   HG22  VAL  29          2HG2      VAL  29 -12.886   9.073   0.597
  223   HG23  VAL  29          3HG2      VAL  29 -13.990  10.428   0.352
  224    H    GLU  30           H        GLU  30 -14.224   9.886   5.205
  225    HA   GLU  30           HA       GLU  30 -12.461  11.493   6.706
  226    HB2  GLU  30          1HB       GLU  30 -14.708   9.946   7.963
  227    HB3  GLU  30          2HB       GLU  30 -14.085  11.538   8.374
  228    HG2  GLU  30          1HG       GLU  30 -14.935  12.372   6.211
  229    HG3  GLU  30          2HG       GLU  30 -15.701  10.807   5.962
  230    H    LYS  31           H        LYS  31 -13.064   8.048   6.741
  231    HA   LYS  31           HA       LYS  31 -11.627   7.437   9.096
  232    HB2  LYS  31          1HB       LYS  31 -12.073   5.718   6.648
  233    HB3  LYS  31          2HB       LYS  31 -11.495   5.148   8.218
  234    HG2  LYS  31          1HG       LYS  31 -13.624   5.867   9.228
  235    HG3  LYS  31          2HG       LYS  31 -14.197   6.341   7.629
  236    HD2  LYS  31          1HD       LYS  31 -13.777   3.974   6.884
  237    HD3  LYS  31          2HD       LYS  31 -13.463   3.575   8.584
  238    HE2  LYS  31          1HE       LYS  31 -16.026   4.834   7.611
  239    HE3  LYS  31          2HE       LYS  31 -15.805   3.094   7.795
  240    HZ1  LYS  31          1HZ       LYS  31 -15.496   5.082   9.977
  241    HZ2  LYS  31          2HZ       LYS  31 -15.407   3.402  10.132
  242    HZ3  LYS  31          3HZ       LYS  31 -16.873   4.138   9.721
  243    H    PHE  32           H        PHE  32 -10.684   7.304   5.668
  244    HA   PHE  32           HA       PHE  32  -8.037   6.524   6.036
  245    HB2  PHE  32          1HB       PHE  32  -9.123   8.240   3.802
  246    HB3  PHE  32          2HB       PHE  32  -7.644   7.286   3.762
  247    HD1  PHE  32           HD1      PHE  32  -8.583   4.784   5.030
  248    HD2  PHE  32           HD2      PHE  32 -10.417   7.273   2.107
  249    HE1  PHE  32           HE1      PHE  32  -9.832   2.852   4.174
  250    HE2  PHE  32           HE2      PHE  32 -11.673   5.341   1.248
  251    HZ   PHE  32           HZ       PHE  32 -11.380   3.122   2.277
  252    H    LYS  33           H        LYS  33  -9.503   9.689   6.205
  253    HA   LYS  33           HA       LYS  33  -7.249  11.324   6.104
  254    HB2  LYS  33          1HB       LYS  33  -9.702  12.024   6.217
  255    HB3  LYS  33          2HB       LYS  33  -9.582  11.776   7.959
  256    HG2  LYS  33          1HG       LYS  33  -7.828  13.435   8.114
  257    HG3  LYS  33          2HG       LYS  33  -7.872  13.667   6.360
  258    HD2  LYS  33          1HD       LYS  33  -9.101  15.445   7.445
  259    HD3  LYS  33          2HD       LYS  33 -10.223  14.413   6.561
  260    HE2  LYS  33          1HE       LYS  33 -10.833  13.280   8.630
  261    HE3  LYS  33          2HE       LYS  33  -9.681  14.270   9.524
  262    HZ1  LYS  33          1HZ       LYS  33 -11.902  15.132   9.767
  263    HZ2  LYS  33          2HZ       LYS  33 -12.090  15.249   8.093
  264    HZ3  LYS  33          3HZ       LYS  33 -10.967  16.231   8.887
  265    H    LYS  34           H        LYS  34  -8.545   9.403   8.765
  266    HA   LYS  34           HA       LYS  34  -6.334  10.325  10.488
  267    HB2  LYS  34          1HB       LYS  34  -7.665   9.871  12.352
  268    HB3  LYS  34          2HB       LYS  34  -8.815  10.470  11.185
  269    HG2  LYS  34          1HG       LYS  34  -9.557   8.236  10.655
  270    HG3  LYS  34          2HG       LYS  34  -8.364   7.556  11.763
  271    HD2  LYS  34          1HD       LYS  34 -10.546   7.619  12.822
  272    HD3  LYS  34          2HD       LYS  34  -9.447   8.735  13.627
  273    HE2  LYS  34          1HE       LYS  34 -11.653   9.734  13.337
  274    HE3  LYS  34          2HE       LYS  34 -10.438  10.606  12.409
  275    HZ1  LYS  34          1HZ       LYS  34 -12.301   8.580  11.297
  276    HZ2  LYS  34          2HZ       LYS  34 -11.187   9.498  10.416
  277    HZ3  LYS  34          3HZ       LYS  34 -12.498  10.254  11.166
  278    H    TRP  35           H        TRP  35  -6.017   8.439   8.319
  279    HA   TRP  35           HA       TRP  35  -5.177   6.406   7.788
  280    HB2  TRP  35          1HB       TRP  35  -3.918   6.888  10.483
  281    HB3  TRP  35          2HB       TRP  35  -3.449   5.550   9.428
  282    HD1  TRP  35           HD1      TRP  35  -3.385   9.395   9.584
  283    HE1  TRP  35           HE1      TRP  35  -1.546  10.256   8.002
  284    HE3  TRP  35           HE3      TRP  35  -2.055   4.963   7.395
  285    HZ2  TRP  35           HZ2      TRP  35   0.226   9.199   6.085
  286    HZ3  TRP  35           HZ3      TRP  35  -0.285   4.980   5.694
  287    HH2  TRP  35           HH2      TRP  35   0.839   7.046   5.051
  288    H    GLU  36           H        GLU  36  -7.715   6.044   8.511
  289    HA   GLU  36           HA       GLU  36  -7.658   3.575  10.100
  290    HB2  GLU  36          1HB       GLU  36  -9.093   5.418  10.986
  291    HB3  GLU  36          2HB       GLU  36 -10.041   5.317   9.513
  292    HG2  GLU  36          1HG       GLU  36 -11.155   4.118  11.260
  293    HG3  GLU  36          2HG       GLU  36 -10.574   2.987  10.041
  294    H    PHE  37           H        PHE  37  -7.596   1.880   8.819
  295    HA   PHE  37           HA       PHE  37  -9.046   1.975   6.252
  296    HB2  PHE  37          1HB       PHE  37  -6.649   0.261   6.963
  297    HB3  PHE  37          2HB       PHE  37  -7.413   0.379   5.382
  298    HD1  PHE  37           HD1      PHE  37  -5.453   2.239   7.904
  299    HD2  PHE  37           HD2      PHE  37  -6.829   2.110   3.876
  300    HE1  PHE  37           HE1      PHE  37  -3.938   4.089   7.328
  301    HE2  PHE  37           HE2      PHE  37  -5.323   3.963   3.302
  302    HZ   PHE  37           HZ       PHE  37  -3.873   4.954   5.023
  303    HA   PRO  38           HA       PRO  38 -11.443  -1.236   8.489
  304    HB2  PRO  38          1HB       PRO  38 -13.228  -0.732   6.188
  305    HB3  PRO  38          2HB       PRO  38 -13.591  -0.754   7.924
  306    HG2  PRO  38          1HG       PRO  38 -13.531   1.547   6.582
  307    HG3  PRO  38          2HG       PRO  38 -12.891   1.431   8.230
  308    HD2  PRO  38          1HD       PRO  38 -11.384   1.437   5.626
  309    HD3  PRO  38          2HD       PRO  38 -11.022   2.307   7.148
  310    H    GLU  39           H        GLU  39 -11.547  -3.361   8.047
  311    HA   GLU  39           HA       GLU  39 -10.296  -4.285   5.623
  312    HB2  GLU  39          1HB       GLU  39  -9.823  -5.264   7.879
  313    HB3  GLU  39          2HB       GLU  39 -11.448  -5.930   7.879
  314    HG2  GLU  39          1HG       GLU  39 -10.945  -7.352   6.040
  315    HG3  GLU  39          2HG       GLU  39  -9.401  -6.548   5.763
  316    H    ASP  40           H        ASP  40 -11.786  -3.608   4.126
  317    HA   ASP  40           HA       ASP  40 -14.179  -5.209   3.747
  318    HB2  ASP  40          1HB       ASP  40 -15.074  -3.456   5.191
  319    HB3  ASP  40          2HB       ASP  40 -14.320  -2.208   4.203
  320    H    ASP  41           H        ASP  41 -14.896  -5.153   1.624
  321    HA   ASP  41           HA       ASP  41 -12.847  -5.129  -0.234
  322    HB2  ASP  41          1HB       ASP  41 -14.519  -5.522  -1.948
  323    HB3  ASP  41          2HB       ASP  41 -14.920  -6.443  -0.505
  324    H    THR  42           H        THR  42 -14.997  -2.527   0.630
  325    HA   THR  42           HA       THR  42 -14.662  -0.800  -1.533
  326    HB   THR  42           HB       THR  42 -14.770  -0.006   1.378
  327    HG1  THR  42           HG1      THR  42 -16.514  -1.308   1.116
  328   HG21  THR  42          1HG2      THR  42 -14.294   1.837  -0.111
  329   HG22  THR  42          2HG2      THR  42 -15.948   1.970   0.488
  330   HG23  THR  42          3HG2      THR  42 -15.646   1.383  -1.148
  331    H    THR  43           H        THR  43 -12.799  -0.952   1.483
  332    HA   THR  43           HA       THR  43 -10.879   0.973   0.821
  333    HB   THR  43           HB       THR  43 -10.453  -1.361   2.685
  334    HG1  THR  43           HG1      THR  43 -11.366   0.210   4.258
  335   HG21  THR  43          1HG2      THR  43  -9.138   0.352   3.957
  336   HG22  THR  43          2HG2      THR  43  -9.375   1.461   2.604
  337   HG23  THR  43          3HG2      THR  43  -8.466  -0.029   2.368
  338    H    MET  44           H        MET  44 -11.010  -2.507   0.256
  339    HA   MET  44           HA       MET  44  -8.353  -3.006  -0.398
  340    HB2  MET  44          1HB       MET  44 -10.925  -4.253  -1.289
  341    HB3  MET  44          2HB       MET  44  -9.409  -4.769  -1.989
  342    HG2  MET  44          1HG       MET  44 -10.151  -6.221  -0.176
  343    HG3  MET  44          2HG       MET  44  -8.591  -5.486   0.151
  344    HE1  MET  44          1HE       MET  44 -10.752  -6.954   2.108
  345    HE2  MET  44          2HE       MET  44 -10.697  -5.964   3.563
  346    HE3  MET  44          3HE       MET  44  -9.197  -6.451   2.774
  347    H    CYS  45           H        CYS  45 -10.993  -2.277  -2.701
  348    HA   CYS  45           HA       CYS  45  -9.259  -2.142  -4.929
  349    HB2  CYS  45          1HB       CYS  45 -12.035  -1.005  -4.545
  350    HB3  CYS  45          2HB       CYS  45 -11.169  -0.984  -6.075
  351    H    TYR  46           H        TYR  46 -10.328   0.250  -2.608
  352    HA   TYR  46           HA       TYR  46  -9.470   2.549  -3.929
  353    HB2  TYR  46          1HB       TYR  46 -10.806   2.869  -2.028
  354    HB3  TYR  46          2HB       TYR  46  -9.788   1.835  -1.026
  355    HD1  TYR  46           HD1      TYR  46  -9.636   5.032  -2.957
  356    HD2  TYR  46           HD2      TYR  46  -8.298   2.835   0.436
  357    HE1  TYR  46           HE1      TYR  46  -8.447   7.015  -2.142
  358    HE2  TYR  46           HE2      TYR  46  -7.105   4.821   1.255
  359    HH   TYR  46           HH       TYR  46  -6.213   6.889   0.483
  360    H    ILE  47           H        ILE  47  -7.774   0.456  -1.626
  361    HA   ILE  47           HA       ILE  47  -5.320   1.780  -1.655
  362    HB   ILE  47           HB       ILE  47  -5.985  -1.106  -1.120
  363   HG12  ILE  47          1HG1      ILE  47  -6.908   0.475   0.494
  364   HG13  ILE  47          2HG1      ILE  47  -5.609  -0.450   1.242
  365   HG21  ILE  47          1HG2      ILE  47  -3.730  -1.270  -0.082
  366   HG22  ILE  47          2HG2      ILE  47  -3.338   0.299  -0.787
  367   HG23  ILE  47          3HG2      ILE  47  -3.693  -1.074  -1.836
  368   HD11  ILE  47          1HD1      ILE  47  -4.103   1.526   0.734
  369   HD12  ILE  47          2HD1      ILE  47  -5.343   1.767   1.963
  370   HD13  ILE  47          3HD1      ILE  47  -5.578   2.415   0.340
  371    H    LYS  48           H        LYS  48  -6.628  -0.715  -3.800
  372    HA   LYS  48           HA       LYS  48  -4.223  -1.307  -5.120
  373    HB2  LYS  48          1HB       LYS  48  -6.400  -2.616  -5.273
  374    HB3  LYS  48          2HB       LYS  48  -6.937  -1.408  -6.432
  375    HG2  LYS  48          1HG       LYS  48  -4.852  -1.929  -7.757
  376    HG3  LYS  48          2HG       LYS  48  -4.619  -3.304  -6.683
  377    HD2  LYS  48          1HD       LYS  48  -5.713  -4.190  -8.548
  378    HD3  LYS  48          2HD       LYS  48  -6.988  -3.995  -7.343
  379    HE2  LYS  48          1HE       LYS  48  -7.783  -2.012  -8.399
  380    HE3  LYS  48          2HE       LYS  48  -6.384  -1.950  -9.469
  381    HZ1  LYS  48          1HZ       LYS  48  -8.503  -4.029  -9.486
  382    HZ2  LYS  48          2HZ       LYS  48  -7.138  -4.025 -10.490
  383    HZ3  LYS  48          3HZ       LYS  48  -8.302  -2.800 -10.630
  384    H    CYS  49           H        CYS  49  -6.866   0.921  -5.966
  385    HA   CYS  49           HA       CYS  49  -5.787   1.944  -8.307
  386    HB2  CYS  49          1HB       CYS  49  -8.042   2.429  -7.768
  387    HB3  CYS  49          2HB       CYS  49  -7.606   3.236  -6.265
  388    H    VAL  50           H        VAL  50  -5.403   3.157  -4.974
  389    HA   VAL  50           HA       VAL  50  -3.838   5.378  -5.622
  390    HB   VAL  50           HB       VAL  50  -4.120   3.808  -3.070
  391   HG11  VAL  50          1HG1      VAL  50  -2.651   6.404  -3.523
  392   HG12  VAL  50          2HG1      VAL  50  -1.935   4.866  -3.035
  393   HG13  VAL  50          3HG1      VAL  50  -3.035   5.712  -1.950
  394   HG21  VAL  50          1HG2      VAL  50  -5.166   6.481  -3.964
  395   HG22  VAL  50          2HG2      VAL  50  -5.430   5.753  -2.378
  396   HG23  VAL  50          3HG2      VAL  50  -6.096   4.990  -3.822
  397    H    PHE  51           H        PHE  51  -2.936   2.125  -4.551
  398    HA   PHE  51           HA       PHE  51  -0.165   2.538  -4.507
  399    HB2  PHE  51          1HB       PHE  51  -1.987   0.200  -4.489
  400    HB3  PHE  51          2HB       PHE  51  -0.326  -0.111  -4.975
  401    HD1  PHE  51           HD1      PHE  51   0.171  -1.498  -3.100
  402    HD2  PHE  51           HD2      PHE  51  -1.227   2.481  -2.529
  403    HE1  PHE  51           HE1      PHE  51   0.813  -1.616  -0.730
  404    HE2  PHE  51           HE2      PHE  51  -0.583   2.367  -0.159
  405    HZ   PHE  51           HZ       PHE  51   0.437   0.320   0.743
  406    H    ASN  52           H        ASN  52  -2.389   1.844  -7.073
  407    HA   ASN  52           HA       ASN  52  -0.384   1.108  -9.002
  408    HB2  ASN  52          1HB       ASN  52  -2.734   0.316  -9.162
  409    HB3  ASN  52          2HB       ASN  52  -3.256   1.983  -9.433
  410   HD21  ASN  52          1HD2      ASN  52  -0.368   0.429 -10.737
  411   HD22  ASN  52          2HD2      ASN  52  -0.847   0.535 -12.396
  412    H    LYS  53           H        LYS  53  -2.157   3.980  -8.085
  413    HA   LYS  53           HA       LYS  53  -1.341   5.660 -10.203
  414    HB2  LYS  53          1HB       LYS  53  -2.420   6.131  -7.445
  415    HB3  LYS  53          2HB       LYS  53  -1.921   7.488  -8.444
  416    HG2  LYS  53          1HG       LYS  53  -3.999   5.437  -9.208
  417    HG3  LYS  53          2HG       LYS  53  -4.351   7.022  -8.521
  418    HD2  LYS  53          1HD       LYS  53  -3.324   8.098 -10.452
  419    HD3  LYS  53          2HD       LYS  53  -2.915   6.518 -11.127
  420    HE2  LYS  53          1HE       LYS  53  -5.246   5.957 -11.341
  421    HE3  LYS  53          2HE       LYS  53  -5.716   7.445 -10.522
  422    HZ1  LYS  53          1HZ       LYS  53  -5.943   7.608 -12.928
  423    HZ2  LYS  53          2HZ       LYS  53  -4.292   7.308 -13.122
  424    HZ3  LYS  53          3HZ       LYS  53  -4.809   8.715 -12.340
  425    H    MET  54           H        MET  54   0.123   4.690  -7.219
  426    HA   MET  54           HA       MET  54   2.213   6.706  -7.396
  427    HB2  MET  54          1HB       MET  54   1.678   4.519  -5.377
  428    HB3  MET  54          2HB       MET  54   3.014   5.660  -5.274
  429    HG2  MET  54          1HG       MET  54   1.575   7.471  -4.926
  430    HG3  MET  54          2HG       MET  54   0.165   6.561  -5.449
  431    HE1  MET  54          1HE       MET  54   2.602   7.449  -2.654
  432    HE2  MET  54          2HE       MET  54   3.088   5.760  -2.782
  433    HE3  MET  54          3HE       MET  54   2.226   6.327  -1.352
  434    H    GLN  55           H        GLN  55   1.656   4.085  -9.068
  435    HA   GLN  55           HA       GLN  55   2.756   2.408 -10.066
  436    HB2  GLN  55          1HB       GLN  55   4.735   4.621  -9.951
  437    HB3  GLN  55          2HB       GLN  55   5.282   3.053 -10.542
  438    HG2  GLN  55          1HG       GLN  55   2.857   4.430 -11.641
  439    HG3  GLN  55          2HG       GLN  55   4.471   4.774 -12.238
  440   HE21  GLN  55          1HE2      GLN  55   3.554   1.552 -11.214
  441   HE22  GLN  55          2HE2      GLN  55   3.519   0.852 -12.790
  442    H    LEU  56           H        LEU  56   2.422   1.770  -7.539
  443    HA   LEU  56           HA       LEU  56   5.003   0.781  -6.583
  444    HB2  LEU  56          1HB       LEU  56   2.786   2.169  -5.253
  445    HB3  LEU  56          2HB       LEU  56   3.392   0.770  -4.353
  446    HG   LEU  56           HG       LEU  56   5.019   3.125  -5.314
  447   HD11  LEU  56          1HD1      LEU  56   4.109   2.394  -2.537
  448   HD12  LEU  56          2HD1      LEU  56   3.453   3.702  -3.514
  449   HD13  LEU  56          3HD1      LEU  56   5.130   3.761  -2.973
  450   HD21  LEU  56          1HD2      LEU  56   6.720   2.141  -3.758
  451   HD22  LEU  56          2HD2      LEU  56   6.430   1.214  -5.229
  452   HD23  LEU  56          3HD2      LEU  56   5.720   0.691  -3.700
  453    H    PHE  57           H        PHE  57   1.821   0.049  -7.531
  454    HA   PHE  57           HA       PHE  57   2.307  -2.799  -7.111
  455    HB2  PHE  57          1HB       PHE  57   0.846  -2.198  -5.252
  456    HB3  PHE  57          2HB       PHE  57  -0.237  -1.340  -6.338
  457    HD1  PHE  57           HD1      PHE  57  -1.824  -2.522  -7.712
  458    HD2  PHE  57           HD2      PHE  57   0.855  -4.632  -5.162
  459    HE1  PHE  57           HE1      PHE  57  -3.175  -4.559  -7.983
  460    HE2  PHE  57           HE2      PHE  57  -0.492  -6.672  -5.434
  461    HZ   PHE  57           HZ       PHE  57  -2.509  -6.635  -6.845
  462    H    ASP  58           H        ASP  58   1.653  -4.014  -8.791
  463    HA   ASP  58           HA       ASP  58   0.213  -2.639 -10.962
  464    HB2  ASP  58          1HB       ASP  58   2.522  -3.158 -11.602
  465    HB3  ASP  58          2HB       ASP  58   2.284  -4.844 -11.159
  466    H    ASP  59           H        ASP  59  -1.494  -3.683 -11.891
  467    HA   ASP  59           HA       ASP  59  -2.980  -5.374 -10.186
  468    HB2  ASP  59          1HB       ASP  59  -3.947  -3.749 -11.804
  469    HB3  ASP  59          2HB       ASP  59  -3.460  -4.801 -13.115
  470    H    THR  60           H        THR  60  -0.697  -6.031 -12.655
  471    HA   THR  60           HA       THR  60  -1.547  -8.814 -12.897
  472    HB   THR  60           HB       THR  60   0.424  -7.141 -14.434
  473    HG1  THR  60           HG1      THR  60  -1.287  -6.794 -15.594
  474   HG21  THR  60          1HG2      THR  60   0.755  -9.069 -15.903
  475   HG22  THR  60          2HG2      THR  60  -0.230 -10.060 -14.827
  476   HG23  THR  60          3HG2      THR  60   1.308  -9.403 -14.263
  477    H    GLU  61           H        GLU  61   1.580  -7.093 -12.512
  478    HA   GLU  61           HA       GLU  61   2.898  -9.480 -11.647
  479    HB2  GLU  61          1HB       GLU  61   4.033  -6.716 -11.369
  480    HB3  GLU  61          2HB       GLU  61   4.869  -8.237 -11.630
  481    HG2  GLU  61          1HG       GLU  61   3.877  -8.367 -13.877
  482    HG3  GLU  61          2HG       GLU  61   3.161  -6.779 -13.620
  483    H    GLY  62           H        GLY  62   1.072  -7.152  -9.954
  484    HA2  GLY  62          1HA       GLY  62   0.548  -7.251  -7.672
  485    HA3  GLY  62          2HA       GLY  62   1.893  -8.371  -7.443
  486    HA   PRO  63           HA       PRO  63   3.222  -4.442  -5.419
  487    HB2  PRO  63          1HB       PRO  63   4.906  -6.359  -3.937
  488    HB3  PRO  63          2HB       PRO  63   3.801  -5.120  -3.325
  489    HG2  PRO  63          1HG       PRO  63   3.241  -7.754  -3.183
  490    HG3  PRO  63          2HG       PRO  63   1.987  -6.517  -3.382
  491    HD2  PRO  63          1HD       PRO  63   3.158  -8.386  -5.404
  492    HD3  PRO  63          2HD       PRO  63   1.488  -7.780  -5.253
  493    H    LEU  64           H        LEU  64   4.751  -3.309  -6.415
  494    HA   LEU  64           HA       LEU  64   6.890  -4.672  -7.836
  495    HB2  LEU  64          1HB       LEU  64   6.396  -1.699  -7.643
  496    HB3  LEU  64          2HB       LEU  64   7.374  -2.544  -8.826
  497    HG   LEU  64           HG       LEU  64   4.380  -2.834  -8.593
  498   HD11  LEU  64          1HD1      LEU  64   4.959  -0.596  -9.338
  499   HD12  LEU  64          2HD1      LEU  64   4.296  -1.540 -10.672
  500   HD13  LEU  64          3HD1      LEU  64   6.035  -1.266 -10.565
  501   HD21  LEU  64          1HD2      LEU  64   6.296  -3.781 -10.713
  502   HD22  LEU  64          2HD2      LEU  64   4.545  -4.012 -10.695
  503   HD23  LEU  64          3HD2      LEU  64   5.556  -4.798  -9.477
  504    H    VAL  65           H        VAL  65   8.189  -5.459  -6.304
  505    HA   VAL  65           HA       VAL  65   8.858  -4.466  -3.853
  506    HB   VAL  65           HB       VAL  65  10.526  -6.177  -5.677
  507   HG11  VAL  65          1HG1      VAL  65  11.711  -6.896  -3.648
  508   HG12  VAL  65          2HG1      VAL  65  10.836  -5.680  -2.717
  509   HG13  VAL  65          3HG1      VAL  65  11.959  -5.182  -3.984
  510   HG21  VAL  65          1HG2      VAL  65   9.650  -7.995  -4.233
  511   HG22  VAL  65          2HG2      VAL  65   8.410  -7.174  -5.179
  512   HG23  VAL  65          3HG2      VAL  65   8.593  -6.810  -3.464
  513    H    ASP  66           H        ASP  66  10.628  -3.904  -6.893
  514    HA   ASP  66           HA       ASP  66  12.818  -2.596  -5.739
  515    HB2  ASP  66          1HB       ASP  66  12.853  -3.431  -8.019
  516    HB3  ASP  66          2HB       ASP  66  11.653  -2.237  -8.499
  517    H    ASN  67           H        ASN  67   9.882  -1.182  -7.210
  518    HA   ASN  67           HA       ASN  67  10.532   1.486  -6.564
  519    HB2  ASN  67          1HB       ASN  67   7.895   0.159  -7.163
  520    HB3  ASN  67          2HB       ASN  67   8.041   1.878  -6.835
  521   HD21  ASN  67          1HD2      ASN  67   7.340   2.455  -8.858
  522   HD22  ASN  67          2HD2      ASN  67   8.309   2.250 -10.276
  523    H    LEU  68           H        LEU  68   8.874  -1.066  -4.858
  524    HA   LEU  68           HA       LEU  68   7.800   0.404  -2.743
  525    HB2  LEU  68          1HB       LEU  68   8.621  -2.443  -3.109
  526    HB3  LEU  68          2HB       LEU  68   8.169  -1.875  -1.509
  527    HG   LEU  68           HG       LEU  68   6.372  -1.493  -3.889
  528   HD11  LEU  68          1HD1      LEU  68   5.183  -3.504  -3.211
  529   HD12  LEU  68          2HD1      LEU  68   6.394  -3.814  -1.964
  530   HD13  LEU  68          3HD1      LEU  68   6.843  -3.883  -3.668
  531   HD21  LEU  68          1HD2      LEU  68   5.861  -1.595  -0.924
  532   HD22  LEU  68          2HD2      LEU  68   4.655  -1.310  -2.181
  533   HD23  LEU  68          3HD2      LEU  68   5.939  -0.134  -1.906
  534    H    VAL  69           H        VAL  69  10.954  -1.172  -3.055
  535    HA   VAL  69           HA       VAL  69  11.955  -0.352  -0.534
  536    HB   VAL  69           HB       VAL  69  13.447  -1.062  -3.053
  537   HG11  VAL  69          1HG1      VAL  69  14.896   0.146  -1.567
  538   HG12  VAL  69          2HG1      VAL  69  15.310  -1.568  -1.488
  539   HG13  VAL  69          3HG1      VAL  69  14.361  -0.824  -0.197
  540   HG21  VAL  69          1HG2      VAL  69  11.941  -2.823  -2.234
  541   HG22  VAL  69          2HG2      VAL  69  12.751  -2.757  -0.667
  542   HG23  VAL  69          3HG2      VAL  69  13.640  -3.272  -2.101
  543    H    HIS  70           H        HIS  70  12.178   1.033  -3.791
  544    HA   HIS  70           HA       HIS  70  13.961   3.115  -3.122
  545    HB2  HIS  70          1HB       HIS  70  11.954   2.840  -5.359
  546    HB3  HIS  70          2HB       HIS  70  13.066   4.199  -5.232
  547    HD1  HIS  70           HD1      HIS  70  13.681   2.993  -7.690
  548    HD2  HIS  70           HD2      HIS  70  15.008   1.172  -4.201
  549    HE1  HIS  70           HE1      HIS  70  15.550   1.472  -8.394
  550    HE2  HIS  70           HE2      HIS  70  16.223   0.262  -6.290
  551    H    GLN  71           H        GLN  71  10.553   2.763  -2.698
  552    HA   GLN  71           HA       GLN  71  10.142   5.588  -2.105
  553    HB2  GLN  71          1HB       GLN  71   8.467   3.989  -3.283
  554    HB3  GLN  71          2HB       GLN  71   8.130   3.404  -1.655
  555    HG2  GLN  71          1HG       GLN  71   6.494   5.030  -2.159
  556    HG3  GLN  71          2HG       GLN  71   7.606   5.748  -0.995
  557   HE21  GLN  71          1HE2      GLN  71   7.133   7.853  -1.568
  558   HE22  GLN  71          2HE2      GLN  71   7.605   8.534  -3.077
  559    H    LEU  72           H        LEU  72   9.596   2.508  -0.395
  560    HA   LEU  72           HA       LEU  72   9.014   3.691   2.067
  561    HB2  LEU  72          1HB       LEU  72   9.894   0.904   1.376
  562    HB3  LEU  72          2HB       LEU  72   9.505   1.389   3.013
  563    HG   LEU  72           HG       LEU  72   7.589   1.537   0.688
  564   HD11  LEU  72          1HD1      LEU  72   8.150  -0.777   1.228
  565   HD12  LEU  72          2HD1      LEU  72   6.501  -0.400   1.732
  566   HD13  LEU  72          3HD1      LEU  72   7.795  -0.477   2.929
  567   HD21  LEU  72          1HD2      LEU  72   5.907   1.771   2.527
  568   HD22  LEU  72          2HD2      LEU  72   6.988   3.151   2.342
  569   HD23  LEU  72          3HD2      LEU  72   7.250   1.994   3.649
  570    H    ALA  73           H        ALA  73  12.072   2.367   0.840
  571    HA   ALA  73           HA       ALA  73  13.463   2.736   3.298
  572    HB1  ALA  73          1HB       ALA  73  14.066   1.043   1.619
  573    HB2  ALA  73          2HB       ALA  73  15.425   2.064   2.099
  574    HB3  ALA  73          3HB       ALA  73  14.617   2.337   0.554
  575    H    HIS  74           H        HIS  74  12.170   5.134   2.399
  576    HA   HIS  74           HA       HIS  74  14.080   6.972   1.352
  577    HB2  HIS  74          1HB       HIS  74  11.643   7.355   1.169
  578    HB3  HIS  74          2HB       HIS  74  11.533   7.499   2.922
  579    HD1  HIS  74           HD1      HIS  74  11.641   9.809   3.796
  580    HD2  HIS  74           HD2      HIS  74  13.353   9.502   0.019
  581    HE1  HIS  74           HE1      HIS  74  12.238  12.153   3.132
  582    HE2  HIS  74           HE2      HIS  74  13.451  11.917   0.940
  583    H    GLY  75           H        GLY  75  15.940   6.685   2.619
  584    HA2  GLY  75          1HA       GLY  75  17.270   7.881   4.189
  585    HA3  GLY  75          2HA       GLY  75  15.833   8.139   5.167
  586    H    ARG  76           H        ARG  76  16.077   4.978   3.993
  587    HA   ARG  76           HA       ARG  76  17.321   4.069   6.490
  588    HB2  ARG  76          1HB       ARG  76  14.600   3.474   5.474
  589    HB3  ARG  76          2HB       ARG  76  15.471   2.150   6.244
  590    HG2  ARG  76          1HG       ARG  76  15.823   3.721   8.194
  591    HG3  ARG  76          2HG       ARG  76  14.644   4.787   7.427
  592    HD2  ARG  76          1HD       ARG  76  13.087   2.808   7.377
  593    HD3  ARG  76          2HD       ARG  76  14.235   1.983   8.421
  594    HE   ARG  76           HE       ARG  76  13.670   4.412   9.628
  595   HH11  ARG  76          1HH1      ARG  76  11.967   1.506   8.721
  596   HH12  ARG  76          2HH1      ARG  76  10.770   1.662   9.967
  597   HH21  ARG  76          1HH2      ARG  76  12.092   4.624  11.281
  598   HH22  ARG  76          2HH2      ARG  76  10.836   3.434  11.420
  599    H    ASP  77           H        ASP  77  17.808   1.659   6.381
  600    HA   ASP  77           HA       ASP  77  19.406   1.138   4.114
  601    HB2  ASP  77          1HB       ASP  77  19.927   0.284   6.350
  602    HB3  ASP  77          2HB       ASP  77  18.503  -0.748   6.293
  603    H    ALA  78           H        ALA  78  18.784   0.534   2.228
  604    HA   ALA  78           HA       ALA  78  16.167  -0.138   1.515
  605    HB1  ALA  78          1HB       ALA  78  17.829   0.895   0.028
  606    HB2  ALA  78          2HB       ALA  78  17.045  -0.510  -0.692
  607    HB3  ALA  78          3HB       ALA  78  18.682  -0.646  -0.051
  608    H    GLU  79           H        GLU  79  18.934  -2.181   2.232
  609    HA   GLU  79           HA       GLU  79  17.904  -4.568   1.123
  610    HB2  GLU  79          1HB       GLU  79  20.006  -4.052   3.214
  611    HB3  GLU  79          2HB       GLU  79  19.612  -5.665   2.632
  612    HG2  GLU  79          1HG       GLU  79  20.249  -5.058   0.394
  613    HG3  GLU  79          2HG       GLU  79  20.531  -3.393   0.889
  614    H    GLU  80           H        GLU  80  17.866  -3.263   4.428
  615    HA   GLU  80           HA       GLU  80  16.407  -5.330   5.636
  616    HB2  GLU  80          1HB       GLU  80  16.690  -2.404   6.205
  617    HB3  GLU  80          2HB       GLU  80  15.588  -3.395   7.149
  618    HG2  GLU  80          1HG       GLU  80  18.497  -4.011   6.799
  619    HG3  GLU  80          2HG       GLU  80  17.850  -3.084   8.146
  620    H    VAL  81           H        VAL  81  15.303  -2.324   4.126
  621    HA   VAL  81           HA       VAL  81  12.565  -2.659   4.493
  622    HB   VAL  81           HB       VAL  81  14.082  -1.199   2.338
  623   HG11  VAL  81          1HG1      VAL  81  11.831  -1.650   1.527
  624   HG12  VAL  81          2HG1      VAL  81  12.000   0.055   1.951
  625   HG13  VAL  81          3HG1      VAL  81  11.150  -1.047   3.038
  626   HG21  VAL  81          1HG2      VAL  81  13.489   0.751   3.715
  627   HG22  VAL  81          2HG2      VAL  81  14.516  -0.406   4.554
  628   HG23  VAL  81          3HG2      VAL  81  12.790  -0.339   4.911
  629    H    ARG  82           H        ARG  82  14.549  -3.519   1.656
  630    HA   ARG  82           HA       ARG  82  12.637  -4.684   0.042
  631    HB2  ARG  82          1HB       ARG  82  15.011  -4.269  -0.543
  632    HB3  ARG  82          2HB       ARG  82  15.472  -5.637   0.456
  633    HG2  ARG  82          1HG       ARG  82  14.082  -7.088  -0.988
  634    HG3  ARG  82          2HG       ARG  82  13.809  -5.699  -2.042
  635    HD2  ARG  82          1HD       ARG  82  16.229  -5.482  -2.355
  636    HD3  ARG  82          2HD       ARG  82  16.478  -6.889  -1.330
  637    HE   ARG  82           HE       ARG  82  14.785  -7.374  -3.609
  638   HH11  ARG  82          1HH1      ARG  82  18.066  -7.327  -2.389
  639   HH12  ARG  82          2HH1      ARG  82  18.666  -8.433  -3.583
  640   HH21  ARG  82          1HH2      ARG  82  15.567  -8.819  -5.191
  641   HH22  ARG  82          2HH2      ARG  82  17.236  -9.299  -5.169
  642    H    THR  83           H        THR  83  14.412  -6.071   2.743
  643    HA   THR  83           HA       THR  83  13.637  -8.745   2.389
  644    HB   THR  83           HB       THR  83  14.622  -7.171   4.756
  645    HG1  THR  83           HG1      THR  83  16.270  -7.545   3.416
  646   HG21  THR  83          1HG2      THR  83  14.945  -9.298   5.953
  647   HG22  THR  83          2HG2      THR  83  14.067 -10.140   4.676
  648   HG23  THR  83          3HG2      THR  83  13.238  -8.949   5.679
  649    H    GLU  84           H        GLU  84  12.385  -6.296   4.672
  650    HA   GLU  84           HA       GLU  84  10.307  -7.921   5.648
  651    HB2  GLU  84          1HB       GLU  84  10.605  -4.916   5.699
  652    HB3  GLU  84          2HB       GLU  84   9.387  -5.817   6.597
  653    HG2  GLU  84          1HG       GLU  84  11.234  -7.069   7.700
  654    HG3  GLU  84          2HG       GLU  84  12.369  -5.964   6.930
  655    H    VAL  85           H        VAL  85  10.389  -5.616   2.955
  656    HA   VAL  85           HA       VAL  85   7.658  -5.616   2.350
  657    HB   VAL  85           HB       VAL  85  10.098  -5.315   0.607
  658   HG11  VAL  85          1HG1      VAL  85   7.211  -5.104  -0.240
  659   HG12  VAL  85          2HG1      VAL  85   8.377  -6.308  -0.791
  660   HG13  VAL  85          3HG1      VAL  85   8.597  -4.607  -1.212
  661   HG21  VAL  85          1HG2      VAL  85   9.615  -3.501   2.139
  662   HG22  VAL  85          2HG2      VAL  85   7.961  -3.398   1.527
  663   HG23  VAL  85          3HG2      VAL  85   9.320  -2.992   0.475
  664    H    LEU  86           H        LEU  86  10.250  -7.761   1.170
  665    HA   LEU  86           HA       LEU  86   8.740  -9.347  -0.531
  666    HB2  LEU  86          1HB       LEU  86  11.204  -9.961   1.093
  667    HB3  LEU  86          2HB       LEU  86  10.513 -11.101  -0.059
  668    HG   LEU  86           HG       LEU  86  11.368  -8.324  -0.832
  669   HD11  LEU  86          1HD1      LEU  86  12.954 -10.881  -0.996
  670   HD12  LEU  86          2HD1      LEU  86  13.275  -9.542   0.107
  671   HD13  LEU  86          3HD1      LEU  86  13.439  -9.311  -1.635
  672   HD21  LEU  86          1HD2      LEU  86  10.803 -10.841  -2.386
  673   HD22  LEU  86          2HD2      LEU  86  11.450  -9.351  -3.077
  674   HD23  LEU  86          3HD2      LEU  86   9.835  -9.367  -2.368
  675    H    LYS  87           H        LYS  87   9.088  -9.507   2.950
  676    HA   LYS  87           HA       LYS  87   7.931 -12.095   3.273
  677    HB2  LYS  87          1HB       LYS  87   8.329  -9.784   5.172
  678    HB3  LYS  87          2HB       LYS  87   7.592 -11.302   5.665
  679    HG2  LYS  87          1HG       LYS  87   9.617 -12.504   5.067
  680    HG3  LYS  87          2HG       LYS  87  10.363 -10.993   4.519
  681    HD2  LYS  87          1HD       LYS  87  11.133 -11.586   6.753
  682    HD3  LYS  87          2HD       LYS  87  10.185 -10.099   6.798
  683    HE2  LYS  87          1HE       LYS  87   9.628 -11.586   8.660
  684    HE3  LYS  87          2HE       LYS  87   8.250 -11.338   7.594
  685    HZ1  LYS  87          1HZ       LYS  87   8.541 -13.663   8.294
  686    HZ2  LYS  87          2HZ       LYS  87  10.034 -13.709   7.504
  687    HZ3  LYS  87          3HZ       LYS  87   8.614 -13.479   6.617
  688    H    CYS  88           H        CYS  88   6.664  -9.033   2.567
  689    HA   CYS  88           HA       CYS  88   3.987  -9.811   3.465
  690    HB2  CYS  88          1HB       CYS  88   5.287  -7.172   2.915
  691    HB3  CYS  88          2HB       CYS  88   3.519  -7.315   2.848
  692    H    VAL  89           H        VAL  89   5.948  -9.676   0.734
  693    HA   VAL  89           HA       VAL  89   3.932  -9.222  -1.227
  694    HB   VAL  89           HB       VAL  89   6.634 -10.550  -1.453
  695   HG11  VAL  89          1HG1      VAL  89   4.692  -9.708  -3.600
  696   HG12  VAL  89          2HG1      VAL  89   5.193 -11.356  -3.225
  697   HG13  VAL  89          3HG1      VAL  89   6.357 -10.213  -3.891
  698   HG21  VAL  89          1HG2      VAL  89   5.668  -7.778  -2.143
  699   HG22  VAL  89          2HG2      VAL  89   7.252  -8.425  -2.571
  700   HG23  VAL  89          3HG2      VAL  89   6.814  -8.220  -0.876
  701    H    ASP  90           H        ASP  90   2.223 -10.474  -1.052
  702    HA   ASP  90           HA       ASP  90   2.560 -13.375  -0.800
  703    HB2  ASP  90          1HB       ASP  90   1.121 -12.021   0.843
  704    HB3  ASP  90          2HB       ASP  90  -0.010 -11.820  -0.496
  705    H    LYS  91           H        LYS  91   0.617 -14.540  -1.998
  706    HA   LYS  91           HA       LYS  91   0.759 -13.616  -4.788
  707    HB2  LYS  91          1HB       LYS  91  -0.062 -16.352  -3.825
  708    HB3  LYS  91          2HB       LYS  91   0.432 -15.871  -5.444
  709    HG2  LYS  91          1HG       LYS  91   2.207 -15.939  -3.029
  710    HG3  LYS  91          2HG       LYS  91   2.170 -17.131  -4.326
  711    HD2  LYS  91          1HD       LYS  91   2.942 -15.523  -5.922
  712    HD3  LYS  91          2HD       LYS  91   2.770 -14.209  -4.757
  713    HE2  LYS  91          1HE       LYS  91   5.107 -14.873  -5.017
  714    HE3  LYS  91          2HE       LYS  91   4.528 -15.182  -3.381
  715    HZ1  LYS  91          1HZ       LYS  91   4.260 -17.504  -3.933
  716    HZ2  LYS  91          2HZ       LYS  91   5.848 -17.017  -4.257
  717    HZ3  LYS  91          3HZ       LYS  91   4.752 -17.220  -5.528
  718    H    ASN  92           H        ASN  92  -1.121 -13.947  -6.142
  719    HA   ASN  92           HA       ASN  92  -3.498 -12.926  -4.874
  720    HB2  ASN  92          1HB       ASN  92  -2.671 -12.187  -7.128
  721    HB3  ASN  92          2HB       ASN  92  -3.098 -13.777  -7.745
  722   HD21  ASN  92          1HD2      ASN  92  -4.446 -12.646  -9.227
  723   HD22  ASN  92          2HD2      ASN  92  -6.019 -12.109  -8.742
  724    H    THR  93           H        THR  93  -3.492 -14.969  -3.527
  725    HA   THR  93           HA       THR  93  -4.238 -17.455  -4.664
  726    HB   THR  93           HB       THR  93  -4.797 -18.086  -2.315
  727    HG1  THR  93           HG1      THR  93  -5.522 -16.059  -1.528
  728   HG21  THR  93          1HG2      THR  93  -2.522 -18.313  -3.148
  729   HG22  THR  93          2HG2      THR  93  -2.525 -17.852  -1.447
  730   HG23  THR  93          3HG2      THR  93  -2.173 -16.647  -2.684
  731    H    ASP  94           H        ASP  94  -6.070 -14.730  -3.446
  732    HA   ASP  94           HA       ASP  94  -8.532 -16.259  -3.388
  733    HB2  ASP  94          1HB       ASP  94  -7.945 -13.370  -2.715
  734    HB3  ASP  94          2HB       ASP  94  -9.535 -14.127  -2.555
  735    H    ASN  95           H        ASN  95  -6.819 -14.606  -5.679
  736    HA   ASN  95           HA       ASN  95  -7.209 -14.155  -7.849
  737    HB2  ASN  95          1HB       ASN  95  -9.752 -15.632  -7.250
  738    HB3  ASN  95          2HB       ASN  95  -9.428 -14.950  -8.832
  739   HD21  ASN  95          1HD2      ASN  95  -6.910 -16.303  -6.805
  740   HD22  ASN  95          2HD2      ASN  95  -6.613 -17.696  -7.796
  741    H    ASN  96           H        ASN  96  -7.784 -12.118  -5.904
  742    HA   ASN  96           HA       ASN  96  -9.368 -10.435  -7.692
  743    HB2  ASN  96          1HB       ASN  96  -9.880  -9.525  -5.021
  744    HB3  ASN  96          2HB       ASN  96 -11.035 -10.034  -6.246
  745   HD21  ASN  96          1HD2      ASN  96 -11.941 -12.044  -6.118
  746   HD22  ASN  96          2HD2      ASN  96 -11.732 -13.085  -4.753
  747    H    ALA  97           H        ALA  97  -8.267  -8.679  -8.178
  748    HA   ALA  97           HA       ALA  97  -5.655  -8.290  -7.203
  749    HB1  ALA  97          1HB       ALA  97  -5.578  -6.360  -8.657
  750    HB2  ALA  97          2HB       ALA  97  -7.332  -6.393  -8.830
  751    HB3  ALA  97          3HB       ALA  97  -6.359  -7.713  -9.475
  752    H    CYS  98           H        CYS  98  -8.701  -6.657  -6.443
  753    HA   CYS  98           HA       CYS  98  -7.591  -4.547  -4.909
  754    HB2  CYS  98          1HB       CYS  98 -10.277  -5.903  -4.557
  755    HB3  CYS  98          2HB       CYS  98  -9.810  -4.346  -3.884
  756    H    HIS  99           H        HIS  99  -8.440  -7.863  -4.163
  757    HA   HIS  99           HA       HIS  99  -8.131  -7.594  -1.319
  758    HB2  HIS  99          1HB       HIS  99  -9.536  -9.308  -2.692
  759    HB3  HIS  99          2HB       HIS  99  -8.025 -10.191  -2.844
  760    HD1  HIS  99           HD1      HIS  99 -10.224 -11.632  -1.500
  761    HD2  HIS  99           HD2      HIS  99  -7.646  -9.135   0.612
  762    HE1  HIS  99           HE1      HIS  99 -10.345 -12.398   0.891
  763    HE2  HIS  99           HE2      HIS  99  -8.862 -10.809   2.165
  764    H    TRP 100           H        TRP 100  -6.143  -8.324  -4.035
  765    HA   TRP 100           HA       TRP 100  -4.021  -9.618  -2.641
  766    HB2  TRP 100          1HB       TRP 100  -4.513  -9.908  -5.074
  767    HB3  TRP 100          2HB       TRP 100  -3.954  -8.259  -5.351
  768    HD1  TRP 100           HD1      TRP 100  -1.763  -9.855  -2.846
  769    HE1  TRP 100           HE1      TRP 100   0.406 -10.693  -3.942
  770    HE3  TRP 100           HE3      TRP 100  -3.134  -9.476  -7.758
  771    HZ2  TRP 100           HZ2      TRP 100   1.402 -11.143  -6.540
  772    HZ3  TRP 100           HZ3      TRP 100  -1.516 -10.132  -9.487
  773    HH2  TRP 100           HH2      TRP 100   0.704 -10.950  -8.897
  774    H    ALA 101           H        ALA 101  -4.375  -6.369  -4.061
  775    HA   ALA 101           HA       ALA 101  -1.901  -5.360  -3.212
  776    HB1  ALA 101          1HB       ALA 101  -4.463  -3.881  -3.780
  777    HB2  ALA 101          2HB       ALA 101  -3.213  -4.297  -4.950
  778    HB3  ALA 101          3HB       ALA 101  -2.864  -3.149  -3.658
  779    H    PHE 102           H        PHE 102  -5.067  -5.398  -1.675
  780    HA   PHE 102           HA       PHE 102  -4.389  -3.697   0.458
  781    HB2  PHE 102          1HB       PHE 102  -6.708  -4.173  -0.190
  782    HB3  PHE 102          2HB       PHE 102  -6.532  -5.827   0.393
  783    HD1  PHE 102           HD1      PHE 102  -6.880  -6.320   2.680
  784    HD2  PHE 102           HD2      PHE 102  -6.457  -2.277   1.422
  785    HE1  PHE 102           HE1      PHE 102  -7.560  -5.555   4.917
  786    HE2  PHE 102           HE2      PHE 102  -7.129  -1.507   3.660
  787    HZ   PHE 102           HZ       PHE 102  -7.682  -3.145   5.410
  788    H    ARG 103           H        ARG 103  -3.922  -7.088  -0.132
  789    HA   ARG 103           HA       ARG 103  -3.437  -7.917   2.538
  790    HB2  ARG 103          1HB       ARG 103  -3.962  -9.492   0.698
  791    HB3  ARG 103          2HB       ARG 103  -2.406  -9.115  -0.030
  792    HG2  ARG 103          1HG       ARG 103  -1.224 -10.065   1.805
  793    HG3  ARG 103          2HG       ARG 103  -2.715 -10.261   2.722
  794    HD2  ARG 103          1HD       ARG 103  -2.110 -11.656   0.110
  795    HD3  ARG 103          2HD       ARG 103  -1.904 -12.375   1.706
  796    HE   ARG 103           HE       ARG 103  -4.492 -11.540   1.682
  797   HH11  ARG 103          1HH1      ARG 103  -2.546 -13.609  -0.381
  798   HH12  ARG 103          2HH1      ARG 103  -3.891 -14.610  -0.845
  799   HH21  ARG 103          1HH2      ARG 103  -6.238 -12.859   1.098
  800   HH22  ARG 103          2HH2      ARG 103  -6.002 -14.179  -0.012
  801    H    GLY 104           H        GLY 104  -1.331  -6.838  -0.097
  802    HA2  GLY 104          1HA       GLY 104   1.130  -7.186   1.248
  803    HA3  GLY 104          2HA       GLY 104   0.842  -6.078  -0.099
  804    H    PHE 105           H        PHE 105  -0.983  -4.354   0.947
  805    HA   PHE 105           HA       PHE 105   0.605  -2.586   2.431
  806    HB2  PHE 105          1HB       PHE 105  -1.067  -1.660   1.044
  807    HB3  PHE 105          2HB       PHE 105  -2.322  -2.657   1.759
  808    HD1  PHE 105           HD1      PHE 105  -3.889  -1.224   2.677
  809    HD2  PHE 105           HD2      PHE 105   0.254  -0.443   3.303
  810    HE1  PHE 105           HE1      PHE 105  -4.471   0.634   4.170
  811    HE2  PHE 105           HE2      PHE 105  -0.336   1.427   4.801
  812    HZ   PHE 105           HZ       PHE 105  -2.693   1.962   5.235
  813    H    LYS 106           H        LYS 106  -2.132  -4.611   3.377
  814    HA   LYS 106           HA       LYS 106  -2.365  -3.779   6.025
  815    HB2  LYS 106          1HB       LYS 106  -4.198  -4.950   5.329
  816    HB3  LYS 106          2HB       LYS 106  -3.258  -6.157   4.459
  817    HG2  LYS 106          1HG       LYS 106  -2.606  -7.087   6.699
  818    HG3  LYS 106          2HG       LYS 106  -3.785  -5.982   7.415
  819    HD2  LYS 106          1HD       LYS 106  -5.509  -6.989   5.897
  820    HD3  LYS 106          2HD       LYS 106  -4.310  -8.198   5.439
  821    HE2  LYS 106          1HE       LYS 106  -5.650  -9.170   7.139
  822    HE3  LYS 106          2HE       LYS 106  -4.105  -8.761   7.881
  823    HZ1  LYS 106          1HZ       LYS 106  -6.692  -7.348   8.159
  824    HZ2  LYS 106          2HZ       LYS 106  -5.221  -6.645   8.621
  825    HZ3  LYS 106          3HZ       LYS 106  -5.753  -8.060   9.375
  826    H    CYS 107           H        CYS 107  -0.489  -6.446   4.631
  827    HA   CYS 107           HA       CYS 107   0.400  -7.572   7.024
  828    HB2  CYS 107          1HB       CYS 107   0.627  -8.859   5.064
  829    HB3  CYS 107          2HB       CYS 107   1.505  -7.591   4.218
  830    H    PHE 108           H        PHE 108   1.793  -5.031   4.999
  831    HA   PHE 108           HA       PHE 108   4.257  -4.948   6.444
  832    HB2  PHE 108          1HB       PHE 108   3.887  -4.356   3.999
  833    HB3  PHE 108          2HB       PHE 108   3.210  -2.833   4.576
  834    HD1  PHE 108           HD1      PHE 108   6.237  -4.837   4.175
  835    HD2  PHE 108           HD2      PHE 108   4.644  -1.142   5.568
  836    HE1  PHE 108           HE1      PHE 108   8.505  -3.895   4.266
  837    HE2  PHE 108           HE2      PHE 108   6.911  -0.196   5.654
  838    HZ   PHE 108           HZ       PHE 108   8.843  -1.572   4.998
  839    H    GLN 109           H        GLN 109   1.393  -2.839   6.272
  840    HA   GLN 109           HA       GLN 109   2.375  -0.895   8.063
  841    HB2  GLN 109          1HB       GLN 109   0.118  -0.036   8.141
  842    HB3  GLN 109          2HB       GLN 109   0.561  -0.440   6.493
  843    HG2  GLN 109          1HG       GLN 109  -1.501  -1.328   6.469
  844    HG3  GLN 109          2HG       GLN 109  -0.678  -2.711   7.190
  845   HE21  GLN 109          1HE2      GLN 109  -1.169  -3.304   9.253
  846   HE22  GLN 109          2HE2      GLN 109  -2.394  -2.538  10.209
  847    H    LYS 110           H        LYS 110   1.257  -4.028   8.611
  848    HA   LYS 110           HA       LYS 110   0.075  -3.738  11.165
  849    HB2  LYS 110          1HB       LYS 110  -0.180  -5.690   9.648
  850    HB3  LYS 110          2HB       LYS 110   1.486  -6.131   9.980
  851    HG2  LYS 110          1HG       LYS 110   0.862  -6.324  12.381
  852    HG3  LYS 110          2HG       LYS 110  -0.812  -6.057  11.905
  853    HD2  LYS 110          1HD       LYS 110  -0.740  -8.029  10.478
  854    HD3  LYS 110          2HD       LYS 110   0.945  -8.297  10.919
  855    HE2  LYS 110          1HE       LYS 110  -1.386  -8.317  12.831
  856    HE3  LYS 110          2HE       LYS 110  -0.599  -9.748  12.170
  857    HZ1  LYS 110          1HZ       LYS 110   0.706  -7.698  13.877
  858    HZ2  LYS 110          2HZ       LYS 110   1.453  -9.080  13.253
  859    HZ3  LYS 110          3HZ       LYS 110   0.206  -9.232  14.385
  860    H    ASN 111           H        ASN 111   3.354  -3.746  10.067
  861    HA   ASN 111           HA       ASN 111   4.256  -3.803  12.871
  862    HB2  ASN 111          1HB       ASN 111   5.719  -5.000  10.514
  863    HB3  ASN 111          2HB       ASN 111   6.313  -4.923  12.169
  864   HD21  ASN 111          1HD2      ASN 111   4.166  -6.495   9.972
  865   HD22  ASN 111          2HD2      ASN 111   3.703  -7.783  11.022
  866    H    ASN 112           H        ASN 112   4.556  -2.415   9.685
  867    HA   ASN 112           HA       ASN 112   6.513  -0.493  10.761
  868    HB2  ASN 112          1HB       ASN 112   6.593  -1.842   8.050
  869    HB3  ASN 112          2HB       ASN 112   7.637  -0.505   8.547
  870   HD21  ASN 112          1HD2      ASN 112   8.020  -3.445   7.838
  871   HD22  ASN 112          2HD2      ASN 112   9.055  -4.036   9.098
  872    H    LEU 113           H        LEU 113   4.146   0.438  10.966
  873    HA   LEU 113           HA       LEU 113   3.120   1.552   8.514
  874    HB2  LEU 113          1HB       LEU 113   1.510   0.925  10.157
  875    HB3  LEU 113          2HB       LEU 113   2.289   1.901  11.386
  876    HG   LEU 113           HG       LEU 113   1.655   3.933  10.088
  877   HD11  LEU 113          1HD1      LEU 113   1.490   2.803   7.897
  878   HD12  LEU 113          2HD1      LEU 113   0.069   3.768   8.297
  879   HD13  LEU 113          3HD1      LEU 113   0.014   2.014   8.454
  880   HD21  LEU 113          1HD2      LEU 113  -0.685   3.888  10.722
  881   HD22  LEU 113          2HD2      LEU 113   0.294   3.097  11.958
  882   HD23  LEU 113          3HD2      LEU 113  -0.642   2.128  10.823
  883    H    SER 114           H        SER 114   5.123   2.578  11.163
  884    HA   SER 114           HA       SER 114   4.985   5.364  10.763
  885    HB2  SER 114          1HB       SER 114   7.336   5.232  11.885
  886    HB3  SER 114          2HB       SER 114   5.919   4.719  12.804
  887    HG   SER 114           HG       SER 114   7.143   2.999  13.056
  888    H    LEU 115           H        LEU 115   6.873   2.850   9.198
  889    HA   LEU 115           HA       LEU 115   8.648   4.582   7.822
  890    HB2  LEU 115          1HB       LEU 115   9.055   2.173   8.150
  891    HB3  LEU 115          2HB       LEU 115   7.725   1.815   7.065
  892    HG   LEU 115           HG       LEU 115   8.954   2.961   5.239
  893   HD11  LEU 115          1HD1      LEU 115  10.314   4.480   6.462
  894   HD12  LEU 115          2HD1      LEU 115  11.394   3.356   5.635
  895   HD13  LEU 115          3HD1      LEU 115  11.069   3.168   7.360
  896   HD21  LEU 115          1HD2      LEU 115  10.641   1.197   4.929
  897   HD22  LEU 115          2HD2      LEU 115   9.088   0.551   5.457
  898   HD23  LEU 115          3HD2      LEU 115  10.414   0.704   6.606
  899    H    ILE 116           H        ILE 116   5.465   3.304   7.170
  900    HA   ILE 116           HA       ILE 116   5.286   4.039   4.452
  901    HB   ILE 116           HB       ILE 116   3.157   3.524   6.533
  902   HG12  ILE 116          1HG1      ILE 116   4.141   1.843   4.215
  903   HG13  ILE 116          2HG1      ILE 116   4.652   1.636   5.893
  904   HG21  ILE 116          1HG2      ILE 116   1.594   3.296   4.627
  905   HG22  ILE 116          2HG2      ILE 116   2.851   3.932   3.564
  906   HG23  ILE 116          3HG2      ILE 116   2.184   4.946   4.844
  907   HD11  ILE 116          1HD1      ILE 116   2.268   1.195   6.474
  908   HD12  ILE 116          2HD1      ILE 116   2.991   0.003   5.399
  909   HD13  ILE 116          3HD1      ILE 116   1.904   1.226   4.750
  910    H    LYS 117           H        LYS 117   4.535   5.676   7.463
  911    HA   LYS 117           HA       LYS 117   3.398   8.001   6.286
  912    HB2  LYS 117          1HB       LYS 117   4.592   7.487   9.008
  913    HB3  LYS 117          2HB       LYS 117   3.847   9.015   8.554
  914    HG2  LYS 117          1HG       LYS 117   1.725   7.882   8.171
  915    HG3  LYS 117          2HG       LYS 117   2.459   6.332   8.582
  916    HD2  LYS 117          1HD       LYS 117   2.905   7.118  10.842
  917    HD3  LYS 117          2HD       LYS 117   2.253   8.708  10.442
  918    HE2  LYS 117          1HE       LYS 117   0.056   7.718  10.059
  919    HE3  LYS 117          2HE       LYS 117   0.705   6.118  10.407
  920    HZ1  LYS 117          1HZ       LYS 117   1.187   6.830  12.659
  921    HZ2  LYS 117          2HZ       LYS 117  -0.450   7.067  12.315
  922    HZ3  LYS 117          3HZ       LYS 117   0.608   8.383  12.326
  923    H    ALA 118           H        ALA 118   6.625   6.938   7.017
  924    HA   ALA 118           HA       ALA 118   7.831   9.553   6.830
  925    HB1  ALA 118          1HB       ALA 118   9.924   8.344   7.124
  926    HB2  ALA 118          2HB       ALA 118   9.065   6.813   6.937
  927    HB3  ALA 118          3HB       ALA 118   8.725   7.853   8.320
  928    H    SER 119           H        SER 119   7.368   6.791   4.722
  929    HA   SER 119           HA       SER 119   9.321   7.419   2.813
  930    HB2  SER 119          1HB       SER 119   7.980   5.909   1.322
  931    HB3  SER 119          2HB       SER 119   8.385   5.220   2.894
  932    HG   SER 119           HG       SER 119   5.920   5.978   1.867
  933    H    ILE 120           H        ILE 120   6.053   8.574   3.242
  934    HA   ILE 120           HA       ILE 120   6.136   9.982   0.689
  935    HB   ILE 120           HB       ILE 120   3.840  10.721   1.252
  936   HG12  ILE 120          1HG1      ILE 120   4.076   8.862   3.623
  937   HG13  ILE 120          2HG1      ILE 120   4.165  10.619   3.739
  938   HG21  ILE 120          1HG2      ILE 120   4.195   8.717  -0.062
  939   HG22  ILE 120          2HG2      ILE 120   2.791   8.524   0.987
  940   HG23  ILE 120          3HG2      ILE 120   4.320   7.756   1.410
  941   HD11  ILE 120          1HD1      ILE 120   1.817   9.025   2.747
  942   HD12  ILE 120          2HD1      ILE 120   1.906  10.783   2.824
  943   HD13  ILE 120          3HD1      ILE 120   1.954   9.832   4.308
  944    H    LYS 121           H        LYS 121   7.250  10.521   3.745
  945    HA   LYS 121           HA       LYS 121   6.676  13.375   3.777
  946    HB2  LYS 121          1HB       LYS 121   6.617  12.082   5.883
  947    HB3  LYS 121          2HB       LYS 121   8.310  11.669   5.667
  948    HG2  LYS 121          1HG       LYS 121   8.956  13.987   5.914
  949    HG3  LYS 121          2HG       LYS 121   7.261  14.475   5.994
  950    HD2  LYS 121          1HD       LYS 121   6.966  13.226   8.053
  951    HD3  LYS 121          2HD       LYS 121   8.621  12.632   7.955
  952    HE2  LYS 121          1HE       LYS 121   7.921  15.552   8.148
  953    HE3  LYS 121          2HE       LYS 121   8.230  14.538   9.554
  954    HZ1  LYS 121          1HZ       LYS 121  10.119  15.346   7.421
  955    HZ2  LYS 121          2HZ       LYS 121  10.428  14.014   8.420
  956    HZ3  LYS 121          3HZ       LYS 121  10.256  15.553   9.098
  957    H    LYS 122           H        LYS 122   7.905  14.673   2.588
  958    HA   LYS 122           HA       LYS 122  10.797  14.094   2.431
  959    HB2  LYS 122          1HB       LYS 122   9.042  14.465   0.301
  960    HB3  LYS 122          2HB       LYS 122   9.821  16.019   0.491
  961    HG2  LYS 122          1HG       LYS 122  12.015  14.974   0.344
  962    HG3  LYS 122          2HG       LYS 122  11.251  13.399   0.132
  963    HD2  LYS 122          1HD       LYS 122  10.374  13.998  -1.972
  964    HD3  LYS 122          2HD       LYS 122  10.698  15.713  -1.706
  965    HE2  LYS 122          1HE       LYS 122  12.805  13.571  -1.979
  966    HE3  LYS 122          2HE       LYS 122  12.294  14.656  -3.272
  967    HZ1  LYS 122          1HZ       LYS 122  13.551  15.477  -0.706
  968    HZ2  LYS 122          2HZ       LYS 122  13.027  16.535  -1.915
  969    HZ3  LYS 122          3HZ       LYS 122  14.298  15.466  -2.221
  970    H    ASP 123           H        ASP 123   8.861  15.658   4.233
  971    HA   ASP 123           HA       ASP 123   9.825  18.349   4.090
  972    HB2  ASP 123          1HB       ASP 123   7.611  17.781   5.053
  973    HB3  ASP 123          2HB       ASP 123   8.421  16.939   6.369
  974    H21  ACD 201           H21      ACD   1  -4.161   4.095   1.446
  975    H22  ACD 201           H22      ACD   1  -3.286   4.878   2.772
  976    H31  ACD 201           H31      ACD   1  -2.012   6.241   1.267
  977    H32  ACD 201           H32      ACD   1  -3.062   5.863  -0.093
  978    H41  ACD 201           H41      ACD   1  -2.305   3.488  -0.022
  979    H42  ACD 201           H42      ACD   1  -0.953   4.608  -0.271
  980    H5   ACD 201           H5       ACD   1  -1.499   2.959   2.249
  981    H6   ACD 201           H6       ACD   1   0.627   3.851   2.895
  982    H71  ACD 201           H71      ACD   1   0.903   5.057   0.220
  983    H72  ACD 201           H72      ACD   1   0.003   6.205   1.211
  984    H8   ACD 201           H8       ACD   1   1.970   6.598   2.636
  985    H9   ACD 201           H9       ACD   1   4.046   5.606   2.009
  986   H101  ACD 201          H101      ACD   1   2.920   4.687  -0.503
  987   H102  ACD 201          H102      ACD   1   2.424   3.467   0.671
  988    H11  ACD 201           H11      ACD   1   5.414   4.243   0.501
  989    H12  ACD 201           H12      ACD   1   5.659   1.894   0.242
  990   H131  ACD 201          H131      ACD   1   2.672   2.013  -0.419
  991   H132  ACD 201          H132      ACD   1   3.733   0.610  -0.577
  992    H14  ACD 201           H14      ACD   1   2.683   1.637   2.158
  993    H15  ACD 201           H15      ACD   1   2.595  -0.710   2.578
  994   H161  ACD 201          H161      ACD   1   2.731  -1.376  -0.230
  995   H162  ACD 201          H162      ACD   1   4.398  -0.955   0.182
  996   H171  ACD 201          H171      ACD   1   4.500  -2.658   1.894
  997   H172  ACD 201          H172      ACD   1   2.766  -2.963   1.779
  998   H181  ACD 201          H181      ACD   1   4.774  -3.451  -0.464
  999   H182  ACD 201          H182      ACD   1   3.043  -3.798  -0.535
 1000   H191  ACD 201          H191      ACD   1   5.068  -5.065   1.360
 1001   H192  ACD 201          H192      ACD   1   3.327  -5.351   1.439
 1002   H201  ACD 201          H201      ACD   1   3.400  -6.233  -0.880
 1003   H202  ACD 201          H202      ACD   1   4.442  -7.127   0.175
 1004   H203  ACD 201          H203      ACD   1   5.112  -5.974  -0.928
  Start of MODEL    6
    1    H1   MET   1          1H        MET   1  11.754   3.305 -15.378
    2    H2   MET   1          2H        MET   1  12.417   2.369 -14.138
    3    H3   MET   1          3H        MET   1  12.588   1.880 -15.747
    4    HA   MET   1           HA       MET   1  14.640   2.802 -14.963
    5    HB2  MET   1          1HB       MET   1  13.216   4.685 -16.858
    6    HB3  MET   1          2HB       MET   1  14.955   4.555 -16.659
    7    HG2  MET   1          1HG       MET   1  13.133   2.396 -17.687
    8    HG3  MET   1          2HG       MET   1  14.186   3.413 -18.663
    9    HE1  MET   1          1HE       MET   1  17.746   2.237 -17.567
   10    HE2  MET   1          2HE       MET   1  16.833   3.563 -16.849
   11    HE3  MET   1          3HE       MET   1  16.812   3.324 -18.594
   12    H    GLU   2           H        GLU   2  12.333   5.515 -15.209
   13    HA   GLU   2           HA       GLU   2  13.772   6.857 -13.040
   14    HB2  GLU   2          1HB       GLU   2  11.712   7.927 -14.965
   15    HB3  GLU   2          2HB       GLU   2  12.579   8.871 -13.765
   16    HG2  GLU   2          1HG       GLU   2  14.660   8.484 -14.901
   17    HG3  GLU   2          2HG       GLU   2  13.874   7.388 -16.035
   18    H    PHE   3           H        PHE   3  12.973   6.872 -11.077
   19    HA   PHE   3           HA       PHE   3  10.095   6.387 -10.729
   20    HB2  PHE   3          1HB       PHE   3  11.423   4.591  -9.792
   21    HB3  PHE   3          2HB       PHE   3  12.383   5.744  -8.862
   22    HD1  PHE   3           HD1      PHE   3   8.883   4.575  -9.322
   23    HD2  PHE   3           HD2      PHE   3  11.783   6.227  -6.688
   24    HE1  PHE   3           HE1      PHE   3   7.288   4.380  -7.455
   25    HE2  PHE   3           HE2      PHE   3  10.197   6.037  -4.814
   26    HZ   PHE   3           HZ       PHE   3   7.947   5.112  -5.197
   27    H    THR   4           H        THR   4   8.952   7.987  -9.972
   28    HA   THR   4           HA       THR   4  10.271  10.175  -8.509
   29    HB   THR   4           HB       THR   4   7.436  10.528  -9.153
   30    HG1  THR   4           HG1      THR   4   9.316  10.395 -11.306
   31   HG21  THR   4          1HG2      THR   4   8.859  12.325  -8.368
   32   HG22  THR   4          2HG2      THR   4   8.268  12.677  -9.991
   33   HG23  THR   4          3HG2      THR   4   9.923  12.116  -9.759
   34    H    VAL   5           H        VAL   5  10.114  10.110  -6.382
   35    HA   VAL   5           HA       VAL   5   8.397   8.212  -5.084
   36    HB   VAL   5           HB       VAL   5   9.497   8.630  -3.137
   37   HG11  VAL   5          1HG1      VAL   5  11.817   9.077  -3.487
   38   HG12  VAL   5          2HG1      VAL   5  11.473   9.842  -5.035
   39   HG13  VAL   5          3HG1      VAL   5  11.174   8.118  -4.818
   40   HG21  VAL   5          1HG2      VAL   5   8.691  10.888  -2.763
   41   HG22  VAL   5          2HG2      VAL   5   9.874  11.522  -3.909
   42   HG23  VAL   5          3HG2      VAL   5  10.413  10.786  -2.399
   43    H    SER   6           H        SER   6   6.524   8.469  -4.125
   44    HA   SER   6           HA       SER   6   5.022  10.834  -4.822
   45    HB2  SER   6          1HB       SER   6   3.114   9.499  -3.846
   46    HB3  SER   6          2HB       SER   6   3.954   8.719  -5.187
   47    HG   SER   6           HG       SER   6   4.947   8.178  -2.659
   48    H    THR   7           H        THR   7   5.105  12.562  -3.522
   49    HA   THR   7           HA       THR   7   5.688  12.278  -0.710
   50    HB   THR   7           HB       THR   7   5.547  14.733  -0.642
   51    HG1  THR   7           HG1      THR   7   4.809  14.452  -3.402
   52   HG21  THR   7          1HG2      THR   7   7.422  15.206  -2.153
   53   HG22  THR   7          2HG2      THR   7   7.136  13.679  -2.988
   54   HG23  THR   7          3HG2      THR   7   7.653  13.679  -1.302
   55    H    THR   8           H        THR   8   4.238  13.718   0.810
   56    HA   THR   8           HA       THR   8   1.767  12.482   1.065
   57    HB   THR   8           HB       THR   8   2.372  15.231   2.141
   58    HG1  THR   8           HG1      THR   8   3.823  13.041   2.502
   59   HG21  THR   8          1HG2      THR   8   0.713  12.922   3.153
   60   HG22  THR   8          2HG2      THR   8   0.111  14.459   2.536
   61   HG23  THR   8          3HG2      THR   8   1.016  14.411   4.047
   62    H    GLU   9           H        GLU   9   2.583  15.593  -0.421
   63    HA   GLU   9           HA       GLU   9   0.010  16.482  -0.996
   64    HB2  GLU   9          1HB       GLU   9   2.586  16.942  -2.497
   65    HB3  GLU   9          2HB       GLU   9   1.083  17.768  -2.866
   66    HG2  GLU   9          1HG       GLU   9   2.391  19.232  -1.552
   67    HG3  GLU   9          2HG       GLU   9   1.080  18.639  -0.532
   68    H    ASP  10           H        ASP  10   2.223  14.539  -2.991
   69    HA   ASP  10           HA       ASP  10   0.511  14.271  -5.205
   70    HB2  ASP  10          1HB       ASP  10   2.579  12.261  -4.288
   71    HB3  ASP  10          2HB       ASP  10   1.895  12.416  -5.903
   72    H    LEU  11           H        LEU  11   0.901  12.390  -2.260
   73    HA   LEU  11           HA       LEU  11  -0.721  10.243  -2.997
   74    HB2  LEU  11          1HB       LEU  11   0.790  10.078  -1.126
   75    HB3  LEU  11          2HB       LEU  11  -0.116  11.312  -0.239
   76    HG   LEU  11           HG       LEU  11  -2.058   9.772  -0.201
   77   HD11  LEU  11          1HD1      LEU  11  -1.777   7.456  -0.839
   78   HD12  LEU  11          2HD1      LEU  11  -0.128   7.782  -1.373
   79   HD13  LEU  11          3HD1      LEU  11  -1.492   8.507  -2.223
   80   HD21  LEU  11          1HD2      LEU  11   0.453   8.531   0.907
   81   HD22  LEU  11          2HD2      LEU  11  -1.193   8.297   1.494
   82   HD23  LEU  11          3HD2      LEU  11  -0.416   9.873   1.652
   83    H    GLN  12           H        GLN  12  -1.485  13.331  -1.458
   84    HA   GLN  12           HA       GLN  12  -4.174  12.764  -0.815
   85    HB2  GLN  12          1HB       GLN  12  -2.811  15.383  -1.432
   86    HB3  GLN  12          2HB       GLN  12  -4.469  15.261  -0.867
   87    HG2  GLN  12          1HG       GLN  12  -3.652  14.180   1.193
   88    HG3  GLN  12          2HG       GLN  12  -2.000  14.407   0.622
   89   HE21  GLN  12          1HE2      GLN  12  -3.333  15.463   3.001
   90   HE22  GLN  12          2HE2      GLN  12  -3.193  17.186   2.894
   91    H    ARG  13           H        ARG  13  -2.607  13.747  -3.747
   92    HA   ARG  13           HA       ARG  13  -4.931  14.503  -5.182
   93    HB2  ARG  13          1HB       ARG  13  -2.668  15.175  -5.853
   94    HB3  ARG  13          2HB       ARG  13  -2.263  13.501  -6.187
   95    HG2  ARG  13          1HG       ARG  13  -3.949  13.449  -7.962
   96    HG3  ARG  13          2HG       ARG  13  -4.331  15.150  -7.630
   97    HD2  ARG  13          1HD       ARG  13  -2.051  15.778  -8.191
   98    HD3  ARG  13          2HD       ARG  13  -1.640  14.087  -8.475
   99    HE   ARG  13           HE       ARG  13  -3.778  14.660 -10.130
  100   HH11  ARG  13          1HH1      ARG  13  -0.493  15.784  -9.697
  101   HH12  ARG  13          2HH1      ARG  13  -0.285  16.215 -11.364
  102   HH21  ARG  13          1HH2      ARG  13  -3.505  15.191 -12.329
  103   HH22  ARG  13          2HH2      ARG  13  -2.000  15.865 -12.868
  104    H    TYR  14           H        TYR  14  -3.058  11.483  -4.968
  105    HA   TYR  14           HA       TYR  14  -4.608  10.096  -6.886
  106    HB2  TYR  14          1HB       TYR  14  -2.854   8.981  -4.689
  107    HB3  TYR  14          2HB       TYR  14  -3.516   8.061  -6.036
  108    HD1  TYR  14           HD1      TYR  14  -0.557   9.254  -4.975
  109    HD2  TYR  14           HD2      TYR  14  -3.100   9.601  -8.366
  110    HE1  TYR  14           HE1      TYR  14   1.386   9.833  -6.367
  111    HE2  TYR  14           HE2      TYR  14  -1.165  10.168  -9.766
  112    HH   TYR  14           HH       TYR  14   2.059   9.784  -8.698
  113    H    ARG  15           H        ARG  15  -4.916  10.420  -3.373
  114    HA   ARG  15           HA       ARG  15  -6.837   8.434  -2.951
  115    HB2  ARG  15          1HB       ARG  15  -7.113  11.087  -1.580
  116    HB3  ARG  15          2HB       ARG  15  -7.436   9.489  -0.953
  117    HG2  ARG  15          1HG       ARG  15  -4.936   9.088  -0.995
  118    HG3  ARG  15          2HG       ARG  15  -4.767  10.820  -1.308
  119    HD2  ARG  15          1HD       ARG  15  -6.332  11.068   0.768
  120    HD3  ARG  15          2HD       ARG  15  -5.814   9.426   1.132
  121    HE   ARG  15           HE       ARG  15  -3.880  11.618   0.779
  122   HH11  ARG  15          1HH1      ARG  15  -5.002   8.799   2.527
  123   HH12  ARG  15          2HH1      ARG  15  -3.922   9.050   3.862
  124   HH21  ARG  15          1HH2      ARG  15  -2.436  11.925   2.541
  125   HH22  ARG  15          2HH2      ARG  15  -2.461  10.806   3.864
  126    H    THR  16           H        THR  16  -7.239  11.834  -3.814
  127    HA   THR  16           HA       THR  16 -10.028  11.906  -3.925
  128    HB   THR  16           HB       THR  16  -8.291  13.531  -5.761
  129    HG1  THR  16           HG1      THR  16  -7.191  13.964  -3.951
  130   HG21  THR  16          1HG2      THR  16  -9.912  15.280  -5.234
  131   HG22  THR  16          2HG2      THR  16 -10.755  14.178  -4.145
  132   HG23  THR  16          3HG2      THR  16 -10.709  13.845  -5.877
  133    H    GLU  17           H        GLU  17  -7.670  11.218  -6.501
  134    HA   GLU  17           HA       GLU  17  -9.587  10.995  -8.582
  135    HB2  GLU  17          1HB       GLU  17  -6.954   9.526  -8.553
  136    HB3  GLU  17          2HB       GLU  17  -7.862  10.116  -9.933
  137    HG2  GLU  17          1HG       GLU  17  -6.477  11.847  -7.902
  138    HG3  GLU  17          2HG       GLU  17  -5.917  11.500  -9.543
  139    H    CYS  18           H        CYS  18  -8.398   8.687  -6.234
  140    HA   CYS  18           HA       CYS  18  -9.722   6.481  -7.543
  141    HB2  CYS  18          1HB       CYS  18  -8.365   6.693  -4.853
  142    HB3  CYS  18          2HB       CYS  18  -9.045   5.202  -5.523
  143    H    VAL  19           H        VAL  19 -10.437   8.771  -5.033
  144    HA   VAL  19           HA       VAL  19 -12.592   7.356  -3.880
  145    HB   VAL  19           HB       VAL  19 -11.695  10.211  -3.750
  146   HG11  VAL  19          1HG1      VAL  19 -13.531  10.741  -2.251
  147   HG12  VAL  19          2HG1      VAL  19 -14.226   9.141  -2.509
  148   HG13  VAL  19          3HG1      VAL  19 -14.142  10.293  -3.846
  149   HG21  VAL  19          1HG2      VAL  19 -11.545   9.651  -1.341
  150   HG22  VAL  19          2HG2      VAL  19 -10.533   8.630  -2.361
  151   HG23  VAL  19          3HG2      VAL  19 -12.055   8.005  -1.728
  152    H    SER  20           H        SER  20 -12.426  10.005  -6.210
  153    HA   SER  20           HA       SER  20 -15.172  10.247  -6.669
  154    HB2  SER  20          1HB       SER  20 -12.832  10.873  -8.477
  155    HB3  SER  20          2HB       SER  20 -14.476  11.472  -8.707
  156    HG   SER  20           HG       SER  20 -14.280  12.495  -6.646
  157    H    SER  21           H        SER  21 -12.766   8.102  -8.141
  158    HA   SER  21           HA       SER  21 -14.553   7.354 -10.280
  159    HB2  SER  21          1HB       SER  21 -12.696   5.714 -10.825
  160    HB3  SER  21          2HB       SER  21 -12.245   7.417 -10.853
  161    HG   SER  21           HG       SER  21 -10.971   7.126  -9.185
  162    H    LEU  22           H        LEU  22 -13.251   5.760  -7.353
  163    HA   LEU  22           HA       LEU  22 -14.715   3.348  -7.947
  164    HB2  LEU  22          1HB       LEU  22 -13.041   4.159  -5.575
  165    HB3  LEU  22          2HB       LEU  22 -13.808   2.578  -5.740
  166    HG   LEU  22           HG       LEU  22 -11.738   3.706  -7.624
  167   HD11  LEU  22          1HD1      LEU  22 -11.511   1.578  -5.498
  168   HD12  LEU  22          2HD1      LEU  22 -10.819   3.197  -5.409
  169   HD13  LEU  22          3HD1      LEU  22 -10.239   2.056  -6.625
  170   HD21  LEU  22          1HD2      LEU  22 -13.263   2.190  -8.730
  171   HD22  LEU  22          2HD2      LEU  22 -13.036   0.996  -7.453
  172   HD23  LEU  22          3HD2      LEU  22 -11.692   1.419  -8.512
  173    H    ASN  23           H        ASN  23 -15.886   6.133  -7.045
  174    HA   ASN  23           HA       ASN  23 -17.676   6.911  -5.867
  175    HB2  ASN  23          1HB       ASN  23 -18.490   4.020  -6.148
  176    HB3  ASN  23          2HB       ASN  23 -19.545   5.279  -5.542
  177   HD21  ASN  23          1HD2      ASN  23 -20.306   6.861  -6.942
  178   HD22  ASN  23          2HD2      ASN  23 -20.238   6.667  -8.662
  179    H    ILE  24           H        ILE  24 -15.432   6.306  -4.293
  180    HA   ILE  24           HA       ILE  24 -16.096   4.829  -1.966
  181    HB   ILE  24           HB       ILE  24 -14.055   7.042  -2.198
  182   HG12  ILE  24          1HG1      ILE  24 -13.746   5.340  -3.984
  183   HG13  ILE  24          2HG1      ILE  24 -12.426   5.338  -2.818
  184   HG21  ILE  24          1HG2      ILE  24 -14.536   6.344   0.081
  185   HG22  ILE  24          2HG2      ILE  24 -12.918   5.836  -0.398
  186   HG23  ILE  24          3HG2      ILE  24 -14.235   4.661  -0.355
  187   HD11  ILE  24          1HD1      ILE  24 -13.385   3.364  -1.744
  188   HD12  ILE  24          2HD1      ILE  24 -13.063   3.083  -3.457
  189   HD13  ILE  24          3HD1      ILE  24 -14.712   3.380  -2.908
  190    HA   PRO  25           HA       PRO  25 -18.862   7.833  -0.107
  191    HB2  PRO  25          1HB       PRO  25 -18.333   6.241   2.311
  192    HB3  PRO  25          2HB       PRO  25 -19.865   6.612   1.516
  193    HG2  PRO  25          1HG       PRO  25 -18.774   4.171   1.417
  194    HG3  PRO  25          2HG       PRO  25 -19.700   4.852   0.068
  195    HD2  PRO  25          1HD       PRO  25 -16.741   4.551   0.380
  196    HD3  PRO  25          2HD       PRO  25 -17.752   4.388  -1.077
  197    H    ALA  26           H        ALA  26 -18.599   9.619   1.050
  198    HA   ALA  26           HA       ALA  26 -16.057  10.647   1.584
  199    HB1  ALA  26          1HB       ALA  26 -18.118  11.953   1.135
  200    HB2  ALA  26          2HB       ALA  26 -17.203  12.528   2.526
  201    HB3  ALA  26          3HB       ALA  26 -18.665  11.571   2.768
  202    H    ASP  27           H        ASP  27 -18.307   8.924   3.633
  203    HA   ASP  27           HA       ASP  27 -17.219   9.409   6.146
  204    HB2  ASP  27          1HB       ASP  27 -19.277   8.170   5.859
  205    HB3  ASP  27          2HB       ASP  27 -18.415   6.852   5.070
  206    H    TYR  28           H        TYR  28 -16.381   6.818   3.849
  207    HA   TYR  28           HA       TYR  28 -14.315   5.678   5.301
  208    HB2  TYR  28          1HB       TYR  28 -14.963   5.781   2.380
  209    HB3  TYR  28          2HB       TYR  28 -13.483   4.996   2.930
  210    HD1  TYR  28           HD1      TYR  28 -17.172   4.948   3.209
  211    HD2  TYR  28           HD2      TYR  28 -13.554   2.808   3.861
  212    HE1  TYR  28           HE1      TYR  28 -18.467   2.909   3.658
  213    HE2  TYR  28           HE2      TYR  28 -14.840   0.766   4.320
  214    HH   TYR  28           HH       TYR  28 -17.021   0.062   4.956
  215    H    VAL  29           H        VAL  29 -14.315   8.421   3.110
  216    HA   VAL  29           HA       VAL  29 -11.577   8.782   2.765
  217    HB   VAL  29           HB       VAL  29 -13.730  10.886   2.896
  218   HG11  VAL  29          1HG1      VAL  29 -12.163  12.196   1.478
  219   HG12  VAL  29          2HG1      VAL  29 -10.934  10.963   1.772
  220   HG13  VAL  29          3HG1      VAL  29 -11.565  11.919   3.113
  221   HG21  VAL  29          1HG2      VAL  29 -13.714  10.668   0.441
  222   HG22  VAL  29          2HG2      VAL  29 -14.215   9.185   1.252
  223   HG23  VAL  29          3HG2      VAL  29 -12.585   9.320   0.593
  224    H    GLU  30           H        GLU  30 -13.712   9.966   5.356
  225    HA   GLU  30           HA       GLU  30 -11.745  11.490   6.717
  226    HB2  GLU  30          1HB       GLU  30 -14.007  10.112   8.137
  227    HB3  GLU  30          2HB       GLU  30 -13.228  11.648   8.503
  228    HG2  GLU  30          1HG       GLU  30 -14.137  12.449   6.276
  229    HG3  GLU  30          2HG       GLU  30 -15.185  11.036   6.339
  230    H    LYS  31           H        LYS  31 -12.550   8.089   6.773
  231    HA   LYS  31           HA       LYS  31 -11.023   7.391   9.051
  232    HB2  LYS  31          1HB       LYS  31 -11.698   5.715   6.627
  233    HB3  LYS  31          2HB       LYS  31 -11.039   5.102   8.147
  234    HG2  LYS  31          1HG       LYS  31 -13.063   5.903   9.309
  235    HG3  LYS  31          2HG       LYS  31 -13.724   6.407   7.751
  236    HD2  LYS  31          1HD       LYS  31 -13.515   4.063   6.954
  237    HD3  LYS  31          2HD       LYS  31 -12.979   3.600   8.580
  238    HE2  LYS  31          1HE       LYS  31 -15.618   4.951   8.019
  239    HE3  LYS  31          2HE       LYS  31 -15.422   3.200   8.115
  240    HZ1  LYS  31          1HZ       LYS  31 -14.601   3.470  10.381
  241    HZ2  LYS  31          2HZ       LYS  31 -16.162   4.100  10.216
  242    HZ3  LYS  31          3HZ       LYS  31 -14.835   5.142  10.282
  243    H    PHE  32           H        PHE  32 -10.287   7.176   5.583
  244    HA   PHE  32           HA       PHE  32  -7.682   6.246   5.776
  245    HB2  PHE  32          1HB       PHE  32  -8.774   8.071   3.635
  246    HB3  PHE  32          2HB       PHE  32  -7.398   6.984   3.487
  247    HD1  PHE  32           HD1      PHE  32 -10.158   7.221   1.928
  248    HD2  PHE  32           HD2      PHE  32  -8.593   4.604   4.893
  249    HE1  PHE  32           HE1      PHE  32 -11.651   5.436   1.137
  250    HE2  PHE  32           HE2      PHE  32 -10.083   2.818   4.107
  251    HZ   PHE  32           HZ       PHE  32 -11.613   3.226   2.222
  252    H    LYS  33           H        LYS  33  -8.911   9.532   5.826
  253    HA   LYS  33           HA       LYS  33  -6.460  10.899   5.663
  254    HB2  LYS  33          1HB       LYS  33  -8.930  11.752   5.505
  255    HB3  LYS  33          2HB       LYS  33  -8.778  11.946   7.249
  256    HG2  LYS  33          1HG       LYS  33  -6.992  13.492   7.016
  257    HG3  LYS  33          2HG       LYS  33  -6.852  13.156   5.284
  258    HD2  LYS  33          1HD       LYS  33  -7.988  15.273   5.631
  259    HD3  LYS  33          2HD       LYS  33  -9.107  14.095   4.945
  260    HE2  LYS  33          1HE       LYS  33 -10.036  13.686   7.174
  261    HE3  LYS  33          2HE       LYS  33  -8.916  14.865   7.856
  262    HZ1  LYS  33          1HZ       LYS  33 -11.071  15.857   7.515
  263    HZ2  LYS  33          2HZ       LYS  33 -11.060  15.431   5.878
  264    HZ3  LYS  33          3HZ       LYS  33  -9.951  16.569   6.462
  265    H    LYS  34           H        LYS  34  -7.917   9.132   8.249
  266    HA   LYS  34           HA       LYS  34  -5.957  10.246  10.131
  267    HB2  LYS  34          1HB       LYS  34  -8.579   8.858  10.639
  268    HB3  LYS  34          2HB       LYS  34  -7.415   9.216  11.907
  269    HG2  LYS  34          1HG       LYS  34  -7.608  11.636  11.207
  270    HG3  LYS  34          2HG       LYS  34  -8.979  11.143  10.215
  271    HD2  LYS  34          1HD       LYS  34  -8.725  10.813  13.206
  272    HD3  LYS  34          2HD       LYS  34  -9.733  11.993  12.370
  273    HE2  LYS  34          1HE       LYS  34 -10.025   8.993  12.213
  274    HE3  LYS  34          2HE       LYS  34 -11.038  10.078  13.164
  275    HZ1  LYS  34          1HZ       LYS  34 -10.778  10.141  10.205
  276    HZ2  LYS  34          2HZ       LYS  34 -11.792  11.121  11.139
  277    HZ3  LYS  34          3HZ       LYS  34 -12.068   9.456  11.061
  278    H    TRP  35           H        TRP  35  -5.685   8.099   8.043
  279    HA   TRP  35           HA       TRP  35  -4.650   6.111   7.742
  280    HB2  TRP  35          1HB       TRP  35  -3.655   6.738  10.520
  281    HB3  TRP  35          2HB       TRP  35  -3.047   5.392   9.546
  282    HD1  TRP  35           HD1      TRP  35  -2.830   9.161   9.934
  283    HE1  TRP  35           HE1      TRP  35  -0.988  10.070   8.382
  284    HE3  TRP  35           HE3      TRP  35  -1.870   4.916   7.248
  285    HZ2  TRP  35           HZ2      TRP  35   0.650   9.110   6.300
  286    HZ3  TRP  35           HZ3      TRP  35  -0.153   4.995   5.496
  287    HH2  TRP  35           HH2      TRP  35   1.089   7.046   5.028
  288    H    GLU  36           H        GLU  36  -7.266   5.771   8.330
  289    HA   GLU  36           HA       GLU  36  -7.253   3.339   9.976
  290    HB2  GLU  36          1HB       GLU  36  -9.474   5.338   9.601
  291    HB3  GLU  36          2HB       GLU  36  -9.674   3.780  10.386
  292    HG2  GLU  36          1HG       GLU  36  -8.035   4.449  12.078
  293    HG3  GLU  36          2HG       GLU  36  -7.893   6.018  11.292
  294    H    PHE  37           H        PHE  37  -7.266   1.666   8.670
  295    HA   PHE  37           HA       PHE  37  -8.853   1.830   6.190
  296    HB2  PHE  37          1HB       PHE  37  -6.420   0.098   6.715
  297    HB3  PHE  37          2HB       PHE  37  -7.263   0.280   5.178
  298    HD1  PHE  37           HD1      PHE  37  -6.866   2.185   3.768
  299    HD2  PHE  37           HD2      PHE  37  -5.080   1.936   7.626
  300    HE1  PHE  37           HE1      PHE  37  -5.399   4.076   3.211
  301    HE2  PHE  37           HE2      PHE  37  -3.602   3.820   7.067
  302    HZ   PHE  37           HZ       PHE  37  -3.763   4.896   4.857
  303    HA   PRO  38           HA       PRO  38 -11.137  -1.449   8.437
  304    HB2  PRO  38          1HB       PRO  38 -13.021  -0.880   6.232
  305    HB3  PRO  38          2HB       PRO  38 -13.308  -0.957   7.980
  306    HG2  PRO  38          1HG       PRO  38 -13.309   1.386   6.720
  307    HG3  PRO  38          2HG       PRO  38 -12.576   1.215   8.325
  308    HD2  PRO  38          1HD       PRO  38 -11.222   1.283   5.642
  309    HD3  PRO  38          2HD       PRO  38 -10.777   2.126   7.156
  310    H    GLU  39           H        GLU  39 -11.364  -3.549   7.949
  311    HA   GLU  39           HA       GLU  39 -10.145  -4.476   5.499
  312    HB2  GLU  39          1HB       GLU  39  -9.678  -5.450   7.766
  313    HB3  GLU  39          2HB       GLU  39 -11.306  -6.109   7.752
  314    HG2  GLU  39          1HG       GLU  39 -10.761  -7.412   5.765
  315    HG3  GLU  39          2HG       GLU  39  -9.127  -6.749   5.779
  316    H    ASP  40           H        ASP  40 -11.763  -3.687   4.078
  317    HA   ASP  40           HA       ASP  40 -13.938  -5.555   3.659
  318    HB2  ASP  40          1HB       ASP  40 -15.732  -4.105   3.871
  319    HB3  ASP  40          2HB       ASP  40 -14.693  -3.527   5.166
  320    H    ASP  41           H        ASP  41 -14.982  -5.205   1.503
  321    HA   ASP  41           HA       ASP  41 -13.005  -5.194  -0.433
  322    HB2  ASP  41          1HB       ASP  41 -14.788  -5.193  -2.115
  323    HB3  ASP  41          2HB       ASP  41 -15.150  -6.296  -0.795
  324    H    THR  42           H        THR  42 -15.081  -2.483   0.531
  325    HA   THR  42           HA       THR  42 -14.590  -0.761  -1.611
  326    HB   THR  42           HB       THR  42 -14.856   0.244   1.201
  327    HG1  THR  42           HG1      THR  42 -16.440  -1.230   1.255
  328   HG21  THR  42          1HG2      THR  42 -14.672   1.917  -0.541
  329   HG22  THR  42          2HG2      THR  42 -16.319   1.906   0.095
  330   HG23  THR  42          3HG2      THR  42 -15.966   1.141  -1.454
  331    H    THR  43           H        THR  43 -13.004  -0.800   1.576
  332    HA   THR  43           HA       THR  43 -11.017   1.078   1.020
  333    HB   THR  43           HB       THR  43 -10.925  -1.232   2.965
  334    HG1  THR  43           HG1      THR  43 -12.553  -0.085   3.760
  335   HG21  THR  43          1HG2      THR  43  -9.343   0.235   4.215
  336   HG22  THR  43          2HG2      THR  43  -9.341   1.339   2.838
  337   HG23  THR  43          3HG2      THR  43  -8.714  -0.296   2.654
  338    H    MET  44           H        MET  44 -11.167  -2.375   0.439
  339    HA   MET  44           HA       MET  44  -8.427  -2.865   0.105
  340    HB2  MET  44          1HB       MET  44 -10.799  -4.296  -1.085
  341    HB3  MET  44          2HB       MET  44  -9.148  -4.901  -1.131
  342    HG2  MET  44          1HG       MET  44  -9.100  -4.997   1.292
  343    HG3  MET  44          2HG       MET  44 -10.729  -4.331   1.365
  344    HE1  MET  44          1HE       MET  44 -11.414  -6.272   2.935
  345    HE2  MET  44          2HE       MET  44  -9.821  -7.027   2.838
  346    HE3  MET  44          3HE       MET  44 -11.272  -7.988   2.543
  347    H    CYS  45           H        CYS  45 -10.943  -2.279  -2.361
  348    HA   CYS  45           HA       CYS  45  -8.950  -2.347  -4.428
  349    HB2  CYS  45          1HB       CYS  45 -11.514  -2.930  -4.624
  350    HB3  CYS  45          2HB       CYS  45 -11.658  -1.206  -4.976
  351    H    TYR  46           H        TYR  46 -10.346   0.106  -2.430
  352    HA   TYR  46           HA       TYR  46  -9.614   2.381  -3.860
  353    HB2  TYR  46          1HB       TYR  46 -10.878   2.761  -1.931
  354    HB3  TYR  46          2HB       TYR  46  -9.827   1.765  -0.925
  355    HD1  TYR  46           HD1      TYR  46  -9.877   4.963  -2.851
  356    HD2  TYR  46           HD2      TYR  46  -8.190   2.782   0.393
  357    HE1  TYR  46           HE1      TYR  46  -8.700   6.984  -2.102
  358    HE2  TYR  46           HE2      TYR  46  -7.003   4.800   1.142
  359    HH   TYR  46           HH       TYR  46  -6.291   6.921   0.408
  360    H    ILE  47           H        ILE  47  -7.765   0.415  -1.566
  361    HA   ILE  47           HA       ILE  47  -5.335   1.774  -1.765
  362    HB   ILE  47           HB       ILE  47  -5.867  -1.129  -1.161
  363   HG12  ILE  47          1HG1      ILE  47  -6.855   0.433   0.450
  364   HG13  ILE  47          2HG1      ILE  47  -5.513  -0.439   1.186
  365   HG21  ILE  47          1HG2      ILE  47  -3.586  -1.139  -0.170
  366   HG22  ILE  47          2HG2      ILE  47  -3.315   0.450  -0.884
  367   HG23  ILE  47          3HG2      ILE  47  -3.596  -0.946  -1.923
  368   HD11  ILE  47          1HD1      ILE  47  -5.541   2.405   0.218
  369   HD12  ILE  47          2HD1      ILE  47  -4.082   1.555   0.731
  370   HD13  ILE  47          3HD1      ILE  47  -5.393   1.825   1.877
  371    H    LYS  48           H        LYS  48  -6.749  -0.766  -3.751
  372    HA   LYS  48           HA       LYS  48  -4.491  -1.433  -5.261
  373    HB2  LYS  48          1HB       LYS  48  -6.654  -2.687  -5.225
  374    HB3  LYS  48          2HB       LYS  48  -7.364  -1.422  -6.205
  375    HG2  LYS  48          1HG       LYS  48  -4.927  -2.879  -7.149
  376    HG3  LYS  48          2HG       LYS  48  -6.525  -3.595  -7.342
  377    HD2  LYS  48          1HD       LYS  48  -5.735  -0.872  -8.376
  378    HD3  LYS  48          2HD       LYS  48  -5.730  -2.347  -9.342
  379    HE2  LYS  48          1HE       LYS  48  -8.166  -1.247  -7.944
  380    HE3  LYS  48          2HE       LYS  48  -7.762  -0.918  -9.624
  381    HZ1  LYS  48          1HZ       LYS  48  -8.244  -3.625  -8.496
  382    HZ2  LYS  48          2HZ       LYS  48  -7.941  -3.256 -10.118
  383    HZ3  LYS  48          3HZ       LYS  48  -9.367  -2.727  -9.383
  384    H    CYS  49           H        CYS  49  -7.125   0.829  -6.027
  385    HA   CYS  49           HA       CYS  49  -6.082   1.842  -8.387
  386    HB2  CYS  49          1HB       CYS  49  -8.322   2.334  -7.875
  387    HB3  CYS  49          2HB       CYS  49  -7.912   3.061  -6.323
  388    H    VAL  50           H        VAL  50  -5.627   3.047  -5.064
  389    HA   VAL  50           HA       VAL  50  -4.138   5.312  -5.725
  390    HB   VAL  50           HB       VAL  50  -4.252   3.692  -3.189
  391   HG11  VAL  50          1HG1      VAL  50  -3.234   5.605  -2.066
  392   HG12  VAL  50          2HG1      VAL  50  -3.003   6.399  -3.623
  393   HG13  VAL  50          3HG1      VAL  50  -2.138   4.905  -3.257
  394   HG21  VAL  50          1HG2      VAL  50  -5.632   5.577  -2.415
  395   HG22  VAL  50          2HG2      VAL  50  -6.337   4.725  -3.788
  396   HG23  VAL  50          3HG2      VAL  50  -5.532   6.275  -4.031
  397    H    PHE  51           H        PHE  51  -3.105   2.084  -4.703
  398    HA   PHE  51           HA       PHE  51  -0.346   2.581  -4.733
  399    HB2  PHE  51          1HB       PHE  51  -2.096   0.191  -4.612
  400    HB3  PHE  51          2HB       PHE  51  -0.429  -0.076  -5.110
  401    HD1  PHE  51           HD1      PHE  51  -1.369   2.571  -2.739
  402    HD2  PHE  51           HD2      PHE  51   0.110  -1.396  -3.189
  403    HE1  PHE  51           HE1      PHE  51  -0.700   2.554  -0.372
  404    HE2  PHE  51           HE2      PHE  51   0.777  -1.418  -0.825
  405    HZ   PHE  51           HZ       PHE  51   0.375   0.560   0.587
  406    H    ASN  52           H        ASN  52  -2.618   1.832  -7.212
  407    HA   ASN  52           HA       ASN  52  -0.684   0.979  -9.164
  408    HB2  ASN  52          1HB       ASN  52  -3.040   0.214  -9.220
  409    HB3  ASN  52          2HB       ASN  52  -3.561   1.874  -9.524
  410   HD21  ASN  52          1HD2      ASN  52  -0.710   0.335 -10.916
  411   HD22  ASN  52          2HD2      ASN  52  -1.289   0.343 -12.545
  412    H    LYS  53           H        LYS  53  -2.428   3.926  -8.376
  413    HA   LYS  53           HA       LYS  53  -1.483   5.412 -10.618
  414    HB2  LYS  53          1HB       LYS  53  -2.917   6.090  -8.073
  415    HB3  LYS  53          2HB       LYS  53  -2.294   7.378  -9.096
  416    HG2  LYS  53          1HG       LYS  53  -3.673   6.587 -10.945
  417    HG3  LYS  53          2HG       LYS  53  -4.239   5.234  -9.965
  418    HD2  LYS  53          1HD       LYS  53  -5.267   6.808  -8.393
  419    HD3  LYS  53          2HD       LYS  53  -4.696   8.160  -9.373
  420    HE2  LYS  53          1HE       LYS  53  -6.592   6.003 -10.300
  421    HE3  LYS  53          2HE       LYS  53  -7.060   7.628  -9.802
  422    HZ1  LYS  53          1HZ       LYS  53  -5.364   6.912 -12.131
  423    HZ2  LYS  53          2HZ       LYS  53  -5.665   8.491 -11.620
  424    HZ3  LYS  53          3HZ       LYS  53  -6.938   7.530 -12.176
  425    H    MET  54           H        MET  54  -0.228   4.637  -7.522
  426    HA   MET  54           HA       MET  54   1.728   6.780  -7.558
  427    HB2  MET  54          1HB       MET  54   1.118   4.562  -5.622
  428    HB3  MET  54          2HB       MET  54   2.510   5.625  -5.431
  429    HG2  MET  54          1HG       MET  54   1.153   7.503  -5.121
  430    HG3  MET  54          2HG       MET  54  -0.281   6.673  -5.716
  431    HE1  MET  54          1HE       MET  54   2.466   5.610  -2.912
  432    HE2  MET  54          2HE       MET  54   1.600   6.341  -1.557
  433    HE3  MET  54          3HE       MET  54   2.144   7.341  -2.899
  434    H    GLN  55           H        GLN  55   1.471   4.014  -9.193
  435    HA   GLN  55           HA       GLN  55   2.851   2.592 -10.246
  436    HB2  GLN  55          1HB       GLN  55   4.546   4.983  -9.800
  437    HB3  GLN  55          2HB       GLN  55   5.335   3.522 -10.395
  438    HG2  GLN  55          1HG       GLN  55   3.821   3.480 -12.297
  439    HG3  GLN  55          2HG       GLN  55   2.992   4.902 -11.675
  440   HE21  GLN  55          1HE2      GLN  55   3.931   6.913 -11.904
  441   HE22  GLN  55          2HE2      GLN  55   5.327   7.194 -12.888
  442    H    LEU  56           H        LEU  56   2.359   1.804  -7.728
  443    HA   LEU  56           HA       LEU  56   4.954   0.899  -6.720
  444    HB2  LEU  56          1HB       LEU  56   2.743   2.272  -5.376
  445    HB3  LEU  56          2HB       LEU  56   3.323   0.851  -4.496
  446    HG   LEU  56           HG       LEU  56   4.999   3.195  -5.396
  447   HD11  LEU  56          1HD1      LEU  56   3.464   3.824  -3.616
  448   HD12  LEU  56          2HD1      LEU  56   5.116   3.750  -3.012
  449   HD13  LEU  56          3HD1      LEU  56   3.989   2.444  -2.655
  450   HD21  LEU  56          1HD2      LEU  56   6.690   2.188  -3.879
  451   HD22  LEU  56          2HD2      LEU  56   6.352   1.219  -5.314
  452   HD23  LEU  56          3HD2      LEU  56   5.661   0.761  -3.757
  453    H    PHE  57           H        PHE  57   1.836   0.063  -7.769
  454    HA   PHE  57           HA       PHE  57   2.325  -2.752  -7.114
  455    HB2  PHE  57          1HB       PHE  57   0.746  -2.069  -5.414
  456    HB3  PHE  57          2HB       PHE  57  -0.250  -1.238  -6.596
  457    HD1  PHE  57           HD1      PHE  57   0.805  -4.560  -5.381
  458    HD2  PHE  57           HD2      PHE  57  -1.900  -2.381  -7.846
  459    HE1  PHE  57           HE1      PHE  57  -0.583  -6.575  -5.638
  460    HE2  PHE  57           HE2      PHE  57  -3.286  -4.395  -8.108
  461    HZ   PHE  57           HZ       PHE  57  -2.630  -6.493  -7.001
  462    H    ASP  58           H        ASP  58   1.781  -4.140  -8.707
  463    HA   ASP  58           HA       ASP  58   0.350  -3.045 -11.040
  464    HB2  ASP  58          1HB       ASP  58   2.664  -3.507 -11.660
  465    HB3  ASP  58          2HB       ASP  58   2.553  -5.130 -10.980
  466    H    ASP  59           H        ASP  59  -1.306  -4.275 -11.864
  467    HA   ASP  59           HA       ASP  59  -2.570  -6.010  -9.988
  468    HB2  ASP  59          1HB       ASP  59  -4.371  -6.159 -11.607
  469    HB3  ASP  59          2HB       ASP  59  -3.834  -4.498 -11.467
  470    H    THR  60           H        THR  60  -0.254  -6.591 -12.371
  471    HA   THR  60           HA       THR  60  -1.061  -9.384 -12.656
  472    HB   THR  60           HB       THR  60   0.959  -7.720 -14.149
  473    HG1  THR  60           HG1      THR  60  -0.863  -7.322 -15.160
  474   HG21  THR  60          1HG2      THR  60   1.830  -9.980 -13.904
  475   HG22  THR  60          2HG2      THR  60   1.328  -9.684 -15.569
  476   HG23  THR  60          3HG2      THR  60   0.310 -10.647 -14.499
  477    H    GLU  61           H        GLU  61   2.057  -7.646 -12.209
  478    HA   GLU  61           HA       GLU  61   3.289  -9.990 -11.108
  479    HB2  GLU  61          1HB       GLU  61   4.441  -7.222 -10.935
  480    HB3  GLU  61          2HB       GLU  61   5.274  -8.767 -11.042
  481    HG2  GLU  61          1HG       GLU  61   4.301  -9.009 -13.338
  482    HG3  GLU  61          2HG       GLU  61   3.795  -7.329 -13.209
  483    H    GLY  62           H        GLY  62   1.361  -7.564  -9.739
  484    HA2  GLY  62          1HA       GLY  62   0.633  -7.517  -7.514
  485    HA3  GLY  62          2HA       GLY  62   1.971  -8.586  -7.083
  486    HA   PRO  63           HA       PRO  63   3.137  -4.513  -5.257
  487    HB2  PRO  63          1HB       PRO  63   4.805  -6.368  -3.675
  488    HB3  PRO  63          2HB       PRO  63   3.722  -5.081  -3.128
  489    HG2  PRO  63          1HG       PRO  63   3.117  -7.705  -2.863
  490    HG3  PRO  63          2HG       PRO  63   1.883  -6.454  -3.117
  491    HD2  PRO  63          1HD       PRO  63   2.984  -8.458  -5.028
  492    HD3  PRO  63          2HD       PRO  63   1.352  -7.752  -4.942
  493    H    LEU  64           H        LEU  64   4.664  -3.425  -6.316
  494    HA   LEU  64           HA       LEU  64   6.825  -4.839  -7.631
  495    HB2  LEU  64          1HB       LEU  64   6.296  -1.865  -7.562
  496    HB3  LEU  64          2HB       LEU  64   7.359  -2.723  -8.658
  497    HG   LEU  64           HG       LEU  64   4.367  -3.083  -8.582
  498   HD11  LEU  64          1HD1      LEU  64   4.369  -1.862 -10.705
  499   HD12  LEU  64          2HD1      LEU  64   6.094  -1.550 -10.522
  500   HD13  LEU  64          3HD1      LEU  64   4.947  -0.857  -9.377
  501   HD21  LEU  64          1HD2      LEU  64   4.705  -4.306 -10.656
  502   HD22  LEU  64          2HD2      LEU  64   5.593  -5.053  -9.323
  503   HD23  LEU  64          3HD2      LEU  64   6.450  -4.075 -10.515
  504    H    VAL  65           H        VAL  65   8.083  -5.577  -6.024
  505    HA   VAL  65           HA       VAL  65   8.742  -4.362  -3.678
  506    HB   VAL  65           HB       VAL  65   9.370  -6.513  -3.514
  507   HG11  VAL  65          1HG1      VAL  65  10.335  -6.354  -6.360
  508   HG12  VAL  65          2HG1      VAL  65   8.962  -7.262  -5.721
  509   HG13  VAL  65          3HG1      VAL  65  10.605  -7.761  -5.336
  510   HG21  VAL  65          1HG2      VAL  65  11.787  -6.846  -3.555
  511   HG22  VAL  65          2HG2      VAL  65  11.328  -5.316  -2.810
  512   HG23  VAL  65          3HG2      VAL  65  11.971  -5.339  -4.452
  513    H    ASP  66           H        ASP  66  10.335  -3.957  -6.797
  514    HA   ASP  66           HA       ASP  66  12.690  -2.728  -5.881
  515    HB2  ASP  66          1HB       ASP  66  12.394  -3.635  -8.145
  516    HB3  ASP  66          2HB       ASP  66  11.275  -2.329  -8.516
  517    H    ASN  67           H        ASN  67   9.748  -1.215  -7.224
  518    HA   ASN  67           HA       ASN  67  10.517   1.434  -6.646
  519    HB2  ASN  67          1HB       ASN  67   7.829   0.167  -7.143
  520    HB3  ASN  67          2HB       ASN  67   8.018   1.888  -6.838
  521   HD21  ASN  67          1HD2      ASN  67   7.145   2.279  -8.899
  522   HD22  ASN  67          2HD2      ASN  67   8.108   2.098 -10.329
  523    H    LEU  68           H        LEU  68   8.866  -1.028  -4.826
  524    HA   LEU  68           HA       LEU  68   7.807   0.516  -2.759
  525    HB2  LEU  68          1HB       LEU  68   8.577  -2.351  -3.044
  526    HB3  LEU  68          2HB       LEU  68   8.143  -1.737  -1.459
  527    HG   LEU  68           HG       LEU  68   6.342  -1.390  -3.843
  528   HD11  LEU  68          1HD1      LEU  68   6.740  -3.778  -3.565
  529   HD12  LEU  68          2HD1      LEU  68   5.105  -3.352  -3.063
  530   HD13  LEU  68          3HD1      LEU  68   6.352  -3.656  -1.850
  531   HD21  LEU  68          1HD2      LEU  68   4.638  -1.124  -2.126
  532   HD22  LEU  68          2HD2      LEU  68   5.940   0.045  -1.915
  533   HD23  LEU  68          3HD2      LEU  68   5.853  -1.374  -0.874
  534    H    VAL  69           H        VAL  69  10.965  -1.068  -3.024
  535    HA   VAL  69           HA       VAL  69  11.907  -0.243  -0.473
  536    HB   VAL  69           HB       VAL  69  13.448  -1.031  -2.938
  537   HG11  VAL  69          1HG1      VAL  69  14.292  -0.775  -0.060
  538   HG12  VAL  69          2HG1      VAL  69  14.874   0.181  -1.424
  539   HG13  VAL  69          3HG1      VAL  69  15.258  -1.537  -1.323
  540   HG21  VAL  69          1HG2      VAL  69  12.653  -2.658  -0.534
  541   HG22  VAL  69          2HG2      VAL  69  13.575  -3.220  -1.929
  542   HG23  VAL  69          3HG2      VAL  69  11.889  -2.745  -2.123
  543    H    HIS  70           H        HIS  70  12.199   1.102  -3.737
  544    HA   HIS  70           HA       HIS  70  13.975   3.191  -3.083
  545    HB2  HIS  70          1HB       HIS  70  12.032   2.760  -5.328
  546    HB3  HIS  70          2HB       HIS  70  12.861   4.304  -5.160
  547    HD1  HIS  70           HD1      HIS  70  15.164   4.456  -6.104
  548    HD2  HIS  70           HD2      HIS  70  13.889   0.521  -5.705
  549    HE1  HIS  70           HE1      HIS  70  16.946   3.057  -7.182
  550    HE2  HIS  70           HE2      HIS  70  16.138   0.685  -6.970
  551    H    GLN  71           H        GLN  71  10.588   2.821  -2.597
  552    HA   GLN  71           HA       GLN  71  10.156   5.645  -2.048
  553    HB2  GLN  71          1HB       GLN  71   8.452   4.247  -3.211
  554    HB3  GLN  71          2HB       GLN  71   8.270   3.305  -1.739
  555    HG2  GLN  71          1HG       GLN  71   6.485   4.930  -1.944
  556    HG3  GLN  71          2HG       GLN  71   7.497   5.263  -0.542
  557   HE21  GLN  71          1HE2      GLN  71   8.717   7.102  -0.478
  558   HE22  GLN  71          2HE2      GLN  71   8.518   8.397  -1.602
  559    H    LEU  72           H        LEU  72   9.656   2.612  -0.256
  560    HA   LEU  72           HA       LEU  72   9.094   3.852   2.189
  561    HB2  LEU  72          1HB       LEU  72   9.964   1.041   1.559
  562    HB3  LEU  72          2HB       LEU  72   9.496   1.563   3.163
  563    HG   LEU  72           HG       LEU  72   7.687   1.699   0.750
  564   HD11  LEU  72          1HD1      LEU  72   7.803  -0.344   2.972
  565   HD12  LEU  72          2HD1      LEU  72   8.236  -0.621   1.285
  566   HD13  LEU  72          3HD1      LEU  72   6.564  -0.257   1.717
  567   HD21  LEU  72          1HD2      LEU  72   7.185   2.067   3.703
  568   HD22  LEU  72          2HD2      LEU  72   5.920   1.926   2.481
  569   HD23  LEU  72          3HD2      LEU  72   7.040   3.289   2.436
  570    H    ALA  73           H        ALA  73  12.114   2.414   0.977
  571    HA   ALA  73           HA       ALA  73  13.482   2.690   3.458
  572    HB1  ALA  73          1HB       ALA  73  15.406   1.892   2.288
  573    HB2  ALA  73          2HB       ALA  73  14.651   2.238   0.731
  574    HB3  ALA  73          3HB       ALA  73  13.992   0.974   1.770
  575    H    HIS  74           H        HIS  74  12.391   5.217   2.277
  576    HA   HIS  74           HA       HIS  74  14.672   6.776   1.508
  577    HB2  HIS  74          1HB       HIS  74  12.344   7.353   0.805
  578    HB3  HIS  74          2HB       HIS  74  11.970   7.748   2.481
  579    HD1  HIS  74           HD1      HIS  74  13.969   8.970  -0.461
  580    HD2  HIS  74           HD2      HIS  74  12.839  10.235   3.332
  581    HE1  HIS  74           HE1      HIS  74  14.614  11.398  -0.337
  582    HE2  HIS  74           HE2      HIS  74  14.087  12.084   2.026
  583    H    GLY  75           H        GLY  75  16.223   6.601   3.073
  584    HA2  GLY  75          1HA       GLY  75  17.228   7.731   4.920
  585    HA3  GLY  75          2HA       GLY  75  15.628   7.947   5.617
  586    H    ARG  76           H        ARG  76  16.337   4.851   4.309
  587    HA   ARG  76           HA       ARG  76  17.283   3.787   6.848
  588    HB2  ARG  76          1HB       ARG  76  14.579   3.326   5.759
  589    HB3  ARG  76          2HB       ARG  76  15.424   1.890   6.322
  590    HG2  ARG  76          1HG       ARG  76  15.824   3.207   8.475
  591    HG3  ARG  76          2HG       ARG  76  14.579   4.307   7.879
  592    HD2  ARG  76          1HD       ARG  76  13.099   2.294   7.608
  593    HD3  ARG  76          2HD       ARG  76  14.317   1.371   8.478
  594    HE   ARG  76           HE       ARG  76  13.527   3.699   9.917
  595   HH11  ARG  76          1HH1      ARG  76  12.574   0.410   9.163
  596   HH12  ARG  76          2HH1      ARG  76  11.595   0.240  10.585
  597   HH21  ARG  76          1HH2      ARG  76  12.241   3.477  11.774
  598   HH22  ARG  76          2HH2      ARG  76  11.405   1.986  12.071
  599    H    ASP  77           H        ASP  77  17.818   1.429   6.643
  600    HA   ASP  77           HA       ASP  77  19.398   0.909   4.371
  601    HB2  ASP  77          1HB       ASP  77  18.395  -0.909   6.562
  602    HB3  ASP  77          2HB       ASP  77  19.491  -1.439   5.294
  603    H    ALA  78           H        ALA  78  18.526   0.754   2.455
  604    HA   ALA  78           HA       ALA  78  16.008  -0.164   1.739
  605    HB1  ALA  78          1HB       ALA  78  17.448   1.127   0.265
  606    HB2  ALA  78          2HB       ALA  78  16.923  -0.362  -0.517
  607    HB3  ALA  78          3HB       ALA  78  18.556  -0.239   0.136
  608    H    GLU  79           H        GLU  79  18.979  -1.892   2.310
  609    HA   GLU  79           HA       GLU  79  18.373  -4.374   1.198
  610    HB2  GLU  79          1HB       GLU  79  20.025  -3.683   3.626
  611    HB3  GLU  79          2HB       GLU  79  19.965  -5.288   2.911
  612    HG2  GLU  79          1HG       GLU  79  20.835  -4.373   0.814
  613    HG3  GLU  79          2HG       GLU  79  20.930  -2.780   1.558
  614    H    GLU  80           H        GLU  80  17.771  -3.178   4.491
  615    HA   GLU  80           HA       GLU  80  16.495  -5.555   5.390
  616    HB2  GLU  80          1HB       GLU  80  16.436  -2.738   6.466
  617    HB3  GLU  80          2HB       GLU  80  15.789  -4.141   7.306
  618    HG2  GLU  80          1HG       GLU  80  18.053  -5.129   7.279
  619    HG3  GLU  80          2HG       GLU  80  18.651  -3.645   6.557
  620    H    VAL  81           H        VAL  81  15.349  -2.430   4.213
  621    HA   VAL  81           HA       VAL  81  12.621  -2.742   4.584
  622    HB   VAL  81           HB       VAL  81  14.091  -1.260   2.415
  623   HG11  VAL  81          1HG1      VAL  81  11.197  -1.080   3.245
  624   HG12  VAL  81          2HG1      VAL  81  11.809  -1.624   1.683
  625   HG13  VAL  81          3HG1      VAL  81  12.013   0.060   2.173
  626   HG21  VAL  81          1HG2      VAL  81  14.683  -0.467   4.558
  627   HG22  VAL  81          2HG2      VAL  81  13.005  -0.487   5.101
  628   HG23  VAL  81          3HG2      VAL  81  13.527   0.679   3.884
  629    H    ARG  82           H        ARG  82  14.561  -3.602   1.706
  630    HA   ARG  82           HA       ARG  82  12.545  -4.650   0.114
  631    HB2  ARG  82          1HB       ARG  82  14.958  -4.276  -0.511
  632    HB3  ARG  82          2HB       ARG  82  15.331  -5.778   0.319
  633    HG2  ARG  82          1HG       ARG  82  13.748  -6.939  -1.187
  634    HG3  ARG  82          2HG       ARG  82  13.559  -5.433  -2.073
  635    HD2  ARG  82          1HD       ARG  82  16.006  -5.418  -2.459
  636    HD3  ARG  82          2HD       ARG  82  16.094  -7.008  -1.704
  637    HE   ARG  82           HE       ARG  82  14.201  -7.136  -3.744
  638   HH11  ARG  82          1HH1      ARG  82  17.646  -6.654  -3.387
  639   HH12  ARG  82          2HH1      ARG  82  18.029  -7.337  -4.935
  640   HH21  ARG  82          1HH2      ARG  82  14.702  -8.040  -5.788
  641   HH22  ARG  82          2HH2      ARG  82  16.358  -8.128  -6.297
  642    H    THR  83           H        THR  83  14.450  -6.186   2.645
  643    HA   THR  83           HA       THR  83  13.552  -8.814   2.301
  644    HB   THR  83           HB       THR  83  14.701  -7.301   4.631
  645    HG1  THR  83           HG1      THR  83  15.623  -9.049   2.653
  646   HG21  THR  83          1HG2      THR  83  14.021 -10.243   4.592
  647   HG22  THR  83          2HG2      THR  83  13.251  -9.016   5.597
  648   HG23  THR  83          3HG2      THR  83  14.951  -9.416   5.841
  649    H    GLU  84           H        GLU  84  12.487  -6.329   4.633
  650    HA   GLU  84           HA       GLU  84  10.394  -7.790   5.749
  651    HB2  GLU  84          1HB       GLU  84  10.656  -4.797   5.501
  652    HB3  GLU  84          2HB       GLU  84   9.577  -5.650   6.597
  653    HG2  GLU  84          1HG       GLU  84  11.579  -6.717   7.614
  654    HG3  GLU  84          2HG       GLU  84  12.578  -5.655   6.630
  655    H    VAL  85           H        VAL  85  10.371  -5.555   2.979
  656    HA   VAL  85           HA       VAL  85   7.631  -5.627   2.445
  657    HB   VAL  85           HB       VAL  85  10.012  -5.294   0.630
  658   HG11  VAL  85          1HG1      VAL  85   7.095  -5.123  -0.128
  659   HG12  VAL  85          2HG1      VAL  85   8.252  -6.329  -0.696
  660   HG13  VAL  85          3HG1      VAL  85   8.450  -4.633  -1.148
  661   HG21  VAL  85          1HG2      VAL  85   7.872  -3.398   1.584
  662   HG22  VAL  85          2HG2      VAL  85   9.218  -2.986   0.518
  663   HG23  VAL  85          3HG2      VAL  85   9.531  -3.485   2.182
  664    H    LEU  86           H        LEU  86  10.234  -7.743   1.258
  665    HA   LEU  86           HA       LEU  86   8.689  -9.350  -0.403
  666    HB2  LEU  86          1HB       LEU  86  11.248  -9.912   1.082
  667    HB3  LEU  86          2HB       LEU  86  10.528 -11.050  -0.055
  668    HG   LEU  86           HG       LEU  86  11.268  -8.238  -0.820
  669   HD11  LEU  86          1HD1      LEU  86  13.263  -9.393  -0.025
  670   HD12  LEU  86          2HD1      LEU  86  13.310  -9.175  -1.776
  671   HD13  LEU  86          3HD1      LEU  86  12.910 -10.751  -1.094
  672   HD21  LEU  86          1HD2      LEU  86   9.678  -9.286  -2.291
  673   HD22  LEU  86          2HD2      LEU  86  10.669 -10.740  -2.383
  674   HD23  LEU  86          3HD2      LEU  86  11.251  -9.231  -3.086
  675    H    LYS  87           H        LYS  87   9.191  -9.483   3.059
  676    HA   LYS  87           HA       LYS  87   8.101 -12.063   3.519
  677    HB2  LYS  87          1HB       LYS  87   8.394  -9.614   5.248
  678    HB3  LYS  87          2HB       LYS  87   7.585 -11.059   5.835
  679    HG2  LYS  87          1HG       LYS  87   9.575 -12.361   5.574
  680    HG3  LYS  87          2HG       LYS  87  10.404 -11.008   4.781
  681    HD2  LYS  87          1HD       LYS  87  11.021 -11.332   7.180
  682    HD3  LYS  87          2HD       LYS  87  10.383  -9.732   6.809
  683    HE2  LYS  87          1HE       LYS  87   9.431 -10.507   8.880
  684    HE3  LYS  87          2HE       LYS  87   8.174 -10.453   7.650
  685    HZ1  LYS  87          1HZ       LYS  87   8.403 -12.840   7.363
  686    HZ2  LYS  87          2HZ       LYS  87   8.046 -12.468   8.975
  687    HZ3  LYS  87          3HZ       LYS  87   9.622 -12.888   8.532
  688    H    CYS  88           H        CYS  88   6.705  -9.116   2.593
  689    HA   CYS  88           HA       CYS  88   4.035  -9.990   3.415
  690    HB2  CYS  88          1HB       CYS  88   5.221  -7.309   2.786
  691    HB3  CYS  88          2HB       CYS  88   3.463  -7.551   2.699
  692    H    VAL  89           H        VAL  89   6.096  -9.973   0.786
  693    HA   VAL  89           HA       VAL  89   3.974  -9.815  -1.212
  694    HB   VAL  89           HB       VAL  89   6.910 -10.354  -1.643
  695   HG11  VAL  89          1HG1      VAL  89   6.400  -9.645  -3.958
  696   HG12  VAL  89          2HG1      VAL  89   4.693  -9.572  -3.515
  697   HG13  VAL  89          3HG1      VAL  89   5.551 -11.112  -3.469
  698   HG21  VAL  89          1HG2      VAL  89   7.062  -7.996  -2.364
  699   HG22  VAL  89          2HG2      VAL  89   6.696  -8.169  -0.649
  700   HG23  VAL  89          3HG2      VAL  89   5.415  -7.744  -1.785
  701    H    ASP  90           H        ASP  90   2.817 -11.648  -1.354
  702    HA   ASP  90           HA       ASP  90   4.280 -14.013  -2.135
  703    HB2  ASP  90          1HB       ASP  90   2.950 -15.527  -0.678
  704    HB3  ASP  90          2HB       ASP  90   4.009 -14.450   0.234
  705    H    LYS  91           H        LYS  91   2.215 -15.799  -2.395
  706    HA   LYS  91           HA       LYS  91   1.448 -14.969  -4.981
  707    HB2  LYS  91          1HB       LYS  91   0.266 -17.332  -3.550
  708    HB3  LYS  91          2HB       LYS  91   0.560 -17.114  -5.270
  709    HG2  LYS  91          1HG       LYS  91   2.969 -17.179  -4.863
  710    HG3  LYS  91          2HG       LYS  91   2.655 -17.462  -3.152
  711    HD2  LYS  91          1HD       LYS  91   3.126 -19.569  -4.216
  712    HD3  LYS  91          2HD       LYS  91   1.420 -19.523  -3.769
  713    HE2  LYS  91          1HE       LYS  91   1.666 -20.461  -5.986
  714    HE3  LYS  91          2HE       LYS  91   0.851 -18.901  -6.083
  715    HZ1  LYS  91          1HZ       LYS  91   3.717 -19.417  -6.664
  716    HZ2  LYS  91          2HZ       LYS  91   2.977 -17.900  -6.712
  717    HZ3  LYS  91          3HZ       LYS  91   2.508 -19.100  -7.804
  718    H    ASN  92           H        ASN  92  -0.516 -14.720  -5.926
  719    HA   ASN  92           HA       ASN  92  -2.500 -13.339  -4.330
  720    HB2  ASN  92          1HB       ASN  92  -1.802 -12.488  -6.553
  721    HB3  ASN  92          2HB       ASN  92  -2.424 -13.955  -7.286
  722   HD21  ASN  92          1HD2      ASN  92  -3.771 -12.671  -8.582
  723   HD22  ASN  92          2HD2      ASN  92  -5.244 -12.007  -7.957
  724    H    THR  93           H        THR  93  -3.188 -15.182  -3.072
  725    HA   THR  93           HA       THR  93  -4.595 -17.303  -4.446
  726    HB   THR  93           HB       THR  93  -5.092 -18.158  -2.198
  727    HG1  THR  93           HG1      THR  93  -4.671 -17.009  -0.409
  728   HG21  THR  93          1HG2      THR  93  -2.770 -18.534  -1.453
  729   HG22  THR  93          2HG2      THR  93  -2.228 -17.293  -2.585
  730   HG23  THR  93          3HG2      THR  93  -2.977 -18.772  -3.185
  731    H    ASP  94           H        ASP  94  -5.285 -14.174  -3.517
  732    HA   ASP  94           HA       ASP  94  -8.058 -14.530  -2.830
  733    HB2  ASP  94          1HB       ASP  94  -6.339 -12.114  -3.355
  734    HB3  ASP  94          2HB       ASP  94  -8.091 -11.971  -3.169
  735    H    ASN  95           H        ASN  95  -6.237 -14.187  -5.703
  736    HA   ASN  95           HA       ASN  95  -6.763 -14.208  -7.898
  737    HB2  ASN  95          1HB       ASN  95  -9.412 -15.104  -6.800
  738    HB3  ASN  95          2HB       ASN  95  -9.098 -14.959  -8.519
  739   HD21  ASN  95          1HD2      ASN  95  -9.498 -17.161  -8.754
  740   HD22  ASN  95          2HD2      ASN  95  -8.322 -18.352  -8.286
  741    H    ASN  96           H        ASN  96  -7.285 -11.777  -6.171
  742    HA   ASN  96           HA       ASN  96  -8.663 -10.231  -8.215
  743    HB2  ASN  96          1HB       ASN  96 -10.520 -10.744  -6.816
  744    HB3  ASN  96          2HB       ASN  96  -9.587 -10.471  -5.347
  745   HD21  ASN  96          1HD2      ASN  96 -11.259  -8.972  -8.009
  746   HD22  ASN  96          2HD2      ASN  96 -11.362  -7.392  -7.304
  747    H    ALA  97           H        ALA  97  -7.657  -8.333  -8.530
  748    HA   ALA  97           HA       ALA  97  -5.193  -7.890  -7.194
  749    HB1  ALA  97          1HB       ALA  97  -6.597  -6.043  -9.110
  750    HB2  ALA  97          2HB       ALA  97  -5.564  -7.390  -9.580
  751    HB3  ALA  97          3HB       ALA  97  -4.887  -6.030  -8.685
  752    H    CYS  98           H        CYS  98  -8.394  -6.496  -6.809
  753    HA   CYS  98           HA       CYS  98  -7.634  -4.241  -5.288
  754    HB2  CYS  98          1HB       CYS  98 -10.179  -5.840  -4.972
  755    HB3  CYS  98          2HB       CYS  98  -9.926  -4.164  -4.497
  756    H    HIS  99           H        HIS  99  -8.298  -7.583  -4.454
  757    HA   HIS  99           HA       HIS  99  -7.964  -7.272  -1.639
  758    HB2  HIS  99          1HB       HIS  99  -8.213  -9.549  -3.538
  759    HB3  HIS  99          2HB       HIS  99  -7.491  -9.880  -1.969
  760    HD1  HIS  99           HD1      HIS  99  -9.155 -10.776  -0.416
  761    HD2  HIS  99           HD2      HIS  99 -10.844  -8.005  -3.022
  762    HE1  HIS  99           HE1      HIS  99 -11.585 -10.635   0.224
  763    HE2  HIS  99           HE2      HIS  99 -12.564  -8.882  -1.296
  764    H    TRP 100           H        TRP 100  -5.858  -8.307  -4.273
  765    HA   TRP 100           HA       TRP 100  -3.757  -9.265  -2.678
  766    HB2  TRP 100          1HB       TRP 100  -4.159  -9.687  -5.158
  767    HB3  TRP 100          2HB       TRP 100  -3.412  -8.117  -5.451
  768    HD1  TRP 100           HD1      TRP 100  -1.679  -9.801  -2.645
  769    HE1  TRP 100           HE1      TRP 100   0.500 -10.909  -3.452
  770    HE3  TRP 100           HE3      TRP 100  -2.440  -9.507  -7.694
  771    HZ2  TRP 100           HZ2      TRP 100   1.734 -11.562  -5.902
  772    HZ3  TRP 100           HZ3      TRP 100  -0.715 -10.403  -9.198
  773    HH2  TRP 100           HH2      TRP 100   1.328 -11.413  -8.327
  774    H    ALA 101           H        ALA 101  -4.281  -6.090  -4.168
  775    HA   ALA 101           HA       ALA 101  -1.843  -4.935  -3.357
  776    HB1  ALA 101          1HB       ALA 101  -4.478  -3.579  -3.888
  777    HB2  ALA 101          2HB       ALA 101  -3.270  -3.985  -5.104
  778    HB3  ALA 101          3HB       ALA 101  -2.895  -2.801  -3.850
  779    H    PHE 102           H        PHE 102  -5.065  -4.958  -1.885
  780    HA   PHE 102           HA       PHE 102  -4.401  -3.399   0.363
  781    HB2  PHE 102          1HB       PHE 102  -6.705  -3.749  -0.321
  782    HB3  PHE 102          2HB       PHE 102  -6.572  -5.471   0.018
  783    HD1  PHE 102           HD1      PHE 102  -7.145  -6.278   2.140
  784    HD2  PHE 102           HD2      PHE 102  -6.342  -2.133   1.617
  785    HE1  PHE 102           HE1      PHE 102  -7.888  -5.846   4.442
  786    HE2  PHE 102           HE2      PHE 102  -7.082  -1.691   3.919
  787    HZ   PHE 102           HZ       PHE 102  -7.857  -3.547   5.338
  788    H    ARG 103           H        ARG 103  -4.076  -6.743  -0.421
  789    HA   ARG 103           HA       ARG 103  -3.711  -7.822   2.164
  790    HB2  ARG 103          1HB       ARG 103  -4.344  -9.149   0.211
  791    HB3  ARG 103          2HB       ARG 103  -2.820  -8.771  -0.566
  792    HG2  ARG 103          1HG       ARG 103  -1.631 -10.048   1.134
  793    HG3  ARG 103          2HG       ARG 103  -3.163 -10.431   1.922
  794    HD2  ARG 103          1HD       ARG 103  -3.923 -11.663   0.012
  795    HD3  ARG 103          2HD       ARG 103  -2.569 -11.093  -0.957
  796    HE   ARG 103           HE       ARG 103  -1.252 -12.412   0.884
  797   HH11  ARG 103          1HH1      ARG 103  -4.275 -13.263  -0.665
  798   HH12  ARG 103          2HH1      ARG 103  -3.948 -14.973  -0.643
  799   HH21  ARG 103          1HH2      ARG 103  -0.806 -14.656   0.894
  800   HH22  ARG 103          2HH2      ARG 103  -1.993 -15.765   0.281
  801    H    GLY 104           H        GLY 104  -1.451  -6.687  -0.321
  802    HA2  GLY 104          1HA       GLY 104   0.927  -7.303   1.122
  803    HA3  GLY 104          2HA       GLY 104   0.789  -6.161  -0.221
  804    H    PHE 105           H        PHE 105  -1.007  -4.361   0.806
  805    HA   PHE 105           HA       PHE 105   0.661  -2.684   2.307
  806    HB2  PHE 105          1HB       PHE 105  -0.950  -1.691   0.877
  807    HB3  PHE 105          2HB       PHE 105  -2.265  -2.582   1.622
  808    HD1  PHE 105           HD1      PHE 105   0.474  -0.486   3.038
  809    HD2  PHE 105           HD2      PHE 105  -3.722  -1.060   2.579
  810    HE1  PHE 105           HE1      PHE 105   0.044   1.459   4.486
  811    HE2  PHE 105           HE2      PHE 105  -4.150   0.873   4.031
  812    HZ   PHE 105           HZ       PHE 105  -2.265   2.137   4.987
  813    H    LYS 106           H        LYS 106  -2.151  -4.615   3.205
  814    HA   LYS 106           HA       LYS 106  -2.416  -3.754   5.852
  815    HB2  LYS 106          1HB       LYS 106  -4.291  -4.869   5.181
  816    HB3  LYS 106          2HB       LYS 106  -3.398  -6.072   4.258
  817    HG2  LYS 106          1HG       LYS 106  -2.770  -7.157   6.391
  818    HG3  LYS 106          2HG       LYS 106  -3.779  -5.980   7.241
  819    HD2  LYS 106          1HD       LYS 106  -5.752  -6.771   6.126
  820    HD3  LYS 106          2HD       LYS 106  -4.798  -7.816   5.076
  821    HE2  LYS 106          1HE       LYS 106  -4.130  -9.158   6.996
  822    HE3  LYS 106          2HE       LYS 106  -5.027  -8.092   8.072
  823    HZ1  LYS 106          1HZ       LYS 106  -6.280  -9.637   5.872
  824    HZ2  LYS 106          2HZ       LYS 106  -7.070  -8.777   7.102
  825    HZ3  LYS 106          3HZ       LYS 106  -6.194 -10.179   7.471
  826    H    CYS 107           H        CYS 107  -0.559  -6.424   4.467
  827    HA   CYS 107           HA       CYS 107   0.282  -7.568   6.875
  828    HB2  CYS 107          1HB       CYS 107   0.526  -8.842   4.903
  829    HB3  CYS 107          2HB       CYS 107   1.443  -7.579   4.089
  830    H    PHE 108           H        PHE 108   1.744  -5.047   4.862
  831    HA   PHE 108           HA       PHE 108   4.188  -5.002   6.335
  832    HB2  PHE 108          1HB       PHE 108   3.871  -4.407   3.903
  833    HB3  PHE 108          2HB       PHE 108   3.165  -2.887   4.451
  834    HD1  PHE 108           HD1      PHE 108   6.232  -4.889   4.229
  835    HD2  PHE 108           HD2      PHE 108   4.552  -1.139   5.342
  836    HE1  PHE 108           HE1      PHE 108   8.485  -3.915   4.351
  837    HE2  PHE 108           HE2      PHE 108   6.803  -0.161   5.459
  838    HZ   PHE 108           HZ       PHE 108   8.773  -1.549   4.961
  839    H    GLN 109           H        GLN 109   1.365  -2.848   6.157
  840    HA   GLN 109           HA       GLN 109   2.371  -0.886   7.923
  841    HB2  GLN 109          1HB       GLN 109   0.150   0.021   7.933
  842    HB3  GLN 109          2HB       GLN 109   0.528  -0.514   6.305
  843    HG2  GLN 109          1HG       GLN 109  -1.562  -1.352   6.449
  844    HG3  GLN 109          2HG       GLN 109  -0.708  -2.708   7.191
  845   HE21  GLN 109          1HE2      GLN 109  -2.460  -3.358   8.405
  846   HE22  GLN 109          2HE2      GLN 109  -3.064  -2.452   9.749
  847    H    LYS 110           H        LYS 110   1.282  -4.018   8.521
  848    HA   LYS 110           HA       LYS 110  -0.013  -3.717  10.996
  849    HB2  LYS 110          1HB       LYS 110  -0.119  -5.763   9.652
  850    HB3  LYS 110          2HB       LYS 110   1.591  -6.039   9.923
  851    HG2  LYS 110          1HG       LYS 110   1.206  -6.309  12.294
  852    HG3  LYS 110          2HG       LYS 110  -0.515  -6.010  12.064
  853    HD2  LYS 110          1HD       LYS 110   1.071  -8.297  10.896
  854    HD3  LYS 110          2HD       LYS 110  -0.053  -8.400  12.252
  855    HE2  LYS 110          1HE       LYS 110  -1.879  -7.695  10.770
  856    HE3  LYS 110          2HE       LYS 110  -0.748  -7.631   9.419
  857    HZ1  LYS 110          1HZ       LYS 110  -1.963  -9.688   9.388
  858    HZ2  LYS 110          2HZ       LYS 110  -1.492 -10.048  10.971
  859    HZ3  LYS 110          3HZ       LYS 110  -0.339 -10.010   9.736
  860    H    ASN 111           H        ASN 111   3.396  -3.993  10.119
  861    HA   ASN 111           HA       ASN 111   4.043  -3.555  12.956
  862    HB2  ASN 111          1HB       ASN 111   5.329  -5.376  13.046
  863    HB3  ASN 111          2HB       ASN 111   4.648  -5.848  11.499
  864   HD21  ASN 111          1HD2      ASN 111   5.865  -5.626   9.643
  865   HD22  ASN 111          2HD2      ASN 111   7.561  -5.298   9.677
  866    H    ASN 112           H        ASN 112   4.421  -2.508   9.738
  867    HA   ASN 112           HA       ASN 112   6.561  -0.676  10.600
  868    HB2  ASN 112          1HB       ASN 112   6.324  -2.168   7.990
  869    HB3  ASN 112          2HB       ASN 112   7.317  -0.716   8.170
  870   HD21  ASN 112          1HD2      ASN 112   7.933  -3.596   7.629
  871   HD22  ASN 112          2HD2      ASN 112   9.168  -3.990   8.785
  872    H    LEU 113           H        LEU 113   4.238   0.370  11.013
  873    HA   LEU 113           HA       LEU 113   3.159   1.562   8.612
  874    HB2  LEU 113          1HB       LEU 113   1.561   0.865  10.240
  875    HB3  LEU 113          2HB       LEU 113   2.341   1.806  11.496
  876    HG   LEU 113           HG       LEU 113   1.704   3.873  10.249
  877   HD11  LEU 113          1HD1      LEU 113   0.114   3.745   8.448
  878   HD12  LEU 113          2HD1      LEU 113   0.060   1.988   8.572
  879   HD13  LEU 113          3HD1      LEU 113   1.535   2.785   8.027
  880   HD21  LEU 113          1HD2      LEU 113  -0.642   3.803  10.888
  881   HD22  LEU 113          2HD2      LEU 113   0.353   3.004  12.107
  882   HD23  LEU 113          3HD2      LEU 113  -0.583   2.041  10.963
  883    H    SER 114           H        SER 114   5.068   2.544  11.394
  884    HA   SER 114           HA       SER 114   4.971   5.327  10.998
  885    HB2  SER 114          1HB       SER 114   7.246   3.685  12.144
  886    HB3  SER 114          2HB       SER 114   7.012   5.418  12.358
  887    HG   SER 114           HG       SER 114   5.367   5.065  13.696
  888    H    LEU 115           H        LEU 115   6.941   2.821   9.520
  889    HA   LEU 115           HA       LEU 115   8.766   4.497   8.180
  890    HB2  LEU 115          1HB       LEU 115   9.075   2.071   8.446
  891    HB3  LEU 115          2HB       LEU 115   7.722   1.787   7.371
  892    HG   LEU 115           HG       LEU 115   8.982   2.918   5.550
  893   HD11  LEU 115          1HD1      LEU 115  11.150   2.944   7.628
  894   HD12  LEU 115          2HD1      LEU 115  10.429   4.328   6.809
  895   HD13  LEU 115          3HD1      LEU 115  11.429   3.190   5.904
  896   HD21  LEU 115          1HD2      LEU 115   8.986   0.490   5.732
  897   HD22  LEU 115          2HD2      LEU 115  10.360   0.564   6.834
  898   HD23  LEU 115          3HD2      LEU 115  10.547   1.077   5.158
  899    H    ILE 116           H        ILE 116   5.607   3.206   7.314
  900    HA   ILE 116           HA       ILE 116   5.529   4.014   4.644
  901    HB   ILE 116           HB       ILE 116   3.313   3.553   6.643
  902   HG12  ILE 116          1HG1      ILE 116   4.291   1.900   4.303
  903   HG13  ILE 116          2HG1      ILE 116   4.737   1.621   5.993
  904   HG21  ILE 116          1HG2      ILE 116   1.777   3.474   4.738
  905   HG22  ILE 116          2HG2      ILE 116   3.082   3.990   3.671
  906   HG23  ILE 116          3HG2      ILE 116   2.492   5.077   4.929
  907   HD11  ILE 116          1HD1      ILE 116   1.969   1.454   4.824
  908   HD12  ILE 116          2HD1      ILE 116   2.378   1.204   6.519
  909   HD13  ILE 116          3HD1      ILE 116   2.988   0.096   5.290
  910    H    LYS 117           H        LYS 117   4.506   5.635   7.602
  911    HA   LYS 117           HA       LYS 117   3.450   7.955   6.419
  912    HB2  LYS 117          1HB       LYS 117   4.616   7.448   9.149
  913    HB3  LYS 117          2HB       LYS 117   3.880   8.976   8.692
  914    HG2  LYS 117          1HG       LYS 117   1.765   7.824   8.259
  915    HG3  LYS 117          2HG       LYS 117   2.498   6.292   8.733
  916    HD2  LYS 117          1HD       LYS 117   2.886   7.153  10.978
  917    HD3  LYS 117          2HD       LYS 117   2.227   8.721  10.513
  918    HE2  LYS 117          1HE       LYS 117   0.055   7.685  10.091
  919    HE3  LYS 117          2HE       LYS 117   0.714   6.110  10.535
  920    HZ1  LYS 117          1HZ       LYS 117  -0.507   7.133  12.359
  921    HZ2  LYS 117          2HZ       LYS 117   0.532   8.463  12.337
  922    HZ3  LYS 117          3HZ       LYS 117   1.124   6.937  12.757
  923    H    ALA 118           H        ALA 118   6.698   7.077   7.454
  924    HA   ALA 118           HA       ALA 118   7.786   9.704   7.062
  925    HB1  ALA 118          1HB       ALA 118   8.713   8.209   8.716
  926    HB2  ALA 118          2HB       ALA 118   9.934   8.622   7.512
  927    HB3  ALA 118          3HB       ALA 118   9.138   7.048   7.461
  928    H    SER 119           H        SER 119   7.268   6.943   5.044
  929    HA   SER 119           HA       SER 119   9.311   7.408   3.153
  930    HB2  SER 119          1HB       SER 119   6.655   6.012   2.764
  931    HB3  SER 119          2HB       SER 119   8.058   5.883   1.702
  932    HG   SER 119           HG       SER 119   8.188   5.240   4.456
  933    H    ILE 120           H        ILE 120   6.008   8.586   3.429
  934    HA   ILE 120           HA       ILE 120   6.196   9.970   0.868
  935    HB   ILE 120           HB       ILE 120   3.863  10.688   1.339
  936   HG12  ILE 120          1HG1      ILE 120   4.027   8.848   3.726
  937   HG13  ILE 120          2HG1      ILE 120   4.152  10.601   3.846
  938   HG21  ILE 120          1HG2      ILE 120   4.389   7.730   1.551
  939   HG22  ILE 120          2HG2      ILE 120   4.271   8.670   0.062
  940   HG23  ILE 120          3HG2      ILE 120   2.851   8.461   1.089
  941   HD11  ILE 120          1HD1      ILE 120   1.794   9.046   2.820
  942   HD12  ILE 120          2HD1      ILE 120   1.916  10.804   2.867
  943   HD13  ILE 120          3HD1      ILE 120   1.917   9.880   4.368
  944    H    LYS 121           H        LYS 121   7.367  10.585   3.804
  945    HA   LYS 121           HA       LYS 121   6.498  13.339   4.074
  946    HB2  LYS 121          1HB       LYS 121   6.734  11.980   6.082
  947    HB3  LYS 121          2HB       LYS 121   8.422  11.673   5.702
  948    HG2  LYS 121          1HG       LYS 121   8.914  14.058   5.966
  949    HG3  LYS 121          2HG       LYS 121   7.220  14.356   6.353
  950    HD2  LYS 121          1HD       LYS 121   8.540  14.246   8.386
  951    HD3  LYS 121          2HD       LYS 121   7.417  12.890   8.311
  952    HE2  LYS 121          1HE       LYS 121   9.611  12.171   9.093
  953    HE3  LYS 121          2HE       LYS 121   9.219  11.430   7.545
  954    HZ1  LYS 121          1HZ       LYS 121  11.517  12.238   7.673
  955    HZ2  LYS 121          2HZ       LYS 121  10.952  13.816   7.882
  956    HZ3  LYS 121          3HZ       LYS 121  10.645  12.993   6.438
  957    H    LYS 122           H        LYS 122   7.606  15.065   3.428
  958    HA   LYS 122           HA       LYS 122  10.304  14.708   2.335
  959    HB2  LYS 122          1HB       LYS 122   9.153  17.387   2.183
  960    HB3  LYS 122          2HB       LYS 122   9.897  16.421   0.942
  961    HG2  LYS 122          1HG       LYS 122   7.798  15.164   0.663
  962    HG3  LYS 122          2HG       LYS 122   7.039  16.227   1.851
  963    HD2  LYS 122          1HD       LYS 122   8.335  17.192  -0.696
  964    HD3  LYS 122          2HD       LYS 122   6.611  16.858  -0.533
  965    HE2  LYS 122          1HE       LYS 122   8.129  18.833   1.168
  966    HE3  LYS 122          2HE       LYS 122   7.217  19.263  -0.277
  967    HZ1  LYS 122          1HZ       LYS 122   6.114  18.035   2.190
  968    HZ2  LYS 122          2HZ       LYS 122   5.222  18.356   0.785
  969    HZ3  LYS 122          3HZ       LYS 122   5.890  19.631   1.679
  970    H    ASP 123           H        ASP 123  11.914  15.042   3.675
  971    HA   ASP 123           HA       ASP 123  11.503  16.443   6.162
  972    HB2  ASP 123          1HB       ASP 123  12.876  14.417   6.120
  973    HB3  ASP 123          2HB       ASP 123  14.005  15.195   5.015
  974    H21  ACD 201           H21      ACD   1  -4.468   4.547   1.419
  975    H22  ACD 201           H22      ACD   1  -3.484   5.164   2.751
  976    H31  ACD 201           H31      ACD   1  -2.102   6.445   1.232
  977    H32  ACD 201           H32      ACD   1  -3.167   6.107  -0.128
  978    H41  ACD 201           H41      ACD   1  -2.603   3.676   0.054
  979    H42  ACD 201           H42      ACD   1  -1.172   4.674  -0.244
  980    H5   ACD 201           H5       ACD   1  -1.841   3.194   2.353
  981    H6   ACD 201           H6       ACD   1   0.361   3.912   2.952
  982    H71  ACD 201           H71      ACD   1   0.825   4.929   0.255
  983    H72  ACD 201           H72      ACD   1  -0.082   6.192   1.083
  984    H8   ACD 201           H8       ACD   1   1.798   6.576   2.664
  985    H9   ACD 201           H9       ACD   1   3.899   5.598   2.096
  986   H101  ACD 201          H101      ACD   1   2.814   4.661  -0.437
  987   H102  ACD 201          H102      ACD   1   2.352   3.428   0.738
  988    H11  ACD 201           H11      ACD   1   5.309   4.286   0.606
  989    H12  ACD 201           H12      ACD   1   5.626   1.956   0.274
  990   H131  ACD 201          H131      ACD   1   2.662   2.020  -0.462
  991   H132  ACD 201          H132      ACD   1   3.750   0.635  -0.578
  992    H14  ACD 201           H14      ACD   1   2.624   1.662   2.127
  993    H15  ACD 201           H15      ACD   1   2.475  -0.679   2.540
  994   H161  ACD 201          H161      ACD   1   2.648  -1.361  -0.256
  995   H162  ACD 201          H162      ACD   1   4.313  -0.969   0.177
  996   H171  ACD 201          H171      ACD   1   4.356  -2.656   1.909
  997   H172  ACD 201          H172      ACD   1   2.617  -2.936   1.760
  998   H181  ACD 201          H181      ACD   1   4.658  -3.467  -0.441
  999   H182  ACD 201          H182      ACD   1   2.930  -3.814  -0.525
 1000   H191  ACD 201          H191      ACD   1   4.926  -5.061   1.418
 1001   H192  ACD 201          H192      ACD   1   3.184  -5.353   1.460
 1002   H201  ACD 201          H201      ACD   1   3.303  -6.256  -0.832
 1003   H202  ACD 201          H202      ACD   1   4.349  -7.132   0.231
 1004   H203  ACD 201          H203      ACD   1   5.008  -5.970  -0.868
  Start of MODEL    7
    1    H1   MET   1          1H        MET   1  12.286  13.050 -16.298
    2    H2   MET   1          2H        MET   1  11.965  13.926 -17.703
    3    H3   MET   1          3H        MET   1  11.395  14.484 -16.217
    4    HA   MET   1           HA       MET   1  14.232  14.262 -17.035
    5    HB2  MET   1          1HB       MET   1  12.490  16.686 -16.528
    6    HB3  MET   1          2HB       MET   1  14.214  16.731 -16.863
    7    HG2  MET   1          1HG       MET   1  13.812  15.777 -19.074
    8    HG3  MET   1          2HG       MET   1  12.083  15.732 -18.736
    9    HE1  MET   1          1HE       MET   1  11.571  17.086 -20.955
   10    HE2  MET   1          2HE       MET   1  13.295  17.121 -21.327
   11    HE3  MET   1          3HE       MET   1  12.351  18.610 -21.374
   12    H    GLU   2           H        GLU   2  12.080  15.756 -14.620
   13    HA   GLU   2           HA       GLU   2  14.175  15.548 -12.609
   14    HB2  GLU   2          1HB       GLU   2  11.424  16.781 -12.504
   15    HB3  GLU   2          2HB       GLU   2  12.610  16.842 -11.207
   16    HG2  GLU   2          1HG       GLU   2  14.089  18.162 -12.548
   17    HG3  GLU   2          2HG       GLU   2  13.049  17.966 -13.956
   18    H    PHE   3           H        PHE   3  14.268  13.980 -11.163
   19    HA   PHE   3           HA       PHE   3  12.397  11.838 -11.219
   20    HB2  PHE   3          1HB       PHE   3  14.781  11.494 -10.726
   21    HB3  PHE   3          2HB       PHE   3  14.600  12.393  -9.216
   22    HD1  PHE   3           HD1      PHE   3  13.390   9.404 -11.040
   23    HD2  PHE   3           HD2      PHE   3  14.003  11.261  -7.264
   24    HE1  PHE   3           HE1      PHE   3  12.805   7.295  -9.916
   25    HE2  PHE   3           HE2      PHE   3  13.421   9.155  -6.130
   26    HZ   PHE   3           HZ       PHE   3  12.820   7.169  -7.457
   27    H    THR   4           H        THR   4  10.457  11.919 -10.348
   28    HA   THR   4           HA       THR   4  10.067  13.533  -7.910
   29    HB   THR   4           HB       THR   4   7.659  13.101  -9.501
   30    HG1  THR   4           HG1      THR   4   9.972  14.107 -10.698
   31   HG21  THR   4          1HG2      THR   4   7.776  14.625  -7.619
   32   HG22  THR   4          2HG2      THR   4   7.414  15.509  -9.101
   33   HG23  THR   4          3HG2      THR   4   9.041  15.552  -8.423
   34    H    VAL   5           H        VAL   5   9.730  12.292  -6.248
   35    HA   VAL   5           HA       VAL   5   8.433   9.682  -6.550
   36    HB   VAL   5           HB       VAL   5   9.475   9.018  -4.646
   37   HG11  VAL   5          1HG1      VAL   5  11.260   9.965  -6.011
   38   HG12  VAL   5          2HG1      VAL   5  11.631   9.994  -4.289
   39   HG13  VAL   5          3HG1      VAL   5  11.137  11.474  -5.106
   40   HG21  VAL   5          1HG2      VAL   5   8.123  10.444  -3.186
   41   HG22  VAL   5          2HG2      VAL   5   9.237  11.783  -3.471
   42   HG23  VAL   5          3HG2      VAL   5   9.793  10.335  -2.630
   43    H    SER   6           H        SER   6   6.705   9.105  -5.064
   44    HA   SER   6           HA       SER   6   4.706  11.185  -5.149
   45    HB2  SER   6          1HB       SER   6   4.407   8.334  -4.173
   46    HB3  SER   6          2HB       SER   6   3.119   9.432  -4.673
   47    HG   SER   6           HG       SER   6   4.570   7.770  -6.184
   48    H    THR   7           H        THR   7   5.168  12.649  -3.539
   49    HA   THR   7           HA       THR   7   5.653  11.777  -0.825
   50    HB   THR   7           HB       THR   7   5.760  14.178  -0.291
   51    HG1  THR   7           HG1      THR   7   4.969  14.453  -3.028
   52   HG21  THR   7          1HG2      THR   7   7.307  13.375  -2.750
   53   HG22  THR   7          2HG2      THR   7   7.766  13.061  -1.077
   54   HG23  THR   7          3HG2      THR   7   7.716  14.716  -1.684
   55    H    THR   8           H        THR   8   4.360  13.447   0.802
   56    HA   THR   8           HA       THR   8   1.794  12.380   1.085
   57    HB   THR   8           HB       THR   8   2.691  15.046   2.182
   58    HG1  THR   8           HG1      THR   8   3.965  12.824   2.516
   59   HG21  THR   8          1HG2      THR   8   1.222  14.387   4.075
   60   HG22  THR   8          2HG2      THR   8   0.722  12.974   3.145
   61   HG23  THR   8          3HG2      THR   8   0.354  14.593   2.555
   62    H    GLU   9           H        GLU   9   2.909  15.387  -0.348
   63    HA   GLU   9           HA       GLU   9   0.426  16.572  -0.823
   64    HB2  GLU   9          1HB       GLU   9   3.009  16.879  -2.358
   65    HB3  GLU   9          2HB       GLU   9   1.637  17.978  -2.429
   66    HG2  GLU   9          1HG       GLU   9   1.923  18.580  -0.131
   67    HG3  GLU   9          2HG       GLU   9   3.179  17.363   0.076
   68    H    ASP  10           H        ASP  10   2.435  14.482  -2.859
   69    HA   ASP  10           HA       ASP  10   0.698  14.463  -5.099
   70    HB2  ASP  10          1HB       ASP  10   2.671  12.315  -4.280
   71    HB3  ASP  10          2HB       ASP  10   1.967  12.552  -5.878
   72    H    LEU  11           H        LEU  11   1.012  12.452  -2.239
   73    HA   LEU  11           HA       LEU  11  -0.687  10.381  -3.025
   74    HB2  LEU  11          1HB       LEU  11   0.829  10.135  -1.166
   75    HB3  LEU  11          2HB       LEU  11  -0.026  11.386  -0.253
   76    HG   LEU  11           HG       LEU  11  -2.028   9.889  -0.266
   77   HD11  LEU  11          1HD1      LEU  11  -1.763   7.569  -0.852
   78   HD12  LEU  11          2HD1      LEU  11  -0.080   7.844  -1.303
   79   HD13  LEU  11          3HD1      LEU  11  -1.378   8.577  -2.244
   80   HD21  LEU  11          1HD2      LEU  11  -0.458  10.029   1.640
   81   HD22  LEU  11          2HD2      LEU  11   0.448   8.677   0.958
   82   HD23  LEU  11          3HD2      LEU  11  -1.217   8.444   1.490
   83    H    GLN  12           H        GLN  12  -1.335  13.501  -1.577
   84    HA   GLN  12           HA       GLN  12  -4.013  13.035  -0.826
   85    HB2  GLN  12          1HB       GLN  12  -2.546  15.569  -1.531
   86    HB3  GLN  12          2HB       GLN  12  -4.217  15.551  -0.984
   87    HG2  GLN  12          1HG       GLN  12  -1.843  14.543   0.565
   88    HG3  GLN  12          2HG       GLN  12  -2.687  16.064   0.839
   89   HE21  GLN  12          1HE2      GLN  12  -2.787  12.621   1.211
   90   HE22  GLN  12          2HE2      GLN  12  -4.149  12.571   2.273
   91    H    ARG  13           H        ARG  13  -2.506  13.875  -3.843
   92    HA   ARG  13           HA       ARG  13  -4.891  14.570  -5.227
   93    HB2  ARG  13          1HB       ARG  13  -2.757  15.317  -6.082
   94    HB3  ARG  13          2HB       ARG  13  -2.190  13.660  -6.232
   95    HG2  ARG  13          1HG       ARG  13  -3.951  13.242  -7.911
   96    HG3  ARG  13          2HG       ARG  13  -4.407  14.953  -7.811
   97    HD2  ARG  13          1HD       ARG  13  -2.268  15.627  -8.642
   98    HD3  ARG  13          2HD       ARG  13  -1.654  13.977  -8.542
   99    HE   ARG  13           HE       ARG  13  -3.814  13.790 -10.203
  100   HH11  ARG  13          1HH1      ARG  13  -0.894  15.732 -10.192
  101   HH12  ARG  13          2HH1      ARG  13  -0.778  15.800 -11.921
  102   HH21  ARG  13          1HH2      ARG  13  -3.664  13.872 -12.477
  103   HH22  ARG  13          2HH2      ARG  13  -2.368  14.752 -13.224
  104    H    TYR  14           H        TYR  14  -2.806  11.672  -5.462
  105    HA   TYR  14           HA       TYR  14  -4.432  10.251  -7.217
  106    HB2  TYR  14          1HB       TYR  14  -2.670   9.007  -5.102
  107    HB3  TYR  14          2HB       TYR  14  -3.184   8.285  -6.618
  108    HD1  TYR  14           HD1      TYR  14  -2.651  10.210  -8.644
  109    HD2  TYR  14           HD2      TYR  14  -0.388   9.363  -5.140
  110    HE1  TYR  14           HE1      TYR  14  -0.619  11.029  -9.764
  111    HE2  TYR  14           HE2      TYR  14   1.645  10.187  -6.247
  112    HH   TYR  14           HH       TYR  14   1.584  11.946  -9.141
  113    H    ARG  15           H        ARG  15  -4.478  10.371  -3.707
  114    HA   ARG  15           HA       ARG  15  -6.191   8.163  -3.346
  115    HB2  ARG  15          1HB       ARG  15  -5.340   8.487  -1.318
  116    HB3  ARG  15          2HB       ARG  15  -4.845  10.120  -1.725
  117    HG2  ARG  15          1HG       ARG  15  -7.026  10.968  -1.057
  118    HG3  ARG  15          2HG       ARG  15  -7.581   9.321  -0.737
  119    HD2  ARG  15          1HD       ARG  15  -5.801   9.079   0.957
  120    HD3  ARG  15          2HD       ARG  15  -5.326  10.750   0.677
  121    HE   ARG  15           HE       ARG  15  -7.830  11.134   1.347
  122   HH11  ARG  15          1HH1      ARG  15  -5.570   8.835   2.721
  123   HH12  ARG  15          2HH1      ARG  15  -6.252   8.931   4.315
  124   HH21  ARG  15          1HH2      ARG  15  -8.736  11.262   3.433
  125   HH22  ARG  15          2HH2      ARG  15  -8.067  10.309   4.717
  126    H    THR  16           H        THR  16  -6.758  11.587  -3.799
  127    HA   THR  16           HA       THR  16  -9.538  11.529  -3.220
  128    HB   THR  16           HB       THR  16  -7.850  13.496  -4.771
  129    HG1  THR  16           HG1      THR  16  -7.235  13.905  -2.788
  130   HG21  THR  16          1HG2      THR  16 -10.670  13.804  -3.738
  131   HG22  THR  16          2HG2      THR  16 -10.195  13.678  -5.432
  132   HG23  THR  16          3HG2      THR  16  -9.696  15.075  -4.479
  133    H    GLU  17           H        GLU  17  -7.654  11.506  -6.230
  134    HA   GLU  17           HA       GLU  17  -9.813  11.403  -8.030
  135    HB2  GLU  17          1HB       GLU  17  -7.229   9.989  -8.627
  136    HB3  GLU  17          2HB       GLU  17  -8.256  10.916  -9.699
  137    HG2  GLU  17          1HG       GLU  17  -7.556  12.979  -8.738
  138    HG3  GLU  17          2HG       GLU  17  -6.650  12.142  -7.476
  139    H    CYS  18           H        CYS  18  -8.127   8.841  -6.279
  140    HA   CYS  18           HA       CYS  18  -9.516   6.713  -7.565
  141    HB2  CYS  18          1HB       CYS  18  -8.011   6.820  -4.946
  142    HB3  CYS  18          2HB       CYS  18  -8.736   5.349  -5.607
  143    H    VAL  19           H        VAL  19 -10.136   8.711  -4.753
  144    HA   VAL  19           HA       VAL  19 -12.234   7.203  -3.661
  145    HB   VAL  19           HB       VAL  19 -11.385  10.054  -3.406
  146   HG11  VAL  19          1HG1      VAL  19 -13.935   8.971  -2.217
  147   HG12  VAL  19          2HG1      VAL  19 -13.843  10.134  -3.541
  148   HG13  VAL  19          3HG1      VAL  19 -13.236  10.567  -1.941
  149   HG21  VAL  19          1HG2      VAL  19 -10.263   8.400  -2.060
  150   HG22  VAL  19          2HG2      VAL  19 -11.808   7.776  -1.477
  151   HG23  VAL  19          3HG2      VAL  19 -11.281   9.397  -1.019
  152    H    SER  20           H        SER  20 -12.282   9.969  -5.863
  153    HA   SER  20           HA       SER  20 -15.059  10.042  -6.236
  154    HB2  SER  20          1HB       SER  20 -12.885  10.875  -8.169
  155    HB3  SER  20          2HB       SER  20 -14.563  11.420  -8.193
  156    HG   SER  20           HG       SER  20 -13.638  11.860  -5.755
  157    H    SER  21           H        SER  21 -12.548   8.184  -7.921
  158    HA   SER  21           HA       SER  21 -14.271   7.408 -10.074
  159    HB2  SER  21          1HB       SER  21 -11.584   6.324  -9.209
  160    HB3  SER  21          2HB       SER  21 -12.375   5.996 -10.754
  161    HG   SER  21           HG       SER  21 -11.063   8.276  -9.864
  162    H    LEU  22           H        LEU  22 -13.061   5.779  -7.139
  163    HA   LEU  22           HA       LEU  22 -14.396   3.323  -7.880
  164    HB2  LEU  22          1HB       LEU  22 -12.789   4.136  -5.471
  165    HB3  LEU  22          2HB       LEU  22 -13.534   2.544  -5.642
  166    HG   LEU  22           HG       LEU  22 -11.537   3.671  -7.595
  167   HD11  LEU  22          1HD1      LEU  22  -9.940   2.144  -6.502
  168   HD12  LEU  22          2HD1      LEU  22 -11.149   1.807  -5.262
  169   HD13  LEU  22          3HD1      LEU  22 -10.487   3.433  -5.429
  170   HD21  LEU  22          1HD2      LEU  22 -12.536   0.867  -7.135
  171   HD22  LEU  22          2HD2      LEU  22 -11.384   1.388  -8.368
  172   HD23  LEU  22          3HD2      LEU  22 -13.061   1.931  -8.440
  173    H    ASN  23           H        ASN  23 -15.739   5.994  -7.002
  174    HA   ASN  23           HA       ASN  23 -17.591   6.681  -5.871
  175    HB2  ASN  23          1HB       ASN  23 -18.272   3.742  -6.006
  176    HB3  ASN  23          2HB       ASN  23 -19.398   5.030  -5.636
  177   HD21  ASN  23          1HD2      ASN  23 -17.590   3.443  -8.109
  178   HD22  ASN  23          2HD2      ASN  23 -18.341   4.239  -9.451
  179    H    ILE  24           H        ILE  24 -15.323   6.199  -4.251
  180    HA   ILE  24           HA       ILE  24 -15.982   4.707  -1.929
  181    HB   ILE  24           HB       ILE  24 -13.980   6.958  -2.123
  182   HG12  ILE  24          1HG1      ILE  24 -13.568   5.302  -3.909
  183   HG13  ILE  24          2HG1      ILE  24 -12.301   5.269  -2.686
  184   HG21  ILE  24          1HG2      ILE  24 -14.167   4.577  -0.285
  185   HG22  ILE  24          2HG2      ILE  24 -14.488   6.258   0.142
  186   HG23  ILE  24          3HG2      ILE  24 -12.858   5.758  -0.303
  187   HD11  ILE  24          1HD1      ILE  24 -13.307   3.275  -1.706
  188   HD12  ILE  24          2HD1      ILE  24 -12.896   3.036  -3.404
  189   HD13  ILE  24          3HD1      ILE  24 -14.573   3.315  -2.935
  190    HA   PRO  25           HA       PRO  25 -18.847   7.722  -0.240
  191    HB2  PRO  25          1HB       PRO  25 -18.633   6.039   2.153
  192    HB3  PRO  25          2HB       PRO  25 -20.054   6.443   1.186
  193    HG2  PRO  25          1HG       PRO  25 -18.949   3.992   1.179
  194    HG3  PRO  25          2HG       PRO  25 -19.745   4.690  -0.242
  195    HD2  PRO  25          1HD       PRO  25 -16.830   4.393   0.348
  196    HD3  PRO  25          2HD       PRO  25 -17.696   4.250  -1.202
  197    H    ALA  26           H        ALA  26 -18.644   9.431   1.050
  198    HA   ALA  26           HA       ALA  26 -16.188  10.392   1.885
  199    HB1  ALA  26          1HB       ALA  26 -18.901  11.105   2.987
  200    HB2  ALA  26          2HB       ALA  26 -18.185  11.766   1.518
  201    HB3  ALA  26          3HB       ALA  26 -17.445  12.094   3.086
  202    H    ASP  27           H        ASP  27 -18.532   8.468   3.632
  203    HA   ASP  27           HA       ASP  27 -17.636   8.631   6.231
  204    HB2  ASP  27          1HB       ASP  27 -18.700   6.249   4.710
  205    HB3  ASP  27          2HB       ASP  27 -18.441   6.249   6.450
  206    H    TYR  28           H        TYR  28 -16.529   6.267   3.780
  207    HA   TYR  28           HA       TYR  28 -14.514   5.150   5.352
  208    HB2  TYR  28          1HB       TYR  28 -15.052   5.248   2.413
  209    HB3  TYR  28          2HB       TYR  28 -13.531   4.568   2.992
  210    HD1  TYR  28           HD1      TYR  28 -13.464   2.392   3.957
  211    HD2  TYR  28           HD2      TYR  28 -17.216   4.235   3.157
  212    HE1  TYR  28           HE1      TYR  28 -14.601   0.264   4.417
  213    HE2  TYR  28           HE2      TYR  28 -18.361   2.106   3.612
  214    HH   TYR  28           HH       TYR  28 -17.824  -0.317   3.603
  215    H    VAL  29           H        VAL  29 -14.496   7.950   3.224
  216    HA   VAL  29           HA       VAL  29 -11.746   8.415   3.076
  217    HB   VAL  29           HB       VAL  29 -13.970  10.438   3.093
  218   HG11  VAL  29          1HG1      VAL  29 -11.849  11.517   3.465
  219   HG12  VAL  29          2HG1      VAL  29 -12.371  11.827   1.809
  220   HG13  VAL  29          3HG1      VAL  29 -11.124  10.620   2.133
  221   HG21  VAL  29          1HG2      VAL  29 -12.654   8.940   0.841
  222   HG22  VAL  29          2HG2      VAL  29 -13.791  10.275   0.639
  223   HG23  VAL  29          3HG2      VAL  29 -14.321   8.771   1.393
  224    H    GLU  30           H        GLU  30 -14.125   9.427   5.515
  225    HA   GLU  30           HA       GLU  30 -12.459  11.038   7.121
  226    HB2  GLU  30          1HB       GLU  30 -14.585   9.212   8.247
  227    HB3  GLU  30          2HB       GLU  30 -14.018  10.758   8.862
  228    HG2  GLU  30          1HG       GLU  30 -15.396  10.574   6.222
  229    HG3  GLU  30          2HG       GLU  30 -16.294  10.696   7.732
  230    H    LYS  31           H        LYS  31 -12.893   7.550   7.016
  231    HA   LYS  31           HA       LYS  31 -11.369   6.947   9.326
  232    HB2  LYS  31          1HB       LYS  31 -11.899   5.214   6.906
  233    HB3  LYS  31          2HB       LYS  31 -11.311   4.658   8.479
  234    HG2  LYS  31          1HG       LYS  31 -13.413   5.434   9.501
  235    HG3  LYS  31          2HG       LYS  31 -13.996   5.896   7.901
  236    HD2  LYS  31          1HD       LYS  31 -13.669   3.523   7.182
  237    HD3  LYS  31          2HD       LYS  31 -13.299   3.125   8.872
  238    HE2  LYS  31          1HE       LYS  31 -15.870   4.414   7.953
  239    HE3  LYS  31          2HE       LYS  31 -15.675   2.682   8.219
  240    HZ1  LYS  31          1HZ       LYS  31 -15.234   3.079  10.520
  241    HZ2  LYS  31          2HZ       LYS  31 -16.667   3.877  10.116
  242    HZ3  LYS  31          3HZ       LYS  31 -15.235   4.756  10.299
  243    H    PHE  32           H        PHE  32 -10.579   7.029   5.878
  244    HA   PHE  32           HA       PHE  32  -7.956   6.074   6.102
  245    HB2  PHE  32          1HB       PHE  32  -9.040   7.896   3.954
  246    HB3  PHE  32          2HB       PHE  32  -7.628   6.855   3.832
  247    HD1  PHE  32           HD1      PHE  32 -10.194   6.995   2.084
  248    HD2  PHE  32           HD2      PHE  32  -8.942   4.463   5.263
  249    HE1  PHE  32           HE1      PHE  32 -11.613   5.192   1.200
  250    HE2  PHE  32           HE2      PHE  32 -10.358   2.657   4.387
  251    HZ   PHE  32           HZ       PHE  32 -11.693   3.017   2.351
  252    H    LYS  33           H        LYS  33  -9.263   9.169   6.841
  253    HA   LYS  33           HA       LYS  33  -6.774  10.598   6.536
  254    HB2  LYS  33          1HB       LYS  33  -9.248  11.501   6.484
  255    HB3  LYS  33          2HB       LYS  33  -9.028  11.593   8.228
  256    HG2  LYS  33          1HG       LYS  33  -7.102  13.028   7.955
  257    HG3  LYS  33          2HG       LYS  33  -7.233  12.899   6.194
  258    HD2  LYS  33          1HD       LYS  33  -9.451  13.960   6.309
  259    HD3  LYS  33          2HD       LYS  33  -9.272  14.122   8.058
  260    HE2  LYS  33          1HE       LYS  33  -7.505  15.380   5.962
  261    HE3  LYS  33          2HE       LYS  33  -8.729  16.213   6.919
  262    HZ1  LYS  33          1HZ       LYS  33  -6.257  14.926   7.950
  263    HZ2  LYS  33          2HZ       LYS  33  -7.457  15.619   8.918
  264    HZ3  LYS  33          3HZ       LYS  33  -6.566  16.586   7.862
  265    H    LYS  34           H        LYS  34  -8.049   8.452   8.796
  266    HA   LYS  34           HA       LYS  34  -6.127   9.385  10.818
  267    HB2  LYS  34          1HB       LYS  34  -8.775   7.998  11.100
  268    HB3  LYS  34          2HB       LYS  34  -7.563   7.858  12.368
  269    HG2  LYS  34          1HG       LYS  34  -7.549  10.288  12.609
  270    HG3  LYS  34          2HG       LYS  34  -8.753  10.422  11.328
  271    HD2  LYS  34          1HD       LYS  34 -10.329   9.123  12.677
  272    HD3  LYS  34          2HD       LYS  34  -9.120   8.983  13.955
  273    HE2  LYS  34          1HE       LYS  34  -9.109  11.429  14.184
  274    HE3  LYS  34          2HE       LYS  34 -10.345  11.543  12.934
  275    HZ1  LYS  34          1HZ       LYS  34 -11.326  11.670  15.122
  276    HZ2  LYS  34          2HZ       LYS  34 -10.642  10.187  15.557
  277    HZ3  LYS  34          3HZ       LYS  34 -11.825  10.249  14.353
  278    H    TRP  35           H        TRP  35  -5.772   7.672   8.424
  279    HA   TRP  35           HA       TRP  35  -4.786   5.755   7.744
  280    HB2  TRP  35          1HB       TRP  35  -3.661   5.966  10.534
  281    HB3  TRP  35          2HB       TRP  35  -3.099   4.778   9.353
  282    HD1  TRP  35           HD1      TRP  35  -2.926   8.488  10.200
  283    HE1  TRP  35           HE1      TRP  35  -1.129   9.602   8.730
  284    HE3  TRP  35           HE3      TRP  35  -1.936   4.595   7.032
  285    HZ2  TRP  35           HZ2      TRP  35   0.496   8.918   6.526
  286    HZ3  TRP  35           HZ3      TRP  35  -0.250   4.906   5.276
  287    HH2  TRP  35           HH2      TRP  35   0.946   7.016   5.024
  288    H    GLU  36           H        GLU  36  -7.427   5.434   8.728
  289    HA   GLU  36           HA       GLU  36  -7.325   2.773   9.955
  290    HB2  GLU  36          1HB       GLU  36  -9.490   4.862   9.890
  291    HB3  GLU  36          2HB       GLU  36  -9.806   3.193  10.344
  292    HG2  GLU  36          1HG       GLU  36  -7.775   4.940  11.700
  293    HG3  GLU  36          2HG       GLU  36  -9.441   4.767  12.246
  294    H    PHE  37           H        PHE  37  -7.367   1.223   8.509
  295    HA   PHE  37           HA       PHE  37  -9.081   1.558   6.133
  296    HB2  PHE  37          1HB       PHE  37  -6.588  -0.152   6.335
  297    HB3  PHE  37          2HB       PHE  37  -7.516   0.179   4.882
  298    HD1  PHE  37           HD1      PHE  37  -7.158   2.175   3.619
  299    HD2  PHE  37           HD2      PHE  37  -5.244   1.633   7.386
  300    HE1  PHE  37           HE1      PHE  37  -5.713   4.112   3.164
  301    HE2  PHE  37           HE2      PHE  37  -3.793   3.563   6.928
  302    HZ   PHE  37           HZ       PHE  37  -4.029   4.807   4.817
  303    HA   PRO  38           HA       PRO  38 -11.008  -1.986   8.393
  304    HB2  PRO  38          1HB       PRO  38 -13.239  -1.142   6.641
  305    HB3  PRO  38          2HB       PRO  38 -13.225  -1.474   8.384
  306    HG2  PRO  38          1HG       PRO  38 -13.415   1.025   7.496
  307    HG3  PRO  38          2HG       PRO  38 -12.420   0.633   8.912
  308    HD2  PRO  38          1HD       PRO  38 -11.541   1.123   6.073
  309    HD3  PRO  38          2HD       PRO  38 -10.829   1.730   7.601
  310    H    GLU  39           H        GLU  39 -11.376  -4.020   7.664
  311    HA   GLU  39           HA       GLU  39 -10.496  -4.672   5.033
  312    HB2  GLU  39          1HB       GLU  39 -11.691  -6.402   7.200
  313    HB3  GLU  39          2HB       GLU  39 -11.053  -7.019   5.682
  314    HG2  GLU  39          1HG       GLU  39  -8.862  -6.043   6.248
  315    HG3  GLU  39          2HG       GLU  39  -9.513  -5.553   7.808
  316    H    ASP  40           H        ASP  40 -11.883  -3.664   3.672
  317    HA   ASP  40           HA       ASP  40 -14.380  -5.072   3.130
  318    HB2  ASP  40          1HB       ASP  40 -15.084  -3.172   4.538
  319    HB3  ASP  40          2HB       ASP  40 -14.243  -2.054   3.468
  320    H    ASP  41           H        ASP  41 -14.988  -4.951   0.959
  321    HA   ASP  41           HA       ASP  41 -12.848  -4.982  -0.842
  322    HB2  ASP  41          1HB       ASP  41 -14.494  -5.260  -2.615
  323    HB3  ASP  41          2HB       ASP  41 -14.937  -6.242  -1.225
  324    H    THR  42           H        THR  42 -14.982  -2.411   0.095
  325    HA   THR  42           HA       THR  42 -14.470  -0.567  -1.967
  326    HB   THR  42           HB       THR  42 -14.941   0.023   0.958
  327    HG1  THR  42           HG1      THR  42 -16.638  -1.229   0.417
  328   HG21  THR  42          1HG2      THR  42 -14.312   1.984  -0.277
  329   HG22  THR  42          2HG2      THR  42 -16.043   2.051   0.057
  330   HG23  THR  42          3HG2      THR  42 -15.470   1.601  -1.550
  331    H    THR  43           H        THR  43 -13.048  -0.712   1.284
  332    HA   THR  43           HA       THR  43 -10.996   1.123   0.931
  333    HB   THR  43           HB       THR  43 -10.952  -1.318   2.707
  334    HG1  THR  43           HG1      THR  43 -11.760   0.469   4.224
  335   HG21  THR  43          1HG2      THR  43  -9.584   0.160   4.177
  336   HG22  THR  43          2HG2      THR  43  -9.542   1.345   2.870
  337   HG23  THR  43          3HG2      THR  43  -8.801  -0.239   2.646
  338    H    MET  44           H        MET  44 -11.126  -2.308   0.193
  339    HA   MET  44           HA       MET  44  -8.348  -2.730   0.004
  340    HB2  MET  44          1HB       MET  44 -10.611  -4.275  -1.260
  341    HB3  MET  44          2HB       MET  44  -8.948  -4.829  -1.149
  342    HG2  MET  44          1HG       MET  44  -9.090  -4.797   1.283
  343    HG3  MET  44          2HG       MET  44 -10.749  -4.218   1.183
  344    HE1  MET  44          1HE       MET  44  -9.828  -6.721   2.877
  345    HE2  MET  44          2HE       MET  44 -11.100  -7.887   2.506
  346    HE3  MET  44          3HE       MET  44 -11.510  -6.195   2.790
  347    H    CYS  45           H        CYS  45 -10.812  -2.128  -2.496
  348    HA   CYS  45           HA       CYS  45  -8.808  -2.192  -4.555
  349    HB2  CYS  45          1HB       CYS  45 -11.523  -2.572  -4.595
  350    HB3  CYS  45          2HB       CYS  45 -11.368  -0.957  -5.291
  351    H    TYR  46           H        TYR  46 -10.199   0.217  -2.502
  352    HA   TYR  46           HA       TYR  46  -9.427   2.527  -3.864
  353    HB2  TYR  46          1HB       TYR  46 -10.720   2.897  -1.961
  354    HB3  TYR  46          2HB       TYR  46  -9.747   1.812  -0.969
  355    HD1  TYR  46           HD1      TYR  46  -9.410   5.047  -2.841
  356    HD2  TYR  46           HD2      TYR  46  -8.309   2.734   0.563
  357    HE1  TYR  46           HE1      TYR  46  -8.172   6.969  -1.933
  358    HE2  TYR  46           HE2      TYR  46  -7.070   4.649   1.473
  359    HH   TYR  46           HH       TYR  46  -6.145   6.693   0.905
  360    H    ILE  47           H        ILE  47  -7.651   0.510  -1.565
  361    HA   ILE  47           HA       ILE  47  -5.194   1.818  -1.713
  362    HB   ILE  47           HB       ILE  47  -5.819  -1.078  -1.169
  363   HG12  ILE  47          1HG1      ILE  47  -6.779   0.445   0.468
  364   HG13  ILE  47          2HG1      ILE  47  -5.429  -0.421   1.198
  365   HG21  ILE  47          1HG2      ILE  47  -3.560  -1.219  -0.181
  366   HG22  ILE  47          2HG2      ILE  47  -3.212   0.393  -0.806
  367   HG23  ILE  47          3HG2      ILE  47  -3.530  -0.936  -1.923
  368   HD11  ILE  47          1HD1      ILE  47  -5.515   2.436   0.274
  369   HD12  ILE  47          2HD1      ILE  47  -4.020   1.608   0.713
  370   HD13  ILE  47          3HD1      ILE  47  -5.293   1.825   1.914
  371    H    LYS  48           H        LYS  48  -6.612  -0.702  -3.724
  372    HA   LYS  48           HA       LYS  48  -4.369  -1.377  -5.234
  373    HB2  LYS  48          1HB       LYS  48  -6.534  -2.614  -5.224
  374    HB3  LYS  48          2HB       LYS  48  -7.241  -1.314  -6.170
  375    HG2  LYS  48          1HG       LYS  48  -5.708  -1.778  -7.999
  376    HG3  LYS  48          2HG       LYS  48  -4.934  -3.041  -7.039
  377    HD2  LYS  48          1HD       LYS  48  -6.998  -4.310  -6.993
  378    HD3  LYS  48          2HD       LYS  48  -7.834  -3.029  -7.868
  379    HE2  LYS  48          1HE       LYS  48  -5.448  -4.500  -8.956
  380    HE3  LYS  48          2HE       LYS  48  -7.107  -5.011  -9.240
  381    HZ1  LYS  48          1HZ       LYS  48  -7.541  -2.882 -10.295
  382    HZ2  LYS  48          2HZ       LYS  48  -6.275  -3.694 -11.069
  383    HZ3  LYS  48          3HZ       LYS  48  -5.942  -2.399 -10.033
  384    H    CYS  49           H        CYS  49  -6.948   0.971  -5.953
  385    HA   CYS  49           HA       CYS  49  -5.916   1.909  -8.360
  386    HB2  CYS  49          1HB       CYS  49  -8.151   2.430  -7.810
  387    HB3  CYS  49          2HB       CYS  49  -7.694   3.238  -6.313
  388    H    VAL  50           H        VAL  50  -5.435   3.171  -5.062
  389    HA   VAL  50           HA       VAL  50  -3.928   5.412  -5.780
  390    HB   VAL  50           HB       VAL  50  -4.006   3.845  -3.203
  391   HG11  VAL  50          1HG1      VAL  50  -1.929   5.083  -3.286
  392   HG12  VAL  50          2HG1      VAL  50  -3.047   5.867  -2.166
  393   HG13  VAL  50          3HG1      VAL  50  -2.790   6.544  -3.774
  394   HG21  VAL  50          1HG2      VAL  50  -6.124   4.807  -3.776
  395   HG22  VAL  50          2HG2      VAL  50  -5.365   6.362  -4.110
  396   HG23  VAL  50          3HG2      VAL  50  -5.406   5.738  -2.461
  397    H    PHE  51           H        PHE  51  -2.957   2.183  -4.726
  398    HA   PHE  51           HA       PHE  51  -0.190   2.630  -4.786
  399    HB2  PHE  51          1HB       PHE  51  -1.980   0.258  -4.655
  400    HB3  PHE  51          2HB       PHE  51  -0.296  -0.023  -5.088
  401    HD1  PHE  51           HD1      PHE  51   0.238  -1.273  -3.130
  402    HD2  PHE  51           HD2      PHE  51  -1.389   2.647  -2.802
  403    HE1  PHE  51           HE1      PHE  51   0.809  -1.239  -0.739
  404    HE2  PHE  51           HE2      PHE  51  -0.815   2.687  -0.411
  405    HZ   PHE  51           HZ       PHE  51   0.284   0.744   0.623
  406    H    ASN  52           H        ASN  52  -2.509   1.918  -7.224
  407    HA   ASN  52           HA       ASN  52  -0.673   0.924  -9.192
  408    HB2  ASN  52          1HB       ASN  52  -3.051   0.293  -9.215
  409    HB3  ASN  52          2HB       ASN  52  -3.502   1.980  -9.477
  410   HD21  ASN  52          1HD2      ASN  52  -0.771   0.370 -11.001
  411   HD22  ASN  52          2HD2      ASN  52  -1.410   0.422 -12.608
  412    H    LYS  53           H        LYS  53  -2.253   4.016  -8.515
  413    HA   LYS  53           HA       LYS  53  -1.185   5.286 -10.843
  414    HB2  LYS  53          1HB       LYS  53  -2.607   6.316  -8.401
  415    HB3  LYS  53          2HB       LYS  53  -2.016   7.400  -9.651
  416    HG2  LYS  53          1HG       LYS  53  -3.421   5.858 -11.235
  417    HG3  LYS  53          2HG       LYS  53  -4.238   5.399  -9.741
  418    HD2  LYS  53          1HD       LYS  53  -5.476   7.186 -10.719
  419    HD3  LYS  53          2HD       LYS  53  -4.629   7.844  -9.317
  420    HE2  LYS  53          1HE       LYS  53  -2.910   8.769 -10.759
  421    HE3  LYS  53          2HE       LYS  53  -3.669   8.039 -12.172
  422    HZ1  LYS  53          1HZ       LYS  53  -4.810  10.178 -10.452
  423    HZ2  LYS  53          2HZ       LYS  53  -5.628   9.426 -11.732
  424    HZ3  LYS  53          3HZ       LYS  53  -4.246  10.344 -12.043
  425    H    MET  54           H        MET  54  -0.116   4.780  -7.608
  426    HA   MET  54           HA       MET  54   1.980   6.771  -7.767
  427    HB2  MET  54          1HB       MET  54   1.202   4.725  -5.701
  428    HB3  MET  54          2HB       MET  54   2.668   5.692  -5.559
  429    HG2  MET  54          1HG       MET  54   1.447   7.685  -5.394
  430    HG3  MET  54          2HG       MET  54  -0.038   6.917  -5.944
  431    HE1  MET  54          1HE       MET  54   1.786   6.635  -1.734
  432    HE2  MET  54          2HE       MET  54   2.395   7.612  -3.070
  433    HE3  MET  54          3HE       MET  54   2.624   5.864  -3.082
  434    H    GLN  55           H        GLN  55   1.560   3.967  -9.253
  435    HA   GLN  55           HA       GLN  55   2.817   2.399 -10.230
  436    HB2  GLN  55          1HB       GLN  55   4.704   4.682  -9.964
  437    HB3  GLN  55          2HB       GLN  55   5.291   3.151 -10.625
  438    HG2  GLN  55          1HG       GLN  55   3.581   3.248 -12.346
  439    HG3  GLN  55          2HG       GLN  55   2.962   4.743 -11.658
  440   HE21  GLN  55          1HE2      GLN  55   3.314   5.917 -13.512
  441   HE22  GLN  55          2HE2      GLN  55   4.897   6.343 -14.066
  442    H    LEU  56           H        LEU  56   2.396   1.828  -7.650
  443    HA   LEU  56           HA       LEU  56   4.961   0.840  -6.662
  444    HB2  LEU  56          1HB       LEU  56   2.757   2.262  -5.356
  445    HB3  LEU  56          2HB       LEU  56   3.330   0.856  -4.446
  446    HG   LEU  56           HG       LEU  56   5.022   3.163  -5.408
  447   HD11  LEU  56          1HD1      LEU  56   3.967   2.506  -2.663
  448   HD12  LEU  56          2HD1      LEU  56   3.509   3.883  -3.661
  449   HD13  LEU  56          3HD1      LEU  56   5.147   3.763  -3.024
  450   HD21  LEU  56          1HD2      LEU  56   6.678   2.161  -3.809
  451   HD22  LEU  56          2HD2      LEU  56   6.391   1.228  -5.278
  452   HD23  LEU  56          3HD2      LEU  56   5.647   0.732  -3.757
  453    H    PHE  57           H        PHE  57   1.804   0.072  -7.678
  454    HA   PHE  57           HA       PHE  57   2.306  -2.755  -7.120
  455    HB2  PHE  57          1HB       PHE  57   0.738  -2.099  -5.376
  456    HB3  PHE  57          2HB       PHE  57  -0.299  -1.307  -6.554
  457    HD1  PHE  57           HD1      PHE  57  -1.892  -2.528  -7.822
  458    HD2  PHE  57           HD2      PHE  57   0.893  -4.569  -5.328
  459    HE1  PHE  57           HE1      PHE  57  -3.183  -4.605  -8.083
  460    HE2  PHE  57           HE2      PHE  57  -0.393  -6.649  -5.591
  461    HZ   PHE  57           HZ       PHE  57  -2.432  -6.667  -6.968
  462    H    ASP  58           H        ASP  58   1.877  -4.035  -8.804
  463    HA   ASP  58           HA       ASP  58   0.517  -2.838 -11.125
  464    HB2  ASP  58          1HB       ASP  58   2.891  -3.369 -11.555
  465    HB3  ASP  58          2HB       ASP  58   2.612  -5.037 -11.069
  466    H    ASP  59           H        ASP  59  -1.128  -3.943 -12.052
  467    HA   ASP  59           HA       ASP  59  -2.632  -5.628 -10.349
  468    HB2  ASP  59          1HB       ASP  59  -3.667  -4.085 -11.945
  469    HB3  ASP  59          2HB       ASP  59  -3.017  -5.008 -13.283
  470    H    THR  60           H        THR  60  -0.304  -6.261 -12.808
  471    HA   THR  60           HA       THR  60  -1.116  -9.048 -13.049
  472    HB   THR  60           HB       THR  60   0.909  -7.377 -14.523
  473    HG1  THR  60           HG1      THR  60  -1.689  -7.859 -14.848
  474   HG21  THR  60          1HG2      THR  60   1.796  -9.632 -14.316
  475   HG22  THR  60          2HG2      THR  60   1.278  -9.317 -15.973
  476   HG23  THR  60          3HG2      THR  60   0.276 -10.301 -14.906
  477    H    GLU  61           H        GLU  61   2.004  -7.340 -12.561
  478    HA   GLU  61           HA       GLU  61   3.268  -9.726 -11.604
  479    HB2  GLU  61          1HB       GLU  61   4.402  -6.963 -11.322
  480    HB3  GLU  61          2HB       GLU  61   5.242  -8.490 -11.525
  481    HG2  GLU  61          1HG       GLU  61   4.404  -8.653 -13.809
  482    HG3  GLU  61          2HG       GLU  61   3.593  -7.104 -13.612
  483    H    GLY  62           H        GLY  62   1.379  -7.357 -10.064
  484    HA2  GLY  62          1HA       GLY  62   0.732  -7.357  -7.818
  485    HA3  GLY  62          2HA       GLY  62   2.044  -8.482  -7.467
  486    HA   PRO  63           HA       PRO  63   3.368  -4.480  -5.642
  487    HB2  PRO  63          1HB       PRO  63   4.924  -5.632  -3.708
  488    HB3  PRO  63          2HB       PRO  63   3.186  -5.348  -3.530
  489    HG2  PRO  63          1HG       PRO  63   4.645  -7.847  -4.257
  490    HG3  PRO  63          2HG       PRO  63   3.264  -7.638  -3.173
  491    HD2  PRO  63          1HD       PRO  63   3.028  -8.563  -5.697
  492    HD3  PRO  63          2HD       PRO  63   1.750  -7.598  -4.922
  493    H    LEU  64           H        LEU  64   4.964  -3.413  -6.627
  494    HA   LEU  64           HA       LEU  64   7.194  -4.886  -7.788
  495    HB2  LEU  64          1HB       LEU  64   6.762  -1.892  -7.811
  496    HB3  LEU  64          2HB       LEU  64   7.915  -2.793  -8.764
  497    HG   LEU  64           HG       LEU  64   6.264  -2.263 -10.285
  498   HD11  LEU  64          1HD1      LEU  64   5.723  -5.027  -9.258
  499   HD12  LEU  64          2HD1      LEU  64   6.822  -4.535 -10.548
  500   HD13  LEU  64          3HD1      LEU  64   5.075  -4.391 -10.773
  501   HD21  LEU  64          1HD2      LEU  64   4.186  -3.079  -8.274
  502   HD22  LEU  64          2HD2      LEU  64   3.877  -2.518  -9.916
  503   HD23  LEU  64          3HD2      LEU  64   4.598  -1.428  -8.735
  504    H    VAL  65           H        VAL  65   8.482  -5.580  -6.267
  505    HA   VAL  65           HA       VAL  65   8.969  -4.574  -3.775
  506    HB   VAL  65           HB       VAL  65  10.804  -6.205  -5.511
  507   HG11  VAL  65          1HG1      VAL  65  11.893  -6.902  -3.425
  508   HG12  VAL  65          2HG1      VAL  65  10.907  -5.745  -2.531
  509   HG13  VAL  65          3HG1      VAL  65  12.082  -5.172  -3.717
  510   HG21  VAL  65          1HG2      VAL  65   8.776  -6.945  -3.419
  511   HG22  VAL  65          2HG2      VAL  65   9.903  -8.076  -4.167
  512   HG23  VAL  65          3HG2      VAL  65   8.683  -7.270  -5.149
  513    H    ASP  66           H        ASP  66  10.903  -3.947  -6.706
  514    HA   ASP  66           HA       ASP  66  12.931  -2.498  -5.430
  515    HB2  ASP  66          1HB       ASP  66  13.184  -3.345  -7.685
  516    HB3  ASP  66          2HB       ASP  66  11.929  -2.258  -8.267
  517    H    ASN  67           H        ASN  67  10.055  -1.282  -7.154
  518    HA   ASN  67           HA       ASN  67  10.422   1.433  -6.629
  519    HB2  ASN  67          1HB       ASN  67   7.840  -0.109  -6.960
  520    HB3  ASN  67          2HB       ASN  67   7.974   1.639  -7.011
  521   HD21  ASN  67          1HD2      ASN  67   7.093   1.612  -9.101
  522   HD22  ASN  67          2HD2      ASN  67   8.046   1.154 -10.474
  523    H    LEU  68           H        LEU  68   8.947  -1.126  -4.778
  524    HA   LEU  68           HA       LEU  68   7.756   0.407  -2.760
  525    HB2  LEU  68          1HB       LEU  68   8.632  -2.446  -3.003
  526    HB3  LEU  68          2HB       LEU  68   8.077  -1.829  -1.454
  527    HG   LEU  68           HG       LEU  68   6.419  -1.539  -3.942
  528   HD11  LEU  68          1HD1      LEU  68   6.349  -3.829  -1.980
  529   HD12  LEU  68          2HD1      LEU  68   6.943  -3.920  -3.638
  530   HD13  LEU  68          3HD1      LEU  68   5.241  -3.570  -3.331
  531   HD21  LEU  68          1HD2      LEU  68   5.843  -0.160  -2.011
  532   HD22  LEU  68          2HD2      LEU  68   5.735  -1.609  -1.013
  533   HD23  LEU  68          3HD2      LEU  68   4.600  -1.367  -2.341
  534    H    VAL  69           H        VAL  69  10.948  -1.100  -2.973
  535    HA   VAL  69           HA       VAL  69  11.849  -0.246  -0.424
  536    HB   VAL  69           HB       VAL  69  13.419  -1.010  -2.875
  537   HG11  VAL  69          1HG1      VAL  69  15.228  -1.480  -1.238
  538   HG12  VAL  69          2HG1      VAL  69  14.243  -0.693   0.001
  539   HG13  VAL  69          3HG1      VAL  69  14.824   0.231  -1.383
  540   HG21  VAL  69          1HG2      VAL  69  13.612  -3.190  -1.798
  541   HG22  VAL  69          2HG2      VAL  69  11.925  -2.770  -2.097
  542   HG23  VAL  69          3HG2      VAL  69  12.598  -2.622  -0.471
  543    H    HIS  70           H        HIS  70  12.151   1.107  -3.688
  544    HA   HIS  70           HA       HIS  70  13.906   3.205  -2.973
  545    HB2  HIS  70          1HB       HIS  70  12.076   2.754  -5.307
  546    HB3  HIS  70          2HB       HIS  70  12.907   4.295  -5.112
  547    HD1  HIS  70           HD1      HIS  70  15.211   4.421  -6.032
  548    HD2  HIS  70           HD2      HIS  70  13.975   0.498  -5.463
  549    HE1  HIS  70           HE1      HIS  70  17.026   2.991  -7.017
  550    HE2  HIS  70           HE2      HIS  70  16.151   0.633  -6.839
  551    H    GLN  71           H        GLN  71  10.487   2.837  -2.664
  552    HA   GLN  71           HA       GLN  71  10.077   5.669  -2.106
  553    HB2  GLN  71          1HB       GLN  71   8.426   4.157  -3.359
  554    HB3  GLN  71          2HB       GLN  71   8.052   3.469  -1.782
  555    HG2  GLN  71          1HG       GLN  71   6.435   5.170  -2.382
  556    HG3  GLN  71          2HG       GLN  71   7.361   5.636  -0.961
  557   HE21  GLN  71          1HE2      GLN  71   8.749   7.355  -1.063
  558   HE22  GLN  71          2HE2      GLN  71   8.759   8.474  -2.375
  559    H    LEU  72           H        LEU  72   9.531   2.601  -0.388
  560    HA   LEU  72           HA       LEU  72   8.821   3.789   2.045
  561    HB2  LEU  72          1HB       LEU  72   9.796   1.022   1.403
  562    HB3  LEU  72          2HB       LEU  72   9.312   1.501   3.016
  563    HG   LEU  72           HG       LEU  72   7.524   1.594   0.587
  564   HD11  LEU  72          1HD1      LEU  72   8.096  -0.705   1.190
  565   HD12  LEU  72          2HD1      LEU  72   6.413  -0.349   1.586
  566   HD13  LEU  72          3HD1      LEU  72   7.632  -0.390   2.863
  567   HD21  LEU  72          1HD2      LEU  72   7.039   2.103   3.514
  568   HD22  LEU  72          2HD2      LEU  72   5.749   1.796   2.352
  569   HD23  LEU  72          3HD2      LEU  72   6.785   3.207   2.159
  570    H    ALA  73           H        ALA  73  11.942   2.489   0.964
  571    HA   ALA  73           HA       ALA  73  13.240   2.879   3.469
  572    HB1  ALA  73          1HB       ALA  73  14.496   2.507   0.766
  573    HB2  ALA  73          2HB       ALA  73  13.905   1.199   1.792
  574    HB3  ALA  73          3HB       ALA  73  15.240   2.217   2.341
  575    H    HIS  74           H        HIS  74  11.959   5.256   2.579
  576    HA   HIS  74           HA       HIS  74  13.748   7.134   1.445
  577    HB2  HIS  74          1HB       HIS  74  11.240   7.348   1.541
  578    HB3  HIS  74          2HB       HIS  74  11.398   7.698   3.257
  579    HD1  HIS  74           HD1      HIS  74  11.628   9.227  -0.082
  580    HD2  HIS  74           HD2      HIS  74  12.630  10.237   3.824
  581    HE1  HIS  74           HE1      HIS  74  11.977  11.715  -0.095
  582    HE2  HIS  74           HE2      HIS  74  12.800  12.258   2.218
  583    H    GLY  75           H        GLY  75  15.710   7.018   2.518
  584    HA2  GLY  75          1HA       GLY  75  17.201   7.996   4.011
  585    HA3  GLY  75          2HA       GLY  75  15.840   8.526   4.989
  586    H    ARG  76           H        ARG  76  16.212   5.205   3.956
  587    HA   ARG  76           HA       ARG  76  17.304   4.416   6.533
  588    HB2  ARG  76          1HB       ARG  76  14.490   4.027   5.756
  589    HB3  ARG  76          2HB       ARG  76  15.288   2.593   6.392
  590    HG2  ARG  76          1HG       ARG  76  15.980   3.972   8.364
  591    HG3  ARG  76          2HG       ARG  76  14.937   5.254   7.753
  592    HD2  ARG  76          1HD       ARG  76  13.013   3.828   7.926
  593    HD3  ARG  76          2HD       ARG  76  14.018   2.461   8.396
  594    HE   ARG  76           HE       ARG  76  14.379   4.629  10.182
  595   HH11  ARG  76          1HH1      ARG  76  12.099   2.112   9.347
  596   HH12  ARG  76          2HH1      ARG  76  11.393   2.047  10.928
  597   HH21  ARG  76          1HH2      ARG  76  13.454   4.554  12.264
  598   HH22  ARG  76          2HH2      ARG  76  12.159   3.442  12.590
  599    H    ASP  77           H        ASP  77  17.663   2.026   6.627
  600    HA   ASP  77           HA       ASP  77  19.230   1.184   4.482
  601    HB2  ASP  77          1HB       ASP  77  18.009  -0.441   6.716
  602    HB3  ASP  77          2HB       ASP  77  19.241  -1.034   5.609
  603    H    ALA  78           H        ALA  78  18.421   0.924   2.549
  604    HA   ALA  78           HA       ALA  78  15.884  -0.010   1.844
  605    HB1  ALA  78          1HB       ALA  78  16.847  -0.321  -0.382
  606    HB2  ALA  78          2HB       ALA  78  18.462  -0.133   0.298
  607    HB3  ALA  78          3HB       ALA  78  17.329   1.216   0.331
  608    H    GLU  79           H        GLU  79  18.835  -1.655   2.618
  609    HA   GLU  79           HA       GLU  79  18.359  -4.192   1.574
  610    HB2  GLU  79          1HB       GLU  79  19.867  -3.340   4.042
  611    HB3  GLU  79          2HB       GLU  79  19.887  -4.980   3.408
  612    HG2  GLU  79          1HG       GLU  79  20.832  -4.165   1.318
  613    HG3  GLU  79          2HG       GLU  79  20.814  -2.520   1.944
  614    H    GLU  80           H        GLU  80  17.516  -2.880   4.771
  615    HA   GLU  80           HA       GLU  80  16.223  -5.229   5.693
  616    HB2  GLU  80          1HB       GLU  80  16.073  -2.346   6.538
  617    HB3  GLU  80          2HB       GLU  80  15.155  -3.615   7.339
  618    HG2  GLU  80          1HG       GLU  80  17.346  -4.771   7.749
  619    HG3  GLU  80          2HG       GLU  80  18.129  -3.300   7.186
  620    H    VAL  81           H        VAL  81  15.054  -2.201   4.320
  621    HA   VAL  81           HA       VAL  81  12.331  -2.611   4.490
  622    HB   VAL  81           HB       VAL  81  13.885  -1.117   2.384
  623   HG11  VAL  81          1HG1      VAL  81  10.969  -0.942   3.124
  624   HG12  VAL  81          2HG1      VAL  81  11.629  -1.523   1.595
  625   HG13  VAL  81          3HG1      VAL  81  11.818   0.174   2.051
  626   HG21  VAL  81          1HG2      VAL  81  13.216   0.829   3.828
  627   HG22  VAL  81          2HG2      VAL  81  14.415  -0.264   4.508
  628   HG23  VAL  81          3HG2      VAL  81  12.737  -0.353   5.047
  629    H    ARG  82           H        ARG  82  14.518  -3.479   1.815
  630    HA   ARG  82           HA       ARG  82  12.711  -4.589   0.046
  631    HB2  ARG  82          1HB       ARG  82  15.126  -4.201  -0.362
  632    HB3  ARG  82          2HB       ARG  82  15.491  -5.600   0.637
  633    HG2  ARG  82          1HG       ARG  82  14.189  -7.001  -0.918
  634    HG3  ARG  82          2HG       ARG  82  13.968  -5.586  -1.948
  635    HD2  ARG  82          1HD       ARG  82  16.418  -5.375  -2.116
  636    HD3  ARG  82          2HD       ARG  82  16.587  -6.856  -1.177
  637    HE   ARG  82           HE       ARG  82  14.937  -7.260  -3.459
  638   HH11  ARG  82          1HH1      ARG  82  18.278  -6.924  -2.468
  639   HH12  ARG  82          2HH1      ARG  82  18.899  -7.853  -3.792
  640   HH21  ARG  82          1HH2      ARG  82  15.746  -8.480  -5.208
  641   HH22  ARG  82          2HH2      ARG  82  17.457  -8.744  -5.354
  642    H    THR  83           H        THR  83  14.355  -6.131   2.776
  643    HA   THR  83           HA       THR  83  13.392  -8.736   2.265
  644    HB   THR  83           HB       THR  83  14.553  -7.413   4.705
  645    HG1  THR  83           HG1      THR  83  16.384  -8.339   4.046
  646   HG21  THR  83          1HG2      THR  83  14.762  -9.651   5.707
  647   HG22  THR  83          2HG2      THR  83  13.805 -10.321   4.384
  648   HG23  THR  83          3HG2      THR  83  13.076  -9.172   5.508
  649    H    GLU  84           H        GLU  84  12.413  -6.295   4.682
  650    HA   GLU  84           HA       GLU  84  10.284  -7.724   5.771
  651    HB2  GLU  84          1HB       GLU  84  10.589  -4.723   5.589
  652    HB3  GLU  84          2HB       GLU  84   9.549  -5.598   6.704
  653    HG2  GLU  84          1HG       GLU  84  11.576  -6.700   7.623
  654    HG3  GLU  84          2HG       GLU  84  12.552  -5.636   6.620
  655    H    VAL  85           H        VAL  85  10.361  -5.596   2.934
  656    HA   VAL  85           HA       VAL  85   7.590  -5.583   2.416
  657    HB   VAL  85           HB       VAL  85   9.993  -5.290   0.620
  658   HG11  VAL  85          1HG1      VAL  85   8.463  -4.638  -1.189
  659   HG12  VAL  85          2HG1      VAL  85   7.092  -5.116  -0.185
  660   HG13  VAL  85          3HG1      VAL  85   8.252  -6.328  -0.726
  661   HG21  VAL  85          1HG2      VAL  85   9.190  -2.980   0.455
  662   HG22  VAL  85          2HG2      VAL  85   9.520  -3.455   2.122
  663   HG23  VAL  85          3HG2      VAL  85   7.855  -3.378   1.540
  664    H    LEU  86           H        LEU  86  10.172  -7.715   1.192
  665    HA   LEU  86           HA       LEU  86   8.636  -9.339  -0.445
  666    HB2  LEU  86          1HB       LEU  86  11.150  -9.904   1.117
  667    HB3  LEU  86          2HB       LEU  86  10.438 -11.063  -0.000
  668    HG   LEU  86           HG       LEU  86  11.226  -8.291  -0.847
  669   HD11  LEU  86          1HD1      LEU  86  13.305  -9.233  -1.661
  670   HD12  LEU  86          2HD1      LEU  86  12.870 -10.815  -1.009
  671   HD13  LEU  86          3HD1      LEU  86  13.177  -9.464   0.082
  672   HD21  LEU  86          1HD2      LEU  86  10.678 -10.863  -2.315
  673   HD22  LEU  86          2HD2      LEU  86  11.284  -9.385  -3.063
  674   HD23  LEU  86          3HD2      LEU  86   9.685  -9.405  -2.321
  675    H    LYS  87           H        LYS  87   9.077  -9.438   3.026
  676    HA   LYS  87           HA       LYS  87   7.949 -12.042   3.396
  677    HB2  LYS  87          1HB       LYS  87   8.439  -9.753   5.302
  678    HB3  LYS  87          2HB       LYS  87   7.784 -11.306   5.807
  679    HG2  LYS  87          1HG       LYS  87   9.795 -12.427   5.035
  680    HG3  LYS  87          2HG       LYS  87  10.458 -10.879   4.487
  681    HD2  LYS  87          1HD       LYS  87  10.465 -10.059   6.770
  682    HD3  LYS  87          2HD       LYS  87   9.729 -11.559   7.335
  683    HE2  LYS  87          1HE       LYS  87  12.436 -11.282   6.036
  684    HE3  LYS  87          2HE       LYS  87  12.132 -11.549   7.751
  685    HZ1  LYS  87          1HZ       LYS  87  11.052 -13.664   7.137
  686    HZ2  LYS  87          2HZ       LYS  87  12.687 -13.617   6.720
  687    HZ3  LYS  87          3HZ       LYS  87  11.508 -13.416   5.526
  688    H    CYS  88           H        CYS  88   6.617  -9.126   2.529
  689    HA   CYS  88           HA       CYS  88   3.980  -9.899   3.566
  690    HB2  CYS  88          1HB       CYS  88   5.203  -7.247   2.917
  691    HB3  CYS  88          2HB       CYS  88   3.440  -7.437   2.840
  692    H    VAL  89           H        VAL  89   5.910  -9.732   0.797
  693    HA   VAL  89           HA       VAL  89   3.826  -9.429  -1.143
  694    HB   VAL  89           HB       VAL  89   6.623 -10.530  -1.437
  695   HG11  VAL  89          1HG1      VAL  89   6.271 -10.105  -3.853
  696   HG12  VAL  89          2HG1      VAL  89   4.577  -9.751  -3.504
  697   HG13  VAL  89          3HG1      VAL  89   5.222 -11.365  -3.204
  698   HG21  VAL  89          1HG2      VAL  89   5.497  -7.799  -2.051
  699   HG22  VAL  89          2HG2      VAL  89   7.126  -8.345  -2.453
  700   HG23  VAL  89          3HG2      VAL  89   6.639  -8.199  -0.766
  701    H    ASP  90           H        ASP  90   2.268 -10.894  -1.179
  702    HA   ASP  90           HA       ASP  90   3.021 -13.730  -1.123
  703    HB2  ASP  90          1HB       ASP  90   0.666 -12.360   0.141
  704    HB3  ASP  90          2HB       ASP  90   0.619 -14.081  -0.242
  705    H    LYS  91           H        LYS  91   1.129 -15.081  -2.017
  706    HA   LYS  91           HA       LYS  91   0.607 -14.177  -4.724
  707    HB2  LYS  91          1HB       LYS  91  -0.315 -16.762  -3.481
  708    HB3  LYS  91          2HB       LYS  91  -0.021 -16.402  -5.179
  709    HG2  LYS  91          1HG       LYS  91   2.367 -16.207  -4.723
  710    HG3  LYS  91          2HG       LYS  91   2.066 -16.623  -3.039
  711    HD2  LYS  91          1HD       LYS  91   1.346 -18.392  -5.369
  712    HD3  LYS  91          2HD       LYS  91   2.849 -18.528  -4.457
  713    HE2  LYS  91          1HE       LYS  91   1.525 -18.903  -2.403
  714    HE3  LYS  91          2HE       LYS  91   0.053 -18.852  -3.371
  715    HZ1  LYS  91          1HZ       LYS  91   0.859 -20.768  -4.616
  716    HZ2  LYS  91          2HZ       LYS  91   0.741 -21.122  -2.968
  717    HZ3  LYS  91          3HZ       LYS  91   2.256 -20.827  -3.663
  718    H    ASN  92           H        ASN  92  -1.483 -14.242  -5.682
  719    HA   ASN  92           HA       ASN  92  -3.530 -13.097  -4.007
  720    HB2  ASN  92          1HB       ASN  92  -3.020 -12.446  -6.426
  721    HB3  ASN  92          2HB       ASN  92  -3.809 -13.947  -6.887
  722   HD21  ASN  92          1HD2      ASN  92  -4.628 -11.357  -7.643
  723   HD22  ASN  92          2HD2      ASN  92  -6.198 -11.078  -6.978
  724    H    THR  93           H        THR  93  -3.985 -14.847  -2.570
  725    HA   THR  93           HA       THR  93  -4.811 -17.390  -3.670
  726    HB   THR  93           HB       THR  93  -5.148 -18.061  -1.315
  727    HG1  THR  93           HG1      THR  93  -5.140 -16.621   0.253
  728   HG21  THR  93          1HG2      THR  93  -2.788 -17.893  -0.638
  729   HG22  THR  93          2HG2      THR  93  -2.525 -16.716  -1.926
  730   HG23  THR  93          3HG2      THR  93  -2.982 -18.371  -2.321
  731    H    ASP  94           H        ASP  94  -6.353 -14.493  -2.567
  732    HA   ASP  94           HA       ASP  94  -8.914 -15.811  -2.191
  733    HB2  ASP  94          1HB       ASP  94  -9.767 -13.666  -1.522
  734    HB3  ASP  94          2HB       ASP  94  -8.193 -13.893  -0.751
  735    H    ASN  95           H        ASN  95  -7.144 -14.547  -4.720
  736    HA   ASN  95           HA       ASN  95  -7.502 -14.468  -6.936
  737    HB2  ASN  95          1HB       ASN  95 -10.181 -15.668  -6.245
  738    HB3  ASN  95          2HB       ASN  95  -9.545 -15.505  -7.871
  739   HD21  ASN  95          1HD2      ASN  95 -10.306 -17.862  -6.326
  740   HD22  ASN  95          2HD2      ASN  95  -8.903 -18.887  -6.306
  741    H    ASN  96           H        ASN  96  -8.417 -12.270  -5.057
  742    HA   ASN  96           HA       ASN  96  -9.817 -10.794  -7.180
  743    HB2  ASN  96          1HB       ASN  96 -11.461 -11.187  -5.472
  744    HB3  ASN  96          2HB       ASN  96 -10.361 -10.678  -4.201
  745   HD21  ASN  96          1HD2      ASN  96 -13.063  -9.793  -5.005
  746   HD22  ASN  96          2HD2      ASN  96 -12.944  -8.085  -5.239
  747    H    ALA  97           H        ALA  97  -8.704  -9.094  -7.865
  748    HA   ALA  97           HA       ALA  97  -6.061  -8.708  -6.960
  749    HB1  ALA  97          1HB       ALA  97  -6.757  -8.425  -9.292
  750    HB2  ALA  97          2HB       ALA  97  -5.909  -7.007  -8.676
  751    HB3  ALA  97          3HB       ALA  97  -7.663  -6.983  -8.836
  752    H    CYS  98           H        CYS  98  -9.037  -6.961  -6.284
  753    HA   CYS  98           HA       CYS  98  -7.838  -4.615  -5.224
  754    HB2  CYS  98          1HB       CYS  98 -10.487  -5.840  -4.421
  755    HB3  CYS  98          2HB       CYS  98 -10.001  -4.160  -4.208
  756    H    HIS  99           H        HIS  99  -8.641  -7.759  -3.875
  757    HA   HIS  99           HA       HIS  99  -8.058  -7.005  -1.158
  758    HB2  HIS  99          1HB       HIS  99  -9.657  -8.829  -1.840
  759    HB3  HIS  99          2HB       HIS  99  -8.271  -9.784  -2.342
  760    HD1  HIS  99           HD1      HIS  99 -10.527  -9.688   0.276
  761    HD2  HIS  99           HD2      HIS  99  -6.378  -9.876   0.162
  762    HE1  HIS  99           HE1      HIS  99  -9.835 -10.656   2.486
  763    HE2  HIS  99           HE2      HIS  99  -7.317 -10.578   2.468
  764    H    TRP 100           H        TRP 100  -6.350  -8.424  -3.851
  765    HA   TRP 100           HA       TRP 100  -4.158  -9.508  -2.493
  766    HB2  TRP 100          1HB       TRP 100  -4.706  -9.959  -4.872
  767    HB3  TRP 100          2HB       TRP 100  -4.177  -8.328  -5.284
  768    HD1  TRP 100           HD1      TRP 100  -1.935  -9.858  -2.738
  769    HE1  TRP 100           HE1      TRP 100   0.232 -10.684  -3.841
  770    HE3  TRP 100           HE3      TRP 100  -3.338  -9.527  -7.645
  771    HZ2  TRP 100           HZ2      TRP 100   1.215 -11.149  -6.439
  772    HZ3  TRP 100           HZ3      TRP 100  -1.727 -10.185  -9.378
  773    HH2  TRP 100           HH2      TRP 100   0.501 -10.983  -8.792
  774    H    ALA 101           H        ALA 101  -4.475  -6.330  -4.079
  775    HA   ALA 101           HA       ALA 101  -1.961  -5.329  -3.315
  776    HB1  ALA 101          1HB       ALA 101  -3.308  -4.315  -5.075
  777    HB2  ALA 101          2HB       ALA 101  -2.896  -3.122  -3.840
  778    HB3  ALA 101          3HB       ALA 101  -4.511  -3.827  -3.885
  779    H    PHE 102           H        PHE 102  -5.103  -5.262  -1.758
  780    HA   PHE 102           HA       PHE 102  -4.400  -3.550   0.362
  781    HB2  PHE 102          1HB       PHE 102  -6.706  -3.934  -0.280
  782    HB3  PHE 102          2HB       PHE 102  -6.582  -5.628   0.188
  783    HD1  PHE 102           HD1      PHE 102  -6.282  -2.185   1.543
  784    HD2  PHE 102           HD2      PHE 102  -7.183  -6.262   2.348
  785    HE1  PHE 102           HE1      PHE 102  -7.027  -1.568   3.805
  786    HE2  PHE 102           HE2      PHE 102  -7.929  -5.657   4.606
  787    HZ   PHE 102           HZ       PHE 102  -7.851  -3.306   5.343
  788    H    ARG 103           H        ARG 103  -4.075  -6.977  -0.167
  789    HA   ARG 103           HA       ARG 103  -3.646  -7.796   2.509
  790    HB2  ARG 103          1HB       ARG 103  -4.220  -9.335   0.638
  791    HB3  ARG 103          2HB       ARG 103  -2.619  -9.056  -0.031
  792    HG2  ARG 103          1HG       ARG 103  -1.585 -10.030   1.912
  793    HG3  ARG 103          2HG       ARG 103  -3.159 -10.231   2.674
  794    HD2  ARG 103          1HD       ARG 103  -3.834 -11.797   0.950
  795    HD3  ARG 103          2HD       ARG 103  -2.319 -11.543   0.085
  796    HE   ARG 103           HE       ARG 103  -1.869 -12.420   2.754
  797   HH11  ARG 103          1HH1      ARG 103  -2.791 -13.564  -0.436
  798   HH12  ARG 103          2HH1      ARG 103  -2.141 -15.153  -0.178
  799   HH21  ARG 103          1HH2      ARG 103  -1.033 -14.521   3.081
  800   HH22  ARG 103          2HH2      ARG 103  -1.164 -15.701   1.817
  801    H    GLY 104           H        GLY 104  -1.457  -6.861  -0.113
  802    HA2  GLY 104          1HA       GLY 104   0.970  -7.284   1.282
  803    HA3  GLY 104          2HA       GLY 104   0.748  -6.202  -0.098
  804    H    PHE 105           H        PHE 105  -1.059  -4.404   0.913
  805    HA   PHE 105           HA       PHE 105   0.624  -2.650   2.314
  806    HB2  PHE 105          1HB       PHE 105  -1.008  -1.713   0.879
  807    HB3  PHE 105          2HB       PHE 105  -2.310  -2.583   1.674
  808    HD1  PHE 105           HD1      PHE 105  -3.748  -1.070   2.676
  809    HD2  PHE 105           HD2      PHE 105   0.453  -0.418   2.923
  810    HE1  PHE 105           HE1      PHE 105  -4.140   0.895   4.094
  811    HE2  PHE 105           HE2      PHE 105   0.062   1.553   4.342
  812    HZ   PHE 105           HZ       PHE 105  -2.236   2.210   4.931
  813    H    LYS 106           H        LYS 106  -2.099  -4.639   3.340
  814    HA   LYS 106           HA       LYS 106  -2.294  -3.580   5.936
  815    HB2  LYS 106          1HB       LYS 106  -4.223  -4.625   5.279
  816    HB3  LYS 106          2HB       LYS 106  -3.393  -6.003   4.561
  817    HG2  LYS 106          1HG       LYS 106  -2.957  -6.888   6.788
  818    HG3  LYS 106          2HG       LYS 106  -3.694  -5.453   7.508
  819    HD2  LYS 106          1HD       LYS 106  -5.822  -6.026   6.407
  820    HD3  LYS 106          2HD       LYS 106  -5.076  -7.485   5.757
  821    HE2  LYS 106          1HE       LYS 106  -5.285  -6.865   8.697
  822    HE3  LYS 106          2HE       LYS 106  -6.465  -7.827   7.814
  823    HZ1  LYS 106          1HZ       LYS 106  -4.809  -9.179   8.983
  824    HZ2  LYS 106          2HZ       LYS 106  -3.581  -8.491   8.048
  825    HZ3  LYS 106          3HZ       LYS 106  -4.773  -9.435   7.314
  826    H    CYS 107           H        CYS 107  -0.568  -6.364   4.627
  827    HA   CYS 107           HA       CYS 107   0.313  -7.461   7.041
  828    HB2  CYS 107          1HB       CYS 107   0.498  -8.793   5.105
  829    HB3  CYS 107          2HB       CYS 107   1.398  -7.561   4.227
  830    H    PHE 108           H        PHE 108   1.677  -4.953   4.973
  831    HA   PHE 108           HA       PHE 108   4.180  -4.882   6.350
  832    HB2  PHE 108          1HB       PHE 108   3.760  -4.303   3.917
  833    HB3  PHE 108          2HB       PHE 108   3.106  -2.772   4.500
  834    HD1  PHE 108           HD1      PHE 108   6.115  -4.843   4.178
  835    HD2  PHE 108           HD2      PHE 108   4.566  -1.047   5.331
  836    HE1  PHE 108           HE1      PHE 108   8.395  -3.932   4.235
  837    HE2  PHE 108           HE2      PHE 108   6.848  -0.133   5.382
  838    HZ   PHE 108           HZ       PHE 108   8.764  -1.576   4.829
  839    H    GLN 109           H        GLN 109   1.392  -2.655   6.176
  840    HA   GLN 109           HA       GLN 109   2.422  -0.724   7.931
  841    HB2  GLN 109          1HB       GLN 109   0.176   0.148   8.064
  842    HB3  GLN 109          2HB       GLN 109   0.521  -0.328   6.411
  843    HG2  GLN 109          1HG       GLN 109  -1.472  -1.319   6.491
  844    HG3  GLN 109          2HG       GLN 109  -0.652  -2.580   7.417
  845   HE21  GLN 109          1HE2      GLN 109  -3.435  -1.756   7.512
  846   HE22  GLN 109          2HE2      GLN 109  -3.744  -1.277   9.145
  847    H    LYS 110           H        LYS 110   1.023  -3.801   8.524
  848    HA   LYS 110           HA       LYS 110  -0.021  -3.463  11.100
  849    HB2  LYS 110          1HB       LYS 110  -0.398  -5.412   9.596
  850    HB3  LYS 110          2HB       LYS 110   1.255  -5.917   9.889
  851    HG2  LYS 110          1HG       LYS 110   0.764  -6.205  12.248
  852    HG3  LYS 110          2HG       LYS 110  -0.906  -5.716  11.961
  853    HD2  LYS 110          1HD       LYS 110  -1.123  -7.618  10.371
  854    HD3  LYS 110          2HD       LYS 110   0.502  -8.131  10.827
  855    HE2  LYS 110          1HE       LYS 110  -1.108  -9.419  12.068
  856    HE3  LYS 110          2HE       LYS 110  -0.263  -8.332  13.171
  857    HZ1  LYS 110          1HZ       LYS 110  -2.152  -6.833  13.086
  858    HZ2  LYS 110          2HZ       LYS 110  -2.636  -8.368  13.599
  859    HZ3  LYS 110          3HZ       LYS 110  -2.959  -7.867  12.017
  860    H    ASN 111           H        ASN 111   3.244  -3.861   9.941
  861    HA   ASN 111           HA       ASN 111   4.199  -3.943  12.733
  862    HB2  ASN 111          1HB       ASN 111   5.634  -5.045  10.312
  863    HB3  ASN 111          2HB       ASN 111   6.145  -5.168  11.989
  864   HD21  ASN 111          1HD2      ASN 111   4.085  -6.431   9.529
  865   HD22  ASN 111          2HD2      ASN 111   3.495  -7.783  10.425
  866    H    ASN 112           H        ASN 112   4.337  -2.376   9.661
  867    HA   ASN 112           HA       ASN 112   6.474  -0.610  10.631
  868    HB2  ASN 112          1HB       ASN 112   6.375  -2.065   7.989
  869    HB3  ASN 112          2HB       ASN 112   7.385  -0.640   8.264
  870   HD21  ASN 112          1HD2      ASN 112   7.844  -3.627   7.797
  871   HD22  ASN 112          2HD2      ASN 112   9.041  -4.025   8.987
  872    H    LEU 113           H        LEU 113   4.260   0.545  10.968
  873    HA   LEU 113           HA       LEU 113   3.232   1.731   8.535
  874    HB2  LEU 113          1HB       LEU 113   1.620   1.156  10.212
  875    HB3  LEU 113          2HB       LEU 113   2.453   2.114  11.419
  876    HG   LEU 113           HG       LEU 113   1.891   4.151  10.092
  877   HD11  LEU 113          1HD1      LEU 113   0.210   2.230   8.493
  878   HD12  LEU 113          2HD1      LEU 113   1.662   3.048   7.919
  879   HD13  LEU 113          3HD1      LEU 113   0.227   3.986   8.333
  880   HD21  LEU 113          1HD2      LEU 113   0.518   3.402  11.995
  881   HD22  LEU 113          2HD2      LEU 113  -0.475   2.460  10.884
  882   HD23  LEU 113          3HD2      LEU 113  -0.439   4.220  10.757
  883    H    SER 114           H        SER 114   5.338   2.567  11.174
  884    HA   SER 114           HA       SER 114   5.398   5.362  10.860
  885    HB2  SER 114          1HB       SER 114   7.704   3.606  11.740
  886    HB3  SER 114          2HB       SER 114   7.440   5.303  12.139
  887    HG   SER 114           HG       SER 114   5.736   4.747  13.424
  888    H    LEU 115           H        LEU 115   7.197   2.774   9.267
  889    HA   LEU 115           HA       LEU 115   8.979   4.415   7.824
  890    HB2  LEU 115          1HB       LEU 115   9.246   1.979   8.176
  891    HB3  LEU 115          2HB       LEU 115   7.904   1.701   7.086
  892    HG   LEU 115           HG       LEU 115   9.220   2.771   5.264
  893   HD11  LEU 115          1HD1      LEU 115  10.670   4.158   6.615
  894   HD12  LEU 115          2HD1      LEU 115  11.633   3.063   5.622
  895   HD13  LEU 115          3HD1      LEU 115  11.397   2.723   7.337
  896   HD21  LEU 115          1HD2      LEU 115  10.710   0.889   4.909
  897   HD22  LEU 115          2HD2      LEU 115   9.168   0.333   5.562
  898   HD23  LEU 115          3HD2      LEU 115  10.582   0.442   6.610
  899    H    ILE 116           H        ILE 116   5.714   3.315   7.241
  900    HA   ILE 116           HA       ILE 116   5.536   4.056   4.520
  901    HB   ILE 116           HB       ILE 116   3.362   3.747   6.601
  902   HG12  ILE 116          1HG1      ILE 116   4.395   1.864   4.465
  903   HG13  ILE 116          2HG1      ILE 116   4.639   1.699   6.211
  904   HG21  ILE 116          1HG2      ILE 116   1.825   3.526   4.691
  905   HG22  ILE 116          2HG2      ILE 116   3.145   3.951   3.604
  906   HG23  ILE 116          3HG2      ILE 116   2.557   5.130   4.778
  907   HD11  ILE 116          1HD1      ILE 116   2.214   1.430   6.486
  908   HD12  ILE 116          2HD1      ILE 116   2.920   0.194   5.445
  909   HD13  ILE 116          3HD1      ILE 116   2.022   1.536   4.738
  910    H    LYS 117           H        LYS 117   4.814   5.722   7.541
  911    HA   LYS 117           HA       LYS 117   3.756   8.074   6.414
  912    HB2  LYS 117          1HB       LYS 117   5.071   7.508   9.062
  913    HB3  LYS 117          2HB       LYS 117   4.426   9.092   8.650
  914    HG2  LYS 117          1HG       LYS 117   2.207   8.135   8.370
  915    HG3  LYS 117          2HG       LYS 117   2.832   6.527   8.719
  916    HD2  LYS 117          1HD       LYS 117   3.436   7.224  10.970
  917    HD3  LYS 117          2HD       LYS 117   2.905   8.870  10.628
  918    HE2  LYS 117          1HE       LYS 117   0.620   8.096  10.341
  919    HE3  LYS 117          2HE       LYS 117   1.134   6.426  10.583
  920    HZ1  LYS 117          1HZ       LYS 117   1.772   6.958  12.826
  921    HZ2  LYS 117          2HZ       LYS 117   0.164   7.417  12.585
  922    HZ3  LYS 117          3HZ       LYS 117   1.382   8.588  12.603
  923    H    ALA 118           H        ALA 118   7.045   7.224   7.451
  924    HA   ALA 118           HA       ALA 118   8.219   9.725   6.787
  925    HB1  ALA 118          1HB       ALA 118  10.339   8.554   7.045
  926    HB2  ALA 118          2HB       ALA 118   9.487   7.009   7.047
  927    HB3  ALA 118          3HB       ALA 118   9.228   8.161   8.356
  928    H    SER 119           H        SER 119   7.581   6.809   5.010
  929    HA   SER 119           HA       SER 119   9.203   7.072   2.797
  930    HB2  SER 119          1HB       SER 119   7.811   5.109   3.240
  931    HB3  SER 119          2HB       SER 119   6.357   6.052   2.926
  932    HG   SER 119           HG       SER 119   8.428   5.609   1.039
  933    H    ILE 120           H        ILE 120   6.004   8.504   3.348
  934    HA   ILE 120           HA       ILE 120   6.118   9.862   0.778
  935    HB   ILE 120           HB       ILE 120   3.843  10.693   1.394
  936   HG12  ILE 120          1HG1      ILE 120   4.073   8.769   3.707
  937   HG13  ILE 120          2HG1      ILE 120   4.226  10.516   3.872
  938   HG21  ILE 120          1HG2      ILE 120   2.743   8.544   1.068
  939   HG22  ILE 120          2HG2      ILE 120   4.239   7.714   1.494
  940   HG23  ILE 120          3HG2      ILE 120   4.163   8.701   0.033
  941   HD11  ILE 120          1HD1      ILE 120   1.799   9.053   2.868
  942   HD12  ILE 120          2HD1      ILE 120   1.957  10.799   3.050
  943   HD13  ILE 120          3HD1      ILE 120   2.000   9.757   4.473
  944    H    LYS 121           H        LYS 121   7.333  10.479   3.755
  945    HA   LYS 121           HA       LYS 121   6.767  13.334   3.780
  946    HB2  LYS 121          1HB       LYS 121   6.852  12.013   5.889
  947    HB3  LYS 121          2HB       LYS 121   8.548  11.683   5.582
  948    HG2  LYS 121          1HG       LYS 121   8.965  14.145   5.639
  949    HG3  LYS 121          2HG       LYS 121   7.286  14.358   6.141
  950    HD2  LYS 121          1HD       LYS 121   7.707  12.948   8.106
  951    HD3  LYS 121          2HD       LYS 121   9.388  12.765   7.608
  952    HE2  LYS 121          1HE       LYS 121   9.229  14.457   9.322
  953    HE3  LYS 121          2HE       LYS 121   9.680  15.204   7.791
  954    HZ1  LYS 121          1HZ       LYS 121   7.989  16.474   8.979
  955    HZ2  LYS 121          2HZ       LYS 121   6.937  15.154   8.926
  956    HZ3  LYS 121          3HZ       LYS 121   7.406  15.918   7.491
  957    H    LYS 122           H        LYS 122   7.978  14.673   2.586
  958    HA   LYS 122           HA       LYS 122  10.669  13.799   1.857
  959    HB2  LYS 122          1HB       LYS 122  10.595  15.604   0.152
  960    HB3  LYS 122          2HB       LYS 122   9.398  14.367  -0.079
  961    HG2  LYS 122          1HG       LYS 122   8.175  16.254  -0.511
  962    HG3  LYS 122          2HG       LYS 122   7.834  16.030   1.201
  963    HD2  LYS 122          1HD       LYS 122   9.383  17.729   1.814
  964    HD3  LYS 122          2HD       LYS 122  10.033  17.815   0.176
  965    HE2  LYS 122          1HE       LYS 122   8.552  19.694   0.612
  966    HE3  LYS 122          2HE       LYS 122   7.877  18.645  -0.631
  967    HZ1  LYS 122          1HZ       LYS 122   7.013  18.966   2.173
  968    HZ2  LYS 122          2HZ       LYS 122   6.604  17.586   1.288
  969    HZ3  LYS 122          3HZ       LYS 122   6.092  19.107   0.755
  970    H    ASP 123           H        ASP 123  12.426  14.753   2.571
  971    HA   ASP 123           HA       ASP 123  12.318  17.396   3.759
  972    HB2  ASP 123          1HB       ASP 123  11.817  15.883   5.636
  973    HB3  ASP 123          2HB       ASP 123  13.290  14.983   5.297
  974    H21  ACD 201           H21      ACD   1  -4.647   4.843   1.288
  975    H22  ACD 201           H22      ACD   1  -3.561   4.918   2.680
  976    H31  ACD 201           H31      ACD   1  -2.136   6.563   1.442
  977    H32  ACD 201           H32      ACD   1  -3.194   6.405   0.040
  978    H41  ACD 201           H41      ACD   1  -2.678   3.933  -0.021
  979    H42  ACD 201           H42      ACD   1  -1.249   4.948  -0.271
  980    H5   ACD 201           H5       ACD   1  -1.854   3.258   2.216
  981    H6   ACD 201           H6       ACD   1   0.395   3.868   2.766
  982    H71  ACD 201           H71      ACD   1   0.789   5.074   0.141
  983    H72  ACD 201           H72      ACD   1  -0.080   6.290   1.078
  984    H8   ACD 201           H8       ACD   1   1.849   6.578   2.599
  985    H9   ACD 201           H9       ACD   1   3.910   5.547   1.977
  986   H101  ACD 201          H101      ACD   1   2.747   4.710  -0.566
  987   H102  ACD 201          H102      ACD   1   2.296   3.455   0.590
  988    H11  ACD 201           H11      ACD   1   5.267   4.280   0.362
  989    H12  ACD 201           H12      ACD   1   5.542   1.938   0.064
  990   H131  ACD 201          H131      ACD   1   2.550   2.011  -0.547
  991   H132  ACD 201          H132      ACD   1   3.624   0.615  -0.691
  992    H14  ACD 201           H14      ACD   1   2.555   1.677   2.026
  993    H15  ACD 201           H15      ACD   1   2.545  -0.656   2.507
  994   H161  ACD 201          H161      ACD   1   2.727  -1.364  -0.298
  995   H162  ACD 201          H162      ACD   1   4.378  -0.923   0.149
  996   H171  ACD 201          H171      ACD   1   4.469  -2.609   1.868
  997   H172  ACD 201          H172      ACD   1   2.735  -2.908   1.757
  998   H181  ACD 201          H181      ACD   1   4.753  -3.465  -0.454
  999   H182  ACD 201          H182      ACD   1   3.019  -3.774  -0.554
 1000   H191  ACD 201          H191      ACD   1   4.971  -5.063   1.406
 1001   H192  ACD 201          H192      ACD   1   3.224  -5.309   1.444
 1002   H201  ACD 201          H201      ACD   1   5.043  -5.992  -0.874
 1003   H202  ACD 201          H202      ACD   1   3.330  -6.224  -0.851
 1004   H203  ACD 201          H203      ACD   1   4.338  -7.123   0.229
  Start of MODEL    8
    1    H1   MET   1          1H        MET   1  10.469   4.574 -17.369
    2    H2   MET   1          2H        MET   1   9.634   5.998 -17.010
    3    H3   MET   1          3H        MET   1   9.890   4.843 -15.803
    4    HA   MET   1           HA       MET   1  12.236   5.213 -15.847
    5    HB2  MET   1          1HB       MET   1  13.222   6.937 -17.246
    6    HB3  MET   1          2HB       MET   1  12.384   5.769 -18.255
    7    HG2  MET   1          1HG       MET   1  10.520   7.278 -18.525
    8    HG3  MET   1          2HG       MET   1  11.262   8.433 -17.421
    9    HE1  MET   1          1HE       MET   1  13.133   6.288 -20.150
   10    HE2  MET   1          2HE       MET   1  13.027   7.356 -21.549
   11    HE3  MET   1          3HE       MET   1  11.567   6.622 -20.888
   12    H    GLU   2           H        GLU   2  13.307   7.230 -14.957
   13    HA   GLU   2           HA       GLU   2  13.381   8.856 -13.390
   14    HB2  GLU   2          1HB       GLU   2  10.925   9.792 -14.855
   15    HB3  GLU   2          2HB       GLU   2  11.792  10.743 -13.660
   16    HG2  GLU   2          1HG       GLU   2  13.786  10.678 -15.076
   17    HG3  GLU   2          2HG       GLU   2  12.886   9.750 -16.276
   18    H    PHE   3           H        PHE   3  12.928   7.212 -11.764
   19    HA   PHE   3           HA       PHE   3  10.311   6.866 -10.733
   20    HB2  PHE   3          1HB       PHE   3  12.036   5.232 -10.230
   21    HB3  PHE   3          2HB       PHE   3  12.992   6.458  -9.389
   22    HD1  PHE   3           HD1      PHE   3  12.652   6.873  -7.110
   23    HD2  PHE   3           HD2      PHE   3   9.779   4.633  -9.304
   24    HE1  PHE   3           HE1      PHE   3  11.491   6.319  -5.013
   25    HE2  PHE   3           HE2      PHE   3   8.609   4.078  -7.212
   26    HZ   PHE   3           HZ       PHE   3   9.463   4.923  -5.064
   27    H    THR   4           H        THR   4   9.158   8.471 -10.017
   28    HA   THR   4           HA       THR   4  10.441  10.584  -8.413
   29    HB   THR   4           HB       THR   4   7.638  10.990  -9.188
   30    HG1  THR   4           HG1      THR   4   9.460  10.146 -11.056
   31   HG21  THR   4          1HG2      THR   4  10.165  12.602  -9.489
   32   HG22  THR   4          2HG2      THR   4   8.978  12.731  -8.190
   33   HG23  THR   4          3HG2      THR   4   8.538  13.186  -9.835
   34    H    VAL   5           H        VAL   5  10.206  10.448  -6.323
   35    HA   VAL   5           HA       VAL   5   8.495   8.466  -5.150
   36    HB   VAL   5           HB       VAL   5   9.573   8.802  -3.178
   37   HG11  VAL   5          1HG1      VAL   5  11.263   8.497  -4.950
   38   HG12  VAL   5          2HG1      VAL   5  11.866   9.256  -3.479
   39   HG13  VAL   5          3HG1      VAL   5  11.552  10.237  -4.908
   40   HG21  VAL   5          1HG2      VAL   5   9.830  11.747  -3.787
   41   HG22  VAL   5          2HG2      VAL   5  10.407  10.956  -2.320
   42   HG23  VAL   5          3HG2      VAL   5   8.682  10.995  -2.678
   43    H    SER   6           H        SER   6   6.631   8.654  -4.123
   44    HA   SER   6           HA       SER   6   5.108  11.061  -4.676
   45    HB2  SER   6          1HB       SER   6   3.193   9.599  -3.885
   46    HB3  SER   6          2HB       SER   6   4.063   9.001  -5.300
   47    HG   SER   6           HG       SER   6   4.649   8.196  -2.645
   48    H    THR   7           H        THR   7   5.410  12.635  -3.167
   49    HA   THR   7           HA       THR   7   5.653  12.001  -0.367
   50    HB   THR   7           HB       THR   7   5.627  14.440  -0.007
   51    HG1  THR   7           HG1      THR   7   5.050  14.472  -2.805
   52   HG21  THR   7          1HG2      THR   7   7.423  13.581  -2.279
   53   HG22  THR   7          2HG2      THR   7   7.740  13.339  -0.561
   54   HG23  THR   7          3HG2      THR   7   7.685  14.972  -1.226
   55    H    THR   8           H        THR   8   4.153  13.501   1.103
   56    HA   THR   8           HA       THR   8   1.647  12.361   1.188
   57    HB   THR   8           HB       THR   8   2.438  15.068   2.266
   58    HG1  THR   8           HG1      THR   8   3.480  12.788   2.856
   59   HG21  THR   8          1HG2      THR   8   0.197  13.197   3.015
   60   HG22  THR   8          2HG2      THR   8   0.041  14.797   2.282
   61   HG23  THR   8          3HG2      THR   8   0.659  14.635   3.928
   62    H    GLU   9           H        GLU   9   2.522  15.540  -0.132
   63    HA   GLU   9           HA       GLU   9  -0.072  16.290  -0.839
   64    HB2  GLU   9          1HB       GLU   9   2.577  17.183  -1.971
   65    HB3  GLU   9          2HB       GLU   9   1.035  17.973  -2.285
   66    HG2  GLU   9          1HG       GLU   9   0.771  18.413   0.101
   67    HG3  GLU   9          2HG       GLU   9   2.317  17.634   0.414
   68    H    ASP  10           H        ASP  10   2.433  14.601  -2.712
   69    HA   ASP  10           HA       ASP  10   0.980  14.477  -5.143
   70    HB2  ASP  10          1HB       ASP  10   2.989  12.439  -4.151
   71    HB3  ASP  10          2HB       ASP  10   2.472  12.695  -5.814
   72    H    LEU  11           H        LEU  11   1.117  12.434  -2.302
   73    HA   LEU  11           HA       LEU  11  -0.379  10.279  -3.290
   74    HB2  LEU  11          1HB       LEU  11   0.973  10.026  -1.333
   75    HB3  LEU  11          2HB       LEU  11   0.060  11.271  -0.472
   76    HG   LEU  11           HG       LEU  11  -1.917   9.774  -0.542
   77   HD11  LEU  11          1HD1      LEU  11  -1.253   8.491  -2.530
   78   HD12  LEU  11          2HD1      LEU  11  -1.656   7.459  -1.158
   79   HD13  LEU  11          3HD1      LEU  11   0.033   7.736  -1.586
   80   HD21  LEU  11          1HD2      LEU  11  -1.198   8.372   1.241
   81   HD22  LEU  11          2HD2      LEU  11  -0.284   9.874   1.364
   82   HD23  LEU  11          3HD2      LEU  11   0.475   8.429   0.693
   83    H    GLN  12           H        GLN  12  -1.314  13.342  -1.881
   84    HA   GLN  12           HA       GLN  12  -4.024  12.695  -1.358
   85    HB2  GLN  12          1HB       GLN  12  -2.674  15.343  -1.873
   86    HB3  GLN  12          2HB       GLN  12  -4.365  15.189  -1.429
   87    HG2  GLN  12          1HG       GLN  12  -3.756  14.215   0.693
   88    HG3  GLN  12          2HG       GLN  12  -2.053  14.241   0.243
   89   HE21  GLN  12          1HE2      GLN  12  -4.324  16.796  -0.504
   90   HE22  GLN  12          2HE2      GLN  12  -3.617  17.980   0.538
   91    H    ARG  13           H        ARG  13  -2.287  13.671  -4.181
   92    HA   ARG  13           HA       ARG  13  -4.447  14.534  -5.774
   93    HB2  ARG  13          1HB       ARG  13  -1.916  13.197  -6.733
   94    HB3  ARG  13          2HB       ARG  13  -2.957  14.265  -7.655
   95    HG2  ARG  13          1HG       ARG  13  -1.321  15.086  -5.261
   96    HG3  ARG  13          2HG       ARG  13  -0.857  15.324  -6.955
   97    HD2  ARG  13          1HD       ARG  13  -1.731  17.378  -6.293
   98    HD3  ARG  13          2HD       ARG  13  -3.040  16.614  -7.183
   99    HE   ARG  13           HE       ARG  13  -4.200  16.286  -5.149
  100   HH11  ARG  13          1HH1      ARG  13  -1.157  17.969  -4.707
  101   HH12  ARG  13          2HH1      ARG  13  -1.626  18.692  -3.202
  102   HH21  ARG  13          1HH2      ARG  13  -4.818  17.223  -3.160
  103   HH22  ARG  13          2HH2      ARG  13  -3.709  18.258  -2.315
  104    H    TYR  14           H        TYR  14  -2.707  11.424  -5.721
  105    HA   TYR  14           HA       TYR  14  -4.440  10.110  -7.521
  106    HB2  TYR  14          1HB       TYR  14  -2.708   8.823  -5.402
  107    HB3  TYR  14          2HB       TYR  14  -3.331   8.068  -6.863
  108    HD1  TYR  14           HD1      TYR  14  -0.429   9.236  -5.500
  109    HD2  TYR  14           HD2      TYR  14  -2.749   9.657  -9.044
  110    HE1  TYR  14           HE1      TYR  14   1.589   9.905  -6.738
  111    HE2  TYR  14           HE2      TYR  14  -0.738  10.318 -10.292
  112    HH   TYR  14           HH       TYR  14   1.526  11.368  -9.724
  113    H    ARG  15           H        ARG  15  -4.419  10.362  -4.015
  114    HA   ARG  15           HA       ARG  15  -6.242   8.289  -3.527
  115    HB2  ARG  15          1HB       ARG  15  -5.322   8.666  -1.543
  116    HB3  ARG  15          2HB       ARG  15  -4.816  10.280  -2.003
  117    HG2  ARG  15          1HG       ARG  15  -6.900  11.207  -1.254
  118    HG3  ARG  15          2HG       ARG  15  -7.587   9.593  -1.025
  119    HD2  ARG  15          1HD       ARG  15  -5.939   9.122   0.713
  120    HD3  ARG  15          2HD       ARG  15  -5.213  10.708   0.477
  121    HE   ARG  15           HE       ARG  15  -7.695  11.400   1.096
  122   HH11  ARG  15          1HH1      ARG  15  -5.648   8.944   2.535
  123   HH12  ARG  15          2HH1      ARG  15  -6.272   9.185   4.136
  124   HH21  ARG  15          1HH2      ARG  15  -8.545  11.687   3.200
  125   HH22  ARG  15          2HH2      ARG  15  -7.939  10.724   4.505
  126    H    THR  16           H        THR  16  -6.706  11.748  -4.044
  127    HA   THR  16           HA       THR  16  -9.492  11.782  -3.527
  128    HB   THR  16           HB       THR  16  -7.906  13.586  -5.359
  129    HG1  THR  16           HG1      THR  16  -6.924  13.955  -3.480
  130   HG21  THR  16          1HG2      THR  16 -10.326  13.803  -5.608
  131   HG22  THR  16          2HG2      THR  16  -9.635  15.236  -4.850
  132   HG23  THR  16          3HG2      THR  16 -10.487  14.044  -3.869
  133    H    GLU  17           H        GLU  17  -7.575  11.344  -6.473
  134    HA   GLU  17           HA       GLU  17  -9.677  11.209  -8.303
  135    HB2  GLU  17          1HB       GLU  17  -6.851  10.469  -8.261
  136    HB3  GLU  17          2HB       GLU  17  -7.804   9.454  -9.315
  137    HG2  GLU  17          1HG       GLU  17  -8.643  11.458 -10.465
  138    HG3  GLU  17          2HG       GLU  17  -7.625  12.461  -9.426
  139    H    CYS  18           H        CYS  18  -8.076   8.579  -6.512
  140    HA   CYS  18           HA       CYS  18  -9.649   6.510  -7.598
  141    HB2  CYS  18          1HB       CYS  18  -8.102   6.627  -5.008
  142    HB3  CYS  18          2HB       CYS  18  -8.832   5.163  -5.679
  143    H    VAL  19           H        VAL  19 -10.082   8.572  -4.767
  144    HA   VAL  19           HA       VAL  19 -12.267   7.237  -3.645
  145    HB   VAL  19           HB       VAL  19 -11.279  10.056  -3.487
  146   HG11  VAL  19          1HG1      VAL  19 -13.726  10.240  -3.585
  147   HG12  VAL  19          2HG1      VAL  19 -13.088  10.671  -1.997
  148   HG13  VAL  19          3HG1      VAL  19 -13.855   9.102  -2.243
  149   HG21  VAL  19          1HG2      VAL  19 -11.175   9.464  -1.079
  150   HG22  VAL  19          2HG2      VAL  19 -10.198   8.417  -2.108
  151   HG23  VAL  19          3HG2      VAL  19 -11.752   7.847  -1.492
  152    H    SER  20           H        SER  20 -12.131   9.893  -5.951
  153    HA   SER  20           HA       SER  20 -14.907  10.175  -6.303
  154    HB2  SER  20          1HB       SER  20 -12.670  10.848  -8.228
  155    HB3  SER  20          2HB       SER  20 -14.306  11.510  -8.263
  156    HG   SER  20           HG       SER  20 -12.216  11.983  -6.433
  157    H    SER  21           H        SER  21 -12.537   8.116  -7.937
  158    HA   SER  21           HA       SER  21 -14.305   7.426 -10.091
  159    HB2  SER  21          1HB       SER  21 -11.818   7.476 -10.285
  160    HB3  SER  21          2HB       SER  21 -11.744   6.071  -9.227
  161    HG   SER  21           HG       SER  21 -11.887   5.017 -11.046
  162    H    LEU  22           H        LEU  22 -13.119   5.726  -7.178
  163    HA   LEU  22           HA       LEU  22 -14.648   3.376  -7.857
  164    HB2  LEU  22          1HB       LEU  22 -12.895   4.092  -5.519
  165    HB3  LEU  22          2HB       LEU  22 -13.745   2.548  -5.643
  166    HG   LEU  22           HG       LEU  22 -11.789   3.530  -7.715
  167   HD11  LEU  22          1HD1      LEU  22 -11.344   1.676  -5.380
  168   HD12  LEU  22          2HD1      LEU  22 -10.636   3.277  -5.592
  169   HD13  LEU  22          3HD1      LEU  22 -10.195   1.968  -6.687
  170   HD21  LEU  22          1HD2      LEU  22 -13.438   1.859  -8.438
  171   HD22  LEU  22          2HD2      LEU  22 -12.912   0.797  -7.130
  172   HD23  LEU  22          3HD2      LEU  22 -11.795   1.220  -8.429
  173    H    ASN  23           H        ASN  23 -15.737   6.152  -6.881
  174    HA   ASN  23           HA       ASN  23 -17.513   6.954  -5.704
  175    HB2  ASN  23          1HB       ASN  23 -18.417   4.083  -5.934
  176    HB3  ASN  23          2HB       ASN  23 -19.435   5.427  -5.454
  177   HD21  ASN  23          1HD2      ASN  23 -20.083   6.924  -6.979
  178   HD22  ASN  23          2HD2      ASN  23 -19.930   6.636  -8.679
  179    H    ILE  24           H        ILE  24 -15.290   6.316  -4.131
  180    HA   ILE  24           HA       ILE  24 -15.958   4.776  -1.855
  181    HB   ILE  24           HB       ILE  24 -13.929   7.007  -2.014
  182   HG12  ILE  24          1HG1      ILE  24 -13.560   5.373  -3.825
  183   HG13  ILE  24          2HG1      ILE  24 -12.291   5.268  -2.606
  184   HG21  ILE  24          1HG2      ILE  24 -12.814   5.792  -0.211
  185   HG22  ILE  24          2HG2      ILE  24 -14.110   4.595  -0.208
  186   HG23  ILE  24          3HG2      ILE  24 -14.448   6.265   0.253
  187   HD11  ILE  24          1HD1      ILE  24 -13.382   3.289  -1.663
  188   HD12  ILE  24          2HD1      ILE  24 -12.965   3.070  -3.365
  189   HD13  ILE  24          3HD1      ILE  24 -14.634   3.401  -2.903
  190    HA   PRO  25           HA       PRO  25 -18.839   7.636   0.031
  191    HB2  PRO  25          1HB       PRO  25 -18.337   5.949   2.392
  192    HB3  PRO  25          2HB       PRO  25 -19.854   6.318   1.570
  193    HG2  PRO  25          1HG       PRO  25 -18.698   3.913   1.396
  194    HG3  PRO  25          2HG       PRO  25 -19.603   4.629   0.051
  195    HD2  PRO  25          1HD       PRO  25 -16.648   4.391   0.437
  196    HD3  PRO  25          2HD       PRO  25 -17.616   4.268  -1.055
  197    H    ALA  26           H        ALA  26 -18.654   9.378   1.273
  198    HA   ALA  26           HA       ALA  26 -16.164  10.453   1.903
  199    HB1  ALA  26          1HB       ALA  26 -18.832  11.194   3.088
  200    HB2  ALA  26          2HB       ALA  26 -18.217  11.752   1.533
  201    HB3  ALA  26          3HB       ALA  26 -17.392  12.210   3.024
  202    H    ASP  27           H        ASP  27 -18.416   8.616   3.878
  203    HA   ASP  27           HA       ASP  27 -17.350   8.971   6.410
  204    HB2  ASP  27          1HB       ASP  27 -18.556   6.510   5.146
  205    HB3  ASP  27          2HB       ASP  27 -18.131   6.602   6.850
  206    H    TYR  28           H        TYR  28 -16.437   6.470   4.033
  207    HA   TYR  28           HA       TYR  28 -14.321   5.396   5.482
  208    HB2  TYR  28          1HB       TYR  28 -14.988   5.471   2.557
  209    HB3  TYR  28          2HB       TYR  28 -13.491   4.722   3.112
  210    HD1  TYR  28           HD1      TYR  28 -13.520   2.566   4.166
  211    HD2  TYR  28           HD2      TYR  28 -17.171   4.559   3.275
  212    HE1  TYR  28           HE1      TYR  28 -14.762   0.499   4.646
  213    HE2  TYR  28           HE2      TYR  28 -18.420   2.498   3.752
  214    HH   TYR  28           HH       TYR  28 -17.083  -0.135   5.348
  215    H    VAL  29           H        VAL  29 -14.448   8.112   3.251
  216    HA   VAL  29           HA       VAL  29 -11.719   8.561   2.899
  217    HB   VAL  29           HB       VAL  29 -13.941  10.590   2.931
  218   HG11  VAL  29          1HG1      VAL  29 -12.417  11.880   1.461
  219   HG12  VAL  29          2HG1      VAL  29 -11.155  10.692   1.801
  220   HG13  VAL  29          3HG1      VAL  29 -11.808  11.682   3.104
  221   HG21  VAL  29          1HG2      VAL  29 -12.751   8.976   0.685
  222   HG22  VAL  29          2HG2      VAL  29 -13.934  10.273   0.494
  223   HG23  VAL  29          3HG2      VAL  29 -14.372   8.800   1.360
  224    H    GLU  30           H        GLU  30 -13.940   9.790   5.411
  225    HA   GLU  30           HA       GLU  30 -12.056  11.433   6.735
  226    HB2  GLU  30          1HB       GLU  30 -14.225   9.974   8.223
  227    HB3  GLU  30          2HB       GLU  30 -13.541  11.567   8.520
  228    HG2  GLU  30          1HG       GLU  30 -14.532  12.246   6.302
  229    HG3  GLU  30          2HG       GLU  30 -15.456  10.753   6.381
  230    H    LYS  31           H        LYS  31 -12.818   8.009   7.043
  231    HA   LYS  31           HA       LYS  31 -11.191   7.446   9.271
  232    HB2  LYS  31          1HB       LYS  31 -11.914   5.639   6.958
  233    HB3  LYS  31          2HB       LYS  31 -11.215   5.116   8.496
  234    HG2  LYS  31          1HG       LYS  31 -13.221   6.000   9.652
  235    HG3  LYS  31          2HG       LYS  31 -13.919   6.374   8.073
  236    HD2  LYS  31          1HD       LYS  31 -13.727   3.988   7.456
  237    HD3  LYS  31          2HD       LYS  31 -13.114   3.645   9.086
  238    HE2  LYS  31          1HE       LYS  31 -15.796   4.914   8.539
  239    HE3  LYS  31          2HE       LYS  31 -15.565   3.181   8.766
  240    HZ1  LYS  31          1HZ       LYS  31 -14.899   5.287  10.754
  241    HZ2  LYS  31          2HZ       LYS  31 -14.687   3.623  10.971
  242    HZ3  LYS  31          3HZ       LYS  31 -16.242   4.264  10.811
  243    H    PHE  32           H        PHE  32 -10.528   7.248   5.787
  244    HA   PHE  32           HA       PHE  32  -7.895   6.319   5.980
  245    HB2  PHE  32          1HB       PHE  32  -9.050   8.027   3.771
  246    HB3  PHE  32          2HB       PHE  32  -7.627   6.998   3.666
  247    HD1  PHE  32           HD1      PHE  32 -10.267   7.033   2.001
  248    HD2  PHE  32           HD2      PHE  32  -8.839   4.650   5.221
  249    HE1  PHE  32           HE1      PHE  32 -11.679   5.166   1.244
  250    HE2  PHE  32           HE2      PHE  32 -10.243   2.784   4.467
  251    HZ   PHE  32           HZ       PHE  32 -11.664   3.036   2.475
  252    H    LYS  33           H        LYS  33  -9.212   9.447   6.504
  253    HA   LYS  33           HA       LYS  33  -6.798  10.906   6.031
  254    HB2  LYS  33          1HB       LYS  33  -9.024  11.960   5.864
  255    HB3  LYS  33          2HB       LYS  33  -9.267  11.700   7.586
  256    HG2  LYS  33          1HG       LYS  33  -7.255  13.129   7.999
  257    HG3  LYS  33          2HG       LYS  33  -7.244  13.500   6.269
  258    HD2  LYS  33          1HD       LYS  33  -9.566  14.018   8.126
  259    HD3  LYS  33          2HD       LYS  33  -8.374  15.225   7.649
  260    HE2  LYS  33          1HE       LYS  33 -10.167  13.719   5.748
  261    HE3  LYS  33          2HE       LYS  33 -10.475  15.347   6.346
  262    HZ1  LYS  33          1HZ       LYS  33  -9.468  15.455   4.189
  263    HZ2  LYS  33          2HZ       LYS  33  -8.171  14.490   4.678
  264    HZ3  LYS  33          3HZ       LYS  33  -8.363  16.038   5.326
  265    H    LYS  34           H        LYS  34  -8.237   9.205   8.703
  266    HA   LYS  34           HA       LYS  34  -6.147  10.213  10.502
  267    HB2  LYS  34          1HB       LYS  34  -8.800   8.881  11.031
  268    HB3  LYS  34          2HB       LYS  34  -7.584   9.061  12.287
  269    HG2  LYS  34          1HG       LYS  34  -8.861  11.312  10.745
  270    HG3  LYS  34          2HG       LYS  34  -9.299  10.804  12.377
  271    HD2  LYS  34          1HD       LYS  34  -6.937  11.279  13.063
  272    HD3  LYS  34          2HD       LYS  34  -6.675  11.971  11.462
  273    HE2  LYS  34          1HE       LYS  34  -8.660  12.917  13.528
  274    HE3  LYS  34          2HE       LYS  34  -7.162  13.722  13.069
  275    HZ1  LYS  34          1HZ       LYS  34  -9.048  14.751  11.998
  276    HZ2  LYS  34          2HZ       LYS  34  -9.515  13.282  11.310
  277    HZ3  LYS  34          3HZ       LYS  34  -8.065  14.016  10.834
  278    H    TRP  35           H        TRP  35  -5.669   8.256   8.414
  279    HA   TRP  35           HA       TRP  35  -4.733   6.237   7.997
  280    HB2  TRP  35          1HB       TRP  35  -3.709   6.809  10.771
  281    HB3  TRP  35          2HB       TRP  35  -3.146   5.437   9.810
  282    HD1  TRP  35           HD1      TRP  35  -2.760   9.178  10.201
  283    HE1  TRP  35           HE1      TRP  35  -0.916  10.014   8.607
  284    HE3  TRP  35           HE3      TRP  35  -2.088   4.927   7.434
  285    HZ2  TRP  35           HZ2      TRP  35   0.606   9.005   6.462
  286    HZ3  TRP  35           HZ3      TRP  35  -0.422   4.947   5.628
  287    HH2  TRP  35           HH2      TRP  35   0.901   6.938   5.149
  288    H    GLU  36           H        GLU  36  -7.294   5.767   8.465
  289    HA   GLU  36           HA       GLU  36  -7.236   3.260   9.989
  290    HB2  GLU  36          1HB       GLU  36  -9.435   5.318   9.916
  291    HB3  GLU  36          2HB       GLU  36  -9.650   3.685  10.537
  292    HG2  GLU  36          1HG       GLU  36  -7.997   4.098  12.250
  293    HG3  GLU  36          2HG       GLU  36  -7.680   5.694  11.582
  294    H    PHE  37           H        PHE  37  -7.443   1.651   8.645
  295    HA   PHE  37           HA       PHE  37  -9.124   1.993   6.245
  296    HB2  PHE  37          1HB       PHE  37  -6.682   0.213   6.485
  297    HB3  PHE  37          2HB       PHE  37  -7.599   0.550   5.024
  298    HD1  PHE  37           HD1      PHE  37  -5.353   2.045   7.550
  299    HD2  PHE  37           HD2      PHE  37  -7.104   2.441   3.687
  300    HE1  PHE  37           HE1      PHE  37  -3.847   3.926   7.064
  301    HE2  PHE  37           HE2      PHE  37  -5.603   4.325   3.200
  302    HZ   PHE  37           HZ       PHE  37  -3.971   5.070   4.888
  303    HA   PRO  38           HA       PRO  38 -11.178  -1.374   8.655
  304    HB2  PRO  38          1HB       PRO  38 -13.293  -0.582   6.727
  305    HB3  PRO  38          2HB       PRO  38 -13.396  -0.869   8.475
  306    HG2  PRO  38          1HG       PRO  38 -13.479   1.609   7.535
  307    HG3  PRO  38          2HG       PRO  38 -12.551   1.233   8.998
  308    HD2  PRO  38          1HD       PRO  38 -11.552   1.645   6.190
  309    HD3  PRO  38          2HD       PRO  38 -10.876   2.254   7.734
  310    H    GLU  39           H        GLU  39 -11.355  -3.432   8.081
  311    HA   GLU  39           HA       GLU  39 -10.428  -4.257   5.513
  312    HB2  GLU  39          1HB       GLU  39  -9.856  -5.471   7.558
  313    HB3  GLU  39          2HB       GLU  39 -11.548  -5.873   7.807
  314    HG2  GLU  39          1HG       GLU  39 -11.577  -7.302   5.927
  315    HG3  GLU  39          2HG       GLU  39 -10.011  -6.712   5.369
  316    H    ASP  40           H        ASP  40 -11.843  -3.605   3.980
  317    HA   ASP  40           HA       ASP  40 -14.252  -5.171   3.648
  318    HB2  ASP  40          1HB       ASP  40 -15.047  -3.227   4.997
  319    HB3  ASP  40          2HB       ASP  40 -14.458  -2.146   3.738
  320    H    ASP  41           H        ASP  41 -15.029  -5.129   1.463
  321    HA   ASP  41           HA       ASP  41 -13.040  -5.188  -0.451
  322    HB2  ASP  41          1HB       ASP  41 -15.287  -6.233  -0.685
  323    HB3  ASP  41          2HB       ASP  41 -15.960  -4.641  -1.021
  324    H    THR  42           H        THR  42 -15.313  -2.540   0.188
  325    HA   THR  42           HA       THR  42 -14.661  -0.789  -1.841
  326    HB   THR  42           HB       THR  42 -15.387  -0.174   1.025
  327    HG1  THR  42           HG1      THR  42 -16.858  -0.612  -1.364
  328   HG21  THR  42          1HG2      THR  42 -14.397   1.791   0.035
  329   HG22  THR  42          2HG2      THR  42 -16.145   2.005   0.128
  330   HG23  THR  42          3HG2      THR  42 -15.386   1.599  -1.411
  331    H    THR  43           H        THR  43 -13.198  -0.874   1.408
  332    HA   THR  43           HA       THR  43 -11.242   1.079   0.988
  333    HB   THR  43           HB       THR  43 -11.032  -1.323   2.807
  334    HG1  THR  43           HG1      THR  43 -11.955   0.359   4.330
  335   HG21  THR  43          1HG2      THR  43  -9.781   1.422   2.865
  336   HG22  THR  43          2HG2      THR  43  -8.957  -0.131   2.727
  337   HG23  THR  43          3HG2      THR  43  -9.759   0.313   4.237
  338    H    MET  44           H        MET  44 -11.327  -2.322   0.207
  339    HA   MET  44           HA       MET  44  -8.532  -2.674  -0.083
  340    HB2  MET  44          1HB       MET  44 -10.821  -4.297  -1.186
  341    HB3  MET  44          2HB       MET  44  -9.139  -4.812  -1.164
  342    HG2  MET  44          1HG       MET  44  -9.136  -4.771   1.255
  343    HG3  MET  44          2HG       MET  44 -10.786  -4.161   1.266
  344    HE1  MET  44          1HE       MET  44 -11.258  -7.738   2.664
  345    HE2  MET  44          2HE       MET  44 -11.517  -6.009   2.916
  346    HE3  MET  44          3HE       MET  44  -9.881  -6.672   2.950
  347    H    CYS  45           H        CYS  45 -11.146  -2.290  -2.480
  348    HA   CYS  45           HA       CYS  45  -9.417  -2.247  -4.713
  349    HB2  CYS  45          1HB       CYS  45 -12.197  -1.103  -4.387
  350    HB3  CYS  45          2HB       CYS  45 -11.337  -1.183  -5.916
  351    H    TYR  46           H        TYR  46 -10.441   0.220  -2.462
  352    HA   TYR  46           HA       TYR  46  -9.614   2.479  -3.880
  353    HB2  TYR  46          1HB       TYR  46 -10.893   2.885  -1.957
  354    HB3  TYR  46          2HB       TYR  46  -9.875   1.862  -0.944
  355    HD1  TYR  46           HD1      TYR  46  -9.615   4.963  -3.032
  356    HD2  TYR  46           HD2      TYR  46  -8.432   2.918   0.511
  357    HE1  TYR  46           HE1      TYR  46  -8.374   6.955  -2.300
  358    HE2  TYR  46           HE2      TYR  46  -7.190   4.906   1.249
  359    HH   TYR  46           HH       TYR  46  -6.370   6.925   0.598
  360    H    ILE  47           H        ILE  47  -7.867   0.492  -1.511
  361    HA   ILE  47           HA       ILE  47  -5.406   1.793  -1.681
  362    HB   ILE  47           HB       ILE  47  -6.033  -1.081  -1.034
  363   HG12  ILE  47          1HG1      ILE  47  -6.991   0.516   0.537
  364   HG13  ILE  47          2HG1      ILE  47  -5.657  -0.339   1.306
  365   HG21  ILE  47          1HG2      ILE  47  -3.776  -1.184  -0.022
  366   HG22  ILE  47          2HG2      ILE  47  -3.420   0.395  -0.723
  367   HG23  ILE  47          3HG2      ILE  47  -3.738  -0.986  -1.775
  368   HD11  ILE  47          1HD1      ILE  47  -4.219   1.653   0.757
  369   HD12  ILE  47          2HD1      ILE  47  -5.491   1.926   1.944
  370   HD13  ILE  47          3HD1      ILE  47  -5.701   2.489   0.286
  371    H    LYS  48           H        LYS  48  -6.799  -0.781  -3.631
  372    HA   LYS  48           HA       LYS  48  -4.540  -1.514  -5.094
  373    HB2  LYS  48          1HB       LYS  48  -6.706  -2.736  -5.107
  374    HB3  LYS  48          2HB       LYS  48  -7.399  -1.439  -6.067
  375    HG2  LYS  48          1HG       LYS  48  -5.684  -1.908  -7.816
  376    HG3  LYS  48          2HG       LYS  48  -5.180  -3.305  -6.866
  377    HD2  LYS  48          1HD       LYS  48  -6.703  -3.970  -8.646
  378    HD3  LYS  48          2HD       LYS  48  -7.429  -4.252  -7.064
  379    HE2  LYS  48          1HE       LYS  48  -8.759  -2.244  -7.276
  380    HE3  LYS  48          2HE       LYS  48  -7.967  -1.844  -8.799
  381    HZ1  LYS  48          1HZ       LYS  48  -9.648  -4.247  -8.310
  382    HZ2  LYS  48          2HZ       LYS  48  -8.913  -3.833  -9.775
  383    HZ3  LYS  48          3HZ       LYS  48 -10.138  -2.859  -9.143
  384    H    CYS  49           H        CYS  49  -7.103   0.819  -5.929
  385    HA   CYS  49           HA       CYS  49  -6.026   1.694  -8.338
  386    HB2  CYS  49          1HB       CYS  49  -8.263   2.251  -7.846
  387    HB3  CYS  49          2HB       CYS  49  -7.830   3.079  -6.352
  388    H    VAL  50           H        VAL  50  -5.547   2.975  -5.062
  389    HA   VAL  50           HA       VAL  50  -4.040   5.214  -5.780
  390    HB   VAL  50           HB       VAL  50  -4.090   3.647  -3.204
  391   HG11  VAL  50          1HG1      VAL  50  -3.183   5.694  -2.173
  392   HG12  VAL  50          2HG1      VAL  50  -2.952   6.378  -3.782
  393   HG13  VAL  50          3HG1      VAL  50  -2.051   4.940  -3.296
  394   HG21  VAL  50          1HG2      VAL  50  -5.509   5.577  -2.479
  395   HG22  VAL  50          2HG2      VAL  50  -6.235   4.518  -3.688
  396   HG23  VAL  50          3HG2      VAL  50  -5.560   6.072  -4.171
  397    H    PHE  51           H        PHE  51  -3.046   2.001  -4.669
  398    HA   PHE  51           HA       PHE  51  -0.285   2.486  -4.731
  399    HB2  PHE  51          1HB       PHE  51  -2.043   0.098  -4.533
  400    HB3  PHE  51          2HB       PHE  51  -0.362  -0.178  -4.976
  401    HD1  PHE  51           HD1      PHE  51   0.189  -1.385  -2.991
  402    HD2  PHE  51           HD2      PHE  51  -1.437   2.544  -2.745
  403    HE1  PHE  51           HE1      PHE  51   0.795  -1.284  -0.609
  404    HE2  PHE  51           HE2      PHE  51  -0.828   2.648  -0.366
  405    HZ   PHE  51           HZ       PHE  51   0.287   0.735   0.705
  406    H    ASN  52           H        ASN  52  -2.575   1.663  -7.170
  407    HA   ASN  52           HA       ASN  52  -0.675   0.647  -9.072
  408    HB2  ASN  52          1HB       ASN  52  -3.051  -0.060  -9.065
  409    HB3  ASN  52          2HB       ASN  52  -3.528   1.589  -9.490
  410   HD21  ASN  52          1HD2      ASN  52  -0.713  -0.102 -10.761
  411   HD22  ASN  52          2HD2      ASN  52  -1.290  -0.200 -12.389
  412    H    LYS  53           H        LYS  53  -2.360   3.706  -8.517
  413    HA   LYS  53           HA       LYS  53  -1.300   4.932 -10.878
  414    HB2  LYS  53          1HB       LYS  53  -2.896   5.902  -8.538
  415    HB3  LYS  53          2HB       LYS  53  -2.183   7.061  -9.654
  416    HG2  LYS  53          1HG       LYS  53  -3.401   5.939 -11.506
  417    HG3  LYS  53          2HG       LYS  53  -4.152   4.874 -10.320
  418    HD2  LYS  53          1HD       LYS  53  -5.204   6.785  -9.242
  419    HD3  LYS  53          2HD       LYS  53  -4.407   7.884 -10.374
  420    HE2  LYS  53          1HE       LYS  53  -5.579   6.790 -12.233
  421    HE3  LYS  53          2HE       LYS  53  -6.391   5.727 -11.087
  422    HZ1  LYS  53          1HZ       LYS  53  -7.458   7.636 -10.104
  423    HZ2  LYS  53          2HZ       LYS  53  -7.781   7.594 -11.759
  424    HZ3  LYS  53          3HZ       LYS  53  -6.644   8.691 -11.151
  425    H    MET  54           H        MET  54  -0.240   4.553  -7.623
  426    HA   MET  54           HA       MET  54   1.719   6.662  -7.756
  427    HB2  MET  54          1HB       MET  54   1.151   4.466  -5.785
  428    HB3  MET  54          2HB       MET  54   2.556   5.516  -5.627
  429    HG2  MET  54          1HG       MET  54   1.224   7.409  -5.296
  430    HG3  MET  54          2HG       MET  54  -0.230   6.592  -5.860
  431    HE1  MET  54          1HE       MET  54   2.607   5.630  -3.182
  432    HE2  MET  54          2HE       MET  54   1.745   6.151  -1.736
  433    HE3  MET  54          3HE       MET  54   2.169   7.323  -2.983
  434    H    GLN  55           H        GLN  55   1.483   3.791  -9.252
  435    HA   GLN  55           HA       GLN  55   2.847   2.302 -10.233
  436    HB2  GLN  55          1HB       GLN  55   4.882   4.494  -9.847
  437    HB3  GLN  55          2HB       GLN  55   5.124   3.070 -10.866
  438    HG2  GLN  55          1HG       GLN  55   3.220   3.757 -12.238
  439    HG3  GLN  55          2HG       GLN  55   3.013   5.182 -11.226
  440   HE21  GLN  55          1HE2      GLN  55   3.580   4.986 -14.077
  441   HE22  GLN  55          2HE2      GLN  55   5.047   5.867 -14.332
  442    H    LEU  56           H        LEU  56   2.394   1.658  -7.709
  443    HA   LEU  56           HA       LEU  56   4.998   0.802  -6.693
  444    HB2  LEU  56          1HB       LEU  56   2.804   2.225  -5.371
  445    HB3  LEU  56          2HB       LEU  56   3.406   0.842  -4.446
  446    HG   LEU  56           HG       LEU  56   5.052   3.157  -5.474
  447   HD11  LEU  56          1HD1      LEU  56   3.508   3.796  -3.676
  448   HD12  LEU  56          2HD1      LEU  56   5.189   3.850  -3.151
  449   HD13  LEU  56          3HD1      LEU  56   4.157   2.506  -2.670
  450   HD21  LEU  56          1HD2      LEU  56   5.752   0.782  -3.767
  451   HD22  LEU  56          2HD2      LEU  56   6.770   2.210  -3.938
  452   HD23  LEU  56          3HD2      LEU  56   6.424   1.201  -5.344
  453    H    PHE  57           H        PHE  57   1.838  -0.032  -7.631
  454    HA   PHE  57           HA       PHE  57   2.398  -2.841  -7.088
  455    HB2  PHE  57          1HB       PHE  57   0.945  -2.176  -5.230
  456    HB3  PHE  57          2HB       PHE  57  -0.205  -1.462  -6.356
  457    HD1  PHE  57           HD1      PHE  57  -1.744  -2.830  -7.598
  458    HD2  PHE  57           HD2      PHE  57   1.141  -4.596  -5.010
  459    HE1  PHE  57           HE1      PHE  57  -2.950  -4.970  -7.716
  460    HE2  PHE  57           HE2      PHE  57  -0.064  -6.735  -5.126
  461    HZ   PHE  57           HZ       PHE  57  -2.107  -6.923  -6.478
  462    H    ASP  58           H        ASP  58   1.763  -4.152  -8.698
  463    HA   ASP  58           HA       ASP  58   0.216  -2.963 -10.907
  464    HB2  ASP  58          1HB       ASP  58   2.568  -3.159 -11.551
  465    HB3  ASP  58          2HB       ASP  58   2.584  -4.850 -11.064
  466    H    ASP  59           H        ASP  59  -1.291  -4.324 -11.912
  467    HA   ASP  59           HA       ASP  59  -2.392  -6.286 -10.136
  468    HB2  ASP  59          1HB       ASP  59  -4.211  -6.451 -11.739
  469    HB3  ASP  59          2HB       ASP  59  -3.816  -4.768 -11.462
  470    H    THR  60           H        THR  60  -0.112  -6.423 -12.607
  471    HA   THR  60           HA       THR  60  -0.630  -9.243 -13.156
  472    HB   THR  60           HB       THR  60   1.256  -7.255 -14.411
  473    HG1  THR  60           HG1      THR  60  -0.425  -6.900 -15.611
  474   HG21  THR  60          1HG2      THR  60   1.804  -8.990 -16.037
  475   HG22  THR  60          2HG2      THR  60   0.825 -10.151 -15.138
  476   HG23  THR  60          3HG2      THR  60   2.282  -9.470 -14.409
  477    H    GLU  61           H        GLU  61   2.260  -7.246 -12.453
  478    HA   GLU  61           HA       GLU  61   3.743  -9.551 -11.573
  479    HB2  GLU  61          1HB       GLU  61   4.598  -6.692 -11.230
  480    HB3  GLU  61          2HB       GLU  61   5.594  -8.128 -11.414
  481    HG2  GLU  61          1HG       GLU  61   4.896  -8.358 -13.717
  482    HG3  GLU  61          2HG       GLU  61   3.851  -6.950 -13.553
  483    H    GLY  62           H        GLY  62   1.638  -7.367 -10.028
  484    HA2  GLY  62          1HA       GLY  62   0.979  -7.397  -7.793
  485    HA3  GLY  62          2HA       GLY  62   2.349  -8.459  -7.440
  486    HA   PRO  63           HA       PRO  63   3.426  -4.459  -5.420
  487    HB2  PRO  63          1HB       PRO  63   5.121  -6.364  -3.911
  488    HB3  PRO  63          2HB       PRO  63   4.025  -5.111  -3.314
  489    HG2  PRO  63          1HG       PRO  63   3.400  -7.712  -3.144
  490    HG3  PRO  63          2HG       PRO  63   2.172  -6.471  -3.450
  491    HD2  PRO  63          1HD       PRO  63   3.453  -8.392  -5.362
  492    HD3  PRO  63          2HD       PRO  63   1.770  -7.808  -5.297
  493    H    LEU  64           H        LEU  64   4.893  -3.282  -6.434
  494    HA   LEU  64           HA       LEU  64   7.066  -4.541  -7.875
  495    HB2  LEU  64          1HB       LEU  64   6.498  -1.587  -7.601
  496    HB3  LEU  64          2HB       LEU  64   7.470  -2.380  -8.824
  497    HG   LEU  64           HG       LEU  64   4.492  -2.745  -8.527
  498   HD11  LEU  64          1HD1      LEU  64   5.008  -0.487  -9.259
  499   HD12  LEU  64          2HD1      LEU  64   4.337  -1.429 -10.591
  500   HD13  LEU  64          3HD1      LEU  64   6.071  -1.121 -10.516
  501   HD21  LEU  64          1HD2      LEU  64   6.401  -3.647 -10.672
  502   HD22  LEU  64          2HD2      LEU  64   4.653  -3.881 -10.666
  503   HD23  LEU  64          3HD2      LEU  64   5.658  -4.679  -9.452
  504    H    VAL  65           H        VAL  65   8.396  -5.334  -6.362
  505    HA   VAL  65           HA       VAL  65   9.097  -4.347  -3.919
  506    HB   VAL  65           HB       VAL  65  10.782  -6.000  -5.786
  507   HG11  VAL  65          1HG1      VAL  65  12.191  -4.980  -4.076
  508   HG12  VAL  65          2HG1      VAL  65  12.014  -6.712  -3.793
  509   HG13  VAL  65          3HG1      VAL  65  11.100  -5.562  -2.816
  510   HG21  VAL  65          1HG2      VAL  65   9.957  -7.860  -4.364
  511   HG22  VAL  65          2HG2      VAL  65   8.692  -7.052  -5.286
  512   HG23  VAL  65          3HG2      VAL  65   8.882  -6.712  -3.566
  513    H    ASP  66           H        ASP  66  10.797  -3.720  -6.990
  514    HA   ASP  66           HA       ASP  66  12.975  -2.351  -5.884
  515    HB2  ASP  66          1HB       ASP  66  13.023  -3.149  -8.156
  516    HB3  ASP  66          2HB       ASP  66  11.711  -2.067  -8.608
  517    H    ASN  67           H        ASN  67   9.980  -0.993  -7.302
  518    HA   ASN  67           HA       ASN  67  10.568   1.683  -6.622
  519    HB2  ASN  67          1HB       ASN  67   7.980   0.278  -7.244
  520    HB3  ASN  67          2HB       ASN  67   8.036   1.980  -6.819
  521   HD21  ASN  67          1HD2      ASN  67   7.228   2.576  -8.818
  522   HD22  ASN  67          2HD2      ASN  67   8.199   2.531 -10.251
  523    H    LEU  68           H        LEU  68   9.031  -0.942  -4.919
  524    HA   LEU  68           HA       LEU  68   7.906   0.500  -2.800
  525    HB2  LEU  68          1HB       LEU  68   8.744  -2.336  -3.190
  526    HB3  LEU  68          2HB       LEU  68   8.280  -1.788  -1.589
  527    HG   LEU  68           HG       LEU  68   6.497  -1.413  -3.980
  528   HD11  LEU  68          1HD1      LEU  68   5.331  -3.431  -3.332
  529   HD12  LEU  68          2HD1      LEU  68   6.483  -3.709  -2.026
  530   HD13  LEU  68          3HD1      LEU  68   7.012  -3.806  -3.706
  531   HD21  LEU  68          1HD2      LEU  68   4.768  -1.220  -2.288
  532   HD22  LEU  68          2HD2      LEU  68   6.050  -0.045  -2.000
  533   HD23  LEU  68          3HD2      LEU  68   5.959  -1.506  -1.019
  534    H    VAL  69           H        VAL  69  11.067  -1.108  -3.053
  535    HA   VAL  69           HA       VAL  69  11.964  -0.305  -0.486
  536    HB   VAL  69           HB       VAL  69  13.555  -1.097  -2.916
  537   HG11  VAL  69          1HG1      VAL  69  14.341  -0.811  -0.026
  538   HG12  VAL  69          2HG1      VAL  69  14.966   0.106  -1.396
  539   HG13  VAL  69          3HG1      VAL  69  15.326  -1.615  -1.250
  540   HG21  VAL  69          1HG2      VAL  69  12.658  -2.701  -0.529
  541   HG22  VAL  69          2HG2      VAL  69  13.675  -3.287  -1.848
  542   HG23  VAL  69          3HG2      VAL  69  12.003  -2.822  -2.164
  543    H    HIS  70           H        HIS  70  12.369   1.073  -3.735
  544    HA   HIS  70           HA       HIS  70  14.100   3.163  -3.030
  545    HB2  HIS  70          1HB       HIS  70  12.072   2.886  -5.241
  546    HB3  HIS  70          2HB       HIS  70  13.073   4.325  -5.072
  547    HD1  HIS  70           HD1      HIS  70  13.745   3.297  -7.582
  548    HD2  HIS  70           HD2      HIS  70  15.239   1.381  -4.212
  549    HE1  HIS  70           HE1      HIS  70  15.737   1.987  -8.378
  550    HE2  HIS  70           HE2      HIS  70  16.523   0.713  -6.352
  551    H    GLN  71           H        GLN  71  10.666   2.816  -2.648
  552    HA   GLN  71           HA       GLN  71  10.266   5.618  -1.975
  553    HB2  GLN  71          1HB       GLN  71   8.592   4.190  -3.255
  554    HB3  GLN  71          2HB       GLN  71   8.278   3.363  -1.733
  555    HG2  GLN  71          1HG       GLN  71   6.598   5.038  -2.091
  556    HG3  GLN  71          2HG       GLN  71   7.608   5.485  -0.717
  557   HE21  GLN  71          1HE2      GLN  71   7.169   7.655  -0.830
  558   HE22  GLN  71          2HE2      GLN  71   7.741   8.663  -2.108
  559    H    LEU  72           H        LEU  72   9.643   2.517  -0.339
  560    HA   LEU  72           HA       LEU  72   9.012   3.675   2.129
  561    HB2  LEU  72          1HB       LEU  72   9.843   0.876   1.418
  562    HB3  LEU  72          2HB       LEU  72   9.380   1.346   3.040
  563    HG   LEU  72           HG       LEU  72   7.603   1.575   0.610
  564   HD11  LEU  72          1HD1      LEU  72   8.038  -0.758   1.176
  565   HD12  LEU  72          2HD1      LEU  72   6.382  -0.317   1.598
  566   HD13  LEU  72          3HD1      LEU  72   7.611  -0.445   2.858
  567   HD21  LEU  72          1HD2      LEU  72   6.955   3.212   2.207
  568   HD22  LEU  72          2HD2      LEU  72   7.134   2.075   3.544
  569   HD23  LEU  72          3HD2      LEU  72   5.832   1.861   2.371
  570    H    ALA  73           H        ALA  73  12.077   2.326   0.950
  571    HA   ALA  73           HA       ALA  73  13.428   2.657   3.438
  572    HB1  ALA  73          1HB       ALA  73  14.638   2.366   0.705
  573    HB2  ALA  73          2HB       ALA  73  14.080   1.026   1.704
  574    HB3  ALA  73          3HB       ALA  73  15.415   2.043   2.258
  575    H    HIS  74           H        HIS  74  12.090   5.023   2.587
  576    HA   HIS  74           HA       HIS  74  13.954   6.954   1.618
  577    HB2  HIS  74          1HB       HIS  74  11.498   7.204   1.356
  578    HB3  HIS  74          2HB       HIS  74  11.331   7.336   3.103
  579    HD1  HIS  74           HD1      HIS  74  11.142   9.646   3.910
  580    HD2  HIS  74           HD2      HIS  74  13.224   9.447   0.315
  581    HE1  HIS  74           HE1      HIS  74  11.636  12.026   3.282
  582    HE2  HIS  74           HE2      HIS  74  12.676  11.884   0.990
  583    H    GLY  75           H        GLY  75  15.760   6.603   2.996
  584    HA2  GLY  75          1HA       GLY  75  17.020   7.708   4.674
  585    HA3  GLY  75          2HA       GLY  75  15.527   8.042   5.542
  586    H    ARG  76           H        ARG  76  16.430   4.907   4.242
  587    HA   ARG  76           HA       ARG  76  17.266   3.904   6.830
  588    HB2  ARG  76          1HB       ARG  76  14.586   3.414   5.728
  589    HB3  ARG  76          2HB       ARG  76  15.438   1.962   6.227
  590    HG2  ARG  76          1HG       ARG  76  15.838   3.160   8.438
  591    HG3  ARG  76          2HG       ARG  76  14.609   4.309   7.900
  592    HD2  ARG  76          1HD       ARG  76  13.049   2.434   7.583
  593    HD3  ARG  76          2HD       ARG  76  14.268   1.332   8.204
  594    HE   ARG  76           HE       ARG  76  13.859   3.339  10.106
  595   HH11  ARG  76          1HH1      ARG  76  12.146   0.661   8.646
  596   HH12  ARG  76          2HH1      ARG  76  11.165   0.353  10.043
  597   HH21  ARG  76          1HH2      ARG  76  12.562   2.944  11.952
  598   HH22  ARG  76          2HH2      ARG  76  11.385   1.670  11.919
  599    H    ASP  77           H        ASP  77  17.735   1.488   6.659
  600    HA   ASP  77           HA       ASP  77  19.424   0.974   4.449
  601    HB2  ASP  77          1HB       ASP  77  18.342  -0.960   6.506
  602    HB3  ASP  77          2HB       ASP  77  19.705  -1.254   5.434
  603    H    ALA  78           H        ALA  78  18.661   0.696   2.510
  604    HA   ALA  78           HA       ALA  78  16.103  -0.068   1.754
  605    HB1  ALA  78          1HB       ALA  78  17.028  -0.326  -0.475
  606    HB2  ALA  78          2HB       ALA  78  18.661  -0.357   0.193
  607    HB3  ALA  78          3HB       ALA  78  17.686   1.108   0.313
  608    H    GLU  79           H        GLU  79  18.950  -2.033   2.347
  609    HA   GLU  79           HA       GLU  79  18.016  -4.398   1.122
  610    HB2  GLU  79          1HB       GLU  79  20.041  -3.985   3.316
  611    HB3  GLU  79          2HB       GLU  79  19.753  -5.527   2.519
  612    HG2  GLU  79          1HG       GLU  79  20.324  -4.445   0.358
  613    HG3  GLU  79          2HG       GLU  79  20.767  -2.994   1.253
  614    H    GLU  80           H        GLU  80  17.806  -3.208   4.450
  615    HA   GLU  80           HA       GLU  80  16.501  -5.475   5.521
  616    HB2  GLU  80          1HB       GLU  80  16.412  -2.584   6.392
  617    HB3  GLU  80          2HB       GLU  80  15.810  -3.938   7.339
  618    HG2  GLU  80          1HG       GLU  80  18.657  -3.421   6.533
  619    HG3  GLU  80          2HG       GLU  80  17.972  -3.287   8.144
  620    H    VAL  81           H        VAL  81  15.337  -2.425   4.184
  621    HA   VAL  81           HA       VAL  81  12.601  -2.749   4.533
  622    HB   VAL  81           HB       VAL  81  14.104  -1.308   2.352
  623   HG11  VAL  81          1HG1      VAL  81  12.033   0.004   2.056
  624   HG12  VAL  81          2HG1      VAL  81  11.202  -1.107   3.149
  625   HG13  VAL  81          3HG1      VAL  81  11.829  -1.690   1.608
  626   HG21  VAL  81          1HG2      VAL  81  13.589   0.658   3.750
  627   HG22  VAL  81          2HG2      VAL  81  14.653  -0.508   4.526
  628   HG23  VAL  81          3HG2      VAL  81  12.949  -0.432   4.977
  629    H    ARG  82           H        ARG  82  14.620  -3.633   1.738
  630    HA   ARG  82           HA       ARG  82  12.767  -4.723   0.032
  631    HB2  ARG  82          1HB       ARG  82  15.199  -4.422  -0.387
  632    HB3  ARG  82          2HB       ARG  82  15.511  -5.842   0.602
  633    HG2  ARG  82          1HG       ARG  82  14.063  -7.134  -0.976
  634    HG3  ARG  82          2HG       ARG  82  14.056  -5.710  -2.017
  635    HD2  ARG  82          1HD       ARG  82  16.552  -5.786  -1.982
  636    HD3  ARG  82          2HD       ARG  82  16.439  -7.326  -1.138
  637    HE   ARG  82           HE       ARG  82  14.968  -7.253  -3.605
  638   HH11  ARG  82          1HH1      ARG  82  18.093  -7.837  -2.143
  639   HH12  ARG  82          2HH1      ARG  82  18.661  -8.828  -3.449
  640   HH21  ARG  82          1HH2      ARG  82  15.719  -8.546  -5.335
  641   HH22  ARG  82          2HH2      ARG  82  17.316  -9.223  -5.268
  642    H    THR  83           H        THR  83  14.397  -6.289   2.754
  643    HA   THR  83           HA       THR  83  13.360  -8.871   2.307
  644    HB   THR  83           HB       THR  83  14.583  -7.505   4.685
  645    HG1  THR  83           HG1      THR  83  15.527  -8.692   2.543
  646   HG21  THR  83          1HG2      THR  83  14.662  -9.660   5.842
  647   HG22  THR  83          2HG2      THR  83  13.710 -10.396   4.551
  648   HG23  THR  83          3HG2      THR  83  12.994  -9.149   5.573
  649    H    GLU  84           H        GLU  84  12.405  -6.355   4.657
  650    HA   GLU  84           HA       GLU  84  10.241  -7.696   5.779
  651    HB2  GLU  84          1HB       GLU  84  10.553  -4.714   5.404
  652    HB3  GLU  84          2HB       GLU  84   9.508  -5.515   6.572
  653    HG2  GLU  84          1HG       GLU  84  11.529  -6.535   7.579
  654    HG3  GLU  84          2HG       GLU  84  12.509  -5.551   6.499
  655    H    VAL  85           H        VAL  85  10.326  -5.549   2.936
  656    HA   VAL  85           HA       VAL  85   7.592  -5.561   2.348
  657    HB   VAL  85           HB       VAL  85  10.022  -5.320   0.582
  658   HG11  VAL  85          1HG1      VAL  85   8.267  -6.325  -0.772
  659   HG12  VAL  85          2HG1      VAL  85   8.516  -4.640  -1.241
  660   HG13  VAL  85          3HG1      VAL  85   7.129  -5.085  -0.243
  661   HG21  VAL  85          1HG2      VAL  85   9.286  -2.994   0.417
  662   HG22  VAL  85          2HG2      VAL  85   9.566  -3.475   2.092
  663   HG23  VAL  85          3HG2      VAL  85   7.917  -3.355   1.471
  664    H    LEU  86           H        LEU  86  10.168  -7.738   1.197
  665    HA   LEU  86           HA       LEU  86   8.626  -9.351  -0.450
  666    HB2  LEU  86          1HB       LEU  86  11.116  -9.965   1.131
  667    HB3  LEU  86          2HB       LEU  86  10.404 -11.085  -0.027
  668    HG   LEU  86           HG       LEU  86  11.295  -8.305  -0.755
  669   HD11  LEU  86          1HD1      LEU  86  12.791 -10.906  -1.046
  670   HD12  LEU  86          2HD1      LEU  86  13.190  -9.610   0.081
  671   HD13  LEU  86          3HD1      LEU  86  13.308  -9.334  -1.658
  672   HD21  LEU  86          1HD2      LEU  86  10.601 -10.748  -2.370
  673   HD22  LEU  86          2HD2      LEU  86  11.270  -9.256  -3.032
  674   HD23  LEU  86          3HD2      LEU  86   9.680  -9.247  -2.273
  675    H    LYS  87           H        LYS  87   9.063  -9.434   3.025
  676    HA   LYS  87           HA       LYS  87   7.906 -12.020   3.412
  677    HB2  LYS  87          1HB       LYS  87   8.402  -9.713   5.293
  678    HB3  LYS  87          2HB       LYS  87   7.693 -11.237   5.811
  679    HG2  LYS  87          1HG       LYS  87   9.702 -12.421   5.060
  680    HG3  LYS  87          2HG       LYS  87  10.419 -10.873   4.580
  681    HD2  LYS  87          1HD       LYS  87  10.341 -10.105   6.880
  682    HD3  LYS  87          2HD       LYS  87   9.548 -11.603   7.376
  683    HE2  LYS  87          1HE       LYS  87  11.565 -12.824   6.499
  684    HE3  LYS  87          2HE       LYS  87  12.347 -11.254   6.329
  685    HZ1  LYS  87          1HZ       LYS  87  11.997 -10.895   8.714
  686    HZ2  LYS  87          2HZ       LYS  87  12.956 -12.252   8.412
  687    HZ3  LYS  87          3HZ       LYS  87  11.335 -12.447   8.852
  688    H    CYS  88           H        CYS  88   6.598  -9.094   2.521
  689    HA   CYS  88           HA       CYS  88   3.944  -9.872   3.512
  690    HB2  CYS  88          1HB       CYS  88   5.187  -7.208   2.948
  691    HB3  CYS  88          2HB       CYS  88   3.422  -7.390   2.860
  692    H    VAL  89           H        VAL  89   5.900  -9.830   0.815
  693    HA   VAL  89           HA       VAL  89   3.883  -9.336  -1.165
  694    HB   VAL  89           HB       VAL  89   6.647 -10.525  -1.420
  695   HG11  VAL  89          1HG1      VAL  89   4.574  -9.810  -3.468
  696   HG12  VAL  89          2HG1      VAL  89   5.433 -11.338  -3.266
  697   HG13  VAL  89          3HG1      VAL  89   6.288  -9.917  -3.867
  698   HG21  VAL  89          1HG2      VAL  89   5.589  -7.766  -2.012
  699   HG22  VAL  89          2HG2      VAL  89   7.204  -8.340  -2.426
  700   HG23  VAL  89          3HG2      VAL  89   6.721  -8.211  -0.736
  701    H    ASP  90           H        ASP  90   2.530 -10.737  -1.999
  702    HA   ASP  90           HA       ASP  90   3.085 -13.605  -1.791
  703    HB2  ASP  90          1HB       ASP  90   0.517 -12.185  -1.128
  704    HB3  ASP  90          2HB       ASP  90   0.538 -13.890  -1.572
  705    H    LYS  91           H        LYS  91   1.665 -14.854  -3.305
  706    HA   LYS  91           HA       LYS  91   1.605 -13.529  -5.909
  707    HB2  LYS  91          1HB       LYS  91   0.973 -16.424  -5.369
  708    HB3  LYS  91          2HB       LYS  91   1.570 -15.684  -6.850
  709    HG2  LYS  91          1HG       LYS  91   3.700 -15.221  -5.735
  710    HG3  LYS  91          2HG       LYS  91   3.106 -16.058  -4.303
  711    HD2  LYS  91          1HD       LYS  91   2.846 -18.107  -5.619
  712    HD3  LYS  91          2HD       LYS  91   3.458 -17.264  -7.044
  713    HE2  LYS  91          1HE       LYS  91   5.583 -16.879  -5.919
  714    HE3  LYS  91          2HE       LYS  91   4.973 -17.675  -4.469
  715    HZ1  LYS  91          1HZ       LYS  91   6.341 -19.169  -5.758
  716    HZ2  LYS  91          2HZ       LYS  91   5.366 -18.950  -7.121
  717    HZ3  LYS  91          3HZ       LYS  91   4.743 -19.720  -5.749
  718    H    ASN  92           H        ASN  92  -0.286 -14.017  -7.325
  719    HA   ASN  92           HA       ASN  92  -2.645 -13.167  -5.905
  720    HB2  ASN  92          1HB       ASN  92  -1.943 -12.225  -8.124
  721    HB3  ASN  92          2HB       ASN  92  -2.382 -13.769  -8.846
  722   HD21  ASN  92          1HD2      ASN  92  -3.931 -12.730 -10.123
  723   HD22  ASN  92          2HD2      ASN  92  -5.449 -12.210  -9.475
  724    H    THR  93           H        THR  93  -2.362 -15.448  -4.817
  725    HA   THR  93           HA       THR  93  -3.967 -17.446  -6.189
  726    HB   THR  93           HB       THR  93  -3.716 -18.765  -4.130
  727    HG1  THR  93           HG1      THR  93  -3.587 -17.438  -2.435
  728   HG21  THR  93          1HG2      THR  93  -1.147 -17.519  -5.100
  729   HG22  THR  93          2HG2      THR  93  -1.951 -18.938  -5.771
  730   HG23  THR  93          3HG2      THR  93  -1.258 -19.002  -4.152
  731    H    ASP  94           H        ASP  94  -4.466 -14.635  -4.582
  732    HA   ASP  94           HA       ASP  94  -6.909 -15.301  -3.202
  733    HB2  ASP  94          1HB       ASP  94  -5.376 -13.485  -2.433
  734    HB3  ASP  94          2HB       ASP  94  -5.765 -12.582  -3.902
  735    H    ASN  95           H        ASN  95  -5.881 -14.272  -6.301
  736    HA   ASN  95           HA       ASN  95  -6.892 -14.165  -8.305
  737    HB2  ASN  95          1HB       ASN  95  -9.278 -15.331  -6.859
  738    HB3  ASN  95          2HB       ASN  95  -9.106 -15.216  -8.602
  739   HD21  ASN  95          1HD2      ASN  95  -6.247 -15.894  -8.555
  740   HD22  ASN  95          2HD2      ASN  95  -6.184 -17.596  -8.221
  741    H    ASN  96           H        ASN  96  -7.225 -12.008  -6.182
  742    HA   ASN  96           HA       ASN  96  -9.013 -10.380  -7.789
  743    HB2  ASN  96          1HB       ASN  96 -10.560 -11.153  -6.127
  744    HB3  ASN  96          2HB       ASN  96  -9.411 -10.847  -4.824
  745   HD21  ASN  96          1HD2      ASN  96 -11.619  -9.424  -7.109
  746   HD22  ASN  96          2HD2      ASN  96 -11.716  -7.872  -6.348
  747    H    ALA  97           H        ALA  97  -8.058  -8.502  -8.174
  748    HA   ALA  97           HA       ALA  97  -5.476  -7.993  -7.152
  749    HB1  ALA  97          1HB       ALA  97  -6.184  -7.405  -9.428
  750    HB2  ALA  97          2HB       ALA  97  -5.488  -6.034  -8.563
  751    HB3  ALA  97          3HB       ALA  97  -7.235  -6.156  -8.761
  752    H    CYS  98           H        CYS  98  -8.652  -6.686  -6.316
  753    HA   CYS  98           HA       CYS  98  -7.739  -4.442  -4.858
  754    HB2  CYS  98          1HB       CYS  98 -10.247  -6.064  -4.382
  755    HB3  CYS  98          2HB       CYS  98  -9.910  -4.475  -3.712
  756    H    HIS  99           H        HIS  99  -8.368  -7.793  -3.824
  757    HA   HIS  99           HA       HIS  99  -7.684  -7.120  -1.097
  758    HB2  HIS  99          1HB       HIS  99  -9.384  -8.887  -1.758
  759    HB3  HIS  99          2HB       HIS  99  -8.022  -9.893  -2.237
  760    HD1  HIS  99           HD1      HIS  99  -7.757 -11.625  -0.486
  761    HD2  HIS  99           HD2      HIS  99  -8.561  -7.877   1.140
  762    HE1  HIS  99           HE1      HIS  99  -7.614 -11.914   2.011
  763    HE2  HIS  99           HE2      HIS  99  -8.313  -9.691   2.963
  764    H    TRP 100           H        TRP 100  -6.109  -8.377  -3.897
  765    HA   TRP 100           HA       TRP 100  -3.863  -9.561  -2.693
  766    HB2  TRP 100          1HB       TRP 100  -4.529  -9.796  -5.101
  767    HB3  TRP 100          2HB       TRP 100  -3.959  -8.151  -5.376
  768    HD1  TRP 100           HD1      TRP 100  -1.683  -9.964  -3.061
  769    HE1  TRP 100           HE1      TRP 100   0.409 -10.769  -4.322
  770    HE3  TRP 100           HE3      TRP 100  -3.253  -9.174  -7.866
  771    HZ2  TRP 100           HZ2      TRP 100   1.280 -11.048  -6.982
  772    HZ3  TRP 100           HZ3      TRP 100  -1.731  -9.736  -9.710
  773    HH2  TRP 100           HH2      TRP 100   0.489 -10.655  -9.283
  774    H    ALA 101           H        ALA 101  -4.296  -6.301  -4.055
  775    HA   ALA 101           HA       ALA 101  -1.816  -5.266  -3.207
  776    HB1  ALA 101          1HB       ALA 101  -2.801  -3.072  -3.674
  777    HB2  ALA 101          2HB       ALA 101  -4.396  -3.817  -3.789
  778    HB3  ALA 101          3HB       ALA 101  -3.148  -4.226  -4.964
  779    H    PHE 102           H        PHE 102  -5.006  -5.327  -1.740
  780    HA   PHE 102           HA       PHE 102  -4.446  -3.582   0.383
  781    HB2  PHE 102          1HB       PHE 102  -6.714  -4.108  -0.332
  782    HB3  PHE 102          2HB       PHE 102  -6.520  -5.768   0.217
  783    HD1  PHE 102           HD1      PHE 102  -6.435  -2.252   1.411
  784    HD2  PHE 102           HD2      PHE 102  -7.133  -6.333   2.403
  785    HE1  PHE 102           HE1      PHE 102  -7.243  -1.572   3.632
  786    HE2  PHE 102           HE2      PHE 102  -7.945  -5.660   4.623
  787    HZ   PHE 102           HZ       PHE 102  -8.001  -3.274   5.241
  788    H    ARG 103           H        ARG 103  -3.954  -7.021  -0.049
  789    HA   ARG 103           HA       ARG 103  -3.575  -7.602   2.724
  790    HB2  ARG 103          1HB       ARG 103  -4.258  -9.277   0.968
  791    HB3  ARG 103          2HB       ARG 103  -2.600  -9.231   0.389
  792    HG2  ARG 103          1HG       ARG 103  -1.773 -10.065   2.466
  793    HG3  ARG 103          2HG       ARG 103  -3.368  -9.944   3.198
  794    HD2  ARG 103          1HD       ARG 103  -2.807 -12.252   2.567
  795    HD3  ARG 103          2HD       ARG 103  -4.210 -11.649   1.697
  796    HE   ARG 103           HE       ARG 103  -1.741 -11.309   0.272
  797   HH11  ARG 103          1HH1      ARG 103  -4.372 -13.478   1.007
  798   HH12  ARG 103          2HH1      ARG 103  -4.175 -14.427  -0.425
  799   HH21  ARG 103          1HH2      ARG 103  -1.464 -12.560  -1.638
  800   HH22  ARG 103          2HH2      ARG 103  -2.500 -13.914  -1.931
  801    H    GLY 104           H        GLY 104  -1.476  -6.813   0.008
  802    HA2  GLY 104          1HA       GLY 104   1.001  -7.209   1.323
  803    HA3  GLY 104          2HA       GLY 104   0.726  -6.139  -0.058
  804    H    PHE 105           H        PHE 105  -1.082  -4.365   0.991
  805    HA   PHE 105           HA       PHE 105   0.588  -2.587   2.386
  806    HB2  PHE 105          1HB       PHE 105  -1.073  -1.670   0.963
  807    HB3  PHE 105          2HB       PHE 105  -2.353  -2.568   1.762
  808    HD1  PHE 105           HD1      PHE 105  -3.822  -0.991   2.640
  809    HD2  PHE 105           HD2      PHE 105   0.374  -0.439   3.140
  810    HE1  PHE 105           HE1      PHE 105  -4.252   0.963   4.064
  811    HE2  PHE 105           HE2      PHE 105  -0.059   1.519   4.566
  812    HZ   PHE 105           HZ       PHE 105  -2.370   2.222   5.030
  813    H    LYS 106           H        LYS 106  -2.183  -4.528   3.412
  814    HA   LYS 106           HA       LYS 106  -2.329  -3.570   6.035
  815    HB2  LYS 106          1HB       LYS 106  -4.251  -4.647   5.410
  816    HB3  LYS 106          2HB       LYS 106  -3.406  -5.966   4.611
  817    HG2  LYS 106          1HG       LYS 106  -2.782  -6.812   6.874
  818    HG3  LYS 106          2HG       LYS 106  -3.806  -5.547   7.564
  819    HD2  LYS 106          1HD       LYS 106  -5.736  -6.470   6.347
  820    HD3  LYS 106          2HD       LYS 106  -4.706  -7.744   5.696
  821    HE2  LYS 106          1HE       LYS 106  -4.241  -8.489   8.015
  822    HE3  LYS 106          2HE       LYS 106  -5.382  -7.279   8.599
  823    HZ1  LYS 106          1HZ       LYS 106  -6.022  -9.550   6.798
  824    HZ2  LYS 106          2HZ       LYS 106  -7.131  -8.378   7.317
  825    HZ3  LYS 106          3HZ       LYS 106  -6.424  -9.435   8.435
  826    H    CYS 107           H        CYS 107  -0.613  -6.351   4.665
  827    HA   CYS 107           HA       CYS 107   0.297  -7.466   7.053
  828    HB2  CYS 107          1HB       CYS 107   0.464  -8.770   5.090
  829    HB3  CYS 107          2HB       CYS 107   1.380  -7.535   4.235
  830    H    PHE 108           H        PHE 108   1.732  -5.003   4.958
  831    HA   PHE 108           HA       PHE 108   4.207  -4.931   6.364
  832    HB2  PHE 108          1HB       PHE 108   3.817  -4.326   3.938
  833    HB3  PHE 108          2HB       PHE 108   3.123  -2.812   4.516
  834    HD1  PHE 108           HD1      PHE 108   6.175  -4.788   4.139
  835    HD2  PHE 108           HD2      PHE 108   4.539  -1.078   5.445
  836    HE1  PHE 108           HE1      PHE 108   8.432  -3.818   4.208
  837    HE2  PHE 108           HE2      PHE 108   6.797  -0.106   5.512
  838    HZ   PHE 108           HZ       PHE 108   8.743  -1.474   4.888
  839    H    GLN 109           H        GLN 109   1.394  -2.737   6.235
  840    HA   GLN 109           HA       GLN 109   2.453  -0.805   7.979
  841    HB2  GLN 109          1HB       GLN 109   0.228   0.104   8.107
  842    HB3  GLN 109          2HB       GLN 109   0.560  -0.387   6.454
  843    HG2  GLN 109          1HG       GLN 109  -1.454  -1.329   6.554
  844    HG3  GLN 109          2HG       GLN 109  -0.646  -2.612   7.461
  845   HE21  GLN 109          1HE2      GLN 109  -3.404  -1.724   7.572
  846   HE22  GLN 109          2HE2      GLN 109  -3.704  -1.274   9.212
  847    H    LYS 110           H        LYS 110   1.092  -3.889   8.591
  848    HA   LYS 110           HA       LYS 110  -0.035  -3.422  11.132
  849    HB2  LYS 110          1HB       LYS 110  -0.511  -5.361   9.623
  850    HB3  LYS 110          2HB       LYS 110   1.071  -6.001  10.028
  851    HG2  LYS 110          1HG       LYS 110   0.458  -6.354  12.279
  852    HG3  LYS 110          2HG       LYS 110  -1.039  -5.447  12.083
  853    HD2  LYS 110          1HD       LYS 110  -1.832  -7.147  10.491
  854    HD3  LYS 110          2HD       LYS 110  -0.345  -8.062  10.751
  855    HE2  LYS 110          1HE       LYS 110  -2.287  -7.344  12.935
  856    HE3  LYS 110          2HE       LYS 110  -2.319  -8.872  12.060
  857    HZ1  LYS 110          1HZ       LYS 110  -0.074  -7.853  13.718
  858    HZ2  LYS 110          2HZ       LYS 110  -0.062  -9.303  12.845
  859    HZ3  LYS 110          3HZ       LYS 110  -1.137  -9.102  14.133
  860    H    ASN 111           H        ASN 111   3.225  -3.866  10.067
  861    HA   ASN 111           HA       ASN 111   4.070  -3.803  12.883
  862    HB2  ASN 111          1HB       ASN 111   5.336  -5.645  12.695
  863    HB3  ASN 111          2HB       ASN 111   4.461  -5.968  11.209
  864   HD21  ASN 111          1HD2      ASN 111   5.451  -5.615   9.241
  865   HD22  ASN 111          2HD2      ASN 111   7.151  -5.349   9.090
  866    H    ASN 112           H        ASN 112   4.327  -2.473   9.741
  867    HA   ASN 112           HA       ASN 112   6.442  -0.673  10.698
  868    HB2  ASN 112          1HB       ASN 112   6.385  -2.166   8.080
  869    HB3  ASN 112          2HB       ASN 112   7.319  -0.680   8.299
  870   HD21  ASN 112          1HD2      ASN 112   8.010  -3.577   7.829
  871   HD22  ASN 112          2HD2      ASN 112   9.218  -3.913   9.027
  872    H    LEU 113           H        LEU 113   4.163   0.398  11.021
  873    HA   LEU 113           HA       LEU 113   3.104   1.558   8.586
  874    HB2  LEU 113          1HB       LEU 113   1.487   0.946  10.215
  875    HB3  LEU 113          2HB       LEU 113   2.312   1.842  11.472
  876    HG   LEU 113           HG       LEU 113   1.757   3.943  10.218
  877   HD11  LEU 113          1HD1      LEU 113   0.095   3.874   8.482
  878   HD12  LEU 113          2HD1      LEU 113  -0.033   2.123   8.624
  879   HD13  LEU 113          3HD1      LEU 113   1.456   2.851   8.018
  880   HD21  LEU 113          1HD2      LEU 113   0.442   3.195  12.132
  881   HD22  LEU 113          2HD2      LEU 113  -0.557   2.208  11.066
  882   HD23  LEU 113          3HD2      LEU 113  -0.585   3.967  10.921
  883    H    SER 114           H        SER 114   5.126   2.513  11.269
  884    HA   SER 114           HA       SER 114   4.946   5.314  10.912
  885    HB2  SER 114          1HB       SER 114   5.869   4.066  12.934
  886    HB3  SER 114          2HB       SER 114   7.345   3.834  12.001
  887    HG   SER 114           HG       SER 114   7.880   5.834  12.363
  888    H    LEU 115           H        LEU 115   6.911   2.822   9.435
  889    HA   LEU 115           HA       LEU 115   8.716   4.516   8.072
  890    HB2  LEU 115          1HB       LEU 115   9.072   2.102   8.420
  891    HB3  LEU 115          2HB       LEU 115   7.748   1.764   7.323
  892    HG   LEU 115           HG       LEU 115   9.013   2.854   5.496
  893   HD11  LEU 115          1HD1      LEU 115  11.454   3.225   5.909
  894   HD12  LEU 115          2HD1      LEU 115  11.107   3.090   7.636
  895   HD13  LEU 115          3HD1      LEU 115  10.374   4.381   6.688
  896   HD21  LEU 115          1HD2      LEU 115  10.658   1.062   5.212
  897   HD22  LEU 115          2HD2      LEU 115   9.108   0.441   5.782
  898   HD23  LEU 115          3HD2      LEU 115  10.456   0.610   6.906
  899    H    ILE 116           H        ILE 116   5.528   3.261   7.324
  900    HA   ILE 116           HA       ILE 116   5.428   4.010   4.613
  901    HB   ILE 116           HB       ILE 116   3.197   3.646   6.627
  902   HG12  ILE 116          1HG1      ILE 116   4.302   1.820   4.476
  903   HG13  ILE 116          2HG1      ILE 116   4.532   1.632   6.221
  904   HG21  ILE 116          1HG2      ILE 116   1.692   3.467   4.707
  905   HG22  ILE 116          2HG2      ILE 116   3.026   3.868   3.626
  906   HG23  ILE 116          3HG2      ILE 116   2.443   5.062   4.787
  907   HD11  ILE 116          1HD1      ILE 116   2.072   1.376   6.437
  908   HD12  ILE 116          2HD1      ILE 116   2.854   0.106   5.498
  909   HD13  ILE 116          3HD1      ILE 116   1.965   1.389   4.678
  910    H    LYS 117           H        LYS 117   4.544   5.652   7.595
  911    HA   LYS 117           HA       LYS 117   3.492   7.992   6.443
  912    HB2  LYS 117          1HB       LYS 117   4.738   7.468   9.137
  913    HB3  LYS 117          2HB       LYS 117   4.016   9.011   8.699
  914    HG2  LYS 117          1HG       LYS 117   1.868   7.902   8.329
  915    HG3  LYS 117          2HG       LYS 117   2.581   6.353   8.769
  916    HD2  LYS 117          1HD       LYS 117   3.058   7.205  11.014
  917    HD3  LYS 117          2HD       LYS 117   2.375   8.770  10.575
  918    HE2  LYS 117          1HE       LYS 117   0.198   7.739  10.224
  919    HE3  LYS 117          2HE       LYS 117   0.872   6.154  10.597
  920    HZ1  LYS 117          1HZ       LYS 117   0.712   8.453  12.467
  921    HZ2  LYS 117          2HZ       LYS 117   1.372   6.941  12.830
  922    HZ3  LYS 117          3HZ       LYS 117  -0.280   7.085  12.498
  923    H    ALA 118           H        ALA 118   6.753   7.178   7.596
  924    HA   ALA 118           HA       ALA 118   7.853   9.745   6.990
  925    HB1  ALA 118          1HB       ALA 118   8.773   8.343   8.737
  926    HB2  ALA 118          2HB       ALA 118   9.996   8.702   7.518
  927    HB3  ALA 118          3HB       ALA 118   9.214   7.120   7.548
  928    H    SER 119           H        SER 119   7.221   6.938   5.132
  929    HA   SER 119           HA       SER 119   9.191   7.263   3.133
  930    HB2  SER 119          1HB       SER 119   7.986   5.156   3.430
  931    HB3  SER 119          2HB       SER 119   6.469   5.942   3.002
  932    HG   SER 119           HG       SER 119   8.735   5.661   1.309
  933    H    ILE 120           H        ILE 120   5.901   8.481   3.520
  934    HA   ILE 120           HA       ILE 120   6.077   9.879   0.959
  935    HB   ILE 120           HB       ILE 120   3.710  10.490   1.363
  936   HG12  ILE 120          1HG1      ILE 120   3.860   8.632   3.736
  937   HG13  ILE 120          2HG1      ILE 120   3.918  10.388   3.877
  938   HG21  ILE 120          1HG2      ILE 120   4.215   8.521   0.074
  939   HG22  ILE 120          2HG2      ILE 120   2.800   8.215   1.082
  940   HG23  ILE 120          3HG2      ILE 120   4.371   7.562   1.546
  941   HD11  ILE 120          1HD1      ILE 120   1.716  10.549   2.870
  942   HD12  ILE 120          2HD1      ILE 120   1.691   9.532   4.308
  943   HD13  ILE 120          3HD1      ILE 120   1.653   8.797   2.708
  944    H    LYS 121           H        LYS 121   6.853  10.471   4.140
  945    HA   LYS 121           HA       LYS 121   6.001  13.244   4.115
  946    HB2  LYS 121          1HB       LYS 121   5.910  11.695   6.153
  947    HB3  LYS 121          2HB       LYS 121   7.654  11.907   6.239
  948    HG2  LYS 121          1HG       LYS 121   6.613  13.464   7.738
  949    HG3  LYS 121          2HG       LYS 121   7.286  14.363   6.373
  950    HD2  LYS 121          1HD       LYS 121   5.046  14.392   5.331
  951    HD3  LYS 121          2HD       LYS 121   4.398  13.579   6.756
  952    HE2  LYS 121          1HE       LYS 121   4.005  15.989   6.836
  953    HE3  LYS 121          2HE       LYS 121   5.058  15.459   8.145
  954    HZ1  LYS 121          1HZ       LYS 121   6.960  16.264   6.929
  955    HZ2  LYS 121          2HZ       LYS 121   5.829  17.510   7.085
  956    HZ3  LYS 121          3HZ       LYS 121   5.989  16.698   5.613
  957    H    LYS 122           H        LYS 122   7.202  14.722   3.219
  958    HA   LYS 122           HA       LYS 122   8.947  16.017   2.625
  959    HB2  LYS 122          1HB       LYS 122   9.893  14.643   4.915
  960    HB3  LYS 122          2HB       LYS 122  11.199  14.703   3.765
  961    HG2  LYS 122          1HG       LYS 122   9.668  17.032   4.901
  962    HG3  LYS 122          2HG       LYS 122  11.345  16.597   5.229
  963    HD2  LYS 122          1HD       LYS 122  11.773  16.929   2.760
  964    HD3  LYS 122          2HD       LYS 122  10.165  17.642   2.666
  965    HE2  LYS 122          1HE       LYS 122  11.798  19.396   2.905
  966    HE3  LYS 122          2HE       LYS 122  10.833  19.292   4.376
  967    HZ1  LYS 122          1HZ       LYS 122  13.542  18.132   4.011
  968    HZ2  LYS 122          2HZ       LYS 122  12.620  18.061   5.426
  969    HZ3  LYS 122          3HZ       LYS 122  13.185  19.550   4.864
  970    H    ASP 123           H        ASP 123  10.134  16.112   0.805
  971    HA   ASP 123           HA       ASP 123  10.517  13.769  -0.777
  972    HB2  ASP 123          1HB       ASP 123  10.089  15.922  -1.840
  973    HB3  ASP 123          2HB       ASP 123  11.569  16.580  -1.156
  974    H21  ACD 201           H21      ACD   1  -4.611   4.962   1.504
  975    H22  ACD 201           H22      ACD   1  -3.399   5.186   2.771
  976    H31  ACD 201           H31      ACD   1  -2.035   6.563   1.214
  977    H32  ACD 201           H32      ACD   1  -3.235   6.334  -0.055
  978    H41  ACD 201           H41      ACD   1  -2.840   3.878   0.010
  979    H42  ACD 201           H42      ACD   1  -1.340   4.759  -0.328
  980    H5   ACD 201           H5       ACD   1  -2.010   3.245   2.248
  981    H6   ACD 201           H6       ACD   1   0.265   3.760   2.765
  982    H71  ACD 201           H71      ACD   1   0.790   4.801   0.124
  983    H72  ACD 201           H72      ACD   1  -0.113   6.097   0.909
  984    H8   ACD 201           H8       ACD   1   1.711   6.391   2.603
  985    H9   ACD 201           H9       ACD   1   3.829   5.481   1.995
  986   H101  ACD 201          H101      ACD   1   2.795   4.694  -0.607
  987   H102  ACD 201          H102      ACD   1   2.324   3.386   0.484
  988    H11  ACD 201           H11      ACD   1   5.285   4.288   0.386
  989    H12  ACD 201           H12      ACD   1   5.626   1.957   0.095
  990   H131  ACD 201          H131      ACD   1   2.658   1.960  -0.620
  991   H132  ACD 201          H132      ACD   1   3.764   0.588  -0.708
  992    H14  ACD 201           H14      ACD   1   2.613   1.659   1.972
  993    H15  ACD 201           H15      ACD   1   2.552  -0.675   2.448
  994   H161  ACD 201          H161      ACD   1   2.784  -1.386  -0.352
  995   H162  ACD 201          H162      ACD   1   4.434  -0.969   0.127
  996   H171  ACD 201          H171      ACD   1   4.470  -2.657   1.842
  997   H172  ACD 201          H172      ACD   1   2.731  -2.926   1.710
  998   H181  ACD 201          H181      ACD   1   4.752  -3.500  -0.498
  999   H182  ACD 201          H182      ACD   1   3.017  -3.815  -0.578
 1000   H191  ACD 201          H191      ACD   1   4.997  -5.088   1.362
 1001   H192  ACD 201          H192      ACD   1   3.251  -5.333   1.430
 1002   H201  ACD 201          H201      ACD   1   4.348  -7.155   0.209
 1003   H202  ACD 201          H202      ACD   1   5.028  -6.028  -0.917
 1004   H203  ACD 201          H203      ACD   1   3.314  -6.266  -0.857
  Start of MODEL    9
    1    H1   MET   1          1H        MET   1  13.263  14.540 -13.994
    2    H2   MET   1          2H        MET   1  13.361  12.885 -14.301
    3    H3   MET   1          3H        MET   1  13.694  13.989 -15.533
    4    HA   MET   1           HA       MET   1  15.715  13.024 -14.656
    5    HB2  MET   1          1HB       MET   1  15.325  15.949 -13.978
    6    HB3  MET   1          2HB       MET   1  16.885  15.151 -14.106
    7    HG2  MET   1          1HG       MET   1  16.454  14.672 -16.457
    8    HG3  MET   1          2HG       MET   1  14.884  15.462 -16.331
    9    HE1  MET   1          1HE       MET   1  16.978  17.963 -18.511
   10    HE2  MET   1          2HE       MET   1  15.484  17.030 -18.404
   11    HE3  MET   1          3HE       MET   1  17.034  16.201 -18.537
   12    H    GLU   2           H        GLU   2  14.270  15.185 -12.201
   13    HA   GLU   2           HA       GLU   2  15.800  13.965 -10.106
   14    HB2  GLU   2          1HB       GLU   2  13.486  15.897  -9.954
   15    HB3  GLU   2          2HB       GLU   2  14.509  15.422  -8.607
   16    HG2  GLU   2          1HG       GLU   2  15.388  16.911 -11.065
   17    HG3  GLU   2          2HG       GLU   2  15.150  17.592  -9.458
   18    H    PHE   3           H        PHE   3  15.348  12.124  -9.188
   19    HA   PHE   3           HA       PHE   3  12.897  10.750  -9.568
   20    HB2  PHE   3          1HB       PHE   3  15.014   9.561  -9.209
   21    HB3  PHE   3          2HB       PHE   3  15.104  10.205  -7.566
   22    HD1  PHE   3           HD1      PHE   3  13.908   9.168  -5.791
   23    HD2  PHE   3           HD2      PHE   3  13.237   7.975  -9.817
   24    HE1  PHE   3           HE1      PHE   3  12.636   7.216  -4.997
   25    HE2  PHE   3           HE2      PHE   3  11.956   6.027  -9.030
   26    HZ   PHE   3           HZ       PHE   3  11.653   5.646  -6.621
   27    H    THR   4           H        THR   4  11.085  11.499  -8.724
   28    HA   THR   4           HA       THR   4  11.141  12.558  -5.965
   29    HB   THR   4           HB       THR   4   8.738  13.061  -7.607
   30    HG1  THR   4           HG1      THR   4  10.835  13.405  -8.941
   31   HG21  THR   4          1HG2      THR   4  10.483  14.753  -5.832
   32   HG22  THR   4          2HG2      THR   4   8.981  13.950  -5.379
   33   HG23  THR   4          3HG2      THR   4   8.957  15.265  -6.553
   34    H    VAL   5           H        VAL   5  10.469  11.208  -4.536
   35    HA   VAL   5           HA       VAL   5   8.705   8.995  -5.114
   36    HB   VAL   5           HB       VAL   5   9.084   8.265  -2.965
   37   HG11  VAL   5          1HG1      VAL   5  11.426  10.111  -3.249
   38   HG12  VAL   5          2HG1      VAL   5  11.230   8.583  -4.101
   39   HG13  VAL   5          3HG1      VAL   5  11.350   8.601  -2.343
   40   HG21  VAL   5          1HG2      VAL   5   9.441   9.631  -1.000
   41   HG22  VAL   5          2HG2      VAL   5   8.008  10.204  -1.852
   42   HG23  VAL   5          3HG2      VAL   5   9.527  11.087  -1.986
   43    H    SER   6           H        SER   6   6.596   8.739  -4.371
   44    HA   SER   6           HA       SER   6   4.931  10.979  -4.571
   45    HB2  SER   6          1HB       SER   6   4.263   8.343  -3.242
   46    HB3  SER   6          2HB       SER   6   3.125   9.489  -3.954
   47    HG   SER   6           HG       SER   6   4.204   9.099  -5.982
   48    H    THR   7           H        THR   7   4.690  12.586  -3.163
   49    HA   THR   7           HA       THR   7   5.485  12.162  -0.382
   50    HB   THR   7           HB       THR   7   5.537  14.639  -0.253
   51    HG1  THR   7           HG1      THR   7   5.146  14.618  -3.076
   52   HG21  THR   7          1HG2      THR   7   7.564  13.427  -0.840
   53   HG22  THR   7          2HG2      THR   7   7.489  14.952  -1.724
   54   HG23  THR   7          3HG2      THR   7   7.097  13.437  -2.540
   55    H    THR   8           H        THR   8   4.164  13.615   1.208
   56    HA   THR   8           HA       THR   8   1.663  12.427   1.427
   57    HB   THR   8           HB       THR   8   2.532  15.016   2.710
   58    HG1  THR   8           HG1      THR   8   3.775  12.812   2.916
   59   HG21  THR   8          1HG2      THR   8   0.962  14.367   4.479
   60   HG22  THR   8          2HG2      THR   8   0.491  12.955   3.531
   61   HG23  THR   8          3HG2      THR   8   0.150  14.577   2.925
   62    H    GLU   9           H        GLU   9   2.443  15.728   0.391
   63    HA   GLU   9           HA       GLU   9  -0.201  16.599   0.086
   64    HB2  GLU   9          1HB       GLU   9   1.891  18.020   0.208
   65    HB3  GLU   9          2HB       GLU   9   2.158  17.626  -1.484
   66    HG2  GLU   9          1HG       GLU   9   1.120  19.749  -1.407
   67    HG3  GLU   9          2HG       GLU   9  -0.093  18.600  -1.972
   68    H    ASP  10           H        ASP  10   2.035  15.074  -2.174
   69    HA   ASP  10           HA       ASP  10   0.273  15.436  -4.420
   70    HB2  ASP  10          1HB       ASP  10   2.205  15.276  -5.510
   71    HB3  ASP  10          2HB       ASP  10   3.029  14.827  -4.021
   72    H    LEU  11           H        LEU  11   1.077  12.918  -2.160
   73    HA   LEU  11           HA       LEU  11  -0.202  10.722  -3.285
   74    HB2  LEU  11          1HB       LEU  11   1.167  10.471  -1.348
   75    HB3  LEU  11          2HB       LEU  11   0.144  11.557  -0.406
   76    HG   LEU  11           HG       LEU  11  -1.673   9.855  -0.587
   77   HD11  LEU  11          1HD1      LEU  11   0.527   8.123  -1.684
   78   HD12  LEU  11          2HD1      LEU  11  -0.877   8.705  -2.578
   79   HD13  LEU  11          3HD1      LEU  11  -1.093   7.590  -1.231
   80   HD21  LEU  11          1HD2      LEU  11  -0.748   8.409   1.120
   81   HD22  LEU  11          2HD2      LEU  11  -0.221  10.069   1.389
   82   HD23  LEU  11          3HD2      LEU  11   0.885   8.894   0.679
   83    H    GLN  12           H        GLN  12  -1.516  13.527  -1.679
   84    HA   GLN  12           HA       GLN  12  -4.102  12.503  -1.160
   85    HB2  GLN  12          1HB       GLN  12  -3.113  15.325  -1.520
   86    HB3  GLN  12          2HB       GLN  12  -4.767  14.934  -1.080
   87    HG2  GLN  12          1HG       GLN  12  -3.922  13.822   0.955
   88    HG3  GLN  12          2HG       GLN  12  -2.290  14.338   0.524
   89   HE21  GLN  12          1HE2      GLN  12  -2.094  15.581   2.389
   90   HE22  GLN  12          2HE2      GLN  12  -2.929  17.083   2.577
   91    H    ARG  13           H        ARG  13  -2.570  13.717  -3.998
   92    HA   ARG  13           HA       ARG  13  -4.884  14.412  -5.482
   93    HB2  ARG  13          1HB       ARG  13  -2.571  15.109  -6.068
   94    HB3  ARG  13          2HB       ARG  13  -2.216  13.447  -6.515
   95    HG2  ARG  13          1HG       ARG  13  -4.157  13.645  -8.152
   96    HG3  ARG  13          2HG       ARG  13  -4.073  15.389  -7.849
   97    HD2  ARG  13          1HD       ARG  13  -1.880  13.624  -8.927
   98    HD3  ARG  13          2HD       ARG  13  -2.782  14.852  -9.812
   99    HE   ARG  13           HE       ARG  13  -1.674  16.245  -7.772
  100   HH11  ARG  13          1HH1      ARG  13  -0.365  14.067 -10.179
  101   HH12  ARG  13          2HH1      ARG  13   1.183  14.846 -10.230
  102   HH21  ARG  13          1HH2      ARG  13   0.353  17.273  -7.824
  103   HH22  ARG  13          2HH2      ARG  13   1.590  16.683  -8.887
  104    H    TYR  14           H        TYR  14  -2.828  11.507  -5.451
  105    HA   TYR  14           HA       TYR  14  -4.340  10.010  -7.287
  106    HB2  TYR  14          1HB       TYR  14  -2.672   8.941  -5.001
  107    HB3  TYR  14          2HB       TYR  14  -3.150   8.072  -6.450
  108    HD1  TYR  14           HD1      TYR  14  -0.338   9.073  -5.098
  109    HD2  TYR  14           HD2      TYR  14  -2.609  10.018  -8.572
  110    HE1  TYR  14           HE1      TYR  14   1.708   9.818  -6.229
  111    HE2  TYR  14           HE2      TYR  14  -0.563  10.758  -9.710
  112    HH   TYR  14           HH       TYR  14   1.708  11.635  -9.028
  113    H    ARG  15           H        ARG  15  -4.492  10.266  -3.782
  114    HA   ARG  15           HA       ARG  15  -6.349   8.224  -3.369
  115    HB2  ARG  15          1HB       ARG  15  -5.622   8.702  -1.320
  116    HB3  ARG  15          2HB       ARG  15  -5.078  10.296  -1.810
  117    HG2  ARG  15          1HG       ARG  15  -7.241  11.236  -1.343
  118    HG3  ARG  15          2HG       ARG  15  -7.927   9.629  -1.076
  119    HD2  ARG  15          1HD       ARG  15  -6.451   9.313   0.848
  120    HD3  ARG  15          2HD       ARG  15  -5.749  10.906   0.580
  121    HE   ARG  15           HE       ARG  15  -8.322  11.521   0.873
  122   HH11  ARG  15          1HH1      ARG  15  -6.303   9.325   2.705
  123   HH12  ARG  15          2HH1      ARG  15  -7.081   9.677   4.215
  124   HH21  ARG  15          1HH2      ARG  15  -9.361  11.974   2.850
  125   HH22  ARG  15          2HH2      ARG  15  -8.841  11.172   4.294
  126    H    THR  16           H        THR  16  -6.737  11.629  -4.104
  127    HA   THR  16           HA       THR  16  -9.516  11.791  -3.744
  128    HB   THR  16           HB       THR  16  -7.609  13.373  -5.456
  129    HG1  THR  16           HG1      THR  16  -7.254  13.839  -3.355
  130   HG21  THR  16          1HG2      THR  16  -9.397  15.036  -5.720
  131   HG22  THR  16          2HG2      THR  16 -10.524  13.950  -4.907
  132   HG23  THR  16          3HG2      THR  16  -9.831  13.497  -6.467
  133    H    GLU  17           H        GLU  17  -7.569  11.260  -6.699
  134    HA   GLU  17           HA       GLU  17  -9.749  11.085  -8.460
  135    HB2  GLU  17          1HB       GLU  17  -7.282   9.452  -8.965
  136    HB3  GLU  17          2HB       GLU  17  -8.273  10.341 -10.099
  137    HG2  GLU  17          1HG       GLU  17  -7.432  12.453  -9.152
  138    HG3  GLU  17          2HG       GLU  17  -6.332  11.522  -8.132
  139    H    CYS  18           H        CYS  18  -8.140   8.606  -6.522
  140    HA   CYS  18           HA       CYS  18  -9.607   6.429  -7.627
  141    HB2  CYS  18          1HB       CYS  18  -8.061   6.671  -5.040
  142    HB3  CYS  18          2HB       CYS  18  -8.766   5.167  -5.648
  143    H    VAL  19           H        VAL  19 -10.128   8.601  -4.920
  144    HA   VAL  19           HA       VAL  19 -12.249   7.150  -3.753
  145    HB   VAL  19           HB       VAL  19 -11.271   9.967  -3.507
  146   HG11  VAL  19          1HG1      VAL  19 -13.067  10.497  -1.944
  147   HG12  VAL  19          2HG1      VAL  19 -13.851   8.959  -2.309
  148   HG13  VAL  19          3HG1      VAL  19 -13.700  10.192  -3.564
  149   HG21  VAL  19          1HG2      VAL  19 -11.719   7.690  -1.581
  150   HG22  VAL  19          2HG2      VAL  19 -11.136   9.292  -1.123
  151   HG23  VAL  19          3HG2      VAL  19 -10.173   8.276  -2.197
  152    H    SER  20           H        SER  20 -12.149   9.872  -5.985
  153    HA   SER  20           HA       SER  20 -14.967  10.112  -6.188
  154    HB2  SER  20          1HB       SER  20 -13.122  11.861  -6.633
  155    HB3  SER  20          2HB       SER  20 -13.013  11.135  -8.236
  156    HG   SER  20           HG       SER  20 -15.229  11.620  -8.534
  157    H    SER  21           H        SER  21 -12.705   7.993  -7.766
  158    HA   SER  21           HA       SER  21 -14.486   7.535 -10.029
  159    HB2  SER  21          1HB       SER  21 -12.724   5.940 -10.770
  160    HB3  SER  21          2HB       SER  21 -12.108   7.569 -10.503
  161    HG   SER  21           HG       SER  21 -10.875   5.709  -9.601
  162    H    LEU  22           H        LEU  22 -13.179   5.712  -7.261
  163    HA   LEU  22           HA       LEU  22 -14.746   3.384  -7.913
  164    HB2  LEU  22          1HB       LEU  22 -13.005   4.071  -5.545
  165    HB3  LEU  22          2HB       LEU  22 -13.807   2.512  -5.754
  166    HG   LEU  22           HG       LEU  22 -11.842   3.638  -7.743
  167   HD11  LEU  22          1HD1      LEU  22 -10.696   3.336  -5.633
  168   HD12  LEU  22          2HD1      LEU  22 -10.230   2.053  -6.750
  169   HD13  LEU  22          3HD1      LEU  22 -11.389   1.725  -5.460
  170   HD21  LEU  22          1HD2      LEU  22 -12.879   0.846  -7.302
  171   HD22  LEU  22          2HD2      LEU  22 -11.769   1.374  -8.569
  172   HD23  LEU  22          3HD2      LEU  22 -13.436   1.950  -8.560
  173    H    ASN  23           H        ASN  23 -15.790   6.173  -6.926
  174    HA   ASN  23           HA       ASN  23 -17.528   7.017  -5.728
  175    HB2  ASN  23          1HB       ASN  23 -18.528   4.168  -5.826
  176    HB3  ASN  23          2HB       ASN  23 -19.489   5.582  -5.446
  177   HD21  ASN  23          1HD2      ASN  23 -18.067   3.693  -7.927
  178   HD22  ASN  23          2HD2      ASN  23 -18.722   4.577  -9.267
  179    H    ILE  24           H        ILE  24 -15.244   6.184  -4.212
  180    HA   ILE  24           HA       ILE  24 -15.934   4.729  -1.905
  181    HB   ILE  24           HB       ILE  24 -13.823   6.878  -2.102
  182   HG12  ILE  24          1HG1      ILE  24 -13.569   5.222  -3.925
  183   HG13  ILE  24          2HG1      ILE  24 -12.259   5.115  -2.755
  184   HG21  ILE  24          1HG2      ILE  24 -14.284   6.180   0.170
  185   HG22  ILE  24          2HG2      ILE  24 -12.712   5.564  -0.338
  186   HG23  ILE  24          3HG2      ILE  24 -14.106   4.485  -0.285
  187   HD11  ILE  24          1HD1      ILE  24 -13.010   2.921  -3.483
  188   HD12  ILE  24          2HD1      ILE  24 -14.638   3.279  -2.908
  189   HD13  ILE  24          3HD1      ILE  24 -13.305   3.154  -1.758
  190    HA   PRO  25           HA       PRO  25 -18.621   7.797  -0.041
  191    HB2  PRO  25          1HB       PRO  25 -18.378   6.033   2.298
  192    HB3  PRO  25          2HB       PRO  25 -19.817   6.531   1.406
  193    HG2  PRO  25          1HG       PRO  25 -18.837   4.038   1.262
  194    HG3  PRO  25          2HG       PRO  25 -19.638   4.830  -0.106
  195    HD2  PRO  25          1HD       PRO  25 -16.724   4.376   0.382
  196    HD3  PRO  25          2HD       PRO  25 -17.643   4.326  -1.144
  197    H    ALA  26           H        ALA  26 -18.309   9.475   1.274
  198    HA   ALA  26           HA       ALA  26 -15.752  10.278   2.026
  199    HB1  ALA  26          1HB       ALA  26 -18.383  11.229   3.138
  200    HB2  ALA  26          2HB       ALA  26 -17.635  11.799   1.647
  201    HB3  ALA  26          3HB       ALA  26 -16.851  12.100   3.200
  202    H    ASP  27           H        ASP  27 -18.149   8.449   3.753
  203    HA   ASP  27           HA       ASP  27 -17.318   8.566   6.376
  204    HB2  ASP  27          1HB       ASP  27 -19.281   7.320   5.653
  205    HB3  ASP  27          2HB       ASP  27 -18.262   6.145   4.832
  206    H    TYR  28           H        TYR  28 -16.196   6.213   3.941
  207    HA   TYR  28           HA       TYR  28 -14.153   5.127   5.515
  208    HB2  TYR  28          1HB       TYR  28 -14.715   5.154   2.568
  209    HB3  TYR  28          2HB       TYR  28 -13.234   4.419   3.185
  210    HD1  TYR  28           HD1      TYR  28 -16.923   4.249   3.235
  211    HD2  TYR  28           HD2      TYR  28 -13.295   2.281   4.267
  212    HE1  TYR  28           HE1      TYR  28 -18.180   2.189   3.700
  213    HE2  TYR  28           HE2      TYR  28 -14.543   0.216   4.737
  214    HH   TYR  28           HH       TYR  28 -17.723  -0.271   3.767
  215    H    VAL  29           H        VAL  29 -14.206   7.811   3.244
  216    HA   VAL  29           HA       VAL  29 -11.472   8.254   2.952
  217    HB   VAL  29           HB       VAL  29 -13.669  10.308   2.950
  218   HG11  VAL  29          1HG1      VAL  29 -11.487  11.332   3.115
  219   HG12  VAL  29          2HG1      VAL  29 -12.142  11.577   1.495
  220   HG13  VAL  29          3HG1      VAL  29 -10.902  10.351   1.773
  221   HG21  VAL  29          1HG2      VAL  29 -13.666   9.963   0.513
  222   HG22  VAL  29          2HG2      VAL  29 -14.138   8.511   1.397
  223   HG23  VAL  29          3HG2      VAL  29 -12.513   8.643   0.723
  224    H    GLU  30           H        GLU  30 -13.741   9.480   5.399
  225    HA   GLU  30           HA       GLU  30 -11.923  11.139   6.745
  226    HB2  GLU  30          1HB       GLU  30 -13.922  11.654   7.580
  227    HB3  GLU  30          2HB       GLU  30 -14.593  10.062   7.248
  228    HG2  GLU  30          1HG       GLU  30 -13.655   9.222   9.306
  229    HG3  GLU  30          2HG       GLU  30 -12.827  10.753   9.580
  230    H    LYS  31           H        LYS  31 -12.619   7.717   6.997
  231    HA   LYS  31           HA       LYS  31 -11.112   7.168   9.322
  232    HB2  LYS  31          1HB       LYS  31 -11.761   5.348   6.997
  233    HB3  LYS  31          2HB       LYS  31 -11.118   4.831   8.560
  234    HG2  LYS  31          1HG       LYS  31 -13.146   5.820   9.626
  235    HG3  LYS  31          2HG       LYS  31 -13.798   6.075   8.006
  236    HD2  LYS  31          1HD       LYS  31 -13.563   3.643   7.573
  237    HD3  LYS  31          2HD       LYS  31 -13.037   3.430   9.255
  238    HE2  LYS  31          1HE       LYS  31 -15.215   4.475   9.964
  239    HE3  LYS  31          2HE       LYS  31 -15.725   4.410   8.278
  240    HZ1  LYS  31          1HZ       LYS  31 -14.993   2.088   9.978
  241    HZ2  LYS  31          2HZ       LYS  31 -15.431   1.996   8.348
  242    HZ3  LYS  31          3HZ       LYS  31 -16.554   2.520   9.494
  243    H    PHE  32           H        PHE  32 -10.293   7.017   5.875
  244    HA   PHE  32           HA       PHE  32  -7.685   6.072   6.123
  245    HB2  PHE  32          1HB       PHE  32  -8.676   7.996   4.017
  246    HB3  PHE  32          2HB       PHE  32  -7.304   6.902   3.884
  247    HD1  PHE  32           HD1      PHE  32  -9.856   7.219   2.119
  248    HD2  PHE  32           HD2      PHE  32  -8.716   4.506   5.190
  249    HE1  PHE  32           HE1      PHE  32 -11.339   5.509   1.157
  250    HE2  PHE  32           HE2      PHE  32 -10.193   2.796   4.228
  251    HZ   PHE  32           HZ       PHE  32 -11.504   3.291   2.207
  252    H    LYS  33           H        LYS  33  -8.995   9.260   6.570
  253    HA   LYS  33           HA       LYS  33  -6.606  10.760   6.485
  254    HB2  LYS  33          1HB       LYS  33  -9.038  11.601   6.524
  255    HB3  LYS  33          2HB       LYS  33  -8.951  11.382   8.271
  256    HG2  LYS  33          1HG       LYS  33  -7.111  12.928   8.422
  257    HG3  LYS  33          2HG       LYS  33  -7.097  13.114   6.663
  258    HD2  LYS  33          1HD       LYS  33  -9.381  14.029   6.766
  259    HD3  LYS  33          2HD       LYS  33  -9.341  13.889   8.526
  260    HE2  LYS  33          1HE       LYS  33  -8.835  16.164   7.852
  261    HE3  LYS  33          2HE       LYS  33  -7.421  15.418   8.592
  262    HZ1  LYS  33          1HZ       LYS  33  -6.828  16.656   6.609
  263    HZ2  LYS  33          2HZ       LYS  33  -7.888  15.728   5.676
  264    HZ3  LYS  33          3HZ       LYS  33  -6.529  15.007   6.381
  265    H    LYS  34           H        LYS  34  -8.097   8.793   8.967
  266    HA   LYS  34           HA       LYS  34  -6.017   9.565  10.879
  267    HB2  LYS  34          1HB       LYS  34  -8.530   7.921  11.240
  268    HB3  LYS  34          2HB       LYS  34  -7.382   8.268  12.525
  269    HG2  LYS  34          1HG       LYS  34  -8.990  10.302  10.994
  270    HG3  LYS  34          2HG       LYS  34  -9.331   9.727  12.625
  271    HD2  LYS  34          1HD       LYS  34  -7.183  10.629  13.386
  272    HD3  LYS  34          2HD       LYS  34  -6.851  11.210  11.754
  273    HE2  LYS  34          1HE       LYS  34  -7.702  12.983  13.239
  274    HE3  LYS  34          2HE       LYS  34  -8.751  12.697  11.852
  275    HZ1  LYS  34          1HZ       LYS  34  -9.191  11.653  14.596
  276    HZ2  LYS  34          2HZ       LYS  34 -10.199  11.381  13.267
  277    HZ3  LYS  34          3HZ       LYS  34 -10.023  12.942  13.886
  278    H    TRP  35           H        TRP  35  -5.589   7.887   8.490
  279    HA   TRP  35           HA       TRP  35  -4.759   5.912   7.767
  280    HB2  TRP  35          1HB       TRP  35  -3.439   6.168  10.463
  281    HB3  TRP  35          2HB       TRP  35  -2.966   4.962   9.258
  282    HD1  TRP  35           HD1      TRP  35  -2.928   8.736   9.895
  283    HE1  TRP  35           HE1      TRP  35  -1.203   9.827   8.331
  284    HE3  TRP  35           HE3      TRP  35  -1.768   4.677   7.017
  285    HZ2  TRP  35           HZ2      TRP  35   0.429   9.066   6.169
  286    HZ3  TRP  35           HZ3      TRP  35  -0.118   4.943   5.220
  287    HH2  TRP  35           HH2      TRP  35   0.964   7.084   4.801
  288    H    GLU  36           H        GLU  36  -7.312   5.564   8.759
  289    HA   GLU  36           HA       GLU  36  -7.157   2.902   9.982
  290    HB2  GLU  36          1HB       GLU  36  -8.490   4.647  11.176
  291    HB3  GLU  36          2HB       GLU  36  -9.558   4.697   9.787
  292    HG2  GLU  36          1HG       GLU  36 -10.515   3.313  11.514
  293    HG3  GLU  36          2HG       GLU  36 -10.092   2.335  10.111
  294    H    PHE  37           H        PHE  37  -7.158   1.408   8.486
  295    HA   PHE  37           HA       PHE  37  -8.864   1.765   6.115
  296    HB2  PHE  37          1HB       PHE  37  -6.370   0.056   6.356
  297    HB3  PHE  37          2HB       PHE  37  -7.289   0.359   4.886
  298    HD1  PHE  37           HD1      PHE  37  -6.969   2.365   3.620
  299    HD2  PHE  37           HD2      PHE  37  -5.052   1.856   7.388
  300    HE1  PHE  37           HE1      PHE  37  -5.555   4.324   3.164
  301    HE2  PHE  37           HE2      PHE  37  -3.632   3.809   6.932
  302    HZ   PHE  37           HZ       PHE  37  -3.884   5.049   4.820
  303    HA   PRO  38           HA       PRO  38 -10.953  -1.648   8.406
  304    HB2  PRO  38          1HB       PRO  38 -12.940  -0.942   6.309
  305    HB3  PRO  38          2HB       PRO  38 -13.171  -1.230   8.043
  306    HG2  PRO  38          1HG       PRO  38 -13.255   1.244   7.096
  307    HG3  PRO  38          2HG       PRO  38 -12.429   0.895   8.626
  308    HD2  PRO  38          1HD       PRO  38 -11.241   1.359   5.907
  309    HD3  PRO  38          2HD       PRO  38 -10.691   1.955   7.502
  310    H    GLU  39           H        GLU  39 -11.237  -3.730   7.838
  311    HA   GLU  39           HA       GLU  39 -10.039  -4.586   5.369
  312    HB2  GLU  39          1HB       GLU  39  -9.641  -5.705   7.556
  313    HB3  GLU  39          2HB       GLU  39 -11.314  -6.239   7.551
  314    HG2  GLU  39          1HG       GLU  39 -10.937  -7.615   5.640
  315    HG3  GLU  39          2HG       GLU  39  -9.318  -6.951   5.415
  316    H    ASP  40           H        ASP  40 -11.605  -3.600   3.990
  317    HA   ASP  40           HA       ASP  40 -13.952  -5.272   3.522
  318    HB2  ASP  40          1HB       ASP  40 -14.858  -3.541   4.969
  319    HB3  ASP  40          2HB       ASP  40 -14.133  -2.279   3.974
  320    H    ASP  41           H        ASP  41 -14.758  -5.172   1.412
  321    HA   ASP  41           HA       ASP  41 -12.954  -5.103  -0.632
  322    HB2  ASP  41          1HB       ASP  41 -15.892  -4.420  -0.883
  323    HB3  ASP  41          2HB       ASP  41 -14.843  -4.969  -2.184
  324    H    THR  42           H        THR  42 -15.091  -2.446   0.324
  325    HA   THR  42           HA       THR  42 -14.610  -0.618  -1.678
  326    HB   THR  42           HB       THR  42 -14.913   0.086   1.235
  327    HG1  THR  42           HG1      THR  42 -16.591  -1.252   0.965
  328   HG21  THR  42          1HG2      THR  42 -16.212   1.978   0.299
  329   HG22  THR  42          2HG2      THR  42 -15.751   1.448  -1.319
  330   HG23  THR  42          3HG2      THR  42 -14.516   1.991  -0.182
  331    H    THR  43           H        THR  43 -12.963  -0.723   1.470
  332    HA   THR  43           HA       THR  43 -11.006   1.196   0.961
  333    HB   THR  43           HB       THR  43 -10.765  -1.220   2.757
  334    HG1  THR  43           HG1      THR  43 -11.523   0.496   4.328
  335   HG21  THR  43          1HG2      THR  43  -9.329   0.326   4.103
  336   HG22  THR  43          2HG2      THR  43  -9.402   1.472   2.763
  337   HG23  THR  43          3HG2      THR  43  -8.652  -0.105   2.533
  338    H    MET  44           H        MET  44 -11.154  -2.207   0.188
  339    HA   MET  44           HA       MET  44  -8.386  -2.605  -0.204
  340    HB2  MET  44          1HB       MET  44 -10.746  -4.158  -1.255
  341    HB3  MET  44          2HB       MET  44  -9.076  -4.707  -1.321
  342    HG2  MET  44          1HG       MET  44  -8.974  -4.686   1.113
  343    HG3  MET  44          2HG       MET  44 -10.637  -4.114   1.179
  344    HE1  MET  44          1HE       MET  44 -10.961  -7.749   2.502
  345    HE2  MET  44          2HE       MET  44 -11.238  -6.035   2.822
  346    HE3  MET  44          3HE       MET  44  -9.591  -6.666   2.764
  347    H    CYS  45           H        CYS  45 -11.045  -2.121  -2.537
  348    HA   CYS  45           HA       CYS  45  -9.351  -2.063  -4.803
  349    HB2  CYS  45          1HB       CYS  45 -12.112  -0.894  -4.402
  350    HB3  CYS  45          2HB       CYS  45 -11.274  -0.923  -5.946
  351    H    TYR  46           H        TYR  46 -10.345   0.379  -2.505
  352    HA   TYR  46           HA       TYR  46  -9.471   2.656  -3.858
  353    HB2  TYR  46          1HB       TYR  46 -10.733   3.039  -1.920
  354    HB3  TYR  46          2HB       TYR  46  -9.744   1.952  -0.946
  355    HD1  TYR  46           HD1      TYR  46  -9.427   5.137  -2.888
  356    HD2  TYR  46           HD2      TYR  46  -8.235   2.893   0.527
  357    HE1  TYR  46           HE1      TYR  46  -8.127   7.058  -2.077
  358    HE2  TYR  46           HE2      TYR  46  -6.936   4.812   1.342
  359    HH   TYR  46           HH       TYR  46  -6.042   6.840   0.734
  360    H    ILE  47           H        ILE  47  -7.756   0.584  -1.535
  361    HA   ILE  47           HA       ILE  47  -5.270   1.843  -1.687
  362    HB   ILE  47           HB       ILE  47  -5.978  -1.010  -1.038
  363   HG12  ILE  47          1HG1      ILE  47  -6.847   0.621   0.549
  364   HG13  ILE  47          2HG1      ILE  47  -5.532  -0.280   1.296
  365   HG21  ILE  47          1HG2      ILE  47  -3.306   0.361  -0.782
  366   HG22  ILE  47          2HG2      ILE  47  -3.698  -1.019  -1.809
  367   HG23  ILE  47          3HG2      ILE  47  -3.712  -1.193  -0.053
  368   HD11  ILE  47          1HD1      ILE  47  -4.033   1.662   0.698
  369   HD12  ILE  47          2HD1      ILE  47  -5.258   1.973   1.925
  370   HD13  ILE  47          3HD1      ILE  47  -5.502   2.548   0.277
  371    H    LYS  48           H        LYS  48  -6.695  -0.718  -3.647
  372    HA   LYS  48           HA       LYS  48  -4.388  -1.435  -5.063
  373    HB2  LYS  48          1HB       LYS  48  -6.567  -2.702  -4.990
  374    HB3  LYS  48          2HB       LYS  48  -7.220  -1.525  -6.115
  375    HG2  LYS  48          1HG       LYS  48  -4.730  -3.046  -6.778
  376    HG3  LYS  48          2HG       LYS  48  -6.319  -3.772  -7.012
  377    HD2  LYS  48          1HD       LYS  48  -6.952  -1.968  -8.507
  378    HD3  LYS  48          2HD       LYS  48  -5.413  -1.156  -8.215
  379    HE2  LYS  48          1HE       LYS  48  -4.203  -2.944  -9.261
  380    HE3  LYS  48          2HE       LYS  48  -5.666  -3.917  -9.393
  381    HZ1  LYS  48          1HZ       LYS  48  -5.116  -2.911 -11.499
  382    HZ2  LYS  48          2HZ       LYS  48  -5.147  -1.359 -10.808
  383    HZ3  LYS  48          3HZ       LYS  48  -6.570  -2.264 -10.913
  384    H    CYS  49           H        CYS  49  -7.039   0.776  -5.960
  385    HA   CYS  49           HA       CYS  49  -5.997   1.682  -8.354
  386    HB2  CYS  49          1HB       CYS  49  -8.225   2.244  -7.807
  387    HB3  CYS  49          2HB       CYS  49  -7.751   3.078  -6.330
  388    H    VAL  50           H        VAL  50  -5.458   2.977  -5.082
  389    HA   VAL  50           HA       VAL  50  -3.903   5.172  -5.847
  390    HB   VAL  50           HB       VAL  50  -4.018   3.659  -3.244
  391   HG11  VAL  50          1HG1      VAL  50  -2.715   6.304  -3.870
  392   HG12  VAL  50          2HG1      VAL  50  -1.910   4.829  -3.329
  393   HG13  VAL  50          3HG1      VAL  50  -3.010   5.686  -2.246
  394   HG21  VAL  50          1HG2      VAL  50  -6.108   4.652  -3.775
  395   HG22  VAL  50          2HG2      VAL  50  -5.333   6.164  -4.243
  396   HG23  VAL  50          3HG2      VAL  50  -5.335   5.661  -2.551
  397    H    PHE  51           H        PHE  51  -3.006   1.922  -4.784
  398    HA   PHE  51           HA       PHE  51  -0.227   2.335  -4.815
  399    HB2  PHE  51          1HB       PHE  51  -2.044  -0.016  -4.691
  400    HB3  PHE  51          2HB       PHE  51  -0.363  -0.318  -5.125
  401    HD1  PHE  51           HD1      PHE  51  -1.446   2.360  -2.837
  402    HD2  PHE  51           HD2      PHE  51   0.183  -1.561  -3.166
  403    HE1  PHE  51           HE1      PHE  51  -0.874   2.400  -0.446
  404    HE2  PHE  51           HE2      PHE  51   0.757  -1.524  -0.775
  405    HZ   PHE  51           HZ       PHE  51   0.230   0.456   0.587
  406    H    ASN  52           H        ASN  52  -2.535   1.584  -7.270
  407    HA   ASN  52           HA       ASN  52  -0.607   0.766  -9.251
  408    HB2  ASN  52          1HB       ASN  52  -2.969  -0.020  -9.259
  409    HB3  ASN  52          2HB       ASN  52  -3.497   1.634  -9.585
  410   HD21  ASN  52          1HD2      ASN  52  -0.669   0.041 -10.974
  411   HD22  ASN  52          2HD2      ASN  52  -1.256   0.042 -12.598
  412    H    LYS  53           H        LYS  53  -2.356   3.671  -8.366
  413    HA   LYS  53           HA       LYS  53  -1.634   5.331 -10.514
  414    HB2  LYS  53          1HB       LYS  53  -2.405   5.847  -7.657
  415    HB3  LYS  53          2HB       LYS  53  -1.994   7.171  -8.738
  416    HG2  LYS  53          1HG       LYS  53  -4.105   5.192  -9.496
  417    HG3  LYS  53          2HG       LYS  53  -4.468   6.509  -8.381
  418    HD2  LYS  53          1HD       LYS  53  -3.620   8.104 -10.095
  419    HD3  LYS  53          2HD       LYS  53  -3.452   6.744 -11.209
  420    HE2  LYS  53          1HE       LYS  53  -5.804   6.315 -11.146
  421    HE3  LYS  53          2HE       LYS  53  -6.034   7.488  -9.850
  422    HZ1  LYS  53          1HZ       LYS  53  -5.149   8.118 -12.610
  423    HZ2  LYS  53          2HZ       LYS  53  -5.378   9.246 -11.364
  424    HZ3  LYS  53          3HZ       LYS  53  -6.698   8.386 -11.985
  425    H    MET  54           H        MET  54  -0.047   4.508  -7.504
  426    HA   MET  54           HA       MET  54   2.024   6.504  -7.844
  427    HB2  MET  54          1HB       MET  54   1.526   4.404  -5.731
  428    HB3  MET  54          2HB       MET  54   2.889   5.521  -5.698
  429    HG2  MET  54          1HG       MET  54   1.529   7.354  -5.322
  430    HG3  MET  54          2HG       MET  54   0.083   6.533  -5.899
  431    HE1  MET  54          1HE       MET  54   2.414   7.300  -2.947
  432    HE2  MET  54          2HE       MET  54   2.902   5.627  -3.211
  433    HE3  MET  54          3HE       MET  54   2.014   6.070  -1.753
  434    H    GLN  55           H        GLN  55   1.536   3.817  -9.430
  435    HA   GLN  55           HA       GLN  55   2.698   2.154 -10.385
  436    HB2  GLN  55          1HB       GLN  55   4.614   4.422 -10.254
  437    HB3  GLN  55          2HB       GLN  55   5.204   2.861 -10.833
  438    HG2  GLN  55          1HG       GLN  55   2.762   4.204 -11.944
  439    HG3  GLN  55          2HG       GLN  55   4.379   4.510 -12.565
  440   HE21  GLN  55          1HE2      GLN  55   3.768   3.691 -14.576
  441   HE22  GLN  55          2HE2      GLN  55   3.609   1.994 -14.858
  442    H    LEU  56           H        LEU  56   2.323   1.571  -7.836
  443    HA   LEU  56           HA       LEU  56   4.906   0.657  -6.805
  444    HB2  LEU  56          1HB       LEU  56   2.609   1.989  -5.559
  445    HB3  LEU  56          2HB       LEU  56   3.215   0.612  -4.630
  446    HG   LEU  56           HG       LEU  56   4.808   3.018  -5.525
  447   HD11  LEU  56          1HD1      LEU  56   3.818   2.236  -2.787
  448   HD12  LEU  56          2HD1      LEU  56   3.176   3.543  -3.776
  449   HD13  LEU  56          3HD1      LEU  56   4.828   3.627  -3.167
  450   HD21  LEU  56          1HD2      LEU  56   6.501   2.090  -3.938
  451   HD22  LEU  56          2HD2      LEU  56   6.271   1.138  -5.405
  452   HD23  LEU  56          3HD2      LEU  56   5.547   0.609  -3.886
  453    H    PHE  57           H        PHE  57   1.877  -0.243  -7.983
  454    HA   PHE  57           HA       PHE  57   2.332  -3.040  -7.289
  455    HB2  PHE  57          1HB       PHE  57   0.791  -2.321  -5.561
  456    HB3  PHE  57          2HB       PHE  57  -0.240  -1.528  -6.740
  457    HD1  PHE  57           HD1      PHE  57  -1.850  -2.755  -8.003
  458    HD2  PHE  57           HD2      PHE  57   0.849  -4.770  -5.397
  459    HE1  PHE  57           HE1      PHE  57  -3.210  -4.795  -8.179
  460    HE2  PHE  57           HE2      PHE  57  -0.507  -6.815  -5.574
  461    HZ   PHE  57           HZ       PHE  57  -2.538  -6.825  -6.965
  462    H    ASP  58           H        ASP  58   1.993  -4.325  -8.968
  463    HA   ASP  58           HA       ASP  58   0.641  -3.207 -11.334
  464    HB2  ASP  58          1HB       ASP  58   2.975  -3.601 -11.815
  465    HB3  ASP  58          2HB       ASP  58   2.891  -5.227 -11.140
  466    H    ASP  59           H        ASP  59  -0.725  -4.525 -12.517
  467    HA   ASP  59           HA       ASP  59  -2.410  -6.160 -10.931
  468    HB2  ASP  59          1HB       ASP  59  -2.364  -5.747 -13.921
  469    HB3  ASP  59          2HB       ASP  59  -3.667  -6.495 -13.023
  470    H    THR  60           H        THR  60   0.340  -6.877 -12.847
  471    HA   THR  60           HA       THR  60  -0.380  -9.708 -12.982
  472    HB   THR  60           HB       THR  60   1.725  -8.095 -14.400
  473    HG1  THR  60           HG1      THR  60  -0.729  -9.300 -15.071
  474   HG21  THR  60          1HG2      THR  60   2.711 -10.243 -13.856
  475   HG22  THR  60          2HG2      THR  60   2.338 -10.169 -15.578
  476   HG23  THR  60          3HG2      THR  60   1.293 -11.082 -14.488
  477    H    GLU  61           H        GLU  61   2.643  -7.867 -12.357
  478    HA   GLU  61           HA       GLU  61   3.852 -10.059 -11.000
  479    HB2  GLU  61          1HB       GLU  61   4.742  -7.196 -10.760
  480    HB3  GLU  61          2HB       GLU  61   5.703  -8.664 -10.659
  481    HG2  GLU  61          1HG       GLU  61   5.311  -9.091 -13.025
  482    HG3  GLU  61          2HG       GLU  61   4.380  -7.600 -13.128
  483    H    GLY  62           H        GLY  62   1.706  -7.592  -9.963
  484    HA2  GLY  62          1HA       GLY  62   0.752  -7.332  -7.854
  485    HA3  GLY  62          2HA       GLY  62   1.925  -8.486  -7.215
  486    HA   PRO  63           HA       PRO  63   3.335  -4.560  -5.441
  487    HB2  PRO  63          1HB       PRO  63   5.036  -5.727  -3.621
  488    HB3  PRO  63          2HB       PRO  63   3.306  -5.471  -3.350
  489    HG2  PRO  63          1HG       PRO  63   4.759  -7.936  -4.168
  490    HG3  PRO  63          2HG       PRO  63   3.385  -7.757  -3.070
  491    HD2  PRO  63          1HD       PRO  63   3.159  -8.638  -5.622
  492    HD3  PRO  63          2HD       PRO  63   1.859  -7.749  -4.793
  493    H    LEU  64           H        LEU  64   4.785  -3.399  -6.456
  494    HA   LEU  64           HA       LEU  64   7.011  -4.648  -7.821
  495    HB2  LEU  64          1HB       LEU  64   6.322  -1.713  -7.639
  496    HB3  LEU  64          2HB       LEU  64   7.438  -2.466  -8.761
  497    HG   LEU  64           HG       LEU  64   4.479  -3.032  -8.714
  498   HD11  LEU  64          1HD1      LEU  64   4.391  -1.726 -10.783
  499   HD12  LEU  64          2HD1      LEU  64   6.087  -1.292 -10.578
  500   HD13  LEU  64          3HD1      LEU  64   4.888  -0.737  -9.412
  501   HD21  LEU  64          1HD2      LEU  64   4.918  -4.141 -10.835
  502   HD22  LEU  64          2HD2      LEU  64   5.856  -4.870  -9.530
  503   HD23  LEU  64          3HD2      LEU  64   6.637  -3.781 -10.674
  504    H    VAL  65           H        VAL  65   8.356  -5.376  -6.331
  505    HA   VAL  65           HA       VAL  65   8.959  -4.360  -3.867
  506    HB   VAL  65           HB       VAL  65  10.714  -6.005  -5.669
  507   HG11  VAL  65          1HG1      VAL  65  11.887  -6.693  -3.638
  508   HG12  VAL  65          2HG1      VAL  65  10.918  -5.560  -2.694
  509   HG13  VAL  65          3HG1      VAL  65  12.041  -4.957  -3.914
  510   HG21  VAL  65          1HG2      VAL  65   9.860  -7.870  -4.270
  511   HG22  VAL  65          2HG2      VAL  65   8.619  -7.080  -5.240
  512   HG23  VAL  65          3HG2      VAL  65   8.743  -6.730  -3.517
  513    H    ASP  66           H        ASP  66  10.697  -3.716  -6.912
  514    HA   ASP  66           HA       ASP  66  12.844  -2.338  -5.749
  515    HB2  ASP  66          1HB       ASP  66  12.901  -3.165  -8.041
  516    HB3  ASP  66          2HB       ASP  66  11.674  -1.994  -8.510
  517    H    ASN  67           H        ASN  67   9.886  -1.017  -7.268
  518    HA   ASN  67           HA       ASN  67  10.426   1.668  -6.610
  519    HB2  ASN  67          1HB       ASN  67   7.853   0.240  -7.250
  520    HB3  ASN  67          2HB       ASN  67   7.925   1.965  -6.929
  521   HD21  ASN  67          1HD2      ASN  67   7.211   2.468  -8.976
  522   HD22  ASN  67          2HD2      ASN  67   8.219   2.303 -10.375
  523    H    LEU  68           H        LEU  68   8.881  -0.944  -4.904
  524    HA   LEU  68           HA       LEU  68   7.735   0.504  -2.799
  525    HB2  LEU  68          1HB       LEU  68   8.613  -2.326  -3.165
  526    HB3  LEU  68          2HB       LEU  68   8.147  -1.769  -1.566
  527    HG   LEU  68           HG       LEU  68   6.352  -1.439  -3.955
  528   HD11  LEU  68          1HD1      LEU  68   6.879  -3.820  -3.678
  529   HD12  LEU  68          2HD1      LEU  68   5.200  -3.463  -3.276
  530   HD13  LEU  68          3HD1      LEU  68   6.379  -3.724  -1.989
  531   HD21  LEU  68          1HD2      LEU  68   5.880  -0.054  -2.001
  532   HD22  LEU  68          2HD2      LEU  68   5.830  -1.497  -0.990
  533   HD23  LEU  68          3HD2      LEU  68   4.623  -1.263  -2.253
  534    H    VAL  69           H        VAL  69  10.924  -1.024  -3.090
  535    HA   VAL  69           HA       VAL  69  11.887  -0.215  -0.556
  536    HB   VAL  69           HB       VAL  69  13.412  -0.855  -3.076
  537   HG11  VAL  69          1HG1      VAL  69  14.812   0.401  -1.570
  538   HG12  VAL  69          2HG1      VAL  69  15.294  -1.296  -1.529
  539   HG13  VAL  69          3HG1      VAL  69  14.326  -0.619  -0.217
  540   HG21  VAL  69          1HG2      VAL  69  11.975  -2.673  -2.261
  541   HG22  VAL  69          2HG2      VAL  69  12.774  -2.576  -0.690
  542   HG23  VAL  69          3HG2      VAL  69  13.690  -3.057  -2.118
  543    H    HIS  70           H        HIS  70  12.172   1.255  -3.792
  544    HA   HIS  70           HA       HIS  70  13.796   3.416  -3.062
  545    HB2  HIS  70          1HB       HIS  70  11.812   3.008  -5.269
  546    HB3  HIS  70          2HB       HIS  70  12.544   4.589  -5.027
  547    HD1  HIS  70           HD1      HIS  70  14.964   4.896  -5.750
  548    HD2  HIS  70           HD2      HIS  70  13.615   0.987  -6.151
  549    HE1  HIS  70           HE1      HIS  70  16.706   3.719  -7.123
  550    HE2  HIS  70           HE2      HIS  70  15.759   1.424  -7.528
  551    H    GLN  71           H        GLN  71  10.406   2.884  -2.657
  552    HA   GLN  71           HA       GLN  71   9.806   5.642  -1.986
  553    HB2  GLN  71          1HB       GLN  71   8.243   4.028  -3.192
  554    HB3  GLN  71          2HB       GLN  71   8.032   3.228  -1.639
  555    HG2  GLN  71          1HG       GLN  71   6.200   4.690  -1.963
  556    HG3  GLN  71          2HG       GLN  71   7.228   5.366  -0.701
  557   HE21  GLN  71          1HE2      GLN  71   6.430   7.424  -0.984
  558   HE22  GLN  71          2HE2      GLN  71   6.817   8.386  -2.360
  559    H    LEU  72           H        LEU  72   9.504   2.526  -0.302
  560    HA   LEU  72           HA       LEU  72   8.857   3.694   2.172
  561    HB2  LEU  72          1HB       LEU  72   9.762   0.914   1.464
  562    HB3  LEU  72          2HB       LEU  72   9.287   1.383   3.083
  563    HG   LEU  72           HG       LEU  72   7.484   1.587   0.670
  564   HD11  LEU  72          1HD1      LEU  72   7.594  -0.523   2.828
  565   HD12  LEU  72          2HD1      LEU  72   8.034  -0.746   1.134
  566   HD13  LEU  72          3HD1      LEU  72   6.361  -0.398   1.572
  567   HD21  LEU  72          1HD2      LEU  72   6.984   1.879   3.630
  568   HD22  LEU  72          2HD2      LEU  72   5.714   1.747   2.414
  569   HD23  LEU  72          3HD2      LEU  72   6.817   3.125   2.389
  570    H    ALA  73           H        ALA  73  11.936   2.449   0.910
  571    HA   ALA  73           HA       ALA  73  13.301   2.754   3.402
  572    HB1  ALA  73          1HB       ALA  73  14.473   2.420   0.657
  573    HB2  ALA  73          2HB       ALA  73  13.936   1.102   1.695
  574    HB3  ALA  73          3HB       ALA  73  15.280   2.130   2.199
  575    H    HIS  74           H        HIS  74  11.995   5.160   2.502
  576    HA   HIS  74           HA       HIS  74  13.985   6.986   1.550
  577    HB2  HIS  74          1HB       HIS  74  11.507   7.287   1.204
  578    HB3  HIS  74          2HB       HIS  74  11.359   7.626   2.927
  579    HD1  HIS  74           HD1      HIS  74  11.468  10.022   3.530
  580    HD2  HIS  74           HD2      HIS  74  13.317   9.255  -0.118
  581    HE1  HIS  74           HE1      HIS  74  12.141  12.266   2.626
  582    HE2  HIS  74           HE2      HIS  74  13.065  11.785   0.334
  583    H    GLY  75           H        GLY  75  15.705   6.670   2.982
  584    HA2  GLY  75          1HA       GLY  75  16.887   7.819   4.710
  585    HA3  GLY  75          2HA       GLY  75  15.366   8.042   5.559
  586    H    ARG  76           H        ARG  76  16.078   4.935   4.201
  587    HA   ARG  76           HA       ARG  76  17.133   3.924   6.722
  588    HB2  ARG  76          1HB       ARG  76  14.422   3.370   5.707
  589    HB3  ARG  76          2HB       ARG  76  15.325   1.965   6.253
  590    HG2  ARG  76          1HG       ARG  76  15.747   3.328   8.384
  591    HG3  ARG  76          2HG       ARG  76  14.425   4.352   7.819
  592    HD2  ARG  76          1HD       ARG  76  13.014   2.321   7.647
  593    HD3  ARG  76          2HD       ARG  76  14.321   1.392   8.362
  594    HE   ARG  76           HE       ARG  76  13.578   3.616   9.980
  595   HH11  ARG  76          1HH1      ARG  76  12.693   0.338   9.118
  596   HH12  ARG  76          2HH1      ARG  76  11.867   0.037  10.611
  597   HH21  ARG  76          1HH2      ARG  76  12.496   3.217  11.949
  598   HH22  ARG  76          2HH2      ARG  76  11.743   1.677  12.216
  599    H    ASP  77           H        ASP  77  17.781   1.633   6.562
  600    HA   ASP  77           HA       ASP  77  19.319   1.036   4.311
  601    HB2  ASP  77          1HB       ASP  77  18.293  -0.754   6.515
  602    HB3  ASP  77          2HB       ASP  77  19.453  -1.270   5.296
  603    H    ALA  78           H        ALA  78  18.551   0.748   2.393
  604    HA   ALA  78           HA       ALA  78  15.990   0.046   1.628
  605    HB1  ALA  78          1HB       ALA  78  17.656   1.137   0.202
  606    HB2  ALA  78          2HB       ALA  78  16.903  -0.248  -0.585
  607    HB3  ALA  78          3HB       ALA  78  18.528  -0.389   0.079
  608    H    GLU  79           H        GLU  79  18.764  -2.045   2.205
  609    HA   GLU  79           HA       GLU  79  17.713  -4.386   1.055
  610    HB2  GLU  79          1HB       GLU  79  19.767  -3.965   3.212
  611    HB3  GLU  79          2HB       GLU  79  19.363  -5.552   2.573
  612    HG2  GLU  79          1HG       GLU  79  20.016  -4.816   0.339
  613    HG3  GLU  79          2HG       GLU  79  20.442  -3.235   0.989
  614    H    GLU  80           H        GLU  80  17.648  -3.231   4.416
  615    HA   GLU  80           HA       GLU  80  16.213  -5.403   5.480
  616    HB2  GLU  80          1HB       GLU  80  16.484  -2.536   6.357
  617    HB3  GLU  80          2HB       GLU  80  15.619  -3.747   7.296
  618    HG2  GLU  80          1HG       GLU  80  18.509  -3.948   6.491
  619    HG3  GLU  80          2HG       GLU  80  17.939  -3.374   8.051
  620    H    VAL  81           H        VAL  81  15.193  -2.295   4.158
  621    HA   VAL  81           HA       VAL  81  12.444  -2.539   4.549
  622    HB   VAL  81           HB       VAL  81  13.997  -1.086   2.424
  623   HG11  VAL  81          1HG1      VAL  81  11.754  -1.443   1.580
  624   HG12  VAL  81          2HG1      VAL  81  11.929   0.237   2.088
  625   HG13  VAL  81          3HG1      VAL  81  11.065  -0.911   3.112
  626   HG21  VAL  81          1HG2      VAL  81  13.479   0.847   3.840
  627   HG22  VAL  81          2HG2      VAL  81  14.441  -0.371   4.670
  628   HG23  VAL  81          3HG2      VAL  81  12.714  -0.233   5.003
  629    H    ARG  82           H        ARG  82  14.408  -3.421   1.698
  630    HA   ARG  82           HA       ARG  82  12.462  -4.505   0.067
  631    HB2  ARG  82          1HB       ARG  82  14.907  -4.201  -0.456
  632    HB3  ARG  82          2HB       ARG  82  15.216  -5.672   0.456
  633    HG2  ARG  82          1HG       ARG  82  13.614  -6.831  -1.092
  634    HG3  ARG  82          2HG       ARG  82  13.650  -5.373  -2.077
  635    HD2  ARG  82          1HD       ARG  82  16.125  -5.596  -2.189
  636    HD3  ARG  82          2HD       ARG  82  15.971  -7.149  -1.371
  637    HE   ARG  82           HE       ARG  82  14.463  -6.778  -3.838
  638   HH11  ARG  82          1HH1      ARG  82  17.262  -8.140  -2.237
  639   HH12  ARG  82          2HH1      ARG  82  17.587  -9.284  -3.500
  640   HH21  ARG  82          1HH2      ARG  82  14.879  -8.289  -5.501
  641   HH22  ARG  82          2HH2      ARG  82  16.228  -9.371  -5.355
  642    H    THR  83           H        THR  83  14.292  -6.040   2.662
  643    HA   THR  83           HA       THR  83  13.261  -8.625   2.414
  644    HB   THR  83           HB       THR  83  14.471  -7.091   4.698
  645    HG1  THR  83           HG1      THR  83  16.165  -7.767   3.657
  646   HG21  THR  83          1HG2      THR  83  13.637  -9.997   4.758
  647   HG22  THR  83          2HG2      THR  83  12.920  -8.696   5.710
  648   HG23  THR  83          3HG2      THR  83  14.596  -9.172   5.987
  649    H    GLU  84           H        GLU  84  12.272  -5.992   4.612
  650    HA   GLU  84           HA       GLU  84  10.094  -7.209   5.815
  651    HB2  GLU  84          1HB       GLU  84  10.569  -4.319   5.128
  652    HB3  GLU  84          2HB       GLU  84   9.162  -4.851   6.028
  653    HG2  GLU  84          1HG       GLU  84  12.038  -5.117   6.849
  654    HG3  GLU  84          2HG       GLU  84  10.821  -4.058   7.552
  655    H    VAL  85           H        VAL  85  10.170  -5.338   2.794
  656    HA   VAL  85           HA       VAL  85   7.458  -5.480   2.155
  657    HB   VAL  85           HB       VAL  85   9.914  -5.319   0.414
  658   HG11  VAL  85          1HG1      VAL  85   8.189  -6.403  -0.899
  659   HG12  VAL  85          2HG1      VAL  85   8.415  -4.742  -1.452
  660   HG13  VAL  85          3HG1      VAL  85   7.030  -5.155  -0.443
  661   HG21  VAL  85          1HG2      VAL  85   9.148  -3.006   0.092
  662   HG22  VAL  85          2HG2      VAL  85   9.470  -3.381   1.786
  663   HG23  VAL  85          3HG2      VAL  85   7.807  -3.313   1.197
  664    H    LEU  86           H        LEU  86  10.116  -7.652   1.201
  665    HA   LEU  86           HA       LEU  86   8.600  -9.415  -0.349
  666    HB2  LEU  86          1HB       LEU  86  11.164  -9.826   1.182
  667    HB3  LEU  86          2HB       LEU  86  10.485 -11.017   0.076
  668    HG   LEU  86           HG       LEU  86  11.168  -8.222  -0.791
  669   HD11  LEU  86          1HD1      LEU  86  13.178  -9.267   0.103
  670   HD12  LEU  86          2HD1      LEU  86  13.262  -9.142  -1.656
  671   HD13  LEU  86          3HD1      LEU  86  12.894 -10.692  -0.897
  672   HD21  LEU  86          1HD2      LEU  86  11.238  -9.314  -3.008
  673   HD22  LEU  86          2HD2      LEU  86   9.650  -9.393  -2.247
  674   HD23  LEU  86          3HD2      LEU  86  10.695 -10.813  -2.253
  675    H    LYS  87           H        LYS  87   8.969  -9.165   3.092
  676    HA   LYS  87           HA       LYS  87   7.989 -11.815   3.667
  677    HB2  LYS  87          1HB       LYS  87   8.310  -9.383   5.436
  678    HB3  LYS  87          2HB       LYS  87   7.860 -10.983   6.010
  679    HG2  LYS  87          1HG       LYS  87   9.994 -11.871   5.234
  680    HG3  LYS  87          2HG       LYS  87  10.450 -10.266   4.646
  681    HD2  LYS  87          1HD       LYS  87  11.498 -10.571   6.761
  682    HD3  LYS  87          2HD       LYS  87  10.165  -9.441   7.005
  683    HE2  LYS  87          1HE       LYS  87  10.223 -11.062   8.805
  684    HE3  LYS  87          2HE       LYS  87   8.775 -11.296   7.828
  685    HZ1  LYS  87          1HZ       LYS  87   9.912 -13.113   6.682
  686    HZ2  LYS  87          2HZ       LYS  87   9.793 -13.402   8.342
  687    HZ3  LYS  87          3HZ       LYS  87  11.266 -12.901   7.676
  688    H    CYS  88           H        CYS  88   6.591  -9.042   2.545
  689    HA   CYS  88           HA       CYS  88   3.966  -9.787   3.628
  690    HB2  CYS  88          1HB       CYS  88   5.183  -7.133   2.991
  691    HB3  CYS  88          2HB       CYS  88   3.418  -7.326   2.920
  692    H    VAL  89           H        VAL  89   5.886  -9.720   0.880
  693    HA   VAL  89           HA       VAL  89   3.842  -9.405  -1.092
  694    HB   VAL  89           HB       VAL  89   6.584 -10.657  -1.284
  695   HG11  VAL  89          1HG1      VAL  89   5.190 -11.540  -3.031
  696   HG12  VAL  89          2HG1      VAL  89   6.285 -10.349  -3.735
  697   HG13  VAL  89          3HG1      VAL  89   4.599  -9.927  -3.427
  698   HG21  VAL  89          1HG2      VAL  89   7.185  -8.556  -2.432
  699   HG22  VAL  89          2HG2      VAL  89   6.708  -8.304  -0.754
  700   HG23  VAL  89          3HG2      VAL  89   5.583  -7.917  -2.057
  701    H    ASP  90           H        ASP  90   2.248 -10.801  -1.316
  702    HA   ASP  90           HA       ASP  90   2.807 -13.663  -1.017
  703    HB2  ASP  90          1HB       ASP  90   0.715 -12.041   0.352
  704    HB3  ASP  90          2HB       ASP  90   0.334 -13.705  -0.096
  705    H    LYS  91           H        LYS  91   0.614 -14.857  -1.693
  706    HA   LYS  91           HA       LYS  91   0.354 -14.187  -4.509
  707    HB2  LYS  91          1HB       LYS  91  -0.943 -16.526  -3.140
  708    HB3  LYS  91          2HB       LYS  91  -0.432 -16.368  -4.815
  709    HG2  LYS  91          1HG       LYS  91   1.906 -16.378  -4.076
  710    HG3  LYS  91          2HG       LYS  91   1.354 -16.642  -2.424
  711    HD2  LYS  91          1HD       LYS  91   0.248 -18.724  -3.160
  712    HD3  LYS  91          2HD       LYS  91   0.899 -18.471  -4.780
  713    HE2  LYS  91          1HE       LYS  91   2.468 -18.918  -2.244
  714    HE3  LYS  91          2HE       LYS  91   2.290 -20.044  -3.587
  715    HZ1  LYS  91          1HZ       LYS  91   3.408 -18.356  -5.001
  716    HZ2  LYS  91          2HZ       LYS  91   4.391 -18.977  -3.777
  717    HZ3  LYS  91          3HZ       LYS  91   3.713 -17.439  -3.611
  718    H    ASN  92           H        ASN  92  -1.669 -14.093  -5.584
  719    HA   ASN  92           HA       ASN  92  -3.681 -12.759  -4.030
  720    HB2  ASN  92          1HB       ASN  92  -4.884 -12.774  -6.367
  721    HB3  ASN  92          2HB       ASN  92  -3.565 -11.672  -6.062
  722   HD21  ASN  92          1HD2      ASN  92  -4.666 -12.758  -8.539
  723   HD22  ASN  92          2HD2      ASN  92  -3.355 -13.525  -9.366
  724    H    THR  93           H        THR  93  -3.888 -14.906  -2.831
  725    HA   THR  93           HA       THR  93  -5.134 -17.128  -4.011
  726    HB   THR  93           HB       THR  93  -3.994 -17.345  -1.892
  727    HG1  THR  93           HG1      THR  93  -6.659 -17.843  -1.152
  728   HG21  THR  93          1HG2      THR  93  -5.070 -16.495   0.198
  729   HG22  THR  93          2HG2      THR  93  -6.133 -15.521  -0.817
  730   HG23  THR  93          3HG2      THR  93  -4.391 -15.247  -0.840
  731    H    ASP  94           H        ASP  94  -6.394 -14.080  -3.192
  732    HA   ASP  94           HA       ASP  94  -9.135 -15.019  -2.974
  733    HB2  ASP  94          1HB       ASP  94  -8.282 -13.132  -1.580
  734    HB3  ASP  94          2HB       ASP  94  -8.094 -12.178  -3.053
  735    H    ASN  95           H        ASN  95  -6.988 -14.319  -5.397
  736    HA   ASN  95           HA       ASN  95  -7.059 -13.884  -7.611
  737    HB2  ASN  95          1HB       ASN  95  -8.487 -15.939  -7.466
  738    HB3  ASN  95          2HB       ASN  95  -9.897 -14.899  -7.474
  739   HD21  ASN  95          1HD2      ASN  95  -6.914 -14.504  -9.320
  740   HD22  ASN  95          2HD2      ASN  95  -7.653 -14.675 -10.883
  741    H    ASN  96           H        ASN  96  -7.450 -11.660  -6.146
  742    HA   ASN  96           HA       ASN  96  -9.115 -10.008  -7.836
  743    HB2  ASN  96          1HB       ASN  96 -10.802 -10.590  -6.293
  744    HB3  ASN  96          2HB       ASN  96  -9.694 -10.547  -4.931
  745   HD21  ASN  96          1HD2      ASN  96 -10.997  -9.216  -3.756
  746   HD22  ASN  96          2HD2      ASN  96 -11.252  -7.545  -4.142
  747    H    ALA  97           H        ALA  97  -8.001  -8.236  -8.244
  748    HA   ALA  97           HA       ALA  97  -5.466  -7.778  -7.126
  749    HB1  ALA  97          1HB       ALA  97  -7.130  -5.846  -8.731
  750    HB2  ALA  97          2HB       ALA  97  -6.123  -7.124  -9.410
  751    HB3  ALA  97          3HB       ALA  97  -5.382  -5.803  -8.505
  752    H    CYS  98           H        CYS  98  -8.625  -6.402  -6.378
  753    HA   CYS  98           HA       CYS  98  -7.729  -4.252  -4.782
  754    HB2  CYS  98          1HB       CYS  98 -10.272  -5.860  -4.456
  755    HB3  CYS  98          2HB       CYS  98  -9.949  -4.280  -3.757
  756    H    HIS  99           H        HIS  99  -8.319  -7.647  -4.050
  757    HA   HIS  99           HA       HIS  99  -7.883  -7.245  -1.215
  758    HB2  HIS  99          1HB       HIS  99  -9.436  -8.980  -2.399
  759    HB3  HIS  99          2HB       HIS  99  -7.960  -9.927  -2.558
  760    HD1  HIS  99           HD1      HIS  99  -6.777 -10.581  -0.216
  761    HD2  HIS  99           HD2      HIS  99 -10.677  -9.158   0.009
  762    HE1  HIS  99           HE1      HIS  99  -7.620 -11.259   2.052
  763    HE2  HIS  99           HE2      HIS  99 -10.011 -10.482   2.123
  764    H    TRP 100           H        TRP 100  -6.080  -8.113  -4.016
  765    HA   TRP 100           HA       TRP 100  -3.946  -9.464  -2.694
  766    HB2  TRP 100          1HB       TRP 100  -4.517  -9.751  -5.114
  767    HB3  TRP 100          2HB       TRP 100  -3.899  -8.126  -5.412
  768    HD1  TRP 100           HD1      TRP 100  -1.730  -9.777  -2.932
  769    HE1  TRP 100           HE1      TRP 100   0.391 -10.705  -4.045
  770    HE3  TRP 100           HE3      TRP 100  -3.162  -9.414  -7.828
  771    HZ2  TRP 100           HZ2      TRP 100   1.335 -11.217  -6.654
  772    HZ3  TRP 100           HZ3      TRP 100  -1.592 -10.141  -9.568
  773    HH2  TRP 100           HH2      TRP 100   0.608 -11.026  -9.000
  774    H    ALA 101           H        ALA 101  -4.223  -6.215  -4.144
  775    HA   ALA 101           HA       ALA 101  -1.726  -5.271  -3.257
  776    HB1  ALA 101          1HB       ALA 101  -2.608  -3.040  -3.737
  777    HB2  ALA 101          2HB       ALA 101  -4.232  -3.713  -3.867
  778    HB3  ALA 101          3HB       ALA 101  -2.992  -4.176  -5.030
  779    H    PHE 102           H        PHE 102  -4.907  -5.330  -1.802
  780    HA   PHE 102           HA       PHE 102  -4.303  -3.662   0.382
  781    HB2  PHE 102          1HB       PHE 102  -6.589  -4.129  -0.357
  782    HB3  PHE 102          2HB       PHE 102  -6.424  -5.797   0.183
  783    HD1  PHE 102           HD1      PHE 102  -6.999  -6.361   2.382
  784    HD2  PHE 102           HD2      PHE 102  -6.280  -2.285   1.375
  785    HE1  PHE 102           HE1      PHE 102  -7.776  -5.676   4.611
  786    HE2  PHE 102           HE2      PHE 102  -7.052  -1.597   3.607
  787    HZ   PHE 102           HZ       PHE 102  -7.800  -3.290   5.229
  788    H    ARG 103           H        ARG 103  -3.867  -7.067  -0.249
  789    HA   ARG 103           HA       ARG 103  -3.460  -7.942   2.412
  790    HB2  ARG 103          1HB       ARG 103  -3.889  -9.463   0.473
  791    HB3  ARG 103          2HB       ARG 103  -2.271  -9.095  -0.109
  792    HG2  ARG 103          1HG       ARG 103  -1.303 -10.030   1.908
  793    HG3  ARG 103          2HG       ARG 103  -2.912 -10.352   2.541
  794    HD2  ARG 103          1HD       ARG 103  -3.307 -11.846   0.572
  795    HD3  ARG 103          2HD       ARG 103  -1.613 -11.627   0.129
  796    HE   ARG 103           HE       ARG 103  -1.800 -12.465   2.815
  797   HH11  ARG 103          1HH1      ARG 103  -2.175 -13.708  -0.447
  798   HH12  ARG 103          2HH1      ARG 103  -1.765 -15.335   0.004
  799   HH21  ARG 103          1HH2      ARG 103  -1.269 -14.606   3.389
  800   HH22  ARG 103          2HH2      ARG 103  -1.259 -15.841   2.171
  801    H    GLY 104           H        GLY 104  -1.255  -6.869  -0.136
  802    HA2  GLY 104          1HA       GLY 104   1.146  -7.196   1.307
  803    HA3  GLY 104          2HA       GLY 104   0.906  -6.101  -0.060
  804    H    PHE 105           H        PHE 105  -0.978  -4.384   0.922
  805    HA   PHE 105           HA       PHE 105   0.581  -2.598   2.418
  806    HB2  PHE 105          1HB       PHE 105  -1.057  -1.727   0.932
  807    HB3  PHE 105          2HB       PHE 105  -2.340  -2.637   1.710
  808    HD1  PHE 105           HD1      PHE 105   0.328  -0.359   2.970
  809    HD2  PHE 105           HD2      PHE 105  -3.842  -1.186   2.699
  810    HE1  PHE 105           HE1      PHE 105  -0.161   1.616   4.355
  811    HE2  PHE 105           HE2      PHE 105  -4.326   0.780   4.090
  812    HZ   PHE 105           HZ       PHE 105  -2.483   2.183   4.920
  813    H    LYS 106           H        LYS 106  -2.174  -4.620   3.296
  814    HA   LYS 106           HA       LYS 106  -2.492  -3.738   5.932
  815    HB2  LYS 106          1HB       LYS 106  -4.321  -4.906   5.237
  816    HB3  LYS 106          2HB       LYS 106  -3.379  -6.096   4.345
  817    HG2  LYS 106          1HG       LYS 106  -2.727  -7.072   6.560
  818    HG3  LYS 106          2HG       LYS 106  -3.908  -5.981   7.302
  819    HD2  LYS 106          1HD       LYS 106  -5.690  -6.966   5.981
  820    HD3  LYS 106          2HD       LYS 106  -4.532  -7.993   5.138
  821    HE2  LYS 106          1HE       LYS 106  -4.002  -9.129   7.233
  822    HE3  LYS 106          2HE       LYS 106  -5.136  -8.088   8.095
  823    HZ1  LYS 106          1HZ       LYS 106  -5.878  -9.944   5.899
  824    HZ2  LYS 106          2HZ       LYS 106  -6.944  -9.012   6.834
  825    HZ3  LYS 106          3HZ       LYS 106  -6.066 -10.272   7.547
  826    H    CYS 107           H        CYS 107  -0.601  -6.440   4.617
  827    HA   CYS 107           HA       CYS 107   0.267  -7.489   7.057
  828    HB2  CYS 107          1HB       CYS 107   0.537  -8.832   5.141
  829    HB3  CYS 107          2HB       CYS 107   1.407  -7.578   4.265
  830    H    PHE 108           H        PHE 108   1.622  -4.986   4.976
  831    HA   PHE 108           HA       PHE 108   4.090  -4.836   6.399
  832    HB2  PHE 108          1HB       PHE 108   3.653  -4.295   3.942
  833    HB3  PHE 108          2HB       PHE 108   3.011  -2.756   4.516
  834    HD1  PHE 108           HD1      PHE 108   5.967  -4.717   3.834
  835    HD2  PHE 108           HD2      PHE 108   4.523  -1.156   5.663
  836    HE1  PHE 108           HE1      PHE 108   8.245  -3.801   3.846
  837    HE2  PHE 108           HE2      PHE 108   6.804  -0.237   5.674
  838    HZ   PHE 108           HZ       PHE 108   8.669  -1.560   4.765
  839    H    GLN 109           H        GLN 109   1.203  -2.759   6.188
  840    HA   GLN 109           HA       GLN 109   2.198  -0.775   7.950
  841    HB2  GLN 109          1HB       GLN 109   0.021   0.188   7.862
  842    HB3  GLN 109          2HB       GLN 109   0.402  -0.414   6.259
  843    HG2  GLN 109          1HG       GLN 109  -1.631  -1.321   6.318
  844    HG3  GLN 109          2HG       GLN 109  -0.920  -2.532   7.389
  845   HE21  GLN 109          1HE2      GLN 109  -2.901  -2.866   8.429
  846   HE22  GLN 109          2HE2      GLN 109  -3.565  -1.714   9.533
  847    H    LYS 110           H        LYS 110   1.122  -3.886   8.546
  848    HA   LYS 110           HA       LYS 110  -0.248  -3.554  10.988
  849    HB2  LYS 110          1HB       LYS 110  -0.374  -5.609   9.675
  850    HB3  LYS 110          2HB       LYS 110   1.339  -5.892   9.929
  851    HG2  LYS 110          1HG       LYS 110   1.004  -6.205  12.275
  852    HG3  LYS 110          2HG       LYS 110  -0.704  -5.803  12.124
  853    HD2  LYS 110          1HD       LYS 110  -1.031  -7.762  10.689
  854    HD3  LYS 110          2HD       LYS 110   0.682  -8.158  10.845
  855    HE2  LYS 110          1HE       LYS 110  -0.658  -9.508  12.363
  856    HE3  LYS 110          2HE       LYS 110   0.403  -8.422  13.258
  857    HZ1  LYS 110          1HZ       LYS 110  -2.503  -8.060  12.776
  858    HZ2  LYS 110          2HZ       LYS 110  -1.511  -6.909  13.512
  859    HZ3  LYS 110          3HZ       LYS 110  -1.756  -8.406  14.253
  860    H    ASN 111           H        ASN 111   3.166  -3.773  10.170
  861    HA   ASN 111           HA       ASN 111   3.776  -3.325  13.014
  862    HB2  ASN 111          1HB       ASN 111   5.082  -5.143  13.190
  863    HB3  ASN 111          2HB       ASN 111   4.257  -5.704  11.747
  864   HD21  ASN 111          1HD2      ASN 111   5.303  -5.699   9.790
  865   HD22  ASN 111          2HD2      ASN 111   7.006  -5.460   9.645
  866    H    ASN 112           H        ASN 112   4.320  -2.464   9.746
  867    HA   ASN 112           HA       ASN 112   6.515  -0.683  10.595
  868    HB2  ASN 112          1HB       ASN 112   6.209  -2.213   8.009
  869    HB3  ASN 112          2HB       ASN 112   7.296  -0.831   8.180
  870   HD21  ASN 112          1HD2      ASN 112   7.647  -3.790   7.714
  871   HD22  ASN 112          2HD2      ASN 112   8.852  -4.257   8.866
  872    H    LEU 113           H        LEU 113   4.083   0.345  10.903
  873    HA   LEU 113           HA       LEU 113   3.170   1.576   8.454
  874    HB2  LEU 113          1HB       LEU 113   1.464   0.917   9.976
  875    HB3  LEU 113          2HB       LEU 113   2.207   1.801  11.293
  876    HG   LEU 113           HG       LEU 113   1.701   3.919  10.067
  877   HD11  LEU 113          1HD1      LEU 113   1.588   2.812   7.821
  878   HD12  LEU 113          2HD1      LEU 113   0.268   3.923   8.178
  879   HD13  LEU 113          3HD1      LEU 113   0.009   2.184   8.289
  880   HD21  LEU 113          1HD2      LEU 113  -0.644   2.125  10.668
  881   HD22  LEU 113          2HD2      LEU 113  -0.700   3.886  10.555
  882   HD23  LEU 113          3HD2      LEU 113   0.237   3.110  11.834
  883    H    SER 114           H        SER 114   5.016   2.450  11.273
  884    HA   SER 114           HA       SER 114   4.981   5.251  10.957
  885    HB2  SER 114          1HB       SER 114   7.236   3.581  12.095
  886    HB3  SER 114          2HB       SER 114   6.863   5.264  12.465
  887    HG   SER 114           HG       SER 114   5.722   4.444  14.024
  888    H    LEU 115           H        LEU 115   6.935   2.717   9.512
  889    HA   LEU 115           HA       LEU 115   8.812   4.356   8.203
  890    HB2  LEU 115          1HB       LEU 115   9.091   1.938   8.467
  891    HB3  LEU 115          2HB       LEU 115   7.727   1.661   7.405
  892    HG   LEU 115           HG       LEU 115   8.968   2.680   5.544
  893   HD11  LEU 115          1HD1      LEU 115  10.373   4.226   6.653
  894   HD12  LEU 115          2HD1      LEU 115  11.433   3.031   5.903
  895   HD13  LEU 115          3HD1      LEU 115  11.102   2.958   7.635
  896   HD21  LEU 115          1HD2      LEU 115   9.070   0.263   5.897
  897   HD22  LEU 115          2HD2      LEU 115  10.472   0.471   6.945
  898   HD23  LEU 115          3HD2      LEU 115  10.581   0.879   5.232
  899    H    ILE 116           H        ILE 116   5.617   3.181   7.312
  900    HA   ILE 116           HA       ILE 116   5.619   4.010   4.631
  901    HB   ILE 116           HB       ILE 116   3.332   3.582   6.559
  902   HG12  ILE 116          1HG1      ILE 116   4.405   1.878   4.297
  903   HG13  ILE 116          2HG1      ILE 116   4.745   1.616   6.012
  904   HG21  ILE 116          1HG2      ILE 116   2.581   5.082   4.801
  905   HG22  ILE 116          2HG2      ILE 116   1.884   3.474   4.567
  906   HG23  ILE 116          3HG2      ILE 116   3.244   4.000   3.575
  907   HD11  ILE 116          1HD1      ILE 116   2.362   1.224   6.407
  908   HD12  ILE 116          2HD1      ILE 116   3.022   0.106   5.214
  909   HD13  ILE 116          3HD1      ILE 116   2.046   1.476   4.693
  910    H    LYS 117           H        LYS 117   4.638   5.610   7.610
  911    HA   LYS 117           HA       LYS 117   3.681   7.992   6.432
  912    HB2  LYS 117          1HB       LYS 117   4.717   7.375   9.191
  913    HB3  LYS 117          2HB       LYS 117   4.071   8.949   8.745
  914    HG2  LYS 117          1HG       LYS 117   1.927   7.930   8.203
  915    HG3  LYS 117          2HG       LYS 117   2.562   6.338   8.606
  916    HD2  LYS 117          1HD       LYS 117   2.913   7.056  10.917
  917    HD3  LYS 117          2HD       LYS 117   2.311   8.666  10.517
  918    HE2  LYS 117          1HE       LYS 117   0.129   7.739   9.981
  919    HE3  LYS 117          2HE       LYS 117   0.725   6.109  10.285
  920    HZ1  LYS 117          1HZ       LYS 117  -0.523   6.968  12.161
  921    HZ2  LYS 117          2HZ       LYS 117   0.537   8.279  12.301
  922    HZ3  LYS 117          3HZ       LYS 117   1.093   6.707  12.592
  923    H    ALA 118           H        ALA 118   6.858   6.860   7.320
  924    HA   ALA 118           HA       ALA 118   8.152   9.417   7.053
  925    HB1  ALA 118          1HB       ALA 118  10.214   8.132   7.281
  926    HB2  ALA 118          2HB       ALA 118   9.289   6.635   7.147
  927    HB3  ALA 118          3HB       ALA 118   9.041   7.705   8.527
  928    H    SER 119           H        SER 119   7.458   6.691   5.002
  929    HA   SER 119           HA       SER 119   9.288   7.129   2.943
  930    HB2  SER 119          1HB       SER 119   6.493   6.007   2.665
  931    HB3  SER 119          2HB       SER 119   7.860   5.717   1.590
  932    HG   SER 119           HG       SER 119   8.325   5.124   4.244
  933    H    ILE 120           H        ILE 120   6.141   8.558   3.560
  934    HA   ILE 120           HA       ILE 120   6.260  10.045   1.043
  935    HB   ILE 120           HB       ILE 120   3.956  10.773   1.634
  936   HG12  ILE 120          1HG1      ILE 120   4.149   8.765   3.877
  937   HG13  ILE 120          2HG1      ILE 120   4.323  10.502   4.121
  938   HG21  ILE 120          1HG2      ILE 120   4.430   7.798   1.638
  939   HG22  ILE 120          2HG2      ILE 120   4.310   8.833   0.215
  940   HG23  ILE 120          3HG2      ILE 120   2.902   8.590   1.249
  941   HD11  ILE 120          1HD1      ILE 120   2.074  10.843   3.258
  942   HD12  ILE 120          2HD1      ILE 120   2.082   9.762   4.647
  943   HD13  ILE 120          3HD1      ILE 120   1.900   9.106   3.020
  944    H    LYS 121           H        LYS 121   7.486  10.436   4.017
  945    HA   LYS 121           HA       LYS 121   6.792  13.237   4.392
  946    HB2  LYS 121          1HB       LYS 121   6.922  11.689   6.326
  947    HB3  LYS 121          2HB       LYS 121   8.632  11.453   5.994
  948    HG2  LYS 121          1HG       LYS 121   8.966  13.900   6.338
  949    HG3  LYS 121          2HG       LYS 121   7.279  14.002   6.844
  950    HD2  LYS 121          1HD       LYS 121   8.660  13.844   8.802
  951    HD3  LYS 121          2HD       LYS 121   7.767  12.334   8.619
  952    HE2  LYS 121          1HE       LYS 121   9.721  11.260   7.667
  953    HE3  LYS 121          2HE       LYS 121  10.616  12.777   7.730
  954    HZ1  LYS 121          1HZ       LYS 121  10.461  12.734  10.130
  955    HZ2  LYS 121          2HZ       LYS 121  11.185  11.314   9.572
  956    HZ3  LYS 121          3HZ       LYS 121   9.574  11.298  10.084
  957    H    LYS 122           H        LYS 122   8.138  14.920   3.975
  958    HA   LYS 122           HA       LYS 122  10.920  14.341   3.342
  959    HB2  LYS 122          1HB       LYS 122  10.378  16.318   1.535
  960    HB3  LYS 122          2HB       LYS 122  10.511  14.608   1.155
  961    HG2  LYS 122          1HG       LYS 122   8.524  15.133   0.159
  962    HG3  LYS 122          2HG       LYS 122   7.961  14.607   1.744
  963    HD2  LYS 122          1HD       LYS 122   6.796  16.614   1.211
  964    HD3  LYS 122          2HD       LYS 122   7.989  17.020   2.447
  965    HE2  LYS 122          1HE       LYS 122   9.462  17.958   0.790
  966    HE3  LYS 122          2HE       LYS 122   8.408  17.416  -0.514
  967    HZ1  LYS 122          1HZ       LYS 122   6.693  18.910   0.310
  968    HZ2  LYS 122          2HZ       LYS 122   8.106  19.761  -0.060
  969    HZ3  LYS 122          3HZ       LYS 122   7.715  19.433   1.549
  970    H    ASP 123           H        ASP 123  11.975  15.392   4.847
  971    HA   ASP 123           HA       ASP 123  11.051  17.994   5.780
  972    HB2  ASP 123          1HB       ASP 123  13.217  16.130   6.746
  973    HB3  ASP 123          2HB       ASP 123  13.069  17.778   7.337
  974    H21  ACD 201           H21      ACD   1  -4.655   5.446   1.644
  975    H22  ACD 201           H22      ACD   1  -3.383   5.440   2.873
  976    H31  ACD 201           H31      ACD   1  -1.968   6.852   1.322
  977    H32  ACD 201           H32      ACD   1  -3.207   6.669   0.084
  978    H41  ACD 201           H41      ACD   1  -2.912   4.191   0.153
  979    H42  ACD 201           H42      ACD   1  -1.397   5.016  -0.249
  980    H5   ACD 201           H5       ACD   1  -2.007   3.520   2.347
  981    H6   ACD 201           H6       ACD   1   0.300   3.982   2.790
  982    H71  ACD 201           H71      ACD   1   0.767   5.024   0.141
  983    H72  ACD 201           H72      ACD   1  -0.096   6.332   0.946
  984    H8   ACD 201           H8       ACD   1   1.791   6.668   2.531
  985    H9   ACD 201           H9       ACD   1   3.855   5.610   1.980
  986   H101  ACD 201          H101      ACD   1   2.737   4.680  -0.546
  987   H102  ACD 201          H102      ACD   1   2.246   3.473   0.646
  988    H11  ACD 201           H11      ACD   1   5.225   4.252   0.509
  989    H12  ACD 201           H12      ACD   1   5.494   1.918   0.188
  990   H131  ACD 201          H131      ACD   1   2.528   2.035  -0.540
  991   H132  ACD 201          H132      ACD   1   3.596   0.633  -0.680
  992    H14  ACD 201           H14      ACD   1   2.438   1.646   2.015
  993    H15  ACD 201           H15      ACD   1   2.426  -0.691   2.465
  994   H161  ACD 201          H161      ACD   1   2.705  -1.387  -0.327
  995   H162  ACD 201          H162      ACD   1   4.338  -0.917   0.159
  996   H171  ACD 201          H171      ACD   1   4.416  -2.599   1.882
  997   H172  ACD 201          H172      ACD   1   2.690  -2.930   1.730
  998   H181  ACD 201          H181      ACD   1   4.755  -3.443  -0.449
  999   H182  ACD 201          H182      ACD   1   3.032  -3.819  -0.549
 1000   H191  ACD 201          H191      ACD   1   5.046  -5.020   1.405
 1001   H192  ACD 201          H192      ACD   1   3.307  -5.306   1.494
 1002   H201  ACD 201          H201      ACD   1   4.452  -7.116   0.285
 1003   H202  ACD 201          H202      ACD   1   5.070  -5.989  -0.872
 1004   H203  ACD 201          H203      ACD   1   3.370  -6.279  -0.772
  Start of MODEL   10
    1    H1   MET   1          1H        MET   1  14.362   5.991 -17.172
    2    H2   MET   1          2H        MET   1  12.732   6.366 -17.401
    3    H3   MET   1          3H        MET   1  13.293   4.804 -17.720
    4    HA   MET   1           HA       MET   1  12.076   4.925 -15.638
    5    HB2  MET   1          1HB       MET   1  13.905   3.267 -15.987
    6    HB3  MET   1          2HB       MET   1  15.033   4.403 -15.261
    7    HG2  MET   1          1HG       MET   1  13.827   4.292 -13.158
    8    HG3  MET   1          2HG       MET   1  12.644   3.204 -13.877
    9    HE1  MET   1          1HE       MET   1  16.279   3.654 -12.556
   10    HE2  MET   1          2HE       MET   1  16.599   3.285 -14.250
   11    HE3  MET   1          3HE       MET   1  17.046   2.129 -12.996
   12    H    GLU   2           H        GLU   2  11.727   7.355 -15.543
   13    HA   GLU   2           HA       GLU   2  13.515   8.681 -13.654
   14    HB2  GLU   2          1HB       GLU   2  11.055   9.736 -15.045
   15    HB3  GLU   2          2HB       GLU   2  12.174  10.678 -14.072
   16    HG2  GLU   2          1HG       GLU   2  13.956  10.174 -15.690
   17    HG3  GLU   2          2HG       GLU   2  12.777   9.314 -16.679
   18    H    PHE   3           H        PHE   3  13.154   7.670 -11.753
   19    HA   PHE   3           HA       PHE   3  10.495   7.130 -10.823
   20    HB2  PHE   3          1HB       PHE   3  12.342   5.652 -10.216
   21    HB3  PHE   3          2HB       PHE   3  13.128   6.970  -9.343
   22    HD1  PHE   3           HD1      PHE   3  10.141   4.800  -9.415
   23    HD2  PHE   3           HD2      PHE   3  12.546   7.441  -7.107
   24    HE1  PHE   3           HE1      PHE   3   8.898   4.154  -7.392
   25    HE2  PHE   3           HE2      PHE   3  11.309   6.801  -5.080
   26    HZ   PHE   3           HZ       PHE   3   9.481   5.158  -5.220
   27    H    THR   4           H        THR   4   9.215   8.578 -10.034
   28    HA   THR   4           HA       THR   4  10.292  10.816  -8.443
   29    HB   THR   4           HB       THR   4   7.411  10.791  -9.033
   30    HG1  THR   4           HG1      THR   4   9.361  10.985 -11.119
   31   HG21  THR   4          1HG2      THR   4   9.578  12.835  -9.465
   32   HG22  THR   4          2HG2      THR   4   8.610  12.660  -8.002
   33   HG23  THR   4          3HG2      THR   4   7.839  13.124  -9.520
   34    H    VAL   5           H        VAL   5   9.771  10.987  -6.330
   35    HA   VAL   5           HA       VAL   5   8.483   8.640  -5.156
   36    HB   VAL   5           HB       VAL   5   9.595   9.021  -3.221
   37   HG11  VAL   5          1HG1      VAL   5  11.281  10.719  -5.027
   38   HG12  VAL   5          2HG1      VAL   5  11.307   8.961  -4.927
   39   HG13  VAL   5          3HG1      VAL   5  11.803   9.931  -3.541
   40   HG21  VAL   5          1HG2      VAL   5   8.438  11.057  -2.608
   41   HG22  VAL   5          2HG2      VAL   5   9.466  11.997  -3.688
   42   HG23  VAL   5          3HG2      VAL   5  10.161  11.214  -2.268
   43    H    SER   6           H        SER   6   6.626   8.659  -4.077
   44    HA   SER   6           HA       SER   6   4.894  10.928  -4.603
   45    HB2  SER   6          1HB       SER   6   4.247   8.217  -3.414
   46    HB3  SER   6          2HB       SER   6   3.075   9.424  -3.942
   47    HG   SER   6           HG       SER   6   4.534   7.632  -5.419
   48    H    THR   7           H        THR   7   5.366  12.522  -3.150
   49    HA   THR   7           HA       THR   7   5.687  11.983  -0.350
   50    HB   THR   7           HB       THR   7   5.711  14.415  -0.059
   51    HG1  THR   7           HG1      THR   7   5.017  14.458  -2.840
   52   HG21  THR   7          1HG2      THR   7   7.320  13.538  -2.458
   53   HG22  THR   7          2HG2      THR   7   7.772  13.301  -0.769
   54   HG23  THR   7          3HG2      THR   7   7.664  14.932  -1.434
   55    H    THR   8           H        THR   8   4.271  13.519   1.143
   56    HA   THR   8           HA       THR   8   1.736  12.513   1.395
   57    HB   THR   8           HB       THR   8   2.678  15.268   2.211
   58    HG1  THR   8           HG1      THR   8   3.628  12.992   2.960
   59   HG21  THR   8          1HG2      THR   8   0.271  15.123   2.332
   60   HG22  THR   8          2HG2      THR   8   0.941  15.067   3.964
   61   HG23  THR   8          3HG2      THR   8   0.376  13.585   3.190
   62    H    GLU   9           H        GLU   9   2.656  15.538  -0.234
   63    HA   GLU   9           HA       GLU   9   0.080  16.330  -0.946
   64    HB2  GLU   9          1HB       GLU   9   2.771  16.967  -2.127
   65    HB3  GLU   9          2HB       GLU   9   1.289  17.645  -2.777
   66    HG2  GLU   9          1HG       GLU   9   2.311  19.221  -1.286
   67    HG3  GLU   9          2HG       GLU   9   0.799  18.641  -0.591
   68    H    ASP  10           H        ASP  10   2.467  14.439  -2.791
   69    HA   ASP  10           HA       ASP  10   0.902  14.179  -5.130
   70    HB2  ASP  10          1HB       ASP  10   2.986  12.242  -4.092
   71    HB3  ASP  10          2HB       ASP  10   2.347  12.317  -5.732
   72    H    LEU  11           H        LEU  11   1.214  12.203  -2.237
   73    HA   LEU  11           HA       LEU  11  -0.359  10.060  -3.112
   74    HB2  LEU  11          1HB       LEU  11   1.115   9.811  -1.239
   75    HB3  LEU  11          2HB       LEU  11   0.246  11.048  -0.322
   76    HG   LEU  11           HG       LEU  11  -1.748   9.533  -0.365
   77   HD11  LEU  11          1HD1      LEU  11  -1.035   8.230  -2.340
   78   HD12  LEU  11          2HD1      LEU  11  -1.473   7.226  -0.961
   79   HD13  LEU  11          3HD1      LEU  11   0.227   7.490  -1.355
   80   HD21  LEU  11          1HD2      LEU  11  -0.172   9.713   1.545
   81   HD22  LEU  11          2HD2      LEU  11   0.709   8.330   0.894
   82   HD23  LEU  11          3HD2      LEU  11  -0.962   8.144   1.423
   83    H    GLN  12           H        GLN  12  -1.183  13.087  -1.512
   84    HA   GLN  12           HA       GLN  12  -3.841  12.357  -0.872
   85    HB2  GLN  12          1HB       GLN  12  -2.502  15.038  -1.119
   86    HB3  GLN  12          2HB       GLN  12  -4.191  14.853  -0.657
   87    HG2  GLN  12          1HG       GLN  12  -1.817  13.723   0.804
   88    HG3  GLN  12          2HG       GLN  12  -2.791  15.102   1.308
   89   HE21  GLN  12          1HE2      GLN  12  -2.264  12.539   2.650
   90   HE22  GLN  12          2HE2      GLN  12  -3.814  11.837   2.947
   91    H    ARG  13           H        ARG  13  -2.338  13.626  -3.728
   92    HA   ARG  13           HA       ARG  13  -4.711  14.351  -5.090
   93    HB2  ARG  13          1HB       ARG  13  -2.561  15.120  -5.908
   94    HB3  ARG  13          2HB       ARG  13  -2.031  13.461  -6.168
   95    HG2  ARG  13          1HG       ARG  13  -3.846  13.177  -7.822
   96    HG3  ARG  13          2HG       ARG  13  -4.255  14.886  -7.609
   97    HD2  ARG  13          1HD       ARG  13  -2.094  15.544  -8.441
   98    HD3  ARG  13          2HD       ARG  13  -1.575  13.859  -8.527
   99    HE   ARG  13           HE       ARG  13  -3.878  14.076 -10.066
  100   HH11  ARG  13          1HH1      ARG  13  -0.614  15.337 -10.087
  101   HH12  ARG  13          2HH1      ARG  13  -0.559  15.535 -11.808
  102   HH21  ARG  13          1HH2      ARG  13  -3.818  14.340 -12.335
  103   HH22  ARG  13          2HH2      ARG  13  -2.391  14.970 -13.092
  104    H    TYR  14           H        TYR  14  -2.648  11.451  -5.384
  105    HA   TYR  14           HA       TYR  14  -4.278  10.079  -7.189
  106    HB2  TYR  14          1HB       TYR  14  -2.531   8.764  -5.104
  107    HB3  TYR  14          2HB       TYR  14  -3.014   8.108  -6.662
  108    HD1  TYR  14           HD1      TYR  14  -0.204   8.904  -5.195
  109    HD2  TYR  14           HD2      TYR  14  -2.492  10.365  -8.473
  110    HE1  TYR  14           HE1      TYR  14   1.840   9.814  -6.209
  111    HE2  TYR  14           HE2      TYR  14  -0.450  11.276  -9.498
  112    HH   TYR  14           HH       TYR  14   1.837  12.049  -8.672
  113    H    ARG  15           H        ARG  15  -4.310  10.156  -3.690
  114    HA   ARG  15           HA       ARG  15  -6.118   8.039  -3.316
  115    HB2  ARG  15          1HB       ARG  15  -5.282   8.350  -1.282
  116    HB3  ARG  15          2HB       ARG  15  -4.691   9.945  -1.714
  117    HG2  ARG  15          1HG       ARG  15  -6.766  10.954  -1.040
  118    HG3  ARG  15          2HG       ARG  15  -7.502   9.364  -0.791
  119    HD2  ARG  15          1HD       ARG  15  -5.894   8.881   0.980
  120    HD3  ARG  15          2HD       ARG  15  -5.120  10.443   0.726
  121    HE   ARG  15           HE       ARG  15  -7.633  11.168   1.271
  122   HH11  ARG  15          1HH1      ARG  15  -5.488   8.876   2.835
  123   HH12  ARG  15          2HH1      ARG  15  -6.139   9.158   4.420
  124   HH21  ARG  15          1HH2      ARG  15  -8.509  11.531   3.359
  125   HH22  ARG  15          2HH2      ARG  15  -7.876  10.654   4.712
  126    H    THR  16           H        THR  16  -6.573  11.519  -3.687
  127    HA   THR  16           HA       THR  16  -9.361  11.535  -3.295
  128    HB   THR  16           HB       THR  16  -7.419  13.384  -4.619
  129    HG1  THR  16           HG1      THR  16  -9.278  13.711  -2.477
  130   HG21  THR  16          1HG2      THR  16  -9.252  14.976  -5.072
  131   HG22  THR  16          2HG2      THR  16 -10.422  13.721  -4.660
  132   HG23  THR  16          3HG2      THR  16  -9.369  13.519  -6.061
  133    H    GLU  17           H        GLU  17  -7.383  11.298  -6.248
  134    HA   GLU  17           HA       GLU  17  -9.558  11.250  -8.049
  135    HB2  GLU  17          1HB       GLU  17  -6.981   9.833  -8.671
  136    HB3  GLU  17          2HB       GLU  17  -8.020  10.760  -9.733
  137    HG2  GLU  17          1HG       GLU  17  -7.362  12.824  -8.628
  138    HG3  GLU  17          2HG       GLU  17  -6.296  11.917  -7.557
  139    H    CYS  18           H        CYS  18  -7.921   8.651  -6.295
  140    HA   CYS  18           HA       CYS  18  -9.375   6.551  -7.545
  141    HB2  CYS  18          1HB       CYS  18  -7.928   6.678  -4.901
  142    HB3  CYS  18          2HB       CYS  18  -8.740   5.226  -5.494
  143    H    VAL  19           H        VAL  19  -9.976   8.647  -4.801
  144    HA   VAL  19           HA       VAL  19 -12.215   7.277  -3.778
  145    HB   VAL  19           HB       VAL  19 -11.172  10.066  -3.486
  146   HG11  VAL  19          1HG1      VAL  19 -13.023  10.654  -2.022
  147   HG12  VAL  19          2HG1      VAL  19 -13.821   9.125  -2.395
  148   HG13  VAL  19          3HG1      VAL  19 -13.595  10.336  -3.662
  149   HG21  VAL  19          1HG2      VAL  19 -11.767   7.817  -1.569
  150   HG22  VAL  19          2HG2      VAL  19 -11.139   9.399  -1.106
  151   HG23  VAL  19          3HG2      VAL  19 -10.178   8.336  -2.133
  152    H    SER  20           H        SER  20 -11.924  10.046  -5.946
  153    HA   SER  20           HA       SER  20 -14.680  10.357  -6.432
  154    HB2  SER  20          1HB       SER  20 -12.864  12.054  -6.818
  155    HB3  SER  20          2HB       SER  20 -12.391  11.142  -8.250
  156    HG   SER  20           HG       SER  20 -14.638  11.460  -8.958
  157    H    SER  21           H        SER  21 -12.287   8.234  -7.854
  158    HA   SER  21           HA       SER  21 -13.899   7.621 -10.173
  159    HB2  SER  21          1HB       SER  21 -11.485   7.625 -10.404
  160    HB3  SER  21          2HB       SER  21 -11.325   6.433  -9.117
  161    HG   SER  21           HG       SER  21 -12.463   6.072 -11.690
  162    H    LEU  22           H        LEU  22 -12.864   5.866  -7.228
  163    HA   LEU  22           HA       LEU  22 -14.399   3.550  -7.995
  164    HB2  LEU  22          1HB       LEU  22 -12.788   4.218  -5.538
  165    HB3  LEU  22          2HB       LEU  22 -13.649   2.690  -5.741
  166    HG   LEU  22           HG       LEU  22 -11.520   3.670  -7.639
  167   HD11  LEU  22          1HD1      LEU  22 -10.065   2.026  -6.525
  168   HD12  LEU  22          2HD1      LEU  22 -11.321   1.762  -5.315
  169   HD13  LEU  22          3HD1      LEU  22 -10.542   3.338  -5.448
  170   HD21  LEU  22          1HD2      LEU  22 -13.145   2.059  -8.535
  171   HD22  LEU  22          2HD2      LEU  22 -12.745   0.951  -7.218
  172   HD23  LEU  22          3HD2      LEU  22 -11.521   1.384  -8.414
  173    H    ASN  23           H        ASN  23 -15.509   6.344  -7.059
  174    HA   ASN  23           HA       ASN  23 -17.349   7.153  -5.983
  175    HB2  ASN  23          1HB       ASN  23 -18.261   4.287  -6.245
  176    HB3  ASN  23          2HB       ASN  23 -19.295   5.646  -5.849
  177   HD21  ASN  23          1HD2      ASN  23 -19.848   7.118  -7.443
  178   HD22  ASN  23          2HD2      ASN  23 -19.580   6.800  -9.125
  179    H    ILE  24           H        ILE  24 -15.174   6.318  -4.326
  180    HA   ILE  24           HA       ILE  24 -15.995   4.885  -2.055
  181    HB   ILE  24           HB       ILE  24 -13.895   7.051  -2.177
  182   HG12  ILE  24          1HG1      ILE  24 -13.524   5.360  -3.941
  183   HG13  ILE  24          2HG1      ILE  24 -12.286   5.278  -2.691
  184   HG21  ILE  24          1HG2      ILE  24 -12.868   5.791  -0.332
  185   HG22  ILE  24          2HG2      ILE  24 -14.257   4.706  -0.321
  186   HG23  ILE  24          3HG2      ILE  24 -14.466   6.410   0.080
  187   HD11  ILE  24          1HD1      ILE  24 -14.644   3.429  -2.982
  188   HD12  ILE  24          2HD1      ILE  24 -13.418   3.339  -1.717
  189   HD13  ILE  24          3HD1      ILE  24 -12.969   3.066  -3.401
  190    HA   PRO  25           HA       PRO  25 -18.832   7.886  -0.300
  191    HB2  PRO  25          1HB       PRO  25 -18.446   6.193   2.089
  192    HB3  PRO  25          2HB       PRO  25 -19.933   6.645   1.255
  193    HG2  PRO  25          1HG       PRO  25 -18.929   4.179   1.085
  194    HG3  PRO  25          2HG       PRO  25 -19.746   4.956  -0.284
  195    HD2  PRO  25          1HD       PRO  25 -16.823   4.544   0.196
  196    HD3  PRO  25          2HD       PRO  25 -17.745   4.466  -1.325
  197    H    ALA  26           H        ALA  26 -18.640   9.613   0.966
  198    HA   ALA  26           HA       ALA  26 -16.097  10.629   1.506
  199    HB1  ALA  26          1HB       ALA  26 -18.729  11.537   2.644
  200    HB2  ALA  26          2HB       ALA  26 -18.087  11.990   1.067
  201    HB3  ALA  26          3HB       ALA  26 -17.252  12.492   2.539
  202    H    ASP  27           H        ASP  27 -18.317   8.885   3.604
  203    HA   ASP  27           HA       ASP  27 -17.113   9.538   6.065
  204    HB2  ASP  27          1HB       ASP  27 -18.322   7.773   7.040
  205    HB3  ASP  27          2HB       ASP  27 -19.341   8.367   5.738
  206    H    TYR  28           H        TYR  28 -16.442   6.872   3.786
  207    HA   TYR  28           HA       TYR  28 -14.403   5.668   5.251
  208    HB2  TYR  28          1HB       TYR  28 -15.062   5.778   2.336
  209    HB3  TYR  28          2HB       TYR  28 -13.571   5.001   2.868
  210    HD1  TYR  28           HD1      TYR  28 -17.235   4.864   2.951
  211    HD2  TYR  28           HD2      TYR  28 -13.630   2.894   4.051
  212    HE1  TYR  28           HE1      TYR  28 -18.506   2.817   3.433
  213    HE2  TYR  28           HE2      TYR  28 -14.892   0.844   4.544
  214    HH   TYR  28           HH       TYR  28 -17.186   0.192   5.125
  215    H    VAL  29           H        VAL  29 -14.358   8.388   3.030
  216    HA   VAL  29           HA       VAL  29 -11.594   8.691   2.760
  217    HB   VAL  29           HB       VAL  29 -13.689  10.852   2.723
  218   HG11  VAL  29          1HG1      VAL  29 -12.082  12.042   1.291
  219   HG12  VAL  29          2HG1      VAL  29 -10.914  10.744   1.553
  220   HG13  VAL  29          3HG1      VAL  29 -11.436  11.747   2.904
  221   HG21  VAL  29          1HG2      VAL  29 -14.273   9.114   1.177
  222   HG22  VAL  29          2HG2      VAL  29 -12.626   9.065   0.551
  223   HG23  VAL  29          3HG2      VAL  29 -13.634  10.486   0.271
  224    H    GLU  30           H        GLU  30 -13.846  10.032   5.164
  225    HA   GLU  30           HA       GLU  30 -11.958  11.540   6.631
  226    HB2  GLU  30          1HB       GLU  30 -14.304  10.166   7.914
  227    HB3  GLU  30          2HB       GLU  30 -13.543  11.695   8.332
  228    HG2  GLU  30          1HG       GLU  30 -14.356  12.651   6.229
  229    HG3  GLU  30          2HG       GLU  30 -15.218  11.151   5.912
  230    H    LYS  31           H        LYS  31 -12.893   8.155   6.758
  231    HA   LYS  31           HA       LYS  31 -11.471   7.460   9.085
  232    HB2  LYS  31          1HB       LYS  31 -12.097   5.750   6.671
  233    HB3  LYS  31          2HB       LYS  31 -11.515   5.149   8.229
  234    HG2  LYS  31          1HG       LYS  31 -13.548   6.101   9.288
  235    HG3  LYS  31          2HG       LYS  31 -14.142   6.513   7.677
  236    HD2  LYS  31          1HD       LYS  31 -13.912   4.083   7.070
  237    HD3  LYS  31          2HD       LYS  31 -13.564   3.758   8.778
  238    HE2  LYS  31          1HE       LYS  31 -15.755   4.772   9.370
  239    HE3  LYS  31          2HE       LYS  31 -16.097   4.974   7.652
  240    HZ1  LYS  31          1HZ       LYS  31 -15.656   2.392   9.052
  241    HZ2  LYS  31          2HZ       LYS  31 -15.948   2.563   7.396
  242    HZ3  LYS  31          3HZ       LYS  31 -17.142   2.990   8.513
  243    H    PHE  32           H        PHE  32 -10.541   7.296   5.666
  244    HA   PHE  32           HA       PHE  32  -7.960   6.305   6.037
  245    HB2  PHE  32          1HB       PHE  32  -8.875   8.132   3.811
  246    HB3  PHE  32          2HB       PHE  32  -7.498   7.038   3.773
  247    HD1  PHE  32           HD1      PHE  32 -10.162   7.321   2.041
  248    HD2  PHE  32           HD2      PHE  32  -8.769   4.647   5.039
  249    HE1  PHE  32           HE1      PHE  32 -11.601   5.552   1.126
  250    HE2  PHE  32           HE2      PHE  32 -10.206   2.877   4.129
  251    HZ   PHE  32           HZ       PHE  32 -11.622   3.320   2.166
  252    H    LYS  33           H        LYS  33  -9.224   9.481   6.539
  253    HA   LYS  33           HA       LYS  33  -6.771  10.912   6.308
  254    HB2  LYS  33          1HB       LYS  33  -9.193  11.836   6.305
  255    HB3  LYS  33          2HB       LYS  33  -9.057  11.765   8.063
  256    HG2  LYS  33          1HG       LYS  33  -7.160  13.243   8.033
  257    HG3  LYS  33          2HG       LYS  33  -7.161  13.254   6.263
  258    HD2  LYS  33          1HD       LYS  33  -9.384  14.294   6.284
  259    HD3  LYS  33          2HD       LYS  33  -9.363  14.295   8.048
  260    HE2  LYS  33          1HE       LYS  33  -8.755  16.484   7.226
  261    HE3  LYS  33          2HE       LYS  33  -7.361  15.732   7.997
  262    HZ1  LYS  33          1HZ       LYS  33  -7.853  15.817   5.072
  263    HZ2  LYS  33          2HZ       LYS  33  -6.488  15.172   5.832
  264    HZ3  LYS  33          3HZ       LYS  33  -6.793  16.834   5.907
  265    H    LYS  34           H        LYS  34  -8.301   9.062   8.842
  266    HA   LYS  34           HA       LYS  34  -6.155   9.860  10.678
  267    HB2  LYS  34          1HB       LYS  34  -8.826   8.554  11.182
  268    HB3  LYS  34          2HB       LYS  34  -7.583   8.670  12.421
  269    HG2  LYS  34          1HG       LYS  34  -9.023  10.926  11.042
  270    HG3  LYS  34          2HG       LYS  34  -9.151  10.446  12.733
  271    HD2  LYS  34          1HD       LYS  34  -6.696  11.573  11.387
  272    HD3  LYS  34          2HD       LYS  34  -7.767  12.438  12.483
  273    HE2  LYS  34          1HE       LYS  34  -6.204   9.972  13.224
  274    HE3  LYS  34          2HE       LYS  34  -5.670  11.619  13.544
  275    HZ1  LYS  34          1HZ       LYS  34  -8.155  10.378  14.603
  276    HZ2  LYS  34          2HZ       LYS  34  -7.625  11.951  14.918
  277    HZ3  LYS  34          3HZ       LYS  34  -6.728  10.632  15.475
  278    H    TRP  35           H        TRP  35  -5.814   8.055   8.430
  279    HA   TRP  35           HA       TRP  35  -5.034   6.016   7.826
  280    HB2  TRP  35          1HB       TRP  35  -3.820   6.307  10.572
  281    HB3  TRP  35          2HB       TRP  35  -3.334   5.065   9.410
  282    HD1  TRP  35           HD1      TRP  35  -3.247   8.869   9.938
  283    HE1  TRP  35           HE1      TRP  35  -1.403   9.868   8.448
  284    HE3  TRP  35           HE3      TRP  35  -1.963   4.671   7.312
  285    HZ2  TRP  35           HZ2      TRP  35   0.357   8.994   6.433
  286    HZ3  TRP  35           HZ3      TRP  35  -0.196   4.841   5.619
  287    HH2  TRP  35           HH2      TRP  35   0.948   6.951   5.184
  288    H    GLU  36           H        GLU  36  -7.616   5.778   8.605
  289    HA   GLU  36           HA       GLU  36  -7.688   3.237  10.072
  290    HB2  GLU  36          1HB       GLU  36  -8.982   5.147  11.030
  291    HB3  GLU  36          2HB       GLU  36  -9.958   5.144   9.574
  292    HG2  GLU  36          1HG       GLU  36 -11.114   3.973  11.327
  293    HG3  GLU  36          2HG       GLU  36 -10.651   2.848  10.053
  294    H    PHE  37           H        PHE  37  -7.686   1.621   8.690
  295    HA   PHE  37           HA       PHE  37  -9.165   1.917   6.158
  296    HB2  PHE  37          1HB       PHE  37  -6.814   0.095   6.747
  297    HB3  PHE  37          2HB       PHE  37  -7.589   0.315   5.182
  298    HD1  PHE  37           HD1      PHE  37  -5.442   1.869   7.719
  299    HD2  PHE  37           HD2      PHE  37  -7.111   2.230   3.819
  300    HE1  PHE  37           HE1      PHE  37  -3.898   3.721   7.230
  301    HE2  PHE  37           HE2      PHE  37  -5.576   4.084   3.331
  302    HZ   PHE  37           HZ       PHE  37  -3.966   4.832   5.033
  303    HA   PRO  38           HA       PRO  38 -11.698  -1.270   8.281
  304    HB2  PRO  38          1HB       PRO  38 -13.386  -0.600   5.935
  305    HB3  PRO  38          2HB       PRO  38 -13.825  -0.749   7.647
  306    HG2  PRO  38          1HG       PRO  38 -13.663   1.648   6.530
  307    HG3  PRO  38          2HG       PRO  38 -13.034   1.375   8.166
  308    HD2  PRO  38          1HD       PRO  38 -11.522   1.548   5.574
  309    HD3  PRO  38          2HD       PRO  38 -11.135   2.276   7.162
  310    H    GLU  39           H        GLU  39 -11.796  -3.361   7.843
  311    HA   GLU  39           HA       GLU  39 -10.562  -4.339   5.436
  312    HB2  GLU  39          1HB       GLU  39 -10.093  -5.316   7.656
  313    HB3  GLU  39          2HB       GLU  39 -11.762  -5.850   7.759
  314    HG2  GLU  39          1HG       GLU  39 -11.471  -7.409   6.016
  315    HG3  GLU  39          2HG       GLU  39  -9.918  -6.709   5.553
  316    H    ASP  40           H        ASP  40 -12.097  -3.577   3.946
  317    HA   ASP  40           HA       ASP  40 -14.316  -5.379   3.508
  318    HB2  ASP  40          1HB       ASP  40 -16.058  -3.967   3.885
  319    HB3  ASP  40          2HB       ASP  40 -14.922  -3.161   4.957
  320    H    ASP  41           H        ASP  41 -15.339  -4.981   1.353
  321    HA   ASP  41           HA       ASP  41 -13.453  -5.013  -0.652
  322    HB2  ASP  41          1HB       ASP  41 -16.375  -4.264  -0.880
  323    HB3  ASP  41          2HB       ASP  41 -15.329  -4.634  -2.245
  324    H    THR  42           H        THR  42 -15.364  -2.234   0.413
  325    HA   THR  42           HA       THR  42 -14.816  -0.417  -1.593
  326    HB   THR  42           HB       THR  42 -14.930   0.343   1.314
  327    HG1  THR  42           HG1      THR  42 -16.672  -0.920   1.250
  328   HG21  THR  42          1HG2      THR  42 -14.570   2.167  -0.225
  329   HG22  THR  42          2HG2      THR  42 -16.208   2.254   0.420
  330   HG23  THR  42          3HG2      THR  42 -15.934   1.642  -1.211
  331    H    THR  43           H        THR  43 -13.140  -0.611   1.525
  332    HA   THR  43           HA       THR  43 -11.091   1.184   0.940
  333    HB   THR  43           HB       THR  43 -11.027  -1.118   2.893
  334    HG1  THR  43           HG1      THR  43 -12.780   0.113   3.474
  335   HG21  THR  43          1HG2      THR  43  -8.831  -0.182   2.616
  336   HG22  THR  43          2HG2      THR  43  -9.486   0.405   4.146
  337   HG23  THR  43          3HG2      THR  43  -9.462   1.458   2.731
  338    H    MET  44           H        MET  44 -11.386  -2.254   0.325
  339    HA   MET  44           HA       MET  44  -8.635  -2.788  -0.033
  340    HB2  MET  44          1HB       MET  44 -11.063  -4.256  -1.055
  341    HB3  MET  44          2HB       MET  44  -9.417  -4.869  -1.161
  342    HG2  MET  44          1HG       MET  44  -9.242  -4.878   1.254
  343    HG3  MET  44          2HG       MET  44 -10.855  -4.186   1.393
  344    HE1  MET  44          1HE       MET  44  -9.973  -6.770   2.967
  345    HE2  MET  44          2HE       MET  44 -11.398  -7.788   2.741
  346    HE3  MET  44          3HE       MET  44 -11.587  -6.060   3.049
  347    H    CYS  45           H        CYS  45 -11.232  -2.248  -2.434
  348    HA   CYS  45           HA       CYS  45  -9.475  -2.312  -4.658
  349    HB2  CYS  45          1HB       CYS  45 -12.202  -1.025  -4.379
  350    HB3  CYS  45          2HB       CYS  45 -11.334  -1.198  -5.899
  351    H    TYR  46           H        TYR  46 -10.462   0.196  -2.447
  352    HA   TYR  46           HA       TYR  46  -9.544   2.434  -3.827
  353    HB2  TYR  46          1HB       TYR  46 -10.850   2.852  -1.933
  354    HB3  TYR  46          2HB       TYR  46  -9.885   1.785  -0.916
  355    HD1  TYR  46           HD1      TYR  46  -8.433   2.757   0.585
  356    HD2  TYR  46           HD2      TYR  46  -9.513   4.933  -2.913
  357    HE1  TYR  46           HE1      TYR  46  -7.160   4.692   1.401
  358    HE2  TYR  46           HE2      TYR  46  -8.238   6.869  -2.100
  359    HH   TYR  46           HH       TYR  46  -6.319   6.711   0.860
  360    H    ILE  47           H        ILE  47  -7.873   0.380  -1.464
  361    HA   ILE  47           HA       ILE  47  -5.399   1.663  -1.542
  362    HB   ILE  47           HB       ILE  47  -6.098  -1.204  -0.947
  363   HG12  ILE  47          1HG1      ILE  47  -7.024   0.393   0.639
  364   HG13  ILE  47          2HG1      ILE  47  -5.718  -0.506   1.406
  365   HG21  ILE  47          1HG2      ILE  47  -3.861  -1.389   0.091
  366   HG22  ILE  47          2HG2      ILE  47  -3.447   0.184  -0.588
  367   HG23  ILE  47          3HG2      ILE  47  -3.794  -1.172  -1.659
  368   HD11  ILE  47          1HD1      ILE  47  -4.223   1.457   0.888
  369   HD12  ILE  47          2HD1      ILE  47  -5.494   1.745   2.072
  370   HD13  ILE  47          3HD1      ILE  47  -5.682   2.335   0.422
  371    H    LYS  48           H        LYS  48  -6.748  -0.880  -3.586
  372    HA   LYS  48           HA       LYS  48  -4.367  -1.575  -4.894
  373    HB2  LYS  48          1HB       LYS  48  -6.639  -2.785  -4.921
  374    HB3  LYS  48          2HB       LYS  48  -7.067  -1.684  -6.222
  375    HG2  LYS  48          1HG       LYS  48  -4.636  -2.614  -7.048
  376    HG3  LYS  48          2HG       LYS  48  -5.306  -4.020  -6.222
  377    HD2  LYS  48          1HD       LYS  48  -5.964  -4.213  -8.476
  378    HD3  LYS  48          2HD       LYS  48  -7.396  -3.671  -7.601
  379    HE2  LYS  48          1HE       LYS  48  -7.069  -1.417  -8.357
  380    HE3  LYS  48          2HE       LYS  48  -5.519  -1.838  -9.083
  381    HZ1  LYS  48          1HZ       LYS  48  -8.169  -2.872  -9.929
  382    HZ2  LYS  48          2HZ       LYS  48  -6.681  -3.303 -10.621
  383    HZ3  LYS  48          3HZ       LYS  48  -7.250  -1.711 -10.747
  384    H    CYS  49           H        CYS  49  -6.976   0.648  -5.820
  385    HA   CYS  49           HA       CYS  49  -5.943   1.571  -8.220
  386    HB2  CYS  49          1HB       CYS  49  -8.172   2.110  -7.657
  387    HB3  CYS  49          2HB       CYS  49  -7.700   2.917  -6.163
  388    H    VAL  50           H        VAL  50  -5.443   2.864  -4.944
  389    HA   VAL  50           HA       VAL  50  -3.945   5.104  -5.678
  390    HB   VAL  50           HB       VAL  50  -3.972   3.552  -3.091
  391   HG11  VAL  50          1HG1      VAL  50  -1.951   4.864  -3.193
  392   HG12  VAL  50          2HG1      VAL  50  -3.085   5.622  -2.075
  393   HG13  VAL  50          3HG1      VAL  50  -2.860   6.289  -3.693
  394   HG21  VAL  50          1HG2      VAL  50  -5.407   5.486  -2.379
  395   HG22  VAL  50          2HG2      VAL  50  -6.128   4.386  -3.551
  396   HG23  VAL  50          3HG2      VAL  50  -5.488   5.939  -4.083
  397    H    PHE  51           H        PHE  51  -2.967   1.881  -4.641
  398    HA   PHE  51           HA       PHE  51  -0.198   2.391  -4.660
  399    HB2  PHE  51          1HB       PHE  51  -1.941  -0.018  -4.479
  400    HB3  PHE  51          2HB       PHE  51  -0.236  -0.264  -4.849
  401    HD1  PHE  51           HD1      PHE  51   0.277  -1.423  -2.831
  402    HD2  PHE  51           HD2      PHE  51  -1.486   2.449  -2.696
  403    HE1  PHE  51           HE1      PHE  51   0.773  -1.283  -0.427
  404    HE2  PHE  51           HE2      PHE  51  -0.990   2.595  -0.292
  405    HZ   PHE  51           HZ       PHE  51   0.142   0.728   0.844
  406    H    ASN  52           H        ASN  52  -2.490   1.492  -7.087
  407    HA   ASN  52           HA       ASN  52  -0.585   0.448  -8.971
  408    HB2  ASN  52          1HB       ASN  52  -2.972  -0.277  -8.886
  409    HB3  ASN  52          2HB       ASN  52  -3.449   1.336  -9.423
  410   HD21  ASN  52          1HD2      ASN  52  -0.644  -0.464 -10.594
  411   HD22  ASN  52          2HD2      ASN  52  -1.237  -0.671 -12.206
  412    H    LYS  53           H        LYS  53  -2.260   3.482  -8.429
  413    HA   LYS  53           HA       LYS  53  -1.391   4.750 -10.820
  414    HB2  LYS  53          1HB       LYS  53  -2.644   5.677  -8.260
  415    HB3  LYS  53          2HB       LYS  53  -2.061   6.857  -9.426
  416    HG2  LYS  53          1HG       LYS  53  -3.606   6.128 -11.066
  417    HG3  LYS  53          2HG       LYS  53  -3.988   4.666 -10.155
  418    HD2  LYS  53          1HD       LYS  53  -5.783   6.277  -9.945
  419    HD3  LYS  53          2HD       LYS  53  -4.987   6.045  -8.389
  420    HE2  LYS  53          1HE       LYS  53  -5.414   8.384  -8.698
  421    HE3  LYS  53          2HE       LYS  53  -3.677   8.104  -8.805
  422    HZ1  LYS  53          1HZ       LYS  53  -5.451   8.325 -11.168
  423    HZ2  LYS  53          2HZ       LYS  53  -3.758   8.309 -11.152
  424    HZ3  LYS  53          3HZ       LYS  53  -4.600   9.632 -10.507
  425    H    MET  54           H        MET  54  -0.068   4.390  -7.617
  426    HA   MET  54           HA       MET  54   2.017   6.339  -8.048
  427    HB2  MET  54          1HB       MET  54   1.383   4.401  -5.851
  428    HB3  MET  54          2HB       MET  54   2.924   5.251  -5.884
  429    HG2  MET  54          1HG       MET  54   1.656   7.387  -5.946
  430    HG3  MET  54          2HG       MET  54   0.177   6.453  -5.732
  431    HE1  MET  54          1HE       MET  54  -0.134   4.773  -3.647
  432    HE2  MET  54          2HE       MET  54   0.906   4.769  -2.227
  433    HE3  MET  54          3HE       MET  54   1.499   4.127  -3.757
  434    H    GLN  55           H        GLN  55   1.564   3.495  -9.453
  435    HA   GLN  55           HA       GLN  55   2.805   1.876 -10.381
  436    HB2  GLN  55          1HB       GLN  55   4.807   4.086 -10.148
  437    HB3  GLN  55          2HB       GLN  55   5.256   2.531 -10.863
  438    HG2  GLN  55          1HG       GLN  55   3.484   2.803 -12.511
  439    HG3  GLN  55          2HG       GLN  55   3.032   4.334 -11.774
  440   HE21  GLN  55          1HE2      GLN  55   3.897   3.781 -14.476
  441   HE22  GLN  55          2HE2      GLN  55   5.313   4.736 -14.751
  442    H    LEU  56           H        LEU  56   2.489   1.782  -7.554
  443    HA   LEU  56           HA       LEU  56   5.024   0.682  -6.625
  444    HB2  LEU  56          1HB       LEU  56   2.820   2.147  -5.359
  445    HB3  LEU  56          2HB       LEU  56   3.402   0.779  -4.398
  446    HG   LEU  56           HG       LEU  56   5.062   3.077  -5.445
  447   HD11  LEU  56          1HD1      LEU  56   5.246   3.680  -3.044
  448   HD12  LEU  56          2HD1      LEU  56   4.020   2.468  -2.686
  449   HD13  LEU  56          3HD1      LEU  56   3.619   3.852  -3.695
  450   HD21  LEU  56          1HD2      LEU  56   6.458   1.159  -5.301
  451   HD22  LEU  56          2HD2      LEU  56   5.760   0.698  -3.749
  452   HD23  LEU  56          3HD2      LEU  56   6.767   2.141  -3.869
  453    H    PHE  57           H        PHE  57   1.875  -0.078  -7.590
  454    HA   PHE  57           HA       PHE  57   2.366  -2.910  -7.164
  455    HB2  PHE  57          1HB       PHE  57   0.974  -2.333  -5.244
  456    HB3  PHE  57          2HB       PHE  57  -0.160  -1.481  -6.281
  457    HD1  PHE  57           HD1      PHE  57   1.039  -4.771  -5.200
  458    HD2  PHE  57           HD2      PHE  57  -1.812  -2.666  -7.560
  459    HE1  PHE  57           HE1      PHE  57  -0.297  -6.823  -5.417
  460    HE2  PHE  57           HE2      PHE  57  -3.147  -4.719  -7.785
  461    HZ   PHE  57           HZ       PHE  57  -2.389  -6.798  -6.710
  462    H    ASP  58           H        ASP  58   1.955  -3.965  -8.982
  463    HA   ASP  58           HA       ASP  58   0.517  -2.560 -11.116
  464    HB2  ASP  58          1HB       ASP  58   2.756  -3.336 -11.708
  465    HB3  ASP  58          2HB       ASP  58   2.347  -4.973 -11.218
  466    H    ASP  59           H        ASP  59  -1.227  -3.457 -12.149
  467    HA   ASP  59           HA       ASP  59  -2.985  -4.886 -10.442
  468    HB2  ASP  59          1HB       ASP  59  -3.650  -3.144 -12.104
  469    HB3  ASP  59          2HB       ASP  59  -3.318  -4.289 -13.384
  470    H    THR  60           H        THR  60  -0.589  -5.980 -12.520
  471    HA   THR  60           HA       THR  60  -1.797  -8.660 -12.596
  472    HB   THR  60           HB       THR  60  -0.008  -7.279 -14.577
  473    HG1  THR  60           HG1      THR  60  -2.619  -7.644 -14.395
  474   HG21  THR  60          1HG2      THR  60  -0.734 -10.209 -14.494
  475   HG22  THR  60          2HG2      THR  60   0.874  -9.522 -14.261
  476   HG23  THR  60          3HG2      THR  60   0.078  -9.391 -15.829
  477    H    GLU  61           H        GLU  61   1.385  -7.015 -12.669
  478    HA   GLU  61           HA       GLU  61   2.760  -9.397 -11.841
  479    HB2  GLU  61          1HB       GLU  61   3.958  -6.644 -11.893
  480    HB3  GLU  61          2HB       GLU  61   4.743  -8.198 -12.119
  481    HG2  GLU  61          1HG       GLU  61   3.588  -8.502 -14.229
  482    HG3  GLU  61          2HG       GLU  61   2.781  -6.954 -14.015
  483    H    GLY  62           H        GLY  62   1.057  -7.131 -10.046
  484    HA2  GLY  62          1HA       GLY  62   0.757  -7.163  -7.741
  485    HA3  GLY  62          2HA       GLY  62   2.090  -8.311  -7.623
  486    HA   PRO  63           HA       PRO  63   3.479  -4.372  -5.622
  487    HB2  PRO  63          1HB       PRO  63   5.086  -6.267  -4.044
  488    HB3  PRO  63          2HB       PRO  63   3.962  -5.016  -3.499
  489    HG2  PRO  63          1HG       PRO  63   3.388  -7.646  -3.317
  490    HG3  PRO  63          2HG       PRO  63   2.145  -6.413  -3.598
  491    HD2  PRO  63          1HD       PRO  63   3.416  -8.309  -5.539
  492    HD3  PRO  63          2HD       PRO  63   1.729  -7.745  -5.444
  493    H    LEU  64           H        LEU  64   5.038  -3.294  -6.661
  494    HA   LEU  64           HA       LEU  64   7.264  -4.744  -7.862
  495    HB2  LEU  64          1HB       LEU  64   6.705  -1.769  -7.913
  496    HB3  LEU  64          2HB       LEU  64   7.943  -2.603  -8.822
  497    HG   LEU  64           HG       LEU  64   6.268  -2.177 -10.380
  498   HD11  LEU  64          1HD1      LEU  64   7.111  -4.423 -10.536
  499   HD12  LEU  64          2HD1      LEU  64   5.407  -4.384 -10.994
  500   HD13  LEU  64          3HD1      LEU  64   5.883  -4.996  -9.409
  501   HD21  LEU  64          1HD2      LEU  64   4.244  -3.245  -8.425
  502   HD22  LEU  64          2HD2      LEU  64   3.911  -2.691 -10.065
  503   HD23  LEU  64          3HD2      LEU  64   4.485  -1.550  -8.850
  504    H    VAL  65           H        VAL  65   8.614  -5.406  -6.382
  505    HA   VAL  65           HA       VAL  65   9.115  -4.378  -3.894
  506    HB   VAL  65           HB       VAL  65  10.939  -6.001  -5.650
  507   HG11  VAL  65          1HG1      VAL  65  12.253  -4.938  -3.912
  508   HG12  VAL  65          2HG1      VAL  65  12.073  -6.657  -3.565
  509   HG13  VAL  65          3HG1      VAL  65  11.108  -5.474  -2.683
  510   HG21  VAL  65          1HG2      VAL  65   8.985  -6.750  -3.489
  511   HG22  VAL  65          2HG2      VAL  65  10.099  -7.870  -4.276
  512   HG23  VAL  65          3HG2      VAL  65   8.832  -7.081  -5.214
  513    H    ASP  66           H        ASP  66  10.955  -3.703  -6.874
  514    HA   ASP  66           HA       ASP  66  13.021  -2.275  -5.636
  515    HB2  ASP  66          1HB       ASP  66  13.223  -3.065  -7.912
  516    HB3  ASP  66          2HB       ASP  66  11.939  -1.980  -8.437
  517    H    ASN  67           H        ASN  67  10.081  -1.001  -7.236
  518    HA   ASN  67           HA       ASN  67  10.559   1.693  -6.598
  519    HB2  ASN  67          1HB       ASN  67   7.955   0.254  -7.099
  520    HB3  ASN  67          2HB       ASN  67   8.096   2.001  -6.946
  521   HD21  ASN  67          1HD2      ASN  67   7.057   0.838  -9.233
  522   HD22  ASN  67          2HD2      ASN  67   8.161   1.075 -10.543
  523    H    LEU  68           H        LEU  68   9.085  -0.924  -4.846
  524    HA   LEU  68           HA       LEU  68   7.926   0.523  -2.749
  525    HB2  LEU  68          1HB       LEU  68   8.828  -2.301  -3.114
  526    HB3  LEU  68          2HB       LEU  68   8.357  -1.749  -1.515
  527    HG   LEU  68           HG       LEU  68   6.556  -1.412  -3.898
  528   HD11  LEU  68          1HD1      LEU  68   7.109  -3.791  -3.675
  529   HD12  LEU  68          2HD1      LEU  68   5.428  -3.463  -3.259
  530   HD13  LEU  68          3HD1      LEU  68   6.616  -3.742  -1.983
  531   HD21  LEU  68          1HD2      LEU  68   6.073  -0.075  -1.913
  532   HD22  LEU  68          2HD2      LEU  68   6.035  -1.540  -0.934
  533   HD23  LEU  68          3HD2      LEU  68   4.826  -1.289  -2.195
  534    H    VAL  69           H        VAL  69  11.168  -0.835  -3.122
  535    HA   VAL  69           HA       VAL  69  12.078  -0.048  -0.535
  536    HB   VAL  69           HB       VAL  69  13.661  -0.684  -3.019
  537   HG11  VAL  69          1HG1      VAL  69  14.471  -0.485  -0.126
  538   HG12  VAL  69          2HG1      VAL  69  15.023   0.532  -1.458
  539   HG13  VAL  69          3HG1      VAL  69  15.482  -1.171  -1.401
  540   HG21  VAL  69          1HG2      VAL  69  12.939  -2.449  -0.688
  541   HG22  VAL  69          2HG2      VAL  69  13.885  -2.905  -2.107
  542   HG23  VAL  69          3HG2      VAL  69  12.176  -2.501  -2.279
  543    H    HIS  70           H        HIS  70  12.264   1.388  -3.768
  544    HA   HIS  70           HA       HIS  70  13.968   3.530  -3.056
  545    HB2  HIS  70          1HB       HIS  70  12.070   3.077  -5.337
  546    HB3  HIS  70          2HB       HIS  70  12.866   4.634  -5.133
  547    HD1  HIS  70           HD1      HIS  70  15.083   4.851  -6.227
  548    HD2  HIS  70           HD2      HIS  70  14.064   0.874  -5.573
  549    HE1  HIS  70           HE1      HIS  70  16.879   3.495  -7.345
  550    HE2  HIS  70           HE2      HIS  70  16.127   1.105  -7.107
  551    H    GLN  71           H        GLN  71  10.563   3.029  -2.691
  552    HA   GLN  71           HA       GLN  71  10.054   5.821  -2.027
  553    HB2  GLN  71          1HB       GLN  71   8.426   4.331  -3.302
  554    HB3  GLN  71          2HB       GLN  71   8.143   3.504  -1.773
  555    HG2  GLN  71          1HG       GLN  71   6.414   5.125  -2.136
  556    HG3  GLN  71          2HG       GLN  71   7.412   5.605  -0.764
  557   HE21  GLN  71          1HE2      GLN  71   6.862   7.764  -0.902
  558   HE22  GLN  71          2HE2      GLN  71   7.417   8.784  -2.178
  559    H    LEU  72           H        LEU  72   9.547   2.691  -0.395
  560    HA   LEU  72           HA       LEU  72   8.853   3.794   2.067
  561    HB2  LEU  72          1HB       LEU  72   9.857   1.061   1.343
  562    HB3  LEU  72          2HB       LEU  72   9.405   1.490   2.980
  563    HG   LEU  72           HG       LEU  72   7.547   1.646   0.606
  564   HD11  LEU  72          1HD1      LEU  72   7.747  -0.441   2.781
  565   HD12  LEU  72          2HD1      LEU  72   8.179  -0.668   1.087
  566   HD13  LEU  72          3HD1      LEU  72   6.500  -0.362   1.534
  567   HD21  LEU  72          1HD2      LEU  72   5.814   1.753   2.413
  568   HD22  LEU  72          2HD2      LEU  72   6.846   3.177   2.296
  569   HD23  LEU  72          3HD2      LEU  72   7.124   1.988   3.571
  570    H    ALA  73           H        ALA  73  11.994   2.556   0.960
  571    HA   ALA  73           HA       ALA  73  13.288   3.000   3.464
  572    HB1  ALA  73          1HB       ALA  73  14.023   1.312   1.854
  573    HB2  ALA  73          2HB       ALA  73  15.321   2.422   2.303
  574    HB3  ALA  73          3HB       ALA  73  14.507   2.597   0.749
  575    H    HIS  74           H        HIS  74  11.930   5.314   2.500
  576    HA   HIS  74           HA       HIS  74  13.616   7.278   1.388
  577    HB2  HIS  74          1HB       HIS  74  11.135   7.442   1.526
  578    HB3  HIS  74          2HB       HIS  74  11.263   7.625   3.273
  579    HD1  HIS  74           HD1      HIS  74  11.647   9.937   4.161
  580    HD2  HIS  74           HD2      HIS  74  12.126   9.704   0.037
  581    HE1  HIS  74           HE1      HIS  74  11.825  12.312   3.367
  582    HE2  HIS  74           HE2      HIS  74  11.943  12.150   0.858
  583    H    GLY  75           H        GLY  75  15.624   7.191   2.410
  584    HA2  GLY  75          1HA       GLY  75  17.151   8.145   3.875
  585    HA3  GLY  75          2HA       GLY  75  15.811   8.708   4.863
  586    H    ARG  76           H        ARG  76  16.203   5.365   3.874
  587    HA   ARG  76           HA       ARG  76  17.224   4.620   6.495
  588    HB2  ARG  76          1HB       ARG  76  14.437   4.201   5.620
  589    HB3  ARG  76          2HB       ARG  76  15.209   2.815   6.383
  590    HG2  ARG  76          1HG       ARG  76  15.777   4.271   8.310
  591    HG3  ARG  76          2HG       ARG  76  14.857   5.571   7.554
  592    HD2  ARG  76          1HD       ARG  76  12.849   4.207   7.627
  593    HD3  ARG  76          2HD       ARG  76  13.758   2.880   8.340
  594    HE   ARG  76           HE       ARG  76  14.159   4.444  10.254
  595   HH11  ARG  76          1HH1      ARG  76  11.395   4.918   8.157
  596   HH12  ARG  76          2HH1      ARG  76  10.407   5.604   9.407
  597   HH21  ARG  76          1HH2      ARG  76  12.859   5.360  11.895
  598   HH22  ARG  76          2HH2      ARG  76  11.239   5.853  11.529
  599    H    ASP  77           H        ASP  77  17.518   2.206   6.647
  600    HA   ASP  77           HA       ASP  77  19.232   1.322   4.644
  601    HB2  ASP  77          1HB       ASP  77  17.817  -0.245   6.802
  602    HB3  ASP  77          2HB       ASP  77  19.131  -0.873   5.816
  603    H    ALA  78           H        ALA  78  18.567   1.077   2.652
  604    HA   ALA  78           HA       ALA  78  16.025   0.299   1.790
  605    HB1  ALA  78          1HB       ALA  78  18.638   0.124   0.306
  606    HB2  ALA  78          2HB       ALA  78  17.619   1.558   0.432
  607    HB3  ALA  78          3HB       ALA  78  17.027   0.129  -0.411
  608    H    GLU  79           H        GLU  79  18.963  -1.593   2.288
  609    HA   GLU  79           HA       GLU  79  18.141  -3.962   1.034
  610    HB2  GLU  79          1HB       GLU  79  20.015  -3.537   3.357
  611    HB3  GLU  79          2HB       GLU  79  19.804  -5.080   2.542
  612    HG2  GLU  79          1HG       GLU  79  20.549  -4.033   0.442
  613    HG3  GLU  79          2HG       GLU  79  20.844  -2.536   1.321
  614    H    GLU  80           H        GLU  80  17.830  -2.913   4.395
  615    HA   GLU  80           HA       GLU  80  16.566  -5.283   5.298
  616    HB2  GLU  80          1HB       GLU  80  16.634  -2.506   6.475
  617    HB3  GLU  80          2HB       GLU  80  16.061  -3.944   7.316
  618    HG2  GLU  80          1HG       GLU  80  18.319  -4.941   6.929
  619    HG3  GLU  80          2HG       GLU  80  18.838  -3.371   6.348
  620    H    VAL  81           H        VAL  81  15.391  -2.122   4.228
  621    HA   VAL  81           HA       VAL  81  12.668  -2.474   4.651
  622    HB   VAL  81           HB       VAL  81  14.120  -0.966   2.481
  623   HG11  VAL  81          1HG1      VAL  81  12.003   0.258   2.124
  624   HG12  VAL  81          2HG1      VAL  81  11.186  -0.902   3.177
  625   HG13  VAL  81          3HG1      VAL  81  11.892  -1.439   1.653
  626   HG21  VAL  81          1HG2      VAL  81  12.839  -0.152   5.072
  627   HG22  VAL  81          2HG2      VAL  81  13.474   0.969   3.868
  628   HG23  VAL  81          3HG2      VAL  81  14.560  -0.156   4.680
  629    H    ARG  82           H        ARG  82  14.562  -3.234   1.722
  630    HA   ARG  82           HA       ARG  82  12.643  -4.354   0.110
  631    HB2  ARG  82          1HB       ARG  82  15.065  -3.968  -0.417
  632    HB3  ARG  82          2HB       ARG  82  15.432  -5.442   0.466
  633    HG2  ARG  82          1HG       ARG  82  13.978  -6.687  -1.094
  634    HG3  ARG  82          2HG       ARG  82  13.767  -5.201  -2.015
  635    HD2  ARG  82          1HD       ARG  82  16.222  -5.080  -2.292
  636    HD3  ARG  82          2HD       ARG  82  16.354  -6.641  -1.488
  637    HE   ARG  82           HE       ARG  82  14.599  -7.028  -3.572
  638   HH11  ARG  82          1HH1      ARG  82  17.924  -5.997  -3.215
  639   HH12  ARG  82          2HH1      ARG  82  18.412  -6.606  -4.763
  640   HH21  ARG  82          1HH2      ARG  82  15.235  -7.835  -5.604
  641   HH22  ARG  82          2HH2      ARG  82  16.880  -7.659  -6.125
  642    H    THR  83           H        THR  83  14.514  -5.924   2.656
  643    HA   THR  83           HA       THR  83  13.598  -8.537   2.323
  644    HB   THR  83           HB       THR  83  14.643  -7.018   4.704
  645    HG1  THR  83           HG1      THR  83  15.785  -8.077   2.621
  646   HG21  THR  83          1HG2      THR  83  13.193  -8.787   5.573
  647   HG22  THR  83          2HG2      THR  83  14.891  -9.145   5.889
  648   HG23  THR  83          3HG2      THR  83  14.041  -9.976   4.585
  649    H    GLU  84           H        GLU  84  12.431  -5.981   4.504
  650    HA   GLU  84           HA       GLU  84  10.394  -7.498   5.676
  651    HB2  GLU  84          1HB       GLU  84  10.556  -4.497   5.441
  652    HB3  GLU  84          2HB       GLU  84   9.572  -5.405   6.582
  653    HG2  GLU  84          1HG       GLU  84  11.784  -6.431   7.358
  654    HG3  GLU  84          2HG       GLU  84  12.541  -5.094   6.496
  655    H    VAL  85           H        VAL  85  10.328  -5.575   2.684
  656    HA   VAL  85           HA       VAL  85   7.446  -5.702   2.543
  657    HB   VAL  85           HB       VAL  85   7.488  -4.507   0.630
  658   HG11  VAL  85          1HG1      VAL  85   9.267  -2.915   0.520
  659   HG12  VAL  85          2HG1      VAL  85  10.301  -3.960   1.491
  660   HG13  VAL  85          3HG1      VAL  85   8.843  -3.262   2.196
  661   HG21  VAL  85          1HG2      VAL  85  10.074  -5.767  -0.274
  662   HG22  VAL  85          2HG2      VAL  85   9.027  -4.709  -1.221
  663   HG23  VAL  85          3HG2      VAL  85   8.462  -6.312  -0.741
  664    H    LEU  86           H        LEU  86  10.115  -7.698   1.485
  665    HA   LEU  86           HA       LEU  86   8.708  -9.228  -0.421
  666    HB2  LEU  86          1HB       LEU  86  11.204  -9.743   1.174
  667    HB3  LEU  86          2HB       LEU  86  10.566 -10.914   0.022
  668    HG   LEU  86           HG       LEU  86  11.247  -8.088  -0.743
  669   HD11  LEU  86          1HD1      LEU  86  12.969 -10.551  -0.960
  670   HD12  LEU  86          2HD1      LEU  86  13.236  -9.205   0.148
  671   HD13  LEU  86          3HD1      LEU  86  13.353  -8.950  -1.594
  672   HD21  LEU  86          1HD2      LEU  86   9.747  -9.196  -2.260
  673   HD22  LEU  86          2HD2      LEU  86  10.781 -10.624  -2.295
  674   HD23  LEU  86          3HD2      LEU  86  11.347  -9.107  -2.996
  675    H    LYS  87           H        LYS  87   8.957  -9.478   3.060
  676    HA   LYS  87           HA       LYS  87   7.892 -12.150   3.149
  677    HB2  LYS  87          1HB       LYS  87   7.882 -11.894   5.545
  678    HB3  LYS  87          2HB       LYS  87   9.381 -11.229   4.917
  679    HG2  LYS  87          1HG       LYS  87   8.371  -8.962   5.072
  680    HG3  LYS  87          2HG       LYS  87   6.972  -9.702   5.873
  681    HD2  LYS  87          1HD       LYS  87   8.469 -10.567   7.624
  682    HD3  LYS  87          2HD       LYS  87   9.832  -9.772   6.834
  683    HE2  LYS  87          1HE       LYS  87   8.719  -7.600   7.153
  684    HE3  LYS  87          2HE       LYS  87   7.403  -8.416   7.997
  685    HZ1  LYS  87          1HZ       LYS  87  10.244  -8.348   8.853
  686    HZ2  LYS  87          2HZ       LYS  87   9.007  -9.177   9.651
  687    HZ3  LYS  87          3HZ       LYS  87   8.970  -7.492   9.560
  688    H    CYS  88           H        CYS  88   6.594  -9.170   2.527
  689    HA   CYS  88           HA       CYS  88   3.924  -9.958   3.446
  690    HB2  CYS  88          1HB       CYS  88   5.148  -7.309   2.737
  691    HB3  CYS  88          2HB       CYS  88   3.386  -7.511   2.727
  692    H    VAL  89           H        VAL  89   5.925  -9.614   0.683
  693    HA   VAL  89           HA       VAL  89   3.886  -9.440  -1.300
  694    HB   VAL  89           HB       VAL  89   6.721 -10.469  -1.523
  695   HG11  VAL  89          1HG1      VAL  89   6.419 -10.041  -3.948
  696   HG12  VAL  89          2HG1      VAL  89   4.708  -9.727  -3.638
  697   HG13  VAL  89          3HG1      VAL  89   5.380 -11.326  -3.329
  698   HG21  VAL  89          1HG2      VAL  89   6.723  -8.159  -0.858
  699   HG22  VAL  89          2HG2      VAL  89   5.537  -7.757  -2.101
  700   HG23  VAL  89          3HG2      VAL  89   7.162  -8.261  -2.563
  701    H    ASP  90           H        ASP  90   2.689 -11.013  -2.174
  702    HA   ASP  90           HA       ASP  90   3.368 -13.804  -1.720
  703    HB2  ASP  90          1HB       ASP  90   1.949 -12.999   0.208
  704    HB3  ASP  90          2HB       ASP  90   0.665 -12.694  -0.965
  705    H    LYS  91           H        LYS  91   2.002 -15.266  -2.985
  706    HA   LYS  91           HA       LYS  91   1.656 -14.304  -5.656
  707    HB2  LYS  91          1HB       LYS  91   0.677 -16.950  -4.601
  708    HB3  LYS  91          2HB       LYS  91   1.139 -16.535  -6.243
  709    HG2  LYS  91          1HG       LYS  91   3.041 -16.641  -3.933
  710    HG3  LYS  91          2HG       LYS  91   2.770 -17.956  -5.073
  711    HD2  LYS  91          1HD       LYS  91   3.489 -16.494  -6.908
  712    HD3  LYS  91          2HD       LYS  91   3.782 -15.197  -5.748
  713    HE2  LYS  91          1HE       LYS  91   5.176 -17.869  -5.844
  714    HE3  LYS  91          2HE       LYS  91   5.862 -16.312  -6.307
  715    HZ1  LYS  91          1HZ       LYS  91   5.550 -15.576  -3.999
  716    HZ2  LYS  91          2HZ       LYS  91   6.595 -16.894  -4.118
  717    HZ3  LYS  91          3HZ       LYS  91   5.009 -17.123  -3.581
  718    H    ASN  92           H        ASN  92  -0.292 -14.488  -6.905
  719    HA   ASN  92           HA       ASN  92  -2.574 -13.454  -5.451
  720    HB2  ASN  92          1HB       ASN  92  -1.839 -12.476  -7.636
  721    HB3  ASN  92          2HB       ASN  92  -2.306 -13.982  -8.412
  722   HD21  ASN  92          1HD2      ASN  92  -3.801 -12.873  -9.697
  723   HD22  ASN  92          2HD2      ASN  92  -5.322 -12.338  -9.066
  724    H    THR  93           H        THR  93  -2.377 -15.815  -4.457
  725    HA   THR  93           HA       THR  93  -4.034 -17.720  -5.879
  726    HB   THR  93           HB       THR  93  -3.921 -19.020  -3.755
  727    HG1  THR  93           HG1      THR  93  -3.313 -18.020  -1.994
  728   HG21  THR  93          1HG2      THR  93  -1.513 -19.494  -3.864
  729   HG22  THR  93          2HG2      THR  93  -1.282 -18.030  -4.821
  730   HG23  THR  93          3HG2      THR  93  -2.239 -19.363  -5.465
  731    H    ASP  94           H        ASP  94  -4.535 -14.917  -4.238
  732    HA   ASP  94           HA       ASP  94  -6.995 -15.590  -2.898
  733    HB2  ASP  94          1HB       ASP  94  -5.316 -13.721  -2.275
  734    HB3  ASP  94          2HB       ASP  94  -6.072 -12.799  -3.578
  735    H    ASN  95           H        ASN  95  -5.936 -14.446  -5.954
  736    HA   ASN  95           HA       ASN  95  -6.894 -14.228  -7.969
  737    HB2  ASN  95          1HB       ASN  95  -7.852 -16.449  -7.297
  738    HB3  ASN  95          2HB       ASN  95  -9.311 -15.600  -6.814
  739   HD21  ASN  95          1HD2      ASN  95 -10.590 -16.615  -8.309
  740   HD22  ASN  95          2HD2      ASN  95 -10.479 -16.292 -10.010
  741    H    ASN  96           H        ASN  96  -7.213 -12.103  -6.067
  742    HA   ASN  96           HA       ASN  96  -9.297 -10.652  -7.449
  743    HB2  ASN  96          1HB       ASN  96 -10.599 -11.554  -5.638
  744    HB3  ASN  96          2HB       ASN  96  -9.372 -11.111  -4.456
  745   HD21  ASN  96          1HD2      ASN  96 -11.963 -10.015  -6.465
  746   HD22  ASN  96          2HD2      ASN  96 -12.132  -8.445  -5.753
  747    H    ALA  97           H        ALA  97  -8.446  -8.745  -7.970
  748    HA   ALA  97           HA       ALA  97  -5.811  -8.112  -7.199
  749    HB1  ALA  97          1HB       ALA  97  -6.016  -6.192  -8.628
  750    HB2  ALA  97          2HB       ALA  97  -7.772  -6.339  -8.635
  751    HB3  ALA  97          3HB       ALA  97  -6.781  -7.579  -9.400
  752    H    CYS  98           H        CYS  98  -8.937  -6.757  -6.213
  753    HA   CYS  98           HA       CYS  98  -7.906  -4.515  -4.837
  754    HB2  CYS  98          1HB       CYS  98 -10.444  -6.056  -4.231
  755    HB3  CYS  98          2HB       CYS  98 -10.051  -4.443  -3.646
  756    H    HIS  99           H        HIS  99  -8.582  -7.826  -3.751
  757    HA   HIS  99           HA       HIS  99  -7.874  -7.183  -1.031
  758    HB2  HIS  99          1HB       HIS  99  -9.559  -8.952  -1.713
  759    HB3  HIS  99          2HB       HIS  99  -8.195  -9.936  -2.224
  760    HD1  HIS  99           HD1      HIS  99  -8.134 -11.748  -0.533
  761    HD2  HIS  99           HD2      HIS  99  -8.506  -7.988   1.210
  762    HE1  HIS  99           HE1      HIS  99  -7.955 -12.124   1.949
  763    HE2  HIS  99           HE2      HIS  99  -8.396  -9.870   2.978
  764    H    TRP 100           H        TRP 100  -6.281  -8.458  -3.846
  765    HA   TRP 100           HA       TRP 100  -4.078  -9.689  -2.617
  766    HB2  TRP 100          1HB       TRP 100  -4.668  -9.961  -5.012
  767    HB3  TRP 100          2HB       TRP 100  -4.157  -8.301  -5.313
  768    HD1  TRP 100           HD1      TRP 100  -1.835 -10.047  -2.967
  769    HE1  TRP 100           HE1      TRP 100   0.301 -10.764  -4.214
  770    HE3  TRP 100           HE3      TRP 100  -3.390  -9.263  -7.778
  771    HZ2  TRP 100           HZ2      TRP 100   1.202 -10.981  -6.870
  772    HZ3  TRP 100           HZ3      TRP 100  -1.826  -9.753  -9.610
  773    HH2  TRP 100           HH2      TRP 100   0.417 -10.599  -9.171
  774    H    ALA 101           H        ALA 101  -4.357  -6.416  -4.010
  775    HA   ALA 101           HA       ALA 101  -1.857  -5.490  -3.099
  776    HB1  ALA 101          1HB       ALA 101  -2.744  -3.247  -3.544
  777    HB2  ALA 101          2HB       ALA 101  -4.362  -3.930  -3.711
  778    HB3  ALA 101          3HB       ALA 101  -3.098  -4.366  -4.861
  779    H    PHE 102           H        PHE 102  -5.051  -5.537  -1.660
  780    HA   PHE 102           HA       PHE 102  -4.482  -3.862   0.518
  781    HB2  PHE 102          1HB       PHE 102  -6.755  -4.382  -0.237
  782    HB3  PHE 102          2HB       PHE 102  -6.566  -6.040   0.323
  783    HD1  PHE 102           HD1      PHE 102  -6.506  -2.514   1.475
  784    HD2  PHE 102           HD2      PHE 102  -7.164  -6.589   2.522
  785    HE1  PHE 102           HE1      PHE 102  -7.329  -1.810   3.683
  786    HE2  PHE 102           HE2      PHE 102  -7.989  -5.890   4.730
  787    HZ   PHE 102           HZ       PHE 102  -8.071  -3.497   5.314
  788    H    ARG 103           H        ARG 103  -3.944  -7.260  -0.071
  789    HA   ARG 103           HA       ARG 103  -3.462  -8.048   2.615
  790    HB2  ARG 103          1HB       ARG 103  -2.578  -9.226  -0.011
  791    HB3  ARG 103          2HB       ARG 103  -2.169  -9.951   1.534
  792    HG2  ARG 103          1HG       ARG 103  -4.572 -10.152   2.038
  793    HG3  ARG 103          2HG       ARG 103  -4.938  -9.510   0.439
  794    HD2  ARG 103          1HD       ARG 103  -5.076 -11.957   0.482
  795    HD3  ARG 103          2HD       ARG 103  -3.796 -11.411  -0.600
  796    HE   ARG 103           HE       ARG 103  -3.141 -12.200   2.151
  797   HH11  ARG 103          1HH1      ARG 103  -2.851 -12.791  -1.306
  798   HH12  ARG 103          2HH1      ARG 103  -1.575 -13.954  -1.118
  799   HH21  ARG 103          1HH2      ARG 103  -1.473 -13.735   2.374
  800   HH22  ARG 103          2HH2      ARG 103  -0.814 -14.494   0.958
  801    H    GLY 104           H        GLY 104  -1.360  -6.977  -0.020
  802    HA2  GLY 104          1HA       GLY 104   1.098  -7.266   1.341
  803    HA3  GLY 104          2HA       GLY 104   0.800  -6.196  -0.033
  804    H    PHE 105           H        PHE 105  -1.092  -4.504   1.009
  805    HA   PHE 105           HA       PHE 105   0.506  -2.667   2.417
  806    HB2  PHE 105          1HB       PHE 105  -1.166  -1.807   0.978
  807    HB3  PHE 105          2HB       PHE 105  -2.426  -2.748   1.759
  808    HD1  PHE 105           HD1      PHE 105   0.206  -0.406   2.992
  809    HD2  PHE 105           HD2      PHE 105  -3.944  -1.352   2.798
  810    HE1  PHE 105           HE1      PHE 105  -0.312   1.549   4.399
  811    HE2  PHE 105           HE2      PHE 105  -4.456   0.591   4.209
  812    HZ   PHE 105           HZ       PHE 105  -2.640   2.044   5.013
  813    H    LYS 106           H        LYS 106  -2.177  -4.746   3.413
  814    HA   LYS 106           HA       LYS 106  -2.411  -3.753   6.029
  815    HB2  LYS 106          1HB       LYS 106  -4.290  -4.893   5.406
  816    HB3  LYS 106          2HB       LYS 106  -3.400  -6.169   4.581
  817    HG2  LYS 106          1HG       LYS 106  -2.784  -7.096   6.785
  818    HG3  LYS 106          2HG       LYS 106  -3.749  -5.831   7.554
  819    HD2  LYS 106          1HD       LYS 106  -5.754  -6.659   6.457
  820    HD3  LYS 106          2HD       LYS 106  -4.808  -7.883   5.610
  821    HE2  LYS 106          1HE       LYS 106  -4.219  -8.909   7.748
  822    HE3  LYS 106          2HE       LYS 106  -5.151  -7.681   8.601
  823    HZ1  LYS 106          1HZ       LYS 106  -7.154  -8.486   7.563
  824    HZ2  LYS 106          2HZ       LYS 106  -6.361  -9.776   8.327
  825    HZ3  LYS 106          3HZ       LYS 106  -6.275  -9.610   6.649
  826    H    CYS 107           H        CYS 107  -0.588  -6.465   4.692
  827    HA   CYS 107           HA       CYS 107   0.368  -7.533   7.086
  828    HB2  CYS 107          1HB       CYS 107   0.569  -8.845   5.127
  829    HB3  CYS 107          2HB       CYS 107   1.418  -7.577   4.253
  830    H    PHE 108           H        PHE 108   1.671  -5.016   4.969
  831    HA   PHE 108           HA       PHE 108   4.153  -4.838   6.361
  832    HB2  PHE 108          1HB       PHE 108   3.671  -4.287   3.909
  833    HB3  PHE 108          2HB       PHE 108   3.062  -2.742   4.507
  834    HD1  PHE 108           HD1      PHE 108   6.017  -4.910   4.225
  835    HD2  PHE 108           HD2      PHE 108   4.576  -1.033   5.223
  836    HE1  PHE 108           HE1      PHE 108   8.321  -4.062   4.243
  837    HE2  PHE 108           HE2      PHE 108   6.879  -0.179   5.236
  838    HZ   PHE 108           HZ       PHE 108   8.755  -1.694   4.741
  839    H    GLN 109           H        GLN 109   1.244  -2.782   6.233
  840    HA   GLN 109           HA       GLN 109   2.272  -0.785   7.963
  841    HB2  GLN 109          1HB       GLN 109   0.052   0.129   7.972
  842    HB3  GLN 109          2HB       GLN 109   0.436  -0.403   6.345
  843    HG2  GLN 109          1HG       GLN 109  -1.559  -1.385   6.381
  844    HG3  GLN 109          2HG       GLN 109  -0.811  -2.598   7.425
  845   HE21  GLN 109          1HE2      GLN 109  -2.720  -3.029   8.498
  846   HE22  GLN 109          2HE2      GLN 109  -3.445  -1.922   9.610
  847    H    LYS 110           H        LYS 110   1.158  -3.902   8.590
  848    HA   LYS 110           HA       LYS 110   0.066  -3.434  11.199
  849    HB2  LYS 110          1HB       LYS 110  -0.464  -5.378   9.678
  850    HB3  LYS 110          2HB       LYS 110   1.128  -6.015  10.053
  851    HG2  LYS 110          1HG       LYS 110   0.438  -5.952  12.472
  852    HG3  LYS 110          2HG       LYS 110  -1.193  -5.609  11.902
  853    HD2  LYS 110          1HD       LYS 110  -0.959  -7.694  10.462
  854    HD3  LYS 110          2HD       LYS 110   0.457  -8.076  11.442
  855    HE2  LYS 110          1HE       LYS 110  -1.445  -9.227  12.353
  856    HE3  LYS 110          2HE       LYS 110  -0.976  -7.945  13.466
  857    HZ1  LYS 110          1HZ       LYS 110  -3.203  -7.806  11.505
  858    HZ2  LYS 110          2HZ       LYS 110  -2.753  -6.569  12.569
  859    HZ3  LYS 110          3HZ       LYS 110  -3.366  -8.022  13.174
  860    H    ASN 111           H        ASN 111   3.203  -3.922   9.842
  861    HA   ASN 111           HA       ASN 111   4.342  -4.290  12.537
  862    HB2  ASN 111          1HB       ASN 111   5.467  -5.253   9.899
  863    HB3  ASN 111          2HB       ASN 111   6.218  -5.453  11.476
  864   HD21  ASN 111          1HD2      ASN 111   3.637  -6.487   9.379
  865   HD22  ASN 111          2HD2      ASN 111   3.214  -7.899  10.276
  866    H    ASN 112           H        ASN 112   4.395  -2.460   9.589
  867    HA   ASN 112           HA       ASN 112   6.493  -0.730  10.696
  868    HB2  ASN 112          1HB       ASN 112   6.507  -2.032   7.975
  869    HB3  ASN 112          2HB       ASN 112   7.468  -0.600   8.358
  870   HD21  ASN 112          1HD2      ASN 112   8.018  -3.520   7.712
  871   HD22  ASN 112          2HD2      ASN 112   9.197  -3.972   8.899
  872    H    LEU 113           H        LEU 113   4.238   0.358  11.012
  873    HA   LEU 113           HA       LEU 113   3.186   1.582   8.625
  874    HB2  LEU 113          1HB       LEU 113   1.632   1.018  10.372
  875    HB3  LEU 113          2HB       LEU 113   2.503   2.005  11.531
  876    HG   LEU 113           HG       LEU 113   1.878   4.015  10.188
  877   HD11  LEU 113          1HD1      LEU 113   1.593   2.830   8.041
  878   HD12  LEU 113          2HD1      LEU 113   0.199   3.825   8.467
  879   HD13  LEU 113          3HD1      LEU 113   0.131   2.077   8.682
  880   HD21  LEU 113          1HD2      LEU 113  -0.449   4.056  10.907
  881   HD22  LEU 113          2HD2      LEU 113   0.567   3.307  12.139
  882   HD23  LEU 113          3HD2      LEU 113  -0.433   2.303  11.092
  883    H    SER 114           H        SER 114   5.474   2.363  11.089
  884    HA   SER 114           HA       SER 114   5.448   5.189  10.821
  885    HB2  SER 114          1HB       SER 114   7.726   3.403  11.716
  886    HB3  SER 114          2HB       SER 114   7.594   5.138  11.994
  887    HG   SER 114           HG       SER 114   5.808   3.152  12.972
  888    H    LEU 115           H        LEU 115   7.194   2.619   9.157
  889    HA   LEU 115           HA       LEU 115   8.950   4.291   7.702
  890    HB2  LEU 115          1HB       LEU 115   9.216   1.841   8.027
  891    HB3  LEU 115          2HB       LEU 115   7.879   1.585   6.927
  892    HG   LEU 115           HG       LEU 115   9.197   2.678   5.129
  893   HD11  LEU 115          1HD1      LEU 115  11.371   2.636   7.210
  894   HD12  LEU 115          2HD1      LEU 115  10.632   4.066   6.491
  895   HD13  LEU 115          3HD1      LEU 115  11.608   2.984   5.498
  896   HD21  LEU 115          1HD2      LEU 115  10.555   0.341   6.462
  897   HD22  LEU 115          2HD2      LEU 115  10.723   0.817   4.773
  898   HD23  LEU 115          3HD2      LEU 115   9.168   0.245   5.378
  899    H    ILE 116           H        ILE 116   5.693   3.136   7.166
  900    HA   ILE 116           HA       ILE 116   5.431   3.960   4.484
  901    HB   ILE 116           HB       ILE 116   3.356   3.493   6.629
  902   HG12  ILE 116          1HG1      ILE 116   4.185   1.840   4.231
  903   HG13  ILE 116          2HG1      ILE 116   4.700   1.540   5.895
  904   HG21  ILE 116          1HG2      ILE 116   2.427   5.026   4.999
  905   HG22  ILE 116          2HG2      ILE 116   1.715   3.423   4.791
  906   HG23  ILE 116          3HG2      ILE 116   2.965   3.984   3.681
  907   HD11  ILE 116          1HD1      ILE 116   1.899   1.394   4.819
  908   HD12  ILE 116          2HD1      ILE 116   2.335   1.194   6.514
  909   HD13  ILE 116          3HD1      ILE 116   2.913   0.042   5.310
  910    H    LYS 117           H        LYS 117   4.605   5.504   7.561
  911    HA   LYS 117           HA       LYS 117   3.596   7.909   6.515
  912    HB2  LYS 117          1HB       LYS 117   4.857   7.191   9.149
  913    HB3  LYS 117          2HB       LYS 117   4.267   8.811   8.813
  914    HG2  LYS 117          1HG       LYS 117   2.027   8.018   8.559
  915    HG3  LYS 117          2HG       LYS 117   2.552   6.337   8.632
  916    HD2  LYS 117          1HD       LYS 117   3.189   6.567  10.930
  917    HD3  LYS 117          2HD       LYS 117   2.933   8.311  10.881
  918    HE2  LYS 117          1HE       LYS 117   0.736   6.310  10.405
  919    HE3  LYS 117          2HE       LYS 117   1.125   6.946  12.001
  920    HZ1  LYS 117          1HZ       LYS 117  -0.666   8.191  11.011
  921    HZ2  LYS 117          2HZ       LYS 117   0.272   8.550   9.650
  922    HZ3  LYS 117          3HZ       LYS 117   0.697   9.182  11.161
  923    H    ALA 118           H        ALA 118   6.852   6.837   7.269
  924    HA   ALA 118           HA       ALA 118   8.069   9.406   6.992
  925    HB1  ALA 118          1HB       ALA 118   9.011   7.645   8.379
  926    HB2  ALA 118          2HB       ALA 118  10.157   8.197   7.159
  927    HB3  ALA 118          3HB       ALA 118   9.300   6.670   6.940
  928    H    SER 119           H        SER 119   7.406   6.748   4.830
  929    HA   SER 119           HA       SER 119   9.272   7.402   2.833
  930    HB2  SER 119          1HB       SER 119   8.037   5.883   1.399
  931    HB3  SER 119          2HB       SER 119   8.141   5.207   3.022
  932    HG   SER 119           HG       SER 119   5.994   6.022   3.374
  933    H    ILE 120           H        ILE 120   6.091   8.631   3.531
  934    HA   ILE 120           HA       ILE 120   6.023  10.081   0.993
  935    HB   ILE 120           HB       ILE 120   3.715  10.696   1.624
  936   HG12  ILE 120          1HG1      ILE 120   4.056   8.800   3.946
  937   HG13  ILE 120          2HG1      ILE 120   4.155  10.554   4.110
  938   HG21  ILE 120          1HG2      ILE 120   4.097   8.722   0.277
  939   HG22  ILE 120          2HG2      ILE 120   2.752   8.446   1.384
  940   HG23  ILE 120          3HG2      ILE 120   4.335   7.752   1.731
  941   HD11  ILE 120          1HD1      ILE 120   1.860  10.724   3.234
  942   HD12  ILE 120          2HD1      ILE 120   1.964   9.798   4.731
  943   HD13  ILE 120          3HD1      ILE 120   1.776   8.963   3.188
  944    H    LYS 121           H        LYS 121   7.457  10.584   3.806
  945    HA   LYS 121           HA       LYS 121   6.593  13.225   4.486
  946    HB2  LYS 121          1HB       LYS 121   7.694  11.688   6.086
  947    HB3  LYS 121          2HB       LYS 121   9.178  11.799   5.153
  948    HG2  LYS 121          1HG       LYS 121   9.405  13.234   7.034
  949    HG3  LYS 121          2HG       LYS 121   9.166  14.268   5.624
  950    HD2  LYS 121          1HD       LYS 121   6.860  14.622   6.204
  951    HD3  LYS 121          2HD       LYS 121   6.966  13.444   7.513
  952    HE2  LYS 121          1HE       LYS 121   8.633  14.880   8.628
  953    HE3  LYS 121          2HE       LYS 121   8.439  16.069   7.344
  954    HZ1  LYS 121          1HZ       LYS 121   6.315  15.169   9.215
  955    HZ2  LYS 121          2HZ       LYS 121   6.111  16.300   7.975
  956    HZ3  LYS 121          3HZ       LYS 121   7.128  16.651   9.275
  957    H    LYS 122           H        LYS 122   7.046  15.026   3.403
  958    HA   LYS 122           HA       LYS 122   9.100  14.973   1.360
  959    HB2  LYS 122          1HB       LYS 122   8.102  17.447   1.113
  960    HB3  LYS 122          2HB       LYS 122   7.383  16.043   0.344
  961    HG2  LYS 122          1HG       LYS 122   5.623  17.283   1.302
  962    HG3  LYS 122          2HG       LYS 122   5.863  15.880   2.343
  963    HD2  LYS 122          1HD       LYS 122   7.066  17.221   3.947
  964    HD3  LYS 122          2HD       LYS 122   7.011  18.619   2.872
  965    HE2  LYS 122          1HE       LYS 122   4.592  17.253   4.044
  966    HE3  LYS 122          2HE       LYS 122   5.338  18.708   4.702
  967    HZ1  LYS 122          1HZ       LYS 122   4.171  18.459   1.975
  968    HZ2  LYS 122          2HZ       LYS 122   4.853  19.858   2.647
  969    HZ3  LYS 122          3HZ       LYS 122   3.434  19.218   3.299
  970    H    ASP 123           H        ASP 123  10.808  16.392   1.228
  971    HA   ASP 123           HA       ASP 123  11.977  17.088   3.744
  972    HB2  ASP 123          1HB       ASP 123  12.932  17.701   0.939
  973    HB3  ASP 123          2HB       ASP 123  13.878  17.894   2.408
  974    H21  ACD 201           H21      ACD   1  -4.563   4.803   1.861
  975    H22  ACD 201           H22      ACD   1  -3.350   5.263   3.062
  976    H31  ACD 201           H31      ACD   1  -2.113   6.536   1.364
  977    H32  ACD 201           H32      ACD   1  -3.351   6.209   0.160
  978    H41  ACD 201           H41      ACD   1  -2.870   3.782   0.290
  979    H42  ACD 201           H42      ACD   1  -1.402   4.685  -0.100
  980    H5   ACD 201           H5       ACD   1  -1.990   3.240   2.532
  981    H6   ACD 201           H6       ACD   1   0.282   3.815   2.998
  982    H71  ACD 201           H71      ACD   1   0.741   4.790   0.313
  983    H72  ACD 201           H72      ACD   1  -0.155   6.094   1.093
  984    H8   ACD 201           H8       ACD   1   1.710   6.429   2.751
  985    H9   ACD 201           H9       ACD   1   3.826   5.573   2.063
  986   H101  ACD 201          H101      ACD   1   2.773   4.776  -0.511
  987   H102  ACD 201          H102      ACD   1   2.283   3.468   0.574
  988    H11  ACD 201           H11      ACD   1   5.255   4.328   0.487
  989    H12  ACD 201           H12      ACD   1   5.572   1.995   0.164
  990   H131  ACD 201          H131      ACD   1   2.602   2.035  -0.552
  991   H132  ACD 201          H132      ACD   1   3.703   0.657  -0.674
  992    H14  ACD 201           H14      ACD   1   2.538   1.665   2.025
  993    H15  ACD 201           H15      ACD   1   2.507  -0.680   2.456
  994   H161  ACD 201          H161      ACD   1   2.786  -1.311  -0.370
  995   H162  ACD 201          H162      ACD   1   4.425  -0.923   0.168
  996   H171  ACD 201          H171      ACD   1   4.369  -2.649   1.863
  997   H172  ACD 201          H172      ACD   1   2.645  -2.923   1.614
  998   H181  ACD 201          H181      ACD   1   4.823  -3.439  -0.460
  999   H182  ACD 201          H182      ACD   1   3.097  -3.733  -0.693
 1000   H191  ACD 201          H191      ACD   1   4.935  -5.095   1.320
 1001   H192  ACD 201          H192      ACD   1   3.182  -5.299   1.317
 1002   H201  ACD 201          H201      ACD   1   5.042  -5.986  -0.974
 1003   H202  ACD 201          H202      ACD   1   3.320  -6.159  -1.009
 1004   H203  ACD 201          H203      ACD   1   4.265  -7.118   0.082
  Start of MODEL   11
    1    H1   MET   1          1H        MET   1  15.807  18.765 -14.974
    2    H2   MET   1          2H        MET   1  16.291  19.148 -13.401
    3    H3   MET   1          3H        MET   1  14.656  18.897 -13.745
    4    HA   MET   1           HA       MET   1  15.013  16.611 -14.204
    5    HB2  MET   1          1HB       MET   1  17.221  15.586 -13.925
    6    HB3  MET   1          2HB       MET   1  17.248  16.807 -15.187
    7    HG2  MET   1          1HG       MET   1  18.299  18.383 -13.669
    8    HG3  MET   1          2HG       MET   1  18.226  17.200 -12.367
    9    HE1  MET   1          1HE       MET   1  22.056  17.416 -13.199
   10    HE2  MET   1          2HE       MET   1  20.818  17.628 -11.962
   11    HE3  MET   1          3HE       MET   1  20.905  18.745 -13.322
   12    H    GLU   2           H        GLU   2  14.481  18.531 -11.960
   13    HA   GLU   2           HA       GLU   2  15.598  17.483  -9.587
   14    HB2  GLU   2          1HB       GLU   2  13.115  19.095 -10.091
   15    HB3  GLU   2          2HB       GLU   2  13.643  18.618  -8.483
   16    HG2  GLU   2          1HG       GLU   2  15.186  20.303 -10.429
   17    HG3  GLU   2          2HG       GLU   2  14.341  20.878  -8.991
   18    H    PHE   3           H        PHE   3  15.201  15.672  -8.566
   19    HA   PHE   3           HA       PHE   3  12.907  14.076  -9.340
   20    HB2  PHE   3          1HB       PHE   3  15.047  12.933  -9.088
   21    HB3  PHE   3          2HB       PHE   3  15.147  13.455  -7.401
   22    HD1  PHE   3           HD1      PHE   3  14.211  12.140  -5.712
   23    HD2  PHE   3           HD2      PHE   3  13.098  11.472  -9.761
   24    HE1  PHE   3           HE1      PHE   3  12.978  10.122  -5.035
   25    HE2  PHE   3           HE2      PHE   3  11.857   9.454  -9.091
   26    HZ   PHE   3           HZ       PHE   3  11.795   8.779  -6.723
   27    H    THR   4           H        THR   4  11.078  14.117  -8.309
   28    HA   THR   4           HA       THR   4  11.025  15.052  -5.512
   29    HB   THR   4           HB       THR   4   8.495  15.200  -7.003
   30    HG1  THR   4           HG1      THR   4  10.142  15.952  -8.568
   31   HG21  THR   4          1HG2      THR   4   8.890  15.991  -4.701
   32   HG22  THR   4          2HG2      THR   4   8.285  17.248  -5.779
   33   HG23  THR   4          3HG2      THR   4   9.993  17.209  -5.342
   34    H    VAL   5           H        VAL   5  10.162  13.768  -4.067
   35    HA   VAL   5           HA       VAL   5   9.170  11.162  -4.956
   36    HB   VAL   5           HB       VAL   5   9.857  10.285  -2.980
   37   HG11  VAL   5          1HG1      VAL   5  11.857  11.263  -2.123
   38   HG12  VAL   5          2HG1      VAL   5  11.413  12.842  -2.770
   39   HG13  VAL   5          3HG1      VAL   5  11.788  11.514  -3.867
   40   HG21  VAL   5          1HG2      VAL   5   9.195  12.855  -1.549
   41   HG22  VAL   5          2HG2      VAL   5   9.741  11.361  -0.788
   42   HG23  VAL   5          3HG2      VAL   5   8.184  11.410  -1.613
   43    H    SER   6           H        SER   6   7.196  10.334  -4.318
   44    HA   SER   6           HA       SER   6   5.063  12.183  -4.313
   45    HB2  SER   6          1HB       SER   6   3.668  10.114  -3.923
   46    HB3  SER   6          2HB       SER   6   4.745  10.029  -5.318
   47    HG   SER   6           HG       SER   6   5.397   9.014  -2.748
   48    H    THR   7           H        THR   7   5.114  13.536  -2.556
   49    HA   THR   7           HA       THR   7   5.375  12.506   0.123
   50    HB   THR   7           HB       THR   7   5.029  14.849   0.831
   51    HG1  THR   7           HG1      THR   7   4.472  15.163  -1.937
   52   HG21  THR   7          1HG2      THR   7   7.059  15.779  -0.193
   53   HG22  THR   7          2HG2      THR   7   7.018  14.505  -1.412
   54   HG23  THR   7          3HG2      THR   7   7.280  14.096   0.283
   55    H    THR   8           H        THR   8   3.690  13.652   1.731
   56    HA   THR   8           HA       THR   8   1.304  12.290   1.569
   57    HB   THR   8           HB       THR   8   1.532  14.929   2.988
   58    HG1  THR   8           HG1      THR   8   2.396  12.693   4.362
   59   HG21  THR   8          1HG2      THR   8  -0.593  13.809   3.198
   60   HG22  THR   8          2HG2      THR   8   0.272  13.666   4.726
   61   HG23  THR   8          3HG2      THR   8   0.202  12.295   3.618
   62    H    GLU   9           H        GLU   9   2.077  15.541   0.427
   63    HA   GLU   9           HA       GLU   9  -0.538  16.333  -0.214
   64    HB2  GLU   9          1HB       GLU   9   2.102  17.221  -1.371
   65    HB3  GLU   9          2HB       GLU   9   0.561  18.007  -1.690
   66    HG2  GLU   9          1HG       GLU   9   1.926  17.750   0.977
   67    HG3  GLU   9          2HG       GLU   9   1.762  19.216   0.008
   68    H    ASP  10           H        ASP  10   2.008  14.851  -2.188
   69    HA   ASP  10           HA       ASP  10   0.542  14.711  -4.590
   70    HB2  ASP  10          1HB       ASP  10   2.698  12.793  -3.657
   71    HB3  ASP  10          2HB       ASP  10   2.156  13.053  -5.314
   72    H    LEU  11           H        LEU  11   0.859  12.557  -1.840
   73    HA   LEU  11           HA       LEU  11  -0.528  10.374  -2.872
   74    HB2  LEU  11          1HB       LEU  11   0.812  10.156  -0.899
   75    HB3  LEU  11          2HB       LEU  11  -0.205  11.301  -0.019
   76    HG   LEU  11           HG       LEU  11  -2.077   9.670  -0.213
   77   HD11  LEU  11          1HD1      LEU  11  -1.274   8.492  -2.199
   78   HD12  LEU  11          2HD1      LEU  11  -1.596   7.387  -0.865
   79   HD13  LEU  11          3HD1      LEU  11   0.065   7.834  -1.260
   80   HD21  LEU  11          1HD2      LEU  11  -0.439   9.848   1.730
   81   HD22  LEU  11          2HD2      LEU  11   0.316   8.392   1.077
   82   HD23  LEU  11          3HD2      LEU  11  -1.366   8.359   1.598
   83    H    GLN  12           H        GLN  12  -1.694  13.213  -1.072
   84    HA   GLN  12           HA       GLN  12  -4.354  12.338  -0.767
   85    HB2  GLN  12          1HB       GLN  12  -3.211  15.127  -0.900
   86    HB3  GLN  12          2HB       GLN  12  -4.892  14.787  -0.527
   87    HG2  GLN  12          1HG       GLN  12  -4.097  13.448   1.428
   88    HG3  GLN  12          2HG       GLN  12  -2.472  14.036   1.087
   89   HE21  GLN  12          1HE2      GLN  12  -1.990  16.216   1.448
   90   HE22  GLN  12          2HE2      GLN  12  -3.015  17.234   2.395
   91    H    ARG  13           H        ARG  13  -2.672  13.864  -3.389
   92    HA   ARG  13           HA       ARG  13  -4.905  14.666  -4.917
   93    HB2  ARG  13          1HB       ARG  13  -2.562  15.447  -5.252
   94    HB3  ARG  13          2HB       ARG  13  -2.171  13.867  -5.913
   95    HG2  ARG  13          1HG       ARG  13  -2.528  15.368  -7.730
   96    HG3  ARG  13          2HG       ARG  13  -3.909  14.252  -7.656
   97    HD2  ARG  13          1HD       ARG  13  -5.237  15.925  -6.537
   98    HD3  ARG  13          2HD       ARG  13  -3.864  17.028  -6.489
   99    HE   ARG  13           HE       ARG  13  -4.350  16.322  -9.154
  100   HH11  ARG  13          1HH1      ARG  13  -5.864  18.095  -6.558
  101   HH12  ARG  13          2HH1      ARG  13  -6.692  19.198  -7.609
  102   HH21  ARG  13          1HH2      ARG  13  -5.415  17.774 -10.561
  103   HH22  ARG  13          2HH2      ARG  13  -6.413  19.029  -9.896
  104    H    TYR  14           H        TYR  14  -2.969  11.701  -4.851
  105    HA   TYR  14           HA       TYR  14  -4.272  10.499  -7.075
  106    HB2  TYR  14          1HB       TYR  14  -2.732   9.134  -4.859
  107    HB3  TYR  14          2HB       TYR  14  -3.111   8.473  -6.441
  108    HD1  TYR  14           HD1      TYR  14  -0.379   9.163  -4.858
  109    HD2  TYR  14           HD2      TYR  14  -2.476  10.813  -8.174
  110    HE1  TYR  14           HE1      TYR  14   1.733  10.063  -5.742
  111    HE2  TYR  14           HE2      TYR  14  -0.370  11.709  -9.066
  112    HH   TYR  14           HH       TYR  14   1.862  12.365  -8.212
  113    H    ARG  15           H        ARG  15  -4.792  10.392  -3.595
  114    HA   ARG  15           HA       ARG  15  -6.556   8.199  -3.558
  115    HB2  ARG  15          1HB       ARG  15  -6.766  10.492  -1.623
  116    HB3  ARG  15          2HB       ARG  15  -7.120   8.799  -1.361
  117    HG2  ARG  15          1HG       ARG  15  -4.713   8.287  -1.613
  118    HG3  ARG  15          2HG       ARG  15  -4.402  10.023  -1.698
  119    HD2  ARG  15          1HD       ARG  15  -5.650   8.535   0.614
  120    HD3  ARG  15          2HD       ARG  15  -4.025   9.215   0.567
  121    HE   ARG  15           HE       ARG  15  -5.898  11.251   0.072
  122   HH11  ARG  15          1HH1      ARG  15  -4.870   9.127   2.664
  123   HH12  ARG  15          2HH1      ARG  15  -5.222  10.290   3.909
  124   HH21  ARG  15          1HH2      ARG  15  -6.399  12.758   1.714
  125   HH22  ARG  15          2HH2      ARG  15  -6.100  12.345   3.372
  126    H    THR  16           H        THR  16  -7.070  11.600  -4.234
  127    HA   THR  16           HA       THR  16  -9.890  11.576  -4.006
  128    HB   THR  16           HB       THR  16  -8.217  13.375  -5.754
  129    HG1  THR  16           HG1      THR  16  -7.514  14.301  -3.975
  130   HG21  THR  16          1HG2      THR  16 -10.875  13.778  -4.383
  131   HG22  THR  16          2HG2      THR  16 -10.620  13.547  -6.112
  132   HG23  THR  16          3HG2      THR  16 -10.009  14.996  -5.316
  133    H    GLU  17           H        GLU  17  -7.666  11.072  -6.726
  134    HA   GLU  17           HA       GLU  17  -9.684  10.863  -8.709
  135    HB2  GLU  17          1HB       GLU  17  -7.118   9.339  -8.971
  136    HB3  GLU  17          2HB       GLU  17  -8.023  10.207 -10.191
  137    HG2  GLU  17          1HG       GLU  17  -7.349  12.336  -9.138
  138    HG3  GLU  17          2HG       GLU  17  -6.315  11.421  -8.036
  139    H    CYS  18           H        CYS  18  -8.191   8.526  -6.544
  140    HA   CYS  18           HA       CYS  18  -9.474   6.260  -7.707
  141    HB2  CYS  18          1HB       CYS  18  -8.197   6.642  -4.993
  142    HB3  CYS  18          2HB       CYS  18  -8.803   5.098  -5.609
  143    H    VAL  19           H        VAL  19 -10.283   8.526  -5.167
  144    HA   VAL  19           HA       VAL  19 -12.443   7.098  -4.077
  145    HB   VAL  19           HB       VAL  19 -11.577   9.957  -3.953
  146   HG11  VAL  19          1HG1      VAL  19 -13.462  10.495  -2.501
  147   HG12  VAL  19          2HG1      VAL  19 -14.164   8.907  -2.815
  148   HG13  VAL  19          3HG1      VAL  19 -14.005  10.079  -4.129
  149   HG21  VAL  19          1HG2      VAL  19 -12.030   7.796  -1.902
  150   HG22  VAL  19          2HG2      VAL  19 -11.480   9.434  -1.545
  151   HG23  VAL  19          3HG2      VAL  19 -10.475   8.358  -2.515
  152    H    SER  20           H        SER  20 -12.357   9.783  -6.388
  153    HA   SER  20           HA       SER  20 -15.140   9.828  -6.858
  154    HB2  SER  20          1HB       SER  20 -13.608  11.712  -7.301
  155    HB3  SER  20          2HB       SER  20 -12.874  10.800  -8.618
  156    HG   SER  20           HG       SER  20 -15.647  11.134  -8.687
  157    H    SER  21           H        SER  21 -12.685   7.702  -8.014
  158    HA   SER  21           HA       SER  21 -14.170   6.964 -10.403
  159    HB2  SER  21          1HB       SER  21 -11.701   7.146 -10.464
  160    HB3  SER  21          2HB       SER  21 -11.591   5.849  -9.277
  161    HG   SER  21           HG       SER  21 -13.086   5.331 -11.564
  162    H    LEU  22           H        LEU  22 -13.149   5.472  -7.326
  163    HA   LEU  22           HA       LEU  22 -14.489   3.006  -8.051
  164    HB2  LEU  22          1HB       LEU  22 -12.857   3.810  -5.653
  165    HB3  LEU  22          2HB       LEU  22 -13.559   2.205  -5.866
  166    HG   LEU  22           HG       LEU  22 -11.609   3.442  -7.806
  167   HD11  LEU  22          1HD1      LEU  22 -11.126   1.511  -5.543
  168   HD12  LEU  22          2HD1      LEU  22 -10.516   3.161  -5.660
  169   HD13  LEU  22          3HD1      LEU  22  -9.948   1.930  -6.788
  170   HD21  LEU  22          1HD2      LEU  22 -12.547   0.606  -7.426
  171   HD22  LEU  22          2HD2      LEU  22 -11.403   1.179  -8.641
  172   HD23  LEU  22          3HD2      LEU  22 -13.086   1.699  -8.701
  173    H    ASN  23           H        ASN  23 -15.842   5.665  -7.205
  174    HA   ASN  23           HA       ASN  23 -17.696   6.352  -6.073
  175    HB2  ASN  23          1HB       ASN  23 -18.322   3.399  -6.067
  176    HB3  ASN  23          2HB       ASN  23 -19.463   4.680  -5.717
  177   HD21  ASN  23          1HD2      ASN  23 -17.786   2.952  -8.161
  178   HD22  ASN  23          2HD2      ASN  23 -18.569   3.695  -9.518
  179    H    ILE  24           H        ILE  24 -15.416   6.030  -4.462
  180    HA   ILE  24           HA       ILE  24 -16.021   4.610  -2.069
  181    HB   ILE  24           HB       ILE  24 -14.018   6.841  -2.406
  182   HG12  ILE  24          1HG1      ILE  24 -13.680   5.103  -4.143
  183   HG13  ILE  24          2HG1      ILE  24 -12.365   5.129  -2.970
  184   HG21  ILE  24          1HG2      ILE  24 -14.201   4.536  -0.472
  185   HG22  ILE  24          2HG2      ILE  24 -14.428   6.248  -0.109
  186   HG23  ILE  24          3HG2      ILE  24 -12.839   5.652  -0.590
  187   HD11  ILE  24          1HD1      ILE  24 -14.644   3.164  -3.038
  188   HD12  ILE  24          2HD1      ILE  24 -13.331   3.179  -1.859
  189   HD13  ILE  24          3HD1      ILE  24 -12.986   2.861  -3.559
  190    HA   PRO  25           HA       PRO  25 -18.826   7.719  -0.415
  191    HB2  PRO  25          1HB       PRO  25 -18.557   6.152   2.050
  192    HB3  PRO  25          2HB       PRO  25 -19.996   6.513   1.095
  193    HG2  PRO  25          1HG       PRO  25 -18.894   4.060   1.187
  194    HG3  PRO  25          2HG       PRO  25 -19.735   4.687  -0.241
  195    HD2  PRO  25          1HD       PRO  25 -16.801   4.404   0.263
  196    HD3  PRO  25          2HD       PRO  25 -17.722   4.195  -1.249
  197    H    ALA  26           H        ALA  26 -18.631   9.453   0.883
  198    HA   ALA  26           HA       ALA  26 -16.103  10.473   1.459
  199    HB1  ALA  26          1HB       ALA  26 -18.734  11.287   2.671
  200    HB2  ALA  26          2HB       ALA  26 -18.121  11.822   1.107
  201    HB3  ALA  26          3HB       ALA  26 -17.270  12.267   2.588
  202    H    ASP  27           H        ASP  27 -18.349   8.688   3.480
  203    HA   ASP  27           HA       ASP  27 -17.286   9.045   6.006
  204    HB2  ASP  27          1HB       ASP  27 -18.378   6.512   4.765
  205    HB3  ASP  27          2HB       ASP  27 -18.046   6.702   6.483
  206    H    TYR  28           H        TYR  28 -16.308   6.631   3.587
  207    HA   TYR  28           HA       TYR  28 -14.174   5.507   4.964
  208    HB2  TYR  28          1HB       TYR  28 -14.862   5.799   2.066
  209    HB3  TYR  28          2HB       TYR  28 -13.306   5.112   2.519
  210    HD1  TYR  28           HD1      TYR  28 -16.960   4.712   3.172
  211    HD2  TYR  28           HD2      TYR  28 -13.167   2.815   2.864
  212    HE1  TYR  28           HE1      TYR  28 -18.046   2.517   3.378
  213    HE2  TYR  28           HE2      TYR  28 -14.242   0.621   3.078
  214    HH   TYR  28           HH       TYR  28 -16.160  -0.447   3.651
  215    H    VAL  29           H        VAL  29 -14.316   8.343   2.870
  216    HA   VAL  29           HA       VAL  29 -11.566   8.751   2.536
  217    HB   VAL  29           HB       VAL  29 -13.745  10.824   2.497
  218   HG11  VAL  29          1HG1      VAL  29 -12.213  12.002   0.953
  219   HG12  VAL  29          2HG1      VAL  29 -10.988  10.777   1.288
  220   HG13  VAL  29          3HG1      VAL  29 -11.556  11.833   2.579
  221   HG21  VAL  29          1HG2      VAL  29 -14.301   9.016   1.016
  222   HG22  VAL  29          2HG2      VAL  29 -12.676   9.031   0.333
  223   HG23  VAL  29          3HG2      VAL  29 -13.761  10.396   0.060
  224    H    GLU  30           H        GLU  30 -13.821   9.964   4.997
  225    HA   GLU  30           HA       GLU  30 -12.005  11.617   6.395
  226    HB2  GLU  30          1HB       GLU  30 -14.130  10.024   7.798
  227    HB3  GLU  30          2HB       GLU  30 -13.537  11.643   8.141
  228    HG2  GLU  30          1HG       GLU  30 -14.567  12.443   6.077
  229    HG3  GLU  30          2HG       GLU  30 -15.236  10.836   5.812
  230    H    LYS  31           H        LYS  31 -12.664   8.181   6.535
  231    HA   LYS  31           HA       LYS  31 -11.206   7.617   8.885
  232    HB2  LYS  31          1HB       LYS  31 -11.862   5.795   6.566
  233    HB3  LYS  31          2HB       LYS  31 -11.262   5.276   8.135
  234    HG2  LYS  31          1HG       LYS  31 -13.278   6.311   9.167
  235    HG3  LYS  31          2HG       LYS  31 -13.895   6.590   7.537
  236    HD2  LYS  31          1HD       LYS  31 -13.734   4.156   7.099
  237    HD3  LYS  31          2HD       LYS  31 -13.231   3.916   8.784
  238    HE2  LYS  31          1HE       LYS  31 -15.368   4.934   9.523
  239    HE3  LYS  31          2HE       LYS  31 -15.863   5.066   7.836
  240    HZ1  LYS  31          1HZ       LYS  31 -15.779   2.675   7.642
  241    HZ2  LYS  31          2HZ       LYS  31 -16.787   3.110   8.924
  242    HZ3  LYS  31          3HZ       LYS  31 -15.234   2.526   9.237
  243    H    PHE  32           H        PHE  32 -10.323   7.446   5.456
  244    HA   PHE  32           HA       PHE  32  -7.755   6.406   5.762
  245    HB2  PHE  32          1HB       PHE  32  -8.680   8.330   3.628
  246    HB3  PHE  32          2HB       PHE  32  -7.308   7.233   3.525
  247    HD1  PHE  32           HD1      PHE  32  -8.588   4.809   4.744
  248    HD2  PHE  32           HD2      PHE  32  -9.985   7.568   1.826
  249    HE1  PHE  32           HE1      PHE  32 -10.030   3.066   3.793
  250    HE2  PHE  32           HE2      PHE  32 -11.435   5.825   0.869
  251    HZ   PHE  32           HZ       PHE  32 -11.456   3.563   1.850
  252    H    LYS  33           H        LYS  33  -8.930   9.691   6.025
  253    HA   LYS  33           HA       LYS  33  -6.421  10.999   6.107
  254    HB2  LYS  33          1HB       LYS  33  -8.705  12.063   5.751
  255    HB3  LYS  33          2HB       LYS  33  -8.942  11.903   7.490
  256    HG2  LYS  33          1HG       LYS  33  -7.062  13.321   7.942
  257    HG3  LYS  33          2HG       LYS  33  -6.667  13.405   6.220
  258    HD2  LYS  33          1HD       LYS  33  -7.827  15.428   6.983
  259    HD3  LYS  33          2HD       LYS  33  -8.774  14.553   5.781
  260    HE2  LYS  33          1HE       LYS  33 -10.226  15.304   7.551
  261    HE3  LYS  33          2HE       LYS  33 -10.100  13.548   7.610
  262    HZ1  LYS  33          1HZ       LYS  33  -8.420  13.827   9.383
  263    HZ2  LYS  33          2HZ       LYS  33  -9.946  14.415   9.812
  264    HZ3  LYS  33          3HZ       LYS  33  -8.720  15.492   9.376
  265    H    LYS  34           H        LYS  34  -7.990   8.959   8.333
  266    HA   LYS  34           HA       LYS  34  -6.282   9.945  10.514
  267    HB2  LYS  34          1HB       LYS  34  -8.977   8.585  10.603
  268    HB3  LYS  34          2HB       LYS  34  -7.973   8.807  12.032
  269    HG2  LYS  34          1HG       LYS  34  -8.073  11.221  11.731
  270    HG3  LYS  34          2HG       LYS  34  -9.037  11.009  10.271
  271    HD2  LYS  34          1HD       LYS  34  -9.859  10.083  13.018
  272    HD3  LYS  34          2HD       LYS  34 -10.378  11.596  12.277
  273    HE2  LYS  34          1HE       LYS  34 -11.410  10.333  10.444
  274    HE3  LYS  34          2HE       LYS  34 -10.899   8.826  11.202
  275    HZ1  LYS  34          1HZ       LYS  34 -12.768  10.809  12.385
  276    HZ2  LYS  34          2HZ       LYS  34 -12.278   9.364  13.113
  277    HZ3  LYS  34          3HZ       LYS  34 -13.204   9.327  11.700
  278    H    TRP  35           H        TRP  35  -5.668   8.056   8.348
  279    HA   TRP  35           HA       TRP  35  -4.887   5.975   7.884
  280    HB2  TRP  35          1HB       TRP  35  -3.864   6.386  10.692
  281    HB3  TRP  35          2HB       TRP  35  -3.323   5.074   9.637
  282    HD1  TRP  35           HD1      TRP  35  -3.119   8.871  10.056
  283    HE1  TRP  35           HE1      TRP  35  -1.169   9.764   8.635
  284    HE3  TRP  35           HE3      TRP  35  -1.908   4.582   7.539
  285    HZ2  TRP  35           HZ2      TRP  35   0.632   8.790   6.710
  286    HZ3  TRP  35           HZ3      TRP  35  -0.062   4.656   5.919
  287    HH2  TRP  35           HH2      TRP  35   1.186   6.708   5.511
  288    H    GLU  36           H        GLU  36  -7.491   5.742   8.400
  289    HA   GLU  36           HA       GLU  36  -7.697   3.261   9.971
  290    HB2  GLU  36          1HB       GLU  36  -8.965   5.102  10.988
  291    HB3  GLU  36          2HB       GLU  36  -9.819   5.348   9.475
  292    HG2  GLU  36          1HG       GLU  36 -11.262   4.153  10.911
  293    HG3  GLU  36          2HG       GLU  36 -10.693   3.036   9.677
  294    H    PHE  37           H        PHE  37  -7.752   1.635   8.600
  295    HA   PHE  37           HA       PHE  37  -9.141   1.997   6.025
  296    HB2  PHE  37          1HB       PHE  37  -6.865   0.094   6.644
  297    HB3  PHE  37          2HB       PHE  37  -7.582   0.379   5.062
  298    HD1  PHE  37           HD1      PHE  37  -5.491   1.819   7.719
  299    HD2  PHE  37           HD2      PHE  37  -6.971   2.296   3.756
  300    HE1  PHE  37           HE1      PHE  37  -3.868   3.629   7.332
  301    HE2  PHE  37           HE2      PHE  37  -5.358   4.107   3.370
  302    HZ   PHE  37           HZ       PHE  37  -3.804   4.778   5.154
  303    HA   PRO  38           HA       PRO  38 -11.858  -1.103   8.046
  304    HB2  PRO  38          1HB       PRO  38 -13.357  -0.430   5.571
  305    HB3  PRO  38          2HB       PRO  38 -13.925  -0.567   7.246
  306    HG2  PRO  38          1HG       PRO  38 -13.638   1.826   6.149
  307    HG3  PRO  38          2HG       PRO  38 -13.128   1.540   7.823
  308    HD2  PRO  38          1HD       PRO  38 -11.438   1.702   5.344
  309    HD3  PRO  38          2HD       PRO  38 -11.140   2.395   6.967
  310    H    GLU  39           H        GLU  39 -12.063  -3.208   7.625
  311    HA   GLU  39           HA       GLU  39 -10.565  -4.220   5.364
  312    HB2  GLU  39          1HB       GLU  39 -10.175  -5.020   7.693
  313    HB3  GLU  39          2HB       GLU  39 -11.772  -5.749   7.666
  314    HG2  GLU  39          1HG       GLU  39 -11.115  -7.231   5.892
  315    HG3  GLU  39          2HG       GLU  39  -9.553  -6.426   5.753
  316    H    ASP  40           H        ASP  40 -12.125  -3.608   3.802
  317    HA   ASP  40           HA       ASP  40 -13.967  -5.744   3.219
  318    HB2  ASP  40          1HB       ASP  40 -15.983  -4.544   3.168
  319    HB3  ASP  40          2HB       ASP  40 -15.223  -3.977   4.646
  320    H    ASP  41           H        ASP  41 -14.889  -5.457   0.969
  321    HA   ASP  41           HA       ASP  41 -12.771  -5.239  -0.773
  322    HB2  ASP  41          1HB       ASP  41 -15.719  -5.065  -1.380
  323    HB3  ASP  41          2HB       ASP  41 -14.472  -5.171  -2.617
  324    H    THR  42           H        THR  42 -15.041  -2.675   0.105
  325    HA   THR  42           HA       THR  42 -14.544  -0.879  -1.970
  326    HB   THR  42           HB       THR  42 -15.077  -0.168   0.914
  327    HG1  THR  42           HG1      THR  42 -16.783  -1.386   0.448
  328   HG21  THR  42          1HG2      THR  42 -15.597   1.298  -1.669
  329   HG22  THR  42          2HG2      THR  42 -14.449   1.755  -0.409
  330   HG23  THR  42          3HG2      THR  42 -16.181   1.809  -0.084
  331    H    THR  43           H        THR  43 -13.068  -0.796   1.282
  332    HA   THR  43           HA       THR  43 -11.103   1.102   0.747
  333    HB   THR  43           HB       THR  43 -10.899  -1.218   2.671
  334    HG1  THR  43           HG1      THR  43 -11.838   0.279   4.156
  335   HG21  THR  43          1HG2      THR  43  -9.477   0.400   3.960
  336   HG22  THR  43          2HG2      THR  43  -9.512   1.462   2.550
  337   HG23  THR  43          3HG2      THR  43  -8.770  -0.131   2.433
  338    H    MET  44           H        MET  44 -11.183  -2.340   0.120
  339    HA   MET  44           HA       MET  44  -8.401  -2.717  -0.159
  340    HB2  MET  44          1HB       MET  44 -10.676  -4.342  -1.280
  341    HB3  MET  44          2HB       MET  44  -8.999  -4.865  -1.215
  342    HG2  MET  44          1HG       MET  44  -9.060  -4.736   1.224
  343    HG3  MET  44          2HG       MET  44 -10.738  -4.210   1.151
  344    HE1  MET  44          1HE       MET  44  -9.716  -6.687   2.901
  345    HE2  MET  44          2HE       MET  44 -11.055  -7.797   2.607
  346    HE3  MET  44          3HE       MET  44 -11.370  -6.074   2.843
  347    H    CYS  45           H        CYS  45 -10.962  -2.246  -2.594
  348    HA   CYS  45           HA       CYS  45  -9.156  -2.256  -4.788
  349    HB2  CYS  45          1HB       CYS  45 -11.950  -1.113  -4.557
  350    HB3  CYS  45          2HB       CYS  45 -11.035  -1.184  -6.056
  351    H    TYR  46           H        TYR  46 -10.292   0.199  -2.588
  352    HA   TYR  46           HA       TYR  46  -9.395   2.474  -3.924
  353    HB2  TYR  46          1HB       TYR  46 -10.768   2.831  -2.060
  354    HB3  TYR  46          2HB       TYR  46  -9.796   1.783  -1.029
  355    HD1  TYR  46           HD1      TYR  46  -8.270   2.728   0.434
  356    HD2  TYR  46           HD2      TYR  46  -9.606   5.006  -2.909
  357    HE1  TYR  46           HE1      TYR  46  -7.080   4.691   1.304
  358    HE2  TYR  46           HE2      TYR  46  -8.416   6.974  -2.043
  359    HH   TYR  46           HH       TYR  46  -6.355   6.779   0.818
  360    H    ILE  47           H        ILE  47  -7.766   0.442  -1.509
  361    HA   ILE  47           HA       ILE  47  -5.293   1.723  -1.528
  362    HB   ILE  47           HB       ILE  47  -6.012  -1.142  -0.954
  363   HG12  ILE  47          1HG1      ILE  47  -6.929   0.478   0.618
  364   HG13  ILE  47          2HG1      ILE  47  -5.651  -0.447   1.401
  365   HG21  ILE  47          1HG2      ILE  47  -3.344   0.216  -0.591
  366   HG22  ILE  47          2HG2      ILE  47  -3.703  -1.157  -1.640
  367   HG23  ILE  47          3HG2      ILE  47  -3.781  -1.341   0.112
  368   HD11  ILE  47          1HD1      ILE  47  -5.377   1.795   2.073
  369   HD12  ILE  47          2HD1      ILE  47  -5.558   2.394   0.427
  370   HD13  ILE  47          3HD1      ILE  47  -4.111   1.492   0.883
  371    H    LYS  48           H        LYS  48  -6.572  -0.846  -3.582
  372    HA   LYS  48           HA       LYS  48  -4.207  -1.518  -4.907
  373    HB2  LYS  48          1HB       LYS  48  -6.448  -2.722  -4.983
  374    HB3  LYS  48          2HB       LYS  48  -6.945  -1.530  -6.175
  375    HG2  LYS  48          1HG       LYS  48  -4.677  -2.295  -7.320
  376    HG3  LYS  48          2HG       LYS  48  -5.010  -3.760  -6.398
  377    HD2  LYS  48          1HD       LYS  48  -5.970  -4.046  -8.556
  378    HD3  LYS  48          2HD       LYS  48  -7.297  -3.778  -7.425
  379    HE2  LYS  48          1HE       LYS  48  -7.589  -1.542  -8.159
  380    HE3  LYS  48          2HE       LYS  48  -6.068  -1.565  -9.051
  381    HZ1  LYS  48          1HZ       LYS  48  -7.019  -3.214 -10.547
  382    HZ2  LYS  48          2HZ       LYS  48  -7.938  -1.789 -10.539
  383    HZ3  LYS  48          3HZ       LYS  48  -8.491  -3.152  -9.704
  384    H    CYS  49           H        CYS  49  -6.803   0.723  -5.845
  385    HA   CYS  49           HA       CYS  49  -5.663   1.688  -8.186
  386    HB2  CYS  49          1HB       CYS  49  -7.938   2.142  -7.777
  387    HB3  CYS  49          2HB       CYS  49  -7.602   2.956  -6.251
  388    H    VAL  50           H        VAL  50  -5.397   2.996  -4.871
  389    HA   VAL  50           HA       VAL  50  -3.929   5.275  -5.537
  390    HB   VAL  50           HB       VAL  50  -4.139   3.731  -2.962
  391   HG11  VAL  50          1HG1      VAL  50  -3.203   5.717  -1.856
  392   HG12  VAL  50          2HG1      VAL  50  -2.855   6.421  -3.436
  393   HG13  VAL  50          3HG1      VAL  50  -2.035   4.942  -2.928
  394   HG21  VAL  50          1HG2      VAL  50  -5.395   6.276  -3.947
  395   HG22  VAL  50          2HG2      VAL  50  -5.557   5.642  -2.310
  396   HG23  VAL  50          3HG2      VAL  50  -6.198   4.730  -3.679
  397    H    PHE  51           H        PHE  51  -2.911   2.056  -4.521
  398    HA   PHE  51           HA       PHE  51  -0.156   2.597  -4.405
  399    HB2  PHE  51          1HB       PHE  51  -1.863   0.163  -4.474
  400    HB3  PHE  51          2HB       PHE  51  -0.156  -0.041  -4.862
  401    HD1  PHE  51           HD1      PHE  51  -1.395   2.481  -2.485
  402    HD2  PHE  51           HD2      PHE  51   0.333  -1.384  -2.947
  403    HE1  PHE  51           HE1      PHE  51  -0.908   2.413  -0.077
  404    HE2  PHE  51           HE2      PHE  51   0.821  -1.454  -0.537
  405    HZ   PHE  51           HZ       PHE  51   0.202   0.446   0.900
  406    H    ASN  52           H        ASN  52  -2.317   1.824  -7.006
  407    HA   ASN  52           HA       ASN  52  -0.233   1.290  -8.921
  408    HB2  ASN  52          1HB       ASN  52  -2.418   0.274  -9.241
  409    HB3  ASN  52          2HB       ASN  52  -3.188   1.866  -9.270
  410   HD21  ASN  52          1HD2      ASN  52  -0.981  -0.267 -10.971
  411   HD22  ASN  52          2HD2      ASN  52  -1.204   0.449 -12.532
  412    H    LYS  53           H        LYS  53  -2.169   3.991  -7.897
  413    HA   LYS  53           HA       LYS  53  -1.578   5.839  -9.914
  414    HB2  LYS  53          1HB       LYS  53  -2.343   6.086  -7.025
  415    HB3  LYS  53          2HB       LYS  53  -2.014   7.521  -7.985
  416    HG2  LYS  53          1HG       LYS  53  -4.083   5.446  -8.697
  417    HG3  LYS  53          2HG       LYS  53  -4.428   6.894  -7.756
  418    HD2  LYS  53          1HD       LYS  53  -3.700   8.283  -9.640
  419    HD3  LYS  53          2HD       LYS  53  -3.357   6.826 -10.578
  420    HE2  LYS  53          1HE       LYS  53  -5.675   6.195 -10.547
  421    HE3  LYS  53          2HE       LYS  53  -6.063   7.511  -9.439
  422    HZ1  LYS  53          1HZ       LYS  53  -5.414   9.088 -11.166
  423    HZ2  LYS  53          2HZ       LYS  53  -6.681   8.087 -11.681
  424    HZ3  LYS  53          3HZ       LYS  53  -5.109   7.807 -12.233
  425    H    MET  54           H        MET  54   0.112   4.924  -6.976
  426    HA   MET  54           HA       MET  54   2.098   7.002  -7.279
  427    HB2  MET  54          1HB       MET  54   1.748   4.764  -5.289
  428    HB3  MET  54          2HB       MET  54   3.139   5.847  -5.281
  429    HG2  MET  54          1HG       MET  54   1.713   7.741  -4.898
  430    HG3  MET  54          2HG       MET  54   0.276   6.734  -5.051
  431    HE1  MET  54          1HE       MET  54   3.706   6.017  -3.004
  432    HE2  MET  54          2HE       MET  54   3.212   6.831  -1.519
  433    HE3  MET  54          3HE       MET  54   3.332   7.739  -3.024
  434    H    GLN  55           H        GLN  55   1.597   4.289  -8.902
  435    HA   GLN  55           HA       GLN  55   2.775   2.800 -10.083
  436    HB2  GLN  55          1HB       GLN  55   4.825   4.948  -9.698
  437    HB3  GLN  55          2HB       GLN  55   5.224   3.468 -10.585
  438    HG2  GLN  55          1HG       GLN  55   3.532   3.925 -12.195
  439    HG3  GLN  55          2HG       GLN  55   2.911   5.261 -11.236
  440   HE21  GLN  55          1HE2      GLN  55   3.159   6.729 -12.891
  441   HE22  GLN  55          2HE2      GLN  55   4.707   7.305 -13.405
  442    H    LEU  56           H        LEU  56   2.356   1.816  -7.754
  443    HA   LEU  56           HA       LEU  56   4.924   0.874  -6.733
  444    HB2  LEU  56          1HB       LEU  56   2.706   2.225  -5.368
  445    HB3  LEU  56          2HB       LEU  56   3.319   0.806  -4.508
  446    HG   LEU  56           HG       LEU  56   4.949   3.181  -5.413
  447   HD11  LEU  56          1HD1      LEU  56   5.044   3.766  -3.045
  448   HD12  LEU  56          2HD1      LEU  56   3.971   2.420  -2.666
  449   HD13  LEU  56          3HD1      LEU  56   3.382   3.769  -3.633
  450   HD21  LEU  56          1HD2      LEU  56   6.313   1.210  -5.327
  451   HD22  LEU  56          2HD2      LEU  56   5.638   0.764  -3.762
  452   HD23  LEU  56          3HD2      LEU  56   6.659   2.196  -3.907
  453    H    PHE  57           H        PHE  57   1.750   0.124  -7.766
  454    HA   PHE  57           HA       PHE  57   2.247  -2.717  -7.316
  455    HB2  PHE  57          1HB       PHE  57   0.843  -2.136  -5.421
  456    HB3  PHE  57          2HB       PHE  57  -0.280  -1.276  -6.463
  457    HD1  PHE  57           HD1      PHE  57  -1.963  -2.438  -7.703
  458    HD2  PHE  57           HD2      PHE  57   0.922  -4.593  -5.431
  459    HE1  PHE  57           HE1      PHE  57  -3.306  -4.483  -7.941
  460    HE2  PHE  57           HE2      PHE  57  -0.420  -6.639  -5.667
  461    HZ   PHE  57           HZ       PHE  57  -2.534  -6.585  -6.922
  462    H    ASP  58           H        ASP  58   1.544  -3.976  -8.950
  463    HA   ASP  58           HA       ASP  58   0.044  -2.664 -11.125
  464    HB2  ASP  58          1HB       ASP  58   2.362  -3.050 -11.802
  465    HB3  ASP  58          2HB       ASP  58   2.248  -4.736 -11.318
  466    H    ASP  59           H        ASP  59  -1.668  -3.760 -11.969
  467    HA   ASP  59           HA       ASP  59  -2.999  -5.613 -10.330
  468    HB2  ASP  59          1HB       ASP  59  -3.469  -4.839 -13.206
  469    HB3  ASP  59          2HB       ASP  59  -4.530  -5.903 -12.313
  470    H    THR  60           H        THR  60  -0.659  -6.091 -12.795
  471    HA   THR  60           HA       THR  60  -1.328  -8.922 -13.038
  472    HB   THR  60           HB       THR  60   0.593  -7.173 -14.562
  473    HG1  THR  60           HG1      THR  60  -2.013  -8.091 -14.942
  474   HG21  THR  60          1HG2      THR  60   0.969  -9.095 -16.026
  475   HG22  THR  60          2HG2      THR  60  -0.024 -10.099 -14.970
  476   HG23  THR  60          3HG2      THR  60   1.499  -9.434 -14.379
  477    H    GLU  61           H        GLU  61   1.707  -7.047 -12.677
  478    HA   GLU  61           HA       GLU  61   3.132  -9.359 -11.777
  479    HB2  GLU  61          1HB       GLU  61   4.143  -6.538 -11.613
  480    HB3  GLU  61          2HB       GLU  61   5.046  -8.027 -11.847
  481    HG2  GLU  61          1HG       GLU  61   4.029  -8.289 -14.054
  482    HG3  GLU  61          2HG       GLU  61   3.183  -6.763 -13.827
  483    H    GLY  62           H        GLY  62   1.159  -7.202 -10.104
  484    HA2  GLY  62          1HA       GLY  62   0.658  -7.250  -7.833
  485    HA3  GLY  62          2HA       GLY  62   2.023  -8.347  -7.597
  486    HA   PRO  63           HA       PRO  63   3.246  -4.423  -5.486
  487    HB2  PRO  63          1HB       PRO  63   4.964  -6.411  -4.099
  488    HB3  PRO  63          2HB       PRO  63   3.924  -5.151  -3.420
  489    HG2  PRO  63          1HG       PRO  63   3.242  -7.737  -3.290
  490    HG3  PRO  63          2HG       PRO  63   2.031  -6.463  -3.528
  491    HD2  PRO  63          1HD       PRO  63   3.210  -8.362  -5.527
  492    HD3  PRO  63          2HD       PRO  63   1.538  -7.752  -5.391
  493    H    LEU  64           H        LEU  64   4.697  -3.240  -6.542
  494    HA   LEU  64           HA       LEU  64   6.841  -4.501  -8.031
  495    HB2  LEU  64          1HB       LEU  64   6.284  -1.547  -7.722
  496    HB3  LEU  64          2HB       LEU  64   7.275  -2.320  -8.943
  497    HG   LEU  64           HG       LEU  64   4.292  -2.683  -8.697
  498   HD11  LEU  64          1HD1      LEU  64   4.163  -1.321 -10.726
  499   HD12  LEU  64          2HD1      LEU  64   5.900  -1.034 -10.641
  500   HD13  LEU  64          3HD1      LEU  64   4.840  -0.411  -9.377
  501   HD21  LEU  64          1HD2      LEU  64   4.456  -3.799 -10.830
  502   HD22  LEU  64          2HD2      LEU  64   5.496  -4.601  -9.648
  503   HD23  LEU  64          3HD2      LEU  64   6.202  -3.534 -10.862
  504    H    VAL  65           H        VAL  65   8.216  -5.308  -6.565
  505    HA   VAL  65           HA       VAL  65   9.005  -4.365  -4.133
  506    HB   VAL  65           HB       VAL  65  10.617  -5.953  -6.114
  507   HG11  VAL  65          1HG1      VAL  65  11.106  -5.545  -3.164
  508   HG12  VAL  65          2HG1      VAL  65  12.116  -4.946  -4.483
  509   HG13  VAL  65          3HG1      VAL  65  11.969  -6.681  -4.203
  510   HG21  VAL  65          1HG2      VAL  65   9.909  -7.849  -4.676
  511   HG22  VAL  65          2HG2      VAL  65   8.578  -7.050  -5.511
  512   HG23  VAL  65          3HG2      VAL  65   8.862  -6.732  -3.800
  513    H    ASP  66           H        ASP  66  10.511  -3.613  -7.265
  514    HA   ASP  66           HA       ASP  66  12.765  -2.279  -6.294
  515    HB2  ASP  66          1HB       ASP  66  12.571  -2.952  -8.611
  516    HB3  ASP  66          2HB       ASP  66  11.243  -1.827  -8.864
  517    H    ASN  67           H        ASN  67   9.691  -0.857  -7.417
  518    HA   ASN  67           HA       ASN  67  10.359   1.776  -6.652
  519    HB2  ASN  67          1HB       ASN  67   7.683   0.491  -7.183
  520    HB3  ASN  67          2HB       ASN  67   7.896   2.207  -6.874
  521   HD21  ASN  67          1HD2      ASN  67   7.235   2.930  -8.808
  522   HD22  ASN  67          2HD2      ASN  67   8.053   2.622 -10.303
  523    H    LEU  68           H        LEU  68   8.837  -0.900  -5.033
  524    HA   LEU  68           HA       LEU  68   7.727   0.421  -2.846
  525    HB2  LEU  68          1HB       LEU  68   8.648  -2.368  -3.350
  526    HB3  LEU  68          2HB       LEU  68   8.214  -1.891  -1.718
  527    HG   LEU  68           HG       LEU  68   6.353  -1.485  -4.043
  528   HD11  LEU  68          1HD1      LEU  68   6.949  -3.874  -3.844
  529   HD12  LEU  68          2HD1      LEU  68   5.261  -3.549  -3.456
  530   HD13  LEU  68          3HD1      LEU  68   6.425  -3.839  -2.161
  531   HD21  LEU  68          1HD2      LEU  68   4.666  -1.391  -2.301
  532   HD22  LEU  68          2HD2      LEU  68   5.923  -0.190  -2.011
  533   HD23  LEU  68          3HD2      LEU  68   5.898  -1.682  -1.072
  534    H    VAL  69           H        VAL  69  10.909  -1.138  -3.133
  535    HA   VAL  69           HA       VAL  69  11.832  -0.291  -0.587
  536    HB   VAL  69           HB       VAL  69  13.412  -1.083  -3.024
  537   HG11  VAL  69          1HG1      VAL  69  14.835   0.081  -1.492
  538   HG12  VAL  69          2HG1      VAL  69  15.165  -1.644  -1.335
  539   HG13  VAL  69          3HG1      VAL  69  14.180  -0.819  -0.126
  540   HG21  VAL  69          1HG2      VAL  69  12.564  -2.741  -0.659
  541   HG22  VAL  69          2HG2      VAL  69  13.483  -3.293  -2.062
  542   HG23  VAL  69          3HG2      VAL  69  11.805  -2.788  -2.250
  543    H    HIS  70           H        HIS  70  12.035   1.045  -3.835
  544    HA   HIS  70           HA       HIS  70  13.893   3.073  -3.327
  545    HB2  HIS  70          1HB       HIS  70  13.140   2.302  -5.577
  546    HB3  HIS  70          2HB       HIS  70  11.611   3.128  -5.307
  547    HD1  HIS  70           HD1      HIS  70  11.542   5.292  -6.480
  548    HD2  HIS  70           HD2      HIS  70  15.380   4.363  -5.178
  549    HE1  HIS  70           HE1      HIS  70  13.000   7.194  -7.248
  550    HE2  HIS  70           HE2      HIS  70  15.318   6.614  -6.447
  551    H    GLN  71           H        GLN  71  10.437   2.914  -2.753
  552    HA   GLN  71           HA       GLN  71  10.320   5.735  -2.029
  553    HB2  GLN  71          1HB       GLN  71   8.466   4.435  -3.272
  554    HB3  GLN  71          2HB       GLN  71   8.084   3.758  -1.689
  555    HG2  GLN  71          1HG       GLN  71   6.652   5.641  -2.124
  556    HG3  GLN  71          2HG       GLN  71   7.756   6.012  -0.802
  557   HE21  GLN  71          1HE2      GLN  71   7.678   8.218  -1.039
  558   HE22  GLN  71          2HE2      GLN  71   8.345   9.038  -2.404
  559    H    LEU  72           H        LEU  72   9.562   2.633  -0.464
  560    HA   LEU  72           HA       LEU  72   8.997   3.693   2.043
  561    HB2  LEU  72          1HB       LEU  72   9.877   0.932   1.244
  562    HB3  LEU  72          2HB       LEU  72   9.417   1.347   2.881
  563    HG   LEU  72           HG       LEU  72   7.607   1.624   0.482
  564   HD11  LEU  72          1HD1      LEU  72   8.140  -0.723   0.925
  565   HD12  LEU  72          2HD1      LEU  72   6.467  -0.361   1.357
  566   HD13  LEU  72          3HD1      LEU  72   7.693  -0.509   2.617
  567   HD21  LEU  72          1HD2      LEU  72   7.151   1.926   3.443
  568   HD22  LEU  72          2HD2      LEU  72   5.850   1.748   2.266
  569   HD23  LEU  72          3HD2      LEU  72   6.925   3.144   2.185
  570    H    ALA  73           H        ALA  73  12.064   2.409   0.793
  571    HA   ALA  73           HA       ALA  73  13.449   2.704   3.277
  572    HB1  ALA  73          1HB       ALA  73  14.604   2.402   0.521
  573    HB2  ALA  73          2HB       ALA  73  14.061   1.067   1.537
  574    HB3  ALA  73          3HB       ALA  73  15.413   2.081   2.055
  575    H    HIS  74           H        HIS  74  12.117   5.068   2.484
  576    HA   HIS  74           HA       HIS  74  13.857   7.023   1.408
  577    HB2  HIS  74          1HB       HIS  74  11.369   7.208   1.510
  578    HB3  HIS  74          2HB       HIS  74  11.492   7.404   3.253
  579    HD1  HIS  74           HD1      HIS  74  12.390   9.173   0.038
  580    HD2  HIS  74           HD2      HIS  74  11.957   9.984   4.096
  581    HE1  HIS  74           HE1      HIS  74  12.455  11.676   0.240
  582    HE2  HIS  74           HE2      HIS  74  11.955  12.132   2.664
  583    H    GLY  75           H        GLY  75  15.837   6.712   2.517
  584    HA2  GLY  75          1HA       GLY  75  17.348   7.680   4.006
  585    HA3  GLY  75          2HA       GLY  75  16.001   8.228   4.990
  586    H    ARG  76           H        ARG  76  16.323   4.899   3.939
  587    HA   ARG  76           HA       ARG  76  17.447   4.087   6.484
  588    HB2  ARG  76          1HB       ARG  76  14.595   3.755   5.803
  589    HB3  ARG  76          2HB       ARG  76  15.384   2.335   6.487
  590    HG2  ARG  76          1HG       ARG  76  16.147   3.761   8.379
  591    HG3  ARG  76          2HG       ARG  76  15.178   5.079   7.723
  592    HD2  ARG  76          1HD       ARG  76  13.978   3.935   9.491
  593    HD3  ARG  76          2HD       ARG  76  13.170   3.704   7.946
  594    HE   ARG  76           HE       ARG  76  14.916   1.548   8.412
  595   HH11  ARG  76          1HH1      ARG  76  11.905   2.887   9.598
  596   HH12  ARG  76          2HH1      ARG  76  11.285   1.355  10.126
  597   HH21  ARG  76          1HH2      ARG  76  14.100  -0.485   9.115
  598   HH22  ARG  76          2HH2      ARG  76  12.528  -0.550   9.861
  599    H    ASP  77           H        ASP  77  17.716   1.679   6.590
  600    HA   ASP  77           HA       ASP  77  19.273   0.775   4.478
  601    HB2  ASP  77          1HB       ASP  77  17.878  -0.849   6.609
  602    HB3  ASP  77          2HB       ASP  77  19.165  -1.442   5.570
  603    H    ALA  78           H        ALA  78  18.644   0.376   2.507
  604    HA   ALA  78           HA       ALA  78  15.998  -0.151   1.713
  605    HB1  ALA  78          1HB       ALA  78  16.922  -0.486  -0.495
  606    HB2  ALA  78          2HB       ALA  78  18.544  -0.633   0.184
  607    HB3  ALA  78          3HB       ALA  78  17.682   0.902   0.282
  608    H    GLU  79           H        GLU  79  18.728  -2.285   2.363
  609    HA   GLU  79           HA       GLU  79  17.640  -4.617   1.223
  610    HB2  GLU  79          1HB       GLU  79  19.673  -4.232   3.410
  611    HB3  GLU  79          2HB       GLU  79  19.213  -5.819   2.810
  612    HG2  GLU  79          1HG       GLU  79  19.875  -5.054   0.527
  613    HG3  GLU  79          2HG       GLU  79  20.523  -3.595   1.272
  614    H    GLU  80           H        GLU  80  17.542  -3.405   4.564
  615    HA   GLU  80           HA       GLU  80  15.968  -5.434   5.671
  616    HB2  GLU  80          1HB       GLU  80  17.034  -3.835   7.101
  617    HB3  GLU  80          2HB       GLU  80  16.188  -2.502   6.331
  618    HG2  GLU  80          1HG       GLU  80  14.098  -3.238   7.250
  619    HG3  GLU  80          2HG       GLU  80  14.856  -4.674   7.916
  620    H    VAL  81           H        VAL  81  15.060  -2.401   4.110
  621    HA   VAL  81           HA       VAL  81  12.299  -2.576   4.400
  622    HB   VAL  81           HB       VAL  81  13.938  -1.256   2.247
  623   HG11  VAL  81          1HG1      VAL  81  11.666  -1.576   1.438
  624   HG12  VAL  81          2HG1      VAL  81  11.947   0.122   1.829
  625   HG13  VAL  81          3HG1      VAL  81  11.024  -0.899   2.934
  626   HG21  VAL  81          1HG2      VAL  81  13.403   0.760   3.599
  627   HG22  VAL  81          2HG2      VAL  81  14.454  -0.405   4.392
  628   HG23  VAL  81          3HG2      VAL  81  12.747  -0.312   4.835
  629    H    ARG  82           H        ARG  82  14.342  -3.630   1.664
  630    HA   ARG  82           HA       ARG  82  12.379  -4.718   0.030
  631    HB2  ARG  82          1HB       ARG  82  14.776  -4.394  -0.552
  632    HB3  ARG  82          2HB       ARG  82  15.167  -5.788   0.446
  633    HG2  ARG  82          1HG       ARG  82  13.821  -7.210  -0.979
  634    HG3  ARG  82          2HG       ARG  82  13.381  -5.819  -1.968
  635    HD2  ARG  82          1HD       ARG  82  15.673  -5.507  -2.628
  636    HD3  ARG  82          2HD       ARG  82  16.198  -6.783  -1.533
  637    HE   ARG  82           HE       ARG  82  14.353  -7.912  -3.278
  638   HH11  ARG  82          1HH1      ARG  82  17.509  -6.403  -3.456
  639   HH12  ARG  82          2HH1      ARG  82  18.032  -7.367  -4.801
  640   HH21  ARG  82          1HH2      ARG  82  15.038  -9.170  -5.055
  641   HH22  ARG  82          2HH2      ARG  82  16.620  -8.920  -5.727
  642    H    THR  83           H        THR  83  14.185  -6.195   2.683
  643    HA   THR  83           HA       THR  83  13.194  -8.801   2.434
  644    HB   THR  83           HB       THR  83  14.327  -7.229   4.736
  645    HG1  THR  83           HG1      THR  83  15.965  -8.980   4.368
  646   HG21  THR  83          1HG2      THR  83  13.518 -10.139   4.794
  647   HG22  THR  83          2HG2      THR  83  12.784  -8.837   5.734
  648   HG23  THR  83          3HG2      THR  83  14.457  -9.308   6.034
  649    H    GLU  84           H        GLU  84  12.144  -6.182   4.624
  650    HA   GLU  84           HA       GLU  84   9.968  -7.443   5.777
  651    HB2  GLU  84          1HB       GLU  84  10.386  -4.527   5.171
  652    HB3  GLU  84          2HB       GLU  84   9.075  -5.142   6.166
  653    HG2  GLU  84          1HG       GLU  84  11.990  -5.563   6.725
  654    HG3  GLU  84          2HG       GLU  84  11.004  -4.302   7.459
  655    H    VAL  85           H        VAL  85  10.067  -5.515   2.786
  656    HA   VAL  85           HA       VAL  85   7.364  -5.611   2.128
  657    HB   VAL  85           HB       VAL  85   9.832  -5.514   0.398
  658   HG11  VAL  85          1HG1      VAL  85   6.957  -5.332  -0.494
  659   HG12  VAL  85          2HG1      VAL  85   8.105  -6.605  -0.913
  660   HG13  VAL  85          3HG1      VAL  85   8.360  -4.959  -1.498
  661   HG21  VAL  85          1HG2      VAL  85   9.084  -3.199   0.022
  662   HG22  VAL  85          2HG2      VAL  85   9.402  -3.544   1.722
  663   HG23  VAL  85          3HG2      VAL  85   7.739  -3.473   1.130
  664    H    LEU  86           H        LEU  86   9.966  -7.862   1.219
  665    HA   LEU  86           HA       LEU  86   8.408  -9.572  -0.351
  666    HB2  LEU  86          1HB       LEU  86  10.956 -10.067   1.188
  667    HB3  LEU  86          2HB       LEU  86  10.251 -11.216   0.053
  668    HG   LEU  86           HG       LEU  86  11.050  -8.422  -0.718
  669   HD11  LEU  86          1HD1      LEU  86  13.073  -9.407  -1.648
  670   HD12  LEU  86          2HD1      LEU  86  12.613 -10.983  -1.005
  671   HD13  LEU  86          3HD1      LEU  86  12.996  -9.659   0.097
  672   HD21  LEU  86          1HD2      LEU  86  10.972  -9.366  -2.979
  673   HD22  LEU  86          2HD2      LEU  86   9.413  -9.464  -2.166
  674   HD23  LEU  86          3HD2      LEU  86  10.424 -10.901  -2.306
  675    H    LYS  87           H        LYS  87   8.933  -9.410   3.087
  676    HA   LYS  87           HA       LYS  87   7.844 -11.990   3.701
  677    HB2  LYS  87          1HB       LYS  87   8.430  -9.545   5.369
  678    HB3  LYS  87          2HB       LYS  87   7.731 -11.005   6.048
  679    HG2  LYS  87          1HG       LYS  87   9.658 -12.272   5.607
  680    HG3  LYS  87          2HG       LYS  87  10.313 -11.039   4.514
  681    HD2  LYS  87          1HD       LYS  87  11.434 -11.112   6.732
  682    HD3  LYS  87          2HD       LYS  87  10.714  -9.549   6.358
  683    HE2  LYS  87          1HE       LYS  87   8.750 -10.180   7.733
  684    HE3  LYS  87          2HE       LYS  87   9.578 -11.675   8.168
  685    HZ1  LYS  87          1HZ       LYS  87  11.298 -10.425   9.237
  686    HZ2  LYS  87          2HZ       LYS  87   9.810  -9.888   9.838
  687    HZ3  LYS  87          3HZ       LYS  87  10.649  -8.955   8.700
  688    H    CYS  88           H        CYS  88   6.459  -9.233   2.546
  689    HA   CYS  88           HA       CYS  88   3.854  -9.929   3.712
  690    HB2  CYS  88          1HB       CYS  88   5.058  -7.286   2.999
  691    HB3  CYS  88          2HB       CYS  88   3.303  -7.475   3.010
  692    H    VAL  89           H        VAL  89   5.706  -9.916   0.907
  693    HA   VAL  89           HA       VAL  89   3.650  -9.421  -1.018
  694    HB   VAL  89           HB       VAL  89   6.356 -10.733  -1.292
  695   HG11  VAL  89          1HG1      VAL  89   6.050 -10.450  -3.717
  696   HG12  VAL  89          2HG1      VAL  89   4.395  -9.910  -3.429
  697   HG13  VAL  89          3HG1      VAL  89   4.868 -11.561  -3.026
  698   HG21  VAL  89          1HG2      VAL  89   6.494  -8.387  -0.734
  699   HG22  VAL  89          2HG2      VAL  89   5.359  -7.983  -2.024
  700   HG23  VAL  89          3HG2      VAL  89   6.954  -8.626  -2.419
  701    H    ASP  90           H        ASP  90   2.076 -10.738  -1.558
  702    HA   ASP  90           HA       ASP  90   2.413 -13.634  -1.162
  703    HB2  ASP  90          1HB       ASP  90  -0.086 -11.945  -1.113
  704    HB3  ASP  90          2HB       ASP  90  -0.125 -13.706  -1.214
  705    H    LYS  91           H        LYS  91   0.787 -14.848  -2.631
  706    HA   LYS  91           HA       LYS  91   1.106 -13.907  -5.401
  707    HB2  LYS  91          1HB       LYS  91   0.173 -16.627  -4.474
  708    HB3  LYS  91          2HB       LYS  91   0.724 -16.157  -6.077
  709    HG2  LYS  91          1HG       LYS  91   2.964 -15.924  -5.324
  710    HG3  LYS  91          2HG       LYS  91   2.475 -16.175  -3.649
  711    HD2  LYS  91          1HD       LYS  91   3.491 -18.188  -4.662
  712    HD3  LYS  91          2HD       LYS  91   1.830 -18.451  -4.133
  713    HE2  LYS  91          1HE       LYS  91   2.211 -19.476  -6.303
  714    HE3  LYS  91          2HE       LYS  91   1.054 -18.157  -6.438
  715    HZ1  LYS  91          1HZ       LYS  91   2.849 -16.740  -7.255
  716    HZ2  LYS  91          2HZ       LYS  91   2.634 -18.094  -8.241
  717    HZ3  LYS  91          3HZ       LYS  91   3.930 -18.035  -7.159
  718    H    ASN  92           H        ASN  92  -0.713 -14.035  -6.832
  719    HA   ASN  92           HA       ASN  92  -3.134 -13.123  -5.560
  720    HB2  ASN  92          1HB       ASN  92  -2.281 -12.156  -7.702
  721    HB3  ASN  92          2HB       ASN  92  -2.657 -13.685  -8.485
  722   HD21  ASN  92          1HD2      ASN  92  -4.078 -12.581  -9.875
  723   HD22  ASN  92          2HD2      ASN  92  -5.653 -12.088  -9.354
  724    H    THR  93           H        THR  93  -3.275 -15.252  -4.408
  725    HA   THR  93           HA       THR  93  -4.582 -17.341  -5.962
  726    HB   THR  93           HB       THR  93  -4.743 -18.513  -3.770
  727    HG1  THR  93           HG1      THR  93  -4.807 -16.712  -2.367
  728   HG21  THR  93          1HG2      THR  93  -2.808 -18.863  -5.189
  729   HG22  THR  93          2HG2      THR  93  -2.333 -18.879  -3.493
  730   HG23  THR  93          3HG2      THR  93  -2.014 -17.456  -4.486
  731    H    ASP  94           H        ASP  94  -5.391 -14.478  -4.506
  732    HA   ASP  94           HA       ASP  94  -7.985 -15.192  -3.476
  733    HB2  ASP  94          1HB       ASP  94  -6.819 -12.453  -4.043
  734    HB3  ASP  94          2HB       ASP  94  -8.265 -12.792  -3.083
  735    H    ASN  95           H        ASN  95  -6.665 -14.374  -6.481
  736    HA   ASN  95           HA       ASN  95  -7.481 -13.971  -8.545
  737    HB2  ASN  95          1HB       ASN  95 -10.069 -15.015  -7.383
  738    HB3  ASN  95          2HB       ASN  95  -9.725 -14.809  -9.092
  739   HD21  ASN  95          1HD2      ASN  95 -10.423 -17.184  -7.568
  740   HD22  ASN  95          2HD2      ASN  95  -9.139 -18.322  -7.852
  741    H    ASN  96           H        ASN  96  -7.627 -11.968  -6.398
  742    HA   ASN  96           HA       ASN  96  -9.401 -10.074  -7.705
  743    HB2  ASN  96          1HB       ASN  96 -10.893 -10.901  -6.045
  744    HB3  ASN  96          2HB       ASN  96  -9.636 -10.922  -4.813
  745   HD21  ASN  96          1HD2      ASN  96 -10.940  -9.719  -3.428
  746   HD22  ASN  96          2HD2      ASN  96 -11.222  -8.028  -3.664
  747    H    ALA  97           H        ALA  97  -8.020  -8.538  -8.219
  748    HA   ALA  97           HA       ALA  97  -5.464  -8.230  -7.131
  749    HB1  ALA  97          1HB       ALA  97  -6.106  -7.515  -9.394
  750    HB2  ALA  97          2HB       ALA  97  -5.297  -6.234  -8.491
  751    HB3  ALA  97          3HB       ALA  97  -7.047  -6.199  -8.695
  752    H    CYS  98           H        CYS  98  -8.508  -6.714  -6.284
  753    HA   CYS  98           HA       CYS  98  -7.464  -4.560  -4.781
  754    HB2  CYS  98          1HB       CYS  98 -10.084  -6.011  -4.362
  755    HB3  CYS  98          2HB       CYS  98  -9.671  -4.412  -3.754
  756    H    HIS  99           H        HIS  99  -8.253  -7.903  -3.906
  757    HA   HIS  99           HA       HIS  99  -7.755  -7.451  -1.101
  758    HB2  HIS  99          1HB       HIS  99  -9.311  -9.229  -2.155
  759    HB3  HIS  99          2HB       HIS  99  -7.844 -10.152  -2.441
  760    HD1  HIS  99           HD1      HIS  99 -10.471  -9.935  -0.118
  761    HD2  HIS  99           HD2      HIS  99  -6.353 -10.391   0.244
  762    HE1  HIS  99           HE1      HIS  99 -10.093 -10.885   2.181
  763    HE2  HIS  99           HE2      HIS  99  -7.590 -11.074   2.412
  764    H    TRP 100           H        TRP 100  -6.009  -8.527  -3.887
  765    HA   TRP 100           HA       TRP 100  -3.819  -9.776  -2.653
  766    HB2  TRP 100          1HB       TRP 100  -4.418  -9.922  -5.079
  767    HB3  TRP 100          2HB       TRP 100  -3.846  -8.268  -5.287
  768    HD1  TRP 100           HD1      TRP 100  -1.571 -10.073  -2.993
  769    HE1  TRP 100           HE1      TRP 100   0.527 -10.862  -4.250
  770    HE3  TRP 100           HE3      TRP 100  -3.155  -9.315  -7.792
  771    HZ2  TRP 100           HZ2      TRP 100   1.401 -11.133  -6.916
  772    HZ3  TRP 100           HZ3      TRP 100  -1.631  -9.864  -9.636
  773    HH2  TRP 100           HH2      TRP 100   0.598 -10.758  -9.216
  774    H    ALA 101           H        ALA 101  -4.162  -6.461  -3.910
  775    HA   ALA 101           HA       ALA 101  -1.664  -5.536  -2.968
  776    HB1  ALA 101          1HB       ALA 101  -2.855  -4.421  -4.764
  777    HB2  ALA 101          2HB       ALA 101  -2.557  -3.295  -3.437
  778    HB3  ALA 101          3HB       ALA 101  -4.161  -3.995  -3.659
  779    H    PHE 102           H        PHE 102  -4.881  -5.601  -1.579
  780    HA   PHE 102           HA       PHE 102  -4.393  -3.775   0.496
  781    HB2  PHE 102          1HB       PHE 102  -6.639  -4.322  -0.252
  782    HB3  PHE 102          2HB       PHE 102  -6.465  -5.964   0.358
  783    HD1  PHE 102           HD1      PHE 102  -7.079  -6.455   2.567
  784    HD2  PHE 102           HD2      PHE 102  -6.424  -2.405   1.422
  785    HE1  PHE 102           HE1      PHE 102  -7.914  -5.706   4.752
  786    HE2  PHE 102           HE2      PHE 102  -7.261  -1.651   3.609
  787    HZ   PHE 102           HZ       PHE 102  -8.008  -3.300   5.278
  788    H    ARG 103           H        ARG 103  -3.951  -7.269   0.263
  789    HA   ARG 103           HA       ARG 103  -3.568  -7.636   3.075
  790    HB2  ARG 103          1HB       ARG 103  -4.276  -9.455   1.495
  791    HB3  ARG 103          2HB       ARG 103  -2.632  -9.455   0.870
  792    HG2  ARG 103          1HG       ARG 103  -1.738 -10.113   2.975
  793    HG3  ARG 103          2HG       ARG 103  -3.296  -9.913   3.759
  794    HD2  ARG 103          1HD       ARG 103  -2.648 -12.280   3.278
  795    HD3  ARG 103          2HD       ARG 103  -4.198 -11.791   2.606
  796    HE   ARG 103           HE       ARG 103  -1.707 -11.970   1.027
  797   HH11  ARG 103          1HH1      ARG 103  -5.159 -12.441   1.408
  798   HH12  ARG 103          2HH1      ARG 103  -5.404 -12.987  -0.227
  799   HH21  ARG 103          1HH2      ARG 103  -2.035 -12.698  -1.140
  800   HH22  ARG 103          2HH2      ARG 103  -3.639 -13.128  -1.668
  801    H    GLY 104           H        GLY 104  -1.509  -6.984   0.318
  802    HA2  GLY 104          1HA       GLY 104   0.995  -7.342   1.596
  803    HA3  GLY 104          2HA       GLY 104   0.688  -6.316   0.189
  804    H    PHE 105           H        PHE 105  -1.071  -4.494   1.187
  805    HA   PHE 105           HA       PHE 105   0.617  -2.669   2.496
  806    HB2  PHE 105          1HB       PHE 105  -1.040  -1.788   1.063
  807    HB3  PHE 105          2HB       PHE 105  -2.321  -2.674   1.875
  808    HD1  PHE 105           HD1      PHE 105  -3.799  -1.167   2.829
  809    HD2  PHE 105           HD2      PHE 105   0.388  -0.424   3.096
  810    HE1  PHE 105           HE1      PHE 105  -4.242   0.816   4.206
  811    HE2  PHE 105           HE2      PHE 105  -0.059   1.566   4.473
  812    HZ   PHE 105           HZ       PHE 105  -2.372   2.186   5.032
  813    H    LYS 106           H        LYS 106  -2.137  -4.569   3.619
  814    HA   LYS 106           HA       LYS 106  -2.261  -3.486   6.202
  815    HB2  LYS 106          1HB       LYS 106  -4.206  -4.551   5.644
  816    HB3  LYS 106          2HB       LYS 106  -3.391  -5.906   4.869
  817    HG2  LYS 106          1HG       LYS 106  -2.761  -6.722   7.125
  818    HG3  LYS 106          2HG       LYS 106  -3.711  -5.402   7.818
  819    HD2  LYS 106          1HD       LYS 106  -5.718  -6.265   6.712
  820    HD3  LYS 106          2HD       LYS 106  -4.769  -7.576   6.010
  821    HE2  LYS 106          1HE       LYS 106  -4.241  -8.379   8.276
  822    HE3  LYS 106          2HE       LYS 106  -5.238  -7.093   8.953
  823    HZ1  LYS 106          1HZ       LYS 106  -7.168  -8.036   7.890
  824    HZ2  LYS 106          2HZ       LYS 106  -6.402  -9.226   8.823
  825    HZ3  LYS 106          3HZ       LYS 106  -6.221  -9.229   7.144
  826    H    CYS 107           H        CYS 107  -0.609  -6.349   4.930
  827    HA   CYS 107           HA       CYS 107   0.353  -7.366   7.343
  828    HB2  CYS 107          1HB       CYS 107   0.465  -8.763   5.443
  829    HB3  CYS 107          2HB       CYS 107   1.336  -7.566   4.495
  830    H    PHE 108           H        PHE 108   1.733  -5.013   5.097
  831    HA   PHE 108           HA       PHE 108   4.264  -4.901   6.374
  832    HB2  PHE 108          1HB       PHE 108   3.716  -4.336   3.962
  833    HB3  PHE 108          2HB       PHE 108   3.092  -2.800   4.564
  834    HD1  PHE 108           HD1      PHE 108   6.049  -4.801   3.881
  835    HD2  PHE 108           HD2      PHE 108   4.625  -1.135   5.507
  836    HE1  PHE 108           HE1      PHE 108   8.321  -3.880   3.792
  837    HE2  PHE 108           HE2      PHE 108   6.901  -0.208   5.415
  838    HZ   PHE 108           HZ       PHE 108   8.752  -1.583   4.553
  839    H    GLN 109           H        GLN 109   1.471  -2.675   6.347
  840    HA   GLN 109           HA       GLN 109   2.615  -0.755   8.048
  841    HB2  GLN 109          1HB       GLN 109   0.386   0.145   8.297
  842    HB3  GLN 109          2HB       GLN 109   0.667  -0.302   6.624
  843    HG2  GLN 109          1HG       GLN 109  -1.338  -1.259   6.755
  844    HG3  GLN 109          2HG       GLN 109  -0.508  -2.556   7.621
  845   HE21  GLN 109          1HE2      GLN 109  -3.272  -1.625   7.807
  846   HE22  GLN 109          2HE2      GLN 109  -3.523  -1.207   9.464
  847    H    LYS 110           H        LYS 110   1.123  -3.799   8.718
  848    HA   LYS 110           HA       LYS 110   0.324  -3.314  11.384
  849    HB2  LYS 110          1HB       LYS 110  -0.464  -5.184   9.923
  850    HB3  LYS 110          2HB       LYS 110   1.114  -5.928  10.104
  851    HG2  LYS 110          1HG       LYS 110   0.783  -6.207  12.452
  852    HG3  LYS 110          2HG       LYS 110  -0.751  -5.342  12.384
  853    HD2  LYS 110          1HD       LYS 110  -1.312  -7.635  12.425
  854    HD3  LYS 110          2HD       LYS 110  -1.504  -7.136  10.745
  855    HE2  LYS 110          1HE       LYS 110  -0.374  -9.248  10.784
  856    HE3  LYS 110          2HE       LYS 110   0.772  -8.006  10.286
  857    HZ1  LYS 110          1HZ       LYS 110   1.645  -7.962  12.542
  858    HZ2  LYS 110          2HZ       LYS 110   1.760  -9.514  11.886
  859    HZ3  LYS 110          3HZ       LYS 110   0.550  -9.159  13.012
  860    H    ASN 111           H        ASN 111   3.369  -3.952   9.910
  861    HA   ASN 111           HA       ASN 111   4.587  -4.384  12.560
  862    HB2  ASN 111          1HB       ASN 111   5.698  -5.126   9.845
  863    HB3  ASN 111          2HB       ASN 111   6.485  -5.393  11.395
  864   HD21  ASN 111          1HD2      ASN 111   3.975  -6.451   9.237
  865   HD22  ASN 111          2HD2      ASN 111   3.626  -7.925  10.067
  866    H    ASN 112           H        ASN 112   4.663  -2.481   9.614
  867    HA   ASN 112           HA       ASN 112   6.707  -0.729  10.802
  868    HB2  ASN 112          1HB       ASN 112   6.767  -1.843   7.985
  869    HB3  ASN 112          2HB       ASN 112   7.852  -0.602   8.617
  870   HD21  ASN 112          1HD2      ASN 112   8.038  -3.520   7.648
  871   HD22  ASN 112          2HD2      ASN 112   9.075  -4.261   8.822
  872    H    LEU 113           H        LEU 113   4.638   0.516  11.138
  873    HA   LEU 113           HA       LEU 113   3.459   1.618   8.729
  874    HB2  LEU 113          1HB       LEU 113   1.943   1.084  10.493
  875    HB3  LEU 113          2HB       LEU 113   2.847   2.044  11.646
  876    HG   LEU 113           HG       LEU 113   2.220   4.078  10.340
  877   HD11  LEU 113          1HD1      LEU 113   1.858   2.971   8.192
  878   HD12  LEU 113          2HD1      LEU 113   0.449   3.911   8.691
  879   HD13  LEU 113          3HD1      LEU 113   0.442   2.155   8.856
  880   HD21  LEU 113          1HD2      LEU 113  -0.062   2.376  11.335
  881   HD22  LEU 113          2HD2      LEU 113  -0.105   4.126  11.112
  882   HD23  LEU 113          3HD2      LEU 113   0.965   3.415  12.323
  883    H    SER 114           H        SER 114   5.667   2.589  11.259
  884    HA   SER 114           HA       SER 114   5.578   5.379  10.810
  885    HB2  SER 114          1HB       SER 114   6.572   4.277  12.829
  886    HB3  SER 114          2HB       SER 114   7.932   3.769  11.829
  887    HG   SER 114           HG       SER 114   8.305   5.740  12.993
  888    H    LEU 115           H        LEU 115   7.424   2.777   9.318
  889    HA   LEU 115           HA       LEU 115   9.179   4.373   7.803
  890    HB2  LEU 115          1HB       LEU 115   9.439   1.944   8.172
  891    HB3  LEU 115          2HB       LEU 115   8.053   1.656   7.140
  892    HG   LEU 115           HG       LEU 115   9.327   2.728   5.262
  893   HD11  LEU 115          1HD1      LEU 115  11.750   2.922   5.522
  894   HD12  LEU 115          2HD1      LEU 115  11.589   2.531   7.235
  895   HD13  LEU 115          3HD1      LEU 115  10.887   4.019   6.599
  896   HD21  LEU 115          1HD2      LEU 115   9.165   0.298   5.507
  897   HD22  LEU 115          2HD2      LEU 115  10.600   0.306   6.532
  898   HD23  LEU 115          3HD2      LEU 115  10.723   0.780   4.839
  899    H    ILE 116           H        ILE 116   5.915   3.203   7.251
  900    HA   ILE 116           HA       ILE 116   5.680   3.918   4.541
  901    HB   ILE 116           HB       ILE 116   3.531   3.665   6.662
  902   HG12  ILE 116          1HG1      ILE 116   4.548   1.714   4.580
  903   HG13  ILE 116          2HG1      ILE 116   4.791   1.600   6.331
  904   HG21  ILE 116          1HG2      ILE 116   1.982   3.369   4.760
  905   HG22  ILE 116          2HG2      ILE 116   3.293   3.793   3.658
  906   HG23  ILE 116          3HG2      ILE 116   2.694   4.983   4.814
  907   HD11  ILE 116          1HD1      ILE 116   2.321   1.433   6.577
  908   HD12  ILE 116          2HD1      ILE 116   3.060   0.093   5.701
  909   HD13  ILE 116          3HD1      ILE 116   2.208   1.355   4.818
  910    H    LYS 117           H        LYS 117   4.945   5.624   7.537
  911    HA   LYS 117           HA       LYS 117   3.875   7.954   6.377
  912    HB2  LYS 117          1HB       LYS 117   5.188   7.440   9.037
  913    HB3  LYS 117          2HB       LYS 117   4.505   9.002   8.601
  914    HG2  LYS 117          1HG       LYS 117   2.314   7.971   8.306
  915    HG3  LYS 117          2HG       LYS 117   2.984   6.393   8.713
  916    HD2  LYS 117          1HD       LYS 117   3.514   7.159  10.950
  917    HD3  LYS 117          2HD       LYS 117   2.975   8.790  10.554
  918    HE2  LYS 117          1HE       LYS 117   0.702   7.953  10.199
  919    HE3  LYS 117          2HE       LYS 117   1.243   6.318  10.579
  920    HZ1  LYS 117          1HZ       LYS 117   1.308   8.634  12.436
  921    HZ2  LYS 117          2HZ       LYS 117   1.809   7.062  12.803
  922    HZ3  LYS 117          3HZ       LYS 117   0.182   7.374  12.472
  923    H    ALA 118           H        ALA 118   7.146   6.984   7.235
  924    HA   ALA 118           HA       ALA 118   8.428   9.446   6.690
  925    HB1  ALA 118          1HB       ALA 118  10.470   8.170   6.718
  926    HB2  ALA 118          2HB       ALA 118   9.562   6.668   6.538
  927    HB3  ALA 118          3HB       ALA 118   9.406   7.621   8.011
  928    H    SER 119           H        SER 119   7.531   6.723   4.692
  929    HA   SER 119           HA       SER 119   9.137   7.232   2.462
  930    HB2  SER 119          1HB       SER 119   6.393   5.962   2.486
  931    HB3  SER 119          2HB       SER 119   7.643   5.750   1.259
  932    HG   SER 119           HG       SER 119   8.200   5.152   3.952
  933    H    ILE 120           H        ILE 120   6.059   8.600   3.426
  934    HA   ILE 120           HA       ILE 120   5.926  10.095   0.904
  935    HB   ILE 120           HB       ILE 120   3.621  10.697   1.624
  936   HG12  ILE 120          1HG1      ILE 120   4.048   8.651   3.799
  937   HG13  ILE 120          2HG1      ILE 120   4.094  10.392   4.072
  938   HG21  ILE 120          1HG2      ILE 120   4.230   7.748   1.516
  939   HG22  ILE 120          2HG2      ILE 120   4.007   8.816   0.130
  940   HG23  ILE 120          3HG2      ILE 120   2.655   8.482   1.212
  941   HD11  ILE 120          1HD1      ILE 120   1.941   9.432   4.678
  942   HD12  ILE 120          2HD1      ILE 120   1.736   8.846   3.028
  943   HD13  ILE 120          3HD1      ILE 120   1.789  10.579   3.349
  944    H    LYS 121           H        LYS 121   7.417  10.521   3.696
  945    HA   LYS 121           HA       LYS 121   6.488  13.189   4.332
  946    HB2  LYS 121          1HB       LYS 121   7.189  11.656   6.122
  947    HB3  LYS 121          2HB       LYS 121   8.812  11.612   5.445
  948    HG2  LYS 121          1HG       LYS 121   8.879  14.115   5.773
  949    HG3  LYS 121          2HG       LYS 121   7.395  13.940   6.708
  950    HD2  LYS 121          1HD       LYS 121   8.526  12.449   8.259
  951    HD3  LYS 121          2HD       LYS 121  10.007  12.552   7.303
  952    HE2  LYS 121          1HE       LYS 121   8.641  14.813   8.758
  953    HE3  LYS 121          2HE       LYS 121  10.147  14.024   9.222
  954    HZ1  LYS 121          1HZ       LYS 121  10.577  16.111   8.108
  955    HZ2  LYS 121          2HZ       LYS 121   9.702  15.615   6.751
  956    HZ3  LYS 121          3HZ       LYS 121  11.145  14.832   7.160
  957    H    LYS 122           H        LYS 122   7.359  15.029   3.638
  958    HA   LYS 122           HA       LYS 122   9.441  15.116   1.714
  959    HB2  LYS 122          1HB       LYS 122   9.169  17.615   3.115
  960    HB3  LYS 122          2HB       LYS 122   8.763  17.240   1.457
  961    HG2  LYS 122          1HG       LYS 122   6.563  16.497   2.121
  962    HG3  LYS 122          2HG       LYS 122   6.973  16.726   3.822
  963    HD2  LYS 122          1HD       LYS 122   7.347  19.140   3.338
  964    HD3  LYS 122          2HD       LYS 122   6.748  18.856   1.702
  965    HE2  LYS 122          1HE       LYS 122   4.602  18.161   2.568
  966    HE3  LYS 122          2HE       LYS 122   5.192  18.296   4.224
  967    HZ1  LYS 122          1HZ       LYS 122   4.883  20.529   2.293
  968    HZ2  LYS 122          2HZ       LYS 122   5.501  20.677   3.859
  969    HZ3  LYS 122          3HZ       LYS 122   3.892  20.220   3.627
  970    H    ASP 123           H        ASP 123  11.577  15.047   2.026
  971    HA   ASP 123           HA       ASP 123  12.552  15.209   4.782
  972    HB2  ASP 123          1HB       ASP 123  13.059  13.163   3.477
  973    HB3  ASP 123          2HB       ASP 123  13.974  14.145   2.339
  974    H21  ACD 201           H21      ACD   1  -4.580   4.999   1.783
  975    H22  ACD 201           H22      ACD   1  -3.338   5.163   3.033
  976    H31  ACD 201           H31      ACD   1  -1.946   6.487   1.439
  977    H32  ACD 201           H32      ACD   1  -3.168   6.266   0.192
  978    H41  ACD 201           H41      ACD   1  -2.847   3.787   0.349
  979    H42  ACD 201           H42      ACD   1  -1.361   4.628  -0.108
  980    H5   ACD 201           H5       ACD   1  -1.880   3.190   2.530
  981    H6   ACD 201           H6       ACD   1   0.402   3.778   2.954
  982    H71  ACD 201           H71      ACD   1   0.771   4.804   0.266
  983    H72  ACD 201           H72      ACD   1  -0.101   6.086   1.102
  984    H8   ACD 201           H8       ACD   1   1.818   6.434   2.663
  985    H9   ACD 201           H9       ACD   1   3.906   5.517   1.967
  986   H101  ACD 201          H101      ACD   1   2.723   4.652  -0.551
  987   H102  ACD 201          H102      ACD   1   2.335   3.371   0.601
  988    H11  ACD 201           H11      ACD   1   5.281   4.288   0.313
  989    H12  ACD 201           H12      ACD   1   5.611   1.951   0.015
  990   H131  ACD 201          H131      ACD   1   2.610   1.936  -0.542
  991   H132  ACD 201          H132      ACD   1   3.714   0.565  -0.674
  992    H14  ACD 201           H14      ACD   1   2.688   1.650   2.049
  993    H15  ACD 201           H15      ACD   1   2.654  -0.683   2.540
  994   H161  ACD 201          H161      ACD   1   2.784  -1.378  -0.287
  995   H162  ACD 201          H162      ACD   1   4.451  -1.009   0.169
  996   H171  ACD 201          H171      ACD   1   4.463  -2.707   1.877
  997   H172  ACD 201          H172      ACD   1   2.720  -2.933   1.759
  998   H181  ACD 201          H181      ACD   1   4.718  -3.564  -0.453
  999   H182  ACD 201          H182      ACD   1   2.973  -3.813  -0.548
 1000   H191  ACD 201          H191      ACD   1   4.903  -5.175   1.383
 1001   H192  ACD 201          H192      ACD   1   3.149  -5.335   1.478
 1002   H201  ACD 201          H201      ACD   1   3.147  -6.258  -0.829
 1003   H202  ACD 201          H202      ACD   1   4.110  -7.212   0.248
 1004   H203  ACD 201          H203      ACD   1   4.872  -6.139  -0.875
  Start of MODEL   12
    1    H1   MET   1          1H        MET   1  15.572  13.654 -16.963
    2    H2   MET   1          2H        MET   1  16.091  12.526 -18.104
    3    H3   MET   1          3H        MET   1  17.083  12.914 -16.792
    4    HA   MET   1           HA       MET   1  14.467  11.535 -16.667
    5    HB2  MET   1          1HB       MET   1  17.284  10.547 -16.171
    6    HB3  MET   1          2HB       MET   1  15.830   9.627 -15.817
    7    HG2  MET   1          1HG       MET   1  15.250   9.562 -18.155
    8    HG3  MET   1          2HG       MET   1  16.619  10.599 -18.552
    9    HE1  MET   1          1HE       MET   1  17.453   8.871 -20.389
   10    HE2  MET   1          2HE       MET   1  16.062   7.853 -20.023
   11    HE3  MET   1          3HE       MET   1  17.677   7.150 -20.073
   12    H    GLU   2           H        GLU   2  13.577  12.822 -15.051
   13    HA   GLU   2           HA       GLU   2  15.021  12.769 -12.483
   14    HB2  GLU   2          1HB       GLU   2  12.971  14.769 -13.423
   15    HB3  GLU   2          2HB       GLU   2  13.732  14.751 -11.840
   16    HG2  GLU   2          1HG       GLU   2  15.891  15.174 -12.858
   17    HG3  GLU   2          2HG       GLU   2  15.152  15.137 -14.457
   18    H    PHE   3           H        PHE   3  14.227  11.306 -11.191
   19    HA   PHE   3           HA       PHE   3  11.478  10.423 -11.488
   20    HB2  PHE   3          1HB       PHE   3  13.198   8.719 -11.240
   21    HB3  PHE   3          2HB       PHE   3  13.691   9.408  -9.692
   22    HD1  PHE   3           HD1      PHE   3  12.656   8.728  -7.710
   23    HD2  PHE   3           HD2      PHE   3  10.871   7.781 -11.451
   24    HE1  PHE   3           HE1      PHE   3  11.036   7.269  -6.565
   25    HE2  PHE   3           HE2      PHE   3   9.247   6.325 -10.314
   26    HZ   PHE   3           HZ       PHE   3   9.329   6.067  -7.866
   27    H    THR   4           H        THR   4   9.876  11.106 -10.290
   28    HA   THR   4           HA       THR   4  10.464  12.488  -7.747
   29    HB   THR   4           HB       THR   4   7.746  12.734  -8.854
   30    HG1  THR   4           HG1      THR   4  10.027  13.869 -10.164
   31   HG21  THR   4          1HG2      THR   4   8.539  13.911  -6.871
   32   HG22  THR   4          2HG2      THR   4   8.055  15.034  -8.142
   33   HG23  THR   4          3HG2      THR   4   9.765  14.723  -7.841
   34    H    VAL   5           H        VAL   5   9.759  11.655  -5.933
   35    HA   VAL   5           HA       VAL   5   8.277   9.130  -6.049
   36    HB   VAL   5           HB       VAL   5   9.211   8.547  -4.062
   37   HG11  VAL   5          1HG1      VAL   5  11.453   9.345  -3.774
   38   HG12  VAL   5          2HG1      VAL   5  11.102  10.768  -4.752
   39   HG13  VAL   5          3HG1      VAL   5  11.079   9.167  -5.487
   40   HG21  VAL   5          1HG2      VAL   5   8.000  10.232  -2.766
   41   HG22  VAL   5          2HG2      VAL   5   9.244  11.421  -3.158
   42   HG23  VAL   5          3HG2      VAL   5   9.648  10.013  -2.176
   43    H    SER   6           H        SER   6   6.486   8.781  -4.605
   44    HA   SER   6           HA       SER   6   4.681  11.030  -4.826
   45    HB2  SER   6          1HB       SER   6   2.984   9.273  -4.112
   46    HB3  SER   6          2HB       SER   6   3.812   8.977  -5.639
   47    HG   SER   6           HG       SER   6   4.811   7.922  -3.222
   48    H    THR   7           H        THR   7   5.309  12.422  -3.199
   49    HA   THR   7           HA       THR   7   5.553  11.573  -0.465
   50    HB   THR   7           HB       THR   7   5.713  13.970   0.057
   51    HG1  THR   7           HG1      THR   7   4.980  14.233  -2.691
   52   HG21  THR   7          1HG2      THR   7   7.745  14.457  -1.196
   53   HG22  THR   7          2HG2      THR   7   7.337  13.208  -2.371
   54   HG23  THR   7          3HG2      THR   7   7.713  12.763  -0.705
   55    H    THR   8           H        THR   8   4.204  13.323   1.061
   56    HA   THR   8           HA       THR   8   1.658  12.241   1.260
   57    HB   THR   8           HB       THR   8   2.321  14.984   2.296
   58    HG1  THR   8           HG1      THR   8   3.542  12.554   2.870
   59   HG21  THR   8          1HG2      THR   8   0.724  12.673   3.400
   60   HG22  THR   8          2HG2      THR   8   0.069  14.158   2.714
   61   HG23  THR   8          3HG2      THR   8   0.987  14.212   4.217
   62    H    GLU   9           H        GLU   9   2.724  15.228  -0.305
   63    HA   GLU   9           HA       GLU   9   0.165  16.217  -0.925
   64    HB2  GLU   9          1HB       GLU   9   2.187  17.608  -1.006
   65    HB3  GLU   9          2HB       GLU   9   2.774  16.687  -2.383
   66    HG2  GLU   9          1HG       GLU   9   1.821  18.798  -3.092
   67    HG3  GLU   9          2HG       GLU   9   0.868  17.446  -3.703
   68    H    ASP  10           H        ASP  10   2.470  14.348  -2.888
   69    HA   ASP  10           HA       ASP  10   0.891  14.106  -5.189
   70    HB2  ASP  10          1HB       ASP  10   2.848  12.039  -4.165
   71    HB3  ASP  10          2HB       ASP  10   2.315  12.271  -5.826
   72    H    LEU  11           H        LEU  11   1.090  12.196  -2.260
   73    HA   LEU  11           HA       LEU  11  -0.481  10.035  -3.078
   74    HB2  LEU  11          1HB       LEU  11   0.930   9.844  -1.163
   75    HB3  LEU  11          2HB       LEU  11   0.079  11.150  -0.330
   76    HG   LEU  11           HG       LEU  11  -1.932   9.707  -0.250
   77   HD11  LEU  11          1HD1      LEU  11  -0.082   7.590  -1.318
   78   HD12  LEU  11          2HD1      LEU  11  -1.420   8.330  -2.199
   79   HD13  LEU  11          3HD1      LEU  11  -1.743   7.355  -0.771
   80   HD21  LEU  11          1HD2      LEU  11   0.477   8.352   0.938
   81   HD22  LEU  11          2HD2      LEU  11  -1.174   8.358   1.557
   82   HD23  LEU  11          3HD2      LEU  11  -0.220   9.838   1.576
   83    H    GLN  12           H        GLN  12  -1.355  13.114  -1.559
   84    HA   GLN  12           HA       GLN  12  -4.073  12.381  -1.106
   85    HB2  GLN  12          1HB       GLN  12  -2.803  15.117  -1.290
   86    HB3  GLN  12          2HB       GLN  12  -4.451  14.811  -0.760
   87    HG2  GLN  12          1HG       GLN  12  -3.496  13.414   1.088
   88    HG3  GLN  12          2HG       GLN  12  -1.903  13.997   0.608
   89   HE21  GLN  12          1HE2      GLN  12  -1.381  16.168   0.938
   90   HE22  GLN  12          2HE2      GLN  12  -2.288  17.172   2.014
   91    H    ARG  13           H        ARG  13  -2.293  13.644  -3.774
   92    HA   ARG  13           HA       ARG  13  -4.438  14.616  -5.325
   93    HB2  ARG  13          1HB       ARG  13  -2.094  15.161  -5.786
   94    HB3  ARG  13          2HB       ARG  13  -1.779  13.484  -6.202
   95    HG2  ARG  13          1HG       ARG  13  -3.238  13.635  -8.116
   96    HG3  ARG  13          2HG       ARG  13  -3.688  15.291  -7.668
   97    HD2  ARG  13          1HD       ARG  13  -0.962  14.305  -8.498
   98    HD3  ARG  13          2HD       ARG  13  -2.033  15.360  -9.419
   99    HE   ARG  13           HE       ARG  13  -1.667  16.723  -7.113
  100   HH11  ARG  13          1HH1      ARG  13   0.538  15.287  -9.419
  101   HH12  ARG  13          2HH1      ARG  13   1.804  16.431  -9.116
  102   HH21  ARG  13          1HH2      ARG  13   0.001  18.229  -6.701
  103   HH22  ARG  13          2HH2      ARG  13   1.501  18.109  -7.568
  104    H    TYR  14           H        TYR  14  -2.650  11.531  -5.555
  105    HA   TYR  14           HA       TYR  14  -4.325  10.344  -7.477
  106    HB2  TYR  14          1HB       TYR  14  -2.658   8.978  -5.351
  107    HB3  TYR  14          2HB       TYR  14  -3.324   8.217  -6.787
  108    HD1  TYR  14           HD1      TYR  14  -0.371   9.343  -5.487
  109    HD2  TYR  14           HD2      TYR  14  -2.731   9.731  -9.009
  110    HE1  TYR  14           HE1      TYR  14   1.644   9.916  -6.770
  111    HE2  TYR  14           HE2      TYR  14  -0.721  10.300 -10.300
  112    HH   TYR  14           HH       TYR  14   2.418   9.834  -9.107
  113    H    ARG  15           H        ARG  15  -4.514  10.485  -4.002
  114    HA   ARG  15           HA       ARG  15  -6.308   8.382  -3.609
  115    HB2  ARG  15          1HB       ARG  15  -5.522   8.822  -1.583
  116    HB3  ARG  15          2HB       ARG  15  -5.027  10.436  -2.054
  117    HG2  ARG  15          1HG       ARG  15  -7.242  11.289  -1.514
  118    HG3  ARG  15          2HG       ARG  15  -7.790   9.651  -1.129
  119    HD2  ARG  15          1HD       ARG  15  -6.043   9.521   0.621
  120    HD3  ARG  15          2HD       ARG  15  -5.612  11.195   0.285
  121    HE   ARG  15           HE       ARG  15  -8.033  11.657   0.920
  122   HH11  ARG  15          1HH1      ARG  15  -6.154   9.002   2.232
  123   HH12  ARG  15          2HH1      ARG  15  -6.954   9.035   3.767
  124   HH21  ARG  15          1HH2      ARG  15  -9.090  11.701   2.931
  125   HH22  ARG  15          2HH2      ARG  15  -8.660  10.552   4.156
  126    H    THR  16           H        THR  16  -6.871  11.832  -4.169
  127    HA   THR  16           HA       THR  16  -9.680  11.776  -3.841
  128    HB   THR  16           HB       THR  16  -8.258  13.580  -5.789
  129    HG1  THR  16           HG1      THR  16  -8.223  13.608  -2.941
  130   HG21  THR  16          1HG2      THR  16 -10.690  13.716  -5.686
  131   HG22  THR  16          2HG2      THR  16  -9.944  15.187  -5.063
  132   HG23  THR  16          3HG2      THR  16 -10.608  13.995  -3.947
  133    H    GLU  17           H        GLU  17  -7.597  11.316  -6.667
  134    HA   GLU  17           HA       GLU  17  -9.632  11.106  -8.598
  135    HB2  GLU  17          1HB       GLU  17  -7.094   9.516  -8.843
  136    HB3  GLU  17          2HB       GLU  17  -7.993  10.358 -10.085
  137    HG2  GLU  17          1HG       GLU  17  -6.386  11.699  -7.926
  138    HG3  GLU  17          2HG       GLU  17  -5.872  11.446  -9.594
  139    H    CYS  18           H        CYS  18  -8.139   8.668  -6.512
  140    HA   CYS  18           HA       CYS  18  -9.552   6.483  -7.672
  141    HB2  CYS  18          1HB       CYS  18  -8.143   6.762  -5.014
  142    HB3  CYS  18          2HB       CYS  18  -8.876   5.259  -5.595
  143    H    VAL  19           H        VAL  19 -10.224   8.757  -5.105
  144    HA   VAL  19           HA       VAL  19 -12.382   7.368  -3.952
  145    HB   VAL  19           HB       VAL  19 -11.497  10.228  -3.877
  146   HG11  VAL  19          1HG1      VAL  19 -13.953  10.290  -3.972
  147   HG12  VAL  19          2HG1      VAL  19 -13.335  10.790  -2.396
  148   HG13  VAL  19          3HG1      VAL  19 -14.024   9.177  -2.601
  149   HG21  VAL  19          1HG2      VAL  19 -11.329   9.716  -1.466
  150   HG22  VAL  19          2HG2      VAL  19 -10.339   8.652  -2.467
  151   HG23  VAL  19          3HG2      VAL  19 -11.868   8.069  -1.805
  152    H    SER  20           H        SER  20 -12.296  10.024  -6.302
  153    HA   SER  20           HA       SER  20 -15.070  10.122  -6.735
  154    HB2  SER  20          1HB       SER  20 -12.764  10.968  -8.492
  155    HB3  SER  20          2HB       SER  20 -14.446  11.442  -8.747
  156    HG   SER  20           HG       SER  20 -13.115  12.973  -7.549
  157    H    SER  21           H        SER  21 -12.577   8.083  -8.148
  158    HA   SER  21           HA       SER  21 -14.196   7.302 -10.399
  159    HB2  SER  21          1HB       SER  21 -11.606   6.171  -9.322
  160    HB3  SER  21          2HB       SER  21 -12.342   5.729 -10.863
  161    HG   SER  21           HG       SER  21 -11.185   8.190 -10.072
  162    H    LEU  22           H        LEU  22 -13.185   5.782  -7.333
  163    HA   LEU  22           HA       LEU  22 -14.681   3.385  -7.993
  164    HB2  LEU  22          1HB       LEU  22 -12.965   4.143  -5.636
  165    HB3  LEU  22          2HB       LEU  22 -13.802   2.594  -5.770
  166    HG   LEU  22           HG       LEU  22 -11.785   3.579  -7.783
  167   HD11  LEU  22          1HD1      LEU  22 -11.434   1.716  -5.437
  168   HD12  LEU  22          2HD1      LEU  22 -10.692   3.305  -5.633
  169   HD13  LEU  22          3HD1      LEU  22 -10.242   1.982  -6.709
  170   HD21  LEU  22          1HD2      LEU  22 -13.450   1.910  -8.538
  171   HD22  LEU  22          2HD2      LEU  22 -12.887   0.827  -7.262
  172   HD23  LEU  22          3HD2      LEU  22 -11.792   1.312  -8.559
  173    H    ASN  23           H        ASN  23 -15.762   6.204  -7.079
  174    HA   ASN  23           HA       ASN  23 -17.529   7.042  -5.908
  175    HB2  ASN  23          1HB       ASN  23 -18.646   5.280  -7.283
  176    HB3  ASN  23          2HB       ASN  23 -18.518   4.189  -5.919
  177   HD21  ASN  23          1HD2      ASN  23 -20.711   3.949  -5.683
  178   HD22  ASN  23          2HD2      ASN  23 -21.741   5.220  -5.112
  179    H    ILE  24           H        ILE  24 -15.259   6.277  -4.346
  180    HA   ILE  24           HA       ILE  24 -15.929   4.830  -2.031
  181    HB   ILE  24           HB       ILE  24 -13.904   7.061  -2.230
  182   HG12  ILE  24          1HG1      ILE  24 -13.562   5.393  -4.031
  183   HG13  ILE  24          2HG1      ILE  24 -12.263   5.351  -2.841
  184   HG21  ILE  24          1HG2      ILE  24 -12.768   5.855  -0.428
  185   HG22  ILE  24          2HG2      ILE  24 -14.069   4.663  -0.404
  186   HG23  ILE  24          3HG2      ILE  24 -14.397   6.336   0.045
  187   HD11  ILE  24          1HD1      ILE  24 -13.285   3.371  -1.822
  188   HD12  ILE  24          2HD1      ILE  24 -12.897   3.117  -3.525
  189   HD13  ILE  24          3HD1      ILE  24 -14.564   3.420  -3.036
  190    HA   PRO  25           HA       PRO  25 -18.725   7.800  -0.147
  191    HB2  PRO  25          1HB       PRO  25 -18.256   6.126   2.229
  192    HB3  PRO  25          2HB       PRO  25 -19.769   6.532   1.417
  193    HG2  PRO  25          1HG       PRO  25 -18.691   4.085   1.273
  194    HG3  PRO  25          2HG       PRO  25 -19.591   4.807  -0.074
  195    HD2  PRO  25          1HD       PRO  25 -16.639   4.489   0.287
  196    HD3  PRO  25          2HD       PRO  25 -17.623   4.364  -1.195
  197    H    ALA  26           H        ALA  26 -18.405   9.567   1.018
  198    HA   ALA  26           HA       ALA  26 -15.846  10.503   1.587
  199    HB1  ALA  26          1HB       ALA  26 -18.455  11.449   2.755
  200    HB2  ALA  26          2HB       ALA  26 -17.798  11.927   1.190
  201    HB3  ALA  26          3HB       ALA  26 -16.952  12.368   2.675
  202    H    ASP  27           H        ASP  27 -18.195   8.913   3.675
  203    HA   ASP  27           HA       ASP  27 -17.049   9.297   6.164
  204    HB2  ASP  27          1HB       ASP  27 -19.163   8.185   5.953
  205    HB3  ASP  27          2HB       ASP  27 -18.436   6.851   5.062
  206    H    TYR  28           H        TYR  28 -16.340   6.672   3.849
  207    HA   TYR  28           HA       TYR  28 -14.304   5.480   5.318
  208    HB2  TYR  28          1HB       TYR  28 -15.021   5.489   2.414
  209    HB3  TYR  28          2HB       TYR  28 -13.533   4.701   2.946
  210    HD1  TYR  28           HD1      TYR  28 -13.601   2.592   4.067
  211    HD2  TYR  28           HD2      TYR  28 -17.210   4.709   3.289
  212    HE1  TYR  28           HE1      TYR  28 -14.898   0.615   4.731
  213    HE2  TYR  28           HE2      TYR  28 -18.514   2.734   3.948
  214    HH   TYR  28           HH       TYR  28 -17.118   0.076   5.570
  215    H    VAL  29           H        VAL  29 -14.220   8.126   3.003
  216    HA   VAL  29           HA       VAL  29 -11.466   8.367   2.671
  217    HB   VAL  29           HB       VAL  29 -13.517  10.573   2.696
  218   HG11  VAL  29          1HG1      VAL  29 -10.748  10.425   1.524
  219   HG12  VAL  29          2HG1      VAL  29 -11.289  11.477   2.831
  220   HG13  VAL  29          3HG1      VAL  29 -11.906  11.714   1.196
  221   HG21  VAL  29          1HG2      VAL  29 -13.527  10.225   0.246
  222   HG22  VAL  29          2HG2      VAL  29 -14.149   8.845   1.152
  223   HG23  VAL  29          3HG2      VAL  29 -12.517   8.798   0.482
  224    H    GLU  30           H        GLU  30 -13.600   9.824   5.124
  225    HA   GLU  30           HA       GLU  30 -11.581  11.299   6.459
  226    HB2  GLU  30          1HB       GLU  30 -14.008  10.201   7.851
  227    HB3  GLU  30          2HB       GLU  30 -13.135  11.703   8.141
  228    HG2  GLU  30          1HG       GLU  30 -13.860  12.465   5.886
  229    HG3  GLU  30          2HG       GLU  30 -14.917  11.060   5.826
  230    H    LYS  31           H        LYS  31 -12.673   7.971   6.781
  231    HA   LYS  31           HA       LYS  31 -11.234   7.289   9.110
  232    HB2  LYS  31          1HB       LYS  31 -11.894   5.558   6.721
  233    HB3  LYS  31          2HB       LYS  31 -11.276   4.969   8.269
  234    HG2  LYS  31          1HG       LYS  31 -13.297   5.852   9.371
  235    HG3  LYS  31          2HG       LYS  31 -13.918   6.332   7.790
  236    HD2  LYS  31          1HD       LYS  31 -13.768   3.968   7.052
  237    HD3  LYS  31          2HD       LYS  31 -13.244   3.527   8.685
  238    HE2  LYS  31          1HE       LYS  31 -15.840   4.958   8.168
  239    HE3  LYS  31          2HE       LYS  31 -15.715   3.198   8.149
  240    HZ1  LYS  31          1HZ       LYS  31 -14.930   4.909  10.442
  241    HZ2  LYS  31          2HZ       LYS  31 -14.990   3.220  10.416
  242    HZ3  LYS  31          3HZ       LYS  31 -16.415   4.120  10.306
  243    H    PHE  32           H        PHE  32 -10.355   6.956   5.685
  244    HA   PHE  32           HA       PHE  32  -7.782   5.948   6.055
  245    HB2  PHE  32          1HB       PHE  32  -8.664   7.709   3.770
  246    HB3  PHE  32          2HB       PHE  32  -7.378   6.508   3.748
  247    HD1  PHE  32           HD1      PHE  32  -8.961   4.355   5.260
  248    HD2  PHE  32           HD2      PHE  32  -9.910   6.854   1.950
  249    HE1  PHE  32           HE1      PHE  32 -10.560   2.673   4.450
  250    HE2  PHE  32           HE2      PHE  32 -11.514   5.174   1.138
  251    HZ   PHE  32           HZ       PHE  32 -11.838   3.078   2.387
  252    H    LYS  33           H        LYS  33  -9.019   9.193   6.046
  253    HA   LYS  33           HA       LYS  33  -6.621  10.646   5.828
  254    HB2  LYS  33          1HB       LYS  33  -9.141  11.394   5.763
  255    HB3  LYS  33          2HB       LYS  33  -8.911  11.609   7.494
  256    HG2  LYS  33          1HG       LYS  33  -7.088  13.152   7.098
  257    HG3  LYS  33          2HG       LYS  33  -7.252  12.918   5.351
  258    HD2  LYS  33          1HD       LYS  33  -9.521  13.830   5.447
  259    HD3  LYS  33          2HD       LYS  33  -9.370  14.050   7.190
  260    HE2  LYS  33          1HE       LYS  33  -7.529  15.615   6.833
  261    HE3  LYS  33          2HE       LYS  33  -7.658  15.379   5.092
  262    HZ1  LYS  33          1HZ       LYS  33  -9.761  16.534   6.844
  263    HZ2  LYS  33          2HZ       LYS  33  -9.895  16.295   5.176
  264    HZ3  LYS  33          3HZ       LYS  33  -8.768  17.401   5.782
  265    H    LYS  34           H        LYS  34  -8.097   8.949   8.490
  266    HA   LYS  34           HA       LYS  34  -6.051  10.027  10.300
  267    HB2  LYS  34          1HB       LYS  34  -8.731   8.758  10.830
  268    HB3  LYS  34          2HB       LYS  34  -7.527   8.930  12.102
  269    HG2  LYS  34          1HG       LYS  34  -8.765  11.162  10.502
  270    HG3  LYS  34          2HG       LYS  34  -9.157  10.732  12.166
  271    HD2  LYS  34          1HD       LYS  34  -6.814  11.221  12.796
  272    HD3  LYS  34          2HD       LYS  34  -6.507  11.745  11.141
  273    HE2  LYS  34          1HE       LYS  34  -8.450  12.972  13.092
  274    HE3  LYS  34          2HE       LYS  34  -6.923  13.666  12.551
  275    HZ1  LYS  34          1HZ       LYS  34  -9.331  13.175  10.881
  276    HZ2  LYS  34          2HZ       LYS  34  -7.850  13.718  10.282
  277    HZ3  LYS  34          3HZ       LYS  34  -8.724  14.677  11.363
  278    H    TRP  35           H        TRP  35  -5.497   8.051   8.300
  279    HA   TRP  35           HA       TRP  35  -4.498   6.048   7.974
  280    HB2  TRP  35          1HB       TRP  35  -3.600   6.726  10.767
  281    HB3  TRP  35          2HB       TRP  35  -2.949   5.355   9.859
  282    HD1  TRP  35           HD1      TRP  35  -2.626   9.081  10.259
  283    HE1  TRP  35           HE1      TRP  35  -0.782   9.958   8.691
  284    HE3  TRP  35           HE3      TRP  35  -1.910   4.888   7.428
  285    HZ2  TRP  35           HZ2      TRP  35   0.766   8.997   6.541
  286    HZ3  TRP  35           HZ3      TRP  35  -0.235   4.947   5.634
  287    HH2  TRP  35           HH2      TRP  35   1.080   6.955   5.196
  288    H    GLU  36           H        GLU  36  -7.187   5.683   8.659
  289    HA   GLU  36           HA       GLU  36  -6.990   3.116  10.063
  290    HB2  GLU  36          1HB       GLU  36  -8.166   4.878  11.400
  291    HB3  GLU  36          2HB       GLU  36  -9.391   4.932  10.142
  292    HG2  GLU  36          1HG       GLU  36 -10.043   2.694  10.574
  293    HG3  GLU  36          2HG       GLU  36  -8.677   2.438  11.654
  294    H    PHE  37           H        PHE  37  -7.286   1.545   8.708
  295    HA   PHE  37           HA       PHE  37  -9.029   1.972   6.363
  296    HB2  PHE  37          1HB       PHE  37  -6.634   0.123   6.559
  297    HB3  PHE  37          2HB       PHE  37  -7.563   0.485   5.109
  298    HD1  PHE  37           HD1      PHE  37  -5.212   1.874   7.585
  299    HD2  PHE  37           HD2      PHE  37  -7.107   2.431   3.812
  300    HE1  PHE  37           HE1      PHE  37  -3.687   3.740   7.098
  301    HE2  PHE  37           HE2      PHE  37  -5.588   4.302   3.326
  302    HZ   PHE  37           HZ       PHE  37  -3.875   4.958   4.969
  303    HA   PRO  38           HA       PRO  38 -11.293  -1.402   8.490
  304    HB2  PRO  38          1HB       PRO  38 -13.166  -0.727   6.293
  305    HB3  PRO  38          2HB       PRO  38 -13.473  -0.924   8.029
  306    HG2  PRO  38          1HG       PRO  38 -13.470   1.499   6.947
  307    HG3  PRO  38          2HG       PRO  38 -12.731   1.216   8.534
  308    HD2  PRO  38          1HD       PRO  38 -11.387   1.496   5.857
  309    HD3  PRO  38          2HD       PRO  38 -10.927   2.204   7.436
  310    H    GLU  39           H        GLU  39 -11.528  -3.488   7.933
  311    HA   GLU  39           HA       GLU  39 -10.279  -4.365   5.488
  312    HB2  GLU  39          1HB       GLU  39  -9.912  -5.443   7.719
  313    HB3  GLU  39          2HB       GLU  39 -11.568  -6.023   7.658
  314    HG2  GLU  39          1HG       GLU  39 -11.064  -7.350   5.704
  315    HG3  GLU  39          2HG       GLU  39  -9.425  -6.702   5.658
  316    H    ASP  40           H        ASP  40 -11.743  -3.550   3.985
  317    HA   ASP  40           HA       ASP  40 -14.143  -5.134   3.570
  318    HB2  ASP  40          1HB       ASP  40 -15.119  -3.415   4.911
  319    HB3  ASP  40          2HB       ASP  40 -14.233  -2.151   4.062
  320    H    ASP  41           H        ASP  41 -14.892  -5.112   1.446
  321    HA   ASP  41           HA       ASP  41 -13.054  -5.112  -0.563
  322    HB2  ASP  41          1HB       ASP  41 -15.221  -6.113  -0.877
  323    HB3  ASP  41          2HB       ASP  41 -16.015  -4.544  -0.783
  324    H    THR  42           H        THR  42 -15.194  -2.388   0.221
  325    HA   THR  42           HA       THR  42 -14.550  -0.670  -1.855
  326    HB   THR  42           HB       THR  42 -15.172   0.078   1.005
  327    HG1  THR  42           HG1      THR  42 -16.906  -1.060   0.452
  328   HG21  THR  42          1HG2      THR  42 -15.477   1.570  -1.595
  329   HG22  THR  42          2HG2      THR  42 -14.419   1.990  -0.247
  330   HG23  THR  42          3HG2      THR  42 -16.170   2.088  -0.059
  331    H    THR  43           H        THR  43 -13.090  -0.764   1.390
  332    HA   THR  43           HA       THR  43 -11.088   1.137   0.961
  333    HB   THR  43           HB       THR  43 -10.931  -1.265   2.783
  334    HG1  THR  43           HG1      THR  43 -11.779   0.510   4.285
  335   HG21  THR  43          1HG2      THR  43  -9.630   1.460   2.874
  336   HG22  THR  43          2HG2      THR  43  -8.823  -0.089   2.635
  337   HG23  THR  43          3HG2      THR  43  -9.572   0.286   4.190
  338    H    MET  44           H        MET  44 -11.243  -2.273   0.202
  339    HA   MET  44           HA       MET  44  -8.468  -2.713  -0.128
  340    HB2  MET  44          1HB       MET  44 -10.823  -4.218  -1.261
  341    HB3  MET  44          2HB       MET  44  -9.163  -4.801  -1.259
  342    HG2  MET  44          1HG       MET  44  -9.144  -4.843   1.149
  343    HG3  MET  44          2HG       MET  44 -10.752  -4.132   1.203
  344    HE1  MET  44          1HE       MET  44  -9.851  -6.792   2.739
  345    HE2  MET  44          2HE       MET  44 -11.308  -7.762   2.510
  346    HE3  MET  44          3HE       MET  44 -11.441  -6.037   2.864
  347    H    CYS  45           H        CYS  45 -11.070  -2.223  -2.524
  348    HA   CYS  45           HA       CYS  45  -9.294  -2.156  -4.731
  349    HB2  CYS  45          1HB       CYS  45 -12.121  -1.122  -4.452
  350    HB3  CYS  45          2HB       CYS  45 -11.221  -1.114  -5.964
  351    H    TYR  46           H        TYR  46 -10.402   0.281  -2.483
  352    HA   TYR  46           HA       TYR  46  -9.556   2.554  -3.870
  353    HB2  TYR  46          1HB       TYR  46 -10.857   2.943  -1.957
  354    HB3  TYR  46          2HB       TYR  46  -9.841   1.924  -0.940
  355    HD1  TYR  46           HD1      TYR  46  -8.303   2.945   0.465
  356    HD2  TYR  46           HD2      TYR  46  -9.684   5.076  -2.954
  357    HE1  TYR  46           HE1      TYR  46  -7.068   4.935   1.212
  358    HE2  TYR  46           HE2      TYR  46  -8.446   7.069  -2.212
  359    HH   TYR  46           HH       TYR  46  -6.177   6.986   0.387
  360    H    ILE  47           H        ILE  47  -7.856   0.559  -1.474
  361    HA   ILE  47           HA       ILE  47  -5.385   1.842  -1.598
  362    HB   ILE  47           HB       ILE  47  -6.054  -1.019  -0.941
  363   HG12  ILE  47          1HG1      ILE  47  -6.995   0.633   0.601
  364   HG13  ILE  47          2HG1      ILE  47  -5.715  -0.278   1.395
  365   HG21  ILE  47          1HG2      ILE  47  -3.802  -1.135   0.100
  366   HG22  ILE  47          2HG2      ILE  47  -3.421   0.420  -0.641
  367   HG23  ILE  47          3HG2      ILE  47  -3.757  -0.982  -1.657
  368   HD11  ILE  47          1HD1      ILE  47  -4.180   1.642   0.895
  369   HD12  ILE  47          2HD1      ILE  47  -5.481   1.988   2.031
  370   HD13  ILE  47          3HD1      ILE  47  -5.602   2.543   0.361
  371    H    LYS  48           H        LYS  48  -6.740  -0.758  -3.555
  372    HA   LYS  48           HA       LYS  48  -4.435  -1.462  -4.965
  373    HB2  LYS  48          1HB       LYS  48  -6.615  -2.708  -4.973
  374    HB3  LYS  48          2HB       LYS  48  -7.256  -1.471  -6.042
  375    HG2  LYS  48          1HG       LYS  48  -5.358  -2.029  -7.617
  376    HG3  LYS  48          2HG       LYS  48  -5.044  -3.424  -6.587
  377    HD2  LYS  48          1HD       LYS  48  -6.413  -4.054  -8.493
  378    HD3  LYS  48          2HD       LYS  48  -7.317  -4.234  -6.990
  379    HE2  LYS  48          1HE       LYS  48  -8.480  -2.155  -7.404
  380    HE3  LYS  48          2HE       LYS  48  -7.506  -1.864  -8.844
  381    HZ1  LYS  48          1HZ       LYS  48  -9.729  -2.762  -9.326
  382    HZ2  LYS  48          2HZ       LYS  48  -9.332  -4.179  -8.492
  383    HZ3  LYS  48          3HZ       LYS  48  -8.488  -3.755  -9.897
  384    H    CYS  49           H        CYS  49  -7.056   0.777  -5.864
  385    HA   CYS  49           HA       CYS  49  -5.983   1.690  -8.248
  386    HB2  CYS  49          1HB       CYS  49  -8.230   2.201  -7.763
  387    HB3  CYS  49          2HB       CYS  49  -7.817   3.025  -6.262
  388    H    VAL  50           H        VAL  50  -5.554   3.014  -4.972
  389    HA   VAL  50           HA       VAL  50  -4.055   5.255  -5.690
  390    HB   VAL  50           HB       VAL  50  -4.131   3.695  -3.111
  391   HG11  VAL  50          1HG1      VAL  50  -2.939   6.406  -3.670
  392   HG12  VAL  50          2HG1      VAL  50  -2.060   4.948  -3.203
  393   HG13  VAL  50          3HG1      VAL  50  -3.177   5.706  -2.066
  394   HG21  VAL  50          1HG2      VAL  50  -6.252   4.621  -3.624
  395   HG22  VAL  50          2HG2      VAL  50  -5.531   6.159  -4.085
  396   HG23  VAL  50          3HG2      VAL  50  -5.514   5.652  -2.396
  397    H    PHE  51           H        PHE  51  -3.068   2.033  -4.631
  398    HA   PHE  51           HA       PHE  51  -0.301   2.505  -4.685
  399    HB2  PHE  51          1HB       PHE  51  -2.064   0.113  -4.531
  400    HB3  PHE  51          2HB       PHE  51  -0.375  -0.150  -4.954
  401    HD1  PHE  51           HD1      PHE  51   0.129  -1.384  -2.965
  402    HD2  PHE  51           HD2      PHE  51  -1.474   2.551  -2.716
  403    HE1  PHE  51           HE1      PHE  51   0.697  -1.305  -0.574
  404    HE2  PHE  51           HE2      PHE  51  -0.907   2.634  -0.326
  405    HZ   PHE  51           HZ       PHE  51   0.182   0.705   0.747
  406    H    ASN  52           H        ASN  52  -2.609   1.776  -7.126
  407    HA   ASN  52           HA       ASN  52  -0.708   0.812  -9.065
  408    HB2  ASN  52          1HB       ASN  52  -3.075   0.073  -9.073
  409    HB3  ASN  52          2HB       ASN  52  -3.573   1.727  -9.451
  410   HD21  ASN  52          1HD2      ASN  52  -0.745   0.085 -10.748
  411   HD22  ASN  52          2HD2      ASN  52  -1.290   0.056 -12.387
  412    H    LYS  53           H        LYS  53  -2.393   3.830  -8.371
  413    HA   LYS  53           HA       LYS  53  -1.443   5.159 -10.716
  414    HB2  LYS  53          1HB       LYS  53  -2.818   6.089  -8.216
  415    HB3  LYS  53          2HB       LYS  53  -2.249   7.237  -9.421
  416    HG2  LYS  53          1HG       LYS  53  -3.688   6.070 -11.096
  417    HG3  LYS  53          2HG       LYS  53  -4.309   5.060  -9.790
  418    HD2  LYS  53          1HD       LYS  53  -5.007   7.178  -8.624
  419    HD3  LYS  53          2HD       LYS  53  -4.587   8.045 -10.104
  420    HE2  LYS  53          1HE       LYS  53  -6.664   5.875  -9.810
  421    HE3  LYS  53          2HE       LYS  53  -6.963   7.592 -10.067
  422    HZ1  LYS  53          1HZ       LYS  53  -5.799   7.375 -12.217
  423    HZ2  LYS  53          2HZ       LYS  53  -7.209   6.449 -12.126
  424    HZ3  LYS  53          3HZ       LYS  53  -5.699   5.703 -11.975
  425    H    MET  54           H        MET  54  -0.284   4.687  -7.493
  426    HA   MET  54           HA       MET  54   1.743   6.729  -7.665
  427    HB2  MET  54          1HB       MET  54   1.124   4.558  -5.676
  428    HB3  MET  54          2HB       MET  54   2.562   5.569  -5.537
  429    HG2  MET  54          1HG       MET  54   1.303   7.491  -5.169
  430    HG3  MET  54          2HG       MET  54  -0.175   6.755  -5.782
  431    HE1  MET  54          1HE       MET  54   1.661   6.100  -1.614
  432    HE2  MET  54          2HE       MET  54   2.214   7.266  -2.815
  433    HE3  MET  54          3HE       MET  54   2.522   5.547  -3.050
  434    H    GLN  55           H        GLN  55   1.359   3.914  -9.186
  435    HA   GLN  55           HA       GLN  55   2.608   2.361 -10.191
  436    HB2  GLN  55          1HB       GLN  55   4.613   4.584  -9.967
  437    HB3  GLN  55          2HB       GLN  55   4.968   3.081 -10.831
  438    HG2  GLN  55          1HG       GLN  55   2.941   3.535 -12.225
  439    HG3  GLN  55          2HG       GLN  55   2.831   5.107 -11.440
  440   HE21  GLN  55          1HE2      GLN  55   4.603   3.124 -13.647
  441   HE22  GLN  55          2HE2      GLN  55   5.562   4.388 -14.337
  442    H    LEU  56           H        LEU  56   2.241   1.673  -7.724
  443    HA   LEU  56           HA       LEU  56   4.837   0.767  -6.728
  444    HB2  LEU  56          1HB       LEU  56   2.641   2.167  -5.398
  445    HB3  LEU  56          2HB       LEU  56   3.193   0.739  -4.510
  446    HG   LEU  56           HG       LEU  56   4.913   3.048  -5.413
  447   HD11  LEU  56          1HD1      LEU  56   3.868   2.328  -2.680
  448   HD12  LEU  56          2HD1      LEU  56   3.371   3.709  -3.651
  449   HD13  LEU  56          3HD1      LEU  56   5.016   3.615  -3.033
  450   HD21  LEU  56          1HD2      LEU  56   5.506   0.594  -3.778
  451   HD22  LEU  56          2HD2      LEU  56   6.561   2.002  -3.859
  452   HD23  LEU  56          3HD2      LEU  56   6.237   1.062  -5.314
  453    H    PHE  57           H        PHE  57   1.704  -0.054  -7.759
  454    HA   PHE  57           HA       PHE  57   2.235  -2.870  -7.192
  455    HB2  PHE  57          1HB       PHE  57   0.714  -2.241  -5.410
  456    HB3  PHE  57          2HB       PHE  57  -0.362  -1.439  -6.543
  457    HD1  PHE  57           HD1      PHE  57   0.873  -4.707  -5.380
  458    HD2  PHE  57           HD2      PHE  57  -1.994  -2.660  -7.773
  459    HE1  PHE  57           HE1      PHE  57  -0.419  -6.787  -5.608
  460    HE2  PHE  57           HE2      PHE  57  -3.287  -4.738  -8.005
  461    HZ   PHE  57           HZ       PHE  57  -2.501  -6.801  -6.921
  462    H    ASP  58           H        ASP  58   1.767  -4.168  -8.853
  463    HA   ASP  58           HA       ASP  58   0.291  -3.030 -11.135
  464    HB2  ASP  58          1HB       ASP  58   2.625  -3.296 -11.733
  465    HB3  ASP  58          2HB       ASP  58   2.645  -4.948 -11.124
  466    H    ASP  59           H        ASP  59  -1.157  -4.381 -12.206
  467    HA   ASP  59           HA       ASP  59  -2.565  -6.150 -10.484
  468    HB2  ASP  59          1HB       ASP  59  -4.128  -6.412 -12.301
  469    HB3  ASP  59          2HB       ASP  59  -3.639  -4.732 -12.233
  470    H    THR  60           H        THR  60  -0.042  -6.641 -12.752
  471    HA   THR  60           HA       THR  60  -0.659  -9.484 -13.007
  472    HB   THR  60           HB       THR  60   1.276  -7.683 -14.451
  473    HG1  THR  60           HG1      THR  60  -1.133  -7.859 -14.898
  474   HG21  THR  60          1HG2      THR  60   1.860  -9.603 -15.846
  475   HG22  THR  60          2HG2      THR  60   0.875 -10.652 -14.826
  476   HG23  THR  60          3HG2      THR  60   2.314  -9.874 -14.164
  477    H    GLU  61           H        GLU  61   2.306  -7.528 -12.474
  478    HA   GLU  61           HA       GLU  61   3.695  -9.776 -11.370
  479    HB2  GLU  61          1HB       GLU  61   4.591  -6.918 -11.166
  480    HB3  GLU  61          2HB       GLU  61   5.564  -8.381 -11.221
  481    HG2  GLU  61          1HG       GLU  61   4.812  -8.742 -13.546
  482    HG3  GLU  61          2HG       GLU  61   3.995  -7.184 -13.479
  483    H    GLY  62           H        GLY  62   1.596  -7.453 -10.022
  484    HA2  GLY  62          1HA       GLY  62   0.857  -7.386  -7.807
  485    HA3  GLY  62          2HA       GLY  62   2.200  -8.444  -7.365
  486    HA   PRO  63           HA       PRO  63   3.358  -4.384  -5.539
  487    HB2  PRO  63          1HB       PRO  63   4.993  -6.171  -3.859
  488    HB3  PRO  63          2HB       PRO  63   3.814  -4.941  -3.380
  489    HG2  PRO  63          1HG       PRO  63   3.340  -7.592  -3.135
  490    HG3  PRO  63          2HG       PRO  63   2.059  -6.403  -3.440
  491    HD2  PRO  63          1HD       PRO  63   3.364  -8.324  -5.321
  492    HD3  PRO  63          2HD       PRO  63   1.677  -7.752  -5.271
  493    H    LEU  64           H        LEU  64   4.902  -3.317  -6.632
  494    HA   LEU  64           HA       LEU  64   7.153  -4.754  -7.776
  495    HB2  LEU  64          1HB       LEU  64   6.629  -1.773  -7.819
  496    HB3  LEU  64          2HB       LEU  64   7.847  -2.628  -8.736
  497    HG   LEU  64           HG       LEU  64   6.189  -2.171 -10.289
  498   HD11  LEU  64          1HD1      LEU  64   6.946  -4.417 -10.488
  499   HD12  LEU  64          2HD1      LEU  64   5.223  -4.355 -10.870
  500   HD13  LEU  64          3HD1      LEU  64   5.762  -4.973  -9.306
  501   HD21  LEU  64          1HD2      LEU  64   4.145  -3.136  -8.308
  502   HD22  LEU  64          2HD2      LEU  64   3.814  -2.635  -9.966
  503   HD23  LEU  64          3HD2      LEU  64   4.428  -1.466  -8.798
  504    H    VAL  65           H        VAL  65   8.450  -5.434  -6.252
  505    HA   VAL  65           HA       VAL  65   8.967  -4.383  -3.784
  506    HB   VAL  65           HB       VAL  65  10.779  -6.055  -5.504
  507   HG11  VAL  65          1HG1      VAL  65  10.880  -5.565  -2.530
  508   HG12  VAL  65          2HG1      VAL  65  12.046  -4.985  -3.720
  509   HG13  VAL  65          3HG1      VAL  65  11.878  -6.716  -3.421
  510   HG21  VAL  65          1HG2      VAL  65   8.677  -7.129  -5.141
  511   HG22  VAL  65          2HG2      VAL  65   8.723  -6.743  -3.422
  512   HG23  VAL  65          3HG2      VAL  65   9.873  -7.897  -4.098
  513    H    ASP  66           H        ASP  66  10.791  -3.797  -6.776
  514    HA   ASP  66           HA       ASP  66  12.893  -2.356  -5.616
  515    HB2  ASP  66          1HB       ASP  66  13.015  -3.223  -7.875
  516    HB3  ASP  66          2HB       ASP  66  11.739  -2.128  -8.394
  517    H    ASN  67           H        ASN  67   9.906  -1.155  -7.134
  518    HA   ASN  67           HA       ASN  67  10.336   1.573  -6.613
  519    HB2  ASN  67          1HB       ASN  67   7.775   0.013  -6.985
  520    HB3  ASN  67          2HB       ASN  67   7.855   1.766  -6.912
  521   HD21  ASN  67          1HD2      ASN  67   6.897   1.746  -9.010
  522   HD22  ASN  67          2HD2      ASN  67   7.873   1.451 -10.410
  523    H    LEU  68           H        LEU  68   8.973  -1.030  -4.758
  524    HA   LEU  68           HA       LEU  68   7.772   0.471  -2.709
  525    HB2  LEU  68          1HB       LEU  68   8.649  -2.367  -3.007
  526    HB3  LEU  68          2HB       LEU  68   8.134  -1.776  -1.435
  527    HG   LEU  68           HG       LEU  68   6.413  -1.423  -3.868
  528   HD11  LEU  68          1HD1      LEU  68   6.357  -3.765  -1.974
  529   HD12  LEU  68          2HD1      LEU  68   6.953  -3.817  -3.632
  530   HD13  LEU  68          3HD1      LEU  68   5.255  -3.462  -3.319
  531   HD21  LEU  68          1HD2      LEU  68   4.638  -1.314  -2.201
  532   HD22  LEU  68          2HD2      LEU  68   5.883  -0.101  -1.897
  533   HD23  LEU  68          3HD2      LEU  68   5.824  -1.568  -0.921
  534    H    VAL  69           H        VAL  69  10.971  -1.039  -2.942
  535    HA   VAL  69           HA       VAL  69  11.908  -0.150  -0.414
  536    HB   VAL  69           HB       VAL  69  13.458  -0.863  -2.899
  537   HG11  VAL  69          1HG1      VAL  69  14.321  -0.553  -0.034
  538   HG12  VAL  69          2HG1      VAL  69  14.848   0.408  -1.416
  539   HG13  VAL  69          3HG1      VAL  69  15.308  -1.290  -1.296
  540   HG21  VAL  69          1HG2      VAL  69  12.009  -2.663  -2.097
  541   HG22  VAL  69          2HG2      VAL  69  12.748  -2.535  -0.501
  542   HG23  VAL  69          3HG2      VAL  69  13.716  -3.049  -1.882
  543    H    HIS  70           H        HIS  70  12.109   1.150  -3.692
  544    HA   HIS  70           HA       HIS  70  13.799   3.324  -3.178
  545    HB2  HIS  70          1HB       HIS  70  13.028   2.330  -5.402
  546    HB3  HIS  70          2HB       HIS  70  11.561   3.275  -5.204
  547    HD1  HIS  70           HD1      HIS  70  13.312   3.744  -7.618
  548    HD2  HIS  70           HD2      HIS  70  13.759   5.858  -4.067
  549    HE1  HIS  70           HE1      HIS  70  14.467   5.884  -8.246
  550    HE2  HIS  70           HE2      HIS  70  14.876   7.070  -6.061
  551    H    GLN  71           H        GLN  71  10.448   2.803  -2.538
  552    HA   GLN  71           HA       GLN  71   9.876   5.621  -2.056
  553    HB2  GLN  71          1HB       GLN  71   8.341   3.701  -3.081
  554    HB3  GLN  71          2HB       GLN  71   7.950   3.455  -1.385
  555    HG2  GLN  71          1HG       GLN  71   6.303   4.889  -2.281
  556    HG3  GLN  71          2HG       GLN  71   7.349   5.872  -1.256
  557   HE21  GLN  71          1HE2      GLN  71   8.307   4.768  -4.426
  558   HE22  GLN  71          2HE2      GLN  71   8.266   6.316  -5.188
  559    H    LEU  72           H        LEU  72   9.550   2.583  -0.251
  560    HA   LEU  72           HA       LEU  72   8.861   3.845   2.158
  561    HB2  LEU  72          1HB       LEU  72   9.755   1.034   1.572
  562    HB3  LEU  72          2HB       LEU  72   9.241   1.566   3.161
  563    HG   LEU  72           HG       LEU  72   7.515   1.692   0.691
  564   HD11  LEU  72          1HD1      LEU  72   8.002  -0.624   1.287
  565   HD12  LEU  72          2HD1      LEU  72   6.325  -0.222   1.659
  566   HD13  LEU  72          3HD1      LEU  72   7.521  -0.306   2.952
  567   HD21  LEU  72          1HD2      LEU  72   6.941   2.159   3.613
  568   HD22  LEU  72          2HD2      LEU  72   5.699   1.968   2.376
  569   HD23  LEU  72          3HD2      LEU  72   6.821   3.329   2.293
  570    H    ALA  73           H        ALA  73  11.953   2.535   1.023
  571    HA   ALA  73           HA       ALA  73  13.274   2.746   3.524
  572    HB1  ALA  73          1HB       ALA  73  15.279   2.237   2.307
  573    HB2  ALA  73          2HB       ALA  73  14.484   2.617   0.778
  574    HB3  ALA  73          3HB       ALA  73  13.953   1.227   1.727
  575    H    HIS  74           H        HIS  74  11.978   5.212   2.818
  576    HA   HIS  74           HA       HIS  74  13.980   7.140   2.100
  577    HB2  HIS  74          1HB       HIS  74  11.547   7.491   1.660
  578    HB3  HIS  74          2HB       HIS  74  11.265   7.564   3.397
  579    HD1  HIS  74           HD1      HIS  74  11.042   9.879   4.215
  580    HD2  HIS  74           HD2      HIS  74  13.573   9.649   0.916
  581    HE1  HIS  74           HE1      HIS  74  11.758  12.242   3.738
  582    HE2  HIS  74           HE2      HIS  74  13.317  12.077   1.767
  583    H    GLY  75           H        GLY  75  15.643   6.647   3.587
  584    HA2  GLY  75          1HA       GLY  75  16.760   7.659   5.432
  585    HA3  GLY  75          2HA       GLY  75  15.205   7.868   6.223
  586    H    ARG  76           H        ARG  76  16.122   4.852   4.718
  587    HA   ARG  76           HA       ARG  76  17.054   3.693   7.199
  588    HB2  ARG  76          1HB       ARG  76  14.344   3.200   6.142
  589    HB3  ARG  76          2HB       ARG  76  15.242   1.763   6.609
  590    HG2  ARG  76          1HG       ARG  76  15.666   2.944   8.819
  591    HG3  ARG  76          2HG       ARG  76  14.417   4.087   8.319
  592    HD2  ARG  76          1HD       ARG  76  13.493   2.316   9.728
  593    HD3  ARG  76          2HD       ARG  76  12.829   2.252   8.100
  594    HE   ARG  76           HE       ARG  76  15.110   0.542   8.627
  595   HH11  ARG  76          1HH1      ARG  76  11.623   0.785   8.491
  596   HH12  ARG  76          2HH1      ARG  76  11.393  -0.911   8.196
  597   HH21  ARG  76          1HH2      ARG  76  14.793  -1.702   8.265
  598   HH22  ARG  76          2HH2      ARG  76  13.167  -2.309   8.044
  599    H    ASP  77           H        ASP  77  17.613   1.324   6.865
  600    HA   ASP  77           HA       ASP  77  19.279   1.039   4.607
  601    HB2  ASP  77          1HB       ASP  77  18.282  -1.095   6.499
  602    HB3  ASP  77          2HB       ASP  77  19.616  -1.277   5.370
  603    H    ALA  78           H        ALA  78  18.500   0.944   2.657
  604    HA   ALA  78           HA       ALA  78  15.981   0.136   1.827
  605    HB1  ALA  78          1HB       ALA  78  18.533   0.106   0.238
  606    HB2  ALA  78          2HB       ALA  78  17.518   1.519   0.522
  607    HB3  ALA  78          3HB       ALA  78  16.895   0.159  -0.412
  608    H    GLU  79           H        GLU  79  18.930  -1.751   2.176
  609    HA   GLU  79           HA       GLU  79  18.057  -4.046   0.780
  610    HB2  GLU  79          1HB       GLU  79  20.101  -3.741   2.978
  611    HB3  GLU  79          2HB       GLU  79  19.851  -5.227   2.070
  612    HG2  GLU  79          1HG       GLU  79  20.358  -3.955  -0.010
  613    HG3  GLU  79          2HG       GLU  79  20.783  -2.575   0.998
  614    H    GLU  80           H        GLU  80  17.823  -3.088   4.162
  615    HA   GLU  80           HA       GLU  80  16.611  -5.487   5.083
  616    HB2  GLU  80          1HB       GLU  80  17.729  -3.955   6.602
  617    HB3  GLU  80          2HB       GLU  80  16.584  -2.686   6.197
  618    HG2  GLU  80          1HG       GLU  80  14.802  -3.876   7.239
  619    HG3  GLU  80          2HG       GLU  80  15.826  -5.278   7.497
  620    H    VAL  81           H        VAL  81  15.381  -2.345   4.031
  621    HA   VAL  81           HA       VAL  81  12.663  -2.730   4.448
  622    HB   VAL  81           HB       VAL  81  14.061  -1.140   2.300
  623   HG11  VAL  81          1HG1      VAL  81  11.767  -1.532   1.613
  624   HG12  VAL  81          2HG1      VAL  81  11.960   0.144   2.136
  625   HG13  VAL  81          3HG1      VAL  81  11.185  -1.034   3.201
  626   HG21  VAL  81          1HG2      VAL  81  12.993  -0.445   5.016
  627   HG22  VAL  81          2HG2      VAL  81  13.533   0.739   3.826
  628   HG23  VAL  81          3HG2      VAL  81  14.674  -0.430   4.483
  629    H    ARG  82           H        ARG  82  14.628  -3.523   1.579
  630    HA   ARG  82           HA       ARG  82  12.687  -4.581  -0.080
  631    HB2  ARG  82          1HB       ARG  82  15.124  -4.257  -0.598
  632    HB3  ARG  82          2HB       ARG  82  15.448  -5.733   0.296
  633    HG2  ARG  82          1HG       ARG  82  13.916  -6.926  -1.263
  634    HG3  ARG  82          2HG       ARG  82  13.833  -5.443  -2.211
  635    HD2  ARG  82          1HD       ARG  82  16.267  -5.498  -2.477
  636    HD3  ARG  82          2HD       ARG  82  16.324  -7.010  -1.578
  637    HE   ARG  82           HE       ARG  82  14.588  -7.133  -3.855
  638   HH11  ARG  82          1HH1      ARG  82  17.924  -7.372  -2.817
  639   HH12  ARG  82          2HH1      ARG  82  18.398  -8.388  -4.140
  640   HH21  ARG  82          1HH2      ARG  82  15.206  -8.467  -5.607
  641   HH22  ARG  82          2HH2      ARG  82  16.849  -9.022  -5.723
  642    H    THR  83           H        THR  83  14.441  -6.123   2.553
  643    HA   THR  83           HA       THR  83  13.467  -8.728   2.199
  644    HB   THR  83           HB       THR  83  14.657  -7.237   4.515
  645    HG1  THR  83           HG1      THR  83  16.379  -7.976   3.580
  646   HG21  THR  83          1HG2      THR  83  13.120  -8.795   5.562
  647   HG22  THR  83          2HG2      THR  83  14.775  -9.369   5.764
  648   HG23  THR  83          3HG2      THR  83  13.726 -10.110   4.556
  649    H    GLU  84           H        GLU  84  12.440  -6.199   4.509
  650    HA   GLU  84           HA       GLU  84  10.320  -7.565   5.663
  651    HB2  GLU  84          1HB       GLU  84  10.468  -4.586   5.202
  652    HB3  GLU  84          2HB       GLU  84   9.517  -5.418   6.425
  653    HG2  GLU  84          1HG       GLU  84  11.691  -6.295   7.337
  654    HG3  GLU  84          2HG       GLU  84  12.499  -5.153   6.265
  655    H    VAL  85           H        VAL  85  10.301  -5.446   2.801
  656    HA   VAL  85           HA       VAL  85   7.567  -5.553   2.250
  657    HB   VAL  85           HB       VAL  85   9.962  -5.247   0.447
  658   HG11  VAL  85          1HG1      VAL  85   7.047  -5.128  -0.308
  659   HG12  VAL  85          2HG1      VAL  85   8.250  -6.274  -0.903
  660   HG13  VAL  85          3HG1      VAL  85   8.375  -4.564  -1.325
  661   HG21  VAL  85          1HG2      VAL  85   9.493  -3.412   1.965
  662   HG22  VAL  85          2HG2      VAL  85   7.831  -3.332   1.379
  663   HG23  VAL  85          3HG2      VAL  85   9.169  -2.938   0.298
  664    H    LEU  86           H        LEU  86  10.193  -7.651   1.047
  665    HA   LEU  86           HA       LEU  86   8.686  -9.327  -0.562
  666    HB2  LEU  86          1HB       LEU  86  11.212  -9.830   0.999
  667    HB3  LEU  86          2HB       LEU  86  10.512 -11.023  -0.090
  668    HG   LEU  86           HG       LEU  86  11.257  -8.258  -0.996
  669   HD11  LEU  86          1HD1      LEU  86  13.342  -9.201  -1.815
  670   HD12  LEU  86          2HD1      LEU  86  12.934 -10.761  -1.100
  671   HD13  LEU  86          3HD1      LEU  86  13.235  -9.366  -0.062
  672   HD21  LEU  86          1HD2      LEU  86   9.722  -9.433  -2.437
  673   HD22  LEU  86          2HD2      LEU  86  10.751 -10.864  -2.416
  674   HD23  LEU  86          3HD2      LEU  86  11.314  -9.383  -3.193
  675    H    LYS  87           H        LYS  87   9.114  -9.348   2.901
  676    HA   LYS  87           HA       LYS  87   8.037 -11.982   3.295
  677    HB2  LYS  87          1HB       LYS  87   8.614  -9.700   5.186
  678    HB3  LYS  87          2HB       LYS  87   7.970 -11.249   5.716
  679    HG2  LYS  87          1HG       LYS  87   9.920 -12.403   5.019
  680    HG3  LYS  87          2HG       LYS  87  10.536 -10.975   4.170
  681    HD2  LYS  87          1HD       LYS  87  11.708 -11.306   6.273
  682    HD3  LYS  87          2HD       LYS  87  10.764  -9.819   6.324
  683    HE2  LYS  87          1HE       LYS  87   8.992 -11.026   7.545
  684    HE3  LYS  87          2HE       LYS  87  10.008 -12.466   7.549
  685    HZ1  LYS  87          1HZ       LYS  87  10.183 -11.239   9.625
  686    HZ2  LYS  87          2HZ       LYS  87  10.709  -9.863   8.792
  687    HZ3  LYS  87          3HZ       LYS  87  11.666 -11.256   8.812
  688    H    CYS  88           H        CYS  88   6.671  -9.065   2.483
  689    HA   CYS  88           HA       CYS  88   4.050  -9.907   3.515
  690    HB2  CYS  88          1HB       CYS  88   5.223  -7.213   2.973
  691    HB3  CYS  88          2HB       CYS  88   3.466  -7.436   2.822
  692    H    VAL  89           H        VAL  89   5.977  -9.650   0.751
  693    HA   VAL  89           HA       VAL  89   3.938  -9.262  -1.194
  694    HB   VAL  89           HB       VAL  89   6.680 -10.502  -1.450
  695   HG11  VAL  89          1HG1      VAL  89   5.269 -11.320  -3.227
  696   HG12  VAL  89          2HG1      VAL  89   6.382 -10.119  -3.879
  697   HG13  VAL  89          3HG1      VAL  89   4.701  -9.688  -3.565
  698   HG21  VAL  89          1HG2      VAL  89   6.796  -8.177  -0.839
  699   HG22  VAL  89          2HG2      VAL  89   5.633  -7.751  -2.094
  700   HG23  VAL  89          3HG2      VAL  89   7.235  -8.346  -2.538
  701    H    ASP  90           H        ASP  90   2.281 -10.592  -1.197
  702    HA   ASP  90           HA       ASP  90   2.720 -13.453  -0.762
  703    HB2  ASP  90          1HB       ASP  90   1.046 -11.902   0.579
  704    HB3  ASP  90          2HB       ASP  90  -0.003 -12.218  -0.805
  705    H    LYS  91           H        LYS  91   0.843 -14.750  -1.943
  706    HA   LYS  91           HA       LYS  91   1.167 -14.150  -4.808
  707    HB2  LYS  91          1HB       LYS  91   0.197 -16.732  -3.595
  708    HB3  LYS  91          2HB       LYS  91   0.825 -16.456  -5.214
  709    HG2  LYS  91          1HG       LYS  91   2.410 -16.318  -2.667
  710    HG3  LYS  91          2HG       LYS  91   2.436 -17.629  -3.847
  711    HD2  LYS  91          1HD       LYS  91   3.339 -16.158  -5.531
  712    HD3  LYS  91          2HD       LYS  91   3.187 -14.775  -4.449
  713    HE2  LYS  91          1HE       LYS  91   4.811 -15.799  -2.927
  714    HE3  LYS  91          2HE       LYS  91   4.973 -17.168  -4.026
  715    HZ1  LYS  91          1HZ       LYS  91   5.613 -14.349  -4.702
  716    HZ2  LYS  91          2HZ       LYS  91   5.830 -15.692  -5.709
  717    HZ3  LYS  91          3HZ       LYS  91   6.749 -15.535  -4.297
  718    H    ASN  92           H        ASN  92  -0.634 -14.372  -6.220
  719    HA   ASN  92           HA       ASN  92  -3.022 -13.224  -5.094
  720    HB2  ASN  92          1HB       ASN  92  -2.039 -12.536  -7.298
  721    HB3  ASN  92          2HB       ASN  92  -2.527 -14.098  -7.941
  722   HD21  ASN  92          1HD2      ASN  92  -3.761 -12.907  -9.479
  723   HD22  ASN  92          2HD2      ASN  92  -5.317 -12.280  -9.057
  724    H    THR  93           H        THR  93  -3.132 -15.309  -3.767
  725    HA   THR  93           HA       THR  93  -4.335 -17.600  -4.978
  726    HB   THR  93           HB       THR  93  -4.789 -18.247  -2.592
  727    HG1  THR  93           HG1      THR  93  -4.797 -16.611  -1.233
  728   HG21  THR  93          1HG2      THR  93  -2.738 -18.938  -3.669
  729   HG22  THR  93          2HG2      THR  93  -2.414 -18.513  -1.989
  730   HG23  THR  93          3HG2      THR  93  -1.983 -17.393  -3.281
  731    H    ASP  94           H        ASP  94  -5.477 -14.568  -3.866
  732    HA   ASP  94           HA       ASP  94  -8.188 -15.449  -3.386
  733    HB2  ASP  94          1HB       ASP  94  -7.038 -12.653  -3.565
  734    HB3  ASP  94          2HB       ASP  94  -8.685 -13.049  -3.061
  735    H    ASN  95           H        ASN  95  -6.335 -14.649  -6.048
  736    HA   ASN  95           HA       ASN  95  -6.723 -14.283  -8.233
  737    HB2  ASN  95          1HB       ASN  95  -9.382 -15.497  -7.511
  738    HB3  ASN  95          2HB       ASN  95  -8.891 -15.140  -9.157
  739   HD21  ASN  95          1HD2      ASN  95  -9.553 -17.684  -8.011
  740   HD22  ASN  95          2HD2      ASN  95  -8.147 -18.689  -8.190
  741    H    ASN  96           H        ASN  96  -7.277 -12.140  -6.342
  742    HA   ASN  96           HA       ASN  96  -8.854 -10.446  -8.106
  743    HB2  ASN  96          1HB       ASN  96 -10.554 -11.162  -6.587
  744    HB3  ASN  96          2HB       ASN  96  -9.505 -10.927  -5.192
  745   HD21  ASN  96          1HD2      ASN  96 -11.521  -9.407  -7.562
  746   HD22  ASN  96          2HD2      ASN  96 -11.598  -7.856  -6.797
  747    H    ALA  97           H        ALA  97  -7.925  -8.518  -8.332
  748    HA   ALA  97           HA       ALA  97  -5.353  -8.117  -7.236
  749    HB1  ALA  97          1HB       ALA  97  -7.027  -6.183  -8.823
  750    HB2  ALA  97          2HB       ALA  97  -5.967  -7.419  -9.499
  751    HB3  ALA  97          3HB       ALA  97  -5.287  -6.091  -8.557
  752    H    CYS  98           H        CYS  98  -8.502  -6.655  -6.463
  753    HA   CYS  98           HA       CYS  98  -7.495  -4.575  -4.825
  754    HB2  CYS  98          1HB       CYS  98 -10.126  -6.051  -4.533
  755    HB3  CYS  98          2HB       CYS  98  -9.716  -4.521  -3.771
  756    H    HIS  99           H        HIS  99  -8.325  -7.940  -4.137
  757    HA   HIS  99           HA       HIS  99  -7.841  -7.753  -1.328
  758    HB2  HIS  99          1HB       HIS  99  -8.137 -10.053  -3.248
  759    HB3  HIS  99          2HB       HIS  99  -7.679 -10.326  -1.573
  760    HD1  HIS  99           HD1      HIS  99 -10.545  -8.953  -3.634
  761    HD2  HIS  99           HD2      HIS  99  -9.762 -10.307   0.222
  762    HE1  HIS  99           HE1      HIS  99 -12.786  -9.153  -2.519
  763    HE2  HIS  99           HE2      HIS  99 -12.294  -9.969  -0.189
  764    H    TRP 100           H        TRP 100  -5.883  -8.384  -4.128
  765    HA   TRP 100           HA       TRP 100  -3.704  -9.595  -2.766
  766    HB2  TRP 100          1HB       TRP 100  -4.209  -9.789  -5.231
  767    HB3  TRP 100          2HB       TRP 100  -3.600  -8.145  -5.424
  768    HD1  TRP 100           HD1      TRP 100  -1.439  -9.716  -2.940
  769    HE1  TRP 100           HE1      TRP 100   0.704 -10.641  -4.017
  770    HE3  TRP 100           HE3      TRP 100  -2.852  -9.546  -7.850
  771    HZ2  TRP 100           HZ2      TRP 100   1.674 -11.221  -6.600
  772    HZ3  TRP 100           HZ3      TRP 100  -1.258 -10.302  -9.560
  773    HH2  TRP 100           HH2      TRP 100   0.957 -11.125  -8.954
  774    H    ALA 101           H        ALA 101  -4.202  -6.310  -4.052
  775    HA   ALA 101           HA       ALA 101  -1.748  -5.258  -3.138
  776    HB1  ALA 101          1HB       ALA 101  -4.318  -3.826  -3.786
  777    HB2  ALA 101          2HB       ALA 101  -3.030  -4.216  -4.925
  778    HB3  ALA 101          3HB       ALA 101  -2.734  -3.069  -3.616
  779    H    PHE 102           H        PHE 102  -5.010  -5.223  -1.765
  780    HA   PHE 102           HA       PHE 102  -4.427  -3.516   0.384
  781    HB2  PHE 102          1HB       PHE 102  -6.704  -3.913  -0.345
  782    HB3  PHE 102          2HB       PHE 102  -6.592  -5.605   0.132
  783    HD1  PHE 102           HD1      PHE 102  -7.214  -6.242   2.304
  784    HD2  PHE 102           HD2      PHE 102  -6.406  -2.150   1.462
  785    HE1  PHE 102           HE1      PHE 102  -8.011  -5.629   4.545
  786    HE2  PHE 102           HE2      PHE 102  -7.201  -1.527   3.705
  787    HZ   PHE 102           HZ       PHE 102  -8.005  -3.266   5.250
  788    H    ARG 103           H        ARG 103  -4.092  -6.956  -0.060
  789    HA   ARG 103           HA       ARG 103  -3.745  -7.635   2.683
  790    HB2  ARG 103          1HB       ARG 103  -4.434  -9.218   0.877
  791    HB3  ARG 103          2HB       ARG 103  -2.795  -9.132   0.254
  792    HG2  ARG 103          1HG       ARG 103  -1.900 -10.168   2.173
  793    HG3  ARG 103          2HG       ARG 103  -3.422 -10.011   3.044
  794    HD2  ARG 103          1HD       ARG 103  -2.745 -12.286   1.937
  795    HD3  ARG 103          2HD       ARG 103  -4.416 -11.726   1.895
  796    HE   ARG 103           HE       ARG 103  -3.664 -10.747  -0.378
  797   HH11  ARG 103          1HH1      ARG 103  -2.708 -13.844   0.947
  798   HH12  ARG 103          2HH1      ARG 103  -2.397 -14.547  -0.606
  799   HH21  ARG 103          1HH2      ARG 103  -3.276 -11.681  -2.413
  800   HH22  ARG 103          2HH2      ARG 103  -2.699 -13.314  -2.513
  801    H    GLY 104           H        GLY 104  -1.585  -6.767   0.040
  802    HA2  GLY 104          1HA       GLY 104   0.870  -7.257   1.376
  803    HA3  GLY 104          2HA       GLY 104   0.630  -6.137   0.029
  804    H    PHE 105           H        PHE 105  -1.131  -4.350   1.074
  805    HA   PHE 105           HA       PHE 105   0.542  -2.636   2.530
  806    HB2  PHE 105          1HB       PHE 105  -1.082  -1.687   1.082
  807    HB3  PHE 105          2HB       PHE 105  -2.391  -2.552   1.872
  808    HD1  PHE 105           HD1      PHE 105   0.381  -0.457   3.215
  809    HD2  PHE 105           HD2      PHE 105  -3.825  -0.970   2.775
  810    HE1  PHE 105           HE1      PHE 105  -0.011   1.527   4.617
  811    HE2  PHE 105           HE2      PHE 105  -4.216   1.006   4.180
  812    HZ   PHE 105           HZ       PHE 105  -2.309   2.258   5.105
  813    H    LYS 106           H        LYS 106  -2.239  -4.579   3.482
  814    HA   LYS 106           HA       LYS 106  -2.428  -3.697   6.142
  815    HB2  LYS 106          1HB       LYS 106  -4.348  -4.746   5.483
  816    HB3  LYS 106          2HB       LYS 106  -3.504  -5.991   4.571
  817    HG2  LYS 106          1HG       LYS 106  -2.870  -7.029   6.750
  818    HG3  LYS 106          2HG       LYS 106  -3.907  -5.838   7.547
  819    HD2  LYS 106          1HD       LYS 106  -5.846  -6.665   6.363
  820    HD3  LYS 106          2HD       LYS 106  -4.844  -7.766   5.417
  821    HE2  LYS 106          1HE       LYS 106  -4.239  -8.959   7.482
  822    HE3  LYS 106          2HE       LYS 106  -5.278  -7.874   8.402
  823    HZ1  LYS 106          1HZ       LYS 106  -6.237  -9.627   6.211
  824    HZ2  LYS 106          2HZ       LYS 106  -7.191  -8.706   7.267
  825    HZ3  LYS 106          3HZ       LYS 106  -6.311 -10.032   7.851
  826    H    CYS 107           H        CYS 107  -0.625  -6.348   4.673
  827    HA   CYS 107           HA       CYS 107   0.264  -7.552   7.046
  828    HB2  CYS 107          1HB       CYS 107   0.416  -8.808   5.050
  829    HB3  CYS 107          2HB       CYS 107   1.322  -7.551   4.217
  830    H    PHE 108           H        PHE 108   1.617  -5.000   5.030
  831    HA   PHE 108           HA       PHE 108   4.144  -4.988   6.366
  832    HB2  PHE 108          1HB       PHE 108   3.713  -4.398   3.946
  833    HB3  PHE 108          2HB       PHE 108   3.047  -2.873   4.525
  834    HD1  PHE 108           HD1      PHE 108   4.503  -1.167   5.468
  835    HD2  PHE 108           HD2      PHE 108   6.068  -4.860   4.036
  836    HE1  PHE 108           HE1      PHE 108   6.767  -0.209   5.468
  837    HE2  PHE 108           HE2      PHE 108   8.330  -3.906   4.043
  838    HZ   PHE 108           HZ       PHE 108   8.683  -1.578   4.753
  839    H    GLN 109           H        GLN 109   1.335  -2.795   6.319
  840    HA   GLN 109           HA       GLN 109   2.439  -0.802   7.944
  841    HB2  GLN 109          1HB       GLN 109   0.193   0.032   8.219
  842    HB3  GLN 109          2HB       GLN 109   0.430  -0.482   6.558
  843    HG2  GLN 109          1HG       GLN 109  -1.554  -1.467   6.825
  844    HG3  GLN 109          2HG       GLN 109  -0.633  -2.727   7.652
  845   HE21  GLN 109          1HE2      GLN 109  -3.402  -1.930   8.006
  846   HE22  GLN 109          2HE2      GLN 109  -3.572  -1.485   9.666
  847    H    LYS 110           H        LYS 110   1.134  -3.890   8.760
  848    HA   LYS 110           HA       LYS 110   0.357  -3.362  11.423
  849    HB2  LYS 110          1HB       LYS 110  -0.225  -5.376   9.981
  850    HB3  LYS 110          2HB       LYS 110   1.375  -5.994  10.358
  851    HG2  LYS 110          1HG       LYS 110   0.736  -5.790  12.784
  852    HG3  LYS 110          2HG       LYS 110  -0.902  -5.464  12.229
  853    HD2  LYS 110          1HD       LYS 110  -0.771  -7.635  10.950
  854    HD3  LYS 110          2HD       LYS 110   0.719  -7.966  11.832
  855    HE2  LYS 110          1HE       LYS 110  -2.010  -7.504  13.031
  856    HE3  LYS 110          2HE       LYS 110  -1.168  -9.046  12.912
  857    HZ1  LYS 110          1HZ       LYS 110   0.581  -8.112  14.346
  858    HZ2  LYS 110          2HZ       LYS 110  -0.924  -8.169  15.110
  859    HZ3  LYS 110          3HZ       LYS 110  -0.335  -6.697  14.525
  860    H    ASN 111           H        ASN 111   3.421  -3.889   9.899
  861    HA   ASN 111           HA       ASN 111   4.701  -4.118  12.545
  862    HB2  ASN 111          1HB       ASN 111   5.767  -5.121   9.902
  863    HB3  ASN 111          2HB       ASN 111   6.513  -5.326  11.484
  864   HD21  ASN 111          1HD2      ASN 111   5.667  -6.815  12.923
  865   HD22  ASN 111          2HD2      ASN 111   4.526  -8.022  12.444
  866    H    ASN 112           H        ASN 112   4.521  -2.351   9.582
  867    HA   ASN 112           HA       ASN 112   6.643  -0.566  10.540
  868    HB2  ASN 112          1HB       ASN 112   6.526  -1.916   7.854
  869    HB3  ASN 112          2HB       ASN 112   7.411  -0.404   8.104
  870   HD21  ASN 112          1HD2      ASN 112   8.032  -3.395   7.615
  871   HD22  ASN 112          2HD2      ASN 112   9.352  -3.685   8.703
  872    H    LEU 113           H        LEU 113   4.279   0.373  10.977
  873    HA   LEU 113           HA       LEU 113   3.166   1.666   8.656
  874    HB2  LEU 113          1HB       LEU 113   1.633   0.994  10.371
  875    HB3  LEU 113          2HB       LEU 113   2.491   1.933  11.579
  876    HG   LEU 113           HG       LEU 113   1.856   3.994  10.309
  877   HD11  LEU 113          1HD1      LEU 113   1.532   2.918   8.133
  878   HD12  LEU 113          2HD1      LEU 113   0.112   3.840   8.632
  879   HD13  LEU 113          3HD1      LEU 113   0.115   2.081   8.767
  880   HD21  LEU 113          1HD2      LEU 113  -0.432   2.254  11.215
  881   HD22  LEU 113          2HD2      LEU 113  -0.453   4.015  11.079
  882   HD23  LEU 113          3HD2      LEU 113   0.592   3.230  12.266
  883    H    SER 114           H        SER 114   5.248   2.503  11.332
  884    HA   SER 114           HA       SER 114   5.243   5.307  11.021
  885    HB2  SER 114          1HB       SER 114   7.596   3.649  11.957
  886    HB3  SER 114          2HB       SER 114   7.177   5.297  12.426
  887    HG   SER 114           HG       SER 114   5.087   4.068  13.116
  888    H    LEU 115           H        LEU 115   7.033   2.733   9.446
  889    HA   LEU 115           HA       LEU 115   8.857   4.365   8.034
  890    HB2  LEU 115          1HB       LEU 115   9.210   1.976   8.370
  891    HB3  LEU 115          2HB       LEU 115   7.804   1.615   7.387
  892    HG   LEU 115           HG       LEU 115   8.942   2.646   5.442
  893   HD11  LEU 115          1HD1      LEU 115  10.405   4.192   6.431
  894   HD12  LEU 115          2HD1      LEU 115  11.441   2.956   5.713
  895   HD13  LEU 115          3HD1      LEU 115  11.138   2.962   7.450
  896   HD21  LEU 115          1HD2      LEU 115  10.499   0.439   6.784
  897   HD22  LEU 115          2HD2      LEU 115  10.525   0.835   5.066
  898   HD23  LEU 115          3HD2      LEU 115   9.045   0.232   5.810
  899    H    ILE 116           H        ILE 116   5.605   3.223   7.382
  900    HA   ILE 116           HA       ILE 116   5.488   3.978   4.667
  901    HB   ILE 116           HB       ILE 116   3.296   3.588   6.710
  902   HG12  ILE 116          1HG1      ILE 116   4.249   1.866   4.408
  903   HG13  ILE 116          2HG1      ILE 116   4.655   1.606   6.110
  904   HG21  ILE 116          1HG2      ILE 116   1.735   3.517   4.830
  905   HG22  ILE 116          2HG2      ILE 116   3.039   3.948   3.728
  906   HG23  ILE 116          3HG2      ILE 116   2.509   5.098   4.956
  907   HD11  ILE 116          1HD1      ILE 116   1.935   1.430   4.841
  908   HD12  ILE 116          2HD1      ILE 116   2.238   1.311   6.573
  909   HD13  ILE 116          3HD1      ILE 116   2.904   0.102   5.475
  910    H    LYS 117           H        LYS 117   4.705   5.630   7.670
  911    HA   LYS 117           HA       LYS 117   3.689   7.997   6.531
  912    HB2  LYS 117          1HB       LYS 117   4.949   7.423   9.207
  913    HB3  LYS 117          2HB       LYS 117   4.290   8.999   8.783
  914    HG2  LYS 117          1HG       LYS 117   2.091   7.998   8.444
  915    HG3  LYS 117          2HG       LYS 117   2.735   6.407   8.838
  916    HD2  LYS 117          1HD       LYS 117   3.280   7.172  11.089
  917    HD3  LYS 117          2HD       LYS 117   2.693   8.788  10.699
  918    HE2  LYS 117          1HE       LYS 117   0.446   7.904  10.363
  919    HE3  LYS 117          2HE       LYS 117   1.026   6.272  10.690
  920    HZ1  LYS 117          1HZ       LYS 117   1.053   8.536  12.612
  921    HZ2  LYS 117          2HZ       LYS 117   1.616   6.973  12.927
  922    HZ3  LYS 117          3HZ       LYS 117  -0.029   7.235  12.632
  923    H    ALA 118           H        ALA 118   6.933   7.111   7.676
  924    HA   ALA 118           HA       ALA 118   8.200   9.558   7.056
  925    HB1  ALA 118          1HB       ALA 118  10.271   8.318   7.305
  926    HB2  ALA 118          2HB       ALA 118   9.380   6.796   7.219
  927    HB3  ALA 118          3HB       ALA 118   9.128   7.890   8.579
  928    H    SER 119           H        SER 119   7.536   6.689   5.192
  929    HA   SER 119           HA       SER 119   9.188   7.002   3.007
  930    HB2  SER 119          1HB       SER 119   7.783   5.028   3.398
  931    HB3  SER 119          2HB       SER 119   6.339   5.977   3.062
  932    HG   SER 119           HG       SER 119   8.412   5.785   1.164
  933    H    ILE 120           H        ILE 120   5.971   8.403   3.536
  934    HA   ILE 120           HA       ILE 120   6.150   9.832   0.994
  935    HB   ILE 120           HB       ILE 120   3.803  10.489   1.457
  936   HG12  ILE 120          1HG1      ILE 120   3.983   8.613   3.813
  937   HG13  ILE 120          2HG1      ILE 120   4.073  10.366   3.963
  938   HG21  ILE 120          1HG2      ILE 120   4.222   8.523   0.140
  939   HG22  ILE 120          2HG2      ILE 120   2.845   8.220   1.201
  940   HG23  ILE 120          3HG2      ILE 120   4.427   7.552   1.597
  941   HD11  ILE 120          1HD1      ILE 120   1.845   9.546   4.447
  942   HD12  ILE 120          2HD1      ILE 120   1.756   8.811   2.849
  943   HD13  ILE 120          3HD1      ILE 120   1.846  10.563   3.011
  944    H    LYS 121           H        LYS 121   7.237  10.402   4.009
  945    HA   LYS 121           HA       LYS 121   6.191  13.073   4.350
  946    HB2  LYS 121          1HB       LYS 121   6.603  11.504   6.253
  947    HB3  LYS 121          2HB       LYS 121   8.327  11.659   5.945
  948    HG2  LYS 121          1HG       LYS 121   7.660  13.098   7.777
  949    HG3  LYS 121          2HG       LYS 121   8.170  14.075   6.398
  950    HD2  LYS 121          1HD       LYS 121   5.845  14.449   5.782
  951    HD3  LYS 121          2HD       LYS 121   5.311  13.428   7.116
  952    HE2  LYS 121          1HE       LYS 121   6.303  14.982   8.710
  953    HE3  LYS 121          2HE       LYS 121   6.873  15.993   7.383
  954    HZ1  LYS 121          1HZ       LYS 121   4.028  15.405   7.993
  955    HZ2  LYS 121          2HZ       LYS 121   4.588  16.398   6.743
  956    HZ3  LYS 121          3HZ       LYS 121   4.832  16.847   8.355
  957    H    LYS 122           H        LYS 122   7.036  14.771   3.399
  958    HA   LYS 122           HA       LYS 122   9.892  15.170   3.258
  959    HB2  LYS 122          1HB       LYS 122   8.630  14.038   1.025
  960    HB3  LYS 122          2HB       LYS 122   8.778  15.734   0.645
  961    HG2  LYS 122          1HG       LYS 122  11.082  14.006   1.517
  962    HG3  LYS 122          2HG       LYS 122  10.677  14.375  -0.160
  963    HD2  LYS 122          1HD       LYS 122  10.984  16.757   0.284
  964    HD3  LYS 122          2HD       LYS 122  11.368  16.400   1.967
  965    HE2  LYS 122          1HE       LYS 122  13.409  16.765   0.740
  966    HE3  LYS 122          2HE       LYS 122  13.303  15.071   1.208
  967    HZ1  LYS 122          1HZ       LYS 122  12.612  16.142  -1.471
  968    HZ2  LYS 122          2HZ       LYS 122  12.585  14.516  -1.014
  969    HZ3  LYS 122          3HZ       LYS 122  14.052  15.350  -1.081
  970    H    ASP 123           H        ASP 123  10.370  17.249   3.424
  971    HA   ASP 123           HA       ASP 123   8.239  19.153   3.737
  972    HB2  ASP 123          1HB       ASP 123  10.157  19.267   5.223
  973    HB3  ASP 123          2HB       ASP 123  11.242  19.471   3.853
  974    H21  ACD 201           H21      ACD   1  -4.846   5.192   1.545
  975    H22  ACD 201           H22      ACD   1  -3.738   5.265   2.923
  976    H31  ACD 201           H31      ACD   1  -2.153   6.620   1.539
  977    H32  ACD 201           H32      ACD   1  -3.242   6.473   0.162
  978    H41  ACD 201           H41      ACD   1  -2.998   3.958   0.311
  979    H42  ACD 201           H42      ACD   1  -1.486   4.797  -0.067
  980    H5   ACD 201           H5       ACD   1  -2.162   3.386   2.569
  981    H6   ACD 201           H6       ACD   1   0.150   3.824   3.016
  982    H71  ACD 201           H71      ACD   1   0.663   4.741   0.327
  983    H72  ACD 201           H72      ACD   1  -0.189   6.095   1.066
  984    H8   ACD 201           H8       ACD   1   1.666   6.376   2.755
  985    H9   ACD 201           H9       ACD   1   3.766   5.482   2.063
  986   H101  ACD 201          H101      ACD   1   2.651   4.705  -0.506
  987   H102  ACD 201          H102      ACD   1   2.220   3.390   0.590
  988    H11  ACD 201           H11      ACD   1   5.172   4.309   0.393
  989    H12  ACD 201           H12      ACD   1   5.514   1.977   0.103
  990   H131  ACD 201          H131      ACD   1   2.519   1.950  -0.502
  991   H132  ACD 201          H132      ACD   1   3.636   0.589  -0.628
  992    H14  ACD 201           H14      ACD   1   2.578   1.643   2.095
  993    H15  ACD 201           H15      ACD   1   2.527  -0.696   2.552
  994   H161  ACD 201          H161      ACD   1   2.654  -1.378  -0.262
  995   H162  ACD 201          H162      ACD   1   4.320  -0.976   0.163
  996   H171  ACD 201          H171      ACD   1   4.389  -2.675   1.881
  997   H172  ACD 201          H172      ACD   1   2.653  -2.952   1.760
  998   H181  ACD 201          H181      ACD   1   4.651  -3.484  -0.475
  999   H182  ACD 201          H182      ACD   1   2.918  -3.817  -0.536
 1000   H191  ACD 201          H191      ACD   1   4.943  -5.094   1.358
 1001   H192  ACD 201          H192      ACD   1   3.198  -5.359   1.454
 1002   H201  ACD 201          H201      ACD   1   4.936  -6.004  -0.938
 1003   H202  ACD 201          H202      ACD   1   3.227  -6.269  -0.836
 1004   H203  ACD 201          H203      ACD   1   4.304  -7.150   0.195
  Start of MODEL   13
    1    H1   MET   1          1H        MET   1  14.361   7.807 -15.239
    2    H2   MET   1          2H        MET   1  14.730   8.478 -16.745
    3    H3   MET   1          3H        MET   1  14.097   9.453 -15.515
    4    HA   MET   1           HA       MET   1  16.721   8.087 -15.456
    5    HB2  MET   1          1HB       MET   1  16.008  11.002 -15.834
    6    HB3  MET   1          2HB       MET   1  17.634  10.417 -15.518
    7    HG2  MET   1          1HG       MET   1  17.479  10.795 -17.839
    8    HG3  MET   1          2HG       MET   1  17.448   9.049 -17.607
    9    HE1  MET   1          1HE       MET   1  14.625  11.814 -17.219
   10    HE2  MET   1          2HE       MET   1  13.836  11.663 -18.788
   11    HE3  MET   1          3HE       MET   1  15.502  12.233 -18.691
   12    H    GLU   2           H        GLU   2  15.077  10.885 -13.986
   13    HA   GLU   2           HA       GLU   2  16.257  10.224 -11.418
   14    HB2  GLU   2          1HB       GLU   2  14.441  12.506 -12.180
   15    HB3  GLU   2          2HB       GLU   2  15.318  12.336 -10.667
   16    HG2  GLU   2          1HG       GLU   2  16.583  12.598 -13.376
   17    HG3  GLU   2          2HG       GLU   2  16.373  13.913 -12.224
   18    H    PHE   3           H        PHE   3  15.258   9.002  -9.988
   19    HA   PHE   3           HA       PHE   3  12.653   7.987 -10.433
   20    HB2  PHE   3          1HB       PHE   3  14.289   6.662  -9.240
   21    HB3  PHE   3          2HB       PHE   3  14.390   7.875  -7.957
   22    HD1  PHE   3           HD1      PHE   3  12.033   5.541  -9.620
   23    HD2  PHE   3           HD2      PHE   3  13.022   7.713  -6.108
   24    HE1  PHE   3           HE1      PHE   3  10.226   4.386  -8.406
   25    HE2  PHE   3           HE2      PHE   3  11.217   6.570  -4.881
   26    HZ   PHE   3           HZ       PHE   3   9.817   4.901  -6.031
   27    H    THR   4           H        THR   4  10.764   8.790  -9.951
   28    HA   THR   4           HA       THR   4  10.624  11.206  -8.299
   29    HB   THR   4           HB       THR   4   8.160  10.336  -9.628
   30    HG1  THR   4           HG1      THR   4  10.552  10.829 -11.097
   31   HG21  THR   4          1HG2      THR   4   9.779  12.873  -9.681
   32   HG22  THR   4          2HG2      THR   4   8.431  12.515  -8.603
   33   HG23  THR   4          3HG2      THR   4   8.155  12.676 -10.335
   34    H    VAL   5           H        VAL   5  10.182  10.915  -6.262
   35    HA   VAL   5           HA       VAL   5   8.721   8.553  -5.358
   36    HB   VAL   5           HB       VAL   5   9.549   8.911  -3.266
   37   HG11  VAL   5          1HG1      VAL   5  11.785   9.850  -3.280
   38   HG12  VAL   5          2HG1      VAL   5  11.470  10.581  -4.853
   39   HG13  VAL   5          3HG1      VAL   5  11.481   8.827  -4.680
   40   HG21  VAL   5          1HG2      VAL   5   9.520  11.892  -3.727
   41   HG22  VAL   5          2HG2      VAL   5   9.983  11.090  -2.227
   42   HG23  VAL   5          3HG2      VAL   5   8.327  10.963  -2.819
   43    H    SER   6           H        SER   6   6.795   8.610  -4.233
   44    HA   SER   6           HA       SER   6   5.082  10.851  -4.981
   45    HB2  SER   6          1HB       SER   6   4.312   8.214  -3.701
   46    HB3  SER   6          2HB       SER   6   3.222   9.385  -4.443
   47    HG   SER   6           HG       SER   6   4.911   7.520  -5.621
   48    H    THR   7           H        THR   7   5.154  12.506  -3.562
   49    HA   THR   7           HA       THR   7   5.710  12.076  -0.770
   50    HB   THR   7           HB       THR   7   5.504  14.523  -0.553
   51    HG1  THR   7           HG1      THR   7   4.661  14.313  -3.273
   52   HG21  THR   7          1HG2      THR   7   7.115  13.713  -2.974
   53   HG22  THR   7          2HG2      THR   7   7.630  13.520  -1.300
   54   HG23  THR   7          3HG2      THR   7   7.385  15.133  -1.965
   55    H    THR   8           H        THR   8   4.294  13.462   0.805
   56    HA   THR   8           HA       THR   8   1.836  12.277   1.161
   57    HB   THR   8           HB       THR   8   2.667  15.023   2.102
   58    HG1  THR   8           HG1      THR   8   4.153  13.745   3.006
   59   HG21  THR   8          1HG2      THR   8   0.577  13.099   3.110
   60   HG22  THR   8          2HG2      THR   8   0.304  14.694   2.403
   61   HG23  THR   8          3HG2      THR   8   1.101  14.548   3.970
   62    H    GLU   9           H        GLU   9   2.516  15.414  -0.355
   63    HA   GLU   9           HA       GLU   9  -0.156  16.124  -0.801
   64    HB2  GLU   9          1HB       GLU   9   1.789  17.687  -0.924
   65    HB3  GLU   9          2HB       GLU   9   2.216  16.966  -2.469
   66    HG2  GLU   9          1HG       GLU   9   0.081  17.675  -3.397
   67    HG3  GLU   9          2HG       GLU   9  -0.361  18.383  -1.846
   68    H    ASP  10           H        ASP  10   2.176  14.374  -2.819
   69    HA   ASP  10           HA       ASP  10   0.527  14.111  -5.100
   70    HB2  ASP  10          1HB       ASP  10   2.637  12.157  -4.152
   71    HB3  ASP  10          2HB       ASP  10   1.946  12.253  -5.767
   72    H    LEU  11           H        LEU  11   0.896  12.214  -2.171
   73    HA   LEU  11           HA       LEU  11  -0.683  10.038  -2.956
   74    HB2  LEU  11          1HB       LEU  11   0.831   9.853  -1.101
   75    HB3  LEU  11          2HB       LEU  11  -0.056  11.086  -0.196
   76    HG   LEU  11           HG       LEU  11  -2.011   9.546  -0.166
   77   HD11  LEU  11          1HD1      LEU  11  -1.440   8.264  -2.161
   78   HD12  LEU  11          2HD1      LEU  11  -1.695   7.223  -0.765
   79   HD13  LEU  11          3HD1      LEU  11  -0.055   7.571  -1.316
   80   HD21  LEU  11          1HD2      LEU  11  -0.408   9.685   1.706
   81   HD22  LEU  11          2HD2      LEU  11   0.509   8.361   0.984
   82   HD23  LEU  11          3HD2      LEU  11  -1.139   8.087   1.548
   83    H    GLN  12           H        GLN  12  -1.473  13.108  -1.447
   84    HA   GLN  12           HA       GLN  12  -4.174  12.424  -0.856
   85    HB2  GLN  12          1HB       GLN  12  -2.811  15.106  -1.110
   86    HB3  GLN  12          2HB       GLN  12  -4.471  14.894  -0.570
   87    HG2  GLN  12          1HG       GLN  12  -3.686  13.576   1.331
   88    HG3  GLN  12          2HG       GLN  12  -2.024  13.784   0.786
   89   HE21  GLN  12          1HE2      GLN  12  -4.775  15.299   2.237
   90   HE22  GLN  12          2HE2      GLN  12  -3.956  16.713   2.808
   91    H    ARG  13           H        ARG  13  -2.506  13.508  -3.638
   92    HA   ARG  13           HA       ARG  13  -4.718  14.469  -5.138
   93    HB2  ARG  13          1HB       ARG  13  -2.336  14.964  -5.639
   94    HB3  ARG  13          2HB       ARG  13  -2.116  13.288  -6.114
   95    HG2  ARG  13          1HG       ARG  13  -3.799  13.616  -7.899
   96    HG3  ARG  13          2HG       ARG  13  -3.875  15.331  -7.448
   97    HD2  ARG  13          1HD       ARG  13  -1.540  13.797  -8.564
   98    HD3  ARG  13          2HD       ARG  13  -2.364  15.185  -9.271
   99    HE   ARG  13           HE       ARG  13  -1.445  16.479  -7.339
  100   HH11  ARG  13          1HH1      ARG  13   0.172  13.606  -8.529
  101   HH12  ARG  13          2HH1      ARG  13   1.709  14.034  -7.843
  102   HH21  ARG  13          1HH2      ARG  13   0.594  17.043  -6.450
  103   HH22  ARG  13          2HH2      ARG  13   1.946  15.966  -6.654
  104    H    TYR  14           H        TYR  14  -2.924  11.389  -5.163
  105    HA   TYR  14           HA       TYR  14  -4.602  10.064  -6.993
  106    HB2  TYR  14          1HB       TYR  14  -2.940   8.797  -4.805
  107    HB3  TYR  14          2HB       TYR  14  -3.554   8.007  -6.249
  108    HD1  TYR  14           HD1      TYR  14  -0.623   9.030  -4.930
  109    HD2  TYR  14           HD2      TYR  14  -2.939   9.654  -8.440
  110    HE1  TYR  14           HE1      TYR  14   1.415   9.650  -6.156
  111    HE2  TYR  14           HE2      TYR  14  -0.907  10.262  -9.682
  112    HH   TYR  14           HH       TYR  14   1.305  11.041  -9.317
  113    H    ARG  15           H        ARG  15  -4.693  10.311  -3.469
  114    HA   ARG  15           HA       ARG  15  -6.655   8.401  -3.005
  115    HB2  ARG  15          1HB       ARG  15  -5.932   8.988  -0.965
  116    HB3  ARG  15          2HB       ARG  15  -5.442  10.587  -1.490
  117    HG2  ARG  15          1HG       ARG  15  -7.830  11.305  -1.283
  118    HG3  ARG  15          2HG       ARG  15  -8.209   9.701  -0.652
  119    HD2  ARG  15          1HD       ARG  15  -6.356  11.738   0.601
  120    HD3  ARG  15          2HD       ARG  15  -7.950  11.268   1.183
  121    HE   ARG  15           HE       ARG  15  -6.457   8.942   1.093
  122   HH11  ARG  15          1HH1      ARG  15  -6.281  12.037   2.738
  123   HH12  ARG  15          2HH1      ARG  15  -5.456  11.394   4.122
  124   HH21  ARG  15          1HH2      ARG  15  -5.352   8.099   2.927
  125   HH22  ARG  15          2HH2      ARG  15  -4.951   9.176   4.235
  126    H    THR  16           H        THR  16  -6.891  11.816  -3.787
  127    HA   THR  16           HA       THR  16  -9.647  12.151  -3.505
  128    HB   THR  16           HB       THR  16  -7.609  13.566  -5.215
  129    HG1  THR  16           HG1      THR  16  -7.198  14.041  -3.138
  130   HG21  THR  16          1HG2      THR  16  -9.249  15.368  -5.474
  131   HG22  THR  16          2HG2      THR  16 -10.461  14.382  -4.656
  132   HG23  THR  16          3HG2      THR  16  -9.814  13.869  -6.217
  133    H    GLU  17           H        GLU  17  -7.696  11.442  -6.398
  134    HA   GLU  17           HA       GLU  17  -9.914  11.399  -8.141
  135    HB2  GLU  17          1HB       GLU  17  -8.149  11.644  -9.511
  136    HB3  GLU  17          2HB       GLU  17  -7.042  10.928  -8.352
  137    HG2  GLU  17          1HG       GLU  17  -7.556   8.724  -9.154
  138    HG3  GLU  17          2HG       GLU  17  -8.868   9.356 -10.153
  139    H    CYS  18           H        CYS  18  -8.205   8.820  -6.414
  140    HA   CYS  18           HA       CYS  18  -9.637   6.673  -7.551
  141    HB2  CYS  18          1HB       CYS  18  -8.208   6.891  -4.897
  142    HB3  CYS  18          2HB       CYS  18  -8.912   5.394  -5.524
  143    H    VAL  19           H        VAL  19 -10.318   8.815  -4.863
  144    HA   VAL  19           HA       VAL  19 -12.475   7.354  -3.790
  145    HB   VAL  19           HB       VAL  19 -11.581  10.197  -3.545
  146   HG11  VAL  19          1HG1      VAL  19 -14.017  10.334  -3.684
  147   HG12  VAL  19          2HG1      VAL  19 -13.435  10.703  -2.059
  148   HG13  VAL  19          3HG1      VAL  19 -14.157   9.130  -2.400
  149   HG21  VAL  19          1HG2      VAL  19 -11.482   9.553  -1.155
  150   HG22  VAL  19          2HG2      VAL  19 -10.466   8.551  -2.192
  151   HG23  VAL  19          3HG2      VAL  19 -12.010   7.931  -1.608
  152    H    SER  20           H        SER  20 -12.409  10.160  -5.954
  153    HA   SER  20           HA       SER  20 -15.193  10.240  -6.381
  154    HB2  SER  20          1HB       SER  20 -13.611  12.118  -6.767
  155    HB3  SER  20          2HB       SER  20 -12.986  11.271  -8.179
  156    HG   SER  20           HG       SER  20 -15.178  11.349  -9.011
  157    H    SER  21           H        SER  21 -12.736   8.209  -7.740
  158    HA   SER  21           HA       SER  21 -14.283   7.587 -10.119
  159    HB2  SER  21          1HB       SER  21 -11.783   7.754 -10.135
  160    HB3  SER  21          2HB       SER  21 -11.727   6.313  -9.125
  161    HG   SER  21           HG       SER  21 -11.987   6.503 -11.784
  162    H    LEU  22           H        LEU  22 -13.175   5.876  -7.173
  163    HA   LEU  22           HA       LEU  22 -14.667   3.518  -7.926
  164    HB2  LEU  22          1HB       LEU  22 -12.957   4.218  -5.550
  165    HB3  LEU  22          2HB       LEU  22 -13.830   2.687  -5.675
  166    HG   LEU  22           HG       LEU  22 -11.828   3.618  -7.724
  167   HD11  LEU  22          1HD1      LEU  22 -10.270   2.042  -6.659
  168   HD12  LEU  22          2HD1      LEU  22 -11.441   1.783  -5.363
  169   HD13  LEU  22          3HD1      LEU  22 -10.704   3.370  -5.582
  170   HD21  LEU  22          1HD2      LEU  22 -13.008   0.911  -7.127
  171   HD22  LEU  22          2HD2      LEU  22 -11.863   1.298  -8.413
  172   HD23  LEU  22          3HD2      LEU  22 -13.493   1.968  -8.455
  173    H    ASN  23           H        ASN  23 -15.796   6.284  -6.967
  174    HA   ASN  23           HA       ASN  23 -17.657   7.050  -5.903
  175    HB2  ASN  23          1HB       ASN  23 -18.493   4.149  -5.992
  176    HB3  ASN  23          2HB       ASN  23 -19.550   5.518  -5.711
  177   HD21  ASN  23          1HD2      ASN  23 -20.086   6.874  -7.418
  178   HD22  ASN  23          2HD2      ASN  23 -19.814   6.419  -9.068
  179    H    ILE  24           H        ILE  24 -15.407   6.329  -4.267
  180    HA   ILE  24           HA       ILE  24 -16.142   4.873  -1.974
  181    HB   ILE  24           HB       ILE  24 -14.082   7.075  -2.127
  182   HG12  ILE  24          1HG1      ILE  24 -13.737   5.408  -3.933
  183   HG13  ILE  24          2HG1      ILE  24 -12.451   5.358  -2.729
  184   HG21  ILE  24          1HG2      ILE  24 -12.988   5.804  -0.326
  185   HG22  ILE  24          2HG2      ILE  24 -14.350   4.681  -0.311
  186   HG23  ILE  24          3HG2      ILE  24 -14.594   6.371   0.130
  187   HD11  ILE  24          1HD1      ILE  24 -14.760   3.440  -2.941
  188   HD12  ILE  24          2HD1      ILE  24 -13.481   3.381  -1.727
  189   HD13  ILE  24          3HD1      ILE  24 -13.094   3.130  -3.431
  190    HA   PRO  25           HA       PRO  25 -18.964   7.867  -0.177
  191    HB2  PRO  25          1HB       PRO  25 -18.572   6.186   2.212
  192    HB3  PRO  25          2HB       PRO  25 -20.060   6.621   1.368
  193    HG2  PRO  25          1HG       PRO  25 -19.022   4.157   1.227
  194    HG3  PRO  25          2HG       PRO  25 -19.874   4.908  -0.134
  195    HD2  PRO  25          1HD       PRO  25 -16.939   4.516   0.287
  196    HD3  PRO  25          2HD       PRO  25 -17.891   4.443  -1.217
  197    H    ALA  26           H        ALA  26 -18.699   9.629   1.003
  198    HA   ALA  26           HA       ALA  26 -16.188  10.623   1.636
  199    HB1  ALA  26          1HB       ALA  26 -18.168  11.995   1.212
  200    HB2  ALA  26          2HB       ALA  26 -17.364  12.449   2.715
  201    HB3  ALA  26          3HB       ALA  26 -18.843  11.488   2.760
  202    H    ASP  27           H        ASP  27 -18.448   8.844   3.638
  203    HA   ASP  27           HA       ASP  27 -17.374   9.284   6.163
  204    HB2  ASP  27          1HB       ASP  27 -19.443   8.056   5.821
  205    HB3  ASP  27          2HB       ASP  27 -18.559   6.733   5.067
  206    H    TYR  28           H        TYR  28 -16.504   6.756   3.804
  207    HA   TYR  28           HA       TYR  28 -14.450   5.598   5.278
  208    HB2  TYR  28          1HB       TYR  28 -15.070   5.715   2.349
  209    HB3  TYR  28          2HB       TYR  28 -13.611   4.905   2.921
  210    HD1  TYR  28           HD1      TYR  28 -13.746   2.743   3.952
  211    HD2  TYR  28           HD2      TYR  28 -17.299   4.900   3.048
  212    HE1  TYR  28           HE1      TYR  28 -15.080   0.733   4.419
  213    HE2  TYR  28           HE2      TYR  28 -18.642   2.897   3.506
  214    HH   TYR  28           HH       TYR  28 -18.252   0.376   3.483
  215    H    VAL  29           H        VAL  29 -14.470   8.364   3.122
  216    HA   VAL  29           HA       VAL  29 -11.729   8.777   2.828
  217    HB   VAL  29           HB       VAL  29 -13.916  10.847   2.949
  218   HG11  VAL  29          1HG1      VAL  29 -11.760  11.897   3.212
  219   HG12  VAL  29          2HG1      VAL  29 -12.349  12.198   1.577
  220   HG13  VAL  29          3HG1      VAL  29 -11.110  10.973   1.858
  221   HG21  VAL  29          1HG2      VAL  29 -12.725   9.318   0.646
  222   HG22  VAL  29          2HG2      VAL  29 -13.854  10.665   0.490
  223   HG23  VAL  29          3HG2      VAL  29 -14.366   9.171   1.276
  224    H    GLU  30           H        GLU  30 -13.954   9.945   5.361
  225    HA   GLU  30           HA       GLU  30 -12.090  11.444   6.848
  226    HB2  GLU  30          1HB       GLU  30 -14.323   9.887   8.131
  227    HB3  GLU  30          2HB       GLU  30 -13.618  11.425   8.611
  228    HG2  GLU  30          1HG       GLU  30 -14.533  12.430   6.548
  229    HG3  GLU  30          2HG       GLU  30 -15.385  10.920   6.251
  230    H    LYS  31           H        LYS  31 -12.838   8.010   6.838
  231    HA   LYS  31           HA       LYS  31 -11.330   7.276   9.100
  232    HB2  LYS  31          1HB       LYS  31 -11.890   5.645   6.617
  233    HB3  LYS  31          2HB       LYS  31 -11.285   5.015   8.153
  234    HG2  LYS  31          1HG       LYS  31 -13.364   5.762   9.241
  235    HG3  LYS  31          2HG       LYS  31 -13.971   6.286   7.669
  236    HD2  LYS  31          1HD       LYS  31 -13.603   3.925   6.860
  237    HD3  LYS  31          2HD       LYS  31 -13.276   3.485   8.548
  238    HE2  LYS  31          1HE       LYS  31 -15.817   4.851   7.680
  239    HE3  LYS  31          2HE       LYS  31 -15.646   3.095   7.731
  240    HZ1  LYS  31          1HZ       LYS  31 -15.207   4.886  10.059
  241    HZ2  LYS  31          2HZ       LYS  31 -15.245   3.195  10.071
  242    HZ3  LYS  31          3HZ       LYS  31 -16.652   4.070   9.743
  243    H    PHE  32           H        PHE  32 -10.499   7.209   5.645
  244    HA   PHE  32           HA       PHE  32  -7.864   6.331   5.926
  245    HB2  PHE  32          1HB       PHE  32  -8.926   8.115   3.735
  246    HB3  PHE  32          2HB       PHE  32  -7.532   7.045   3.641
  247    HD1  PHE  32           HD1      PHE  32 -10.205   7.220   1.960
  248    HD2  PHE  32           HD2      PHE  32  -8.786   4.675   5.061
  249    HE1  PHE  32           HE1      PHE  32 -11.660   5.414   1.143
  250    HE2  PHE  32           HE2      PHE  32 -10.241   2.868   4.250
  251    HZ   PHE  32           HZ       PHE  32 -11.677   3.232   2.283
  252    H    LYS  33           H        LYS  33  -9.258   9.522   6.109
  253    HA   LYS  33           HA       LYS  33  -6.949  11.097   6.029
  254    HB2  LYS  33          1HB       LYS  33  -9.453  11.784   6.098
  255    HB3  LYS  33          2HB       LYS  33  -9.265  11.691   7.848
  256    HG2  LYS  33          1HG       LYS  33  -7.551  13.367   7.819
  257    HG3  LYS  33          2HG       LYS  33  -7.563  13.401   6.050
  258    HD2  LYS  33          1HD       LYS  33  -8.798  15.297   6.921
  259    HD3  LYS  33          2HD       LYS  33  -9.899  14.187   6.107
  260    HE2  LYS  33          1HE       LYS  33 -10.910  14.960   8.151
  261    HE3  LYS  33          2HE       LYS  33 -10.524  13.249   8.305
  262    HZ1  LYS  33          1HZ       LYS  33  -8.565  13.829   9.575
  263    HZ2  LYS  33          2HZ       LYS  33  -9.936  14.502  10.293
  264    HZ3  LYS  33          3HZ       LYS  33  -8.891  15.476   9.394
  265    H    LYS  34           H        LYS  34  -8.286   9.092   8.561
  266    HA   LYS  34           HA       LYS  34  -6.217  10.030  10.421
  267    HB2  LYS  34          1HB       LYS  34  -8.795   8.532  10.853
  268    HB3  LYS  34          2HB       LYS  34  -7.569   8.645  12.109
  269    HG2  LYS  34          1HG       LYS  34  -7.758  11.101  12.020
  270    HG3  LYS  34          2HG       LYS  34  -9.035  10.935  10.813
  271    HD2  LYS  34          1HD       LYS  34  -9.116   9.825  13.618
  272    HD3  LYS  34          2HD       LYS  34  -9.939  11.286  13.073
  273    HE2  LYS  34          1HE       LYS  34 -11.258   9.965  11.500
  274    HE3  LYS  34          2HE       LYS  34 -10.420   8.502  12.013
  275    HZ1  LYS  34          1HZ       LYS  34 -12.579   8.728  13.075
  276    HZ2  LYS  34          2HZ       LYS  34 -12.115  10.206  13.756
  277    HZ3  LYS  34          3HZ       LYS  34 -11.334   8.780  14.220
  278    H    TRP  35           H        TRP  35  -6.049   8.095   8.082
  279    HA   TRP  35           HA       TRP  35  -5.109   6.125   7.493
  280    HB2  TRP  35          1HB       TRP  35  -3.725   6.630  10.117
  281    HB3  TRP  35          2HB       TRP  35  -3.284   5.293   9.047
  282    HD1  TRP  35           HD1      TRP  35  -3.399   9.153   9.069
  283    HE1  TRP  35           HE1      TRP  35  -1.626  10.030   7.423
  284    HE3  TRP  35           HE3      TRP  35  -1.849   4.698   7.094
  285    HZ2  TRP  35           HZ2      TRP  35   0.185   8.975   5.553
  286    HZ3  TRP  35           HZ3      TRP  35  -0.092   4.723   5.386
  287    HH2  TRP  35           HH2      TRP  35   0.911   6.809   4.626
  288    H    GLU  36           H        GLU  36  -7.620   5.791   8.519
  289    HA   GLU  36           HA       GLU  36  -7.434   3.259   9.998
  290    HB2  GLU  36          1HB       GLU  36  -9.766   5.144   9.642
  291    HB3  GLU  36          2HB       GLU  36  -9.855   3.591  10.456
  292    HG2  GLU  36          1HG       GLU  36  -8.030   5.802  11.322
  293    HG3  GLU  36          2HG       GLU  36  -9.668   5.605  11.934
  294    H    PHE  37           H        PHE  37  -7.390   1.609   8.624
  295    HA   PHE  37           HA       PHE  37  -9.070   1.762   6.203
  296    HB2  PHE  37          1HB       PHE  37  -6.567   0.098   6.564
  297    HB3  PHE  37          2HB       PHE  37  -7.470   0.330   5.072
  298    HD1  PHE  37           HD1      PHE  37  -5.259   1.953   7.525
  299    HD2  PHE  37           HD2      PHE  37  -7.130   2.260   3.713
  300    HE1  PHE  37           HE1      PHE  37  -3.832   3.881   6.984
  301    HE2  PHE  37           HE2      PHE  37  -5.709   4.191   3.172
  302    HZ   PHE  37           HZ       PHE  37  -4.057   5.005   4.807
  303    HA   PRO  38           HA       PRO  38 -11.074  -1.662   8.503
  304    HB2  PRO  38          1HB       PRO  38 -13.135  -1.080   6.465
  305    HB3  PRO  38          2HB       PRO  38 -13.290  -1.225   8.225
  306    HG2  PRO  38          1HG       PRO  38 -13.461   1.156   7.048
  307    HG3  PRO  38          2HG       PRO  38 -12.613   0.962   8.594
  308    HD2  PRO  38          1HD       PRO  38 -11.451   1.170   5.825
  309    HD3  PRO  38          2HD       PRO  38 -10.928   1.973   7.338
  310    H    GLU  39           H        GLU  39 -11.220  -3.762   7.926
  311    HA   GLU  39           HA       GLU  39 -10.227  -4.553   5.359
  312    HB2  GLU  39          1HB       GLU  39  -9.725  -5.797   7.447
  313    HB3  GLU  39          2HB       GLU  39 -11.414  -6.267   7.543
  314    HG2  GLU  39          1HG       GLU  39 -11.197  -7.422   5.390
  315    HG3  GLU  39          2HG       GLU  39  -9.490  -6.983   5.346
  316    H    ASP  40           H        ASP  40 -11.781  -3.584   4.027
  317    HA   ASP  40           HA       ASP  40 -14.194  -5.187   3.673
  318    HB2  ASP  40          1HB       ASP  40 -15.660  -3.592   4.242
  319    HB3  ASP  40          2HB       ASP  40 -14.320  -2.645   4.874
  320    H    ASP  41           H        ASP  41 -15.067  -5.066   1.530
  321    HA   ASP  41           HA       ASP  41 -13.103  -5.229  -0.427
  322    HB2  ASP  41          1HB       ASP  41 -15.333  -6.274  -0.597
  323    HB3  ASP  41          2HB       ASP  41 -16.045  -4.689  -0.868
  324    H    THR  42           H        THR  42 -15.242  -2.509   0.325
  325    HA   THR  42           HA       THR  42 -14.650  -0.837  -1.823
  326    HB   THR  42           HB       THR  42 -15.282  -0.042   1.020
  327    HG1  THR  42           HG1      THR  42 -17.070  -1.070   0.514
  328   HG21  THR  42          1HG2      THR  42 -15.543   1.444  -1.591
  329   HG22  THR  42          2HG2      THR  42 -14.497   1.859  -0.232
  330   HG23  THR  42          3HG2      THR  42 -16.249   1.978  -0.067
  331    H    THR  43           H        THR  43 -13.224  -0.743   1.453
  332    HA   THR  43           HA       THR  43 -11.230   1.133   0.957
  333    HB   THR  43           HB       THR  43 -11.104  -1.219   2.856
  334    HG1  THR  43           HG1      THR  43 -12.939   0.031   3.301
  335   HG21  THR  43          1HG2      THR  43  -9.613   1.409   2.811
  336   HG22  THR  43          2HG2      THR  43  -8.924  -0.201   2.605
  337   HG23  THR  43          3HG2      THR  43  -9.599   0.276   4.164
  338    H    MET  44           H        MET  44 -11.311  -2.308   0.311
  339    HA   MET  44           HA       MET  44  -8.546  -2.692  -0.087
  340    HB2  MET  44          1HB       MET  44 -10.900  -4.241  -1.165
  341    HB3  MET  44          2HB       MET  44  -9.228  -4.786  -1.234
  342    HG2  MET  44          1HG       MET  44  -9.120  -4.845   1.178
  343    HG3  MET  44          2HG       MET  44 -10.748  -4.187   1.290
  344    HE1  MET  44          1HE       MET  44 -11.598  -6.048   2.850
  345    HE2  MET  44          2HE       MET  44  -9.964  -6.712   2.892
  346    HE3  MET  44          3HE       MET  44 -11.339  -7.773   2.576
  347    H    CYS  45           H        CYS  45 -11.195  -2.169  -2.424
  348    HA   CYS  45           HA       CYS  45  -9.480  -2.137  -4.683
  349    HB2  CYS  45          1HB       CYS  45 -12.250  -0.968  -4.338
  350    HB3  CYS  45          2HB       CYS  45 -11.400  -1.079  -5.875
  351    H    TYR  46           H        TYR  46 -10.492   0.319  -2.410
  352    HA   TYR  46           HA       TYR  46  -9.631   2.586  -3.798
  353    HB2  TYR  46          1HB       TYR  46 -10.913   2.985  -1.880
  354    HB3  TYR  46          2HB       TYR  46  -9.922   1.924  -0.879
  355    HD1  TYR  46           HD1      TYR  46  -9.711   5.126  -2.808
  356    HD2  TYR  46           HD2      TYR  46  -8.345   2.863   0.533
  357    HE1  TYR  46           HE1      TYR  46  -8.447   7.073  -2.004
  358    HE2  TYR  46           HE2      TYR  46  -7.073   4.806   1.335
  359    HH   TYR  46           HH       TYR  46  -6.254   6.847   0.742
  360    H    ILE  47           H        ILE  47  -7.922   0.473  -1.517
  361    HA   ILE  47           HA       ILE  47  -5.430   1.733  -1.628
  362    HB   ILE  47           HB       ILE  47  -6.128  -1.148  -1.087
  363   HG12  ILE  47          1HG1      ILE  47  -7.027   0.409   0.556
  364   HG13  ILE  47          2HG1      ILE  47  -5.705  -0.502   1.278
  365   HG21  ILE  47          1HG2      ILE  47  -3.475   0.245  -0.741
  366   HG22  ILE  47          2HG2      ILE  47  -3.838  -1.078  -1.849
  367   HG23  ILE  47          3HG2      ILE  47  -3.867  -1.353  -0.106
  368   HD11  ILE  47          1HD1      ILE  47  -4.225   1.473   0.782
  369   HD12  ILE  47          2HD1      ILE  47  -5.483   1.738   1.988
  370   HD13  ILE  47          3HD1      ILE  47  -5.692   2.355   0.349
  371    H    LYS  48           H        LYS  48  -6.882  -0.740  -3.671
  372    HA   LYS  48           HA       LYS  48  -4.635  -1.440  -5.172
  373    HB2  LYS  48          1HB       LYS  48  -6.769  -2.683  -5.229
  374    HB3  LYS  48          2HB       LYS  48  -7.520  -1.339  -6.070
  375    HG2  LYS  48          1HG       LYS  48  -5.967  -1.657  -7.950
  376    HG3  LYS  48          2HG       LYS  48  -5.258  -3.035  -7.103
  377    HD2  LYS  48          1HD       LYS  48  -7.234  -4.301  -7.292
  378    HD3  LYS  48          2HD       LYS  48  -8.193  -2.888  -7.730
  379    HE2  LYS  48          1HE       LYS  48  -5.962  -3.981  -9.434
  380    HE3  LYS  48          2HE       LYS  48  -7.650  -4.456  -9.621
  381    HZ1  LYS  48          1HZ       LYS  48  -6.557  -1.709  -9.925
  382    HZ2  LYS  48          2HZ       LYS  48  -8.193  -2.115 -10.024
  383    HZ3  LYS  48          3HZ       LYS  48  -7.105  -2.716 -11.168
  384    H    CYS  49           H        CYS  49  -7.169   0.964  -5.873
  385    HA   CYS  49           HA       CYS  49  -6.096   1.896  -8.263
  386    HB2  CYS  49          1HB       CYS  49  -8.324   2.464  -7.733
  387    HB3  CYS  49          2HB       CYS  49  -7.863   3.254  -6.226
  388    H    VAL  50           H        VAL  50  -5.598   3.099  -4.950
  389    HA   VAL  50           HA       VAL  50  -4.017   5.296  -5.647
  390    HB   VAL  50           HB       VAL  50  -4.257   3.739  -3.084
  391   HG11  VAL  50          1HG1      VAL  50  -3.131   5.634  -1.991
  392   HG12  VAL  50          2HG1      VAL  50  -2.776   6.320  -3.576
  393   HG13  VAL  50          3HG1      VAL  50  -2.062   4.778  -3.102
  394   HG21  VAL  50          1HG2      VAL  50  -5.308   6.402  -3.992
  395   HG22  VAL  50          2HG2      VAL  50  -5.505   5.731  -2.372
  396   HG23  VAL  50          3HG2      VAL  50  -6.241   4.924  -3.757
  397    H    PHE  51           H        PHE  51  -3.124   2.040  -4.561
  398    HA   PHE  51           HA       PHE  51  -0.353   2.422  -4.578
  399    HB2  PHE  51          1HB       PHE  51  -2.199   0.112  -4.479
  400    HB3  PHE  51          2HB       PHE  51  -0.567  -0.234  -5.031
  401    HD1  PHE  51           HD1      PHE  51  -1.423   2.361  -2.551
  402    HD2  PHE  51           HD2      PHE  51   0.095  -1.565  -3.191
  403    HE1  PHE  51           HE1      PHE  51  -0.682   2.266  -0.207
  404    HE2  PHE  51           HE2      PHE  51   0.837  -1.664  -0.849
  405    HZ   PHE  51           HZ       PHE  51   0.449   0.254   0.645
  406    H    ASN  52           H        ASN  52  -2.632   1.709  -7.079
  407    HA   ASN  52           HA       ASN  52  -0.683   0.865  -9.021
  408    HB2  ASN  52          1HB       ASN  52  -3.018   0.059  -9.078
  409    HB3  ASN  52          2HB       ASN  52  -3.573   1.708  -9.389
  410   HD21  ASN  52          1HD2      ASN  52  -0.683   0.244 -10.767
  411   HD22  ASN  52          2HD2      ASN  52  -1.257   0.236 -12.397
  412    H    LYS  53           H        LYS  53  -2.419   3.809  -8.223
  413    HA   LYS  53           HA       LYS  53  -1.576   5.297 -10.489
  414    HB2  LYS  53          1HB       LYS  53  -2.773   6.004  -7.836
  415    HB3  LYS  53          2HB       LYS  53  -2.237   7.271  -8.931
  416    HG2  LYS  53          1HG       LYS  53  -4.286   5.145  -9.559
  417    HG3  LYS  53          2HG       LYS  53  -4.645   6.811  -9.109
  418    HD2  LYS  53          1HD       LYS  53  -3.498   7.609 -11.114
  419    HD3  LYS  53          2HD       LYS  53  -3.093   5.947 -11.550
  420    HE2  LYS  53          1HE       LYS  53  -5.894   7.021 -11.249
  421    HE3  LYS  53          2HE       LYS  53  -5.049   6.827 -12.784
  422    HZ1  LYS  53          1HZ       LYS  53  -5.693   4.631 -10.891
  423    HZ2  LYS  53          2HZ       LYS  53  -4.928   4.457 -12.389
  424    HZ3  LYS  53          3HZ       LYS  53  -6.534   4.972 -12.315
  425    H    MET  54           H        MET  54  -0.214   4.597  -7.392
  426    HA   MET  54           HA       MET  54   1.867   6.599  -7.616
  427    HB2  MET  54          1HB       MET  54   1.299   4.431  -5.595
  428    HB3  MET  54          2HB       MET  54   2.686   5.514  -5.490
  429    HG2  MET  54          1HG       MET  54   1.311   7.396  -5.180
  430    HG3  MET  54          2HG       MET  54  -0.135   6.516  -5.657
  431    HE1  MET  54          1HE       MET  54   2.301   7.501  -2.959
  432    HE2  MET  54          2HE       MET  54   2.822   5.816  -2.965
  433    HE3  MET  54          3HE       MET  54   1.935   6.465  -1.582
  434    H    GLN  55           H        GLN  55   1.323   3.843  -9.155
  435    HA   GLN  55           HA       GLN  55   2.476   2.247 -10.205
  436    HB2  GLN  55          1HB       GLN  55   4.489   4.453 -10.054
  437    HB3  GLN  55          2HB       GLN  55   4.860   2.934 -10.887
  438    HG2  GLN  55          1HG       GLN  55   2.903   3.290 -12.321
  439    HG3  GLN  55          2HG       GLN  55   2.585   4.805 -11.488
  440   HE21  GLN  55          1HE2      GLN  55   4.580   3.143 -13.751
  441   HE22  GLN  55          2HE2      GLN  55   5.418   4.531 -14.359
  442    H    LEU  56           H        LEU  56   2.341   1.935  -7.432
  443    HA   LEU  56           HA       LEU  56   4.952   0.853  -6.713
  444    HB2  LEU  56          1HB       LEU  56   2.812   2.213  -5.243
  445    HB3  LEU  56          2HB       LEU  56   3.469   0.808  -4.390
  446    HG   LEU  56           HG       LEU  56   5.058   3.159  -5.427
  447   HD11  LEU  56          1HD1      LEU  56   5.303   3.768  -3.068
  448   HD12  LEU  56          2HD1      LEU  56   4.211   2.462  -2.620
  449   HD13  LEU  56          3HD1      LEU  56   3.618   3.816  -3.578
  450   HD21  LEU  56          1HD2      LEU  56   5.836   0.780  -3.758
  451   HD22  LEU  56          2HD2      LEU  56   6.847   2.203  -4.005
  452   HD23  LEU  56          3HD2      LEU  56   6.418   1.178  -5.375
  453    H    PHE  57           H        PHE  57   1.804   0.031  -7.609
  454    HA   PHE  57           HA       PHE  57   2.352  -2.793  -7.076
  455    HB2  PHE  57          1HB       PHE  57   0.790  -2.155  -5.323
  456    HB3  PHE  57          2HB       PHE  57  -0.263  -1.371  -6.492
  457    HD1  PHE  57           HD1      PHE  57  -1.826  -2.619  -7.788
  458    HD2  PHE  57           HD2      PHE  57   0.938  -4.609  -5.229
  459    HE1  PHE  57           HE1      PHE  57  -3.109  -4.701  -8.030
  460    HE2  PHE  57           HE2      PHE  57  -0.345  -6.696  -5.470
  461    HZ   PHE  57           HZ       PHE  57  -2.367  -6.741  -6.870
  462    H    ASP  58           H        ASP  58   1.906  -4.081  -8.758
  463    HA   ASP  58           HA       ASP  58   0.640  -2.855 -11.119
  464    HB2  ASP  58          1HB       ASP  58   3.012  -3.337 -11.485
  465    HB3  ASP  58          2HB       ASP  58   2.779  -4.999 -10.966
  466    H    ASP  59           H        ASP  59  -0.844  -4.043 -12.274
  467    HA   ASP  59           HA       ASP  59  -2.543  -5.679 -10.701
  468    HB2  ASP  59          1HB       ASP  59  -3.926  -5.832 -12.702
  469    HB3  ASP  59          2HB       ASP  59  -3.371  -4.185 -12.479
  470    H    THR  60           H        THR  60   0.124  -6.411 -12.692
  471    HA   THR  60           HA       THR  60  -0.767  -9.183 -13.039
  472    HB   THR  60           HB       THR  60   1.173  -7.465 -14.559
  473    HG1  THR  60           HG1      THR  60  -1.164  -7.413 -14.981
  474   HG21  THR  60          1HG2      THR  60   0.695 -10.427 -14.893
  475   HG22  THR  60          2HG2      THR  60   2.189  -9.660 -14.344
  476   HG23  THR  60          3HG2      THR  60   1.621  -9.405 -15.995
  477    H    GLU  61           H        GLU  61   2.227  -7.320 -12.470
  478    HA   GLU  61           HA       GLU  61   3.621  -9.649 -11.490
  479    HB2  GLU  61          1HB       GLU  61   4.585  -6.814 -11.234
  480    HB3  GLU  61          2HB       GLU  61   5.524  -8.292 -11.340
  481    HG2  GLU  61          1HG       GLU  61   4.855  -8.580 -13.652
  482    HG3  GLU  61          2HG       GLU  61   3.896  -7.105 -13.562
  483    H    GLY  62           H        GLY  62   1.571  -7.339 -10.064
  484    HA2  GLY  62          1HA       GLY  62   0.897  -7.212  -7.838
  485    HA3  GLY  62          2HA       GLY  62   2.184  -8.350  -7.425
  486    HA   PRO  63           HA       PRO  63   3.530  -4.363  -5.556
  487    HB2  PRO  63          1HB       PRO  63   5.146  -6.268  -3.979
  488    HB3  PRO  63          2HB       PRO  63   4.074  -4.976  -3.428
  489    HG2  PRO  63          1HG       PRO  63   3.425  -7.581  -3.198
  490    HG3  PRO  63          2HG       PRO  63   2.215  -6.315  -3.466
  491    HD2  PRO  63          1HD       PRO  63   3.350  -8.303  -5.388
  492    HD3  PRO  63          2HD       PRO  63   1.705  -7.620  -5.299
  493    H    LEU  64           H        LEU  64   5.092  -3.294  -6.620
  494    HA   LEU  64           HA       LEU  64   7.315  -4.760  -7.807
  495    HB2  LEU  64          1HB       LEU  64   6.853  -1.770  -7.807
  496    HB3  LEU  64          2HB       LEU  64   8.032  -2.641  -8.758
  497    HG   LEU  64           HG       LEU  64   6.395  -2.146 -10.298
  498   HD11  LEU  64          1HD1      LEU  64   5.834  -4.902  -9.258
  499   HD12  LEU  64          2HD1      LEU  64   6.924  -4.424 -10.561
  500   HD13  LEU  64          3HD1      LEU  64   5.177  -4.271 -10.770
  501   HD21  LEU  64          1HD2      LEU  64   4.303  -2.910  -8.277
  502   HD22  LEU  64          2HD2      LEU  64   3.995  -2.399  -9.936
  503   HD23  LEU  64          3HD2      LEU  64   4.722  -1.275  -8.789
  504    H    VAL  65           H        VAL  65   8.541  -5.479  -6.168
  505    HA   VAL  65           HA       VAL  65   9.004  -4.234  -3.777
  506    HB   VAL  65           HB       VAL  65   9.602  -6.397  -3.573
  507   HG11  VAL  65          1HG1      VAL  65  11.031  -7.637  -5.230
  508   HG12  VAL  65          2HG1      VAL  65  10.932  -6.218  -6.272
  509   HG13  VAL  65          3HG1      VAL  65   9.469  -7.106  -5.844
  510   HG21  VAL  65          1HG2      VAL  65  12.024  -6.680  -3.349
  511   HG22  VAL  65          2HG2      VAL  65  11.426  -5.189  -2.623
  512   HG23  VAL  65          3HG2      VAL  65  12.258  -5.140  -4.177
  513    H    ASP  66           H        ASP  66  10.786  -3.867  -6.793
  514    HA   ASP  66           HA       ASP  66  13.028  -2.486  -5.825
  515    HB2  ASP  66          1HB       ASP  66  11.613  -2.360  -8.485
  516    HB3  ASP  66          2HB       ASP  66  13.105  -1.491  -8.153
  517    H    ASN  67           H        ASN  67  10.059  -1.142  -7.270
  518    HA   ASN  67           HA       ASN  67  10.576   1.545  -6.707
  519    HB2  ASN  67          1HB       ASN  67   7.952   0.082  -7.022
  520    HB3  ASN  67          2HB       ASN  67   8.080   1.827  -6.885
  521   HD21  ASN  67          1HD2      ASN  67   7.093   2.014  -8.931
  522   HD22  ASN  67          2HD2      ASN  67   7.989   1.722 -10.384
  523    H    LEU  68           H        LEU  68   9.116  -0.997  -4.826
  524    HA   LEU  68           HA       LEU  68   7.993   0.557  -2.783
  525    HB2  LEU  68          1HB       LEU  68   8.780  -2.308  -3.054
  526    HB3  LEU  68          2HB       LEU  68   8.293  -1.690  -1.484
  527    HG   LEU  68           HG       LEU  68   6.564  -1.324  -3.912
  528   HD11  LEU  68          1HD1      LEU  68   6.985  -3.715  -3.693
  529   HD12  LEU  68          2HD1      LEU  68   5.330  -3.318  -3.234
  530   HD13  LEU  68          3HD1      LEU  68   6.536  -3.647  -1.989
  531   HD21  LEU  68          1HD2      LEU  68   4.809  -1.112  -2.251
  532   HD22  LEU  68          2HD2      LEU  68   6.106   0.043  -1.941
  533   HD23  LEU  68          3HD2      LEU  68   5.976  -1.418  -0.964
  534    H    VAL  69           H        VAL  69  11.142  -1.079  -2.973
  535    HA   VAL  69           HA       VAL  69  12.033  -0.216  -0.415
  536    HB   VAL  69           HB       VAL  69  13.620  -1.074  -2.824
  537   HG11  VAL  69          1HG1      VAL  69  15.042   0.157  -1.341
  538   HG12  VAL  69          2HG1      VAL  69  15.391  -1.561  -1.142
  539   HG13  VAL  69          3HG1      VAL  69  14.411  -0.713   0.056
  540   HG21  VAL  69          1HG2      VAL  69  13.721  -3.237  -1.744
  541   HG22  VAL  69          2HG2      VAL  69  12.042  -2.761  -1.998
  542   HG23  VAL  69          3HG2      VAL  69  12.766  -2.627  -0.393
  543    H    HIS  70           H        HIS  70  12.399   1.067  -3.692
  544    HA   HIS  70           HA       HIS  70  14.242   3.097  -3.044
  545    HB2  HIS  70          1HB       HIS  70  13.409   2.099  -5.331
  546    HB3  HIS  70          2HB       HIS  70  12.249   3.416  -5.247
  547    HD1  HIS  70           HD1      HIS  70  14.527   3.160  -7.399
  548    HD2  HIS  70           HD2      HIS  70  14.698   5.507  -3.972
  549    HE1  HIS  70           HE1      HIS  70  16.237   4.936  -7.879
  550    HE2  HIS  70           HE2      HIS  70  16.409   6.275  -5.751
  551    H    GLN  71           H        GLN  71  10.833   2.819  -2.684
  552    HA   GLN  71           HA       GLN  71  10.402   5.658  -2.216
  553    HB2  GLN  71          1HB       GLN  71   8.741   4.251  -3.433
  554    HB3  GLN  71          2HB       GLN  71   8.493   3.323  -1.964
  555    HG2  GLN  71          1HG       GLN  71   6.707   4.923  -2.272
  556    HG3  GLN  71          2HG       GLN  71   7.643   5.293  -0.830
  557   HE21  GLN  71          1HE2      GLN  71   8.751   7.180  -0.699
  558   HE22  GLN  71          2HE2      GLN  71   8.614   8.446  -1.863
  559    H    LEU  72           H        LEU  72   9.804   2.660  -0.387
  560    HA   LEU  72           HA       LEU  72   9.171   3.931   2.023
  561    HB2  LEU  72          1HB       LEU  72  10.075   1.122   1.445
  562    HB3  LEU  72          2HB       LEU  72   9.609   1.656   3.045
  563    HG   LEU  72           HG       LEU  72   7.799   1.730   0.632
  564   HD11  LEU  72          1HD1      LEU  72   6.692  -0.207   1.646
  565   HD12  LEU  72          2HD1      LEU  72   7.912  -0.240   2.920
  566   HD13  LEU  72          3HD1      LEU  72   8.373  -0.571   1.249
  567   HD21  LEU  72          1HD2      LEU  72   7.124   3.362   2.242
  568   HD22  LEU  72          2HD2      LEU  72   7.328   2.215   3.567
  569   HD23  LEU  72          3HD2      LEU  72   6.039   1.978   2.387
  570    H    ALA  73           H        ALA  73  12.234   2.486   0.934
  571    HA   ALA  73           HA       ALA  73  13.563   2.921   3.423
  572    HB1  ALA  73          1HB       ALA  73  14.111   1.109   1.844
  573    HB2  ALA  73          2HB       ALA  73  15.508   2.070   2.333
  574    HB3  ALA  73          3HB       ALA  73  14.780   2.317   0.745
  575    H    HIS  74           H        HIS  74  12.437   5.336   2.342
  576    HA   HIS  74           HA       HIS  74  14.512   6.954   1.218
  577    HB2  HIS  74          1HB       HIS  74  12.038   7.379   0.936
  578    HB3  HIS  74          2HB       HIS  74  11.991   7.881   2.625
  579    HD1  HIS  74           HD1      HIS  74  12.643  10.249   3.133
  580    HD2  HIS  74           HD2      HIS  74  13.580   9.134  -0.758
  581    HE1  HIS  74           HE1      HIS  74  13.325  12.367   1.971
  582    HE2  HIS  74           HE2      HIS  74  14.090  11.627  -0.314
  583    H    GLY  75           H        GLY  75  16.247   6.588   2.660
  584    HA2  GLY  75          1HA       GLY  75  17.582   7.795   4.214
  585    HA3  GLY  75          2HA       GLY  75  16.116   8.295   5.045
  586    H    ARG  76           H        ARG  76  16.585   4.985   4.070
  587    HA   ARG  76           HA       ARG  76  17.521   4.188   6.691
  588    HB2  ARG  76          1HB       ARG  76  14.731   3.791   5.768
  589    HB3  ARG  76          2HB       ARG  76  15.486   2.443   6.615
  590    HG2  ARG  76          1HG       ARG  76  16.048   4.081   8.447
  591    HG3  ARG  76          2HG       ARG  76  15.000   5.236   7.625
  592    HD2  ARG  76          1HD       ARG  76  13.761   4.126   9.368
  593    HD3  ARG  76          2HD       ARG  76  13.148   3.619   7.796
  594    HE   ARG  76           HE       ARG  76  15.113   1.802   8.665
  595   HH11  ARG  76          1HH1      ARG  76  11.840   2.789   9.404
  596   HH12  ARG  76          2HH1      ARG  76  11.386   1.244  10.045
  597   HH21  ARG  76          1HH2      ARG  76  14.525  -0.229   9.502
  598   HH22  ARG  76          2HH2      ARG  76  12.910  -0.486  10.089
  599    H    ASP  77           H        ASP  77  17.824   1.766   6.791
  600    HA   ASP  77           HA       ASP  77  19.391   0.882   4.662
  601    HB2  ASP  77          1HB       ASP  77  18.132  -0.617   6.947
  602    HB3  ASP  77          2HB       ASP  77  19.200  -1.384   5.780
  603    H    ALA  78           H        ALA  78  18.660   0.627   2.724
  604    HA   ALA  78           HA       ALA  78  16.093  -0.030   1.899
  605    HB1  ALA  78          1HB       ALA  78  17.075  -0.379  -0.286
  606    HB2  ALA  78          2HB       ALA  78  18.679  -0.497   0.435
  607    HB3  ALA  78          3HB       ALA  78  17.797   1.029   0.492
  608    H    GLU  79           H        GLU  79  18.848  -2.111   2.590
  609    HA   GLU  79           HA       GLU  79  17.752  -4.489   1.515
  610    HB2  GLU  79          1HB       GLU  79  19.865  -4.037   3.614
  611    HB3  GLU  79          2HB       GLU  79  19.451  -5.626   2.982
  612    HG2  GLU  79          1HG       GLU  79  20.019  -4.815   0.715
  613    HG3  GLU  79          2HG       GLU  79  20.558  -3.299   1.429
  614    H    GLU  80           H        GLU  80  17.655  -3.050   4.728
  615    HA   GLU  80           HA       GLU  80  16.256  -5.113   6.051
  616    HB2  GLU  80          1HB       GLU  80  17.399  -3.304   7.231
  617    HB3  GLU  80          2HB       GLU  80  16.316  -2.126   6.516
  618    HG2  GLU  80          1HG       GLU  80  15.632  -2.463   8.752
  619    HG3  GLU  80          2HG       GLU  80  14.440  -3.233   7.719
  620    H    VAL  81           H        VAL  81  15.214  -2.190   4.373
  621    HA   VAL  81           HA       VAL  81  12.451  -2.456   4.718
  622    HB   VAL  81           HB       VAL  81  14.026  -1.099   2.539
  623   HG11  VAL  81          1HG1      VAL  81  11.762  -1.480   1.751
  624   HG12  VAL  81          2HG1      VAL  81  11.994   0.227   2.138
  625   HG13  VAL  81          3HG1      VAL  81  11.110  -0.821   3.252
  626   HG21  VAL  81          1HG2      VAL  81  12.861  -0.178   5.144
  627   HG22  VAL  81          2HG2      VAL  81  13.436   0.917   3.888
  628   HG23  VAL  81          3HG2      VAL  81  14.556  -0.203   4.656
  629    H    ARG  82           H        ARG  82  14.510  -3.428   1.966
  630    HA   ARG  82           HA       ARG  82  12.624  -4.573   0.304
  631    HB2  ARG  82          1HB       ARG  82  15.052  -4.224  -0.183
  632    HB3  ARG  82          2HB       ARG  82  15.404  -5.630   0.808
  633    HG2  ARG  82          1HG       ARG  82  13.894  -6.936  -0.736
  634    HG3  ARG  82          2HG       ARG  82  13.924  -5.527  -1.793
  635    HD2  ARG  82          1HD       ARG  82  16.382  -5.649  -1.838
  636    HD3  ARG  82          2HD       ARG  82  16.307  -7.107  -0.853
  637    HE   ARG  82           HE       ARG  82  14.818  -7.225  -3.330
  638   HH11  ARG  82          1HH1      ARG  82  17.847  -7.868  -1.702
  639   HH12  ARG  82          2HH1      ARG  82  18.393  -9.007  -2.889
  640   HH21  ARG  82          1HH2      ARG  82  15.531  -8.735  -4.901
  641   HH22  ARG  82          2HH2      ARG  82  17.071  -9.512  -4.703
  642    H    THR  83           H        THR  83  14.339  -5.987   3.039
  643    HA   THR  83           HA       THR  83  13.500  -8.636   2.692
  644    HB   THR  83           HB       THR  83  14.446  -7.086   5.094
  645    HG1  THR  83           HG1      THR  83  16.082  -7.470   3.679
  646   HG21  THR  83          1HG2      THR  83  14.733  -9.266   6.236
  647   HG22  THR  83          2HG2      THR  83  13.826 -10.036   4.934
  648   HG23  THR  83          3HG2      THR  83  13.040  -8.845   5.972
  649    H    GLU  84           H        GLU  84  12.235  -6.105   4.864
  650    HA   GLU  84           HA       GLU  84  10.072  -7.530   5.888
  651    HB2  GLU  84          1HB       GLU  84  10.515  -4.582   5.508
  652    HB3  GLU  84          2HB       GLU  84   9.042  -5.214   6.228
  653    HG2  GLU  84          1HG       GLU  84  11.806  -5.757   7.254
  654    HG3  GLU  84          2HG       GLU  84  10.734  -4.507   7.877
  655    H    VAL  85           H        VAL  85  10.210  -5.417   3.022
  656    HA   VAL  85           HA       VAL  85   7.546  -5.544   2.256
  657    HB   VAL  85           HB       VAL  85  10.061  -5.306   0.613
  658   HG11  VAL  85          1HG1      VAL  85   8.384  -6.337  -0.807
  659   HG12  VAL  85          2HG1      VAL  85   8.630  -4.653  -1.280
  660   HG13  VAL  85          3HG1      VAL  85   7.207  -5.107  -0.340
  661   HG21  VAL  85          1HG2      VAL  85   7.918  -3.342   1.404
  662   HG22  VAL  85          2HG2      VAL  85   9.292  -2.984   0.357
  663   HG23  VAL  85          3HG2      VAL  85   9.560  -3.426   2.043
  664    H    LEU  86           H        LEU  86  10.222  -7.692   1.300
  665    HA   LEU  86           HA       LEU  86   8.802  -9.353  -0.417
  666    HB2  LEU  86          1HB       LEU  86  11.210  -9.900   1.315
  667    HB3  LEU  86          2HB       LEU  86  10.591 -11.044   0.125
  668    HG   LEU  86           HG       LEU  86  11.437  -8.249  -0.595
  669   HD11  LEU  86          1HD1      LEU  86  13.077 -10.778  -0.653
  670   HD12  LEU  86          2HD1      LEU  86  13.326  -9.402   0.423
  671   HD13  LEU  86          3HD1      LEU  86  13.562  -9.216  -1.316
  672   HD21  LEU  86          1HD2      LEU  86   9.999  -9.317  -2.207
  673   HD22  LEU  86          2HD2      LEU  86  10.999 -10.769  -2.184
  674   HD23  LEU  86          3HD2      LEU  86  11.646  -9.262  -2.836
  675    H    LYS  87           H        LYS  87   9.017  -9.366   3.075
  676    HA   LYS  87           HA       LYS  87   7.898 -11.987   3.425
  677    HB2  LYS  87          1HB       LYS  87   8.266  -9.667   5.322
  678    HB3  LYS  87          2HB       LYS  87   7.615 -11.227   5.809
  679    HG2  LYS  87          1HG       LYS  87   9.675 -12.325   5.208
  680    HG3  LYS  87          2HG       LYS  87  10.336 -10.801   4.590
  681    HD2  LYS  87          1HD       LYS  87  10.188  -9.844   6.843
  682    HD3  LYS  87          2HD       LYS  87   9.553 -11.378   7.446
  683    HE2  LYS  87          1HE       LYS  87  12.256 -10.956   6.182
  684    HE3  LYS  87          2HE       LYS  87  11.942 -11.146   7.906
  685    HZ1  LYS  87          1HZ       LYS  87  11.053 -13.367   7.427
  686    HZ2  LYS  87          2HZ       LYS  87  12.675 -13.218   6.976
  687    HZ3  LYS  87          3HZ       LYS  87  11.465 -13.179   5.796
  688    H    CYS  88           H        CYS  88   6.627  -9.086   2.452
  689    HA   CYS  88           HA       CYS  88   3.940  -9.839   3.353
  690    HB2  CYS  88          1HB       CYS  88   5.222  -7.183   2.869
  691    HB3  CYS  88          2HB       CYS  88   3.457  -7.348   2.729
  692    H    VAL  89           H        VAL  89   6.005  -9.597   0.681
  693    HA   VAL  89           HA       VAL  89   3.994  -9.323  -1.338
  694    HB   VAL  89           HB       VAL  89   6.782 -10.473  -1.546
  695   HG11  VAL  89          1HG1      VAL  89   4.803  -9.626  -3.652
  696   HG12  VAL  89          2HG1      VAL  89   5.422 -11.254  -3.365
  697   HG13  VAL  89          3HG1      VAL  89   6.498  -9.994  -3.971
  698   HG21  VAL  89          1HG2      VAL  89   6.906  -8.173  -0.867
  699   HG22  VAL  89          2HG2      VAL  89   5.732  -7.702  -2.097
  700   HG23  VAL  89          3HG2      VAL  89   7.331  -8.278  -2.575
  701    H    ASP  90           H        ASP  90   2.422 -10.773  -1.313
  702    HA   ASP  90           HA       ASP  90   3.123 -13.618  -1.094
  703    HB2  ASP  90          1HB       ASP  90   1.935 -12.570   0.914
  704    HB3  ASP  90          2HB       ASP  90   0.540 -12.387  -0.147
  705    H    LYS  91           H        LYS  91   1.591 -15.057  -2.192
  706    HA   LYS  91           HA       LYS  91   1.017 -14.077  -4.828
  707    HB2  LYS  91          1HB       LYS  91   0.236 -16.763  -3.699
  708    HB3  LYS  91          2HB       LYS  91   0.450 -16.312  -5.387
  709    HG2  LYS  91          1HG       LYS  91   2.844 -15.942  -4.949
  710    HG3  LYS  91          2HG       LYS  91   2.599 -16.558  -3.318
  711    HD2  LYS  91          1HD       LYS  91   1.861 -18.128  -5.771
  712    HD3  LYS  91          2HD       LYS  91   3.460 -18.214  -5.036
  713    HE2  LYS  91          1HE       LYS  91   0.866 -18.820  -3.622
  714    HE3  LYS  91          2HE       LYS  91   1.954 -20.030  -4.301
  715    HZ1  LYS  91          1HZ       LYS  91   2.579 -18.133  -2.105
  716    HZ2  LYS  91          2HZ       LYS  91   3.694 -19.196  -2.800
  717    HZ3  LYS  91          3HZ       LYS  91   2.358 -19.803  -1.962
  718    H    ASN  92           H        ASN  92  -0.942 -14.103  -5.897
  719    HA   ASN  92           HA       ASN  92  -3.125 -13.091  -4.326
  720    HB2  ASN  92          1HB       ASN  92  -2.456 -12.184  -6.566
  721    HB3  ASN  92          2HB       ASN  92  -3.018 -13.684  -7.282
  722   HD21  ASN  92          1HD2      ASN  92  -4.397 -12.342  -8.540
  723   HD22  ASN  92          2HD2      ASN  92  -5.900 -11.774  -7.885
  724    H    THR  93           H        THR  93  -3.472 -15.053  -3.082
  725    HA   THR  93           HA       THR  93  -4.393 -17.421  -4.445
  726    HB   THR  93           HB       THR  93  -4.690 -18.350  -2.182
  727    HG1  THR  93           HG1      THR  93  -4.506 -17.116  -0.412
  728   HG21  THR  93          1HG2      THR  93  -2.519 -18.532  -3.212
  729   HG22  THR  93          2HG2      THR  93  -2.327 -18.232  -1.486
  730   HG23  THR  93          3HG2      THR  93  -2.078 -16.923  -2.641
  731    H    ASP  94           H        ASP  94  -5.859 -14.648  -2.953
  732    HA   ASP  94           HA       ASP  94  -8.453 -15.907  -2.692
  733    HB2  ASP  94          1HB       ASP  94  -9.229 -13.599  -2.078
  734    HB3  ASP  94          2HB       ASP  94  -7.944 -14.240  -1.048
  735    H    ASN  95           H        ASN  95  -6.684 -14.355  -5.090
  736    HA   ASN  95           HA       ASN  95  -7.048 -14.013  -7.273
  737    HB2  ASN  95          1HB       ASN  95  -9.649 -15.430  -6.745
  738    HB3  ASN  95          2HB       ASN  95  -9.068 -14.983  -8.340
  739   HD21  ASN  95          1HD2      ASN  95  -9.650 -17.586  -7.174
  740   HD22  ASN  95          2HD2      ASN  95  -8.193 -18.513  -7.351
  741    H    ASN  96           H        ASN  96  -8.158 -12.083  -5.119
  742    HA   ASN  96           HA       ASN  96  -9.589 -10.493  -7.154
  743    HB2  ASN  96          1HB       ASN  96 -10.108  -9.442  -4.522
  744    HB3  ASN  96          2HB       ASN  96 -11.243  -9.957  -5.760
  745   HD21  ASN  96          1HD2      ASN  96 -11.970 -12.110  -5.761
  746   HD22  ASN  96          2HD2      ASN  96 -11.920 -13.057  -4.320
  747    H    ALA  97           H        ALA  97  -8.446  -8.912  -7.869
  748    HA   ALA  97           HA       ALA  97  -5.885  -8.298  -7.004
  749    HB1  ALA  97          1HB       ALA  97  -5.966  -6.441  -8.575
  750    HB2  ALA  97          2HB       ALA  97  -7.719  -6.599  -8.682
  751    HB3  ALA  97          3HB       ALA  97  -6.680  -7.897  -9.268
  752    H    CYS  98           H        CYS  98  -8.948  -6.783  -6.105
  753    HA   CYS  98           HA       CYS  98  -7.823  -4.490  -4.862
  754    HB2  CYS  98          1HB       CYS  98 -10.410  -5.910  -4.194
  755    HB3  CYS  98          2HB       CYS  98  -9.948  -4.308  -3.640
  756    H    HIS  99           H        HIS  99  -8.392  -7.783  -3.743
  757    HA   HIS  99           HA       HIS  99  -7.703  -7.056  -1.019
  758    HB2  HIS  99          1HB       HIS  99  -9.474  -8.762  -1.542
  759    HB3  HIS  99          2HB       HIS  99  -8.203  -9.820  -2.143
  760    HD1  HIS  99           HD1      HIS  99  -6.981 -11.222  -0.453
  761    HD2  HIS  99           HD2      HIS  99  -9.334  -8.274   1.311
  762    HE1  HIS  99           HE1      HIS  99  -6.921 -11.684   2.022
  763    HE2  HIS  99           HE2      HIS  99  -8.457  -9.974   3.049
  764    H    TRP 100           H        TRP 100  -6.169  -8.252  -3.844
  765    HA   TRP 100           HA       TRP 100  -3.906  -9.432  -2.609
  766    HB2  TRP 100          1HB       TRP 100  -4.544  -9.811  -4.995
  767    HB3  TRP 100          2HB       TRP 100  -4.040  -8.159  -5.359
  768    HD1  TRP 100           HD1      TRP 100  -1.715  -9.693  -2.917
  769    HE1  TRP 100           HE1      TRP 100   0.436 -10.477  -4.082
  770    HE3  TRP 100           HE3      TRP 100  -3.255  -9.344  -7.785
  771    HZ2  TRP 100           HZ2      TRP 100   1.357 -10.907  -6.712
  772    HZ3  TRP 100           HZ3      TRP 100  -1.675  -9.961  -9.563
  773    HH2  TRP 100           HH2      TRP 100   0.580 -10.728  -9.043
  774    H    ALA 101           H        ALA 101  -4.369  -6.240  -4.124
  775    HA   ALA 101           HA       ALA 101  -1.914  -5.135  -3.322
  776    HB1  ALA 101          1HB       ALA 101  -2.938  -2.971  -3.794
  777    HB2  ALA 101          2HB       ALA 101  -4.534  -3.721  -3.814
  778    HB3  ALA 101          3HB       ALA 101  -3.349  -4.142  -5.049
  779    H    PHE 102           H        PHE 102  -5.009  -5.436  -1.749
  780    HA   PHE 102           HA       PHE 102  -4.408  -3.760   0.454
  781    HB2  PHE 102          1HB       PHE 102  -6.695  -4.273  -0.312
  782    HB3  PHE 102          2HB       PHE 102  -6.495  -5.930   0.249
  783    HD1  PHE 102           HD1      PHE 102  -7.134  -6.474   2.426
  784    HD2  PHE 102           HD2      PHE 102  -6.379  -2.409   1.418
  785    HE1  PHE 102           HE1      PHE 102  -7.964  -5.775   4.631
  786    HE2  PHE 102           HE2      PHE 102  -7.200  -1.702   3.627
  787    HZ   PHE 102           HZ       PHE 102  -7.993  -3.385   5.239
  788    H    ARG 103           H        ARG 103  -3.876  -7.117  -0.308
  789    HA   ARG 103           HA       ARG 103  -3.410  -8.094   2.310
  790    HB2  ARG 103          1HB       ARG 103  -3.821  -9.545   0.304
  791    HB3  ARG 103          2HB       ARG 103  -2.224  -9.098  -0.280
  792    HG2  ARG 103          1HG       ARG 103  -1.244 -10.062   1.778
  793    HG3  ARG 103          2HG       ARG 103  -2.854 -10.592   2.249
  794    HD2  ARG 103          1HD       ARG 103  -1.342 -11.474  -0.223
  795    HD3  ARG 103          2HD       ARG 103  -1.574 -12.417   1.243
  796    HE   ARG 103           HE       ARG 103  -3.962 -11.553  -0.193
  797   HH11  ARG 103          1HH1      ARG 103  -1.689 -14.124   0.544
  798   HH12  ARG 103          2HH1      ARG 103  -2.776 -15.383   0.047
  799   HH21  ARG 103          1HH2      ARG 103  -5.379 -13.236  -0.868
  800   HH22  ARG 103          2HH2      ARG 103  -4.840 -14.894  -0.754
  801    H    GLY 104           H        GLY 104  -1.281  -6.849  -0.225
  802    HA2  GLY 104          1HA       GLY 104   1.151  -7.192   1.182
  803    HA3  GLY 104          2HA       GLY 104   0.885  -6.078  -0.164
  804    H    PHE 105           H        PHE 105  -1.029  -4.409   0.888
  805    HA   PHE 105           HA       PHE 105   0.566  -2.623   2.352
  806    HB2  PHE 105          1HB       PHE 105  -1.089  -1.713   0.925
  807    HB3  PHE 105          2HB       PHE 105  -2.361  -2.661   1.677
  808    HD1  PHE 105           HD1      PHE 105  -3.882  -1.193   2.630
  809    HD2  PHE 105           HD2      PHE 105   0.290  -0.462   3.095
  810    HE1  PHE 105           HE1      PHE 105  -4.383   0.709   4.102
  811    HE2  PHE 105           HE2      PHE 105  -0.213   1.444   4.567
  812    HZ   PHE 105           HZ       PHE 105  -2.547   2.031   5.073
  813    H    LYS 106           H        LYS 106  -2.134  -4.706   3.316
  814    HA   LYS 106           HA       LYS 106  -2.322  -3.687   5.936
  815    HB2  LYS 106          1HB       LYS 106  -4.267  -4.688   5.242
  816    HB3  LYS 106          2HB       LYS 106  -3.451  -6.075   4.520
  817    HG2  LYS 106          1HG       LYS 106  -3.041  -6.969   6.757
  818    HG3  LYS 106          2HG       LYS 106  -3.788  -5.535   7.470
  819    HD2  LYS 106          1HD       LYS 106  -5.899  -6.098   6.348
  820    HD3  LYS 106          2HD       LYS 106  -5.148  -7.544   5.676
  821    HE2  LYS 106          1HE       LYS 106  -5.473  -6.962   8.617
  822    HE3  LYS 106          2HE       LYS 106  -6.527  -8.009   7.671
  823    HZ1  LYS 106          1HZ       LYS 106  -4.601  -9.420   7.203
  824    HZ2  LYS 106          2HZ       LYS 106  -4.907  -9.305   8.860
  825    HZ3  LYS 106          3HZ       LYS 106  -3.634  -8.430   8.177
  826    H    CYS 107           H        CYS 107  -0.581  -6.400   4.537
  827    HA   CYS 107           HA       CYS 107   0.284  -7.593   6.920
  828    HB2  CYS 107          1HB       CYS 107   0.462  -8.866   4.942
  829    HB3  CYS 107          2HB       CYS 107   1.352  -7.606   4.098
  830    H    PHE 108           H        PHE 108   1.670  -5.030   4.919
  831    HA   PHE 108           HA       PHE 108   4.172  -5.023   6.299
  832    HB2  PHE 108          1HB       PHE 108   3.790  -4.396   3.881
  833    HB3  PHE 108          2HB       PHE 108   3.105  -2.881   4.468
  834    HD1  PHE 108           HD1      PHE 108   6.142  -4.842   3.997
  835    HD2  PHE 108           HD2      PHE 108   4.538  -1.192   5.485
  836    HE1  PHE 108           HE1      PHE 108   8.400  -3.878   4.071
  837    HE2  PHE 108           HE2      PHE 108   6.797  -0.226   5.559
  838    HZ   PHE 108           HZ       PHE 108   8.731  -1.568   4.848
  839    H    GLN 109           H        GLN 109   1.376  -2.813   6.206
  840    HA   GLN 109           HA       GLN 109   2.436  -0.899   7.972
  841    HB2  GLN 109          1HB       GLN 109   0.187  -0.033   8.151
  842    HB3  GLN 109          2HB       GLN 109   0.528  -0.461   6.483
  843    HG2  GLN 109          1HG       GLN 109  -1.463  -1.454   6.539
  844    HG3  GLN 109          2HG       GLN 109  -0.642  -2.741   7.429
  845   HE21  GLN 109          1HE2      GLN 109  -3.424  -1.862   7.526
  846   HE22  GLN 109          2HE2      GLN 109  -3.737  -1.443   9.173
  847    H    LYS 110           H        LYS 110   1.133  -3.997   8.515
  848    HA   LYS 110           HA       LYS 110   0.132  -3.796  11.120
  849    HB2  LYS 110          1HB       LYS 110  -0.085  -5.731   9.548
  850    HB3  LYS 110          2HB       LYS 110   1.596  -6.124   9.869
  851    HG2  LYS 110          1HG       LYS 110   0.814  -6.188  12.341
  852    HG3  LYS 110          2HG       LYS 110  -0.789  -6.363  11.632
  853    HD2  LYS 110          1HD       LYS 110   1.596  -8.149  11.156
  854    HD3  LYS 110          2HD       LYS 110   0.152  -8.548  12.086
  855    HE2  LYS 110          1HE       LYS 110  -1.213  -8.461  10.120
  856    HE3  LYS 110          2HE       LYS 110   0.130  -7.846   9.160
  857    HZ1  LYS 110          1HZ       LYS 110  -0.246 -10.218   8.805
  858    HZ2  LYS 110          2HZ       LYS 110   0.036 -10.519  10.447
  859    HZ3  LYS 110          3HZ       LYS 110   1.283  -9.927   9.470
  860    H    ASN 111           H        ASN 111   3.405  -4.146   9.873
  861    HA   ASN 111           HA       ASN 111   4.418  -4.179  12.641
  862    HB2  ASN 111          1HB       ASN 111   5.641  -5.311  10.126
  863    HB3  ASN 111          2HB       ASN 111   6.519  -5.130  11.642
  864   HD21  ASN 111          1HD2      ASN 111   6.865  -7.344  11.740
  865   HD22  ASN 111          2HD2      ASN 111   5.605  -8.448  12.172
  866    H    ASN 112           H        ASN 112   4.610  -2.559   9.539
  867    HA   ASN 112           HA       ASN 112   6.512  -0.652  10.725
  868    HB2  ASN 112          1HB       ASN 112   6.712  -1.792   7.926
  869    HB3  ASN 112          2HB       ASN 112   7.718  -0.503   8.582
  870   HD21  ASN 112          1HD2      ASN 112   7.253  -3.859   8.300
  871   HD22  ASN 112          2HD2      ASN 112   8.620  -4.362   9.234
  872    H    LEU 113           H        LEU 113   4.315   0.422  10.986
  873    HA   LEU 113           HA       LEU 113   3.181   1.491   8.547
  874    HB2  LEU 113          1HB       LEU 113   1.625   0.918  10.252
  875    HB3  LEU 113          2HB       LEU 113   2.471   1.881  11.445
  876    HG   LEU 113           HG       LEU 113   1.822   3.924  10.182
  877   HD11  LEU 113          1HD1      LEU 113   1.593   2.868   7.982
  878   HD12  LEU 113          2HD1      LEU 113   0.149   3.772   8.438
  879   HD13  LEU 113          3HD1      LEU 113   0.160   2.013   8.552
  880   HD21  LEU 113          1HD2      LEU 113   0.496   3.142  12.078
  881   HD22  LEU 113          2HD2      LEU 113  -0.455   2.123  10.997
  882   HD23  LEU 113          3HD2      LEU 113  -0.531   3.880  10.846
  883    H    SER 114           H        SER 114   5.180   2.629  11.202
  884    HA   SER 114           HA       SER 114   5.000   5.388  10.662
  885    HB2  SER 114          1HB       SER 114   7.347   3.907  11.876
  886    HB3  SER 114          2HB       SER 114   6.960   5.618  12.072
  887    HG   SER 114           HG       SER 114   6.166   4.581  13.856
  888    H    LEU 115           H        LEU 115   7.072   2.866   9.340
  889    HA   LEU 115           HA       LEU 115   8.835   4.523   7.896
  890    HB2  LEU 115          1HB       LEU 115   9.230   2.135   8.309
  891    HB3  LEU 115          2HB       LEU 115   7.884   1.737   7.259
  892    HG   LEU 115           HG       LEU 115   9.114   2.779   5.362
  893   HD11  LEU 115          1HD1      LEU 115  11.528   3.185   5.667
  894   HD12  LEU 115          2HD1      LEU 115  11.314   2.951   7.402
  895   HD13  LEU 115          3HD1      LEU 115  10.522   4.300   6.593
  896   HD21  LEU 115          1HD2      LEU 115   9.182   0.358   5.765
  897   HD22  LEU 115          2HD2      LEU 115  10.602   0.577   6.790
  898   HD23  LEU 115          3HD2      LEU 115  10.690   0.952   5.070
  899    H    ILE 116           H        ILE 116   5.639   3.289   7.253
  900    HA   ILE 116           HA       ILE 116   5.516   3.890   4.498
  901    HB   ILE 116           HB       ILE 116   3.299   3.619   6.544
  902   HG12  ILE 116          1HG1      ILE 116   4.449   1.662   4.536
  903   HG13  ILE 116          2HG1      ILE 116   4.627   1.588   6.296
  904   HG21  ILE 116          1HG2      ILE 116   3.159   3.679   3.537
  905   HG22  ILE 116          2HG2      ILE 116   2.495   4.881   4.645
  906   HG23  ILE 116          3HG2      ILE 116   1.826   3.246   4.606
  907   HD11  ILE 116          1HD1      ILE 116   2.971   0.017   5.691
  908   HD12  ILE 116          2HD1      ILE 116   2.142   1.182   4.663
  909   HD13  ILE 116          3HD1      ILE 116   2.124   1.386   6.415
  910    H    LYS 117           H        LYS 117   4.636   5.665   7.408
  911    HA   LYS 117           HA       LYS 117   3.570   7.931   6.079
  912    HB2  LYS 117          1HB       LYS 117   4.602   7.523   8.878
  913    HB3  LYS 117          2HB       LYS 117   3.883   9.032   8.331
  914    HG2  LYS 117          1HG       LYS 117   1.796   7.882   7.844
  915    HG3  LYS 117          2HG       LYS 117   2.504   6.344   8.329
  916    HD2  LYS 117          1HD       LYS 117   2.807   7.190  10.599
  917    HD3  LYS 117          2HD       LYS 117   2.136   8.749  10.121
  918    HE2  LYS 117          1HE       LYS 117   0.001   7.690   9.615
  919    HE3  LYS 117          2HE       LYS 117   0.671   6.114  10.031
  920    HZ1  LYS 117          1HZ       LYS 117   0.970   6.850  12.292
  921    HZ2  LYS 117          2HZ       LYS 117  -0.642   7.080  11.834
  922    HZ3  LYS 117          3HZ       LYS 117   0.408   8.400  11.907
  923    H    ALA 118           H        ALA 118   6.751   7.084   7.323
  924    HA   ALA 118           HA       ALA 118   7.978   9.607   6.833
  925    HB1  ALA 118          1HB       ALA 118   8.845   7.964   8.422
  926    HB2  ALA 118          2HB       ALA 118  10.056   8.432   7.229
  927    HB3  ALA 118          3HB       ALA 118   9.224   6.882   7.083
  928    H    SER 119           H        SER 119   7.479   6.719   4.952
  929    HA   SER 119           HA       SER 119   9.293   7.056   2.892
  930    HB2  SER 119          1HB       SER 119   7.928   5.036   3.219
  931    HB3  SER 119          2HB       SER 119   6.490   5.927   2.730
  932    HG   SER 119           HG       SER 119   8.783   5.565   1.101
  933    H    ILE 120           H        ILE 120   6.017   8.359   3.197
  934    HA   ILE 120           HA       ILE 120   6.192   9.687   0.629
  935    HB   ILE 120           HB       ILE 120   3.915  10.554   1.227
  936   HG12  ILE 120          1HG1      ILE 120   4.172   8.674   3.575
  937   HG13  ILE 120          2HG1      ILE 120   4.291  10.427   3.699
  938   HG21  ILE 120          1HG2      ILE 120   4.171   8.553  -0.111
  939   HG22  ILE 120          2HG2      ILE 120   2.803   8.373   0.988
  940   HG23  ILE 120          3HG2      ILE 120   4.333   7.576   1.348
  941   HD11  ILE 120          1HD1      ILE 120   2.008  10.631   2.875
  942   HD12  ILE 120          2HD1      ILE 120   2.094   9.651   4.335
  943   HD13  ILE 120          3HD1      ILE 120   1.893   8.877   2.764
  944    H    LYS 121           H        LYS 121   7.379  10.368   3.616
  945    HA   LYS 121           HA       LYS 121   6.711  13.175   3.703
  946    HB2  LYS 121          1HB       LYS 121   6.979  11.895   5.780
  947    HB3  LYS 121          2HB       LYS 121   8.654  11.563   5.365
  948    HG2  LYS 121          1HG       LYS 121   9.130  13.978   5.444
  949    HG3  LYS 121          2HG       LYS 121   7.457  14.270   5.925
  950    HD2  LYS 121          1HD       LYS 121   7.802  12.922   7.937
  951    HD3  LYS 121          2HD       LYS 121   9.471  12.620   7.452
  952    HE2  LYS 121          1HE       LYS 121   9.973  14.987   7.611
  953    HE3  LYS 121          2HE       LYS 121   8.290  15.340   8.001
  954    HZ1  LYS 121          1HZ       LYS 121   9.664  15.301   9.982
  955    HZ2  LYS 121          2HZ       LYS 121  10.139  13.713   9.655
  956    HZ3  LYS 121          3HZ       LYS 121   8.528  14.051  10.029
  957    H    LYS 122           H        LYS 122   7.705  14.624   2.518
  958    HA   LYS 122           HA       LYS 122  10.607  14.555   2.279
  959    HB2  LYS 122          1HB       LYS 122   9.076  13.684   0.123
  960    HB3  LYS 122          2HB       LYS 122   9.399  15.364  -0.236
  961    HG2  LYS 122          1HG       LYS 122  11.464  13.246   0.307
  962    HG3  LYS 122          2HG       LYS 122  11.098  14.001  -1.246
  963    HD2  LYS 122          1HD       LYS 122  11.700  16.209  -0.183
  964    HD3  LYS 122          2HD       LYS 122  12.300  15.290   1.196
  965    HE2  LYS 122          1HE       LYS 122  14.153  15.802  -0.219
  966    HE3  LYS 122          2HE       LYS 122  13.817  14.077  -0.358
  967    HZ1  LYS 122          1HZ       LYS 122  14.241  15.116  -2.508
  968    HZ2  LYS 122          2HZ       LYS 122  12.920  16.147  -2.287
  969    HZ3  LYS 122          3HZ       LYS 122  12.679  14.482  -2.428
  970    H    ASP 123           H        ASP 123  10.793  16.294   3.512
  971    HA   ASP 123           HA       ASP 123   9.395  18.744   2.719
  972    HB2  ASP 123          1HB       ASP 123   9.350  17.993   5.113
  973    HB3  ASP 123          2HB       ASP 123  11.089  18.252   5.174
  974    H21  ACD 201           H21      ACD   1  -4.585   4.616   1.248
  975    H22  ACD 201           H22      ACD   1  -3.461   4.431   2.600
  976    H31  ACD 201           H31      ACD   1  -1.978   6.163   1.473
  977    H32  ACD 201           H32      ACD   1  -3.045   6.081   0.074
  978    H41  ACD 201           H41      ACD   1  -2.603   3.583  -0.035
  979    H42  ACD 201           H42      ACD   1  -1.173   4.588  -0.336
  980    H5   ACD 201           H5       ACD   1  -1.664   2.828   2.110
  981    H6   ACD 201           H6       ACD   1   0.556   3.531   2.670
  982    H71  ACD 201           H71      ACD   1   0.889   4.861   0.110
  983    H72  ACD 201           H72      ACD   1  -0.076   5.985   1.067
  984    H8   ACD 201           H8       ACD   1   1.811   6.381   2.613
  985    H9   ACD 201           H9       ACD   1   3.941   5.488   2.017
  986   H101  ACD 201          H101      ACD   1   2.910   4.628  -0.556
  987   H102  ACD 201          H102      ACD   1   2.453   3.344   0.561
  988    H11  ACD 201           H11      ACD   1   5.399   4.265   0.459
  989    H12  ACD 201           H12      ACD   1   5.749   1.937   0.153
  990   H131  ACD 201          H131      ACD   1   2.786   1.945  -0.585
  991   H132  ACD 201          H132      ACD   1   3.888   0.572  -0.668
  992    H14  ACD 201           H14      ACD   1   2.743   1.632   2.015
  993    H15  ACD 201           H15      ACD   1   2.589  -0.707   2.444
  994   H161  ACD 201          H161      ACD   1   2.776  -1.394  -0.352
  995   H162  ACD 201          H162      ACD   1   4.440  -1.003   0.093
  996   H171  ACD 201          H171      ACD   1   4.469  -2.689   1.825
  997   H172  ACD 201          H172      ACD   1   2.735  -2.975   1.654
  998   H181  ACD 201          H181      ACD   1   4.796  -3.482  -0.531
  999   H182  ACD 201          H182      ACD   1   3.070  -3.838  -0.632
 1000   H191  ACD 201          H191      ACD   1   5.073  -5.082   1.299
 1001   H192  ACD 201          H192      ACD   1   3.332  -5.370   1.366
 1002   H201  ACD 201          H201      ACD   1   3.423  -6.269  -0.938
 1003   H202  ACD 201          H202      ACD   1   4.470  -7.149   0.121
 1004   H203  ACD 201          H203      ACD   1   5.131  -5.993  -0.987
  Start of MODEL   14
    1    H1   MET   1          1H        MET   1  15.565  15.560 -16.605
    2    H2   MET   1          2H        MET   1  14.157  14.661 -16.857
    3    H3   MET   1          3H        MET   1  15.647  14.059 -17.383
    4    HA   MET   1           HA       MET   1  14.900  12.959 -15.367
    5    HB2  MET   1          1HB       MET   1  17.325  13.250 -15.847
    6    HB3  MET   1          2HB       MET   1  17.304  14.746 -14.925
    7    HG2  MET   1          1HG       MET   1  16.576  13.421 -12.938
    8    HG3  MET   1          2HG       MET   1  16.831  11.962 -13.891
    9    HE1  MET   1          1HE       MET   1  19.191  11.167 -14.783
   10    HE2  MET   1          2HE       MET   1  20.686  12.073 -14.548
   11    HE3  MET   1          3HE       MET   1  19.421  12.718 -15.593
   12    H    GLU   2           H        GLU   2  12.890  14.187 -14.870
   13    HA   GLU   2           HA       GLU   2  13.291  16.045 -12.620
   14    HB2  GLU   2          1HB       GLU   2  10.974  15.831 -14.543
   15    HB3  GLU   2          2HB       GLU   2  10.955  16.817 -13.094
   16    HG2  GLU   2          1HG       GLU   2  11.406  18.230 -14.947
   17    HG3  GLU   2          2HG       GLU   2  12.890  18.083 -14.010
   18    H    PHE   3           H        PHE   3  13.628  13.684 -11.752
   19    HA   PHE   3           HA       PHE   3  11.247  12.153 -11.368
   20    HB2  PHE   3          1HB       PHE   3  13.488  11.114 -11.545
   21    HB3  PHE   3          2HB       PHE   3  13.928  11.844  -9.997
   22    HD1  PHE   3           HD1      PHE   3  12.983  10.983  -7.918
   23    HD2  PHE   3           HD2      PHE   3  11.984   9.267 -11.681
   24    HE1  PHE   3           HE1      PHE   3  12.055   9.012  -6.772
   25    HE2  PHE   3           HE2      PHE   3  11.052   7.298 -10.541
   26    HZ   PHE   3           HZ       PHE   3  11.085   7.169  -8.084
   27    H    THR   4           H        THR   4   9.776  12.459  -9.890
   28    HA   THR   4           HA       THR   4  10.507  13.835  -7.388
   29    HB   THR   4           HB       THR   4   7.722  14.179  -8.225
   30    HG1  THR   4           HG1      THR   4   9.702  14.674 -10.027
   31   HG21  THR   4          1HG2      THR   4   8.760  15.276  -6.304
   32   HG22  THR   4          2HG2      THR   4   8.154  16.449  -7.475
   33   HG23  THR   4          3HG2      THR   4   9.881  16.102  -7.384
   34    H    VAL   5           H        VAL   5   9.879  12.865  -5.594
   35    HA   VAL   5           HA       VAL   5   8.608  10.253  -5.861
   36    HB   VAL   5           HB       VAL   5   9.558   9.655  -3.881
   37   HG11  VAL   5          1HG1      VAL   5  11.292  12.026  -4.488
   38   HG12  VAL   5          2HG1      VAL   5  11.362  10.469  -5.306
   39   HG13  VAL   5          3HG1      VAL   5  11.747  10.579  -3.590
   40   HG21  VAL   5          1HG2      VAL   5   9.387  12.492  -2.872
   41   HG22  VAL   5          2HG2      VAL   5   9.938  11.094  -1.948
   42   HG23  VAL   5          3HG2      VAL   5   8.262  11.190  -2.489
   43    H    SER   6           H        SER   6   6.756   9.634  -4.806
   44    HA   SER   6           HA       SER   6   4.761  11.675  -4.698
   45    HB2  SER   6          1HB       SER   6   4.515   8.748  -3.960
   46    HB3  SER   6          2HB       SER   6   3.196   9.853  -4.358
   47    HG   SER   6           HG       SER   6   4.518  10.104  -6.426
   48    H    THR   7           H        THR   7   5.002  13.031  -2.997
   49    HA   THR   7           HA       THR   7   5.484  12.013  -0.323
   50    HB   THR   7           HB       THR   7   5.500  14.365   0.359
   51    HG1  THR   7           HG1      THR   7   4.670  14.796  -2.342
   52   HG21  THR   7          1HG2      THR   7   7.433  15.108  -0.950
   53   HG22  THR   7          2HG2      THR   7   7.080  13.881  -2.166
   54   HG23  THR   7          3HG2      THR   7   7.556  13.397  -0.539
   55    H    THR   8           H        THR   8   4.018  13.630   1.293
   56    HA   THR   8           HA       THR   8   1.520  12.378   1.412
   57    HB   THR   8           HB       THR   8   2.314  15.010   2.661
   58    HG1  THR   8           HG1      THR   8   3.409  12.721   3.076
   59   HG21  THR   8          1HG2      THR   8   0.096  13.069   3.277
   60   HG22  THR   8          2HG2      THR   8  -0.058  14.747   2.752
   61   HG23  THR   8          3HG2      THR   8   0.589  14.379   4.351
   62    H    GLU   9           H        GLU   9   2.410  15.605   0.237
   63    HA   GLU   9           HA       GLU   9  -0.140  16.564  -0.284
   64    HB2  GLU   9          1HB       GLU   9   2.393  17.177  -1.807
   65    HB3  GLU   9          2HB       GLU   9   0.928  18.149  -1.807
   66    HG2  GLU   9          1HG       GLU   9   1.209  18.523   0.606
   67    HG3  GLU   9          2HG       GLU   9   2.720  17.616   0.549
   68    H    ASP  10           H        ASP  10   2.074  14.762  -2.368
   69    HA   ASP  10           HA       ASP  10   0.474  14.707  -4.686
   70    HB2  ASP  10          1HB       ASP  10   2.442  12.595  -3.777
   71    HB3  ASP  10          2HB       ASP  10   1.870  12.869  -5.422
   72    H    LEU  11           H        LEU  11   0.860  12.451  -2.008
   73    HA   LEU  11           HA       LEU  11  -0.824  10.447  -2.914
   74    HB2  LEU  11          1HB       LEU  11   0.689  10.093  -1.079
   75    HB3  LEU  11          2HB       LEU  11  -0.177  11.268  -0.082
   76    HG   LEU  11           HG       LEU  11  -2.158   9.751  -0.169
   77   HD11  LEU  11          1HD1      LEU  11  -0.207   7.835  -1.426
   78   HD12  LEU  11          2HD1      LEU  11  -1.577   8.590  -2.238
   79   HD13  LEU  11          3HD1      LEU  11  -1.853   7.466  -0.913
   80   HD21  LEU  11          1HD2      LEU  11  -1.321   8.216   1.477
   81   HD22  LEU  11          2HD2      LEU  11  -0.516   9.769   1.701
   82   HD23  LEU  11          3HD2      LEU  11   0.332   8.441   0.909
   83    H    GLN  12           H        GLN  12  -1.556  13.421  -1.190
   84    HA   GLN  12           HA       GLN  12  -4.180  12.851  -0.399
   85    HB2  GLN  12          1HB       GLN  12  -2.868  15.468  -1.118
   86    HB3  GLN  12          2HB       GLN  12  -4.496  15.356  -0.468
   87    HG2  GLN  12          1HG       GLN  12  -3.626  14.337   1.563
   88    HG3  GLN  12          2HG       GLN  12  -1.997  14.402   0.906
   89   HE21  GLN  12          1HE2      GLN  12  -4.614  16.216   2.265
   90   HE22  GLN  12          2HE2      GLN  12  -3.725  17.670   2.560
   91    H    ARG  13           H        ARG  13  -2.933  14.160  -3.432
   92    HA   ARG  13           HA       ARG  13  -5.448  14.610  -4.635
   93    HB2  ARG  13          1HB       ARG  13  -3.488  15.644  -5.582
   94    HB3  ARG  13          2HB       ARG  13  -2.741  14.074  -5.864
   95    HG2  ARG  13          1HG       ARG  13  -4.539  13.518  -7.440
   96    HG3  ARG  13          2HG       ARG  13  -5.229  15.128  -7.188
   97    HD2  ARG  13          1HD       ARG  13  -3.296  16.163  -8.149
   98    HD3  ARG  13          2HD       ARG  13  -2.449  14.615  -8.226
   99    HE   ARG  13           HE       ARG  13  -4.594  14.086  -9.706
  100   HH11  ARG  13          1HH1      ARG  13  -2.454  16.860  -9.765
  101   HH12  ARG  13          2HH1      ARG  13  -2.710  17.172 -11.452
  102   HH21  ARG  13          1HH2      ARG  13  -4.921  14.489 -11.904
  103   HH22  ARG  13          2HH2      ARG  13  -4.106  15.816 -12.673
  104    H    TYR  14           H        TYR  14  -3.222  11.854  -4.672
  105    HA   TYR  14           HA       TYR  14  -4.583  10.376  -6.637
  106    HB2  TYR  14          1HB       TYR  14  -2.865   9.234  -4.426
  107    HB3  TYR  14          2HB       TYR  14  -3.235   8.488  -5.978
  108    HD1  TYR  14           HD1      TYR  14  -2.881  11.190  -7.542
  109    HD2  TYR  14           HD2      TYR  14  -0.464   9.062  -4.760
  110    HE1  TYR  14           HE1      TYR  14  -0.872  12.202  -8.522
  111    HE2  TYR  14           HE2      TYR  14   1.552  10.078  -5.734
  112    HH   TYR  14           HH       TYR  14   1.452  12.728  -7.815
  113    H    ARG  15           H        ARG  15  -4.997  10.542  -3.141
  114    HA   ARG  15           HA       ARG  15  -6.778   8.390  -2.852
  115    HB2  ARG  15          1HB       ARG  15  -7.226  10.936  -1.324
  116    HB3  ARG  15          2HB       ARG  15  -7.460   9.281  -0.815
  117    HG2  ARG  15          1HG       ARG  15  -4.988   8.976  -0.805
  118    HG3  ARG  15          2HG       ARG  15  -4.834  10.704  -1.136
  119    HD2  ARG  15          1HD       ARG  15  -6.346  11.018   0.931
  120    HD3  ARG  15          2HD       ARG  15  -5.926   9.351   1.317
  121    HE   ARG  15           HE       ARG  15  -3.906  11.472   0.999
  122   HH11  ARG  15          1HH1      ARG  15  -5.071   8.586   2.598
  123   HH12  ARG  15          2HH1      ARG  15  -3.950   8.710   3.912
  124   HH21  ARG  15          1HH2      ARG  15  -2.409  11.625   2.726
  125   HH22  ARG  15          2HH2      ARG  15  -2.436  10.442   3.988
  126    H    THR  16           H        THR  16  -7.406  11.809  -3.412
  127    HA   THR  16           HA       THR  16 -10.140  11.811  -3.586
  128    HB   THR  16           HB       THR  16  -8.054  13.488  -4.953
  129    HG1  THR  16           HG1      THR  16  -9.460  14.896  -3.271
  130   HG21  THR  16          1HG2      THR  16  -9.826  15.099  -5.499
  131   HG22  THR  16          2HG2      THR  16 -11.038  13.947  -4.942
  132   HG23  THR  16          3HG2      THR  16 -10.046  13.571  -6.353
  133    H    GLU  17           H        GLU  17  -7.839  11.412  -6.296
  134    HA   GLU  17           HA       GLU  17  -9.847  11.211  -8.279
  135    HB2  GLU  17          1HB       GLU  17  -7.166   9.899  -8.621
  136    HB3  GLU  17          2HB       GLU  17  -8.150  10.736  -9.804
  137    HG2  GLU  17          1HG       GLU  17  -7.701  12.866  -8.647
  138    HG3  GLU  17          2HG       GLU  17  -6.592  12.012  -7.573
  139    H    CYS  18           H        CYS  18  -8.328   8.798  -6.218
  140    HA   CYS  18           HA       CYS  18  -9.569   6.587  -7.559
  141    HB2  CYS  18          1HB       CYS  18  -8.230   6.814  -4.863
  142    HB3  CYS  18          2HB       CYS  18  -8.930   5.314  -5.482
  143    H    VAL  19           H        VAL  19 -10.408   8.733  -4.946
  144    HA   VAL  19           HA       VAL  19 -12.474   7.208  -3.814
  145    HB   VAL  19           HB       VAL  19 -11.744  10.108  -3.708
  146   HG11  VAL  19          1HG1      VAL  19 -14.216   8.938  -2.436
  147   HG12  VAL  19          2HG1      VAL  19 -14.204  10.045  -3.810
  148   HG13  VAL  19          3HG1      VAL  19 -13.606  10.581  -2.239
  149   HG21  VAL  19          1HG2      VAL  19 -12.025   7.923  -1.650
  150   HG22  VAL  19          2HG2      VAL  19 -11.544   9.587  -1.307
  151   HG23  VAL  19          3HG2      VAL  19 -10.520   8.560  -2.313
  152    H    SER  20           H        SER  20 -12.545   9.865  -6.146
  153    HA   SER  20           HA       SER  20 -15.332   9.789  -6.567
  154    HB2  SER  20          1HB       SER  20 -14.712  11.091  -8.676
  155    HB3  SER  20          2HB       SER  20 -14.182  11.778  -7.140
  156    HG   SER  20           HG       SER  20 -12.284  11.769  -8.038
  157    H    SER  21           H        SER  21 -12.692   7.972  -8.008
  158    HA   SER  21           HA       SER  21 -14.202   7.087 -10.282
  159    HB2  SER  21          1HB       SER  21 -11.592   6.113  -9.101
  160    HB3  SER  21          2HB       SER  21 -12.259   5.561 -10.637
  161    HG   SER  21           HG       SER  21 -11.225   8.093  -9.936
  162    H    LEU  22           H        LEU  22 -13.128   5.538  -7.245
  163    HA   LEU  22           HA       LEU  22 -14.517   3.097  -7.913
  164    HB2  LEU  22          1HB       LEU  22 -12.977   3.985  -5.480
  165    HB3  LEU  22          2HB       LEU  22 -13.712   2.388  -5.633
  166    HG   LEU  22           HG       LEU  22 -11.665   3.449  -7.573
  167   HD11  LEU  22          1HD1      LEU  22 -10.050   2.041  -6.369
  168   HD12  LEU  22          2HD1      LEU  22 -11.278   1.709  -5.144
  169   HD13  LEU  22          3HD1      LEU  22 -10.668   3.349  -5.359
  170   HD21  LEU  22          1HD2      LEU  22 -12.603   0.650  -6.974
  171   HD22  LEU  22          2HD2      LEU  22 -11.460   1.141  -8.227
  172   HD23  LEU  22          3HD2      LEU  22 -13.151   1.630  -8.333
  173    H    ASN  23           H        ASN  23 -15.692   5.913  -7.004
  174    HA   ASN  23           HA       ASN  23 -17.478   6.737  -5.881
  175    HB2  ASN  23          1HB       ASN  23 -18.599   5.041  -7.330
  176    HB3  ASN  23          2HB       ASN  23 -18.532   3.910  -5.991
  177   HD21  ASN  23          1HD2      ASN  23 -20.791   3.771  -5.919
  178   HD22  ASN  23          2HD2      ASN  23 -21.764   5.058  -5.284
  179    H    ILE  24           H        ILE  24 -15.319   6.087  -4.277
  180    HA   ILE  24           HA       ILE  24 -15.980   4.606  -1.971
  181    HB   ILE  24           HB       ILE  24 -14.043   6.913  -2.166
  182   HG12  ILE  24          1HG1      ILE  24 -13.597   5.226  -3.921
  183   HG13  ILE  24          2HG1      ILE  24 -12.322   5.261  -2.706
  184   HG21  ILE  24          1HG2      ILE  24 -12.910   5.838  -0.313
  185   HG22  ILE  24          2HG2      ILE  24 -14.110   4.546  -0.305
  186   HG23  ILE  24          3HG2      ILE  24 -14.585   6.192   0.110
  187   HD11  ILE  24          1HD1      ILE  24 -14.535   3.231  -2.907
  188   HD12  ILE  24          2HD1      ILE  24 -13.279   3.259  -1.668
  189   HD13  ILE  24          3HD1      ILE  24 -12.847   2.989  -3.357
  190    HA   PRO  25           HA       PRO  25 -18.851   7.520  -0.107
  191    HB2  PRO  25          1HB       PRO  25 -18.459   5.898   2.297
  192    HB3  PRO  25          2HB       PRO  25 -19.931   6.192   1.368
  193    HG2  PRO  25          1HG       PRO  25 -18.656   3.810   1.400
  194    HG3  PRO  25          2HG       PRO  25 -19.598   4.396   0.020
  195    HD2  PRO  25          1HD       PRO  25 -16.640   4.291   0.389
  196    HD3  PRO  25          2HD       PRO  25 -17.610   4.075  -1.088
  197    H    ALA  26           H        ALA  26 -18.646   9.231   1.199
  198    HA   ALA  26           HA       ALA  26 -16.135  10.287   1.770
  199    HB1  ALA  26          1HB       ALA  26 -18.788  10.992   3.010
  200    HB2  ALA  26          2HB       ALA  26 -18.150  11.631   1.494
  201    HB3  ALA  26          3HB       ALA  26 -17.343  12.001   3.021
  202    H    ASP  27           H        ASP  27 -18.307   8.394   3.757
  203    HA   ASP  27           HA       ASP  27 -17.241   8.685   6.280
  204    HB2  ASP  27          1HB       ASP  27 -18.319   6.205   4.936
  205    HB3  ASP  27          2HB       ASP  27 -17.933   6.285   6.649
  206    H    TYR  28           H        TYR  28 -16.242   6.257   3.862
  207    HA   TYR  28           HA       TYR  28 -14.088   5.258   5.326
  208    HB2  TYR  28          1HB       TYR  28 -14.797   5.257   2.411
  209    HB3  TYR  28          2HB       TYR  28 -13.257   4.584   2.944
  210    HD1  TYR  28           HD1      TYR  28 -13.172   2.463   4.072
  211    HD2  TYR  28           HD2      TYR  28 -16.922   4.239   3.143
  212    HE1  TYR  28           HE1      TYR  28 -14.300   0.345   4.599
  213    HE2  TYR  28           HE2      TYR  28 -18.062   2.124   3.664
  214    HH   TYR  28           HH       TYR  28 -17.546  -0.264   3.784
  215    H    VAL  29           H        VAL  29 -14.331   7.961   3.098
  216    HA   VAL  29           HA       VAL  29 -11.632   8.454   2.624
  217    HB   VAL  29           HB       VAL  29 -13.868  10.463   2.786
  218   HG11  VAL  29          1HG1      VAL  29 -12.444  11.788   1.256
  219   HG12  VAL  29          2HG1      VAL  29 -11.153  10.606   1.491
  220   HG13  VAL  29          3HG1      VAL  29 -11.725  11.569   2.851
  221   HG21  VAL  29          1HG2      VAL  29 -12.800   8.825   0.500
  222   HG22  VAL  29          2HG2      VAL  29 -13.941  10.158   0.327
  223   HG23  VAL  29          3HG2      VAL  29 -14.402   8.714   1.228
  224    H    GLU  30           H        GLU  30 -13.730   9.694   5.238
  225    HA   GLU  30           HA       GLU  30 -11.820  11.392   6.436
  226    HB2  GLU  30          1HB       GLU  30 -13.840   9.896   8.077
  227    HB3  GLU  30          2HB       GLU  30 -13.224  11.530   8.280
  228    HG2  GLU  30          1HG       GLU  30 -14.403  12.131   6.163
  229    HG3  GLU  30          2HG       GLU  30 -15.187  10.555   6.244
  230    H    LYS  31           H        LYS  31 -12.437   7.975   6.724
  231    HA   LYS  31           HA       LYS  31 -10.782   7.513   8.981
  232    HB2  LYS  31          1HB       LYS  31 -11.721   5.586   6.850
  233    HB3  LYS  31          2HB       LYS  31 -11.004   5.144   8.407
  234    HG2  LYS  31          1HG       LYS  31 -12.879   6.325   9.533
  235    HG3  LYS  31          2HG       LYS  31 -13.614   6.572   7.947
  236    HD2  LYS  31          1HD       LYS  31 -13.718   4.156   7.608
  237    HD3  LYS  31          2HD       LYS  31 -12.970   3.897   9.197
  238    HE2  LYS  31          1HE       LYS  31 -15.432   3.632   9.261
  239    HE3  LYS  31          2HE       LYS  31 -14.871   4.942  10.297
  240    HZ1  LYS  31          1HZ       LYS  31 -16.028   5.267   7.583
  241    HZ2  LYS  31          2HZ       LYS  31 -15.513   6.524   8.590
  242    HZ3  LYS  31          3HZ       LYS  31 -16.834   5.569   9.037
  243    H    PHE  32           H        PHE  32 -10.266   7.129   5.484
  244    HA   PHE  32           HA       PHE  32  -7.704   6.040   5.571
  245    HB2  PHE  32          1HB       PHE  32  -8.809   7.909   3.473
  246    HB3  PHE  32          2HB       PHE  32  -7.444   6.818   3.275
  247    HD1  PHE  32           HD1      PHE  32  -8.788   4.498   4.833
  248    HD2  PHE  32           HD2      PHE  32 -10.064   7.015   1.651
  249    HE1  PHE  32           HE1      PHE  32 -10.297   2.733   4.045
  250    HE2  PHE  32           HE2      PHE  32 -11.576   5.247   0.861
  251    HZ   PHE  32           HZ       PHE  32 -11.696   3.102   2.057
  252    H    LYS  33           H        LYS  33  -8.712   9.424   5.563
  253    HA   LYS  33           HA       LYS  33  -6.133  10.555   5.421
  254    HB2  LYS  33          1HB       LYS  33  -8.435  11.691   5.132
  255    HB3  LYS  33          2HB       LYS  33  -8.436  11.816   6.890
  256    HG2  LYS  33          1HG       LYS  33  -6.504  13.178   6.894
  257    HG3  LYS  33          2HG       LYS  33  -6.206  12.869   5.178
  258    HD2  LYS  33          1HD       LYS  33  -7.156  15.087   5.494
  259    HD3  LYS  33          2HD       LYS  33  -8.278  14.054   4.614
  260    HE2  LYS  33          1HE       LYS  33  -9.458  15.374   6.272
  261    HE3  LYS  33          2HE       LYS  33  -9.529  13.663   6.681
  262    HZ1  LYS  33          1HZ       LYS  33  -9.067  15.057   8.608
  263    HZ2  LYS  33          2HZ       LYS  33  -7.652  15.627   7.878
  264    HZ3  LYS  33          3HZ       LYS  33  -7.788  13.995   8.300
  265    H    LYS  34           H        LYS  34  -7.950   9.157   8.027
  266    HA   LYS  34           HA       LYS  34  -6.004  10.078  10.004
  267    HB2  LYS  34          1HB       LYS  34  -8.697   8.754  10.217
  268    HB3  LYS  34          2HB       LYS  34  -7.610   8.808  11.597
  269    HG2  LYS  34          1HG       LYS  34  -8.595  11.217  10.091
  270    HG3  LYS  34          2HG       LYS  34  -9.300  10.605  11.588
  271    HD2  LYS  34          1HD       LYS  34  -7.151  10.946  12.723
  272    HD3  LYS  34          2HD       LYS  34  -6.467  11.580  11.226
  273    HE2  LYS  34          1HE       LYS  34  -8.087  13.400  11.246
  274    HE3  LYS  34          2HE       LYS  34  -8.802  12.756  12.724
  275    HZ1  LYS  34          1HZ       LYS  34  -6.731  13.150  13.874
  276    HZ2  LYS  34          2HZ       LYS  34  -7.274  14.588  13.162
  277    HZ3  LYS  34          3HZ       LYS  34  -6.007  13.719  12.455
  278    H    TRP  35           H        TRP  35  -5.510   8.020   7.876
  279    HA   TRP  35           HA       TRP  35  -4.493   6.020   7.581
  280    HB2  TRP  35          1HB       TRP  35  -3.534   6.715  10.356
  281    HB3  TRP  35          2HB       TRP  35  -2.891   5.363   9.415
  282    HD1  TRP  35           HD1      TRP  35  -2.643   9.106   9.817
  283    HE1  TRP  35           HE1      TRP  35  -0.835  10.020   8.227
  284    HE3  TRP  35           HE3      TRP  35  -1.856   4.914   6.998
  285    HZ2  TRP  35           HZ2      TRP  35   0.713   9.082   6.059
  286    HZ3  TRP  35           HZ3      TRP  35  -0.200   5.006   5.186
  287    HH2  TRP  35           HH2      TRP  35   1.061   7.039   4.724
  288    H    GLU  36           H        GLU  36  -7.129   5.669   8.233
  289    HA   GLU  36           HA       GLU  36  -7.041   3.228   9.859
  290    HB2  GLU  36          1HB       GLU  36  -8.205   5.185  10.937
  291    HB3  GLU  36          2HB       GLU  36  -9.396   5.080   9.655
  292    HG2  GLU  36          1HG       GLU  36  -9.926   2.799  10.353
  293    HG3  GLU  36          2HG       GLU  36  -8.760   2.946  11.663
  294    H    PHE  37           H        PHE  37  -7.375   1.533   8.633
  295    HA   PHE  37           HA       PHE  37  -8.964   1.858   6.168
  296    HB2  PHE  37          1HB       PHE  37  -6.582   0.032   6.602
  297    HB3  PHE  37          2HB       PHE  37  -7.459   0.246   5.093
  298    HD1  PHE  37           HD1      PHE  37  -5.187   1.843   7.500
  299    HD2  PHE  37           HD2      PHE  37  -7.029   2.129   3.670
  300    HE1  PHE  37           HE1      PHE  37  -3.670   3.688   6.908
  301    HE2  PHE  37           HE2      PHE  37  -5.522   3.979   3.081
  302    HZ   PHE  37           HZ       PHE  37  -3.839   4.759   4.698
  303    HA   PRO  38           HA       PRO  38 -11.351  -1.257   8.588
  304    HB2  PRO  38          1HB       PRO  38 -13.254  -0.560   6.417
  305    HB3  PRO  38          2HB       PRO  38 -13.523  -0.696   8.165
  306    HG2  PRO  38          1HG       PRO  38 -13.414   1.696   7.027
  307    HG3  PRO  38          2HG       PRO  38 -12.633   1.409   8.593
  308    HD2  PRO  38          1HD       PRO  38 -11.379   1.560   5.866
  309    HD3  PRO  38          2HD       PRO  38 -10.814   2.255   7.414
  310    H    GLU  39           H        GLU  39 -11.792  -3.341   8.170
  311    HA   GLU  39           HA       GLU  39 -10.623  -4.555   5.858
  312    HB2  GLU  39          1HB       GLU  39 -10.616  -5.498   8.190
  313    HB3  GLU  39          2HB       GLU  39 -12.324  -5.855   7.985
  314    HG2  GLU  39          1HG       GLU  39 -11.206  -7.863   7.529
  315    HG3  GLU  39          2HG       GLU  39 -11.633  -7.203   5.948
  316    H    ASP  40           H        ASP  40 -11.858  -3.687   4.160
  317    HA   ASP  40           HA       ASP  40 -14.249  -5.178   3.540
  318    HB2  ASP  40          1HB       ASP  40 -15.251  -3.354   4.833
  319    HB3  ASP  40          2HB       ASP  40 -14.418  -2.164   3.836
  320    H    ASP  41           H        ASP  41 -14.790  -5.124   1.381
  321    HA   ASP  41           HA       ASP  41 -12.678  -5.090  -0.402
  322    HB2  ASP  41          1HB       ASP  41 -15.635  -4.901  -0.989
  323    HB3  ASP  41          2HB       ASP  41 -14.400  -5.225  -2.197
  324    H    THR  42           H        THR  42 -14.924  -2.504   0.378
  325    HA   THR  42           HA       THR  42 -14.422  -0.740  -1.722
  326    HB   THR  42           HB       THR  42 -14.845  -0.021   1.181
  327    HG1  THR  42           HG1      THR  42 -16.568  -1.258   0.698
  328   HG21  THR  42          1HG2      THR  42 -15.386   1.473  -1.377
  329   HG22  THR  42          2HG2      THR  42 -14.196   1.883  -0.140
  330   HG23  THR  42          3HG2      THR  42 -15.917   1.989   0.224
  331    H    THR  43           H        THR  43 -12.876  -0.789   1.479
  332    HA   THR  43           HA       THR  43 -10.861   1.066   0.978
  333    HB   THR  43           HB       THR  43 -10.717  -1.307   2.840
  334    HG1  THR  43           HG1      THR  43 -11.534   0.418   4.345
  335   HG21  THR  43          1HG2      THR  43  -9.355   0.324   4.205
  336   HG22  THR  43          2HG2      THR  43  -9.312   1.358   2.776
  337   HG23  THR  43          3HG2      THR  43  -8.591  -0.249   2.723
  338    H    MET  44           H        MET  44 -11.032  -2.375   0.354
  339    HA   MET  44           HA       MET  44  -8.280  -2.862   0.067
  340    HB2  MET  44          1HB       MET  44 -10.600  -4.347  -1.164
  341    HB3  MET  44          2HB       MET  44  -8.957  -4.954  -1.027
  342    HG2  MET  44          1HG       MET  44  -9.097  -4.916   1.381
  343    HG3  MET  44          2HG       MET  44 -10.701  -4.197   1.304
  344    HE1  MET  44          1HE       MET  44 -11.598  -6.027   2.951
  345    HE2  MET  44          2HE       MET  44  -9.993  -6.755   3.030
  346    HE3  MET  44          3HE       MET  44 -11.404  -7.763   2.701
  347    H    CYS  45           H        CYS  45 -10.785  -2.289  -2.410
  348    HA   CYS  45           HA       CYS  45  -8.810  -2.378  -4.493
  349    HB2  CYS  45          1HB       CYS  45 -11.460  -2.817  -4.590
  350    HB3  CYS  45          2HB       CYS  45 -11.437  -1.125  -5.095
  351    H    TYR  46           H        TYR  46 -10.181   0.085  -2.483
  352    HA   TYR  46           HA       TYR  46  -9.419   2.367  -3.883
  353    HB2  TYR  46          1HB       TYR  46 -10.709   2.722  -1.964
  354    HB3  TYR  46          2HB       TYR  46  -9.665   1.719  -0.959
  355    HD1  TYR  46           HD1      TYR  46  -9.740   4.952  -2.825
  356    HD2  TYR  46           HD2      TYR  46  -8.022   2.712   0.364
  357    HE1  TYR  46           HE1      TYR  46  -8.591   6.971  -2.025
  358    HE2  TYR  46           HE2      TYR  46  -6.862   4.726   1.161
  359    HH   TYR  46           HH       TYR  46  -6.169   6.873   0.461
  360    H    ILE  47           H        ILE  47  -7.613   0.351  -1.613
  361    HA   ILE  47           HA       ILE  47  -5.183   1.708  -1.715
  362    HB   ILE  47           HB       ILE  47  -5.764  -1.206  -1.223
  363   HG12  ILE  47          1HG1      ILE  47  -6.730   0.294   0.437
  364   HG13  ILE  47          2HG1      ILE  47  -5.381  -0.587   1.150
  365   HG21  ILE  47          1HG2      ILE  47  -3.172   0.289  -0.869
  366   HG22  ILE  47          2HG2      ILE  47  -3.481  -1.057  -1.966
  367   HG23  ILE  47          3HG2      ILE  47  -3.499  -1.317  -0.222
  368   HD11  ILE  47          1HD1      ILE  47  -5.437   2.281   0.257
  369   HD12  ILE  47          2HD1      ILE  47  -3.964   1.430   0.730
  370   HD13  ILE  47          3HD1      ILE  47  -5.267   1.656   1.898
  371    H    LYS  48           H        LYS  48  -6.505  -0.826  -3.814
  372    HA   LYS  48           HA       LYS  48  -4.149  -1.346  -5.247
  373    HB2  LYS  48          1HB       LYS  48  -6.275  -2.723  -5.300
  374    HB3  LYS  48          2HB       LYS  48  -6.941  -1.515  -6.389
  375    HG2  LYS  48          1HG       LYS  48  -5.145  -1.961  -7.989
  376    HG3  LYS  48          2HG       LYS  48  -4.469  -3.164  -6.892
  377    HD2  LYS  48          1HD       LYS  48  -5.683  -4.449  -8.393
  378    HD3  LYS  48          2HD       LYS  48  -6.797  -4.271  -7.040
  379    HE2  LYS  48          1HE       LYS  48  -8.064  -3.903  -9.002
  380    HE3  LYS  48          2HE       LYS  48  -7.801  -2.317  -8.279
  381    HZ1  LYS  48          1HZ       LYS  48  -6.044  -1.902  -9.857
  382    HZ2  LYS  48          2HZ       LYS  48  -7.450  -2.330 -10.691
  383    HZ3  LYS  48          3HZ       LYS  48  -6.199  -3.459 -10.512
  384    H    CYS  49           H        CYS  49  -6.866   0.836  -5.942
  385    HA   CYS  49           HA       CYS  49  -5.931   1.883  -8.336
  386    HB2  CYS  49          1HB       CYS  49  -8.170   2.316  -7.718
  387    HB3  CYS  49          2HB       CYS  49  -7.700   3.085  -6.204
  388    H    VAL  50           H        VAL  50  -5.403   3.077  -5.026
  389    HA   VAL  50           HA       VAL  50  -3.946   5.355  -5.757
  390    HB   VAL  50           HB       VAL  50  -4.044   3.800  -3.179
  391   HG11  VAL  50          1HG1      VAL  50  -1.937   5.013  -3.271
  392   HG12  VAL  50          2HG1      VAL  50  -3.038   5.773  -2.122
  393   HG13  VAL  50          3HG1      VAL  50  -2.792   6.492  -3.712
  394   HG21  VAL  50          1HG2      VAL  50  -5.447   5.678  -2.451
  395   HG22  VAL  50          2HG2      VAL  50  -6.136   4.818  -3.828
  396   HG23  VAL  50          3HG2      VAL  50  -5.331   6.368  -4.070
  397    H    PHE  51           H        PHE  51  -2.926   2.138  -4.705
  398    HA   PHE  51           HA       PHE  51  -0.166   2.625  -4.716
  399    HB2  PHE  51          1HB       PHE  51  -1.925   0.238  -4.636
  400    HB3  PHE  51          2HB       PHE  51  -0.254  -0.032  -5.112
  401    HD1  PHE  51           HD1      PHE  51  -1.176   2.618  -2.743
  402    HD2  PHE  51           HD2      PHE  51   0.205  -1.387  -3.181
  403    HE1  PHE  51           HE1      PHE  51  -0.547   2.573  -0.366
  404    HE2  PHE  51           HE2      PHE  51   0.832  -1.434  -0.807
  405    HZ   PHE  51           HZ       PHE  51   0.458   0.547   0.605
  406    H    ASN  52           H        ASN  52  -2.416   1.835  -7.227
  407    HA   ASN  52           HA       ASN  52  -0.441   1.016  -9.153
  408    HB2  ASN  52          1HB       ASN  52  -2.823   0.237  -9.180
  409    HB3  ASN  52          2HB       ASN  52  -3.312   1.876  -9.618
  410   HD21  ASN  52          1HD2      ASN  52  -0.448   0.174 -10.783
  411   HD22  ASN  52          2HD2      ASN  52  -0.964   0.069 -12.429
  412    H    LYS  53           H        LYS  53  -2.199   3.933  -8.341
  413    HA   LYS  53           HA       LYS  53  -1.325   5.466 -10.572
  414    HB2  LYS  53          1HB       LYS  53  -2.653   6.084  -7.958
  415    HB3  LYS  53          2HB       LYS  53  -2.064   7.398  -8.965
  416    HG2  LYS  53          1HG       LYS  53  -3.528   6.779 -10.748
  417    HG3  LYS  53          2HG       LYS  53  -3.962   5.272  -9.938
  418    HD2  LYS  53          1HD       LYS  53  -5.724   6.942  -9.708
  419    HD3  LYS  53          2HD       LYS  53  -5.023   6.527  -8.144
  420    HE2  LYS  53          1HE       LYS  53  -5.383   8.929  -8.328
  421    HE3  LYS  53          2HE       LYS  53  -3.667   8.557  -8.208
  422    HZ1  LYS  53          1HZ       LYS  53  -5.018   9.007 -10.800
  423    HZ2  LYS  53          2HZ       LYS  53  -3.358   8.996 -10.479
  424    HZ3  LYS  53          3HZ       LYS  53  -4.321  10.263  -9.905
  425    H    MET  54           H        MET  54  -0.018   4.751  -7.446
  426    HA   MET  54           HA       MET  54   2.019   6.802  -7.636
  427    HB2  MET  54          1HB       MET  54   1.399   4.673  -5.599
  428    HB3  MET  54          2HB       MET  54   2.843   5.678  -5.501
  429    HG2  MET  54          1HG       MET  54   1.531   7.650  -5.286
  430    HG3  MET  54          2HG       MET  54   0.050   6.769  -5.639
  431    HE1  MET  54          1HE       MET  54   2.414   6.673  -1.696
  432    HE2  MET  54          2HE       MET  54   2.786   7.651  -3.116
  433    HE3  MET  54          3HE       MET  54   3.099   5.917  -3.134
  434    H    GLN  55           H        GLN  55   1.586   4.008  -9.159
  435    HA   GLN  55           HA       GLN  55   2.810   2.428 -10.150
  436    HB2  GLN  55          1HB       GLN  55   4.665   4.738 -10.014
  437    HB3  GLN  55          2HB       GLN  55   5.303   3.190 -10.573
  438    HG2  GLN  55          1HG       GLN  55   3.460   3.150 -12.252
  439    HG3  GLN  55          2HG       GLN  55   3.041   4.780 -11.743
  440   HE21  GLN  55          1HE2      GLN  55   5.387   2.784 -13.316
  441   HE22  GLN  55          2HE2      GLN  55   6.278   4.062 -14.078
  442    H    LEU  56           H        LEU  56   2.443   1.757  -7.653
  443    HA   LEU  56           HA       LEU  56   5.042   0.842  -6.686
  444    HB2  LEU  56          1HB       LEU  56   2.836   2.215  -5.334
  445    HB3  LEU  56          2HB       LEU  56   3.448   0.814  -4.442
  446    HG   LEU  56           HG       LEU  56   5.066   3.169  -5.411
  447   HD11  LEU  56          1HD1      LEU  56   5.240   3.759  -3.049
  448   HD12  LEU  56          2HD1      LEU  56   4.169   2.424  -2.633
  449   HD13  LEU  56          3HD1      LEU  56   3.563   3.774  -3.589
  450   HD21  LEU  56          1HD2      LEU  56   5.800   0.733  -3.817
  451   HD22  LEU  56          2HD2      LEU  56   6.803   2.177  -3.914
  452   HD23  LEU  56          3HD2      LEU  56   6.464   1.243  -5.370
  453    H    PHE  57           H        PHE  57   1.874   0.048  -7.625
  454    HA   PHE  57           HA       PHE  57   2.416  -2.786  -7.152
  455    HB2  PHE  57          1HB       PHE  57   0.885  -2.200  -5.356
  456    HB3  PHE  57          2HB       PHE  57  -0.173  -1.355  -6.475
  457    HD1  PHE  57           HD1      PHE  57  -1.752  -2.535  -7.832
  458    HD2  PHE  57           HD2      PHE  57   0.947  -4.655  -5.310
  459    HE1  PHE  57           HE1      PHE  57  -3.084  -4.578  -8.130
  460    HE2  PHE  57           HE2      PHE  57  -0.385  -6.701  -5.606
  461    HZ   PHE  57           HZ       PHE  57  -2.401  -6.663  -7.017
  462    H    ASP  58           H        ASP  58   2.028  -3.986  -8.890
  463    HA   ASP  58           HA       ASP  58   0.710  -2.695 -11.179
  464    HB2  ASP  58          1HB       ASP  58   2.998  -3.440 -11.620
  465    HB3  ASP  58          2HB       ASP  58   2.601  -5.065 -11.081
  466    H    ASP  59           H        ASP  59  -1.057  -3.607 -12.113
  467    HA   ASP  59           HA       ASP  59  -2.722  -5.100 -10.364
  468    HB2  ASP  59          1HB       ASP  59  -3.567  -3.415 -11.954
  469    HB3  ASP  59          2HB       ASP  59  -3.128  -4.459 -13.291
  470    H    THR  60           H        THR  60  -0.489  -6.021 -12.765
  471    HA   THR  60           HA       THR  60  -1.654  -8.685 -13.055
  472    HB   THR  60           HB       THR  60   0.522  -7.232 -14.541
  473    HG1  THR  60           HG1      THR  60  -2.142  -7.517 -14.847
  474   HG21  THR  60          1HG2      THR  60   0.705  -9.179 -15.996
  475   HG22  THR  60          2HG2      THR  60  -0.441 -10.059 -14.985
  476   HG23  THR  60          3HG2      THR  60   1.134  -9.594 -14.338
  477    H    GLU  61           H        GLU  61   1.587  -7.257 -12.476
  478    HA   GLU  61           HA       GLU  61   2.625  -9.823 -11.645
  479    HB2  GLU  61          1HB       GLU  61   4.081  -7.189 -11.527
  480    HB3  GLU  61          2HB       GLU  61   4.750  -8.814 -11.628
  481    HG2  GLU  61          1HG       GLU  61   3.829  -9.068 -13.868
  482    HG3  GLU  61          2HG       GLU  61   3.187  -7.429 -13.781
  483    H    GLY  62           H        GLY  62   1.214  -7.166  -9.994
  484    HA2  GLY  62          1HA       GLY  62   0.637  -7.290  -7.703
  485    HA3  GLY  62          2HA       GLY  62   1.943  -8.453  -7.468
  486    HA   PRO  63           HA       PRO  63   3.327  -4.526  -5.474
  487    HB2  PRO  63          1HB       PRO  63   4.971  -6.483  -3.981
  488    HB3  PRO  63          2HB       PRO  63   3.927  -5.190  -3.376
  489    HG2  PRO  63          1HG       PRO  63   3.237  -7.778  -3.184
  490    HG3  PRO  63          2HG       PRO  63   2.039  -6.496  -3.444
  491    HD2  PRO  63          1HD       PRO  63   3.180  -8.460  -5.398
  492    HD3  PRO  63          2HD       PRO  63   1.527  -7.802  -5.285
  493    H    LEU  64           H        LEU  64   4.827  -3.426  -6.522
  494    HA   LEU  64           HA       LEU  64   7.023  -4.797  -7.840
  495    HB2  LEU  64          1HB       LEU  64   6.417  -1.835  -7.781
  496    HB3  LEU  64          2HB       LEU  64   7.499  -2.674  -8.877
  497    HG   LEU  64           HG       LEU  64   4.514  -3.097  -8.793
  498   HD11  LEU  64          1HD1      LEU  64   6.205  -1.555 -10.758
  499   HD12  LEU  64          2HD1      LEU  64   5.054  -0.867  -9.611
  500   HD13  LEU  64          3HD1      LEU  64   4.482  -1.897 -10.922
  501   HD21  LEU  64          1HD2      LEU  64   6.593  -4.051 -10.753
  502   HD22  LEU  64          2HD2      LEU  64   4.858  -4.367 -10.822
  503   HD23  LEU  64          3HD2      LEU  64   5.828  -5.043  -9.513
  504    H    VAL  65           H        VAL  65   8.288  -5.501  -6.226
  505    HA   VAL  65           HA       VAL  65   8.853  -4.327  -3.822
  506    HB   VAL  65           HB       VAL  65  10.576  -6.186  -5.434
  507   HG11  VAL  65          1HG1      VAL  65  11.676  -6.726  -3.298
  508   HG12  VAL  65          2HG1      VAL  65  10.786  -5.415  -2.526
  509   HG13  VAL  65          3HG1      VAL  65  11.960  -5.057  -3.794
  510   HG21  VAL  65          1HG2      VAL  65   8.593  -6.629  -3.214
  511   HG22  VAL  65          2HG2      VAL  65   9.636  -7.876  -3.900
  512   HG23  VAL  65          3HG2      VAL  65   8.412  -7.099  -4.903
  513    H    ASP  66           H        ASP  66  10.618  -3.890  -6.873
  514    HA   ASP  66           HA       ASP  66  12.847  -2.580  -5.800
  515    HB2  ASP  66          1HB       ASP  66  12.710  -3.467  -8.102
  516    HB3  ASP  66          2HB       ASP  66  11.636  -2.138  -8.528
  517    H    ASN  67           H        ASN  67   9.910  -1.177  -7.257
  518    HA   ASN  67           HA       ASN  67  10.561   1.501  -6.661
  519    HB2  ASN  67          1HB       ASN  67   7.921   0.156  -7.220
  520    HB3  ASN  67          2HB       ASN  67   8.081   1.889  -6.970
  521   HD21  ASN  67          1HD2      ASN  67   7.326   2.309  -9.038
  522   HD22  ASN  67          2HD2      ASN  67   8.310   2.059 -10.442
  523    H    LEU  68           H        LEU  68   8.904  -1.020  -4.910
  524    HA   LEU  68           HA       LEU  68   7.806   0.486  -2.830
  525    HB2  LEU  68          1HB       LEU  68   8.618  -2.370  -3.139
  526    HB3  LEU  68          2HB       LEU  68   8.146  -1.776  -1.556
  527    HG   LEU  68           HG       LEU  68   6.383  -1.419  -3.964
  528   HD11  LEU  68          1HD1      LEU  68   6.835  -3.808  -3.719
  529   HD12  LEU  68          2HD1      LEU  68   5.175  -3.420  -3.271
  530   HD13  LEU  68          3HD1      LEU  68   6.381  -3.724  -2.018
  531   HD21  LEU  68          1HD2      LEU  68   5.836  -1.489  -1.005
  532   HD22  LEU  68          2HD2      LEU  68   4.644  -1.217  -2.278
  533   HD23  LEU  68          3HD2      LEU  68   5.927  -0.039  -2.002
  534    H    VAL  69           H        VAL  69  10.940  -1.169  -3.022
  535    HA   VAL  69           HA       VAL  69  11.911  -0.285  -0.515
  536    HB   VAL  69           HB       VAL  69  13.445  -1.070  -2.989
  537   HG11  VAL  69          1HG1      VAL  69  15.283  -1.535  -1.397
  538   HG12  VAL  69          2HG1      VAL  69  14.314  -0.796  -0.119
  539   HG13  VAL  69          3HG1      VAL  69  14.861   0.175  -1.485
  540   HG21  VAL  69          1HG2      VAL  69  13.617  -3.258  -1.963
  541   HG22  VAL  69          2HG2      VAL  69  11.923  -2.810  -2.161
  542   HG23  VAL  69          3HG2      VAL  69  12.685  -2.699  -0.574
  543    H    HIS  70           H        HIS  70  12.120   1.022  -3.786
  544    HA   HIS  70           HA       HIS  70  13.918   3.102  -3.292
  545    HB2  HIS  70          1HB       HIS  70  13.147   2.265  -5.528
  546    HB3  HIS  70          2HB       HIS  70  11.628   3.111  -5.267
  547    HD1  HIS  70           HD1      HIS  70  15.087   3.587  -6.414
  548    HD2  HIS  70           HD2      HIS  70  11.884   5.978  -5.280
  549    HE1  HIS  70           HE1      HIS  70  15.648   5.897  -7.225
  550    HE2  HIS  70           HE2      HIS  70  13.800   7.356  -6.332
  551    H    GLN  71           H        GLN  71  10.494   2.841  -2.665
  552    HA   GLN  71           HA       GLN  71  10.248   5.676  -2.030
  553    HB2  GLN  71          1HB       GLN  71   8.476   4.180  -3.211
  554    HB3  GLN  71          2HB       GLN  71   8.111   3.625  -1.579
  555    HG2  GLN  71          1HG       GLN  71   6.611   5.416  -2.257
  556    HG3  GLN  71          2HG       GLN  71   7.604   5.881  -0.878
  557   HE21  GLN  71          1HE2      GLN  71   7.367   8.082  -1.271
  558   HE22  GLN  71          2HE2      GLN  71   8.138   8.866  -2.600
  559    H    LEU  72           H        LEU  72   9.669   2.591  -0.356
  560    HA   LEU  72           HA       LEU  72   9.131   3.768   2.131
  561    HB2  LEU  72          1HB       LEU  72   9.962   0.968   1.414
  562    HB3  LEU  72          2HB       LEU  72   9.524   1.450   3.040
  563    HG   LEU  72           HG       LEU  72   7.701   1.637   0.640
  564   HD11  LEU  72          1HD1      LEU  72   8.195  -0.685   1.216
  565   HD12  LEU  72          2HD1      LEU  72   6.532  -0.272   1.639
  566   HD13  LEU  72          3HD1      LEU  72   7.766  -0.369   2.897
  567   HD21  LEU  72          1HD2      LEU  72   7.265   2.125   3.580
  568   HD22  LEU  72          2HD2      LEU  72   5.956   1.900   2.419
  569   HD23  LEU  72          3HD2      LEU  72   7.057   3.268   2.249
  570    H    ALA  73           H        ALA  73  12.140   2.397   0.825
  571    HA   ALA  73           HA       ALA  73  13.573   2.760   3.277
  572    HB1  ALA  73          1HB       ALA  73  14.106   0.995   1.643
  573    HB2  ALA  73          2HB       ALA  73  15.498   1.992   2.070
  574    HB3  ALA  73          3HB       ALA  73  14.673   2.238   0.530
  575    H    HIS  74           H        HIS  74  12.326   5.152   2.286
  576    HA   HIS  74           HA       HIS  74  14.244   6.893   1.110
  577    HB2  HIS  74          1HB       HIS  74  11.767   7.285   1.062
  578    HB3  HIS  74          2HB       HIS  74  11.825   7.624   2.791
  579    HD1  HIS  74           HD1      HIS  74  12.315   9.979   3.457
  580    HD2  HIS  74           HD2      HIS  74  13.216   9.246  -0.538
  581    HE1  HIS  74           HE1      HIS  74  12.853  12.224   2.461
  582    HE2  HIS  74           HE2      HIS  74  13.368  11.763   0.040
  583    H    GLY  75           H        GLY  75  16.147   6.683   2.278
  584    HA2  GLY  75          1HA       GLY  75  17.610   7.721   3.788
  585    HA3  GLY  75          2HA       GLY  75  16.229   8.237   4.744
  586    H    ARG  76           H        ARG  76  16.691   4.944   3.650
  587    HA   ARG  76           HA       ARG  76  17.603   4.111   6.284
  588    HB2  ARG  76          1HB       ARG  76  14.876   3.672   5.250
  589    HB3  ARG  76          2HB       ARG  76  15.643   2.279   6.003
  590    HG2  ARG  76          1HG       ARG  76  16.081   3.705   7.999
  591    HG3  ARG  76          2HG       ARG  76  15.112   4.970   7.241
  592    HD2  ARG  76          1HD       ARG  76  13.200   3.469   7.169
  593    HD3  ARG  76          2HD       ARG  76  14.159   2.193   7.912
  594    HE   ARG  76           HE       ARG  76  14.015   4.640   9.433
  595   HH11  ARG  76          1HH1      ARG  76  12.573   1.512   8.817
  596   HH12  ARG  76          2HH1      ARG  76  11.787   1.423  10.358
  597   HH21  ARG  76          1HH2      ARG  76  12.981   4.542  11.460
  598   HH22  ARG  76          2HH2      ARG  76  12.005   3.166  11.864
  599    H    ASP  77           H        ASP  77  17.619   1.560   6.289
  600    HA   ASP  77           HA       ASP  77  19.441   0.778   4.252
  601    HB2  ASP  77          1HB       ASP  77  18.065  -0.848   6.392
  602    HB3  ASP  77          2HB       ASP  77  19.366  -1.438   5.369
  603    H    ALA  78           H        ALA  78  18.772   0.462   2.266
  604    HA   ALA  78           HA       ALA  78  16.210  -0.241   1.423
  605    HB1  ALA  78          1HB       ALA  78  18.807  -0.740  -0.016
  606    HB2  ALA  78          2HB       ALA  78  17.928   0.789  -0.001
  607    HB3  ALA  78          3HB       ALA  78  17.202  -0.637  -0.742
  608    H    GLU  79           H        GLU  79  18.983  -2.243   2.225
  609    HA   GLU  79           HA       GLU  79  18.049  -4.700   1.245
  610    HB2  GLU  79          1HB       GLU  79  19.889  -4.085   3.554
  611    HB3  GLU  79          2HB       GLU  79  19.595  -5.708   2.949
  612    HG2  GLU  79          1HG       GLU  79  20.451  -4.977   0.741
  613    HG3  GLU  79          2HG       GLU  79  20.863  -3.420   1.457
  614    H    GLU  80           H        GLU  80  17.748  -3.222   4.449
  615    HA   GLU  80           HA       GLU  80  16.317  -5.302   5.685
  616    HB2  GLU  80          1HB       GLU  80  17.453  -3.517   6.911
  617    HB3  GLU  80          2HB       GLU  80  16.336  -2.341   6.248
  618    HG2  GLU  80          1HG       GLU  80  14.498  -3.433   7.411
  619    HG3  GLU  80          2HG       GLU  80  15.627  -4.597   8.089
  620    H    VAL  81           H        VAL  81  15.256  -2.288   4.156
  621    HA   VAL  81           HA       VAL  81  12.517  -2.575   4.530
  622    HB   VAL  81           HB       VAL  81  14.063  -1.149   2.379
  623   HG11  VAL  81          1HG1      VAL  81  11.132  -0.950   3.065
  624   HG12  VAL  81          2HG1      VAL  81  11.813  -1.558   1.556
  625   HG13  VAL  81          3HG1      VAL  81  12.003   0.143   1.987
  626   HG21  VAL  81          1HG2      VAL  81  13.497   0.815   3.756
  627   HG22  VAL  81          2HG2      VAL  81  14.506  -0.358   4.593
  628   HG23  VAL  81          3HG2      VAL  81  12.781  -0.266   4.948
  629    H    ARG  82           H        ARG  82  14.526  -3.551   1.745
  630    HA   ARG  82           HA       ARG  82  12.578  -4.650   0.119
  631    HB2  ARG  82          1HB       ARG  82  14.980  -4.354  -0.458
  632    HB3  ARG  82          2HB       ARG  82  15.359  -5.746   0.549
  633    HG2  ARG  82          1HG       ARG  82  13.873  -7.113  -0.880
  634    HG3  ARG  82          2HG       ARG  82  13.676  -5.716  -1.935
  635    HD2  ARG  82          1HD       ARG  82  16.116  -5.662  -2.261
  636    HD3  ARG  82          2HD       ARG  82  16.256  -7.119  -1.282
  637    HE   ARG  82           HE       ARG  82  14.506  -7.843  -3.213
  638   HH11  ARG  82          1HH1      ARG  82  17.690  -6.400  -3.277
  639   HH12  ARG  82          2HH1      ARG  82  18.121  -7.106  -4.802
  640   HH21  ARG  82          1HH2      ARG  82  15.073  -8.796  -5.209
  641   HH22  ARG  82          2HH2      ARG  82  16.634  -8.471  -5.901
  642    H    THR  83           H        THR  83  14.351  -6.130   2.789
  643    HA   THR  83           HA       THR  83  13.343  -8.731   2.509
  644    HB   THR  83           HB       THR  83  14.508  -7.207   4.830
  645    HG1  THR  83           HG1      THR  83  15.458  -8.636   2.744
  646   HG21  THR  83          1HG2      THR  83  13.004  -8.892   5.774
  647   HG22  THR  83          2HG2      THR  83  14.693  -9.321   6.051
  648   HG23  THR  83          3HG2      THR  83  13.771 -10.137   4.787
  649    H    GLU  84           H        GLU  84  12.339  -6.115   4.734
  650    HA   GLU  84           HA       GLU  84  10.177  -7.443   5.885
  651    HB2  GLU  84          1HB       GLU  84  10.445  -4.468   5.441
  652    HB3  GLU  84          2HB       GLU  84   9.421  -5.261   6.628
  653    HG2  GLU  84          1HG       GLU  84  11.541  -6.250   7.581
  654    HG3  GLU  84          2HG       GLU  84  12.414  -5.108   6.567
  655    H    VAL  85           H        VAL  85  10.317  -5.496   2.920
  656    HA   VAL  85           HA       VAL  85   7.558  -5.491   2.362
  657    HB   VAL  85           HB       VAL  85   9.978  -5.291   0.576
  658   HG11  VAL  85          1HG1      VAL  85   8.457  -4.657  -1.249
  659   HG12  VAL  85          2HG1      VAL  85   7.079  -5.081  -0.230
  660   HG13  VAL  85          3HG1      VAL  85   8.216  -6.330  -0.738
  661   HG21  VAL  85          1HG2      VAL  85   9.224  -2.969   0.350
  662   HG22  VAL  85          2HG2      VAL  85   9.539  -3.405   2.030
  663   HG23  VAL  85          3HG2      VAL  85   7.877  -3.309   1.439
  664    H    LEU  86           H        LEU  86  10.134  -7.692   1.257
  665    HA   LEU  86           HA       LEU  86   8.584  -9.355  -0.341
  666    HB2  LEU  86          1HB       LEU  86  11.091  -9.906   1.241
  667    HB3  LEU  86          2HB       LEU  86  10.377 -11.071   0.129
  668    HG   LEU  86           HG       LEU  86  11.217  -8.313  -0.724
  669   HD11  LEU  86          1HD1      LEU  86  13.145  -9.511   0.190
  670   HD12  LEU  86          2HD1      LEU  86  13.263  -9.327  -1.562
  671   HD13  LEU  86          3HD1      LEU  86  12.793 -10.877  -0.869
  672   HD21  LEU  86          1HD2      LEU  86  11.225  -9.374  -2.945
  673   HD22  LEU  86          2HD2      LEU  86   9.634  -9.394  -2.187
  674   HD23  LEU  86          3HD2      LEU  86  10.616 -10.858  -2.213
  675    H    LYS  87           H        LYS  87   9.053  -9.352   3.130
  676    HA   LYS  87           HA       LYS  87   7.906 -11.924   3.596
  677    HB2  LYS  87          1HB       LYS  87   8.403  -9.559   5.402
  678    HB3  LYS  87          2HB       LYS  87   7.714 -11.073   5.975
  679    HG2  LYS  87          1HG       LYS  87   9.715 -12.270   5.304
  680    HG3  LYS  87          2HG       LYS  87  10.409 -10.775   4.655
  681    HD2  LYS  87          1HD       LYS  87  10.416  -9.794   6.871
  682    HD3  LYS  87          2HD       LYS  87   9.643 -11.234   7.536
  683    HE2  LYS  87          1HE       LYS  87  11.613 -12.560   6.817
  684    HE3  LYS  87          2HE       LYS  87  12.386 -11.063   6.296
  685    HZ1  LYS  87          1HZ       LYS  87  12.197 -10.261   8.599
  686    HZ2  LYS  87          2HZ       LYS  87  13.161 -11.642   8.472
  687    HZ3  LYS  87          3HZ       LYS  87  11.580 -11.764   9.064
  688    H    CYS  88           H        CYS  88   6.570  -9.043   2.608
  689    HA   CYS  88           HA       CYS  88   3.932  -9.782   3.672
  690    HB2  CYS  88          1HB       CYS  88   5.189  -7.135   3.090
  691    HB3  CYS  88          2HB       CYS  88   3.422  -7.299   2.985
  692    H    VAL  89           H        VAL  89   5.818  -9.751   0.914
  693    HA   VAL  89           HA       VAL  89   3.811  -9.221  -1.030
  694    HB   VAL  89           HB       VAL  89   6.459 -10.651  -1.239
  695   HG11  VAL  89          1HG1      VAL  89   6.175 -10.391  -3.687
  696   HG12  VAL  89          2HG1      VAL  89   4.520  -9.848  -3.404
  697   HG13  VAL  89          3HG1      VAL  89   4.996 -11.490  -2.973
  698   HG21  VAL  89          1HG2      VAL  89   5.557  -7.893  -2.056
  699   HG22  VAL  89          2HG2      VAL  89   7.136  -8.591  -2.420
  700   HG23  VAL  89          3HG2      VAL  89   6.669  -8.295  -0.745
  701    H    ASP  90           H        ASP  90   2.067 -10.400  -1.155
  702    HA   ASP  90           HA       ASP  90   2.250 -13.310  -0.779
  703    HB2  ASP  90          1HB       ASP  90   0.854 -11.829   0.836
  704    HB3  ASP  90          2HB       ASP  90  -0.279 -11.703  -0.509
  705    H    LYS  91           H        LYS  91   0.348 -14.432  -2.011
  706    HA   LYS  91           HA       LYS  91   0.408 -13.429  -4.772
  707    HB2  LYS  91          1HB       LYS  91  -0.486 -16.171  -3.912
  708    HB3  LYS  91          2HB       LYS  91   0.073 -15.640  -5.493
  709    HG2  LYS  91          1HG       LYS  91   2.318 -15.303  -4.550
  710    HG3  LYS  91          2HG       LYS  91   1.739 -15.960  -3.025
  711    HD2  LYS  91          1HD       LYS  91   2.863 -17.703  -4.230
  712    HD3  LYS  91          2HD       LYS  91   1.135 -18.053  -4.210
  713    HE2  LYS  91          1HE       LYS  91   2.021 -18.496  -6.408
  714    HE3  LYS  91          2HE       LYS  91   0.950 -17.100  -6.482
  715    HZ1  LYS  91          1HZ       LYS  91   3.918 -17.008  -6.388
  716    HZ2  LYS  91          2HZ       LYS  91   2.898 -15.660  -6.446
  717    HZ3  LYS  91          3HZ       LYS  91   2.961 -16.725  -7.755
  718    H    ASN  92           H        ASN  92  -1.527 -13.834  -6.090
  719    HA   ASN  92           HA       ASN  92  -3.862 -12.783  -4.727
  720    HB2  ASN  92          1HB       ASN  92  -3.057 -11.882  -6.921
  721    HB3  ASN  92          2HB       ASN  92  -3.478 -13.422  -7.653
  722   HD21  ASN  92          1HD2      ASN  92  -4.852 -12.252  -9.049
  723   HD22  ASN  92          2HD2      ASN  92  -6.422 -11.739  -8.528
  724    H    THR  93           H        THR  93  -3.830 -14.979  -3.560
  725    HA   THR  93           HA       THR  93  -4.864 -17.238  -4.970
  726    HB   THR  93           HB       THR  93  -5.267 -18.113  -2.625
  727    HG1  THR  93           HG1      THR  93  -5.071 -16.729  -1.032
  728   HG21  THR  93          1HG2      THR  93  -2.875 -18.389  -2.164
  729   HG22  THR  93          2HG2      THR  93  -2.512 -17.120  -3.334
  730   HG23  THR  93          3HG2      THR  93  -3.247 -18.632  -3.869
  731    H    ASP  94           H        ASP  94  -6.283 -14.439  -3.593
  732    HA   ASP  94           HA       ASP  94  -8.867 -15.657  -3.135
  733    HB2  ASP  94          1HB       ASP  94  -8.010 -12.758  -3.025
  734    HB3  ASP  94          2HB       ASP  94  -9.597 -13.369  -2.545
  735    H    ASN  95           H        ASN  95  -7.215 -14.411  -5.753
  736    HA   ASN  95           HA       ASN  95  -7.739 -14.077  -7.913
  737    HB2  ASN  95          1HB       ASN  95  -9.103 -16.126  -7.563
  738    HB3  ASN  95          2HB       ASN  95 -10.482 -15.110  -7.191
  739   HD21  ASN  95          1HD2      ASN  95 -11.691 -15.891  -8.857
  740   HD22  ASN  95          2HD2      ASN  95 -11.357 -15.512 -10.519
  741    H    ASN  96           H        ASN  96  -8.328 -12.048  -5.757
  742    HA   ASN  96           HA       ASN  96  -9.664 -10.232  -7.625
  743    HB2  ASN  96          1HB       ASN  96 -10.132  -9.165  -5.044
  744    HB3  ASN  96          2HB       ASN  96 -11.328  -9.755  -6.191
  745   HD21  ASN  96          1HD2      ASN  96 -12.218 -11.786  -5.866
  746   HD22  ASN  96          2HD2      ASN  96 -12.013 -12.665  -4.390
  747    H    ALA  97           H        ALA  97  -8.234  -8.777  -8.224
  748    HA   ALA  97           HA       ALA  97  -5.701  -8.481  -7.055
  749    HB1  ALA  97          1HB       ALA  97  -5.369  -6.673  -8.640
  750    HB2  ALA  97          2HB       ALA  97  -7.102  -6.611  -8.959
  751    HB3  ALA  97          3HB       ALA  97  -6.171  -8.036  -9.419
  752    H    CYS  98           H        CYS  98  -8.712  -6.769  -6.557
  753    HA   CYS  98           HA       CYS  98  -7.708  -4.491  -5.237
  754    HB2  CYS  98          1HB       CYS  98 -10.327  -5.901  -4.683
  755    HB3  CYS  98          2HB       CYS  98  -9.952  -4.214  -4.342
  756    H    HIS  99           H        HIS  99  -8.504  -7.727  -4.083
  757    HA   HIS  99           HA       HIS  99  -8.008  -7.064  -1.311
  758    HB2  HIS  99          1HB       HIS  99  -9.691  -8.775  -2.108
  759    HB3  HIS  99          2HB       HIS  99  -8.339  -9.800  -2.565
  760    HD1  HIS  99           HD1      HIS  99 -10.491  -8.917   0.243
  761    HD2  HIS  99           HD2      HIS  99  -6.773 -10.691  -0.279
  762    HE1  HIS  99           HE1      HIS  99 -10.012 -10.122   2.393
  763    HE2  HIS  99           HE2      HIS  99  -7.842 -11.332   1.989
  764    H    TRP 100           H        TRP 100  -6.299  -8.326  -4.024
  765    HA   TRP 100           HA       TRP 100  -4.159  -9.606  -2.734
  766    HB2  TRP 100          1HB       TRP 100  -4.696  -9.848  -5.145
  767    HB3  TRP 100          2HB       TRP 100  -4.150  -8.195  -5.419
  768    HD1  TRP 100           HD1      TRP 100  -1.871  -9.856  -3.026
  769    HE1  TRP 100           HE1      TRP 100   0.260 -10.661  -4.212
  770    HE3  TRP 100           HE3      TRP 100  -3.399  -9.324  -7.874
  771    HZ2  TRP 100           HZ2      TRP 100   1.171 -11.038  -6.857
  772    HZ3  TRP 100           HZ3      TRP 100  -1.841  -9.930  -9.671
  773    HH2  TRP 100           HH2      TRP 100   0.397 -10.769  -9.182
  774    H    ALA 101           H        ALA 101  -4.312  -6.343  -4.163
  775    HA   ALA 101           HA       ALA 101  -1.800  -5.470  -3.265
  776    HB1  ALA 101          1HB       ALA 101  -3.038  -4.354  -5.047
  777    HB2  ALA 101          2HB       ALA 101  -2.613  -3.216  -3.767
  778    HB3  ALA 101          3HB       ALA 101  -4.258  -3.839  -3.886
  779    H    PHE 102           H        PHE 102  -4.970  -5.438  -1.795
  780    HA   PHE 102           HA       PHE 102  -4.366  -3.676   0.301
  781    HB2  PHE 102          1HB       PHE 102  -6.659  -4.165  -0.357
  782    HB3  PHE 102          2HB       PHE 102  -6.479  -5.831   0.187
  783    HD1  PHE 102           HD1      PHE 102  -7.218  -6.364   2.323
  784    HD2  PHE 102           HD2      PHE 102  -6.139  -2.345   1.441
  785    HE1  PHE 102           HE1      PHE 102  -7.971  -5.672   4.557
  786    HE2  PHE 102           HE2      PHE 102  -6.887  -1.646   3.676
  787    HZ   PHE 102           HZ       PHE 102  -7.804  -3.310   5.240
  788    H    ARG 103           H        ARG 103  -3.953  -7.151  -0.080
  789    HA   ARG 103           HA       ARG 103  -3.469  -7.702   2.666
  790    HB2  ARG 103          1HB       ARG 103  -4.093  -9.496   1.128
  791    HB3  ARG 103          2HB       ARG 103  -2.608  -9.252   0.223
  792    HG2  ARG 103          1HG       ARG 103  -1.283 -10.196   1.829
  793    HG3  ARG 103          2HG       ARG 103  -2.406  -9.815   3.127
  794    HD2  ARG 103          1HD       ARG 103  -2.218 -12.234   2.610
  795    HD3  ARG 103          2HD       ARG 103  -3.851 -11.606   2.489
  796    HE   ARG 103           HE       ARG 103  -2.125 -12.159   0.159
  797   HH11  ARG 103          1HH1      ARG 103  -5.260 -12.046   1.703
  798   HH12  ARG 103          2HH1      ARG 103  -6.075 -12.833   0.377
  799   HH21  ARG 103          1HH2      ARG 103  -3.208 -13.212  -1.586
  800   HH22  ARG 103          2HH2      ARG 103  -4.925 -13.485  -1.455
  801    H    GLY 104           H        GLY 104  -1.402  -6.857  -0.060
  802    HA2  GLY 104          1HA       GLY 104   1.084  -7.243   1.236
  803    HA3  GLY 104          2HA       GLY 104   0.795  -6.170  -0.139
  804    H    PHE 105           H        PHE 105  -0.966  -4.373   0.895
  805    HA   PHE 105           HA       PHE 105   0.719  -2.626   2.319
  806    HB2  PHE 105          1HB       PHE 105  -0.891  -1.657   0.884
  807    HB3  PHE 105          2HB       PHE 105  -2.203  -2.562   1.623
  808    HD1  PHE 105           HD1      PHE 105   0.498  -0.375   2.970
  809    HD2  PHE 105           HD2      PHE 105  -3.684  -1.113   2.647
  810    HE1  PHE 105           HE1      PHE 105   0.040   1.558   4.421
  811    HE2  PHE 105           HE2      PHE 105  -4.140   0.812   4.103
  812    HZ   PHE 105           HZ       PHE 105  -2.276   2.152   4.992
  813    H    LYS 106           H        LYS 106  -2.113  -4.509   3.278
  814    HA   LYS 106           HA       LYS 106  -2.356  -3.528   5.883
  815    HB2  LYS 106          1HB       LYS 106  -4.257  -4.577   5.199
  816    HB3  LYS 106          2HB       LYS 106  -3.401  -5.891   4.403
  817    HG2  LYS 106          1HG       LYS 106  -2.895  -6.828   6.640
  818    HG3  LYS 106          2HG       LYS 106  -3.875  -5.538   7.350
  819    HD2  LYS 106          1HD       LYS 106  -5.823  -6.312   6.124
  820    HD3  LYS 106          2HD       LYS 106  -4.860  -7.566   5.346
  821    HE2  LYS 106          1HE       LYS 106  -4.431  -8.571   7.553
  822    HE3  LYS 106          2HE       LYS 106  -5.446  -7.335   8.296
  823    HZ1  LYS 106          1HZ       LYS 106  -6.630  -9.422   7.926
  824    HZ2  LYS 106          2HZ       LYS 106  -6.364  -9.291   6.263
  825    HZ3  LYS 106          3HZ       LYS 106  -7.330  -8.146   7.058
  826    H    CYS 107           H        CYS 107  -0.623  -6.360   4.635
  827    HA   CYS 107           HA       CYS 107   0.213  -7.423   7.073
  828    HB2  CYS 107          1HB       CYS 107   0.455  -8.771   5.154
  829    HB3  CYS 107          2HB       CYS 107   1.362  -7.540   4.284
  830    H    PHE 108           H        PHE 108   1.647  -4.956   5.007
  831    HA   PHE 108           HA       PHE 108   4.116  -4.862   6.432
  832    HB2  PHE 108          1HB       PHE 108   3.694  -4.283   3.985
  833    HB3  PHE 108          2HB       PHE 108   3.052  -2.750   4.570
  834    HD1  PHE 108           HD1      PHE 108   6.033  -4.784   4.068
  835    HD2  PHE 108           HD2      PHE 108   4.539  -1.082   5.546
  836    HE1  PHE 108           HE1      PHE 108   8.315  -3.876   4.096
  837    HE2  PHE 108           HE2      PHE 108   6.822  -0.170   5.574
  838    HZ   PHE 108           HZ       PHE 108   8.712  -1.568   4.845
  839    H    GLN 109           H        GLN 109   1.255  -2.763   6.272
  840    HA   GLN 109           HA       GLN 109   2.265  -0.817   8.056
  841    HB2  GLN 109          1HB       GLN 109   0.031   0.107   8.067
  842    HB3  GLN 109          2HB       GLN 109   0.512  -0.319   6.435
  843    HG2  GLN 109          1HG       GLN 109  -1.603  -1.108   6.391
  844    HG3  GLN 109          2HG       GLN 109  -0.803  -2.540   7.040
  845   HE21  GLN 109          1HE2      GLN 109  -1.282  -3.218   9.084
  846   HE22  GLN 109          2HE2      GLN 109  -2.474  -2.469  10.091
  847    H    LYS 110           H        LYS 110   1.213  -3.932   8.661
  848    HA   LYS 110           HA       LYS 110  -0.196  -3.623  11.077
  849    HB2  LYS 110          1HB       LYS 110  -0.246  -5.690   9.787
  850    HB3  LYS 110          2HB       LYS 110   1.470  -5.928  10.064
  851    HG2  LYS 110          1HG       LYS 110   1.108  -6.231  12.414
  852    HG3  LYS 110          2HG       LYS 110  -0.610  -5.891  12.229
  853    HD2  LYS 110          1HD       LYS 110   0.822  -8.174  10.880
  854    HD3  LYS 110          2HD       LYS 110  -0.042  -8.322  12.409
  855    HE2  LYS 110          1HE       LYS 110  -1.252  -7.465   9.781
  856    HE3  LYS 110          2HE       LYS 110  -1.396  -9.066  10.503
  857    HZ1  LYS 110          1HZ       LYS 110  -3.354  -7.801  10.980
  858    HZ2  LYS 110          2HZ       LYS 110  -2.446  -6.524  11.614
  859    HZ3  LYS 110          3HZ       LYS 110  -2.491  -8.009  12.420
  860    H    ASN 111           H        ASN 111   3.246  -3.824  10.350
  861    HA   ASN 111           HA       ASN 111   3.776  -3.203  13.175
  862    HB2  ASN 111          1HB       ASN 111   5.085  -4.996  13.482
  863    HB3  ASN 111          2HB       ASN 111   4.367  -5.636  12.015
  864   HD21  ASN 111          1HD2      ASN 111   5.544  -5.650  10.112
  865   HD22  ASN 111          2HD2      ASN 111   7.249  -5.363  10.083
  866    H    ASN 112           H        ASN 112   4.242  -2.431   9.916
  867    HA   ASN 112           HA       ASN 112   6.436  -0.609  10.640
  868    HB2  ASN 112          1HB       ASN 112   6.140  -2.303   8.168
  869    HB3  ASN 112          2HB       ASN 112   7.165  -0.862   8.202
  870   HD21  ASN 112          1HD2      ASN 112   7.743  -3.784   7.926
  871   HD22  ASN 112          2HD2      ASN 112   8.966  -4.080   9.116
  872    H    LEU 113           H        LEU 113   3.974   0.398  10.922
  873    HA   LEU 113           HA       LEU 113   3.110   1.594   8.432
  874    HB2  LEU 113          1HB       LEU 113   1.374   0.981   9.951
  875    HB3  LEU 113          2HB       LEU 113   2.101   1.899  11.253
  876    HG   LEU 113           HG       LEU 113   1.623   3.984   9.965
  877   HD11  LEU 113          1HD1      LEU 113   0.006   2.181   8.183
  878   HD12  LEU 113          2HD1      LEU 113   1.560   2.880   7.744
  879   HD13  LEU 113          3HD1      LEU 113   0.181   3.930   8.060
  880   HD21  LEU 113          1HD2      LEU 113  -0.749   2.222  10.544
  881   HD22  LEU 113          2HD2      LEU 113  -0.786   3.978  10.394
  882   HD23  LEU 113          3HD2      LEU 113   0.107   3.222  11.714
  883    H    SER 114           H        SER 114   5.045   2.434  11.171
  884    HA   SER 114           HA       SER 114   4.995   5.254  10.850
  885    HB2  SER 114          1HB       SER 114   5.786   4.068  12.918
  886    HB3  SER 114          2HB       SER 114   7.234   3.585  12.032
  887    HG   SER 114           HG       SER 114   7.945   5.614  12.035
  888    H    LEU 115           H        LEU 115   6.874   2.682   9.393
  889    HA   LEU 115           HA       LEU 115   8.777   4.329   8.086
  890    HB2  LEU 115          1HB       LEU 115   9.112   1.922   8.419
  891    HB3  LEU 115          2HB       LEU 115   7.761   1.588   7.356
  892    HG   LEU 115           HG       LEU 115   9.000   2.600   5.477
  893   HD11  LEU 115          1HD1      LEU 115  11.409   3.046   5.779
  894   HD12  LEU 115          2HD1      LEU 115  11.195   2.838   7.519
  895   HD13  LEU 115          3HD1      LEU 115  10.379   4.157   6.683
  896   HD21  LEU 115          1HD2      LEU 115  10.568   0.454   6.898
  897   HD22  LEU 115          2HD2      LEU 115  10.571   0.797   5.169
  898   HD23  LEU 115          3HD2      LEU 115   9.113   0.178   5.943
  899    H    ILE 116           H        ILE 116   5.563   3.198   7.317
  900    HA   ILE 116           HA       ILE 116   5.533   3.948   4.593
  901    HB   ILE 116           HB       ILE 116   3.248   3.625   6.550
  902   HG12  ILE 116          1HG1      ILE 116   4.385   1.747   4.461
  903   HG13  ILE 116          2HG1      ILE 116   4.568   1.583   6.213
  904   HG21  ILE 116          1HG2      ILE 116   3.197   3.838   3.544
  905   HG22  ILE 116          2HG2      ILE 116   2.547   5.014   4.690
  906   HG23  ILE 116          3HG2      ILE 116   1.822   3.411   4.561
  907   HD11  ILE 116          1HD1      ILE 116   2.133   1.305   6.404
  908   HD12  ILE 116          2HD1      ILE 116   2.880   0.070   5.394
  909   HD13  ILE 116          3HD1      ILE 116   2.003   1.405   4.650
  910    H    LYS 117           H        LYS 117   4.609   5.587   7.574
  911    HA   LYS 117           HA       LYS 117   3.654   7.961   6.385
  912    HB2  LYS 117          1HB       LYS 117   4.749   7.376   9.132
  913    HB3  LYS 117          2HB       LYS 117   4.102   8.947   8.676
  914    HG2  LYS 117          1HG       LYS 117   1.939   7.941   8.200
  915    HG3  LYS 117          2HG       LYS 117   2.573   6.346   8.595
  916    HD2  LYS 117          1HD       LYS 117   2.955   7.046  10.898
  917    HD3  LYS 117          2HD       LYS 117   2.394   8.675  10.513
  918    HE2  LYS 117          1HE       LYS 117   0.179   7.821  10.010
  919    HE3  LYS 117          2HE       LYS 117   0.731   6.168  10.275
  920    HZ1  LYS 117          1HZ       LYS 117   0.633   8.308  12.329
  921    HZ2  LYS 117          2HZ       LYS 117   1.154   6.720  12.587
  922    HZ3  LYS 117          3HZ       LYS 117  -0.458   7.025  12.189
  923    H    ALA 118           H        ALA 118   6.830   6.871   7.386
  924    HA   ALA 118           HA       ALA 118   8.170   9.359   6.967
  925    HB1  ALA 118          1HB       ALA 118   9.043   7.643   8.454
  926    HB2  ALA 118          2HB       ALA 118  10.205   8.042   7.189
  927    HB3  ALA 118          3HB       ALA 118   9.257   6.559   7.080
  928    H    SER 119           H        SER 119   7.397   6.605   4.993
  929    HA   SER 119           HA       SER 119   9.165   6.944   2.880
  930    HB2  SER 119          1HB       SER 119   7.758   4.950   3.215
  931    HB3  SER 119          2HB       SER 119   6.328   5.887   2.792
  932    HG   SER 119           HG       SER 119   8.542   5.632   1.053
  933    H    ILE 120           H        ILE 120   5.985   8.404   3.416
  934    HA   ILE 120           HA       ILE 120   6.183   9.893   0.913
  935    HB   ILE 120           HB       ILE 120   3.916  10.749   1.536
  936   HG12  ILE 120          1HG1      ILE 120   4.070   8.702   3.750
  937   HG13  ILE 120          2HG1      ILE 120   4.256  10.435   4.005
  938   HG21  ILE 120          1HG2      ILE 120   2.759   8.637   1.101
  939   HG22  ILE 120          2HG2      ILE 120   4.243   7.758   1.469
  940   HG23  ILE 120          3HG2      ILE 120   4.177   8.831   0.071
  941   HD11  ILE 120          1HD1      ILE 120   2.009   9.677   4.537
  942   HD12  ILE 120          2HD1      ILE 120   1.813   9.083   2.887
  943   HD13  ILE 120          3HD1      ILE 120   2.005  10.810   3.190
  944    H    LYS 121           H        LYS 121   7.424  10.260   3.873
  945    HA   LYS 121           HA       LYS 121   6.823  13.079   4.238
  946    HB2  LYS 121          1HB       LYS 121   6.868  11.480   6.145
  947    HB3  LYS 121          2HB       LYS 121   8.588  11.252   5.868
  948    HG2  LYS 121          1HG       LYS 121   9.011  13.579   6.388
  949    HG3  LYS 121          2HG       LYS 121   7.281  13.871   6.569
  950    HD2  LYS 121          1HD       LYS 121   7.263  12.161   8.392
  951    HD3  LYS 121          2HD       LYS 121   9.023  12.102   8.276
  952    HE2  LYS 121          1HE       LYS 121   9.100  14.520   8.762
  953    HE3  LYS 121          2HE       LYS 121   7.348  14.513   8.957
  954    HZ1  LYS 121          1HZ       LYS 121   7.648  12.877  10.761
  955    HZ2  LYS 121          2HZ       LYS 121   8.375  14.365  11.094
  956    HZ3  LYS 121          3HZ       LYS 121   9.325  13.049  10.618
  957    H    LYS 122           H        LYS 122   8.140  14.681   3.651
  958    HA   LYS 122           HA       LYS 122  10.610  14.045   2.269
  959    HB2  LYS 122          1HB       LYS 122  10.083  16.877   2.684
  960    HB3  LYS 122          2HB       LYS 122  10.340  15.999   1.199
  961    HG2  LYS 122          1HG       LYS 122   7.959  15.235   1.315
  962    HG3  LYS 122          2HG       LYS 122   7.745  16.339   2.676
  963    HD2  LYS 122          1HD       LYS 122   8.458  18.209   1.234
  964    HD3  LYS 122          2HD       LYS 122   8.587  17.091  -0.123
  965    HE2  LYS 122          1HE       LYS 122   6.184  16.567   0.129
  966    HE3  LYS 122          2HE       LYS 122   6.084  17.759   1.423
  967    HZ1  LYS 122          1HZ       LYS 122   5.332  18.711  -0.643
  968    HZ2  LYS 122          2HZ       LYS 122   6.788  18.305  -1.409
  969    HZ3  LYS 122          3HZ       LYS 122   6.779  19.458  -0.174
  970    H    ASP 123           H        ASP 123  12.620  14.383   2.995
  971    HA   ASP 123           HA       ASP 123  12.974  14.735   5.821
  972    HB2  ASP 123          1HB       ASP 123  14.326  13.128   4.507
  973    HB3  ASP 123          2HB       ASP 123  15.065  14.474   3.649
  974    H21  ACD 201           H21      ACD   1  -4.347   4.407   1.349
  975    H22  ACD 201           H22      ACD   1  -3.347   5.036   2.662
  976    H31  ACD 201           H31      ACD   1  -2.022   6.348   1.133
  977    H32  ACD 201           H32      ACD   1  -3.123   6.040  -0.201
  978    H41  ACD 201           H41      ACD   1  -2.526   3.611  -0.109
  979    H42  ACD 201           H42      ACD   1  -1.120   4.638  -0.426
  980    H5   ACD 201           H5       ACD   1  -1.660   3.048   2.123
  981    H6   ACD 201           H6       ACD   1   0.518   3.830   2.708
  982    H71  ACD 201           H71      ACD   1   0.887   5.003   0.051
  983    H72  ACD 201           H72      ACD   1  -0.042   6.187   0.975
  984    H8   ACD 201           H8       ACD   1   1.866   6.582   2.495
  985    H9   ACD 201           H9       ACD   1   3.967   5.598   1.932
  986   H101  ACD 201          H101      ACD   1   2.878   4.667  -0.604
  987   H102  ACD 201          H102      ACD   1   2.426   3.433   0.572
  988    H11  ACD 201           H11      ACD   1   5.389   4.303   0.393
  989    H12  ACD 201           H12      ACD   1   5.701   1.959   0.144
  990   H131  ACD 201          H131      ACD   1   2.722   1.989  -0.538
  991   H132  ACD 201          H132      ACD   1   3.813   0.606  -0.634
  992    H14  ACD 201           H14      ACD   1   2.740   1.702   2.064
  993    H15  ACD 201           H15      ACD   1   2.595  -0.632   2.528
  994   H161  ACD 201          H161      ACD   1   2.729  -1.337  -0.276
  995   H162  ACD 201          H162      ACD   1   4.403  -0.984   0.160
  996   H171  ACD 201          H171      ACD   1   4.387  -2.660   1.913
  997   H172  ACD 201          H172      ACD   1   2.647  -2.910   1.731
  998   H181  ACD 201          H181      ACD   1   4.698  -3.463  -0.458
  999   H182  ACD 201          H182      ACD   1   2.969  -3.814  -0.532
 1000   H191  ACD 201          H191      ACD   1   4.975  -5.047   1.409
 1001   H192  ACD 201          H192      ACD   1   3.235  -5.339   1.459
 1002   H201  ACD 201          H201      ACD   1   4.397  -7.126   0.244
 1003   H202  ACD 201          H202      ACD   1   5.054  -5.980  -0.877
 1004   H203  ACD 201          H203      ACD   1   3.347  -6.266  -0.833
  Start of MODEL   15
    1    H1   MET   1          1H        MET   1  11.377   7.705 -16.887
    2    H2   MET   1          2H        MET   1  11.326   8.480 -18.386
    3    H3   MET   1          3H        MET   1  11.136   9.376 -16.967
    4    HA   MET   1           HA       MET   1  13.588   7.927 -17.784
    5    HB2  MET   1          1HB       MET   1  13.157   9.957 -19.128
    6    HB3  MET   1          2HB       MET   1  13.022  10.898 -17.649
    7    HG2  MET   1          1HG       MET   1  15.374  10.210 -17.113
    8    HG3  MET   1          2HG       MET   1  15.467   9.531 -18.734
    9    HE1  MET   1          1HE       MET   1  13.788  12.841 -17.348
   10    HE2  MET   1          2HE       MET   1  15.054  14.010 -17.724
   11    HE3  MET   1          3HE       MET   1  15.354  12.735 -16.543
   12    H    GLU   2           H        GLU   2  12.217  10.367 -15.592
   13    HA   GLU   2           HA       GLU   2  14.271   9.654 -13.615
   14    HB2  GLU   2          1HB       GLU   2  13.910  11.845 -12.637
   15    HB3  GLU   2          2HB       GLU   2  14.261  12.021 -14.347
   16    HG2  GLU   2          1HG       GLU   2  11.491  12.112 -13.170
   17    HG3  GLU   2          2HG       GLU   2  12.481  13.527 -13.508
   18    H    PHE   3           H        PHE   3  13.700   8.677 -11.807
   19    HA   PHE   3           HA       PHE   3  10.950   8.022 -11.336
   20    HB2  PHE   3          1HB       PHE   3  12.706   6.410 -10.807
   21    HB3  PHE   3          2HB       PHE   3  13.392   7.524  -9.619
   22    HD1  PHE   3           HD1      PHE   3  10.499   5.384 -10.408
   23    HD2  PHE   3           HD2      PHE   3  12.493   7.676  -7.430
   24    HE1  PHE   3           HE1      PHE   3   9.040   4.403  -8.685
   25    HE2  PHE   3           HE2      PHE   3  11.039   6.698  -5.700
   26    HZ   PHE   3           HZ       PHE   3   9.310   5.060  -6.327
   27    H    THR   4           H        THR   4   9.542   9.140 -10.224
   28    HA   THR   4           HA       THR   4  10.514  11.227  -8.369
   29    HB   THR   4           HB       THR   4   7.696  11.331  -9.253
   30    HG1  THR   4           HG1      THR   4   9.573  10.993 -11.096
   31   HG21  THR   4          1HG2      THR   4   9.872  13.402  -9.082
   32   HG22  THR   4          2HG2      THR   4   8.775  12.970  -7.772
   33   HG23  THR   4          3HG2      THR   4   8.139  13.697  -9.250
   34    H    VAL   5           H        VAL   5  10.025  11.069  -6.320
   35    HA   VAL   5           HA       VAL   5   8.533   8.724  -5.435
   36    HB   VAL   5           HB       VAL   5   9.574   8.894  -3.415
   37   HG11  VAL   5          1HG1      VAL   5  11.328   8.803  -5.086
   38   HG12  VAL   5          2HG1      VAL   5  11.857   9.620  -3.617
   39   HG13  VAL   5          3HG1      VAL   5  11.455  10.561  -5.052
   40   HG21  VAL   5          1HG2      VAL   5   9.711  11.895  -3.695
   41   HG22  VAL   5          2HG2      VAL   5  10.267  10.968  -2.301
   42   HG23  VAL   5          3HG2      VAL   5   8.555  10.988  -2.719
   43    H    SER   6           H        SER   6   6.706   8.781  -4.185
   44    HA   SER   6           HA       SER   6   5.039  11.102  -4.748
   45    HB2  SER   6          1HB       SER   6   4.258   8.429  -3.551
   46    HB3  SER   6          2HB       SER   6   3.163   9.661  -4.178
   47    HG   SER   6           HG       SER   6   4.807   7.864  -5.546
   48    H    THR   7           H        THR   7   5.230  12.696  -3.273
   49    HA   THR   7           HA       THR   7   5.775  12.102  -0.498
   50    HB   THR   7           HB       THR   7   5.778  14.529  -0.168
   51    HG1  THR   7           HG1      THR   7   4.937  14.582  -2.905
   52   HG21  THR   7          1HG2      THR   7   7.822  13.473  -0.965
   53   HG22  THR   7          2HG2      THR   7   7.651  15.087  -1.655
   54   HG23  THR   7          3HG2      THR   7   7.288  13.668  -2.634
   55    H    THR   8           H        THR   8   4.405  13.654   1.072
   56    HA   THR   8           HA       THR   8   1.880  12.499   1.328
   57    HB   THR   8           HB       THR   8   2.748  15.158   2.473
   58    HG1  THR   8           HG1      THR   8   4.027  12.979   2.791
   59   HG21  THR   8          1HG2      THR   8   0.737  13.104   3.389
   60   HG22  THR   8          2HG2      THR   8   0.384  14.719   2.772
   61   HG23  THR   8          3HG2      THR   8   1.221  14.528   4.312
   62    H    GLU   9           H        GLU   9   2.855  15.588  -0.090
   63    HA   GLU   9           HA       GLU   9   0.294  16.619  -0.548
   64    HB2  GLU   9          1HB       GLU   9   2.836  17.115  -2.097
   65    HB3  GLU   9          2HB       GLU   9   1.383  18.101  -2.178
   66    HG2  GLU   9          1HG       GLU   9   1.627  18.641   0.192
   67    HG3  GLU   9          2HG       GLU   9   3.100  17.676   0.253
   68    H    ASP  10           H        ASP  10   2.419  14.672  -2.622
   69    HA   ASP  10           HA       ASP  10   0.700  14.599  -4.866
   70    HB2  ASP  10          1HB       ASP  10   2.677  12.457  -4.045
   71    HB3  ASP  10          2HB       ASP  10   2.010  12.726  -5.651
   72    H    LEU  11           H        LEU  11   1.030  12.594  -2.005
   73    HA   LEU  11           HA       LEU  11  -0.484  10.429  -2.840
   74    HB2  LEU  11          1HB       LEU  11   0.934  10.279  -0.911
   75    HB3  LEU  11          2HB       LEU  11  -0.041  11.474  -0.045
   76    HG   LEU  11           HG       LEU  11  -1.939   9.872  -0.111
   77   HD11  LEU  11          1HD1      LEU  11  -1.545   7.569  -0.733
   78   HD12  LEU  11          2HD1      LEU  11   0.112   7.959  -1.199
   79   HD13  LEU  11          3HD1      LEU  11  -1.243   8.636  -2.102
   80   HD21  LEU  11          1HD2      LEU  11  -0.402  10.020   1.824
   81   HD22  LEU  11          2HD2      LEU  11   0.558   8.717   1.119
   82   HD23  LEU  11          3HD2      LEU  11  -1.106   8.416   1.618
   83    H    GLN  12           H        GLN  12  -1.509  13.417  -1.240
   84    HA   GLN  12           HA       GLN  12  -4.130  12.563  -0.644
   85    HB2  GLN  12          1HB       GLN  12  -3.062  15.352  -1.093
   86    HB3  GLN  12          2HB       GLN  12  -4.663  14.995  -0.468
   87    HG2  GLN  12          1HG       GLN  12  -3.531  13.784   1.426
   88    HG3  GLN  12          2HG       GLN  12  -2.011  14.456   0.837
   89   HE21  GLN  12          1HE2      GLN  12  -3.360  14.882   3.373
   90   HE22  GLN  12          2HE2      GLN  12  -3.628  16.588   3.497
   91    H    ARG  13           H        ARG  13  -2.689  13.871  -3.537
   92    HA   ARG  13           HA       ARG  13  -5.126  14.509  -4.858
   93    HB2  ARG  13          1HB       ARG  13  -2.983  15.505  -5.511
   94    HB3  ARG  13          2HB       ARG  13  -2.391  13.927  -6.007
   95    HG2  ARG  13          1HG       ARG  13  -3.080  15.286  -7.920
   96    HG3  ARG  13          2HG       ARG  13  -4.068  13.822  -7.765
   97    HD2  ARG  13          1HD       ARG  13  -5.407  15.812  -8.310
   98    HD3  ARG  13          2HD       ARG  13  -5.860  15.098  -6.764
   99    HE   ARG  13           HE       ARG  13  -3.948  17.278  -6.632
  100   HH11  ARG  13          1HH1      ARG  13  -7.324  16.351  -6.522
  101   HH12  ARG  13          2HH1      ARG  13  -7.809  17.748  -5.614
  102   HH21  ARG  13          1HH2      ARG  13  -4.583  19.120  -5.444
  103   HH22  ARG  13          2HH2      ARG  13  -6.248  19.320  -4.992
  104    H    TYR  14           H        TYR  14  -3.025  11.658  -4.767
  105    HA   TYR  14           HA       TYR  14  -4.389  10.231  -6.807
  106    HB2  TYR  14          1HB       TYR  14  -2.694   9.157  -4.544
  107    HB3  TYR  14          2HB       TYR  14  -3.203   8.256  -5.964
  108    HD1  TYR  14           HD1      TYR  14  -2.743  10.127  -8.152
  109    HD2  TYR  14           HD2      TYR  14  -0.378   9.356  -4.703
  110    HE1  TYR  14           HE1      TYR  14  -0.739  10.863  -9.365
  111    HE2  TYR  14           HE2      TYR  14   1.628  10.106  -5.902
  112    HH   TYR  14           HH       TYR  14   1.495  11.754  -8.867
  113    H    ARG  15           H        ARG  15  -4.789  10.413  -3.309
  114    HA   ARG  15           HA       ARG  15  -6.573   8.237  -3.092
  115    HB2  ARG  15          1HB       ARG  15  -6.707  10.594  -1.235
  116    HB3  ARG  15          2HB       ARG  15  -6.971   8.899  -0.893
  117    HG2  ARG  15          1HG       ARG  15  -4.498   8.578  -1.457
  118    HG3  ARG  15          2HG       ARG  15  -4.376  10.331  -1.290
  119    HD2  ARG  15          1HD       ARG  15  -5.358   8.406   0.813
  120    HD3  ARG  15          2HD       ARG  15  -3.789   9.204   0.793
  121    HE   ARG  15           HE       ARG  15  -5.645  11.229   0.740
  122   HH11  ARG  15          1HH1      ARG  15  -4.985   8.483   2.818
  123   HH12  ARG  15          2HH1      ARG  15  -5.452   9.313   4.272
  124   HH21  ARG  15          1HH2      ARG  15  -6.257  12.327   2.652
  125   HH22  ARG  15          2HH2      ARG  15  -6.143  11.515   4.178
  126    H    THR  16           H        THR  16  -7.062  11.665  -3.697
  127    HA   THR  16           HA       THR  16  -9.878  11.619  -3.631
  128    HB   THR  16           HB       THR  16  -7.921  13.457  -5.012
  129    HG1  THR  16           HG1      THR  16  -7.774  14.286  -3.082
  130   HG21  THR  16          1HG2      THR  16 -10.889  13.823  -4.602
  131   HG22  THR  16          2HG2      THR  16 -10.070  13.593  -6.148
  132   HG23  THR  16          3HG2      THR  16  -9.778  15.053  -5.204
  133    H    GLU  17           H        GLU  17  -7.524  11.374  -6.263
  134    HA   GLU  17           HA       GLU  17  -9.212  11.094  -8.429
  135    HB2  GLU  17          1HB       GLU  17  -6.441  10.371  -7.791
  136    HB3  GLU  17          2HB       GLU  17  -7.148   9.407  -9.069
  137    HG2  GLU  17          1HG       GLU  17  -6.995  12.419  -9.007
  138    HG3  GLU  17          2HG       GLU  17  -5.936  11.349  -9.934
  139    H    CYS  18           H        CYS  18  -8.114   8.629  -6.151
  140    HA   CYS  18           HA       CYS  18  -9.406   6.486  -7.542
  141    HB2  CYS  18          1HB       CYS  18  -8.117   6.639  -4.820
  142    HB3  CYS  18          2HB       CYS  18  -8.820   5.164  -5.500
  143    H    VAL  19           H        VAL  19 -10.240   8.631  -4.926
  144    HA   VAL  19           HA       VAL  19 -12.400   7.182  -3.887
  145    HB   VAL  19           HB       VAL  19 -11.600  10.059  -3.778
  146   HG11  VAL  19          1HG1      VAL  19 -14.028  10.126  -4.049
  147   HG12  VAL  19          2HG1      VAL  19 -13.547  10.590  -2.413
  148   HG13  VAL  19          3HG1      VAL  19 -14.209   8.982  -2.715
  149   HG21  VAL  19          1HG2      VAL  19 -12.113   7.928  -1.707
  150   HG22  VAL  19          2HG2      VAL  19 -11.575   9.574  -1.366
  151   HG23  VAL  19          3HG2      VAL  19 -10.537   8.478  -2.279
  152    H    SER  20           H        SER  20 -12.312   9.812  -6.253
  153    HA   SER  20           HA       SER  20 -15.073   9.748  -6.827
  154    HB2  SER  20          1HB       SER  20 -13.615  11.679  -7.278
  155    HB3  SER  20          2HB       SER  20 -12.774  10.755  -8.520
  156    HG   SER  20           HG       SER  20 -15.567  11.062  -8.660
  157    H    SER  21           H        SER  21 -12.358   7.914  -8.097
  158    HA   SER  21           HA       SER  21 -13.706   7.052 -10.476
  159    HB2  SER  21          1HB       SER  21 -11.215   7.224 -10.234
  160    HB3  SER  21          2HB       SER  21 -11.272   5.837  -9.150
  161    HG   SER  21           HG       SER  21 -11.630   5.969 -11.911
  162    H    LEU  22           H        LEU  22 -12.919   5.515  -7.351
  163    HA   LEU  22           HA       LEU  22 -14.355   3.121  -8.143
  164    HB2  LEU  22          1HB       LEU  22 -12.757   3.865  -5.703
  165    HB3  LEU  22          2HB       LEU  22 -13.586   2.314  -5.872
  166    HG   LEU  22           HG       LEU  22 -11.529   3.304  -7.835
  167   HD11  LEU  22          1HD1      LEU  22 -11.184   1.500  -5.449
  168   HD12  LEU  22          2HD1      LEU  22 -10.474   3.100  -5.666
  169   HD13  LEU  22          3HD1      LEU  22  -9.975   1.765  -6.707
  170   HD21  LEU  22          1HD2      LEU  22 -12.667   0.570  -7.285
  171   HD22  LEU  22          2HD2      LEU  22 -11.455   0.975  -8.504
  172   HD23  LEU  22          3HD2      LEU  22 -13.093   1.611  -8.645
  173    H    ASN  23           H        ASN  23 -15.486   5.915  -7.272
  174    HA   ASN  23           HA       ASN  23 -17.326   6.748  -6.230
  175    HB2  ASN  23          1HB       ASN  23 -18.309   4.970  -7.718
  176    HB3  ASN  23          2HB       ASN  23 -18.374   3.926  -6.313
  177   HD21  ASN  23          1HD2      ASN  23 -18.957   7.392  -6.346
  178   HD22  ASN  23          2HD2      ASN  23 -20.631   7.289  -5.912
  179    H    ILE  24           H        ILE  24 -15.242   6.095  -4.499
  180    HA   ILE  24           HA       ILE  24 -16.035   4.572  -2.260
  181    HB   ILE  24           HB       ILE  24 -14.052   6.850  -2.304
  182   HG12  ILE  24          1HG1      ILE  24 -13.549   5.196  -4.079
  183   HG13  ILE  24          2HG1      ILE  24 -12.333   5.185  -2.805
  184   HG21  ILE  24          1HG2      ILE  24 -14.290   4.446  -0.495
  185   HG22  ILE  24          2HG2      ILE  24 -14.686   6.110  -0.069
  186   HG23  ILE  24          3HG2      ILE  24 -13.017   5.667  -0.429
  187   HD11  ILE  24          1HD1      ILE  24 -12.861   2.936  -3.541
  188   HD12  ILE  24          2HD1      ILE  24 -14.563   3.192  -3.151
  189   HD13  ILE  24          3HD1      ILE  24 -13.357   3.171  -1.863
  190    HA   PRO  25           HA       PRO  25 -18.983   7.491  -0.516
  191    HB2  PRO  25          1HB       PRO  25 -18.742   5.757   1.842
  192    HB3  PRO  25          2HB       PRO  25 -20.166   6.155   0.879
  193    HG2  PRO  25          1HG       PRO  25 -19.019   3.726   0.818
  194    HG3  PRO  25          2HG       PRO  25 -19.818   4.443  -0.592
  195    HD2  PRO  25          1HD       PRO  25 -16.901   4.190   0.013
  196    HD3  PRO  25          2HD       PRO  25 -17.753   4.059  -1.547
  197    H    ALA  26           H        ALA  26 -18.813   9.170   0.833
  198    HA   ALA  26           HA       ALA  26 -16.316  10.141   1.573
  199    HB1  ALA  26          1HB       ALA  26 -18.308  11.528   1.220
  200    HB2  ALA  26          2HB       ALA  26 -17.525  11.879   2.762
  201    HB3  ALA  26          3HB       ALA  26 -18.996  10.906   2.720
  202    H    ASP  27           H        ASP  27 -18.651   8.270   3.397
  203    HA   ASP  27           HA       ASP  27 -17.742   8.462   5.981
  204    HB2  ASP  27          1HB       ASP  27 -18.742   6.031   4.492
  205    HB3  ASP  27          2HB       ASP  27 -18.434   6.031   6.223
  206    H    TYR  28           H        TYR  28 -16.598   6.081   3.576
  207    HA   TYR  28           HA       TYR  28 -14.527   5.066   5.147
  208    HB2  TYR  28          1HB       TYR  28 -15.127   5.038   2.217
  209    HB3  TYR  28          2HB       TYR  28 -13.592   4.392   2.800
  210    HD1  TYR  28           HD1      TYR  28 -13.506   2.288   3.960
  211    HD2  TYR  28           HD2      TYR  28 -17.259   4.004   2.914
  212    HE1  TYR  28           HE1      TYR  28 -14.621   0.169   4.515
  213    HE2  TYR  28           HE2      TYR  28 -18.384   1.885   3.463
  214    HH   TYR  28           HH       TYR  28 -16.764  -0.678   5.111
  215    H    VAL  29           H        VAL  29 -14.628   7.773   2.910
  216    HA   VAL  29           HA       VAL  29 -11.889   8.210   2.596
  217    HB   VAL  29           HB       VAL  29 -14.072  10.279   2.595
  218   HG11  VAL  29          1HG1      VAL  29 -12.509  11.478   1.067
  219   HG12  VAL  29          2HG1      VAL  29 -11.282  10.272   1.463
  220   HG13  VAL  29          3HG1      VAL  29 -11.921  11.328   2.723
  221   HG21  VAL  29          1HG2      VAL  29 -14.069   9.916   0.153
  222   HG22  VAL  29          2HG2      VAL  29 -14.596   8.498   1.061
  223   HG23  VAL  29          3HG2      VAL  29 -12.966   8.560   0.389
  224    H    GLU  30           H        GLU  30 -14.141   9.458   5.061
  225    HA   GLU  30           HA       GLU  30 -12.373  11.167   6.417
  226    HB2  GLU  30          1HB       GLU  30 -14.394   9.512   7.899
  227    HB3  GLU  30          2HB       GLU  30 -13.869  11.165   8.195
  228    HG2  GLU  30          1HG       GLU  30 -14.974  11.850   6.110
  229    HG3  GLU  30          2HG       GLU  30 -15.599  10.212   5.941
  230    H    LYS  31           H        LYS  31 -12.814   7.705   6.586
  231    HA   LYS  31           HA       LYS  31 -11.259   7.250   8.908
  232    HB2  LYS  31          1HB       LYS  31 -11.802   5.355   6.621
  233    HB3  LYS  31          2HB       LYS  31 -11.241   4.914   8.227
  234    HG2  LYS  31          1HG       LYS  31 -13.356   5.853   9.147
  235    HG3  LYS  31          2HG       LYS  31 -13.909   6.088   7.491
  236    HD2  LYS  31          1HD       LYS  31 -13.592   3.653   7.096
  237    HD3  LYS  31          2HD       LYS  31 -13.196   3.473   8.819
  238    HE2  LYS  31          1HE       LYS  31 -15.802   4.543   7.716
  239    HE3  LYS  31          2HE       LYS  31 -15.556   2.921   8.366
  240    HZ1  LYS  31          1HZ       LYS  31 -15.011   3.915  10.508
  241    HZ2  LYS  31          2HZ       LYS  31 -16.556   4.381  10.001
  242    HZ3  LYS  31          3HZ       LYS  31 -15.264   5.464   9.877
  243    H    PHE  32           H        PHE  32 -10.519   7.024   5.448
  244    HA   PHE  32           HA       PHE  32  -7.870   6.175   5.676
  245    HB2  PHE  32          1HB       PHE  32  -9.006   7.890   3.468
  246    HB3  PHE  32          2HB       PHE  32  -7.615   6.818   3.363
  247    HD1  PHE  32           HD1      PHE  32  -8.897   4.515   4.928
  248    HD2  PHE  32           HD2      PHE  32 -10.267   6.926   1.702
  249    HE1  PHE  32           HE1      PHE  32 -10.366   2.689   4.191
  250    HE2  PHE  32           HE2      PHE  32 -11.738   5.100   0.961
  251    HZ   PHE  32           HZ       PHE  32 -11.789   2.977   2.205
  252    H    LYS  33           H        LYS  33  -9.296   9.354   5.855
  253    HA   LYS  33           HA       LYS  33  -6.865  10.813   5.605
  254    HB2  LYS  33          1HB       LYS  33  -9.412  11.552   5.421
  255    HB3  LYS  33          2HB       LYS  33  -9.175  11.924   7.125
  256    HG2  LYS  33          1HG       LYS  33  -7.322  13.384   6.594
  257    HG3  LYS  33          2HG       LYS  33  -7.463  12.973   4.878
  258    HD2  LYS  33          1HD       LYS  33  -9.804  13.892   4.963
  259    HD3  LYS  33          2HD       LYS  33  -9.438  14.480   6.587
  260    HE2  LYS  33          1HE       LYS  33  -7.997  15.226   4.046
  261    HE3  LYS  33          2HE       LYS  33  -9.115  16.245   4.949
  262    HZ1  LYS  33          1HZ       LYS  33  -7.585  16.245   6.802
  263    HZ2  LYS  33          2HZ       LYS  33  -6.803  16.797   5.411
  264    HZ3  LYS  33          3HZ       LYS  33  -6.520  15.229   5.973
  265    H    LYS  34           H        LYS  34  -8.084   8.859   8.070
  266    HA   LYS  34           HA       LYS  34  -6.292  10.143  10.015
  267    HB2  LYS  34          1HB       LYS  34  -8.862   8.646  10.457
  268    HB3  LYS  34          2HB       LYS  34  -7.732   9.000  11.760
  269    HG2  LYS  34          1HG       LYS  34  -7.991  11.393  11.312
  270    HG3  LYS  34          2HG       LYS  34  -9.133  11.021  10.021
  271    HD2  LYS  34          1HD       LYS  34  -9.485  10.339  12.940
  272    HD3  LYS  34          2HD       LYS  34 -10.281  11.662  12.086
  273    HE2  LYS  34          1HE       LYS  34 -11.317   9.990  10.572
  274    HE3  LYS  34          2HE       LYS  34 -10.601   8.711  11.551
  275    HZ1  LYS  34          1HZ       LYS  34 -12.871   9.093  12.203
  276    HZ2  LYS  34          2HZ       LYS  34 -12.564  10.733  12.480
  277    HZ3  LYS  34          3HZ       LYS  34 -11.842   9.561  13.462
  278    H    TRP  35           H        TRP  35  -5.851   8.054   7.923
  279    HA   TRP  35           HA       TRP  35  -4.757   6.103   7.607
  280    HB2  TRP  35          1HB       TRP  35  -3.782   6.800  10.372
  281    HB3  TRP  35          2HB       TRP  35  -3.148   5.431   9.449
  282    HD1  TRP  35           HD1      TRP  35  -3.029   9.223   9.665
  283    HE1  TRP  35           HE1      TRP  35  -1.180  10.098   8.106
  284    HE3  TRP  35           HE3      TRP  35  -1.918   4.879   7.206
  285    HZ2  TRP  35           HZ2      TRP  35   0.515   9.085   6.102
  286    HZ3  TRP  35           HZ3      TRP  35  -0.171   4.919   5.481
  287    HH2  TRP  35           HH2      TRP  35   1.026   6.971   4.936
  288    H    GLU  36           H        GLU  36  -7.380   5.703   8.268
  289    HA   GLU  36           HA       GLU  36  -7.253   3.212   9.826
  290    HB2  GLU  36          1HB       GLU  36  -9.511   5.184   9.542
  291    HB3  GLU  36          2HB       GLU  36  -9.739   3.554  10.159
  292    HG2  GLU  36          1HG       GLU  36  -8.194   4.041  11.983
  293    HG3  GLU  36          2HG       GLU  36  -7.974   5.669  11.350
  294    H    PHE  37           H        PHE  37  -7.386   1.498   8.593
  295    HA   PHE  37           HA       PHE  37  -8.914   1.680   6.081
  296    HB2  PHE  37          1HB       PHE  37  -6.393   0.052   6.532
  297    HB3  PHE  37          2HB       PHE  37  -7.253   0.254   5.007
  298    HD1  PHE  37           HD1      PHE  37  -7.025   2.279   3.712
  299    HD2  PHE  37           HD2      PHE  37  -5.047   1.846   7.460
  300    HE1  PHE  37           HE1      PHE  37  -5.646   4.247   3.213
  301    HE2  PHE  37           HE2      PHE  37  -3.664   3.812   6.961
  302    HZ   PHE  37           HZ       PHE  37  -3.962   5.018   4.838
  303    HA   PRO  38           HA       PRO  38 -10.861  -1.622   8.678
  304    HB2  PRO  38          1HB       PRO  38 -13.075  -0.913   6.839
  305    HB3  PRO  38          2HB       PRO  38 -13.079  -1.115   8.601
  306    HG2  PRO  38          1HG       PRO  38 -13.237   1.311   7.541
  307    HG3  PRO  38          2HG       PRO  38 -12.240   1.015   8.978
  308    HD2  PRO  38          1HD       PRO  38 -11.371   1.291   6.110
  309    HD3  PRO  38          2HD       PRO  38 -10.642   1.988   7.591
  310    H    GLU  39           H        GLU  39 -11.292  -3.700   8.158
  311    HA   GLU  39           HA       GLU  39 -10.391  -4.663   5.631
  312    HB2  GLU  39          1HB       GLU  39 -10.007  -5.910   7.698
  313    HB3  GLU  39          2HB       GLU  39 -11.740  -6.122   7.904
  314    HG2  GLU  39          1HG       GLU  39 -11.846  -7.450   5.887
  315    HG3  GLU  39          2HG       GLU  39 -10.125  -7.187   5.601
  316    H    ASP  40           H        ASP  40 -11.708  -3.823   4.103
  317    HA   ASP  40           HA       ASP  40 -14.224  -5.175   3.671
  318    HB2  ASP  40          1HB       ASP  40 -14.995  -3.271   5.010
  319    HB3  ASP  40          2HB       ASP  40 -14.128  -2.154   3.957
  320    H    ASP  41           H        ASP  41 -14.874  -5.083   1.511
  321    HA   ASP  41           HA       ASP  41 -12.707  -5.165  -0.269
  322    HB2  ASP  41          1HB       ASP  41 -14.331  -5.630  -2.025
  323    HB3  ASP  41          2HB       ASP  41 -14.712  -6.555  -0.579
  324    H    THR  42           H        THR  42 -14.912  -2.584   0.524
  325    HA   THR  42           HA       THR  42 -14.517  -0.926  -1.721
  326    HB   THR  42           HB       THR  42 -14.899  -0.014   1.131
  327    HG1  THR  42           HG1      THR  42 -16.588  -1.336   0.884
  328   HG21  THR  42          1HG2      THR  42 -14.399   1.781  -0.405
  329   HG22  THR  42          2HG2      THR  42 -16.102   1.852   0.048
  330   HG23  THR  42          3HG2      THR  42 -15.633   1.206  -1.525
  331    H    THR  43           H        THR  43 -12.970  -0.786   1.478
  332    HA   THR  43           HA       THR  43 -10.964   1.040   0.944
  333    HB   THR  43           HB       THR  43 -10.751  -1.344   2.785
  334    HG1  THR  43           HG1      THR  43 -11.590   0.314   4.330
  335   HG21  THR  43          1HG2      THR  43  -8.649  -0.193   2.574
  336   HG22  THR  43          2HG2      THR  43  -9.358   0.232   4.135
  337   HG23  THR  43          3HG2      THR  43  -9.435   1.371   2.789
  338    H    MET  44           H        MET  44 -11.109  -2.400   0.303
  339    HA   MET  44           HA       MET  44  -8.359  -2.823  -0.133
  340    HB2  MET  44          1HB       MET  44 -10.737  -4.351  -1.178
  341    HB3  MET  44          2HB       MET  44  -9.075  -4.919  -1.233
  342    HG2  MET  44          1HG       MET  44  -8.968  -4.896   1.193
  343    HG3  MET  44          2HG       MET  44 -10.620  -4.289   1.269
  344    HE1  MET  44          1HE       MET  44 -10.987  -7.918   2.630
  345    HE2  MET  44          2HE       MET  44 -11.273  -6.202   2.933
  346    HE3  MET  44          3HE       MET  44  -9.623  -6.825   2.879
  347    H    CYS  45           H        CYS  45 -11.029  -2.347  -2.451
  348    HA   CYS  45           HA       CYS  45  -9.386  -2.361  -4.743
  349    HB2  CYS  45          1HB       CYS  45 -12.084  -1.043  -4.354
  350    HB3  CYS  45          2HB       CYS  45 -11.307  -1.339  -5.904
  351    H    TYR  46           H        TYR  46 -10.288   0.113  -2.476
  352    HA   TYR  46           HA       TYR  46  -9.472   2.382  -3.887
  353    HB2  TYR  46          1HB       TYR  46 -10.762   2.741  -1.968
  354    HB3  TYR  46          2HB       TYR  46  -9.752   1.695  -0.976
  355    HD1  TYR  46           HD1      TYR  46  -8.185   2.639   0.435
  356    HD2  TYR  46           HD2      TYR  46  -9.652   4.934  -2.837
  357    HE1  TYR  46           HE1      TYR  46  -6.997   4.610   1.295
  358    HE2  TYR  46           HE2      TYR  46  -8.469   6.911  -1.980
  359    HH   TYR  46           HH       TYR  46  -6.257   6.713   0.739
  360    H    ILE  47           H        ILE  47  -7.715   0.238  -1.689
  361    HA   ILE  47           HA       ILE  47  -5.311   1.662  -1.670
  362    HB   ILE  47           HB       ILE  47  -5.887  -1.235  -1.127
  363   HG12  ILE  47          1HG1      ILE  47  -6.851   0.334   0.480
  364   HG13  ILE  47          2HG1      ILE  47  -5.523  -0.547   1.233
  365   HG21  ILE  47          1HG2      ILE  47  -3.590  -1.116  -1.858
  366   HG22  ILE  47          2HG2      ILE  47  -3.636  -1.358  -0.112
  367   HG23  ILE  47          3HG2      ILE  47  -3.280   0.238  -0.773
  368   HD11  ILE  47          1HD1      ILE  47  -5.371   1.720   1.918
  369   HD12  ILE  47          2HD1      ILE  47  -5.531   2.300   0.262
  370   HD13  ILE  47          3HD1      ILE  47  -4.068   1.448   0.758
  371    H    LYS  48           H        LYS  48  -6.404  -0.960  -3.853
  372    HA   LYS  48           HA       LYS  48  -3.892  -1.266  -5.098
  373    HB2  LYS  48          1HB       LYS  48  -5.676  -1.810  -7.144
  374    HB3  LYS  48          2HB       LYS  48  -5.000  -2.981  -6.040
  375    HG2  LYS  48          1HG       LYS  48  -6.921  -2.994  -4.711
  376    HG3  LYS  48          2HG       LYS  48  -7.524  -1.492  -5.419
  377    HD2  LYS  48          1HD       LYS  48  -7.181  -4.074  -6.943
  378    HD3  LYS  48          2HD       LYS  48  -8.703  -3.539  -6.233
  379    HE2  LYS  48          1HE       LYS  48  -8.633  -1.520  -7.619
  380    HE3  LYS  48          2HE       LYS  48  -7.116  -2.059  -8.333
  381    HZ1  LYS  48          1HZ       LYS  48  -8.942  -2.566  -9.782
  382    HZ2  LYS  48          2HZ       LYS  48  -9.742  -3.421  -8.565
  383    HZ3  LYS  48          3HZ       LYS  48  -8.287  -4.010  -9.197
  384    H    CYS  49           H        CYS  49  -6.707   0.734  -5.935
  385    HA   CYS  49           HA       CYS  49  -5.726   1.830  -8.287
  386    HB2  CYS  49          1HB       CYS  49  -7.993   2.190  -7.768
  387    HB3  CYS  49          2HB       CYS  49  -7.620   2.951  -6.223
  388    H    VAL  50           H        VAL  50  -5.360   3.023  -4.943
  389    HA   VAL  50           HA       VAL  50  -3.952   5.352  -5.577
  390    HB   VAL  50           HB       VAL  50  -3.973   3.706  -3.051
  391   HG11  VAL  50          1HG1      VAL  50  -2.894   6.484  -3.516
  392   HG12  VAL  50          2HG1      VAL  50  -1.958   5.050  -3.086
  393   HG13  VAL  50          3HG1      VAL  50  -3.115   5.727  -1.937
  394   HG21  VAL  50          1HG2      VAL  50  -5.463   5.524  -2.266
  395   HG22  VAL  50          2HG2      VAL  50  -6.132   4.571  -3.591
  396   HG23  VAL  50          3HG2      VAL  50  -5.459   6.167  -3.907
  397    H    PHE  51           H        PHE  51  -2.859   2.136  -4.635
  398    HA   PHE  51           HA       PHE  51  -0.108   2.687  -4.649
  399    HB2  PHE  51          1HB       PHE  51  -1.811   0.242  -4.664
  400    HB3  PHE  51          2HB       PHE  51  -0.102   0.056  -5.050
  401    HD1  PHE  51           HD1      PHE  51   0.236  -1.344  -3.103
  402    HD2  PHE  51           HD2      PHE  51  -1.206   2.644  -2.711
  403    HE1  PHE  51           HE1      PHE  51   0.730  -1.403  -0.693
  404    HE2  PHE  51           HE2      PHE  51  -0.710   2.589  -0.306
  405    HZ   PHE  51           HZ       PHE  51   0.257   0.567   0.707
  406    H    ASN  52           H        ASN  52  -2.384   1.997  -7.135
  407    HA   ASN  52           HA       ASN  52  -0.462   1.263  -9.157
  408    HB2  ASN  52          1HB       ASN  52  -2.793   0.423  -9.195
  409    HB3  ASN  52          2HB       ASN  52  -3.374   2.077  -9.408
  410   HD21  ASN  52          1HD2      ASN  52  -0.540   0.649 -10.953
  411   HD22  ASN  52          2HD2      ASN  52  -1.163   0.741 -12.564
  412    H    LYS  53           H        LYS  53  -2.244   4.114  -8.171
  413    HA   LYS  53           HA       LYS  53  -1.491   5.779 -10.338
  414    HB2  LYS  53          1HB       LYS  53  -2.578   6.269  -7.589
  415    HB3  LYS  53          2HB       LYS  53  -2.107   7.619  -8.612
  416    HG2  LYS  53          1HG       LYS  53  -4.181   5.527  -9.267
  417    HG3  LYS  53          2HG       LYS  53  -4.510   7.168  -8.712
  418    HD2  LYS  53          1HD       LYS  53  -3.407   8.047 -10.736
  419    HD3  LYS  53          2HD       LYS  53  -3.137   6.391 -11.288
  420    HE2  LYS  53          1HE       LYS  53  -5.584   6.023 -11.234
  421    HE3  LYS  53          2HE       LYS  53  -5.799   7.718 -10.803
  422    HZ1  LYS  53          1HZ       LYS  53  -4.518   6.742 -13.296
  423    HZ2  LYS  53          2HZ       LYS  53  -4.802   8.358 -12.888
  424    HZ3  LYS  53          3HZ       LYS  53  -6.102   7.320 -13.174
  425    H    MET  54           H        MET  54  -0.013   4.848  -7.361
  426    HA   MET  54           HA       MET  54   1.963   6.973  -7.468
  427    HB2  MET  54          1HB       MET  54   1.413   4.756  -5.504
  428    HB3  MET  54          2HB       MET  54   2.792   5.845  -5.356
  429    HG2  MET  54          1HG       MET  54   1.402   7.706  -5.031
  430    HG3  MET  54          2HG       MET  54  -0.031   6.830  -5.556
  431    HE1  MET  54          1HE       MET  54   2.004   6.628  -1.458
  432    HE2  MET  54          2HE       MET  54   2.440   7.662  -2.817
  433    HE3  MET  54          3HE       MET  54   2.861   5.949  -2.843
  434    H    GLN  55           H        GLN  55   1.622   4.292  -9.162
  435    HA   GLN  55           HA       GLN  55   2.921   2.817 -10.237
  436    HB2  GLN  55          1HB       GLN  55   4.775   5.106  -9.778
  437    HB3  GLN  55          2HB       GLN  55   5.380   3.642 -10.560
  438    HG2  GLN  55          1HG       GLN  55   3.719   3.881 -12.302
  439    HG3  GLN  55          2HG       GLN  55   3.033   5.276 -11.481
  440   HE21  GLN  55          1HE2      GLN  55   3.388   6.634 -13.232
  441   HE22  GLN  55          2HE2      GLN  55   4.970   7.179 -13.675
  442    H    LEU  56           H        LEU  56   2.475   1.982  -7.755
  443    HA   LEU  56           HA       LEU  56   5.061   1.036  -6.768
  444    HB2  LEU  56          1HB       LEU  56   2.876   2.425  -5.397
  445    HB3  LEU  56          2HB       LEU  56   3.431   0.979  -4.540
  446    HG   LEU  56           HG       LEU  56   5.143   3.314  -5.399
  447   HD11  LEU  56          1HD1      LEU  56   3.635   3.949  -3.606
  448   HD12  LEU  56          2HD1      LEU  56   5.277   3.797  -2.990
  449   HD13  LEU  56          3HD1      LEU  56   4.100   2.523  -2.682
  450   HD21  LEU  56          1HD2      LEU  56   6.820   2.251  -3.910
  451   HD22  LEU  56          2HD2      LEU  56   6.457   1.308  -5.356
  452   HD23  LEU  56          3HD2      LEU  56   5.765   0.843  -3.802
  453    H    PHE  57           H        PHE  57   1.918   0.258  -7.807
  454    HA   PHE  57           HA       PHE  57   2.388  -2.577  -7.260
  455    HB2  PHE  57          1HB       PHE  57   0.900  -1.922  -5.453
  456    HB3  PHE  57          2HB       PHE  57  -0.158  -1.084  -6.576
  457    HD1  PHE  57           HD1      PHE  57  -1.838  -2.234  -7.792
  458    HD2  PHE  57           HD2      PHE  57   0.974  -4.403  -5.439
  459    HE1  PHE  57           HE1      PHE  57  -3.212  -4.259  -8.021
  460    HE2  PHE  57           HE2      PHE  57  -0.396  -6.432  -5.671
  461    HZ   PHE  57           HZ       PHE  57  -2.492  -6.361  -6.962
  462    H    ASP  58           H        ASP  58   1.731  -3.887  -8.879
  463    HA   ASP  58           HA       ASP  58   0.330  -2.628 -11.146
  464    HB2  ASP  58          1HB       ASP  58   2.655  -3.100 -11.724
  465    HB3  ASP  58          2HB       ASP  58   2.480  -4.763 -11.180
  466    H    ASP  59           H        ASP  59  -1.308  -3.822 -12.124
  467    HA   ASP  59           HA       ASP  59  -2.715  -5.520 -10.298
  468    HB2  ASP  59          1HB       ASP  59  -4.503  -5.483 -11.890
  469    HB3  ASP  59          2HB       ASP  59  -3.800  -3.880 -11.861
  470    H    THR  60           H        THR  60  -0.357  -6.150 -12.586
  471    HA   THR  60           HA       THR  60  -1.282  -8.909 -12.975
  472    HB   THR  60           HB       THR  60   0.582  -7.162 -14.565
  473    HG1  THR  60           HG1      THR  60  -1.928  -7.342 -14.711
  474   HG21  THR  60          1HG2      THR  60   1.537  -9.402 -14.454
  475   HG22  THR  60          2HG2      THR  60   0.921  -9.059 -16.072
  476   HG23  THR  60          3HG2      THR  60   0.003 -10.096 -14.978
  477    H    GLU  61           H        GLU  61   1.729  -7.042 -12.561
  478    HA   GLU  61           HA       GLU  61   3.178  -9.406 -11.735
  479    HB2  GLU  61          1HB       GLU  61   4.213  -6.585 -11.631
  480    HB3  GLU  61          2HB       GLU  61   5.112  -8.085 -11.799
  481    HG2  GLU  61          1HG       GLU  61   4.142  -8.420 -14.016
  482    HG3  GLU  61          2HG       GLU  61   3.295  -6.884 -13.861
  483    H    GLY  62           H        GLY  62   1.244  -7.185 -10.101
  484    HA2  GLY  62          1HA       GLY  62   0.720  -7.203  -7.833
  485    HA3  GLY  62          2HA       GLY  62   2.068  -8.315  -7.570
  486    HA   PRO  63           HA       PRO  63   3.265  -4.351  -5.503
  487    HB2  PRO  63          1HB       PRO  63   4.907  -6.307  -3.999
  488    HB3  PRO  63          2HB       PRO  63   3.843  -5.027  -3.399
  489    HG2  PRO  63          1HG       PRO  63   3.166  -7.624  -3.244
  490    HG3  PRO  63          2HG       PRO  63   1.964  -6.348  -3.516
  491    HD2  PRO  63          1HD       PRO  63   3.148  -8.294  -5.456
  492    HD3  PRO  63          2HD       PRO  63   1.494  -7.634  -5.379
  493    H    LEU  64           H        LEU  64   4.777  -3.212  -6.505
  494    HA   LEU  64           HA       LEU  64   6.946  -4.535  -7.902
  495    HB2  LEU  64          1HB       LEU  64   6.432  -1.568  -7.664
  496    HB3  LEU  64          2HB       LEU  64   7.435  -2.385  -8.847
  497    HG   LEU  64           HG       LEU  64   4.443  -2.709  -8.664
  498   HD11  LEU  64          1HD1      LEU  64   6.106  -1.081 -10.577
  499   HD12  LEU  64          2HD1      LEU  64   5.005  -0.450  -9.352
  500   HD13  LEU  64          3HD1      LEU  64   4.374  -1.374 -10.716
  501   HD21  LEU  64          1HD2      LEU  64   5.650  -4.641  -9.567
  502   HD22  LEU  64          2HD2      LEU  64   6.403  -3.591 -10.769
  503   HD23  LEU  64          3HD2      LEU  64   4.656  -3.841 -10.787
  504    H    VAL  65           H        VAL  65   8.245  -5.341  -6.371
  505    HA   VAL  65           HA       VAL  65   8.906  -4.338  -3.915
  506    HB   VAL  65           HB       VAL  65  10.557  -6.076  -5.732
  507   HG11  VAL  65          1HG1      VAL  65  10.887  -5.576  -2.773
  508   HG12  VAL  65          2HG1      VAL  65  11.993  -5.054  -4.046
  509   HG13  VAL  65          3HG1      VAL  65  11.769  -6.774  -3.722
  510   HG21  VAL  65          1HG2      VAL  65   8.426  -7.039  -5.196
  511   HG22  VAL  65          2HG2      VAL  65   8.648  -6.679  -3.485
  512   HG23  VAL  65          3HG2      VAL  65   9.674  -7.876  -4.276
  513    H    ASP  66           H        ASP  66  10.644  -3.768  -6.969
  514    HA   ASP  66           HA       ASP  66  12.865  -2.476  -5.872
  515    HB2  ASP  66          1HB       ASP  66  12.782  -3.273  -8.173
  516    HB3  ASP  66          2HB       ASP  66  11.593  -2.042  -8.573
  517    H    ASN  67           H        ASN  67   9.965  -0.966  -7.338
  518    HA   ASN  67           HA       ASN  67  10.617   1.666  -6.615
  519    HB2  ASN  67          1HB       ASN  67   7.970   0.358  -7.209
  520    HB3  ASN  67          2HB       ASN  67   8.118   2.069  -6.841
  521   HD21  ASN  67          1HD2      ASN  67   7.347   2.639  -8.865
  522   HD22  ASN  67          2HD2      ASN  67   8.322   2.496 -10.289
  523    H    LEU  68           H        LEU  68   8.963  -0.894  -4.910
  524    HA   LEU  68           HA       LEU  68   7.904   0.574  -2.783
  525    HB2  LEU  68          1HB       LEU  68   8.684  -2.285  -3.171
  526    HB3  LEU  68          2HB       LEU  68   8.236  -1.723  -1.568
  527    HG   LEU  68           HG       LEU  68   6.448  -1.305  -3.948
  528   HD11  LEU  68          1HD1      LEU  68   5.234  -3.306  -3.300
  529   HD12  LEU  68          2HD1      LEU  68   6.415  -3.632  -2.030
  530   HD13  LEU  68          3HD1      LEU  68   6.898  -3.709  -3.723
  531   HD21  LEU  68          1HD2      LEU  68   5.937  -1.410  -0.985
  532   HD22  LEU  68          2HD2      LEU  68   4.731  -1.111  -2.238
  533   HD23  LEU  68          3HD2      LEU  68   6.029   0.051  -1.964
  534    H    VAL  69           H        VAL  69  11.052  -0.976  -3.174
  535    HA   VAL  69           HA       VAL  69  12.048  -0.247  -0.613
  536    HB   VAL  69           HB       VAL  69  13.535  -0.962  -3.134
  537   HG11  VAL  69          1HG1      VAL  69  14.984   0.202  -1.604
  538   HG12  VAL  69          2HG1      VAL  69  15.377  -1.518  -1.585
  539   HG13  VAL  69          3HG1      VAL  69  14.435  -0.810  -0.269
  540   HG21  VAL  69          1HG2      VAL  69  13.665  -3.185  -2.218
  541   HG22  VAL  69          2HG2      VAL  69  11.974  -2.693  -2.318
  542   HG23  VAL  69          3HG2      VAL  69  12.812  -2.671  -0.764
  543    H    HIS  70           H        HIS  70  12.361   1.195  -3.857
  544    HA   HIS  70           HA       HIS  70  14.127   3.260  -3.110
  545    HB2  HIS  70          1HB       HIS  70  12.185   2.968  -5.382
  546    HB3  HIS  70          2HB       HIS  70  13.109   4.449  -5.161
  547    HD1  HIS  70           HD1      HIS  70  15.668   4.332  -5.594
  548    HD2  HIS  70           HD2      HIS  70  13.633   0.793  -6.361
  549    HE1  HIS  70           HE1      HIS  70  17.258   2.913  -6.921
  550    HE2  HIS  70           HE2      HIS  70  15.913   0.890  -7.572
  551    H    GLN  71           H        GLN  71  10.725   2.904  -2.681
  552    HA   GLN  71           HA       GLN  71  10.313   5.722  -2.068
  553    HB2  GLN  71          1HB       GLN  71   8.614   4.309  -3.280
  554    HB3  GLN  71          2HB       GLN  71   8.377   3.421  -1.781
  555    HG2  GLN  71          1HG       GLN  71   6.636   5.073  -2.076
  556    HG3  GLN  71          2HG       GLN  71   7.628   5.447  -0.672
  557   HE21  GLN  71          1HE2      GLN  71   8.872   7.275  -0.657
  558   HE22  GLN  71          2HE2      GLN  71   8.714   8.523  -1.836
  559    H    LEU  72           H        LEU  72   9.762   2.652  -0.354
  560    HA   LEU  72           HA       LEU  72   9.257   3.838   2.128
  561    HB2  LEU  72          1HB       LEU  72  10.094   1.037   1.424
  562    HB3  LEU  72          2HB       LEU  72   9.669   1.529   3.050
  563    HG   LEU  72           HG       LEU  72   7.813   1.704   0.676
  564   HD11  LEU  72          1HD1      LEU  72   8.339  -0.623   1.213
  565   HD12  LEU  72          2HD1      LEU  72   6.679  -0.232   1.670
  566   HD13  LEU  72          3HD1      LEU  72   7.935  -0.331   2.906
  567   HD21  LEU  72          1HD2      LEU  72   7.407   2.135   3.630
  568   HD22  LEU  72          2HD2      LEU  72   6.089   1.934   2.475
  569   HD23  LEU  72          3HD2      LEU  72   7.186   3.306   2.329
  570    H    ALA  73           H        ALA  73  12.231   2.372   0.851
  571    HA   ALA  73           HA       ALA  73  13.697   2.730   3.268
  572    HB1  ALA  73          1HB       ALA  73  14.147   0.945   1.633
  573    HB2  ALA  73          2HB       ALA  73  15.579   1.884   2.057
  574    HB3  ALA  73          3HB       ALA  73  14.762   2.165   0.518
  575    H    HIS  74           H        HIS  74  12.548   5.183   2.309
  576    HA   HIS  74           HA       HIS  74  14.545   6.835   1.120
  577    HB2  HIS  74          1HB       HIS  74  12.077   7.309   1.072
  578    HB3  HIS  74          2HB       HIS  74  12.160   7.682   2.791
  579    HD1  HIS  74           HD1      HIS  74  12.782  10.026   3.412
  580    HD2  HIS  74           HD2      HIS  74  13.546   9.179  -0.590
  581    HE1  HIS  74           HE1      HIS  74  13.355  12.232   2.347
  582    HE2  HIS  74           HE2      HIS  74  13.910  11.678  -0.045
  583    H    GLY  75           H        GLY  75  16.420   6.428   2.367
  584    HA2  GLY  75          1HA       GLY  75  17.906   7.374   3.942
  585    HA3  GLY  75          2HA       GLY  75  16.525   7.927   4.879
  586    H    ARG  76           H        ARG  76  17.073   4.679   3.629
  587    HA   ARG  76           HA       ARG  76  17.825   3.637   6.221
  588    HB2  ARG  76          1HB       ARG  76  15.076   3.455   5.204
  589    HB3  ARG  76          2HB       ARG  76  15.765   1.920   5.704
  590    HG2  ARG  76          1HG       ARG  76  16.349   3.025   7.885
  591    HG3  ARG  76          2HG       ARG  76  15.355   4.386   7.370
  592    HD2  ARG  76          1HD       ARG  76  13.415   3.028   7.266
  593    HD3  ARG  76          2HD       ARG  76  14.352   1.554   7.482
  594    HE   ARG  76           HE       ARG  76  14.196   3.592   9.600
  595   HH11  ARG  76          1HH1      ARG  76  13.746   0.286   8.511
  596   HH12  ARG  76          2HH1      ARG  76  13.464  -0.328  10.107
  597   HH21  ARG  76          1HH2      ARG  76  13.839   2.774  11.693
  598   HH22  ARG  76          2HH2      ARG  76  13.534   1.082  11.918
  599    H    ASP  77           H        ASP  77  18.181   1.271   6.136
  600    HA   ASP  77           HA       ASP  77  19.706   0.497   3.913
  601    HB2  ASP  77          1HB       ASP  77  18.519  -1.180   6.130
  602    HB3  ASP  77          2HB       ASP  77  19.699  -1.764   4.963
  603    H    ALA  78           H        ALA  78  18.914   0.220   2.004
  604    HA   ALA  78           HA       ALA  78  16.294  -0.299   1.277
  605    HB1  ALA  78          1HB       ALA  78  18.787  -0.936  -0.285
  606    HB2  ALA  78          2HB       ALA  78  18.015   0.647  -0.191
  607    HB3  ALA  78          3HB       ALA  78  17.168  -0.705  -0.940
  608    H    GLU  79           H        GLU  79  18.955  -2.558   1.807
  609    HA   GLU  79           HA       GLU  79  17.649  -4.857   0.795
  610    HB2  GLU  79          1HB       GLU  79  19.904  -4.552   2.769
  611    HB3  GLU  79          2HB       GLU  79  19.350  -6.106   2.161
  612    HG2  GLU  79          1HG       GLU  79  19.867  -5.361  -0.126
  613    HG3  GLU  79          2HG       GLU  79  20.506  -3.858   0.532
  614    H    GLU  80           H        GLU  80  17.831  -3.421   3.994
  615    HA   GLU  80           HA       GLU  80  16.516  -5.490   5.400
  616    HB2  GLU  80          1HB       GLU  80  17.869  -3.295   6.130
  617    HB3  GLU  80          2HB       GLU  80  16.242  -2.662   6.292
  618    HG2  GLU  80          1HG       GLU  80  17.166  -5.189   7.622
  619    HG3  GLU  80          2HG       GLU  80  17.291  -3.607   8.367
  620    H    VAL  81           H        VAL  81  15.401  -2.424   4.030
  621    HA   VAL  81           HA       VAL  81  12.678  -2.645   4.567
  622    HB   VAL  81           HB       VAL  81  14.150  -1.238   2.349
  623   HG11  VAL  81          1HG1      VAL  81  11.248  -1.005   3.141
  624   HG12  VAL  81          2HG1      VAL  81  11.873  -1.579   1.594
  625   HG13  VAL  81          3HG1      VAL  81  12.094   0.107   2.064
  626   HG21  VAL  81          1HG2      VAL  81  14.694  -0.477   4.549
  627   HG22  VAL  81          2HG2      VAL  81  12.987  -0.339   4.969
  628   HG23  VAL  81          3HG2      VAL  81  13.687   0.729   3.753
  629    H    ARG  82           H        ARG  82  14.468  -3.595   1.634
  630    HA   ARG  82           HA       ARG  82  12.421  -4.579   0.077
  631    HB2  ARG  82          1HB       ARG  82  14.830  -4.327  -0.546
  632    HB3  ARG  82          2HB       ARG  82  15.162  -5.808   0.336
  633    HG2  ARG  82          1HG       ARG  82  13.571  -6.983  -1.155
  634    HG3  ARG  82          2HG       ARG  82  13.435  -5.498  -2.092
  635    HD2  ARG  82          1HD       ARG  82  15.053  -6.977  -3.117
  636    HD3  ARG  82          2HD       ARG  82  15.852  -5.536  -2.484
  637    HE   ARG  82           HE       ARG  82  15.810  -7.882  -0.761
  638   HH11  ARG  82          1HH1      ARG  82  17.615  -5.899  -3.013
  639   HH12  ARG  82          2HH1      ARG  82  19.155  -6.530  -2.526
  640   HH21  ARG  82          1HH2      ARG  82  17.820  -8.704  -0.113
  641   HH22  ARG  82          2HH2      ARG  82  19.273  -8.133  -0.872
  642    H    THR  83           H        THR  83  14.141  -6.147   2.716
  643    HA   THR  83           HA       THR  83  13.193  -8.761   2.261
  644    HB   THR  83           HB       THR  83  14.248  -7.439   4.756
  645    HG1  THR  83           HG1      THR  83  15.928  -7.555   3.418
  646   HG21  THR  83          1HG2      THR  83  13.810 -10.374   4.192
  647   HG22  THR  83          2HG2      THR  83  12.912  -9.393   5.352
  648   HG23  THR  83          3HG2      THR  83  14.628  -9.708   5.607
  649    H    GLU  84           H        GLU  84  12.165  -6.352   4.727
  650    HA   GLU  84           HA       GLU  84  10.028  -7.907   5.651
  651    HB2  GLU  84          1HB       GLU  84   9.167  -5.584   6.476
  652    HB3  GLU  84          2HB       GLU  84  10.598  -6.314   7.186
  653    HG2  GLU  84          1HG       GLU  84  11.960  -4.911   5.613
  654    HG3  GLU  84          2HG       GLU  84  10.463  -4.082   5.191
  655    H    VAL  85           H        VAL  85  10.195  -5.649   2.954
  656    HA   VAL  85           HA       VAL  85   7.435  -5.560   2.390
  657    HB   VAL  85           HB       VAL  85   9.870  -5.339   0.627
  658   HG11  VAL  85          1HG1      VAL  85   6.983  -5.064  -0.209
  659   HG12  VAL  85          2HG1      VAL  85   8.107  -6.318  -0.736
  660   HG13  VAL  85          3HG1      VAL  85   8.382  -4.634  -1.199
  661   HG21  VAL  85          1HG2      VAL  85   9.168  -3.002   0.477
  662   HG22  VAL  85          2HG2      VAL  85   9.426  -3.500   2.150
  663   HG23  VAL  85          3HG2      VAL  85   7.785  -3.354   1.516
  664    H    LEU  86           H        LEU  86   9.980  -7.769   1.240
  665    HA   LEU  86           HA       LEU  86   8.420  -9.351  -0.428
  666    HB2  LEU  86          1HB       LEU  86  10.912  -9.993   1.143
  667    HB3  LEU  86          2HB       LEU  86  10.186 -11.107  -0.014
  668    HG   LEU  86           HG       LEU  86  11.052  -8.328  -0.773
  669   HD11  LEU  86          1HD1      LEU  86  12.631 -10.886  -1.002
  670   HD12  LEU  86          2HD1      LEU  86  12.961  -9.583   0.139
  671   HD13  LEU  86          3HD1      LEU  86  13.114  -9.295  -1.594
  672   HD21  LEU  86          1HD2      LEU  86  11.093  -9.343  -3.024
  673   HD22  LEU  86          2HD2      LEU  86   9.491  -9.363  -2.291
  674   HD23  LEU  86          3HD2      LEU  86  10.458 -10.836  -2.333
  675    H    LYS  87           H        LYS  87   8.827  -9.461   3.052
  676    HA   LYS  87           HA       LYS  87   7.684 -12.024   3.470
  677    HB2  LYS  87          1HB       LYS  87   7.936  -9.613   5.268
  678    HB3  LYS  87          2HB       LYS  87   7.249 -11.138   5.808
  679    HG2  LYS  87          1HG       LYS  87   9.355 -12.269   5.310
  680    HG3  LYS  87          2HG       LYS  87  10.052 -10.728   4.776
  681    HD2  LYS  87          1HD       LYS  87   9.726  -9.811   7.013
  682    HD3  LYS  87          2HD       LYS  87   9.002 -11.330   7.541
  683    HE2  LYS  87          1HE       LYS  87  11.095 -12.491   7.090
  684    HE3  LYS  87          2HE       LYS  87  11.822 -10.986   6.533
  685    HZ1  LYS  87          1HZ       LYS  87  10.834 -11.526   9.281
  686    HZ2  LYS  87          2HZ       LYS  87  11.508 -10.068   8.750
  687    HZ3  LYS  87          3HZ       LYS  87  12.456 -11.468   8.800
  688    H    CYS  88           H        CYS  88   6.363  -9.033   2.583
  689    HA   CYS  88           HA       CYS  88   3.682  -9.806   3.470
  690    HB2  CYS  88          1HB       CYS  88   4.958  -7.174   2.815
  691    HB3  CYS  88          2HB       CYS  88   3.188  -7.343   2.800
  692    H    VAL  89           H        VAL  89   5.668  -9.765   0.763
  693    HA   VAL  89           HA       VAL  89   3.650  -9.354  -1.230
  694    HB   VAL  89           HB       VAL  89   6.405 -10.574  -1.443
  695   HG11  VAL  89          1HG1      VAL  89   6.145 -10.178  -3.872
  696   HG12  VAL  89          2HG1      VAL  89   4.462  -9.732  -3.586
  697   HG13  VAL  89          3HG1      VAL  89   5.009 -11.374  -3.247
  698   HG21  VAL  89          1HG2      VAL  89   5.383  -7.811  -2.085
  699   HG22  VAL  89          2HG2      VAL  89   6.992  -8.413  -2.486
  700   HG23  VAL  89          3HG2      VAL  89   6.507  -8.252  -0.798
  701    H    ASP  90           H        ASP  90   2.012 -10.733  -1.258
  702    HA   ASP  90           HA       ASP  90   2.533 -13.599  -0.912
  703    HB2  ASP  90          1HB       ASP  90  -0.082 -12.080  -0.822
  704    HB3  ASP  90          2HB       ASP  90   0.074 -13.824  -0.615
  705    H    LYS  91           H        LYS  91   1.042 -15.013  -2.245
  706    HA   LYS  91           HA       LYS  91   1.204 -14.200  -5.048
  707    HB2  LYS  91          1HB       LYS  91   0.291 -16.866  -3.961
  708    HB3  LYS  91          2HB       LYS  91   0.856 -16.488  -5.585
  709    HG2  LYS  91          1HG       LYS  91   3.086 -16.070  -4.737
  710    HG3  LYS  91          2HG       LYS  91   2.534 -16.439  -3.104
  711    HD2  LYS  91          1HD       LYS  91   2.444 -18.364  -5.424
  712    HD3  LYS  91          2HD       LYS  91   3.717 -18.323  -4.206
  713    HE2  LYS  91          1HE       LYS  91   1.992 -18.727  -2.467
  714    HE3  LYS  91          2HE       LYS  91   0.794 -18.899  -3.749
  715    HZ1  LYS  91          1HZ       LYS  91   1.606 -21.046  -3.032
  716    HZ2  LYS  91          2HZ       LYS  91   3.199 -20.601  -3.380
  717    HZ3  LYS  91          3HZ       LYS  91   2.074 -20.759  -4.630
  718    H    ASN  92           H        ASN  92  -0.596 -14.414  -6.458
  719    HA   ASN  92           HA       ASN  92  -2.987 -13.327  -5.262
  720    HB2  ASN  92          1HB       ASN  92  -2.033 -12.486  -7.411
  721    HB3  ASN  92          2HB       ASN  92  -2.447 -14.025  -8.148
  722   HD21  ASN  92          1HD2      ASN  92  -3.691 -12.799  -9.636
  723   HD22  ASN  92          2HD2      ASN  92  -5.284 -12.259  -9.219
  724    H    THR  93           H        THR  93  -3.089 -15.503  -4.061
  725    HA   THR  93           HA       THR  93  -4.402 -17.629  -5.502
  726    HB   THR  93           HB       THR  93  -4.734 -18.602  -3.224
  727    HG1  THR  93           HG1      THR  93  -4.836 -16.769  -1.932
  728   HG21  THR  93          1HG2      THR  93  -2.355 -18.996  -2.770
  729   HG22  THR  93          2HG2      THR  93  -1.939 -17.677  -3.865
  730   HG23  THR  93          3HG2      THR  93  -2.730 -19.126  -4.488
  731    H    ASP  94           H        ASP  94  -5.312 -14.688  -4.096
  732    HA   ASP  94           HA       ASP  94  -7.992 -15.399  -3.361
  733    HB2  ASP  94          1HB       ASP  94  -6.758 -12.674  -3.837
  734    HB3  ASP  94          2HB       ASP  94  -8.333 -12.973  -3.091
  735    H    ASN  95           H        ASN  95  -6.376 -14.453  -6.214
  736    HA   ASN  95           HA       ASN  95  -6.970 -14.010  -8.332
  737    HB2  ASN  95          1HB       ASN  95  -8.190 -16.209  -7.906
  738    HB3  ASN  95          2HB       ASN  95  -9.647 -15.248  -7.743
  739   HD21  ASN  95          1HD2      ASN  95 -10.652 -14.504  -9.545
  740   HD22  ASN  95          2HD2      ASN  95 -10.105 -14.839 -11.158
  741    H    ASN  96           H        ASN  96  -7.406 -12.042  -6.337
  742    HA   ASN  96           HA       ASN  96  -9.315 -10.347  -7.712
  743    HB2  ASN  96          1HB       ASN  96 -10.758 -11.336  -6.067
  744    HB3  ASN  96          2HB       ASN  96  -9.567 -11.103  -4.790
  745   HD21  ASN  96          1HD2      ASN  96 -12.041  -9.648  -6.717
  746   HD22  ASN  96          2HD2      ASN  96 -12.136  -8.162  -5.838
  747    H    ALA  97           H        ALA  97  -8.293  -8.489  -8.039
  748    HA   ALA  97           HA       ALA  97  -5.730  -7.984  -6.996
  749    HB1  ALA  97          1HB       ALA  97  -6.508  -7.223  -9.208
  750    HB2  ALA  97          2HB       ALA  97  -5.799  -5.924  -8.250
  751    HB3  ALA  97          3HB       ALA  97  -7.551  -6.046  -8.411
  752    H    CYS  98           H        CYS  98  -8.913  -6.799  -6.059
  753    HA   CYS  98           HA       CYS  98  -8.031  -4.639  -4.468
  754    HB2  CYS  98          1HB       CYS  98 -10.537  -6.300  -4.113
  755    HB3  CYS  98          2HB       CYS  98 -10.237  -4.713  -3.412
  756    H    HIS  99           H        HIS  99  -8.683  -8.033  -3.643
  757    HA   HIS  99           HA       HIS  99  -8.105  -7.609  -0.858
  758    HB2  HIS  99          1HB       HIS  99  -9.623  -9.406  -1.982
  759    HB3  HIS  99          2HB       HIS  99  -8.123 -10.297  -2.202
  760    HD1  HIS  99           HD1      HIS  99 -10.815  -9.885   0.123
  761    HD2  HIS  99           HD2      HIS  99  -6.747 -10.690   0.432
  762    HE1  HIS  99           HE1      HIS  99 -10.498 -10.901   2.395
  763    HE2  HIS  99           HE2      HIS  99  -8.009 -11.206   2.627
  764    H    TRP 100           H        TRP 100  -6.340  -8.530  -3.686
  765    HA   TRP 100           HA       TRP 100  -4.121  -9.770  -2.451
  766    HB2  TRP 100          1HB       TRP 100  -4.711  -9.990  -4.859
  767    HB3  TRP 100          2HB       TRP 100  -4.223  -8.316  -5.112
  768    HD1  TRP 100           HD1      TRP 100  -1.845 -10.003  -2.806
  769    HE1  TRP 100           HE1      TRP 100   0.283 -10.699  -4.073
  770    HE3  TRP 100           HE3      TRP 100  -3.488  -9.316  -7.598
  771    HZ2  TRP 100           HZ2      TRP 100   1.147 -10.942  -6.750
  772    HZ3  TRP 100           HZ3      TRP 100  -1.956  -9.807  -9.453
  773    HH2  TRP 100           HH2      TRP 100   0.312 -10.606  -9.045
  774    H    ALA 101           H        ALA 101  -4.502  -6.490  -3.797
  775    HA   ALA 101           HA       ALA 101  -1.979  -5.555  -2.938
  776    HB1  ALA 101          1HB       ALA 101  -4.470  -4.030  -3.673
  777    HB2  ALA 101          2HB       ALA 101  -3.169  -4.509  -4.763
  778    HB3  ALA 101          3HB       ALA 101  -2.862  -3.325  -3.491
  779    H    PHE 102           H        PHE 102  -5.178  -5.507  -1.488
  780    HA   PHE 102           HA       PHE 102  -4.606  -3.650   0.533
  781    HB2  PHE 102          1HB       PHE 102  -6.888  -4.176  -0.068
  782    HB3  PHE 102          2HB       PHE 102  -6.690  -5.835   0.489
  783    HD1  PHE 102           HD1      PHE 102  -6.461  -2.318   1.682
  784    HD2  PHE 102           HD2      PHE 102  -7.314  -6.371   2.670
  785    HE1  PHE 102           HE1      PHE 102  -7.181  -1.618   3.928
  786    HE2  PHE 102           HE2      PHE 102  -8.040  -5.675   4.912
  787    HZ   PHE 102           HZ       PHE 102  -7.973  -3.294   5.545
  788    H    ARG 103           H        ARG 103  -4.148  -7.139   0.339
  789    HA   ARG 103           HA       ARG 103  -3.657  -7.428   3.148
  790    HB2  ARG 103          1HB       ARG 103  -4.482  -9.291   1.691
  791    HB3  ARG 103          2HB       ARG 103  -2.883  -9.347   0.961
  792    HG2  ARG 103          1HG       ARG 103  -1.872  -9.904   3.063
  793    HG3  ARG 103          2HG       ARG 103  -3.412  -9.710   3.891
  794    HD2  ARG 103          1HD       ARG 103  -2.838 -12.068   3.491
  795    HD3  ARG 103          2HD       ARG 103  -4.330 -11.587   2.693
  796    HE   ARG 103           HE       ARG 103  -1.746 -11.810   1.279
  797   HH11  ARG 103          1HH1      ARG 103  -5.199 -12.386   1.513
  798   HH12  ARG 103          2HH1      ARG 103  -5.333 -13.027  -0.102
  799   HH21  ARG 103          1HH2      ARG 103  -1.944 -12.672  -0.860
  800   HH22  ARG 103          2HH2      ARG 103  -3.502 -13.187  -1.433
  801    H    GLY 104           H        GLY 104  -1.701  -6.889   0.283
  802    HA2  GLY 104          1HA       GLY 104   0.843  -7.256   1.469
  803    HA3  GLY 104          2HA       GLY 104   0.497  -6.216   0.081
  804    H    PHE 105           H        PHE 105  -1.238  -4.417   1.181
  805    HA   PHE 105           HA       PHE 105   0.511  -2.618   2.470
  806    HB2  PHE 105          1HB       PHE 105  -1.144  -1.714   1.043
  807    HB3  PHE 105          2HB       PHE 105  -2.434  -2.569   1.875
  808    HD1  PHE 105           HD1      PHE 105   0.340  -0.388   3.071
  809    HD2  PHE 105           HD2      PHE 105  -3.865  -1.011   2.813
  810    HE1  PHE 105           HE1      PHE 105  -0.049   1.626   4.430
  811    HE2  PHE 105           HE2      PHE 105  -4.250   0.992   4.179
  812    HZ   PHE 105           HZ       PHE 105  -2.339   2.315   4.989
  813    H    LYS 106           H        LYS 106  -2.319  -4.421   3.581
  814    HA   LYS 106           HA       LYS 106  -2.451  -3.542   6.237
  815    HB2  LYS 106          1HB       LYS 106  -3.965  -5.229   4.779
  816    HB3  LYS 106          2HB       LYS 106  -2.992  -6.406   5.649
  817    HG2  LYS 106          1HG       LYS 106  -5.103  -6.010   6.759
  818    HG3  LYS 106          2HG       LYS 106  -3.727  -5.564   7.765
  819    HD2  LYS 106          1HD       LYS 106  -4.102  -3.202   7.244
  820    HD3  LYS 106          2HD       LYS 106  -5.449  -3.640   6.188
  821    HE2  LYS 106          1HE       LYS 106  -6.681  -4.531   8.071
  822    HE3  LYS 106          2HE       LYS 106  -5.315  -4.239   9.146
  823    HZ1  LYS 106          1HZ       LYS 106  -6.900  -2.153   7.739
  824    HZ2  LYS 106          2HZ       LYS 106  -5.582  -1.863   8.761
  825    HZ3  LYS 106          3HZ       LYS 106  -6.997  -2.540   9.381
  826    H    CYS 107           H        CYS 107  -0.787  -6.344   4.877
  827    HA   CYS 107           HA       CYS 107   0.277  -7.381   7.203
  828    HB2  CYS 107          1HB       CYS 107   0.343  -8.707   5.260
  829    HB3  CYS 107          2HB       CYS 107   1.188  -7.476   4.332
  830    H    PHE 108           H        PHE 108   1.640  -4.933   5.025
  831    HA   PHE 108           HA       PHE 108   4.138  -4.855   6.401
  832    HB2  PHE 108          1HB       PHE 108   3.736  -4.308   3.956
  833    HB3  PHE 108          2HB       PHE 108   3.093  -2.760   4.509
  834    HD1  PHE 108           HD1      PHE 108   6.099  -4.876   4.308
  835    HD2  PHE 108           HD2      PHE 108   4.559  -1.019   5.249
  836    HE1  PHE 108           HE1      PHE 108   8.386  -3.981   4.371
  837    HE2  PHE 108           HE2      PHE 108   6.846  -0.119   5.306
  838    HZ   PHE 108           HZ       PHE 108   8.761  -1.597   4.863
  839    H    GLN 109           H        GLN 109   1.294  -2.706   6.305
  840    HA   GLN 109           HA       GLN 109   2.406  -0.742   8.014
  841    HB2  GLN 109          1HB       GLN 109   0.209   0.212   8.117
  842    HB3  GLN 109          2HB       GLN 109   0.514  -0.321   6.473
  843    HG2  GLN 109          1HG       GLN 109  -1.474  -1.292   6.573
  844    HG3  GLN 109          2HG       GLN 109  -0.730  -2.491   7.637
  845   HE21  GLN 109          1HE2      GLN 109  -2.598  -2.858   8.795
  846   HE22  GLN 109          2HE2      GLN 109  -3.283  -1.697   9.882
  847    H    LYS 110           H        LYS 110   1.127  -3.827   8.629
  848    HA   LYS 110           HA       LYS 110   0.088  -3.469  11.230
  849    HB2  LYS 110          1HB       LYS 110  -0.353  -5.421   9.799
  850    HB3  LYS 110          2HB       LYS 110   1.325  -5.910   9.946
  851    HG2  LYS 110          1HG       LYS 110   0.139  -7.254  11.438
  852    HG3  LYS 110          2HG       LYS 110   0.921  -6.029  12.432
  853    HD2  LYS 110          1HD       LYS 110  -1.128  -4.802  12.640
  854    HD3  LYS 110          2HD       LYS 110  -1.931  -5.857  11.475
  855    HE2  LYS 110          1HE       LYS 110  -0.855  -6.711  14.159
  856    HE3  LYS 110          2HE       LYS 110  -2.547  -6.387  13.797
  857    HZ1  LYS 110          1HZ       LYS 110  -0.877  -8.517  12.576
  858    HZ2  LYS 110          2HZ       LYS 110  -2.487  -8.194  12.176
  859    HZ3  LYS 110          3HZ       LYS 110  -2.096  -8.739  13.727
  860    H    ASN 111           H        ASN 111   3.324  -3.823   9.982
  861    HA   ASN 111           HA       ASN 111   4.345  -3.884  12.750
  862    HB2  ASN 111          1HB       ASN 111   5.595  -5.152  10.306
  863    HB3  ASN 111          2HB       ASN 111   6.293  -5.124  11.923
  864   HD21  ASN 111          1HD2      ASN 111   3.826  -6.490   9.890
  865   HD22  ASN 111          2HD2      ASN 111   3.379  -7.772  10.956
  866    H    ASN 112           H        ASN 112   4.427  -2.382   9.652
  867    HA   ASN 112           HA       ASN 112   6.599  -0.622  10.553
  868    HB2  ASN 112          1HB       ASN 112   6.395  -2.059   7.909
  869    HB3  ASN 112          2HB       ASN 112   7.446  -0.662   8.171
  870   HD21  ASN 112          1HD2      ASN 112   7.773  -3.686   7.694
  871   HD22  ASN 112          2HD2      ASN 112   9.007  -4.110   8.828
  872    H    LEU 113           H        LEU 113   4.302   0.450  10.941
  873    HA   LEU 113           HA       LEU 113   3.248   1.672   8.532
  874    HB2  LEU 113          1HB       LEU 113   1.624   1.007  10.139
  875    HB3  LEU 113          2HB       LEU 113   2.434   1.881  11.419
  876    HG   LEU 113           HG       LEU 113   1.855   4.008  10.237
  877   HD11  LEU 113          1HD1      LEU 113   1.624   2.991   7.993
  878   HD12  LEU 113          2HD1      LEU 113   0.241   3.982   8.460
  879   HD13  LEU 113          3HD1      LEU 113   0.132   2.225   8.532
  880   HD21  LEU 113          1HD2      LEU 113  -0.517   3.953  10.866
  881   HD22  LEU 113          2HD2      LEU 113   0.502   3.184  12.085
  882   HD23  LEU 113          3HD2      LEU 113  -0.438   2.194  10.970
  883    H    SER 114           H        SER 114   5.273   2.516  11.241
  884    HA   SER 114           HA       SER 114   5.246   5.325  10.915
  885    HB2  SER 114          1HB       SER 114   7.440   3.542  12.015
  886    HB3  SER 114          2HB       SER 114   7.366   5.294  12.197
  887    HG   SER 114           HG       SER 114   5.274   3.592  13.062
  888    H    LEU 115           H        LEU 115   7.077   2.770   9.343
  889    HA   LEU 115           HA       LEU 115   8.910   4.449   7.981
  890    HB2  LEU 115          1HB       LEU 115   9.231   2.020   8.276
  891    HB3  LEU 115          2HB       LEU 115   7.879   1.727   7.205
  892    HG   LEU 115           HG       LEU 115   9.134   2.837   5.373
  893   HD11  LEU 115          1HD1      LEU 115  10.577   4.267   6.644
  894   HD12  LEU 115          2HD1      LEU 115  11.570   3.149   5.707
  895   HD13  LEU 115          3HD1      LEU 115  11.322   2.879   7.433
  896   HD21  LEU 115          1HD2      LEU 115   9.148   0.397   5.639
  897   HD22  LEU 115          2HD2      LEU 115  10.577   0.526   6.665
  898   HD23  LEU 115          3HD2      LEU 115  10.663   0.997   4.968
  899    H    ILE 116           H        ILE 116   5.694   3.255   7.295
  900    HA   ILE 116           HA       ILE 116   5.544   4.030   4.593
  901    HB   ILE 116           HB       ILE 116   3.334   3.692   6.634
  902   HG12  ILE 116          1HG1      ILE 116   4.449   1.802   4.543
  903   HG13  ILE 116          2HG1      ILE 116   4.661   1.662   6.295
  904   HG21  ILE 116          1HG2      ILE 116   1.855   3.424   4.684
  905   HG22  ILE 116          2HG2      ILE 116   3.197   3.872   3.632
  906   HG23  ILE 116          3HG2      ILE 116   2.553   5.043   4.784
  907   HD11  ILE 116          1HD1      ILE 116   2.177   1.276   4.670
  908   HD12  ILE 116          2HD1      ILE 116   2.129   1.516   6.414
  909   HD13  ILE 116          3HD1      ILE 116   2.984   0.131   5.738
  910    H    LYS 117           H        LYS 117   4.602   5.643   7.600
  911    HA   LYS 117           HA       LYS 117   3.594   7.995   6.421
  912    HB2  LYS 117          1HB       LYS 117   4.699   7.423   9.165
  913    HB3  LYS 117          2HB       LYS 117   4.035   8.989   8.715
  914    HG2  LYS 117          1HG       LYS 117   1.883   7.948   8.235
  915    HG3  LYS 117          2HG       LYS 117   2.535   6.367   8.655
  916    HD2  LYS 117          1HD       LYS 117   2.913   7.099  10.941
  917    HD3  LYS 117          2HD       LYS 117   2.364   8.726  10.538
  918    HE2  LYS 117          1HE       LYS 117   0.140   7.834  10.009
  919    HE3  LYS 117          2HE       LYS 117   0.697   6.214  10.423
  920    HZ1  LYS 117          1HZ       LYS 117  -0.524   7.238  12.242
  921    HZ2  LYS 117          2HZ       LYS 117   0.571   8.524  12.285
  922    HZ3  LYS 117          3HZ       LYS 117   1.088   6.963  12.685
  923    H    ALA 118           H        ALA 118   6.801   6.966   7.344
  924    HA   ALA 118           HA       ALA 118   8.010   9.552   7.078
  925    HB1  ALA 118          1HB       ALA 118   9.258   6.823   7.233
  926    HB2  ALA 118          2HB       ALA 118   8.890   7.874   8.599
  927    HB3  ALA 118          3HB       ALA 118  10.102   8.360   7.415
  928    H    SER 119           H        SER 119   7.574   6.767   4.990
  929    HA   SER 119           HA       SER 119   9.540   7.403   3.097
  930    HB2  SER 119          1HB       SER 119   8.382   5.832   1.614
  931    HB3  SER 119          2HB       SER 119   8.520   5.188   3.249
  932    HG   SER 119           HG       SER 119   6.304   6.061   3.529
  933    H    ILE 120           H        ILE 120   6.226   8.492   3.429
  934    HA   ILE 120           HA       ILE 120   6.341   9.928   0.897
  935    HB   ILE 120           HB       ILE 120   4.043  10.682   1.482
  936   HG12  ILE 120          1HG1      ILE 120   4.267   8.766   3.805
  937   HG13  ILE 120          2HG1      ILE 120   4.423  10.515   3.970
  938   HG21  ILE 120          1HG2      ILE 120   4.512   7.711   1.586
  939   HG22  ILE 120          2HG2      ILE 120   4.376   8.697   0.131
  940   HG23  ILE 120          3HG2      ILE 120   2.981   8.492   1.190
  941   HD11  ILE 120          1HD1      ILE 120   2.199   9.810   4.557
  942   HD12  ILE 120          2HD1      ILE 120   2.005   9.022   2.992
  943   HD13  ILE 120          3HD1      ILE 120   2.154  10.775   3.084
  944    H    LYS 121           H        LYS 121   7.546  10.428   3.865
  945    HA   LYS 121           HA       LYS 121   6.878  13.243   4.096
  946    HB2  LYS 121          1HB       LYS 121   6.944  11.838   6.108
  947    HB3  LYS 121          2HB       LYS 121   8.636  11.479   5.802
  948    HG2  LYS 121          1HG       LYS 121   9.224  13.806   6.147
  949    HG3  LYS 121          2HG       LYS 121   7.522  14.220   6.360
  950    HD2  LYS 121          1HD       LYS 121   8.648  14.026   8.516
  951    HD3  LYS 121          2HD       LYS 121   7.415  12.778   8.334
  952    HE2  LYS 121          1HE       LYS 121   9.181  11.180   7.675
  953    HE3  LYS 121          2HE       LYS 121  10.387  12.435   7.952
  954    HZ1  LYS 121          1HZ       LYS 121   9.710  12.519  10.268
  955    HZ2  LYS 121          2HZ       LYS 121  10.190  10.956   9.850
  956    HZ3  LYS 121          3HZ       LYS 121   8.549  11.323  10.001
  957    H    LYS 122           H        LYS 122   8.032  14.746   3.143
  958    HA   LYS 122           HA       LYS 122  10.900  14.314   2.797
  959    HB2  LYS 122          1HB       LYS 122  10.337  13.961   0.622
  960    HB3  LYS 122          2HB       LYS 122   8.891  14.927   0.705
  961    HG2  LYS 122          1HG       LYS 122  10.317  16.968   0.668
  962    HG3  LYS 122          2HG       LYS 122  11.730  15.926   0.483
  963    HD2  LYS 122          1HD       LYS 122  10.805  15.045  -1.607
  964    HD3  LYS 122          2HD       LYS 122   9.393  16.086  -1.420
  965    HE2  LYS 122          1HE       LYS 122  10.879  18.056  -1.487
  966    HE3  LYS 122          2HE       LYS 122  12.250  16.983  -1.767
  967    HZ1  LYS 122          1HZ       LYS 122   9.899  17.315  -3.551
  968    HZ2  LYS 122          2HZ       LYS 122  11.175  16.239  -3.814
  969    HZ3  LYS 122          3HZ       LYS 122  11.460  17.905  -3.833
  970    H    ASP 123           H        ASP 123  12.072  15.941   3.551
  971    HA   ASP 123           HA       ASP 123  10.688  18.385   4.368
  972    HB2  ASP 123          1HB       ASP 123  12.022  17.118   6.046
  973    HB3  ASP 123          2HB       ASP 123  13.466  17.443   5.094
  974    H21  ACD 201           H21      ACD   1  -4.062   4.481   2.017
  975    H22  ACD 201           H22      ACD   1  -2.764   4.985   3.106
  976    H31  ACD 201           H31      ACD   1  -1.852   6.479   1.398
  977    H32  ACD 201           H32      ACD   1  -3.201   6.142   0.316
  978    H41  ACD 201           H41      ACD   1  -2.512   3.808   0.078
  979    H42  ACD 201           H42      ACD   1  -1.107   4.842  -0.239
  980    H5   ACD 201           H5       ACD   1  -1.501   3.010   2.172
  981    H6   ACD 201           H6       ACD   1   0.722   3.709   2.687
  982    H71  ACD 201           H71      ACD   1   0.977   5.113   0.162
  983    H72  ACD 201           H72      ACD   1   0.050   6.208   1.186
  984    H8   ACD 201           H8       ACD   1   1.989   6.584   2.643
  985    H9   ACD 201           H9       ACD   1   4.076   5.588   2.066
  986   H101  ACD 201          H101      ACD   1   2.989   4.701  -0.481
  987   H102  ACD 201          H102      ACD   1   2.503   3.461   0.675
  988    H11  ACD 201           H11      ACD   1   5.478   4.275   0.560
  989    H12  ACD 201           H12      ACD   1   5.754   1.942   0.214
  990   H131  ACD 201          H131      ACD   1   2.798   2.063  -0.536
  991   H132  ACD 201          H132      ACD   1   3.857   0.655  -0.643
  992    H14  ACD 201           H14      ACD   1   2.729   1.704   2.053
  993    H15  ACD 201           H15      ACD   1   2.509  -0.634   2.453
  994   H161  ACD 201          H161      ACD   1   2.694  -1.307  -0.346
  995   H162  ACD 201          H162      ACD   1   4.367  -0.963   0.106
  996   H171  ACD 201          H171      ACD   1   4.363  -2.668   1.808
  997   H172  ACD 201          H172      ACD   1   2.615  -2.878   1.687
  998   H181  ACD 201          H181      ACD   1   4.599  -3.489  -0.545
  999   H182  ACD 201          H182      ACD   1   2.854  -3.752  -0.614
 1000   H191  ACD 201          H191      ACD   1   4.812  -5.093   1.301
 1001   H192  ACD 201          H192      ACD   1   3.060  -5.299   1.373
 1002   H201  ACD 201          H201      ACD   1   4.825  -6.021  -0.977
 1003   H202  ACD 201          H202      ACD   1   3.102  -6.201  -0.935
 1004   H203  ACD 201          H203      ACD   1   4.096  -7.135   0.131
  Start of MODEL   16
    1    H1   MET   1          1H        MET   1  18.991   4.770  -9.279
    2    H2   MET   1          2H        MET   1  17.500   5.544  -9.113
    3    H3   MET   1          3H        MET   1  18.857   6.145  -8.307
    4    HA   MET   1           HA       MET   1  19.915   6.671 -10.394
    5    HB2  MET   1          1HB       MET   1  18.927   4.965 -11.788
    6    HB3  MET   1          2HB       MET   1  17.322   5.638 -11.549
    7    HG2  MET   1          1HG       MET   1  18.248   6.168 -13.752
    8    HG3  MET   1          2HG       MET   1  17.910   7.609 -12.797
    9    HE1  MET   1          1HE       MET   1  19.759   7.574 -15.430
   10    HE2  MET   1          2HE       MET   1  21.041   8.662 -14.895
   11    HE3  MET   1          3HE       MET   1  19.360   9.014 -14.496
   12    H    GLU   2           H        GLU   2  16.463   7.120  -9.652
   13    HA   GLU   2           HA       GLU   2  16.896  10.022  -9.915
   14    HB2  GLU   2          1HB       GLU   2  14.344   8.498 -10.411
   15    HB3  GLU   2          2HB       GLU   2  14.550  10.236 -10.543
   16    HG2  GLU   2          1HG       GLU   2  16.150   9.871 -12.377
   17    HG3  GLU   2          2HG       GLU   2  15.835   8.139 -12.264
   18    H    PHE   3           H        PHE   3  16.532  11.190  -8.150
   19    HA   PHE   3           HA       PHE   3  15.234   9.959  -5.867
   20    HB2  PHE   3          1HB       PHE   3  17.169  11.337  -5.404
   21    HB3  PHE   3          2HB       PHE   3  16.440  12.708  -6.244
   22    HD1  PHE   3           HD1      PHE   3  15.049  10.352  -3.696
   23    HD2  PHE   3           HD2      PHE   3  16.069  14.362  -4.702
   24    HE1  PHE   3           HE1      PHE   3  14.054  11.131  -1.588
   25    HE2  PHE   3           HE2      PHE   3  15.070  15.147  -2.595
   26    HZ   PHE   3           HZ       PHE   3  14.062  13.531  -1.035
   27    H    THR   4           H        THR   4  13.146   9.707  -6.331
   28    HA   THR   4           HA       THR   4  11.513  12.108  -6.279
   29    HB   THR   4           HB       THR   4  10.418  10.188  -8.190
   30    HG1  THR   4           HG1      THR   4  12.878  11.524  -8.778
   31   HG21  THR   4          1HG2      THR   4  10.006  12.243  -9.464
   32   HG22  THR   4          2HG2      THR   4  10.977  13.146  -8.299
   33   HG23  THR   4          3HG2      THR   4   9.472  12.381  -7.789
   34    H    VAL   5           H        VAL   5  10.410  11.719  -4.498
   35    HA   VAL   5           HA       VAL   5   9.282   9.017  -4.097
   36    HB   VAL   5           HB       VAL   5   9.560   9.188  -1.838
   37   HG11  VAL   5          1HG1      VAL   5  11.660  11.083  -2.831
   38   HG12  VAL   5          2HG1      VAL   5  11.767   9.327  -2.725
   39   HG13  VAL   5          3HG1      VAL   5  11.667  10.293  -1.254
   40   HG21  VAL   5          1HG2      VAL   5   8.117  11.138  -1.529
   41   HG22  VAL   5          2HG2      VAL   5   9.441  12.201  -2.005
   42   HG23  VAL   5          3HG2      VAL   5   9.561  11.251  -0.524
   43    H    SER   6           H        SER   6   7.136   8.819  -3.496
   44    HA   SER   6           HA       SER   6   5.402  10.889  -4.469
   45    HB2  SER   6          1HB       SER   6   3.586   9.320  -3.735
   46    HB3  SER   6          2HB       SER   6   4.757   8.589  -4.834
   47    HG   SER   6           HG       SER   6   5.040   8.393  -2.029
   48    H    THR   7           H        THR   7   5.300  12.690  -3.248
   49    HA   THR   7           HA       THR   7   5.632  12.618  -0.406
   50    HB   THR   7           HB       THR   7   5.235  15.044  -0.494
   51    HG1  THR   7           HG1      THR   7   4.710  14.552  -3.266
   52   HG21  THR   7          1HG2      THR   7   7.044  14.114  -2.725
   53   HG22  THR   7          2HG2      THR   7   7.472  14.138  -1.016
   54   HG23  THR   7          3HG2      THR   7   7.145  15.650  -1.864
   55    H    THR   8           H        THR   8   4.027  13.927   0.972
   56    HA   THR   8           HA       THR   8   1.597  12.644   1.207
   57    HB   THR   8           HB       THR   8   2.201  15.490   2.035
   58    HG1  THR   8           HG1      THR   8   3.612  13.549   2.738
   59   HG21  THR   8          1HG2      THR   8  -0.139  15.029   2.242
   60   HG22  THR   8          2HG2      THR   8   0.572  14.967   3.856
   61   HG23  THR   8          3HG2      THR   8   0.183  13.472   3.002
   62    H    GLU   9           H        GLU   9   2.277  15.755  -0.371
   63    HA   GLU   9           HA       GLU   9  -0.271  16.398  -1.235
   64    HB2  GLU   9          1HB       GLU   9   1.601  17.945  -1.383
   65    HB3  GLU   9          2HB       GLU   9   2.360  16.946  -2.612
   66    HG2  GLU   9          1HG       GLU   9   0.394  17.355  -4.066
   67    HG3  GLU   9          2HG       GLU   9  -0.211  18.476  -2.847
   68    H    ASP  10           H        ASP  10   2.225  14.541  -2.993
   69    HA   ASP  10           HA       ASP  10   0.719  14.107  -5.325
   70    HB2  ASP  10          1HB       ASP  10   2.819  12.244  -4.180
   71    HB3  ASP  10          2HB       ASP  10   2.246  12.297  -5.845
   72    H    LEU  11           H        LEU  11   1.002  12.298  -2.331
   73    HA   LEU  11           HA       LEU  11  -0.518  10.075  -3.101
   74    HB2  LEU  11          1HB       LEU  11   0.905   9.955  -1.183
   75    HB3  LEU  11          2HB       LEU  11   0.026  11.258  -0.374
   76    HG   LEU  11           HG       LEU  11  -1.966   9.761  -0.306
   77   HD11  LEU  11          1HD1      LEU  11  -1.710   7.416  -0.757
   78   HD12  LEU  11          2HD1      LEU  11  -0.020   7.649  -1.198
   79   HD13  LEU  11          3HD1      LEU  11  -1.299   8.336  -2.199
   80   HD21  LEU  11          1HD2      LEU  11  -0.353  10.017   1.578
   81   HD22  LEU  11          2HD2      LEU  11   0.471   8.569   0.999
   82   HD23  LEU  11          3HD2      LEU  11  -1.198   8.470   1.556
   83    H    GLN  12           H        GLN  12  -1.428  13.187  -1.698
   84    HA   GLN  12           HA       GLN  12  -4.113  12.472  -1.128
   85    HB2  GLN  12          1HB       GLN  12  -2.812  15.154  -1.535
   86    HB3  GLN  12          2HB       GLN  12  -4.498  14.956  -1.074
   87    HG2  GLN  12          1HG       GLN  12  -2.099  14.043   0.493
   88    HG3  GLN  12          2HG       GLN  12  -3.129  15.422   0.868
   89   HE21  GLN  12          1HE2      GLN  12  -2.822  11.973   0.900
   90   HE22  GLN  12          2HE2      GLN  12  -4.206  11.652   1.883
   91    H    ARG  13           H        ARG  13  -2.474  13.730  -3.930
   92    HA   ARG  13           HA       ARG  13  -4.708  14.432  -5.474
   93    HB2  ARG  13          1HB       ARG  13  -2.445  15.085  -6.087
   94    HB3  ARG  13          2HB       ARG  13  -2.000  13.403  -6.332
   95    HG2  ARG  13          1HG       ARG  13  -3.539  13.241  -8.202
   96    HG3  ARG  13          2HG       ARG  13  -4.049  14.919  -7.936
   97    HD2  ARG  13          1HD       ARG  13  -1.786  15.684  -8.391
   98    HD3  ARG  13          2HD       ARG  13  -1.255  14.018  -8.612
   99    HE   ARG  13           HE       ARG  13  -3.378  14.549 -10.378
  100   HH11  ARG  13          1HH1      ARG  13  -0.030  15.422  -9.856
  101   HH12  ARG  13          2HH1      ARG  13   0.293  15.699 -11.537
  102   HH21  ARG  13          1HH2      ARG  13  -2.949  14.893 -12.598
  103   HH22  ARG  13          2HH2      ARG  13  -1.368  15.406 -13.098
  104    H    TYR  14           H        TYR  14  -2.755  11.440  -5.618
  105    HA   TYR  14           HA       TYR  14  -4.430  10.091  -7.423
  106    HB2  TYR  14          1HB       TYR  14  -2.581   8.893  -5.348
  107    HB3  TYR  14          2HB       TYR  14  -3.257   8.054  -6.739
  108    HD1  TYR  14           HD1      TYR  14  -0.327   9.410  -5.620
  109    HD2  TYR  14           HD2      TYR  14  -2.903   9.578  -9.003
  110    HE1  TYR  14           HE1      TYR  14   1.561  10.141  -7.018
  111    HE2  TYR  14           HE2      TYR  14  -1.025  10.300 -10.405
  112    HH   TYR  14           HH       TYR  14   2.187  10.094  -9.456
  113    H    ARG  15           H        ARG  15  -4.460  10.251  -3.923
  114    HA   ARG  15           HA       ARG  15  -6.213   8.107  -3.493
  115    HB2  ARG  15          1HB       ARG  15  -5.414   8.516  -1.462
  116    HB3  ARG  15          2HB       ARG  15  -4.881  10.120  -1.937
  117    HG2  ARG  15          1HG       ARG  15  -6.950  11.089  -1.269
  118    HG3  ARG  15          2HG       ARG  15  -7.703   9.499  -1.081
  119    HD2  ARG  15          1HD       ARG  15  -6.238   8.971   0.766
  120    HD3  ARG  15          2HD       ARG  15  -5.342  10.468   0.535
  121    HE   ARG  15           HE       ARG  15  -7.826  11.369   0.990
  122   HH11  ARG  15          1HH1      ARG  15  -5.881   8.964   2.652
  123   HH12  ARG  15          2HH1      ARG  15  -6.534   9.348   4.214
  124   HH21  ARG  15          1HH2      ARG  15  -8.678  11.874   3.051
  125   HH22  ARG  15          2HH2      ARG  15  -8.149  10.984   4.435
  126    H    THR  16           H        THR  16  -6.808  11.568  -3.962
  127    HA   THR  16           HA       THR  16  -9.616  11.424  -3.553
  128    HB   THR  16           HB       THR  16  -8.224  13.451  -5.298
  129    HG1  THR  16           HG1      THR  16  -7.094  13.720  -3.456
  130   HG21  THR  16          1HG2      THR  16 -10.657  13.636  -3.524
  131   HG22  THR  16          2HG2      THR  16 -10.688  13.445  -5.276
  132   HG23  THR  16          3HG2      THR  16 -10.016  14.912  -4.558
  133    H    GLU  17           H        GLU  17  -7.597  11.287  -6.491
  134    HA   GLU  17           HA       GLU  17  -9.632  11.127  -8.405
  135    HB2  GLU  17          1HB       GLU  17  -7.145   9.433  -8.604
  136    HB3  GLU  17          2HB       GLU  17  -8.071  10.166  -9.895
  137    HG2  GLU  17          1HG       GLU  17  -6.376  11.667  -7.922
  138    HG3  GLU  17          2HG       GLU  17  -5.948  11.294  -9.594
  139    H    CYS  18           H        CYS  18  -8.064   8.493  -6.618
  140    HA   CYS  18           HA       CYS  18  -9.625   6.437  -7.741
  141    HB2  CYS  18          1HB       CYS  18  -8.108   6.540  -5.134
  142    HB3  CYS  18          2HB       CYS  18  -8.834   5.078  -5.814
  143    H    VAL  19           H        VAL  19 -10.089   8.456  -4.875
  144    HA   VAL  19           HA       VAL  19 -12.253   7.068  -3.776
  145    HB   VAL  19           HB       VAL  19 -11.319   9.903  -3.560
  146   HG11  VAL  19          1HG1      VAL  19 -13.755  10.061  -3.575
  147   HG12  VAL  19          2HG1      VAL  19 -13.094  10.404  -1.975
  148   HG13  VAL  19          3HG1      VAL  19 -13.844   8.841  -2.302
  149   HG21  VAL  19          1HG2      VAL  19 -10.141   8.287  -2.261
  150   HG22  VAL  19          2HG2      VAL  19 -11.645   7.609  -1.643
  151   HG23  VAL  19          3HG2      VAL  19 -11.148   9.235  -1.168
  152    H    SER  20           H        SER  20 -12.238   9.891  -5.927
  153    HA   SER  20           HA       SER  20 -15.063   9.985  -6.149
  154    HB2  SER  20          1HB       SER  20 -13.509  11.911  -6.481
  155    HB3  SER  20          2HB       SER  20 -12.994  11.185  -8.001
  156    HG   SER  20           HG       SER  20 -15.423  11.215  -8.433
  157    H    SER  21           H        SER  21 -12.704   8.021  -7.730
  158    HA   SER  21           HA       SER  21 -14.398   7.511 -10.041
  159    HB2  SER  21          1HB       SER  21 -11.758   6.297  -9.202
  160    HB3  SER  21          2HB       SER  21 -12.577   5.987 -10.732
  161    HG   SER  21           HG       SER  21 -11.569   8.478  -9.793
  162    H    LEU  22           H        LEU  22 -13.160   5.722  -7.202
  163    HA   LEU  22           HA       LEU  22 -14.679   3.379  -7.955
  164    HB2  LEU  22          1HB       LEU  22 -12.905   3.993  -5.595
  165    HB3  LEU  22          2HB       LEU  22 -13.717   2.442  -5.828
  166    HG   LEU  22           HG       LEU  22 -11.776   3.615  -7.814
  167   HD11  LEU  22          1HD1      LEU  22 -10.626   3.213  -5.714
  168   HD12  LEU  22          2HD1      LEU  22 -10.165   1.994  -6.903
  169   HD13  LEU  22          3HD1      LEU  22 -11.317   1.594  -5.626
  170   HD21  LEU  22          1HD2      LEU  22 -11.747   1.392  -8.728
  171   HD22  LEU  22          2HD2      LEU  22 -13.412   1.970  -8.654
  172   HD23  LEU  22          3HD2      LEU  22 -12.821   0.817  -7.454
  173    H    ASN  23           H        ASN  23 -15.757   6.113  -6.850
  174    HA   ASN  23           HA       ASN  23 -17.536   6.853  -5.631
  175    HB2  ASN  23          1HB       ASN  23 -18.401   3.972  -5.886
  176    HB3  ASN  23          2HB       ASN  23 -19.431   5.302  -5.395
  177   HD21  ASN  23          1HD2      ASN  23 -18.323   7.199  -7.263
  178   HD22  ASN  23          2HD2      ASN  23 -18.905   6.732  -8.827
  179    H    ILE  24           H        ILE  24 -15.254   6.147  -4.130
  180    HA   ILE  24           HA       ILE  24 -15.932   4.620  -1.839
  181    HB   ILE  24           HB       ILE  24 -13.797   6.747  -2.015
  182   HG12  ILE  24          1HG1      ILE  24 -13.582   5.167  -3.910
  183   HG13  ILE  24          2HG1      ILE  24 -12.258   4.995  -2.761
  184   HG21  ILE  24          1HG2      ILE  24 -14.065   4.272  -0.307
  185   HG22  ILE  24          2HG2      ILE  24 -14.250   5.941   0.231
  186   HG23  ILE  24          3HG2      ILE  24 -12.677   5.363  -0.317
  187   HD11  ILE  24          1HD1      ILE  24 -14.663   3.197  -2.984
  188   HD12  ILE  24          2HD1      ILE  24 -13.344   3.013  -1.826
  189   HD13  ILE  24          3HD1      ILE  24 -13.034   2.838  -3.555
  190    HA   PRO  25           HA       PRO  25 -18.549   7.715   0.094
  191    HB2  PRO  25          1HB       PRO  25 -18.140   6.023   2.464
  192    HB3  PRO  25          2HB       PRO  25 -19.638   6.506   1.668
  193    HG2  PRO  25          1HG       PRO  25 -18.662   4.006   1.511
  194    HG3  PRO  25          2HG       PRO  25 -19.585   4.763   0.202
  195    HD2  PRO  25          1HD       PRO  25 -16.651   4.268   0.413
  196    HD3  PRO  25          2HD       PRO  25 -17.706   4.274  -1.021
  197    H    ALA  26           H        ALA  26 -18.162   9.453   1.265
  198    HA   ALA  26           HA       ALA  26 -15.574  10.316   1.803
  199    HB1  ALA  26          1HB       ALA  26 -18.130  11.328   3.033
  200    HB2  ALA  26          2HB       ALA  26 -17.511  11.786   1.447
  201    HB3  ALA  26          3HB       ALA  26 -16.607  12.209   2.903
  202    H    ASP  27           H        ASP  27 -17.892   8.705   3.872
  203    HA   ASP  27           HA       ASP  27 -16.778   9.064   6.377
  204    HB2  ASP  27          1HB       ASP  27 -18.261   6.758   5.154
  205    HB3  ASP  27          2HB       ASP  27 -17.618   6.633   6.787
  206    H    TYR  28           H        TYR  28 -15.997   6.472   4.047
  207    HA   TYR  28           HA       TYR  28 -13.931   5.323   5.516
  208    HB2  TYR  28          1HB       TYR  28 -14.655   5.365   2.617
  209    HB3  TYR  28          2HB       TYR  28 -13.102   4.685   3.095
  210    HD1  TYR  28           HD1      TYR  28 -13.014   2.659   4.484
  211    HD2  TYR  28           HD2      TYR  28 -16.723   4.210   3.096
  212    HE1  TYR  28           HE1      TYR  28 -14.100   0.516   4.992
  213    HE2  TYR  28           HE2      TYR  28 -17.815   2.070   3.604
  214    HH   TYR  28           HH       TYR  28 -17.179  -0.299   3.861
  215    H    VAL  29           H        VAL  29 -13.929   8.005   3.233
  216    HA   VAL  29           HA       VAL  29 -11.187   8.295   2.854
  217    HB   VAL  29           HB       VAL  29 -13.277  10.463   2.870
  218   HG11  VAL  29          1HG1      VAL  29 -10.526  10.349   1.650
  219   HG12  VAL  29          2HG1      VAL  29 -11.059  11.410   2.955
  220   HG13  VAL  29          3HG1      VAL  29 -11.716  11.611   1.331
  221   HG21  VAL  29          1HG2      VAL  29 -13.318  10.065   0.427
  222   HG22  VAL  29          2HG2      VAL  29 -13.896   8.690   1.367
  223   HG23  VAL  29          3HG2      VAL  29 -12.275   8.665   0.677
  224    H    GLU  30           H        GLU  30 -13.302   9.809   5.301
  225    HA   GLU  30           HA       GLU  30 -11.314  11.344   6.578
  226    HB2  GLU  30          1HB       GLU  30 -13.564  10.099   8.117
  227    HB3  GLU  30          2HB       GLU  30 -12.818  11.679   8.307
  228    HG2  GLU  30          1HG       GLU  30 -13.804  12.352   6.154
  229    HG3  GLU  30          2HG       GLU  30 -14.658  10.812   6.107
  230    H    LYS  31           H        LYS  31 -12.310   8.005   6.960
  231    HA   LYS  31           HA       LYS  31 -10.843   7.427   9.301
  232    HB2  LYS  31          1HB       LYS  31 -11.687   5.562   7.076
  233    HB3  LYS  31          2HB       LYS  31 -11.081   5.066   8.661
  234    HG2  LYS  31          1HG       LYS  31 -12.993   6.313   9.679
  235    HG3  LYS  31          2HG       LYS  31 -13.633   6.528   8.048
  236    HD2  LYS  31          1HD       LYS  31 -13.656   4.072   7.764
  237    HD3  LYS  31          2HD       LYS  31 -13.111   3.897   9.445
  238    HE2  LYS  31          1HE       LYS  31 -15.141   5.135  10.181
  239    HE3  LYS  31          2HE       LYS  31 -15.693   5.170   8.507
  240    HZ1  LYS  31          1HZ       LYS  31 -16.710   3.378   9.773
  241    HZ2  LYS  31          2HZ       LYS  31 -15.191   2.713  10.093
  242    HZ3  LYS  31          3HZ       LYS  31 -15.773   2.769   8.507
  243    H    PHE  32           H        PHE  32 -10.053   7.122   5.870
  244    HA   PHE  32           HA       PHE  32  -7.567   5.888   6.140
  245    HB2  PHE  32          1HB       PHE  32  -8.398   7.840   3.994
  246    HB3  PHE  32          2HB       PHE  32  -7.097   6.662   3.885
  247    HD1  PHE  32           HD1      PHE  32  -9.615   7.082   2.101
  248    HD2  PHE  32           HD2      PHE  32  -8.659   4.395   5.255
  249    HE1  PHE  32           HE1      PHE  32 -11.182   5.430   1.168
  250    HE2  PHE  32           HE2      PHE  32 -10.219   2.743   4.328
  251    HZ   PHE  32           HZ       PHE  32 -11.481   3.251   2.278
  252    H    LYS  33           H        LYS  33  -8.494   9.252   6.412
  253    HA   LYS  33           HA       LYS  33  -5.880  10.367   6.413
  254    HB2  LYS  33          1HB       LYS  33  -8.187  11.542   6.196
  255    HB3  LYS  33          2HB       LYS  33  -8.188  11.512   7.957
  256    HG2  LYS  33          1HG       LYS  33  -6.130  12.772   8.026
  257    HG3  LYS  33          2HG       LYS  33  -6.042  12.759   6.257
  258    HD2  LYS  33          1HD       LYS  33  -8.187  13.984   6.183
  259    HD3  LYS  33          2HD       LYS  33  -8.186  14.051   7.944
  260    HE2  LYS  33          1HE       LYS  33  -6.201  15.383   7.957
  261    HE3  LYS  33          2HE       LYS  33  -5.992  15.177   6.218
  262    HZ1  LYS  33          1HZ       LYS  33  -8.225  16.614   7.544
  263    HZ2  LYS  33          2HZ       LYS  33  -8.061  16.394   5.876
  264    HZ3  LYS  33          3HZ       LYS  33  -6.933  17.330   6.721
  265    H    LYS  34           H        LYS  34  -7.725   8.623   8.727
  266    HA   LYS  34           HA       LYS  34  -5.889   9.348  10.891
  267    HB2  LYS  34          1HB       LYS  34  -8.528   7.868  10.905
  268    HB3  LYS  34          2HB       LYS  34  -7.525   8.080  12.334
  269    HG2  LYS  34          1HG       LYS  34  -7.779  10.494  12.164
  270    HG3  LYS  34          2HG       LYS  34  -8.742  10.297  10.699
  271    HD2  LYS  34          1HD       LYS  34 -10.424   9.059  11.961
  272    HD3  LYS  34          2HD       LYS  34  -9.456   9.222  13.426
  273    HE2  LYS  34          1HE       LYS  34 -10.619  11.503  11.837
  274    HE3  LYS  34          2HE       LYS  34 -11.297  10.852  13.328
  275    HZ1  LYS  34          1HZ       LYS  34  -8.661  12.179  13.013
  276    HZ2  LYS  34          2HZ       LYS  34  -9.199  11.450  14.439
  277    HZ3  LYS  34          3HZ       LYS  34 -10.014  12.794  13.821
  278    H    TRP  35           H        TRP  35  -5.487   7.550   8.497
  279    HA   TRP  35           HA       TRP  35  -4.590   5.570   7.907
  280    HB2  TRP  35          1HB       TRP  35  -3.475   5.809  10.702
  281    HB3  TRP  35          2HB       TRP  35  -2.908   4.633   9.505
  282    HD1  TRP  35           HD1      TRP  35  -2.661   8.287  10.465
  283    HE1  TRP  35           HE1      TRP  35  -0.926   9.454   8.961
  284    HE3  TRP  35           HE3      TRP  35  -1.907   4.558   7.052
  285    HZ2  TRP  35           HZ2      TRP  35   0.558   8.870   6.641
  286    HZ3  TRP  35           HZ3      TRP  35  -0.317   4.943   5.222
  287    HH2  TRP  35           HH2      TRP  35   0.894   7.048   5.015
  288    H    GLU  36           H        GLU  36  -7.213   5.371   8.763
  289    HA   GLU  36           HA       GLU  36  -7.277   2.717  10.015
  290    HB2  GLU  36          1HB       GLU  36  -9.381   4.873   9.912
  291    HB3  GLU  36          2HB       GLU  36  -9.698   3.229  10.443
  292    HG2  GLU  36          1HG       GLU  36  -8.004   3.539  12.220
  293    HG3  GLU  36          2HG       GLU  36  -7.851   5.218  11.715
  294    H    PHE  37           H        PHE  37  -7.352   1.235   8.502
  295    HA   PHE  37           HA       PHE  37  -9.078   1.707   6.162
  296    HB2  PHE  37          1HB       PHE  37  -6.692  -0.156   6.338
  297    HB3  PHE  37          2HB       PHE  37  -7.616   0.225   4.890
  298    HD1  PHE  37           HD1      PHE  37  -7.166   2.199   3.627
  299    HD2  PHE  37           HD2      PHE  37  -5.258   1.566   7.382
  300    HE1  PHE  37           HE1      PHE  37  -5.648   4.078   3.172
  301    HE2  PHE  37           HE2      PHE  37  -3.731   3.436   6.924
  302    HZ   PHE  37           HZ       PHE  37  -3.928   4.701   4.820
  303    HA   PRO  38           HA       PRO  38 -11.325  -1.568   8.522
  304    HB2  PRO  38          1HB       PRO  38 -13.285  -0.705   6.452
  305    HB3  PRO  38          2HB       PRO  38 -13.522  -1.025   8.180
  306    HG2  PRO  38          1HG       PRO  38 -13.461   1.472   7.311
  307    HG3  PRO  38          2HG       PRO  38 -12.633   1.027   8.816
  308    HD2  PRO  38          1HD       PRO  38 -11.462   1.507   6.093
  309    HD3  PRO  38          2HD       PRO  38 -10.846   2.005   7.700
  310    H    GLU  39           H        GLU  39 -11.496  -3.643   7.981
  311    HA   GLU  39           HA       GLU  39 -10.446  -4.523   5.485
  312    HB2  GLU  39          1HB       GLU  39 -10.042  -5.700   7.609
  313    HB3  GLU  39          2HB       GLU  39 -11.745  -6.121   7.694
  314    HG2  GLU  39          1HG       GLU  39 -11.575  -7.543   5.812
  315    HG3  GLU  39          2HG       GLU  39  -9.966  -6.940   5.417
  316    H    ASP  40           H        ASP  40 -11.821  -3.703   3.961
  317    HA   ASP  40           HA       ASP  40 -14.226  -5.250   3.452
  318    HB2  ASP  40          1HB       ASP  40 -15.111  -3.373   4.774
  319    HB3  ASP  40          2HB       ASP  40 -14.319  -2.224   3.698
  320    H    ASP  41           H        ASP  41 -14.807  -5.279   1.336
  321    HA   ASP  41           HA       ASP  41 -12.799  -5.240  -0.555
  322    HB2  ASP  41          1HB       ASP  41 -14.837  -6.536  -0.820
  323    HB3  ASP  41          2HB       ASP  41 -15.785  -5.064  -0.988
  324    H    THR  42           H        THR  42 -15.098  -2.674   0.229
  325    HA   THR  42           HA       THR  42 -14.645  -0.979  -1.959
  326    HB   THR  42           HB       THR  42 -15.176  -0.066   0.868
  327    HG1  THR  42           HG1      THR  42 -16.756  -1.519   0.620
  328   HG21  THR  42          1HG2      THR  42 -15.929   1.020  -1.844
  329   HG22  THR  42          2HG2      THR  42 -14.799   1.737  -0.696
  330   HG23  THR  42          3HG2      THR  42 -16.518   1.662  -0.312
  331    H    THR  43           H        THR  43 -13.127  -0.982   1.258
  332    HA   THR  43           HA       THR  43 -11.212   1.014   0.798
  333    HB   THR  43           HB       THR  43 -10.915  -1.379   2.618
  334    HG1  THR  43           HG1      THR  43 -11.859   0.300   4.148
  335   HG21  THR  43          1HG2      THR  43  -9.673   0.289   4.028
  336   HG22  THR  43          2HG2      THR  43  -9.763   1.409   2.668
  337   HG23  THR  43          3HG2      THR  43  -8.885  -0.110   2.500
  338    H    MET  44           H        MET  44 -11.284  -2.391   0.033
  339    HA   MET  44           HA       MET  44  -8.488  -2.732  -0.275
  340    HB2  MET  44          1HB       MET  44 -10.765  -4.394  -1.344
  341    HB3  MET  44          2HB       MET  44  -9.081  -4.895  -1.293
  342    HG2  MET  44          1HG       MET  44  -9.108  -4.772   1.134
  343    HG3  MET  44          2HG       MET  44 -10.778  -4.217   1.097
  344    HE1  MET  44          1HE       MET  44  -9.819  -6.628   2.869
  345    HE2  MET  44          2HE       MET  44 -11.117  -7.790   2.585
  346    HE3  MET  44          3HE       MET  44 -11.493  -6.077   2.785
  347    H    CYS  45           H        CYS  45 -11.125  -2.388  -2.669
  348    HA   CYS  45           HA       CYS  45  -9.402  -2.352  -4.907
  349    HB2  CYS  45          1HB       CYS  45 -12.184  -1.208  -4.563
  350    HB3  CYS  45          2HB       CYS  45 -11.328  -1.256  -6.099
  351    H    TYR  46           H        TYR  46 -10.436   0.110  -2.662
  352    HA   TYR  46           HA       TYR  46  -9.597   2.371  -4.063
  353    HB2  TYR  46          1HB       TYR  46 -10.902   2.764  -2.158
  354    HB3  TYR  46          2HB       TYR  46  -9.887   1.746  -1.134
  355    HD1  TYR  46           HD1      TYR  46  -9.662   4.857  -3.202
  356    HD2  TYR  46           HD2      TYR  46  -8.428   2.797   0.312
  357    HE1  TYR  46           HE1      TYR  46  -8.424   6.848  -2.471
  358    HE2  TYR  46           HE2      TYR  46  -7.192   4.788   1.050
  359    HH   TYR  46           HH       TYR  46  -6.449   6.826   0.461
  360    H    ILE  47           H        ILE  47  -7.872   0.388  -1.673
  361    HA   ILE  47           HA       ILE  47  -5.426   1.715  -1.784
  362    HB   ILE  47           HB       ILE  47  -6.052  -1.158  -1.147
  363   HG12  ILE  47          1HG1      ILE  47  -7.011   0.438   0.417
  364   HG13  ILE  47          2HG1      ILE  47  -5.681  -0.414   1.196
  365   HG21  ILE  47          1HG2      ILE  47  -3.433   0.297  -0.810
  366   HG22  ILE  47          2HG2      ILE  47  -3.751  -1.070  -1.878
  367   HG23  ILE  47          3HG2      ILE  47  -3.806  -1.285  -0.127
  368   HD11  ILE  47          1HD1      ILE  47  -5.528   1.860   1.822
  369   HD12  ILE  47          2HD1      ILE  47  -5.718   2.409   0.160
  370   HD13  ILE  47          3HD1      ILE  47  -4.239   1.580   0.652
  371    H    LYS  48           H        LYS  48  -6.741  -0.858  -3.800
  372    HA   LYS  48           HA       LYS  48  -4.393  -1.525  -5.170
  373    HB2  LYS  48          1HB       LYS  48  -6.524  -2.831  -5.222
  374    HB3  LYS  48          2HB       LYS  48  -7.204  -1.596  -6.271
  375    HG2  LYS  48          1HG       LYS  48  -5.499  -2.075  -7.953
  376    HG3  LYS  48          2HG       LYS  48  -4.800  -3.300  -6.894
  377    HD2  LYS  48          1HD       LYS  48  -6.175  -4.380  -8.546
  378    HD3  LYS  48          2HD       LYS  48  -6.948  -4.529  -6.969
  379    HE2  LYS  48          1HE       LYS  48  -8.625  -4.001  -8.596
  380    HE3  LYS  48          2HE       LYS  48  -8.393  -2.595  -7.559
  381    HZ1  LYS  48          1HZ       LYS  48  -7.219  -2.950 -10.263
  382    HZ2  LYS  48          2HZ       LYS  48  -7.036  -1.591  -9.276
  383    HZ3  LYS  48          3HZ       LYS  48  -8.557  -1.987  -9.891
  384    H    CYS  49           H        CYS  49  -7.003   0.737  -6.028
  385    HA   CYS  49           HA       CYS  49  -5.914   1.656  -8.420
  386    HB2  CYS  49          1HB       CYS  49  -8.179   2.134  -7.943
  387    HB3  CYS  49          2HB       CYS  49  -7.782   2.982  -6.451
  388    H    VAL  50           H        VAL  50  -5.543   2.963  -5.124
  389    HA   VAL  50           HA       VAL  50  -4.070   5.228  -5.823
  390    HB   VAL  50           HB       VAL  50  -4.170   3.680  -3.239
  391   HG11  VAL  50          1HG1      VAL  50  -2.100   4.965  -3.332
  392   HG12  VAL  50          2HG1      VAL  50  -3.230   5.677  -2.178
  393   HG13  VAL  50          3HG1      VAL  50  -3.009   6.414  -3.766
  394   HG21  VAL  50          1HG2      VAL  50  -6.284   4.613  -3.853
  395   HG22  VAL  50          2HG2      VAL  50  -5.540   6.174  -4.194
  396   HG23  VAL  50          3HG2      VAL  50  -5.601   5.570  -2.537
  397    H    PHE  51           H        PHE  51  -3.013   2.046  -4.679
  398    HA   PHE  51           HA       PHE  51  -0.270   2.632  -4.657
  399    HB2  PHE  51          1HB       PHE  51  -1.944   0.183  -4.480
  400    HB3  PHE  51          2HB       PHE  51  -0.236  -0.034  -4.859
  401    HD1  PHE  51           HD1      PHE  51  -1.643   2.612  -2.702
  402    HD2  PHE  51           HD2      PHE  51   0.434  -1.098  -2.860
  403    HE1  PHE  51           HE1      PHE  51  -1.137   2.797  -0.304
  404    HE2  PHE  51           HE2      PHE  51   0.942  -0.917  -0.462
  405    HZ   PHE  51           HZ       PHE  51   0.157   1.032   0.820
  406    H    ASN  52           H        ASN  52  -2.461   1.709  -7.143
  407    HA   ASN  52           HA       ASN  52  -0.467   0.784  -8.999
  408    HB2  ASN  52          1HB       ASN  52  -2.803  -0.044  -9.038
  409    HB3  ASN  52          2HB       ASN  52  -3.353   1.575  -9.483
  410   HD21  ASN  52          1HD2      ASN  52  -0.433   0.014 -10.683
  411   HD22  ASN  52          2HD2      ASN  52  -0.968  -0.111 -12.321
  412    H    LYS  53           H        LYS  53  -2.282   3.746  -8.429
  413    HA   LYS  53           HA       LYS  53  -1.280   5.077 -10.749
  414    HB2  LYS  53          1HB       LYS  53  -2.885   5.892  -8.366
  415    HB3  LYS  53          2HB       LYS  53  -2.203   7.130  -9.413
  416    HG2  LYS  53          1HG       LYS  53  -4.021   4.904 -10.319
  417    HG3  LYS  53          2HG       LYS  53  -4.542   6.549  -9.959
  418    HD2  LYS  53          1HD       LYS  53  -2.534   5.775 -12.079
  419    HD3  LYS  53          2HD       LYS  53  -4.226   6.173 -12.374
  420    HE2  LYS  53          1HE       LYS  53  -3.842   8.422 -11.461
  421    HE3  LYS  53          2HE       LYS  53  -2.146   8.019 -11.198
  422    HZ1  LYS  53          1HZ       LYS  53  -1.875   7.721 -13.572
  423    HZ2  LYS  53          2HZ       LYS  53  -2.468   9.270 -13.242
  424    HZ3  LYS  53          3HZ       LYS  53  -3.507   8.077 -13.835
  425    H    MET  54           H        MET  54  -0.137   4.567  -7.558
  426    HA   MET  54           HA       MET  54   1.816   6.709  -7.705
  427    HB2  MET  54          1HB       MET  54   1.187   4.595  -5.658
  428    HB3  MET  54          2HB       MET  54   2.599   5.640  -5.520
  429    HG2  MET  54          1HG       MET  54   1.292   7.550  -5.265
  430    HG3  MET  54          2HG       MET  54  -0.156   6.754  -5.874
  431    HE1  MET  54          1HE       MET  54   1.642   6.258  -1.664
  432    HE2  MET  54          2HE       MET  54   2.248   7.328  -2.929
  433    HE3  MET  54          3HE       MET  54   2.485   5.588  -3.061
  434    H    GLN  55           H        GLN  55   1.580   3.963  -9.283
  435    HA   GLN  55           HA       GLN  55   2.926   2.471 -10.269
  436    HB2  GLN  55          1HB       GLN  55   4.840   4.732  -9.801
  437    HB3  GLN  55          2HB       GLN  55   5.315   3.278 -10.691
  438    HG2  GLN  55          1HG       GLN  55   3.610   3.690 -12.329
  439    HG3  GLN  55          2HG       GLN  55   2.991   5.048 -11.401
  440   HE21  GLN  55          1HE2      GLN  55   3.935   4.981 -14.130
  441   HE22  GLN  55          2HE2      GLN  55   5.244   6.102 -14.230
  442    H    LEU  56           H        LEU  56   2.446   1.796  -7.709
  443    HA   LEU  56           HA       LEU  56   5.027   0.864  -6.701
  444    HB2  LEU  56          1HB       LEU  56   2.845   2.308  -5.378
  445    HB3  LEU  56          2HB       LEU  56   3.430   0.913  -4.458
  446    HG   LEU  56           HG       LEU  56   5.092   3.229  -5.459
  447   HD11  LEU  56          1HD1      LEU  56   3.591   3.890  -3.658
  448   HD12  LEU  56          2HD1      LEU  56   5.261   3.853  -3.101
  449   HD13  LEU  56          3HD1      LEU  56   4.160   2.545  -2.674
  450   HD21  LEU  56          1HD2      LEU  56   5.798   0.830  -3.792
  451   HD22  LEU  56          2HD2      LEU  56   6.817   2.259  -3.951
  452   HD23  LEU  56          3HD2      LEU  56   6.458   1.271  -5.366
  453    H    PHE  57           H        PHE  57   1.857   0.066  -7.663
  454    HA   PHE  57           HA       PHE  57   2.384  -2.751  -7.149
  455    HB2  PHE  57          1HB       PHE  57   1.007  -2.162  -5.237
  456    HB3  PHE  57          2HB       PHE  57  -0.145  -1.331  -6.272
  457    HD1  PHE  57           HD1      PHE  57   1.118  -4.622  -5.223
  458    HD2  PHE  57           HD2      PHE  57  -1.831  -2.531  -7.476
  459    HE1  PHE  57           HE1      PHE  57  -0.195  -6.692  -5.426
  460    HE2  PHE  57           HE2      PHE  57  -3.144  -4.600  -7.682
  461    HZ   PHE  57           HZ       PHE  57  -2.326  -6.682  -6.655
  462    H    ASP  58           H        ASP  58   1.570  -4.082  -8.685
  463    HA   ASP  58           HA       ASP  58  -0.119  -2.912 -10.792
  464    HB2  ASP  58          1HB       ASP  58   2.178  -2.993 -11.625
  465    HB3  ASP  58          2HB       ASP  58   2.321  -4.677 -11.146
  466    H    ASP  59           H        ASP  59  -1.636  -4.368 -11.701
  467    HA   ASP  59           HA       ASP  59  -2.440  -6.421  -9.846
  468    HB2  ASP  59          1HB       ASP  59  -4.437  -6.621 -11.145
  469    HB3  ASP  59          2HB       ASP  59  -4.053  -4.917 -11.046
  470    H    THR  60           H        THR  60  -0.447  -6.331 -12.539
  471    HA   THR  60           HA       THR  60  -0.836  -9.146 -13.186
  472    HB   THR  60           HB       THR  60   0.785  -6.955 -14.467
  473    HG1  THR  60           HG1      THR  60  -1.286  -6.776 -15.110
  474   HG21  THR  60          1HG2      THR  60   0.601  -9.846 -15.306
  475   HG22  THR  60          2HG2      THR  60   2.028  -9.048 -14.646
  476   HG23  THR  60          3HG2      THR  60   1.385  -8.553 -16.213
  477    H    GLU  61           H        GLU  61   1.966  -7.010 -12.566
  478    HA   GLU  61           HA       GLU  61   3.655  -9.243 -11.911
  479    HB2  GLU  61          1HB       GLU  61   4.325  -6.352 -11.441
  480    HB3  GLU  61          2HB       GLU  61   5.404  -7.693 -11.782
  481    HG2  GLU  61          1HG       GLU  61   4.589  -7.836 -14.044
  482    HG3  GLU  61          2HG       GLU  61   3.423  -6.553 -13.726
  483    H    GLY  62           H        GLY  62   1.531  -7.241 -10.125
  484    HA2  GLY  62          1HA       GLY  62   0.979  -7.453  -7.868
  485    HA3  GLY  62          2HA       GLY  62   2.422  -8.450  -7.636
  486    HA   PRO  63           HA       PRO  63   3.340  -4.437  -5.502
  487    HB2  PRO  63          1HB       PRO  63   5.051  -6.346  -4.003
  488    HB3  PRO  63          2HB       PRO  63   3.947  -5.102  -3.400
  489    HG2  PRO  63          1HG       PRO  63   3.330  -7.708  -3.251
  490    HG3  PRO  63          2HG       PRO  63   2.098  -6.468  -3.558
  491    HD2  PRO  63          1HD       PRO  63   3.402  -8.371  -5.474
  492    HD3  PRO  63          2HD       PRO  63   1.716  -7.796  -5.418
  493    H    LEU  64           H        LEU  64   4.811  -3.228  -6.475
  494    HA   LEU  64           HA       LEU  64   6.983  -4.447  -7.947
  495    HB2  LEU  64          1HB       LEU  64   6.453  -1.499  -7.582
  496    HB3  LEU  64          2HB       LEU  64   7.389  -2.269  -8.844
  497    HG   LEU  64           HG       LEU  64   4.410  -2.597  -8.516
  498   HD11  LEU  64          1HD1      LEU  64   4.234  -1.178 -10.501
  499   HD12  LEU  64          2HD1      LEU  64   5.973  -0.898 -10.448
  500   HD13  LEU  64          3HD1      LEU  64   4.948  -0.312  -9.140
  501   HD21  LEU  64          1HD2      LEU  64   4.479  -3.659 -10.666
  502   HD22  LEU  64          2HD2      LEU  64   5.598  -4.485  -9.571
  503   HD23  LEU  64          3HD2      LEU  64   6.217  -3.372 -10.791
  504    H    VAL  65           H        VAL  65   8.229  -5.309  -6.354
  505    HA   VAL  65           HA       VAL  65   8.929  -4.322  -3.915
  506    HB   VAL  65           HB       VAL  65  10.602  -6.031  -5.738
  507   HG11  VAL  65          1HG1      VAL  65  11.999  -5.050  -4.006
  508   HG12  VAL  65          2HG1      VAL  65  11.758  -6.771  -3.703
  509   HG13  VAL  65          3HG1      VAL  65  10.861  -5.577  -2.766
  510   HG21  VAL  65          1HG2      VAL  65   9.698  -7.860  -4.308
  511   HG22  VAL  65          2HG2      VAL  65   8.490  -7.047  -5.299
  512   HG23  VAL  65          3HG2      VAL  65   8.612  -6.676  -3.579
  513    H    ASP  66           H        ASP  66  10.629  -3.734  -6.976
  514    HA   ASP  66           HA       ASP  66  12.871  -2.446  -5.910
  515    HB2  ASP  66          1HB       ASP  66  11.529  -2.136  -8.591
  516    HB3  ASP  66          2HB       ASP  66  13.064  -1.382  -8.180
  517    H    ASN  67           H        ASN  67   9.903  -0.975  -7.244
  518    HA   ASN  67           HA       ASN  67  10.624   1.658  -6.545
  519    HB2  ASN  67          1HB       ASN  67   7.943   0.434  -7.140
  520    HB3  ASN  67          2HB       ASN  67   8.177   2.154  -6.855
  521   HD21  ASN  67          1HD2      ASN  67   7.142   1.135  -9.262
  522   HD22  ASN  67          2HD2      ASN  67   8.291   1.441 -10.519
  523    H    LEU  68           H        LEU  68   9.004  -0.911  -4.865
  524    HA   LEU  68           HA       LEU  68   7.870   0.536  -2.755
  525    HB2  LEU  68          1HB       LEU  68   8.686  -2.309  -3.143
  526    HB3  LEU  68          2HB       LEU  68   8.204  -1.757  -1.546
  527    HG   LEU  68           HG       LEU  68   6.463  -1.345  -3.962
  528   HD11  LEU  68          1HD1      LEU  68   5.243  -3.352  -3.319
  529   HD12  LEU  68          2HD1      LEU  68   6.421  -3.674  -2.047
  530   HD13  LEU  68          3HD1      LEU  68   6.910  -3.741  -3.740
  531   HD21  LEU  68          1HD2      LEU  68   5.996   0.011  -1.982
  532   HD22  LEU  68          2HD2      LEU  68   5.878  -1.456  -1.011
  533   HD23  LEU  68          3HD2      LEU  68   4.708  -1.152  -2.296
  534    H    VAL  69           H        VAL  69  11.020  -1.058  -3.022
  535    HA   VAL  69           HA       VAL  69  11.938  -0.290  -0.442
  536    HB   VAL  69           HB       VAL  69  13.502  -1.065  -2.900
  537   HG11  VAL  69          1HG1      VAL  69  14.293  -0.893  -0.004
  538   HG12  VAL  69          2HG1      VAL  69  14.928   0.073  -1.336
  539   HG13  VAL  69          3HG1      VAL  69  15.265  -1.656  -1.262
  540   HG21  VAL  69          1HG2      VAL  69  12.643  -2.742  -0.552
  541   HG22  VAL  69          2HG2      VAL  69  13.551  -3.284  -1.965
  542   HG23  VAL  69          3HG2      VAL  69  11.879  -2.757  -2.143
  543    H    HIS  70           H        HIS  70  12.328   1.050  -3.693
  544    HA   HIS  70           HA       HIS  70  14.046   3.163  -3.185
  545    HB2  HIS  70          1HB       HIS  70  13.518   2.734  -5.439
  546    HB3  HIS  70          2HB       HIS  70  11.790   2.769  -5.133
  547    HD1  HIS  70           HD1      HIS  70  14.729   5.100  -5.573
  548    HD2  HIS  70           HD2      HIS  70  10.578   5.204  -5.454
  549    HE1  HIS  70           HE1      HIS  70  14.088   7.406  -6.336
  550    HE2  HIS  70           HE2      HIS  70  11.572   7.367  -6.456
  551    H    GLN  71           H        GLN  71  10.600   2.922  -2.601
  552    HA   GLN  71           HA       GLN  71  10.360   5.719  -1.883
  553    HB2  GLN  71          1HB       GLN  71   8.576   4.584  -3.146
  554    HB3  GLN  71          2HB       GLN  71   8.333   3.475  -1.807
  555    HG2  GLN  71          1HG       GLN  71   6.628   5.178  -1.794
  556    HG3  GLN  71          2HG       GLN  71   7.665   5.332  -0.375
  557   HE21  GLN  71          1HE2      GLN  71   7.243   7.451  -0.002
  558   HE22  GLN  71          2HE2      GLN  71   7.759   8.725  -1.047
  559    H    LEU  72           H        LEU  72   9.666   2.636  -0.238
  560    HA   LEU  72           HA       LEU  72   9.144   3.822   2.248
  561    HB2  LEU  72          1HB       LEU  72   9.839   0.983   1.528
  562    HB3  LEU  72          2HB       LEU  72   9.385   1.484   3.146
  563    HG   LEU  72           HG       LEU  72   7.635   1.793   0.705
  564   HD11  LEU  72          1HD1      LEU  72   7.953  -0.559   1.241
  565   HD12  LEU  72          2HD1      LEU  72   6.323  -0.049   1.690
  566   HD13  LEU  72          3HD1      LEU  72   7.562  -0.246   2.932
  567   HD21  LEU  72          1HD2      LEU  72   7.146   2.269   3.642
  568   HD22  LEU  72          2HD2      LEU  72   5.865   2.163   2.433
  569   HD23  LEU  72          3HD2      LEU  72   7.066   3.449   2.330
  570    H    ALA  73           H        ALA  73  12.081   2.188   1.053
  571    HA   ALA  73           HA       ALA  73  13.463   2.474   3.529
  572    HB1  ALA  73          1HB       ALA  73  15.353   1.552   2.384
  573    HB2  ALA  73          2HB       ALA  73  14.600   1.864   0.820
  574    HB3  ALA  73          3HB       ALA  73  13.897   0.675   1.914
  575    H    HIS  74           H        HIS  74  12.472   4.987   2.490
  576    HA   HIS  74           HA       HIS  74  14.610   6.508   1.374
  577    HB2  HIS  74          1HB       HIS  74  12.217   7.165   1.159
  578    HB3  HIS  74          2HB       HIS  74  12.171   7.488   2.893
  579    HD1  HIS  74           HD1      HIS  74  12.779   9.792   3.602
  580    HD2  HIS  74           HD2      HIS  74  14.043   8.960  -0.268
  581    HE1  HIS  74           HE1      HIS  74  13.673  11.960   2.703
  582    HE2  HIS  74           HE2      HIS  74  14.665  11.358   0.470
  583    H    GLY  75           H        GLY  75  16.438   6.244   2.600
  584    HA2  GLY  75          1HA       GLY  75  17.882   7.204   4.191
  585    HA3  GLY  75          2HA       GLY  75  16.481   7.719   5.120
  586    H    ARG  76           H        ARG  76  16.722   4.475   3.921
  587    HA   ARG  76           HA       ARG  76  17.698   3.468   6.474
  588    HB2  ARG  76          1HB       ARG  76  14.923   3.190   5.502
  589    HB3  ARG  76          2HB       ARG  76  15.663   1.723   6.133
  590    HG2  ARG  76          1HG       ARG  76  16.237   3.070   8.189
  591    HG3  ARG  76          2HG       ARG  76  15.168   4.320   7.554
  592    HD2  ARG  76          1HD       ARG  76  13.341   2.671   7.479
  593    HD3  ARG  76          2HD       ARG  76  14.415   1.476   8.199
  594    HE   ARG  76           HE       ARG  76  14.301   3.807   9.800
  595   HH11  ARG  76          1HH1      ARG  76  12.451   0.951   8.957
  596   HH12  ARG  76          2HH1      ARG  76  11.544   0.954  10.433
  597   HH21  ARG  76          1HH2      ARG  76  13.118   3.794  11.746
  598   HH22  ARG  76          2HH2      ARG  76  11.922   2.566  12.022
  599    H    ASP  77           H        ASP  77  18.173   1.162   6.394
  600    HA   ASP  77           HA       ASP  77  19.616   0.385   4.146
  601    HB2  ASP  77          1HB       ASP  77  18.507  -1.256   6.421
  602    HB3  ASP  77          2HB       ASP  77  19.632  -1.880   5.220
  603    H    ALA  78           H        ALA  78  18.875   0.016   2.257
  604    HA   ALA  78           HA       ALA  78  16.242  -0.359   1.512
  605    HB1  ALA  78          1HB       ALA  78  18.013   0.507   0.067
  606    HB2  ALA  78          2HB       ALA  78  17.111  -0.799  -0.702
  607    HB3  ALA  78          3HB       ALA  78  18.713  -1.108  -0.031
  608    H    GLU  79           H        GLU  79  18.791  -2.796   1.874
  609    HA   GLU  79           HA       GLU  79  17.313  -4.922   0.749
  610    HB2  GLU  79          1HB       GLU  79  19.693  -4.891   2.588
  611    HB3  GLU  79          2HB       GLU  79  19.022  -6.365   1.905
  612    HG2  GLU  79          1HG       GLU  79  19.437  -5.528  -0.339
  613    HG3  GLU  79          2HG       GLU  79  20.102  -4.043   0.331
  614    H    GLU  80           H        GLU  80  17.713  -3.809   4.067
  615    HA   GLU  80           HA       GLU  80  16.304  -5.868   5.349
  616    HB2  GLU  80          1HB       GLU  80  16.890  -3.016   6.017
  617    HB3  GLU  80          2HB       GLU  80  15.790  -3.939   7.028
  618    HG2  GLU  80          1HG       GLU  80  18.168  -3.891   7.795
  619    HG3  GLU  80          2HG       GLU  80  17.466  -5.487   7.606
  620    H    VAL  81           H        VAL  81  15.192  -2.705   4.181
  621    HA   VAL  81           HA       VAL  81  12.468  -3.009   4.690
  622    HB   VAL  81           HB       VAL  81  13.892  -1.453   2.541
  623   HG11  VAL  81          1HG1      VAL  81  11.607  -1.784   1.809
  624   HG12  VAL  81          2HG1      VAL  81  11.817  -0.119   2.355
  625   HG13  VAL  81          3HG1      VAL  81  11.003  -1.295   3.392
  626   HG21  VAL  81          1HG2      VAL  81  12.793  -0.723   5.236
  627   HG22  VAL  81          2HG2      VAL  81  13.407   0.438   4.059
  628   HG23  VAL  81          3HG2      VAL  81  14.485  -0.776   4.745
  629    H    ARG  82           H        ARG  82  14.323  -3.758   1.746
  630    HA   ARG  82           HA       ARG  82  12.371  -4.784   0.102
  631    HB2  ARG  82          1HB       ARG  82  14.791  -4.457  -0.422
  632    HB3  ARG  82          2HB       ARG  82  15.138  -5.928   0.472
  633    HG2  ARG  82          1HG       ARG  82  13.646  -7.149  -1.100
  634    HG3  ARG  82          2HG       ARG  82  13.526  -5.663  -2.041
  635    HD2  ARG  82          1HD       ARG  82  15.977  -5.639  -2.256
  636    HD3  ARG  82          2HD       ARG  82  16.048  -7.174  -1.400
  637    HE   ARG  82           HE       ARG  82  14.430  -7.793  -3.424
  638   HH11  ARG  82          1HH1      ARG  82  17.442  -6.011  -3.390
  639   HH12  ARG  82          2HH1      ARG  82  17.926  -6.550  -4.967
  640   HH21  ARG  82          1HH2      ARG  82  15.059  -8.498  -5.502
  641   HH22  ARG  82          2HH2      ARG  82  16.571  -7.963  -6.171
  642    H    THR  83           H        THR  83  14.169  -6.410   2.664
  643    HA   THR  83           HA       THR  83  13.160  -8.997   2.283
  644    HB   THR  83           HB       THR  83  14.360  -7.573   4.644
  645    HG1  THR  83           HG1      THR  83  15.676  -8.166   2.824
  646   HG21  THR  83          1HG2      THR  83  12.862  -9.252   5.576
  647   HG22  THR  83          2HG2      THR  83  14.543  -9.745   5.785
  648   HG23  THR  83          3HG2      THR  83  13.559 -10.483   4.523
  649    H    GLU  84           H        GLU  84  12.198  -6.482   4.626
  650    HA   GLU  84           HA       GLU  84  10.029  -7.782   5.767
  651    HB2  GLU  84          1HB       GLU  84  10.281  -4.812   5.286
  652    HB3  GLU  84          2HB       GLU  84   9.306  -5.601   6.519
  653    HG2  GLU  84          1HG       GLU  84  11.381  -6.504   7.506
  654    HG3  GLU  84          2HG       GLU  84  12.303  -5.564   6.337
  655    H    VAL  85           H        VAL  85  10.127  -5.686   2.894
  656    HA   VAL  85           HA       VAL  85   7.413  -5.682   2.263
  657    HB   VAL  85           HB       VAL  85   9.877  -5.516   0.533
  658   HG11  VAL  85          1HG1      VAL  85   8.426  -4.834  -1.326
  659   HG12  VAL  85          2HG1      VAL  85   7.009  -5.227  -0.349
  660   HG13  VAL  85          3HG1      VAL  85   8.126  -6.503  -0.833
  661   HG21  VAL  85          1HG2      VAL  85   9.178  -3.175   0.311
  662   HG22  VAL  85          2HG2      VAL  85   9.457  -3.634   1.991
  663   HG23  VAL  85          3HG2      VAL  85   7.808  -3.495   1.378
  664    H    LEU  86           H        LEU  86   9.969  -7.927   1.211
  665    HA   LEU  86           HA       LEU  86   8.403  -9.534  -0.441
  666    HB2  LEU  86          1HB       LEU  86  10.910 -10.142   1.113
  667    HB3  LEU  86          2HB       LEU  86  10.185 -11.267  -0.034
  668    HG   LEU  86           HG       LEU  86  11.037  -8.485  -0.793
  669   HD11  LEU  86          1HD1      LEU  86  12.591 -11.051  -1.074
  670   HD12  LEU  86          2HD1      LEU  86  12.955  -9.753   0.063
  671   HD13  LEU  86          3HD1      LEU  86  13.070  -9.464  -1.675
  672   HD21  LEU  86          1HD2      LEU  86   9.437  -9.479  -2.288
  673   HD22  LEU  86          2HD2      LEU  86  10.380 -10.967  -2.362
  674   HD23  LEU  86          3HD2      LEU  86  11.025  -9.478  -3.054
  675    H    LYS  87           H        LYS  87   8.780  -9.513   3.013
  676    HA   LYS  87           HA       LYS  87   7.612 -12.099   3.457
  677    HB2  LYS  87          1HB       LYS  87   8.178  -9.763   5.282
  678    HB3  LYS  87          2HB       LYS  87   7.447 -11.262   5.843
  679    HG2  LYS  87          1HG       LYS  87   9.391 -12.515   5.173
  680    HG3  LYS  87          2HG       LYS  87  10.126 -11.059   4.482
  681    HD2  LYS  87          1HD       LYS  87  10.267 -10.058   6.674
  682    HD3  LYS  87          2HD       LYS  87   9.416 -11.430   7.390
  683    HE2  LYS  87          1HE       LYS  87  12.100 -11.520   6.020
  684    HE3  LYS  87          2HE       LYS  87  11.822 -11.596   7.759
  685    HZ1  LYS  87          1HZ       LYS  87  10.844 -13.583   5.782
  686    HZ2  LYS  87          2HZ       LYS  87  10.632 -13.663   7.457
  687    HZ3  LYS  87          3HZ       LYS  87  12.180 -13.787   6.794
  688    H    CYS  88           H        CYS  88   6.380  -9.201   2.465
  689    HA   CYS  88           HA       CYS  88   3.702  -9.865   3.462
  690    HB2  CYS  88          1HB       CYS  88   5.009  -7.262   2.754
  691    HB3  CYS  88          2HB       CYS  88   3.239  -7.406   2.734
  692    H    VAL  89           H        VAL  89   5.721  -9.842   0.764
  693    HA   VAL  89           HA       VAL  89   3.694  -9.553  -1.251
  694    HB   VAL  89           HB       VAL  89   6.500 -10.658  -1.457
  695   HG11  VAL  89          1HG1      VAL  89   5.157 -11.490  -3.262
  696   HG12  VAL  89          2HG1      VAL  89   6.208 -10.219  -3.887
  697   HG13  VAL  89          3HG1      VAL  89   4.504  -9.882  -3.570
  698   HG21  VAL  89          1HG2      VAL  89   7.012  -8.468  -2.505
  699   HG22  VAL  89          2HG2      VAL  89   6.568  -8.344  -0.804
  700   HG23  VAL  89          3HG2      VAL  89   5.400  -7.914  -2.053
  701    H    ASP  90           H        ASP  90   2.496 -11.113  -2.127
  702    HA   ASP  90           HA       ASP  90   3.189 -13.899  -1.868
  703    HB2  ASP  90          1HB       ASP  90   1.806 -13.041   0.214
  704    HB3  ASP  90          2HB       ASP  90   0.450 -13.171  -0.909
  705    H    LYS  91           H        LYS  91   1.243 -15.205  -2.895
  706    HA   LYS  91           HA       LYS  91   0.869 -13.991  -5.524
  707    HB2  LYS  91          1HB       LYS  91   0.103 -16.785  -4.713
  708    HB3  LYS  91          2HB       LYS  91   0.482 -16.167  -6.317
  709    HG2  LYS  91          1HG       LYS  91   2.803 -15.848  -5.638
  710    HG3  LYS  91          2HG       LYS  91   2.421 -16.525  -4.058
  711    HD2  LYS  91          1HD       LYS  91   1.829 -18.640  -5.064
  712    HD3  LYS  91          2HD       LYS  91   2.078 -17.972  -6.678
  713    HE2  LYS  91          1HE       LYS  91   4.196 -18.267  -4.551
  714    HE3  LYS  91          2HE       LYS  91   3.982 -19.337  -5.936
  715    HZ1  LYS  91          1HZ       LYS  91   4.434 -17.464  -7.401
  716    HZ2  LYS  91          2HZ       LYS  91   5.722 -17.712  -6.333
  717    HZ3  LYS  91          3HZ       LYS  91   4.641 -16.443  -6.068
  718    H    ASN  92           H        ASN  92  -1.133 -13.978  -6.600
  719    HA   ASN  92           HA       ASN  92  -3.305 -13.150  -4.895
  720    HB2  ASN  92          1HB       ASN  92  -2.733 -12.017  -7.048
  721    HB3  ASN  92          2HB       ASN  92  -3.257 -13.464  -7.894
  722   HD21  ASN  92          1HD2      ASN  92  -4.752 -12.139  -8.994
  723   HD22  ASN  92          2HD2      ASN  92  -6.247 -11.684  -8.259
  724    H    THR  93           H        THR  93  -3.405 -15.323  -3.899
  725    HA   THR  93           HA       THR  93  -4.660 -17.446  -5.376
  726    HB   THR  93           HB       THR  93  -4.818 -18.502  -3.090
  727    HG1  THR  93           HG1      THR  93  -4.574 -17.171  -1.456
  728   HG21  THR  93          1HG2      THR  93  -2.926 -18.946  -4.536
  729   HG22  THR  93          2HG2      THR  93  -2.390 -18.817  -2.862
  730   HG23  THR  93          3HG2      THR  93  -2.126 -17.477  -3.979
  731    H    ASP  94           H        ASP  94  -5.736 -14.642  -3.792
  732    HA   ASP  94           HA       ASP  94  -8.329 -15.671  -3.037
  733    HB2  ASP  94          1HB       ASP  94  -7.351 -12.809  -3.189
  734    HB3  ASP  94          2HB       ASP  94  -8.871 -13.342  -2.463
  735    H    ASN  95           H        ASN  95  -6.844 -14.463  -5.805
  736    HA   ASN  95           HA       ASN  95  -7.494 -14.118  -7.920
  737    HB2  ASN  95          1HB       ASN  95 -10.041 -15.400  -6.965
  738    HB3  ASN  95          2HB       ASN  95  -9.723 -14.985  -8.641
  739   HD21  ASN  95          1HD2      ASN  95 -10.181 -17.561  -7.359
  740   HD22  ASN  95          2HD2      ASN  95  -8.799 -18.535  -7.756
  741    H    ASN  96           H        ASN  96  -8.205 -12.170  -5.645
  742    HA   ASN  96           HA       ASN  96  -9.564 -10.352  -7.508
  743    HB2  ASN  96          1HB       ASN  96 -10.027  -9.467  -4.810
  744    HB3  ASN  96          2HB       ASN  96 -11.201  -9.834  -6.067
  745   HD21  ASN  96          1HD2      ASN  96 -12.194 -11.838  -6.095
  746   HD22  ASN  96          2HD2      ASN  96 -12.128 -12.912  -4.742
  747    H    ALA  97           H        ALA  97  -8.231  -8.822  -8.064
  748    HA   ALA  97           HA       ALA  97  -5.684  -8.494  -6.934
  749    HB1  ALA  97          1HB       ALA  97  -7.174  -6.631  -8.775
  750    HB2  ALA  97          2HB       ALA  97  -6.186  -8.004  -9.273
  751    HB3  ALA  97          3HB       ALA  97  -5.437  -6.623  -8.471
  752    H    CYS  98           H        CYS  98  -8.723  -6.846  -6.312
  753    HA   CYS  98           HA       CYS  98  -7.713  -4.610  -4.922
  754    HB2  CYS  98          1HB       CYS  98 -10.302  -6.097  -4.421
  755    HB3  CYS  98          2HB       CYS  98  -9.908  -4.490  -3.826
  756    H    HIS  99           H        HIS  99  -8.440  -7.902  -3.840
  757    HA   HIS  99           HA       HIS  99  -7.839  -7.287  -1.096
  758    HB2  HIS  99          1HB       HIS  99  -9.434  -9.103  -1.838
  759    HB3  HIS  99          2HB       HIS  99  -8.032 -10.030  -2.360
  760    HD1  HIS  99           HD1      HIS  99  -7.078 -11.567  -0.636
  761    HD2  HIS  99           HD2      HIS  99  -9.318  -8.491   1.053
  762    HE1  HIS  99           HE1      HIS  99  -7.171 -12.055   1.824
  763    HE2  HIS  99           HE2      HIS  99  -8.725 -10.325   2.767
  764    H    TRP 100           H        TRP 100  -6.167  -8.471  -3.881
  765    HA   TRP 100           HA       TRP 100  -3.926  -9.638  -2.686
  766    HB2  TRP 100          1HB       TRP 100  -4.547  -9.811  -5.103
  767    HB3  TRP 100          2HB       TRP 100  -4.010  -8.146  -5.326
  768    HD1  TRP 100           HD1      TRP 100  -1.669  -9.816  -3.027
  769    HE1  TRP 100           HE1      TRP 100   0.431 -10.608  -4.279
  770    HE3  TRP 100           HE3      TRP 100  -3.328  -9.286  -7.835
  771    HZ2  TRP 100           HZ2      TRP 100   1.275 -10.981  -6.938
  772    HZ3  TRP 100           HZ3      TRP 100  -1.812  -9.885  -9.674
  773    HH2  TRP 100           HH2      TRP 100   0.440 -10.718  -9.243
  774    H    ALA 101           H        ALA 101  -4.271  -6.359  -4.034
  775    HA   ALA 101           HA       ALA 101  -1.807  -5.369  -3.127
  776    HB1  ALA 101          1HB       ALA 101  -2.726  -3.165  -3.606
  777    HB2  ALA 101          2HB       ALA 101  -4.348  -3.852  -3.696
  778    HB3  ALA 101          3HB       ALA 101  -3.133  -4.306  -4.889
  779    H    PHE 102           H        PHE 102  -4.980  -5.500  -1.666
  780    HA   PHE 102           HA       PHE 102  -4.475  -3.730   0.453
  781    HB2  PHE 102          1HB       PHE 102  -6.720  -4.343  -0.301
  782    HB3  PHE 102          2HB       PHE 102  -6.489  -5.974   0.318
  783    HD1  PHE 102           HD1      PHE 102  -7.152  -6.465   2.500
  784    HD2  PHE 102           HD2      PHE 102  -6.482  -2.412   1.378
  785    HE1  PHE 102           HE1      PHE 102  -8.016  -5.721   4.678
  786    HE2  PHE 102           HE2      PHE 102  -7.340  -1.664   3.558
  787    HZ   PHE 102           HZ       PHE 102  -8.108  -3.317   5.213
  788    H    ARG 103           H        ARG 103  -3.893  -7.165   0.033
  789    HA   ARG 103           HA       ARG 103  -3.424  -7.775   2.772
  790    HB2  ARG 103          1HB       ARG 103  -2.409  -9.125   0.277
  791    HB3  ARG 103          2HB       ARG 103  -2.165  -9.751   1.894
  792    HG2  ARG 103          1HG       ARG 103  -4.608  -9.900   2.158
  793    HG3  ARG 103          2HG       ARG 103  -4.794  -9.358   0.493
  794    HD2  ARG 103          1HD       ARG 103  -3.655 -11.917   1.524
  795    HD3  ARG 103          2HD       ARG 103  -4.919 -11.678   0.322
  796    HE   ARG 103           HE       ARG 103  -2.422 -10.607  -0.538
  797   HH11  ARG 103          1HH1      ARG 103  -4.282 -13.557  -0.290
  798   HH12  ARG 103          2HH1      ARG 103  -3.311 -14.411  -1.440
  799   HH21  ARG 103          1HH2      ARG 103  -1.160 -11.711  -2.064
  800   HH22  ARG 103          2HH2      ARG 103  -1.549 -13.354  -2.481
  801    H    GLY 104           H        GLY 104  -1.339  -6.886   0.063
  802    HA2  GLY 104          1HA       GLY 104   1.134  -7.124   1.379
  803    HA3  GLY 104          2HA       GLY 104   0.812  -6.097  -0.024
  804    H    PHE 105           H        PHE 105  -1.036  -4.355   0.997
  805    HA   PHE 105           HA       PHE 105   0.633  -2.499   2.291
  806    HB2  PHE 105          1HB       PHE 105  -1.031  -1.654   0.840
  807    HB3  PHE 105          2HB       PHE 105  -2.305  -2.530   1.675
  808    HD1  PHE 105           HD1      PHE 105   0.418  -0.300   2.895
  809    HD2  PHE 105           HD2      PHE 105  -3.777  -0.971   2.568
  810    HE1  PHE 105           HE1      PHE 105  -0.011   1.709   4.245
  811    HE2  PHE 105           HE2      PHE 105  -4.204   1.033   3.924
  812    HZ   PHE 105           HZ       PHE 105  -2.318   2.375   4.766
  813    H    LYS 106           H        LYS 106  -2.082  -4.464   3.428
  814    HA   LYS 106           HA       LYS 106  -2.160  -3.267   5.985
  815    HB2  LYS 106          1HB       LYS 106  -4.177  -4.173   5.391
  816    HB3  LYS 106          2HB       LYS 106  -3.475  -5.659   4.751
  817    HG2  LYS 106          1HG       LYS 106  -3.188  -6.528   6.945
  818    HG3  LYS 106          2HG       LYS 106  -3.509  -4.951   7.674
  819    HD2  LYS 106          1HD       LYS 106  -5.819  -5.063   6.734
  820    HD3  LYS 106          2HD       LYS 106  -5.469  -6.705   6.199
  821    HE2  LYS 106          1HE       LYS 106  -5.171  -7.446   8.460
  822    HE3  LYS 106          2HE       LYS 106  -5.280  -5.796   9.068
  823    HZ1  LYS 106          1HZ       LYS 106  -7.340  -6.975   9.410
  824    HZ2  LYS 106          2HZ       LYS 106  -7.475  -7.318   7.760
  825    HZ3  LYS 106          3HZ       LYS 106  -7.577  -5.717   8.306
  826    H    CYS 107           H        CYS 107  -0.613  -6.141   4.696
  827    HA   CYS 107           HA       CYS 107   0.261  -7.278   7.096
  828    HB2  CYS 107          1HB       CYS 107   0.359  -8.631   5.175
  829    HB3  CYS 107          2HB       CYS 107   1.253  -7.430   4.254
  830    H    PHE 108           H        PHE 108   1.698  -4.826   5.001
  831    HA   PHE 108           HA       PHE 108   4.206  -4.819   6.377
  832    HB2  PHE 108          1HB       PHE 108   3.867  -4.250   3.954
  833    HB3  PHE 108          2HB       PHE 108   3.135  -2.735   4.481
  834    HD1  PHE 108           HD1      PHE 108   6.226  -4.609   4.057
  835    HD2  PHE 108           HD2      PHE 108   4.513  -1.003   5.540
  836    HE1  PHE 108           HE1      PHE 108   8.457  -3.585   4.149
  837    HE2  PHE 108           HE2      PHE 108   6.746   0.025   5.627
  838    HZ   PHE 108           HZ       PHE 108   8.720  -1.266   4.928
  839    H    GLN 109           H        GLN 109   1.465  -2.528   6.205
  840    HA   GLN 109           HA       GLN 109   2.541  -0.633   7.975
  841    HB2  GLN 109          1HB       GLN 109   0.341   0.314   8.106
  842    HB3  GLN 109          2HB       GLN 109   0.638  -0.194   6.452
  843    HG2  GLN 109          1HG       GLN 109  -1.405  -1.079   6.599
  844    HG3  GLN 109          2HG       GLN 109  -0.600  -2.387   7.473
  845   HE21  GLN 109          1HE2      GLN 109  -3.349  -1.433   7.679
  846   HE22  GLN 109          2HE2      GLN 109  -3.578  -0.988   9.332
  847    H    LYS 110           H        LYS 110   1.102  -3.687   8.529
  848    HA   LYS 110           HA       LYS 110   0.033  -3.421  11.083
  849    HB2  LYS 110          1HB       LYS 110  -0.283  -5.385   9.660
  850    HB3  LYS 110          2HB       LYS 110   1.421  -5.771   9.794
  851    HG2  LYS 110          1HG       LYS 110   1.187  -6.207  12.145
  852    HG3  LYS 110          2HG       LYS 110  -0.517  -5.755  12.082
  853    HD2  LYS 110          1HD       LYS 110  -0.956  -7.593  10.540
  854    HD3  LYS 110          2HD       LYS 110   0.753  -8.033  10.564
  855    HE2  LYS 110          1HE       LYS 110  -0.478  -9.497  12.031
  856    HE3  LYS 110          2HE       LYS 110   0.579  -8.458  12.984
  857    HZ1  LYS 110          1HZ       LYS 110  -1.336  -7.043  13.458
  858    HZ2  LYS 110          2HZ       LYS 110  -1.582  -8.623  13.998
  859    HZ3  LYS 110          3HZ       LYS 110  -2.339  -8.087  12.584
  860    H    ASN 111           H        ASN 111   3.355  -3.799  10.013
  861    HA   ASN 111           HA       ASN 111   4.218  -3.747  12.832
  862    HB2  ASN 111          1HB       ASN 111   5.698  -4.875  10.449
  863    HB3  ASN 111          2HB       ASN 111   6.274  -4.859  12.113
  864   HD21  ASN 111          1HD2      ASN 111   5.343  -6.243  13.619
  865   HD22  ASN 111          2HD2      ASN 111   4.377  -7.595  13.144
  866    H    ASN 112           H        ASN 112   4.478  -2.262   9.704
  867    HA   ASN 112           HA       ASN 112   6.481  -0.397  10.785
  868    HB2  ASN 112          1HB       ASN 112   6.484  -1.693   8.053
  869    HB3  ASN 112          2HB       ASN 112   7.531  -0.351   8.527
  870   HD21  ASN 112          1HD2      ASN 112   7.952  -3.247   7.756
  871   HD22  ASN 112          2HD2      ASN 112   9.038  -3.835   8.968
  872    H    LEU 113           H        LEU 113   4.207   0.665  11.088
  873    HA   LEU 113           HA       LEU 113   3.176   1.833   8.643
  874    HB2  LEU 113          1HB       LEU 113   1.534   1.183  10.244
  875    HB3  LEU 113          2HB       LEU 113   2.309   2.111  11.513
  876    HG   LEU 113           HG       LEU 113   1.741   4.189  10.247
  877   HD11  LEU 113          1HD1      LEU 113   0.080   2.338   8.552
  878   HD12  LEU 113          2HD1      LEU 113   1.579   3.102   8.033
  879   HD13  LEU 113          3HD1      LEU 113   0.176   4.093   8.425
  880   HD21  LEU 113          1HD2      LEU 113  -0.593   2.415  10.944
  881   HD22  LEU 113          2HD2      LEU 113  -0.623   4.176  10.832
  882   HD23  LEU 113          3HD2      LEU 113   0.338   3.386  12.082
  883    H    SER 114           H        SER 114   5.190   2.766  11.334
  884    HA   SER 114           HA       SER 114   4.975   5.576  10.975
  885    HB2  SER 114          1HB       SER 114   5.886   4.467  13.045
  886    HB3  SER 114          2HB       SER 114   7.350   4.093  12.134
  887    HG   SER 114           HG       SER 114   7.331   6.492  11.706
  888    H    LEU 115           H        LEU 115   7.064   3.109   9.594
  889    HA   LEU 115           HA       LEU 115   8.823   4.788   8.192
  890    HB2  LEU 115          1HB       LEU 115   9.176   2.379   8.507
  891    HB3  LEU 115          2HB       LEU 115   7.817   2.046   7.455
  892    HG   LEU 115           HG       LEU 115   9.049   3.162   5.595
  893   HD11  LEU 115          1HD1      LEU 115  11.493   3.455   5.906
  894   HD12  LEU 115          2HD1      LEU 115  11.258   3.199   7.636
  895   HD13  LEU 115          3HD1      LEU 115  10.515   4.585   6.842
  896   HD21  LEU 115          1HD2      LEU 115  10.577   1.307   5.197
  897   HD22  LEU 115          2HD2      LEU 115   9.041   0.730   5.845
  898   HD23  LEU 115          3HD2      LEU 115  10.458   0.831   6.890
  899    H    ILE 116           H        ILE 116   5.610   3.588   7.472
  900    HA   ILE 116           HA       ILE 116   5.535   4.361   4.752
  901    HB   ILE 116           HB       ILE 116   3.247   3.954   6.695
  902   HG12  ILE 116          1HG1      ILE 116   4.553   2.069   4.714
  903   HG13  ILE 116          2HG1      ILE 116   4.635   1.958   6.478
  904   HG21  ILE 116          1HG2      ILE 116   1.876   3.608   4.684
  905   HG22  ILE 116          2HG2      ILE 116   3.257   4.051   3.682
  906   HG23  ILE 116          3HG2      ILE 116   2.533   5.245   4.763
  907   HD11  ILE 116          1HD1      ILE 116   2.135   1.694   6.449
  908   HD12  ILE 116          2HD1      ILE 116   3.060   0.363   5.757
  909   HD13  ILE 116          3HD1      ILE 116   2.259   1.521   4.699
  910    H    LYS 117           H        LYS 117   4.587   5.931   7.762
  911    HA   LYS 117           HA       LYS 117   3.482   8.267   6.652
  912    HB2  LYS 117          1HB       LYS 117   4.778   7.743   9.321
  913    HB3  LYS 117          2HB       LYS 117   4.027   9.277   8.909
  914    HG2  LYS 117          1HG       LYS 117   1.890   8.136   8.569
  915    HG3  LYS 117          2HG       LYS 117   2.636   6.597   8.991
  916    HD2  LYS 117          1HD       LYS 117   3.132   7.433  11.229
  917    HD3  LYS 117          2HD       LYS 117   2.456   9.006  10.810
  918    HE2  LYS 117          1HE       LYS 117   0.264   7.988  10.483
  919    HE3  LYS 117          2HE       LYS 117   0.935   6.400  10.852
  920    HZ1  LYS 117          1HZ       LYS 117   0.905   8.696  12.731
  921    HZ2  LYS 117          2HZ       LYS 117   1.421   7.125  13.072
  922    HZ3  LYS 117          3HZ       LYS 117  -0.208   7.426  12.744
  923    H    ALA 118           H        ALA 118   6.746   7.503   7.795
  924    HA   ALA 118           HA       ALA 118   7.871  10.042   7.224
  925    HB1  ALA 118          1HB       ALA 118  10.001   8.950   7.592
  926    HB2  ALA 118          2HB       ALA 118   9.223   7.370   7.482
  927    HB3  ALA 118          3HB       ALA 118   8.828   8.455   8.813
  928    H    SER 119           H        SER 119   7.412   7.144   5.338
  929    HA   SER 119           HA       SER 119   9.207   7.605   3.266
  930    HB2  SER 119          1HB       SER 119   8.015   5.479   3.578
  931    HB3  SER 119          2HB       SER 119   6.499   6.258   3.125
  932    HG   SER 119           HG       SER 119   8.795   5.868   1.501
  933    H    ILE 120           H        ILE 120   5.831   8.689   3.596
  934    HA   ILE 120           HA       ILE 120   5.970  10.086   1.053
  935    HB   ILE 120           HB       ILE 120   3.637  10.789   1.563
  936   HG12  ILE 120          1HG1      ILE 120   3.840   8.919   3.923
  937   HG13  ILE 120          2HG1      ILE 120   3.957  10.672   4.070
  938   HG21  ILE 120          1HG2      ILE 120   2.660   8.546   1.305
  939   HG22  ILE 120          2HG2      ILE 120   4.216   7.839   1.735
  940   HG23  ILE 120          3HG2      ILE 120   4.059   8.794   0.261
  941   HD11  ILE 120          1HD1      ILE 120   1.727   9.947   4.594
  942   HD12  ILE 120          2HD1      ILE 120   1.603   9.109   3.048
  943   HD13  ILE 120          3HD1      ILE 120   1.712  10.868   3.091
  944    H    LYS 121           H        LYS 121   7.073  10.738   4.039
  945    HA   LYS 121           HA       LYS 121   6.394  13.564   4.080
  946    HB2  LYS 121          1HB       LYS 121   6.500  12.099   6.146
  947    HB3  LYS 121          2HB       LYS 121   8.240  12.038   5.922
  948    HG2  LYS 121          1HG       LYS 121   6.803  14.656   6.175
  949    HG3  LYS 121          2HG       LYS 121   7.270  13.726   7.597
  950    HD2  LYS 121          1HD       LYS 121   9.611  13.770   6.817
  951    HD3  LYS 121          2HD       LYS 121   9.114  14.767   5.448
  952    HE2  LYS 121          1HE       LYS 121  10.047  16.127   7.253
  953    HE3  LYS 121          2HE       LYS 121   8.347  16.502   6.973
  954    HZ1  LYS 121          1HZ       LYS 121   8.842  16.343   9.328
  955    HZ2  LYS 121          2HZ       LYS 121   9.394  14.757   9.137
  956    HZ3  LYS 121          3HZ       LYS 121   7.767  15.124   8.869
  957    H    LYS 122           H        LYS 122   7.648  15.066   3.174
  958    HA   LYS 122           HA       LYS 122  10.467  14.567   2.812
  959    HB2  LYS 122          1HB       LYS 122   9.870  13.644   0.798
  960    HB3  LYS 122          2HB       LYS 122   8.506  14.693   0.570
  961    HG2  LYS 122          1HG       LYS 122  10.006  15.354  -1.081
  962    HG3  LYS 122          2HG       LYS 122  10.281  16.542   0.192
  963    HD2  LYS 122          1HD       LYS 122  11.934  14.066   0.198
  964    HD3  LYS 122          2HD       LYS 122  12.283  15.295  -1.017
  965    HE2  LYS 122          1HE       LYS 122  12.121  15.833   1.943
  966    HE3  LYS 122          2HE       LYS 122  13.620  15.504   1.075
  967    HZ1  LYS 122          1HZ       LYS 122  13.024  17.915   1.447
  968    HZ2  LYS 122          2HZ       LYS 122  11.807  17.703   0.285
  969    HZ3  LYS 122          3HZ       LYS 122  13.426  17.475  -0.139
  970    H    ASP 123           H        ASP 123  10.955  16.248   4.112
  971    HA   ASP 123           HA       ASP 123   9.686  18.828   3.734
  972    HB2  ASP 123          1HB       ASP 123  10.948  19.521   5.722
  973    HB3  ASP 123          2HB       ASP 123  10.062  18.032   6.023
  974    H21  ACD 201           H21      ACD   1  -4.736   5.058   1.607
  975    H22  ACD 201           H22      ACD   1  -3.623   5.456   2.924
  976    H31  ACD 201           H31      ACD   1  -2.193   6.719   1.394
  977    H32  ACD 201           H32      ACD   1  -3.329   6.485   0.066
  978    H41  ACD 201           H41      ACD   1  -2.955   4.006   0.221
  979    H42  ACD 201           H42      ACD   1  -1.468   4.892  -0.151
  980    H5   ACD 201           H5       ACD   1  -2.125   3.485   2.496
  981    H6   ACD 201           H6       ACD   1   0.182   3.959   2.936
  982    H71  ACD 201           H71      ACD   1   0.712   4.837   0.251
  983    H72  ACD 201           H72      ACD   1  -0.195   6.189   0.929
  984    H8   ACD 201           H8       ACD   1   1.624   6.586   2.632
  985    H9   ACD 201           H9       ACD   1   3.752   5.686   2.036
  986   H101  ACD 201          H101      ACD   1   2.698   4.763  -0.518
  987   H102  ACD 201          H102      ACD   1   2.281   3.491   0.636
  988    H11  ACD 201           H11      ACD   1   5.211   4.460   0.500
  989    H12  ACD 201           H12      ACD   1   5.620   2.143   0.178
  990   H131  ACD 201          H131      ACD   1   2.652   2.072  -0.539
  991   H132  ACD 201          H132      ACD   1   3.799   0.732  -0.654
  992    H14  ACD 201           H14      ACD   1   2.632   1.725   2.049
  993    H15  ACD 201           H15      ACD   1   2.608  -0.616   2.482
  994   H161  ACD 201          H161      ACD   1   2.853  -1.258  -0.344
  995   H162  ACD 201          H162      ACD   1   4.495  -0.862   0.171
  996   H171  ACD 201          H171      ACD   1   4.508  -2.599   1.827
  997   H172  ACD 201          H172      ACD   1   2.768  -2.848   1.689
  998   H181  ACD 201          H181      ACD   1   4.809  -3.414  -0.506
  999   H182  ACD 201          H182      ACD   1   3.067  -3.668  -0.645
 1000   H191  ACD 201          H191      ACD   1   4.963  -5.069   1.293
 1001   H192  ACD 201          H192      ACD   1   3.209  -5.237   1.350
 1002   H201  ACD 201          H201      ACD   1   4.979  -5.980  -0.996
 1003   H202  ACD 201          H202      ACD   1   3.255  -6.111  -0.980
 1004   H203  ACD 201          H203      ACD   1   4.205  -7.087   0.087
  Start of MODEL   17
    1    H1   MET   1          1H        MET   1  16.987  17.369 -16.504
    2    H2   MET   1          2H        MET   1  17.628  16.094 -15.598
    3    H3   MET   1          3H        MET   1  17.365  17.594 -14.873
    4    HA   MET   1           HA       MET   1  15.013  17.379 -15.114
    5    HB2  MET   1          1HB       MET   1  14.039  15.276 -15.953
    6    HB3  MET   1          2HB       MET   1  14.967  16.106 -17.191
    7    HG2  MET   1          1HG       MET   1  16.853  14.575 -16.754
    8    HG3  MET   1          2HG       MET   1  15.848  13.712 -15.593
    9    HE1  MET   1          1HE       MET   1  16.434  14.634 -19.337
   10    HE2  MET   1          2HE       MET   1  14.810  15.275 -19.090
   11    HE3  MET   1          3HE       MET   1  15.057  13.879 -20.139
   12    H    GLU   2           H        GLU   2  14.022  16.816 -13.264
   13    HA   GLU   2           HA       GLU   2  15.572  15.147 -11.414
   14    HB2  GLU   2          1HB       GLU   2  13.412  17.183 -10.885
   15    HB3  GLU   2          2HB       GLU   2  14.238  16.248  -9.648
   16    HG2  GLU   2          1HG       GLU   2  15.451  18.283 -11.493
   17    HG3  GLU   2          2HG       GLU   2  15.193  18.437  -9.755
   18    H    PHE   3           H        PHE   3  14.775  13.359 -10.509
   19    HA   PHE   3           HA       PHE   3  12.265  12.319 -11.503
   20    HB2  PHE   3          1HB       PHE   3  14.149  10.792 -11.313
   21    HB3  PHE   3          2HB       PHE   3  14.282  11.127  -9.582
   22    HD1  PHE   3           HD1      PHE   3  12.031   9.717 -12.163
   23    HD2  PHE   3           HD2      PHE   3  13.067   9.865  -8.042
   24    HE1  PHE   3           HE1      PHE   3  10.462   7.876 -11.707
   25    HE2  PHE   3           HE2      PHE   3  11.500   8.023  -7.578
   26    HZ   PHE   3           HZ       PHE   3  10.197   7.027  -9.412
   27    H    THR   4           H        THR   4  10.407  12.158 -10.402
   28    HA   THR   4           HA       THR   4  10.330  13.418  -7.739
   29    HB   THR   4           HB       THR   4   7.773  13.032  -9.127
   30    HG1  THR   4           HG1      THR   4   9.804  14.762 -10.171
   31   HG21  THR   4          1HG2      THR   4   7.427  15.306  -8.349
   32   HG22  THR   4          2HG2      THR   4   9.127  15.422  -7.891
   33   HG23  THR   4          3HG2      THR   4   8.065  14.291  -7.054
   34    H    VAL   5           H        VAL   5   9.771  12.300  -6.056
   35    HA   VAL   5           HA       VAL   5   8.571   9.623  -6.400
   36    HB   VAL   5           HB       VAL   5   9.513   8.949  -4.417
   37   HG11  VAL   5          1HG1      VAL   5  11.371  11.110  -5.322
   38   HG12  VAL   5          2HG1      VAL   5  11.329   9.432  -5.861
   39   HG13  VAL   5          3HG1      VAL   5  11.792   9.815  -4.203
   40   HG21  VAL   5          1HG2      VAL   5   9.676  11.807  -3.462
   41   HG22  VAL   5          2HG2      VAL   5  10.127  10.375  -2.539
   42   HG23  VAL   5          3HG2      VAL   5   8.444  10.635  -2.993
   43    H    SER   6           H        SER   6   6.759   9.040  -5.194
   44    HA   SER   6           HA       SER   6   4.816  11.120  -5.102
   45    HB2  SER   6          1HB       SER   6   4.553   8.246  -4.186
   46    HB3  SER   6          2HB       SER   6   3.238   9.348  -4.594
   47    HG   SER   6           HG       SER   6   4.550   9.454  -6.718
   48    H    THR   7           H        THR   7   5.389  12.565  -3.483
   49    HA   THR   7           HA       THR   7   5.695  11.694  -0.745
   50    HB   THR   7           HB       THR   7   5.751  14.100  -0.200
   51    HG1  THR   7           HG1      THR   7   5.085  14.355  -2.964
   52   HG21  THR   7          1HG2      THR   7   7.466  13.369  -2.572
   53   HG22  THR   7          2HG2      THR   7   7.815  12.986  -0.887
   54   HG23  THR   7          3HG2      THR   7   7.795  14.665  -1.423
   55    H    THR   8           H        THR   8   4.264  13.378   0.793
   56    HA   THR   8           HA       THR   8   1.699  12.268   0.856
   57    HB   THR   8           HB       THR   8   2.459  14.917   2.088
   58    HG1  THR   8           HG1      THR   8   4.023  13.372   2.679
   59   HG21  THR   8          1HG2      THR   8   0.108  14.403   2.268
   60   HG22  THR   8          2HG2      THR   8   0.865  14.170   3.843
   61   HG23  THR   8          3HG2      THR   8   0.473  12.775   2.837
   62    H    GLU   9           H        GLU   9   2.866  15.322  -0.474
   63    HA   GLU   9           HA       GLU   9   0.475  16.484  -1.260
   64    HB2  GLU   9          1HB       GLU   9   2.538  17.706  -1.426
   65    HB3  GLU   9          2HB       GLU   9   3.195  16.552  -2.575
   66    HG2  GLU   9          1HG       GLU   9   1.390  17.218  -4.154
   67    HG3  GLU   9          2HG       GLU   9   0.942  18.485  -3.014
   68    H    ASP  10           H        ASP  10   2.592  14.346  -3.140
   69    HA   ASP  10           HA       ASP  10   0.958  14.185  -5.418
   70    HB2  ASP  10          1HB       ASP  10   2.901  12.084  -4.432
   71    HB3  ASP  10          2HB       ASP  10   2.318  12.301  -6.080
   72    H    LEU  11           H        LEU  11   1.154  12.271  -2.485
   73    HA   LEU  11           HA       LEU  11  -0.479  10.150  -3.248
   74    HB2  LEU  11          1HB       LEU  11   0.918  10.012  -1.303
   75    HB3  LEU  11          2HB       LEU  11   0.026  11.319  -0.515
   76    HG   LEU  11           HG       LEU  11  -1.974   9.841  -0.496
   77   HD11  LEU  11          1HD1      LEU  11  -0.030   7.729  -1.398
   78   HD12  LEU  11          2HD1      LEU  11  -1.317   8.422  -2.384
   79   HD13  LEU  11          3HD1      LEU  11  -1.718   7.483  -0.946
   80   HD21  LEU  11          1HD2      LEU  11  -1.242   8.492   1.356
   81   HD22  LEU  11          2HD2      LEU  11  -0.425  10.054   1.433
   82   HD23  LEU  11          3HD2      LEU  11   0.439   8.633   0.846
   83    H    GLN  12           H        GLN  12  -1.283  13.339  -2.015
   84    HA   GLN  12           HA       GLN  12  -3.981  12.766  -1.374
   85    HB2  GLN  12          1HB       GLN  12  -2.625  15.375  -2.029
   86    HB3  GLN  12          2HB       GLN  12  -4.292  15.245  -1.482
   87    HG2  GLN  12          1HG       GLN  12  -1.807  14.501   0.040
   88    HG3  GLN  12          2HG       GLN  12  -2.932  15.808   0.396
   89   HE21  GLN  12          1HE2      GLN  12  -2.359  12.392   0.559
   90   HE22  GLN  12          2HE2      GLN  12  -3.692  12.005   1.590
   91    H    ARG  13           H        ARG  13  -2.361  13.808  -4.279
   92    HA   ARG  13           HA       ARG  13  -4.618  14.406  -5.847
   93    HB2  ARG  13          1HB       ARG  13  -2.422  15.087  -6.557
   94    HB3  ARG  13          2HB       ARG  13  -1.865  13.421  -6.598
   95    HG2  ARG  13          1HG       ARG  13  -3.422  12.950  -8.427
   96    HG3  ARG  13          2HG       ARG  13  -3.942  14.644  -8.396
   97    HD2  ARG  13          1HD       ARG  13  -1.742  15.379  -9.011
   98    HD3  ARG  13          2HD       ARG  13  -1.110  13.740  -8.870
   99    HE   ARG  13           HE       ARG  13  -3.245  14.173 -10.802
  100   HH11  ARG  13          1HH1      ARG  13   0.188  13.826 -10.217
  101   HH12  ARG  13          2HH1      ARG  13   0.547  13.358 -11.847
  102   HH21  ARG  13          1HH2      ARG  13  -2.773  13.572 -12.958
  103   HH22  ARG  13          2HH2      ARG  13  -1.136  13.208 -13.403
  104    H    TYR  14           H        TYR  14  -2.656  11.434  -5.684
  105    HA   TYR  14           HA       TYR  14  -4.229   9.963  -7.501
  106    HB2  TYR  14          1HB       TYR  14  -2.533   8.813  -5.283
  107    HB3  TYR  14          2HB       TYR  14  -2.989   8.038  -6.792
  108    HD1  TYR  14           HD1      TYR  14  -2.420   9.956  -8.841
  109    HD2  TYR  14           HD2      TYR  14  -0.240   9.146  -5.279
  110    HE1  TYR  14           HE1      TYR  14  -0.373  10.805  -9.906
  111    HE2  TYR  14           HE2      TYR  14   1.812   9.995  -6.336
  112    HH   TYR  14           HH       TYR  14   2.707  10.298  -8.654
  113    H    ARG  15           H        ARG  15  -4.368  10.319  -4.016
  114    HA   ARG  15           HA       ARG  15  -6.171   8.215  -3.550
  115    HB2  ARG  15          1HB       ARG  15  -5.349   8.677  -1.540
  116    HB3  ARG  15          2HB       ARG  15  -4.852  10.284  -2.030
  117    HG2  ARG  15          1HG       ARG  15  -7.019  11.175  -1.437
  118    HG3  ARG  15          2HG       ARG  15  -7.633   9.546  -1.119
  119    HD2  ARG  15          1HD       ARG  15  -5.955   9.275   0.657
  120    HD3  ARG  15          2HD       ARG  15  -5.382  10.913   0.364
  121    HE   ARG  15           HE       ARG  15  -7.812  11.518   0.970
  122   HH11  ARG  15          1HH1      ARG  15  -6.005   8.833   2.319
  123   HH12  ARG  15          2HH1      ARG  15  -6.753   8.952   3.878
  124   HH21  ARG  15          1HH2      ARG  15  -8.806  11.669   3.025
  125   HH22  ARG  15          2HH2      ARG  15  -8.374  10.546   4.271
  126    H    THR  16           H        THR  16  -6.619  11.648  -4.196
  127    HA   THR  16           HA       THR  16  -9.428  11.705  -3.935
  128    HB   THR  16           HB       THR  16  -7.615  13.369  -5.692
  129    HG1  THR  16           HG1      THR  16  -6.985  13.825  -3.667
  130   HG21  THR  16          1HG2      THR  16 -10.418  13.931  -4.728
  131   HG22  THR  16          2HG2      THR  16  -9.967  13.491  -6.376
  132   HG23  THR  16          3HG2      THR  16  -9.410  15.017  -5.686
  133    H    GLU  17           H        GLU  17  -7.317  11.292  -6.750
  134    HA   GLU  17           HA       GLU  17  -9.136  10.947  -8.757
  135    HB2  GLU  17          1HB       GLU  17  -7.085  10.896  -9.670
  136    HB3  GLU  17          2HB       GLU  17  -6.360  10.191  -8.248
  137    HG2  GLU  17          1HG       GLU  17  -5.969   8.624  -9.902
  138    HG3  GLU  17          2HG       GLU  17  -7.390   7.990  -9.072
  139    H    CYS  18           H        CYS  18  -7.845   8.424  -6.618
  140    HA   CYS  18           HA       CYS  18  -9.394   6.328  -7.710
  141    HB2  CYS  18          1HB       CYS  18  -7.971   6.555  -5.058
  142    HB3  CYS  18          2HB       CYS  18  -8.718   5.073  -5.673
  143    H    VAL  19           H        VAL  19  -9.947   8.560  -5.032
  144    HA   VAL  19           HA       VAL  19 -12.186   7.225  -3.972
  145    HB   VAL  19           HB       VAL  19 -11.180  10.040  -3.748
  146   HG11  VAL  19          1HG1      VAL  19 -13.628  10.199  -3.856
  147   HG12  VAL  19          2HG1      VAL  19 -13.007  10.598  -2.253
  148   HG13  VAL  19          3HG1      VAL  19 -13.753   9.027  -2.543
  149   HG21  VAL  19          1HG2      VAL  19 -11.620   7.776  -1.809
  150   HG22  VAL  19          2HG2      VAL  19 -11.089   9.394  -1.348
  151   HG23  VAL  19          3HG2      VAL  19 -10.076   8.401  -2.396
  152    H    SER  20           H        SER  20 -11.887   9.928  -6.221
  153    HA   SER  20           HA       SER  20 -14.615  10.274  -6.746
  154    HB2  SER  20          1HB       SER  20 -12.782  11.878  -7.308
  155    HB3  SER  20          2HB       SER  20 -12.299  10.805  -8.619
  156    HG   SER  20           HG       SER  20 -14.570  12.426  -8.375
  157    H    SER  21           H        SER  21 -12.270   8.016  -8.122
  158    HA   SER  21           HA       SER  21 -13.969   7.350 -10.359
  159    HB2  SER  21          1HB       SER  21 -11.508   7.333 -10.560
  160    HB3  SER  21          2HB       SER  21 -11.431   6.021  -9.386
  161    HG   SER  21           HG       SER  21 -12.949   5.816 -11.767
  162    H    LEU  22           H        LEU  22 -12.906   5.700  -7.371
  163    HA   LEU  22           HA       LEU  22 -14.473   3.368  -8.030
  164    HB2  LEU  22          1HB       LEU  22 -12.806   4.103  -5.629
  165    HB3  LEU  22          2HB       LEU  22 -13.671   2.571  -5.775
  166    HG   LEU  22           HG       LEU  22 -11.584   3.497  -7.741
  167   HD11  LEU  22          1HD1      LEU  22 -10.571   3.216  -5.546
  168   HD12  LEU  22          2HD1      LEU  22 -10.093   1.901  -6.621
  169   HD13  LEU  22          3HD1      LEU  22 -11.327   1.631  -5.388
  170   HD21  LEU  22          1HD2      LEU  22 -12.787   0.787  -7.223
  171   HD22  LEU  22          2HD2      LEU  22 -11.610   1.205  -8.470
  172   HD23  LEU  22          3HD2      LEU  22 -13.244   1.865  -8.546
  173    H    ASN  23           H        ASN  23 -15.508   6.215  -7.138
  174    HA   ASN  23           HA       ASN  23 -17.281   7.096  -6.011
  175    HB2  ASN  23          1HB       ASN  23 -18.265   4.254  -6.248
  176    HB3  ASN  23          2HB       ASN  23 -19.251   5.605  -5.724
  177   HD21  ASN  23          1HD2      ASN  23 -19.850   7.180  -7.198
  178   HD22  ASN  23          2HD2      ASN  23 -19.738   6.918  -8.909
  179    H    ILE  24           H        ILE  24 -15.066   6.210  -4.411
  180    HA   ILE  24           HA       ILE  24 -15.881   4.885  -2.072
  181    HB   ILE  24           HB       ILE  24 -13.715   6.976  -2.268
  182   HG12  ILE  24          1HG1      ILE  24 -13.449   5.266  -4.044
  183   HG13  ILE  24          2HG1      ILE  24 -12.165   5.183  -2.841
  184   HG21  ILE  24          1HG2      ILE  24 -12.687   5.694  -0.437
  185   HG22  ILE  24          2HG2      ILE  24 -14.095   4.629  -0.411
  186   HG23  ILE  24          3HG2      ILE  24 -14.271   6.335   0.001
  187   HD11  ILE  24          1HD1      ILE  24 -13.259   3.264  -1.808
  188   HD12  ILE  24          2HD1      ILE  24 -12.921   2.973  -3.516
  189   HD13  ILE  24          3HD1      ILE  24 -14.560   3.366  -2.996
  190    HA   PRO  25           HA       PRO  25 -18.487   8.137  -0.400
  191    HB2  PRO  25          1HB       PRO  25 -18.373   6.491   2.024
  192    HB3  PRO  25          2HB       PRO  25 -19.768   6.986   1.065
  193    HG2  PRO  25          1HG       PRO  25 -18.859   4.454   1.094
  194    HG3  PRO  25          2HG       PRO  25 -19.624   5.187  -0.327
  195    HD2  PRO  25          1HD       PRO  25 -16.731   4.664   0.213
  196    HD3  PRO  25          2HD       PRO  25 -17.636   4.576  -1.318
  197    H    ALA  26           H        ALA  26 -18.122   9.855   0.833
  198    HA   ALA  26           HA       ALA  26 -15.541  10.623   1.522
  199    HB1  ALA  26          1HB       ALA  26 -16.577  12.526   2.613
  200    HB2  ALA  26          2HB       ALA  26 -18.130  11.688   2.635
  201    HB3  ALA  26          3HB       ALA  26 -17.407  12.163   1.098
  202    H    ASP  27           H        ASP  27 -18.007   9.034   3.417
  203    HA   ASP  27           HA       ASP  27 -17.061   9.355   5.992
  204    HB2  ASP  27          1HB       ASP  27 -19.172   8.239   5.410
  205    HB3  ASP  27          2HB       ASP  27 -18.269   6.845   4.828
  206    H    TYR  28           H        TYR  28 -16.203   6.750   3.700
  207    HA   TYR  28           HA       TYR  28 -14.264   5.529   5.286
  208    HB2  TYR  28          1HB       TYR  28 -14.793   5.601   2.342
  209    HB3  TYR  28          2HB       TYR  28 -13.338   4.809   2.946
  210    HD1  TYR  28           HD1      TYR  28 -13.470   2.683   4.059
  211    HD2  TYR  28           HD2      TYR  28 -17.018   4.760   2.972
  212    HE1  TYR  28           HE1      TYR  28 -14.789   0.661   4.520
  213    HE2  TYR  28           HE2      TYR  28 -18.346   2.743   3.420
  214    HH   TYR  28           HH       TYR  28 -17.098   0.058   5.085
  215    H    VAL  29           H        VAL  29 -14.057   8.228   3.043
  216    HA   VAL  29           HA       VAL  29 -11.288   8.461   2.827
  217    HB   VAL  29           HB       VAL  29 -13.347  10.658   2.780
  218   HG11  VAL  29          1HG1      VAL  29 -10.514  10.559   1.775
  219   HG12  VAL  29          2HG1      VAL  29 -11.152  11.601   3.048
  220   HG13  VAL  29          3HG1      VAL  29 -11.669  11.833   1.378
  221   HG21  VAL  29          1HG2      VAL  29 -12.195   8.957   0.583
  222   HG22  VAL  29          2HG2      VAL  29 -13.247  10.353   0.339
  223   HG23  VAL  29          3HG2      VAL  29 -13.854   8.925   1.179
  224    H    GLU  30           H        GLU  30 -13.527   9.845   5.215
  225    HA   GLU  30           HA       GLU  30 -11.607  11.322   6.676
  226    HB2  GLU  30          1HB       GLU  30 -14.022  10.092   7.967
  227    HB3  GLU  30          2HB       GLU  30 -13.242  11.634   8.295
  228    HG2  GLU  30          1HG       GLU  30 -13.961  12.387   6.040
  229    HG3  GLU  30          2HG       GLU  30 -14.923  10.919   5.924
  230    H    LYS  31           H        LYS  31 -12.607   7.960   6.817
  231    HA   LYS  31           HA       LYS  31 -11.238   7.268   9.195
  232    HB2  LYS  31          1HB       LYS  31 -11.877   5.520   6.812
  233    HB3  LYS  31          2HB       LYS  31 -11.350   4.950   8.400
  234    HG2  LYS  31          1HG       LYS  31 -13.395   5.971   9.377
  235    HG3  LYS  31          2HG       LYS  31 -13.929   6.356   7.742
  236    HD2  LYS  31          1HD       LYS  31 -13.753   3.924   7.190
  237    HD3  LYS  31          2HD       LYS  31 -13.415   3.618   8.905
  238    HE2  LYS  31          1HE       LYS  31 -15.908   4.981   7.868
  239    HE3  LYS  31          2HE       LYS  31 -15.808   3.270   8.284
  240    HZ1  LYS  31          1HZ       LYS  31 -16.736   4.538  10.095
  241    HZ2  LYS  31          2HZ       LYS  31 -15.385   5.551  10.142
  242    HZ3  LYS  31          3HZ       LYS  31 -15.231   3.917  10.555
  243    H    PHE  32           H        PHE  32 -10.322   6.955   5.779
  244    HA   PHE  32           HA       PHE  32  -7.784   5.873   6.164
  245    HB2  PHE  32          1HB       PHE  32  -8.595   7.709   3.911
  246    HB3  PHE  32          2HB       PHE  32  -7.310   6.511   3.884
  247    HD1  PHE  32           HD1      PHE  32  -9.814   6.907   2.051
  248    HD2  PHE  32           HD2      PHE  32  -8.904   4.317   5.299
  249    HE1  PHE  32           HE1      PHE  32 -11.403   5.250   1.170
  250    HE2  PHE  32           HE2      PHE  32 -10.488   2.658   4.422
  251    HZ   PHE  32           HZ       PHE  32 -11.738   3.119   2.354
  252    H    LYS  33           H        LYS  33  -8.904   9.178   6.201
  253    HA   LYS  33           HA       LYS  33  -6.417  10.497   6.075
  254    HB2  LYS  33          1HB       LYS  33  -8.875  11.406   5.928
  255    HB3  LYS  33          2HB       LYS  33  -8.711  11.570   7.673
  256    HG2  LYS  33          1HG       LYS  33  -6.771  12.996   7.392
  257    HG3  LYS  33          2HG       LYS  33  -6.876  12.813   5.634
  258    HD2  LYS  33          1HD       LYS  33  -9.104  13.858   5.681
  259    HD3  LYS  33          2HD       LYS  33  -8.961  14.067   7.426
  260    HE2  LYS  33          1HE       LYS  33  -8.411  16.137   6.307
  261    HE3  LYS  33          2HE       LYS  33  -6.969  15.470   7.070
  262    HZ1  LYS  33          1HZ       LYS  33  -6.513  16.281   4.840
  263    HZ2  LYS  33          2HZ       LYS  33  -7.661  15.226   4.196
  264    HZ3  LYS  33          3HZ       LYS  33  -6.272  14.612   4.932
  265    H    LYS  34           H        LYS  34  -8.077   8.849   8.646
  266    HA   LYS  34           HA       LYS  34  -6.197   9.885  10.633
  267    HB2  LYS  34          1HB       LYS  34  -8.701   8.215  10.929
  268    HB3  LYS  34          2HB       LYS  34  -7.666   8.672  12.276
  269    HG2  LYS  34          1HG       LYS  34  -8.132  11.029  11.825
  270    HG3  LYS  34          2HG       LYS  34  -9.163  10.563  10.469
  271    HD2  LYS  34          1HD       LYS  34 -10.599   9.307  12.032
  272    HD3  LYS  34          2HD       LYS  34  -9.592   9.858  13.371
  273    HE2  LYS  34          1HE       LYS  34 -11.578  11.233  13.207
  274    HE3  LYS  34          2HE       LYS  34 -10.150  12.187  12.807
  275    HZ1  LYS  34          1HZ       LYS  34 -12.019  12.575  11.288
  276    HZ2  LYS  34          2HZ       LYS  34 -11.969  10.954  10.814
  277    HZ3  LYS  34          3HZ       LYS  34 -10.660  11.970  10.483
  278    H    TRP  35           H        TRP  35  -5.906   7.743   8.411
  279    HA   TRP  35           HA       TRP  35  -4.794   5.822   8.030
  280    HB2  TRP  35          1HB       TRP  35  -3.691   6.426  10.773
  281    HB3  TRP  35          2HB       TRP  35  -3.096   5.110   9.749
  282    HD1  TRP  35           HD1      TRP  35  -2.955   8.878  10.179
  283    HE1  TRP  35           HE1      TRP  35  -1.209   9.853   8.558
  284    HE3  TRP  35           HE3      TRP  35  -2.015   4.698   7.384
  285    HZ2  TRP  35           HZ2      TRP  35   0.355   8.969   6.389
  286    HZ3  TRP  35           HZ3      TRP  35  -0.383   4.847   5.558
  287    HH2  TRP  35           HH2      TRP  35   0.784   6.933   5.065
  288    H    GLU  36           H        GLU  36  -7.372   5.485   8.736
  289    HA   GLU  36           HA       GLU  36  -7.288   2.946  10.219
  290    HB2  GLU  36          1HB       GLU  36  -9.529   4.959  10.059
  291    HB3  GLU  36          2HB       GLU  36  -9.695   3.350  10.746
  292    HG2  GLU  36          1HG       GLU  36  -8.020   3.911  12.433
  293    HG3  GLU  36          2HG       GLU  36  -7.881   5.522  11.737
  294    H    PHE  37           H        PHE  37  -7.367   1.363   8.810
  295    HA   PHE  37           HA       PHE  37  -9.081   1.667   6.429
  296    HB2  PHE  37          1HB       PHE  37  -6.652  -0.125   6.725
  297    HB3  PHE  37          2HB       PHE  37  -7.570   0.155   5.252
  298    HD1  PHE  37           HD1      PHE  37  -7.122   2.047   3.870
  299    HD2  PHE  37           HD2      PHE  37  -5.296   1.710   7.703
  300    HE1  PHE  37           HE1      PHE  37  -5.634   3.931   3.328
  301    HE2  PHE  37           HE2      PHE  37  -3.801   3.583   7.159
  302    HZ   PHE  37           HZ       PHE  37  -3.970   4.697   4.972
  303    HA   PRO  38           HA       PRO  38 -11.241  -1.627   8.813
  304    HB2  PRO  38          1HB       PRO  38 -13.360  -0.877   6.896
  305    HB3  PRO  38          2HB       PRO  38 -13.424  -1.015   8.662
  306    HG2  PRO  38          1HG       PRO  38 -13.475   1.374   7.493
  307    HG3  PRO  38          2HG       PRO  38 -12.563   1.109   8.989
  308    HD2  PRO  38          1HD       PRO  38 -11.539   1.241   6.164
  309    HD3  PRO  38          2HD       PRO  38 -10.876   1.993   7.649
  310    H    GLU  39           H        GLU  39 -11.826  -3.685   8.233
  311    HA   GLU  39           HA       GLU  39 -10.820  -4.630   5.725
  312    HB2  GLU  39          1HB       GLU  39 -10.550  -5.929   7.798
  313    HB3  GLU  39          2HB       GLU  39 -12.293  -6.134   7.891
  314    HG2  GLU  39          1HG       GLU  39 -12.305  -7.436   5.879
  315    HG3  GLU  39          2HG       GLU  39 -10.594  -7.110   5.607
  316    H    ASP  40           H        ASP  40 -12.087  -3.663   4.206
  317    HA   ASP  40           HA       ASP  40 -14.652  -4.924   3.683
  318    HB2  ASP  40          1HB       ASP  40 -15.300  -2.953   5.032
  319    HB3  ASP  40          2HB       ASP  40 -14.407  -1.904   3.933
  320    H    ASP  41           H        ASP  41 -15.233  -4.802   1.499
  321    HA   ASP  41           HA       ASP  41 -13.018  -4.962  -0.224
  322    HB2  ASP  41          1HB       ASP  41 -14.612  -5.350  -2.023
  323    HB3  ASP  41          2HB       ASP  41 -15.075  -6.266  -0.594
  324    H    THR  42           H        THR  42 -15.148  -2.320   0.533
  325    HA   THR  42           HA       THR  42 -14.643  -0.650  -1.678
  326    HB   THR  42           HB       THR  42 -15.069   0.258   1.167
  327    HG1  THR  42           HG1      THR  42 -16.724  -1.137   0.836
  328   HG21  THR  42          1HG2      THR  42 -14.549   2.053  -0.349
  329   HG22  THR  42          2HG2      THR  42 -16.268   2.118   0.043
  330   HG23  THR  42          3HG2      THR  42 -15.739   1.468  -1.510
  331    H    THR  43           H        THR  43 -13.164  -0.633   1.557
  332    HA   THR  43           HA       THR  43 -11.100   1.165   1.114
  333    HB   THR  43           HB       THR  43 -11.010  -1.274   2.897
  334    HG1  THR  43           HG1      THR  43 -11.757   0.468   4.457
  335   HG21  THR  43          1HG2      THR  43  -9.581   0.227   4.316
  336   HG22  THR  43          2HG2      THR  43  -9.551   1.364   2.965
  337   HG23  THR  43          3HG2      THR  43  -8.853  -0.243   2.778
  338    H    MET  44           H        MET  44 -11.307  -2.260   0.398
  339    HA   MET  44           HA       MET  44  -8.545  -2.711   0.041
  340    HB2  MET  44          1HB       MET  44 -10.917  -4.242  -1.010
  341    HB3  MET  44          2HB       MET  44  -9.259  -4.828  -1.028
  342    HG2  MET  44          1HG       MET  44  -9.199  -4.774   1.396
  343    HG3  MET  44          2HG       MET  44 -10.831  -4.113   1.435
  344    HE1  MET  44          1HE       MET  44 -11.365  -7.691   2.830
  345    HE2  MET  44          2HE       MET  44 -11.600  -5.963   3.091
  346    HE3  MET  44          3HE       MET  44  -9.971  -6.645   3.101
  347    H    CYS  45           H        CYS  45 -11.163  -2.222  -2.326
  348    HA   CYS  45           HA       CYS  45  -9.463  -2.301  -4.582
  349    HB2  CYS  45          1HB       CYS  45 -12.185  -1.020  -4.254
  350    HB3  CYS  45          2HB       CYS  45 -11.369  -1.262  -5.793
  351    H    TYR  46           H        TYR  46 -10.413   0.247  -2.387
  352    HA   TYR  46           HA       TYR  46  -9.504   2.454  -3.822
  353    HB2  TYR  46          1HB       TYR  46 -10.756   2.912  -1.896
  354    HB3  TYR  46          2HB       TYR  46  -9.768   1.859  -0.884
  355    HD1  TYR  46           HD1      TYR  46  -9.467   4.977  -2.942
  356    HD2  TYR  46           HD2      TYR  46  -8.238   2.850   0.537
  357    HE1  TYR  46           HE1      TYR  46  -8.174   6.933  -2.201
  358    HE2  TYR  46           HE2      TYR  46  -6.945   4.802   1.280
  359    HH   TYR  46           HH       TYR  46  -5.976   6.813   0.466
  360    H    ILE  47           H        ILE  47  -7.805   0.384  -1.494
  361    HA   ILE  47           HA       ILE  47  -5.303   1.614  -1.670
  362    HB   ILE  47           HB       ILE  47  -6.023  -1.231  -0.998
  363   HG12  ILE  47          1HG1      ILE  47  -6.929   0.400   0.568
  364   HG13  ILE  47          2HG1      ILE  47  -5.614  -0.483   1.339
  365   HG21  ILE  47          1HG2      ILE  47  -3.735  -1.221  -1.743
  366   HG22  ILE  47          2HG2      ILE  47  -3.767  -1.388   0.014
  367   HG23  ILE  47          3HG2      ILE  47  -3.368   0.166  -0.717
  368   HD11  ILE  47          1HD1      ILE  47  -5.412   1.801   1.948
  369   HD12  ILE  47          2HD1      ILE  47  -5.570   2.333   0.276
  370   HD13  ILE  47          3HD1      ILE  47  -4.123   1.464   0.792
  371    H    LYS  48           H        LYS  48  -6.789  -0.933  -3.600
  372    HA   LYS  48           HA       LYS  48  -4.560  -1.751  -5.061
  373    HB2  LYS  48          1HB       LYS  48  -6.907  -2.772  -5.004
  374    HB3  LYS  48          2HB       LYS  48  -7.357  -1.564  -6.193
  375    HG2  LYS  48          1HG       LYS  48  -5.183  -3.620  -6.558
  376    HG3  LYS  48          2HG       LYS  48  -6.831  -3.788  -7.154
  377    HD2  LYS  48          1HD       LYS  48  -4.928  -1.583  -7.955
  378    HD3  LYS  48          2HD       LYS  48  -5.197  -3.056  -8.883
  379    HE2  LYS  48          1HE       LYS  48  -7.394  -1.124  -8.165
  380    HE3  LYS  48          2HE       LYS  48  -6.466  -1.020  -9.656
  381    HZ1  LYS  48          1HZ       LYS  48  -8.580  -2.204  -9.924
  382    HZ2  LYS  48          2HZ       LYS  48  -8.065  -3.380  -8.829
  383    HZ3  LYS  48          3HZ       LYS  48  -7.253  -3.179 -10.299
  384    H    CYS  49           H        CYS  49  -7.071   0.611  -5.951
  385    HA   CYS  49           HA       CYS  49  -5.936   1.499  -8.315
  386    HB2  CYS  49          1HB       CYS  49  -8.171   2.086  -7.860
  387    HB3  CYS  49          2HB       CYS  49  -7.751   2.896  -6.351
  388    H    VAL  50           H        VAL  50  -5.495   2.819  -5.026
  389    HA   VAL  50           HA       VAL  50  -3.988   5.046  -5.766
  390    HB   VAL  50           HB       VAL  50  -4.048   3.519  -3.170
  391   HG11  VAL  50          1HG1      VAL  50  -1.982   4.762  -3.261
  392   HG12  VAL  50          2HG1      VAL  50  -3.107   5.574  -2.168
  393   HG13  VAL  50          3HG1      VAL  50  -2.840   6.209  -3.791
  394   HG21  VAL  50          1HG2      VAL  50  -5.445   5.983  -4.148
  395   HG22  VAL  50          2HG2      VAL  50  -5.430   5.465  -2.462
  396   HG23  VAL  50          3HG2      VAL  50  -6.172   4.442  -3.695
  397    H    PHE  51           H        PHE  51  -2.974   1.847  -4.651
  398    HA   PHE  51           HA       PHE  51  -0.220   2.355  -4.683
  399    HB2  PHE  51          1HB       PHE  51  -1.954  -0.059  -4.547
  400    HB3  PHE  51          2HB       PHE  51  -0.256  -0.302  -4.947
  401    HD1  PHE  51           HD1      PHE  51  -1.388   2.399  -2.730
  402    HD2  PHE  51           HD2      PHE  51   0.206  -1.542  -2.948
  403    HE1  PHE  51           HE1      PHE  51  -0.852   2.485  -0.331
  404    HE2  PHE  51           HE2      PHE  51   0.741  -1.460  -0.551
  405    HZ   PHE  51           HZ       PHE  51   0.215   0.555   0.761
  406    H    ASN  52           H        ASN  52  -2.482   1.480  -7.142
  407    HA   ASN  52           HA       ASN  52  -0.541   0.578  -9.061
  408    HB2  ASN  52          1HB       ASN  52  -2.872  -0.227  -9.087
  409    HB3  ASN  52          2HB       ASN  52  -3.435   1.411  -9.426
  410   HD21  ASN  52          1HD2      ASN  52  -0.567  -0.073 -10.839
  411   HD22  ASN  52          2HD2      ASN  52  -1.179  -0.117 -12.455
  412    H    LYS  53           H        LYS  53  -2.358   3.543  -8.464
  413    HA   LYS  53           HA       LYS  53  -1.478   4.917 -10.781
  414    HB2  LYS  53          1HB       LYS  53  -2.647   5.873  -8.174
  415    HB3  LYS  53          2HB       LYS  53  -2.345   6.943  -9.535
  416    HG2  LYS  53          1HG       LYS  53  -4.145   4.524  -9.607
  417    HG3  LYS  53          2HG       LYS  53  -4.705   6.169  -9.319
  418    HD2  LYS  53          1HD       LYS  53  -4.144   6.847 -11.508
  419    HD3  LYS  53          2HD       LYS  53  -3.159   5.407 -11.787
  420    HE2  LYS  53          1HE       LYS  53  -5.340   5.313 -12.946
  421    HE3  LYS  53          2HE       LYS  53  -5.130   4.010 -11.779
  422    HZ1  LYS  53          1HZ       LYS  53  -6.763   6.470 -11.437
  423    HZ2  LYS  53          2HZ       LYS  53  -6.451   5.354 -10.197
  424    HZ3  LYS  53          3HZ       LYS  53  -7.318   4.872 -11.563
  425    H    MET  54           H        MET  54  -0.225   4.505  -7.569
  426    HA   MET  54           HA       MET  54   1.762   6.583  -7.792
  427    HB2  MET  54          1HB       MET  54   1.143   4.478  -5.736
  428    HB3  MET  54          2HB       MET  54   2.581   5.490  -5.620
  429    HG2  MET  54          1HG       MET  54   1.302   7.437  -5.397
  430    HG3  MET  54          2HG       MET  54  -0.178   6.622  -5.895
  431    HE1  MET  54          1HE       MET  54   1.805   6.467  -1.762
  432    HE2  MET  54          2HE       MET  54   2.249   7.516  -3.108
  433    HE3  MET  54          3HE       MET  54   2.668   5.804  -3.151
  434    H    GLN  55           H        GLN  55   1.526   3.812  -9.358
  435    HA   GLN  55           HA       GLN  55   2.887   2.327 -10.333
  436    HB2  GLN  55          1HB       GLN  55   4.647   4.695  -9.947
  437    HB3  GLN  55          2HB       GLN  55   5.348   3.207 -10.599
  438    HG2  GLN  55          1HG       GLN  55   3.743   3.250 -12.417
  439    HG3  GLN  55          2HG       GLN  55   2.977   4.674 -11.725
  440   HE21  GLN  55          1HE2      GLN  55   5.721   3.454 -13.457
  441   HE22  GLN  55          2HE2      GLN  55   6.357   4.990 -13.939
  442    H    LEU  56           H        LEU  56   2.405   1.768  -7.714
  443    HA   LEU  56           HA       LEU  56   4.979   0.845  -6.677
  444    HB2  LEU  56          1HB       LEU  56   2.725   2.233  -5.416
  445    HB3  LEU  56          2HB       LEU  56   3.292   0.836  -4.492
  446    HG   LEU  56           HG       LEU  56   4.954   3.193  -5.386
  447   HD11  LEU  56          1HD1      LEU  56   3.939   2.422  -2.654
  448   HD12  LEU  56          2HD1      LEU  56   3.372   3.780  -3.623
  449   HD13  LEU  56          3HD1      LEU  56   5.025   3.763  -3.010
  450   HD21  LEU  56          1HD2      LEU  56   6.342   1.248  -5.288
  451   HD22  LEU  56          2HD2      LEU  56   5.633   0.763  -3.749
  452   HD23  LEU  56          3HD2      LEU  56   6.639   2.208  -3.841
  453    H    PHE  57           H        PHE  57   1.922  -0.013  -7.816
  454    HA   PHE  57           HA       PHE  57   2.414  -2.822  -7.256
  455    HB2  PHE  57          1HB       PHE  57   0.955  -2.195  -5.409
  456    HB3  PHE  57          2HB       PHE  57  -0.156  -1.397  -6.511
  457    HD1  PHE  57           HD1      PHE  57   1.096  -4.645  -5.341
  458    HD2  PHE  57           HD2      PHE  57  -1.789  -2.627  -7.734
  459    HE1  PHE  57           HE1      PHE  57  -0.201  -6.726  -5.529
  460    HE2  PHE  57           HE2      PHE  57  -3.089  -4.706  -7.927
  461    HZ   PHE  57           HZ       PHE  57  -2.293  -6.757  -6.821
  462    H    ASP  58           H        ASP  58   1.802  -4.102  -8.890
  463    HA   ASP  58           HA       ASP  58   0.263  -2.905 -11.098
  464    HB2  ASP  58          1HB       ASP  58   2.636  -3.038 -11.717
  465    HB3  ASP  58          2HB       ASP  58   2.672  -4.740 -11.277
  466    H    ASP  59           H        ASP  59  -1.142  -4.348 -12.209
  467    HA   ASP  59           HA       ASP  59  -2.242  -6.333 -10.459
  468    HB2  ASP  59          1HB       ASP  59  -3.977  -6.602 -12.156
  469    HB3  ASP  59          2HB       ASP  59  -3.698  -4.908 -11.816
  470    H    THR  60           H        THR  60   0.146  -6.410 -12.834
  471    HA   THR  60           HA       THR  60  -0.227  -9.270 -13.300
  472    HB   THR  60           HB       THR  60   1.588  -7.236 -14.584
  473    HG1  THR  60           HG1      THR  60  -0.338  -7.076 -15.549
  474   HG21  THR  60          1HG2      THR  60   2.325  -9.031 -16.085
  475   HG22  THR  60          2HG2      THR  60   1.432 -10.201 -15.115
  476   HG23  THR  60          3HG2      THR  60   2.801  -9.333 -14.415
  477    H    GLU  61           H        GLU  61   2.574  -7.144 -12.628
  478    HA   GLU  61           HA       GLU  61   4.137  -9.296 -11.598
  479    HB2  GLU  61          1HB       GLU  61   4.757  -6.402 -11.140
  480    HB3  GLU  61          2HB       GLU  61   5.857  -7.749 -11.366
  481    HG2  GLU  61          1HG       GLU  61   5.227  -7.899 -13.701
  482    HG3  GLU  61          2HG       GLU  61   4.093  -6.570 -13.486
  483    H    GLY  62           H        GLY  62   1.778  -7.292 -10.181
  484    HA2  GLY  62          1HA       GLY  62   1.020  -7.218  -7.994
  485    HA3  GLY  62          2HA       GLY  62   2.327  -8.317  -7.546
  486    HA   PRO  63           HA       PRO  63   3.405  -4.342  -5.554
  487    HB2  PRO  63          1HB       PRO  63   5.045  -5.532  -3.678
  488    HB3  PRO  63          2HB       PRO  63   3.308  -5.257  -3.474
  489    HG2  PRO  63          1HG       PRO  63   4.773  -7.731  -4.224
  490    HG3  PRO  63          2HG       PRO  63   3.330  -7.544  -3.222
  491    HD2  PRO  63          1HD       PRO  63   3.286  -8.415  -5.789
  492    HD3  PRO  63          2HD       PRO  63   1.928  -7.543  -5.045
  493    H    LEU  64           H        LEU  64   4.872  -3.146  -6.512
  494    HA   LEU  64           HA       LEU  64   7.112  -4.336  -7.898
  495    HB2  LEU  64          1HB       LEU  64   6.450  -1.402  -7.618
  496    HB3  LEU  64          2HB       LEU  64   7.491  -2.147  -8.814
  497    HG   LEU  64           HG       LEU  64   4.519  -2.625  -8.627
  498   HD11  LEU  64          1HD1      LEU  64   6.088  -0.936 -10.568
  499   HD12  LEU  64          2HD1      LEU  64   5.011  -0.331  -9.308
  500   HD13  LEU  64          3HD1      LEU  64   4.360  -1.275 -10.647
  501   HD21  LEU  64          1HD2      LEU  64   5.817  -4.490  -9.548
  502   HD22  LEU  64          2HD2      LEU  64   6.513  -3.396 -10.745
  503   HD23  LEU  64          3HD2      LEU  64   4.778  -3.728 -10.757
  504    H    VAL  65           H        VAL  65   8.525  -5.069  -6.468
  505    HA   VAL  65           HA       VAL  65   9.146  -4.114  -3.977
  506    HB   VAL  65           HB       VAL  65  10.871  -5.677  -5.879
  507   HG11  VAL  65          1HG1      VAL  65  12.166  -6.363  -3.917
  508   HG12  VAL  65          2HG1      VAL  65  11.238  -5.249  -2.914
  509   HG13  VAL  65          3HG1      VAL  65  12.283  -4.625  -4.193
  510   HG21  VAL  65          1HG2      VAL  65   9.056  -6.468  -3.616
  511   HG22  VAL  65          2HG2      VAL  65  10.136  -7.573  -4.466
  512   HG23  VAL  65          3HG2      VAL  65   8.818  -6.790  -5.333
  513    H    ASP  66           H        ASP  66  10.781  -3.293  -7.038
  514    HA   ASP  66           HA       ASP  66  12.961  -1.952  -5.916
  515    HB2  ASP  66          1HB       ASP  66  12.909  -2.602  -8.252
  516    HB3  ASP  66          2HB       ASP  66  11.610  -1.458  -8.570
  517    H    ASN  67           H        ASN  67   9.905  -0.572  -7.141
  518    HA   ASN  67           HA       ASN  67  10.517   2.066  -6.306
  519    HB2  ASN  67          1HB       ASN  67   7.929   0.737  -7.077
  520    HB3  ASN  67          2HB       ASN  67   8.023   2.432  -6.608
  521   HD21  ASN  67          1HD2      ASN  67   7.172   1.449  -9.138
  522   HD22  ASN  67          2HD2      ASN  67   8.297   2.030 -10.323
  523    H    LEU  68           H        LEU  68   8.933  -0.656  -4.813
  524    HA   LEU  68           HA       LEU  68   7.776   0.631  -2.618
  525    HB2  LEU  68          1HB       LEU  68   8.699  -2.158  -3.156
  526    HB3  LEU  68          2HB       LEU  68   8.213  -1.709  -1.530
  527    HG   LEU  68           HG       LEU  68   6.425  -1.264  -3.907
  528   HD11  LEU  68          1HD1      LEU  68   5.319  -3.348  -3.388
  529   HD12  LEU  68          2HD1      LEU  68   6.447  -3.651  -2.066
  530   HD13  LEU  68          3HD1      LEU  68   7.021  -3.659  -3.732
  531   HD21  LEU  68          1HD2      LEU  68   5.918  -0.005  -1.877
  532   HD22  LEU  68          2HD2      LEU  68   5.890  -1.507  -0.952
  533   HD23  LEU  68          3HD2      LEU  68   4.683  -1.219  -2.205
  534    H    VAL  69           H        VAL  69  10.975  -0.825  -3.000
  535    HA   VAL  69           HA       VAL  69  11.909  -0.156  -0.403
  536    HB   VAL  69           HB       VAL  69  13.445  -0.751  -2.926
  537   HG11  VAL  69          1HG1      VAL  69  14.855   0.397  -1.357
  538   HG12  VAL  69          2HG1      VAL  69  15.280  -1.315  -1.358
  539   HG13  VAL  69          3HG1      VAL  69  14.305  -0.645  -0.046
  540   HG21  VAL  69          1HG2      VAL  69  11.928  -2.545  -2.197
  541   HG22  VAL  69          2HG2      VAL  69  12.716  -2.540  -0.618
  542   HG23  VAL  69          3HG2      VAL  69  13.626  -3.000  -2.059
  543    H    HIS  70           H        HIS  70  12.136   1.419  -3.568
  544    HA   HIS  70           HA       HIS  70  13.908   3.464  -2.796
  545    HB2  HIS  70          1HB       HIS  70  13.375   2.841  -5.150
  546    HB3  HIS  70          2HB       HIS  70  11.789   3.579  -4.949
  547    HD1  HIS  70           HD1      HIS  70  11.680   5.893  -5.817
  548    HD2  HIS  70           HD2      HIS  70  15.509   4.903  -4.529
  549    HE1  HIS  70           HE1      HIS  70  13.103   7.914  -6.292
  550    HE2  HIS  70           HE2      HIS  70  15.435   7.241  -5.631
  551    H    GLN  71           H        GLN  71  10.489   3.063  -2.383
  552    HA   GLN  71           HA       GLN  71  10.096   5.847  -1.608
  553    HB2  GLN  71          1HB       GLN  71   8.423   4.263  -2.900
  554    HB3  GLN  71          2HB       GLN  71   8.008   3.732  -1.273
  555    HG2  GLN  71          1HG       GLN  71   6.483   5.455  -1.973
  556    HG3  GLN  71          2HG       GLN  71   7.490   6.042  -0.650
  557   HE21  GLN  71          1HE2      GLN  71   7.221   8.195  -1.162
  558   HE22  GLN  71          2HE2      GLN  71   7.922   8.914  -2.563
  559    H    LEU  72           H        LEU  72   9.508   2.666  -0.125
  560    HA   LEU  72           HA       LEU  72   8.868   3.690   2.392
  561    HB2  LEU  72          1HB       LEU  72   9.760   0.943   1.558
  562    HB3  LEU  72          2HB       LEU  72   9.269   1.334   3.194
  563    HG   LEU  72           HG       LEU  72   7.517   1.649   0.759
  564   HD11  LEU  72          1HD1      LEU  72   6.319  -0.310   1.626
  565   HD12  LEU  72          2HD1      LEU  72   7.532  -0.482   2.897
  566   HD13  LEU  72          3HD1      LEU  72   7.988  -0.702   1.208
  567   HD21  LEU  72          1HD2      LEU  72   5.725   1.811   2.507
  568   HD22  LEU  72          2HD2      LEU  72   6.822   3.187   2.431
  569   HD23  LEU  72          3HD2      LEU  72   7.007   1.982   3.707
  570    H    ALA  73           H        ALA  73  11.956   2.371   1.198
  571    HA   ALA  73           HA       ALA  73  13.272   2.621   3.713
  572    HB1  ALA  73          1HB       ALA  73  13.947   1.024   1.980
  573    HB2  ALA  73          2HB       ALA  73  15.280   2.048   2.520
  574    HB3  ALA  73          3HB       ALA  73  14.487   2.369   0.978
  575    H    HIS  74           H        HIS  74  11.987   5.035   2.905
  576    HA   HIS  74           HA       HIS  74  13.930   6.942   2.010
  577    HB2  HIS  74          1HB       HIS  74  11.426   7.135   1.694
  578    HB3  HIS  74          2HB       HIS  74  11.294   7.448   3.423
  579    HD1  HIS  74           HD1      HIS  74  11.340   9.822   4.069
  580    HD2  HIS  74           HD2      HIS  74  13.044   9.205   0.331
  581    HE1  HIS  74           HE1      HIS  74  11.853  12.110   3.175
  582    HE2  HIS  74           HE2      HIS  74  12.663  11.714   0.820
  583    H    GLY  75           H        GLY  75  15.643   6.532   3.482
  584    HA2  GLY  75          1HA       GLY  75  16.809   7.627   5.261
  585    HA3  GLY  75          2HA       GLY  75  15.273   7.837   6.092
  586    H    ARG  76           H        ARG  76  16.143   4.807   4.605
  587    HA   ARG  76           HA       ARG  76  17.191   3.667   7.052
  588    HB2  ARG  76          1HB       ARG  76  14.423   3.209   6.164
  589    HB3  ARG  76          2HB       ARG  76  15.323   1.745   6.528
  590    HG2  ARG  76          1HG       ARG  76  15.898   2.790   8.744
  591    HG3  ARG  76          2HG       ARG  76  14.718   4.047   8.366
  592    HD2  ARG  76          1HD       ARG  76  13.741   2.287   9.755
  593    HD3  ARG  76          2HD       ARG  76  12.974   2.361   8.173
  594    HE   ARG  76           HE       ARG  76  15.130   0.439   8.470
  595   HH11  ARG  76          1HH1      ARG  76  11.675   0.993   8.529
  596   HH12  ARG  76          2HH1      ARG  76  11.282  -0.668   8.227
  597   HH21  ARG  76          1HH2      ARG  76  14.608  -1.751   8.109
  598   HH22  ARG  76          2HH2      ARG  76  12.930  -2.227   7.975
  599    H    ASP  77           H        ASP  77  17.661   1.257   6.679
  600    HA   ASP  77           HA       ASP  77  19.249   1.054   4.350
  601    HB2  ASP  77          1HB       ASP  77  19.882  -0.085   6.401
  602    HB3  ASP  77          2HB       ASP  77  18.435  -1.086   6.320
  603    H    ALA  78           H        ALA  78  18.655   0.638   2.421
  604    HA   ALA  78           HA       ALA  78  16.045   0.023   1.625
  605    HB1  ALA  78          1HB       ALA  78  17.654   1.258   0.270
  606    HB2  ALA  78          2HB       ALA  78  16.966  -0.104  -0.611
  607    HB3  ALA  78          3HB       ALA  78  18.596  -0.215   0.052
  608    H    GLU  79           H        GLU  79  18.826  -2.045   2.137
  609    HA   GLU  79           HA       GLU  79  17.839  -4.292   0.710
  610    HB2  GLU  79          1HB       GLU  79  19.918  -4.063   2.881
  611    HB3  GLU  79          2HB       GLU  79  19.592  -5.540   1.985
  612    HG2  GLU  79          1HG       GLU  79  20.217  -4.439  -0.084
  613    HG3  GLU  79          2HG       GLU  79  20.507  -2.937   0.783
  614    H    GLU  80           H        GLU  80  17.839  -3.391   4.128
  615    HA   GLU  80           HA       GLU  80  16.491  -5.655   5.115
  616    HB2  GLU  80          1HB       GLU  80  17.691  -4.121   6.554
  617    HB3  GLU  80          2HB       GLU  80  16.603  -2.814   6.122
  618    HG2  GLU  80          1HG       GLU  80  14.773  -3.931   7.215
  619    HG3  GLU  80          2HG       GLU  80  15.799  -5.310   7.580
  620    H    VAL  81           H        VAL  81  15.293  -2.457   4.131
  621    HA   VAL  81           HA       VAL  81  12.584  -2.830   4.579
  622    HB   VAL  81           HB       VAL  81  14.015  -1.167   2.522
  623   HG11  VAL  81          1HG1      VAL  81  11.089  -1.131   3.266
  624   HG12  VAL  81          2HG1      VAL  81  11.762  -1.562   1.693
  625   HG13  VAL  81          3HG1      VAL  81  11.902   0.092   2.288
  626   HG21  VAL  81          1HG2      VAL  81  13.427   0.637   4.085
  627   HG22  VAL  81          2HG2      VAL  81  14.471  -0.588   4.800
  628   HG23  VAL  81          3HG2      VAL  81  12.748  -0.567   5.179
  629    H    ARG  82           H        ARG  82  14.455  -3.501   1.628
  630    HA   ARG  82           HA       ARG  82  12.514  -4.474  -0.051
  631    HB2  ARG  82          1HB       ARG  82  14.905  -4.194  -0.618
  632    HB3  ARG  82          2HB       ARG  82  15.286  -5.602   0.359
  633    HG2  ARG  82          1HG       ARG  82  13.456  -6.686  -1.265
  634    HG3  ARG  82          2HG       ARG  82  14.104  -5.434  -2.331
  635    HD2  ARG  82          1HD       ARG  82  15.338  -7.513  -2.589
  636    HD3  ARG  82          2HD       ARG  82  16.362  -6.247  -1.904
  637    HE   ARG  82           HE       ARG  82  15.298  -7.602   0.245
  638   HH11  ARG  82          1HH1      ARG  82  17.353  -8.361  -2.472
  639   HH12  ARG  82          2HH1      ARG  82  18.162  -9.662  -1.661
  640   HH21  ARG  82          1HH2      ARG  82  16.346  -9.297   1.329
  641   HH22  ARG  82          2HH2      ARG  82  17.587 -10.197   0.514
  642    H    THR  83           H        THR  83  14.298  -6.220   2.457
  643    HA   THR  83           HA       THR  83  13.223  -8.762   1.929
  644    HB   THR  83           HB       THR  83  14.608  -7.525   4.280
  645    HG1  THR  83           HG1      THR  83  16.249  -8.927   3.615
  646   HG21  THR  83          1HG2      THR  83  13.599 -10.370   4.137
  647   HG22  THR  83          2HG2      THR  83  13.038  -9.121   5.251
  648   HG23  THR  83          3HG2      THR  83  14.691  -9.726   5.364
  649    H    GLU  84           H        GLU  84  12.364  -6.320   4.378
  650    HA   GLU  84           HA       GLU  84  10.258  -7.660   5.584
  651    HB2  GLU  84          1HB       GLU  84  10.420  -4.683   5.114
  652    HB3  GLU  84          2HB       GLU  84   9.484  -5.502   6.353
  653    HG2  GLU  84          1HG       GLU  84  11.752  -6.426   7.129
  654    HG3  GLU  84          2HG       GLU  84  12.435  -5.116   6.171
  655    H    VAL  85           H        VAL  85  10.185  -5.531   2.728
  656    HA   VAL  85           HA       VAL  85   7.444  -5.622   2.216
  657    HB   VAL  85           HB       VAL  85   9.819  -5.338   0.381
  658   HG11  VAL  85          1HG1      VAL  85   8.258  -4.677  -1.398
  659   HG12  VAL  85          2HG1      VAL  85   6.902  -5.135  -0.364
  660   HG13  VAL  85          3HG1      VAL  85   8.038  -6.364  -0.922
  661   HG21  VAL  85          1HG2      VAL  85   9.405  -3.494   1.890
  662   HG22  VAL  85          2HG2      VAL  85   7.723  -3.408   1.360
  663   HG23  VAL  85          3HG2      VAL  85   9.025  -3.019   0.234
  664    H    LEU  86           H        LEU  86  10.035  -7.751   1.019
  665    HA   LEU  86           HA       LEU  86   8.479  -9.378  -0.613
  666    HB2  LEU  86          1HB       LEU  86  11.030  -9.961   0.882
  667    HB3  LEU  86          2HB       LEU  86  10.315 -11.064  -0.292
  668    HG   LEU  86           HG       LEU  86  11.083  -8.238  -0.978
  669   HD11  LEU  86          1HD1      LEU  86  12.713 -10.740  -1.383
  670   HD12  LEU  86          2HD1      LEU  86  13.042  -9.503  -0.171
  671   HD13  LEU  86          3HD1      LEU  86  13.142  -9.102  -1.884
  672   HD21  LEU  86          1HD2      LEU  86   9.510  -9.211  -2.499
  673   HD22  LEU  86          2HD2      LEU  86  10.454 -10.696  -2.594
  674   HD23  LEU  86          3HD2      LEU  86  11.097  -9.198  -3.269
  675    H    LYS  87           H        LYS  87   8.955  -9.441   2.843
  676    HA   LYS  87           HA       LYS  87   7.903 -12.060   3.287
  677    HB2  LYS  87          1HB       LYS  87   8.299  -9.679   5.097
  678    HB3  LYS  87          2HB       LYS  87   7.627 -11.201   5.667
  679    HG2  LYS  87          1HG       LYS  87   9.660 -12.365   5.065
  680    HG3  LYS  87          2HG       LYS  87  10.339 -10.873   4.392
  681    HD2  LYS  87          1HD       LYS  87  10.293  -9.848   6.599
  682    HD3  LYS  87          2HD       LYS  87   9.555 -11.300   7.276
  683    HE2  LYS  87          1HE       LYS  87  11.537 -12.591   6.677
  684    HE3  LYS  87          2HE       LYS  87  12.272 -11.150   5.978
  685    HZ1  LYS  87          1HZ       LYS  87  12.264 -10.127   8.161
  686    HZ2  LYS  87          2HZ       LYS  87  13.097 -11.594   8.205
  687    HZ3  LYS  87          3HZ       LYS  87  11.533 -11.495   8.835
  688    H    CYS  88           H        CYS  88   6.480  -9.194   2.333
  689    HA   CYS  88           HA       CYS  88   3.858 -10.017   3.370
  690    HB2  CYS  88          1HB       CYS  88   5.021  -7.335   2.696
  691    HB3  CYS  88          2HB       CYS  88   3.259  -7.564   2.721
  692    H    VAL  89           H        VAL  89   5.766  -9.938   0.617
  693    HA   VAL  89           HA       VAL  89   3.733  -9.415  -1.343
  694    HB   VAL  89           HB       VAL  89   6.506 -10.573  -1.628
  695   HG11  VAL  89          1HG1      VAL  89   5.176 -11.313  -3.479
  696   HG12  VAL  89          2HG1      VAL  89   6.226 -10.010  -4.037
  697   HG13  VAL  89          3HG1      VAL  89   4.520  -9.695  -3.711
  698   HG21  VAL  89          1HG2      VAL  89   7.060  -8.349  -2.548
  699   HG22  VAL  89          2HG2      VAL  89   6.564  -8.289  -0.858
  700   HG23  VAL  89          3HG2      VAL  89   5.440  -7.794  -2.123
  701    H    ASP  90           H        ASP  90   2.115 -10.831  -1.519
  702    HA   ASP  90           HA       ASP  90   2.728 -13.704  -1.437
  703    HB2  ASP  90          1HB       ASP  90   0.105 -12.265  -1.033
  704    HB3  ASP  90          2HB       ASP  90   0.249 -14.018  -1.147
  705    H    LYS  91           H        LYS  91   1.200 -15.033  -2.806
  706    HA   LYS  91           HA       LYS  91   1.262 -14.089  -5.556
  707    HB2  LYS  91          1HB       LYS  91   0.198 -16.737  -4.595
  708    HB3  LYS  91          2HB       LYS  91   0.870 -16.326  -6.167
  709    HG2  LYS  91          1HG       LYS  91   3.070 -16.156  -5.241
  710    HG3  LYS  91          2HG       LYS  91   2.441 -16.414  -3.617
  711    HD2  LYS  91          1HD       LYS  91   3.438 -18.460  -4.493
  712    HD3  LYS  91          2HD       LYS  91   1.702 -18.658  -4.253
  713    HE2  LYS  91          1HE       LYS  91   2.420 -19.654  -6.359
  714    HE3  LYS  91          2HE       LYS  91   1.325 -18.303  -6.637
  715    HZ1  LYS  91          1HZ       LYS  91   4.285 -18.150  -6.822
  716    HZ2  LYS  91          2HZ       LYS  91   3.191 -16.914  -7.190
  717    HZ3  LYS  91          3HZ       LYS  91   3.241 -18.308  -8.142
  718    H    ASN  92           H        ASN  92  -0.600 -14.185  -6.928
  719    HA   ASN  92           HA       ASN  92  -2.995 -13.221  -5.616
  720    HB2  ASN  92          1HB       ASN  92  -2.140 -12.225  -7.738
  721    HB3  ASN  92          2HB       ASN  92  -2.504 -13.742  -8.545
  722   HD21  ASN  92          1HD2      ASN  92  -3.904 -12.673  -9.948
  723   HD22  ASN  92          2HD2      ASN  92  -5.486 -12.167  -9.455
  724    H    THR  93           H        THR  93  -3.201 -15.365  -4.503
  725    HA   THR  93           HA       THR  93  -4.488 -17.428  -6.102
  726    HB   THR  93           HB       THR  93  -4.735 -18.597  -3.914
  727    HG1  THR  93           HG1      THR  93  -4.364 -17.540  -2.103
  728   HG21  THR  93          1HG2      THR  93  -2.751 -18.976  -5.261
  729   HG22  THR  93          2HG2      THR  93  -2.340 -18.993  -3.546
  730   HG23  THR  93          3HG2      THR  93  -1.967 -17.576  -4.529
  731    H    ASP  94           H        ASP  94  -5.303 -14.581  -4.558
  732    HA   ASP  94           HA       ASP  94  -7.912 -15.250  -3.599
  733    HB2  ASP  94          1HB       ASP  94  -6.770 -12.519  -4.244
  734    HB3  ASP  94          2HB       ASP  94  -8.188 -12.855  -3.245
  735    H    ASN  95           H        ASN  95  -6.570 -14.280  -6.609
  736    HA   ASN  95           HA       ASN  95  -7.387 -13.790  -8.652
  737    HB2  ASN  95          1HB       ASN  95  -9.759 -15.265  -7.533
  738    HB3  ASN  95          2HB       ASN  95  -9.731 -14.636  -9.170
  739   HD21  ASN  95          1HD2      ASN  95  -9.955 -16.756  -9.942
  740   HD22  ASN  95          2HD2      ASN  95  -8.603 -17.845  -9.984
  741    H    ASN  96           H        ASN  96  -7.645 -11.915  -6.449
  742    HA   ASN  96           HA       ASN  96  -9.542 -10.082  -7.665
  743    HB2  ASN  96          1HB       ASN  96 -10.975 -11.037  -6.026
  744    HB3  ASN  96          2HB       ASN  96  -9.708 -11.041  -4.803
  745   HD21  ASN  96          1HD2      ASN  96 -11.033  -9.944  -3.360
  746   HD22  ASN  96          2HD2      ASN  96 -11.398  -8.260  -3.533
  747    H    ALA  97           H        ALA  97  -8.297  -8.407  -8.104
  748    HA   ALA  97           HA       ALA  97  -5.758  -7.967  -7.019
  749    HB1  ALA  97          1HB       ALA  97  -5.779  -5.871  -8.253
  750    HB2  ALA  97          2HB       ALA  97  -7.521  -6.010  -8.482
  751    HB3  ALA  97          3HB       ALA  97  -6.438  -7.181  -9.231
  752    H    CYS  98           H        CYS  98  -8.905  -6.684  -6.097
  753    HA   CYS  98           HA       CYS  98  -7.979  -4.564  -4.485
  754    HB2  CYS  98          1HB       CYS  98 -10.495  -6.199  -4.108
  755    HB3  CYS  98          2HB       CYS  98 -10.170  -4.619  -3.409
  756    H    HIS  99           H        HIS  99  -8.489  -7.997  -3.772
  757    HA   HIS  99           HA       HIS  99  -7.926  -7.580  -0.957
  758    HB2  HIS  99          1HB       HIS  99  -9.532  -9.346  -1.973
  759    HB3  HIS  99          2HB       HIS  99  -8.071 -10.271  -2.298
  760    HD1  HIS  99           HD1      HIS  99  -7.619 -11.948  -0.527
  761    HD2  HIS  99           HD2      HIS  99  -9.506  -8.556   0.986
  762    HE1  HIS  99           HE1      HIS  99  -7.935 -12.374   1.929
  763    HE2  HIS  99           HE2      HIS  99  -9.266 -10.413   2.766
  764    H    TRP 100           H        TRP 100  -6.267  -8.559  -3.833
  765    HA   TRP 100           HA       TRP 100  -4.031  -9.820  -2.664
  766    HB2  TRP 100          1HB       TRP 100  -4.658  -9.998  -5.066
  767    HB3  TRP 100          2HB       TRP 100  -4.174  -8.320  -5.300
  768    HD1  TRP 100           HD1      TRP 100  -1.776 -10.066  -3.058
  769    HE1  TRP 100           HE1      TRP 100   0.342 -10.729  -4.356
  770    HE3  TRP 100           HE3      TRP 100  -3.443  -9.248  -7.828
  771    HZ2  TRP 100           HZ2      TRP 100   1.194 -10.899  -7.034
  772    HZ3  TRP 100           HZ3      TRP 100  -1.910  -9.682  -9.701
  773    HH2  TRP 100           HH2      TRP 100   0.358 -10.493  -9.318
  774    H    ALA 101           H        ALA 101  -4.429  -6.514  -3.931
  775    HA   ALA 101           HA       ALA 101  -1.906  -5.574  -3.082
  776    HB1  ALA 101          1HB       ALA 101  -2.819  -3.339  -3.552
  777    HB2  ALA 101          2HB       ALA 101  -4.429  -4.042  -3.711
  778    HB3  ALA 101          3HB       ALA 101  -3.159  -4.480  -4.853
  779    H    PHE 102           H        PHE 102  -5.074  -5.623  -1.580
  780    HA   PHE 102           HA       PHE 102  -4.490  -3.811   0.484
  781    HB2  PHE 102          1HB       PHE 102  -6.766  -4.329  -0.188
  782    HB3  PHE 102          2HB       PHE 102  -6.588  -5.979   0.398
  783    HD1  PHE 102           HD1      PHE 102  -7.252  -6.480   2.577
  784    HD2  PHE 102           HD2      PHE 102  -6.387  -2.442   1.534
  785    HE1  PHE 102           HE1      PHE 102  -8.043  -5.744   4.786
  786    HE2  PHE 102           HE2      PHE 102  -7.172  -1.702   3.745
  787    HZ   PHE 102           HZ       PHE 102  -8.002  -3.351   5.373
  788    H    ARG 103           H        ARG 103  -4.055  -7.294   0.187
  789    HA   ARG 103           HA       ARG 103  -3.575  -7.729   2.969
  790    HB2  ARG 103          1HB       ARG 103  -4.294  -9.543   1.426
  791    HB3  ARG 103          2HB       ARG 103  -2.715  -9.464   0.660
  792    HG2  ARG 103          1HG       ARG 103  -1.617 -10.136   2.665
  793    HG3  ARG 103          2HG       ARG 103  -3.116 -10.022   3.577
  794    HD2  ARG 103          1HD       ARG 103  -2.513 -12.344   3.034
  795    HD3  ARG 103          2HD       ARG 103  -4.050 -11.862   2.329
  796    HE   ARG 103           HE       ARG 103  -1.530 -12.006   0.800
  797   HH11  ARG 103          1HH1      ARG 103  -4.967 -12.557   1.137
  798   HH12  ARG 103          2HH1      ARG 103  -5.186 -13.070  -0.509
  799   HH21  ARG 103          1HH2      ARG 103  -1.825 -12.713  -1.387
  800   HH22  ARG 103          2HH2      ARG 103  -3.418 -13.155  -1.932
  801    H    GLY 104           H        GLY 104  -1.569  -7.020   0.169
  802    HA2  GLY 104          1HA       GLY 104   0.955  -7.384   1.400
  803    HA3  GLY 104          2HA       GLY 104   0.624  -6.333   0.018
  804    H    PHE 105           H        PHE 105  -1.117  -4.533   1.082
  805    HA   PHE 105           HA       PHE 105   0.622  -2.743   2.377
  806    HB2  PHE 105          1HB       PHE 105  -1.055  -1.847   0.960
  807    HB3  PHE 105          2HB       PHE 105  -2.332  -2.699   1.812
  808    HD1  PHE 105           HD1      PHE 105   0.449  -0.526   3.003
  809    HD2  PHE 105           HD2      PHE 105  -3.760  -1.108   2.715
  810    HE1  PHE 105           HE1      PHE 105   0.073   1.500   4.345
  811    HE2  PHE 105           HE2      PHE 105  -4.135   0.911   4.062
  812    HZ   PHE 105           HZ       PHE 105  -2.217   2.220   4.878
  813    H    LYS 106           H        LYS 106  -2.135  -4.638   3.522
  814    HA   LYS 106           HA       LYS 106  -2.204  -3.538   6.108
  815    HB2  LYS 106          1HB       LYS 106  -4.196  -4.496   5.481
  816    HB3  LYS 106          2HB       LYS 106  -3.440  -5.943   4.820
  817    HG2  LYS 106          1HG       LYS 106  -3.001  -6.715   7.105
  818    HG3  LYS 106          2HG       LYS 106  -3.735  -5.237   7.735
  819    HD2  LYS 106          1HD       LYS 106  -5.849  -5.851   6.623
  820    HD3  LYS 106          2HD       LYS 106  -5.105  -7.356   6.082
  821    HE2  LYS 106          1HE       LYS 106  -5.548  -6.501   8.939
  822    HE3  LYS 106          2HE       LYS 106  -6.457  -7.734   8.069
  823    HZ1  LYS 106          1HZ       LYS 106  -3.584  -7.839   8.795
  824    HZ2  LYS 106          2HZ       LYS 106  -4.375  -8.997   7.851
  825    HZ3  LYS 106          3HZ       LYS 106  -4.829  -8.767   9.462
  826    H    CYS 107           H        CYS 107  -0.586  -6.343   4.750
  827    HA   CYS 107           HA       CYS 107   0.328  -7.524   7.114
  828    HB2  CYS 107          1HB       CYS 107   0.456  -8.801   5.135
  829    HB3  CYS 107          2HB       CYS 107   1.338  -7.549   4.271
  830    H    PHE 108           H        PHE 108   1.657  -4.956   5.110
  831    HA   PHE 108           HA       PHE 108   4.215  -4.977   6.393
  832    HB2  PHE 108          1HB       PHE 108   3.772  -4.346   3.997
  833    HB3  PHE 108          2HB       PHE 108   3.078  -2.840   4.595
  834    HD1  PHE 108           HD1      PHE 108   4.511  -1.132   5.598
  835    HD2  PHE 108           HD2      PHE 108   6.129  -4.751   4.041
  836    HE1  PHE 108           HE1      PHE 108   6.762  -0.136   5.620
  837    HE2  PHE 108           HE2      PHE 108   8.374  -3.760   4.065
  838    HZ   PHE 108           HZ       PHE 108   8.694  -1.451   4.852
  839    H    GLN 109           H        GLN 109   1.414  -2.738   6.447
  840    HA   GLN 109           HA       GLN 109   2.651  -0.835   8.121
  841    HB2  GLN 109          1HB       GLN 109   0.401   0.058   8.476
  842    HB3  GLN 109          2HB       GLN 109   0.735  -0.245   6.775
  843    HG2  GLN 109          1HG       GLN 109  -0.695  -2.052   6.685
  844    HG3  GLN 109          2HG       GLN 109  -0.701  -2.272   8.438
  845   HE21  GLN 109          1HE2      GLN 109  -2.935  -2.211   8.586
  846   HE22  GLN 109          2HE2      GLN 109  -3.851  -0.759   8.346
  847    H    LYS 110           H        LYS 110   1.132  -3.849   8.784
  848    HA   LYS 110           HA       LYS 110   0.314  -3.427  11.441
  849    HB2  LYS 110          1HB       LYS 110  -0.351  -5.327   9.963
  850    HB3  LYS 110          2HB       LYS 110   1.254  -6.007  10.181
  851    HG2  LYS 110          1HG       LYS 110   0.786  -6.054  12.635
  852    HG3  LYS 110          2HG       LYS 110  -0.866  -5.574  12.260
  853    HD2  LYS 110          1HD       LYS 110  -1.170  -7.578  10.917
  854    HD3  LYS 110          2HD       LYS 110   0.498  -8.057  11.225
  855    HE2  LYS 110          1HE       LYS 110  -1.656  -7.729  13.310
  856    HE3  LYS 110          2HE       LYS 110  -1.084  -9.262  12.658
  857    HZ1  LYS 110          1HZ       LYS 110   0.532  -7.314  14.212
  858    HZ2  LYS 110          2HZ       LYS 110   1.121  -8.753  13.546
  859    HZ3  LYS 110          3HZ       LYS 110  -0.045  -8.802  14.768
  860    H    ASN 111           H        ASN 111   3.426  -3.888  10.020
  861    HA   ASN 111           HA       ASN 111   4.601  -4.137  12.716
  862    HB2  ASN 111          1HB       ASN 111   5.876  -4.941  10.095
  863    HB3  ASN 111          2HB       ASN 111   6.558  -5.144  11.702
  864   HD21  ASN 111          1HD2      ASN 111   6.016  -7.124   9.660
  865   HD22  ASN 111          2HD2      ASN 111   4.961  -8.285  10.388
  866    H    ASN 112           H        ASN 112   4.603  -2.423   9.675
  867    HA   ASN 112           HA       ASN 112   6.604  -0.543  10.735
  868    HB2  ASN 112          1HB       ASN 112   6.568  -1.797   7.980
  869    HB3  ASN 112          2HB       ASN 112   7.600  -0.445   8.453
  870   HD21  ASN 112          1HD2      ASN 112   7.998  -3.360   7.636
  871   HD22  ASN 112          2HD2      ASN 112   9.153  -3.938   8.792
  872    H    LEU 113           H        LEU 113   4.423   0.580  11.122
  873    HA   LEU 113           HA       LEU 113   3.217   1.654   8.705
  874    HB2  LEU 113          1HB       LEU 113   1.674   1.012  10.399
  875    HB3  LEU 113          2HB       LEU 113   2.500   1.967  11.611
  876    HG   LEU 113           HG       LEU 113   1.820   4.021  10.368
  877   HD11  LEU 113          1HD1      LEU 113   0.153   3.876   8.634
  878   HD12  LEU 113          2HD1      LEU 113   0.134   2.118   8.759
  879   HD13  LEU 113          3HD1      LEU 113   1.574   2.942   8.163
  880   HD21  LEU 113          1HD2      LEU 113   0.534   3.191  12.271
  881   HD22  LEU 113          2HD2      LEU 113  -0.428   2.188  11.185
  882   HD23  LEU 113          3HD2      LEU 113  -0.512   3.947  11.069
  883    H    SER 114           H        SER 114   5.280   2.711  11.325
  884    HA   SER 114           HA       SER 114   5.088   5.495  10.892
  885    HB2  SER 114          1HB       SER 114   6.102   4.463  12.921
  886    HB3  SER 114          2HB       SER 114   7.467   3.935  11.940
  887    HG   SER 114           HG       SER 114   6.752   6.512  12.778
  888    H    LEU 115           H        LEU 115   7.053   2.975   9.430
  889    HA   LEU 115           HA       LEU 115   8.777   4.626   7.942
  890    HB2  LEU 115          1HB       LEU 115   9.055   2.186   8.363
  891    HB3  LEU 115          2HB       LEU 115   7.765   1.888   7.214
  892    HG   LEU 115           HG       LEU 115   9.147   3.019   5.469
  893   HD11  LEU 115          1HD1      LEU 115  11.150   3.004   7.704
  894   HD12  LEU 115          2HD1      LEU 115  10.565   4.387   6.782
  895   HD13  LEU 115          3HD1      LEU 115  11.594   3.182   6.008
  896   HD21  LEU 115          1HD2      LEU 115  10.411   0.623   6.801
  897   HD22  LEU 115          2HD2      LEU 115  10.650   1.134   5.130
  898   HD23  LEU 115          3HD2      LEU 115   9.063   0.578   5.664
  899    H    ILE 116           H        ILE 116   5.556   3.378   7.363
  900    HA   ILE 116           HA       ILE 116   5.369   4.073   4.634
  901    HB   ILE 116           HB       ILE 116   3.186   3.727   6.702
  902   HG12  ILE 116          1HG1      ILE 116   4.303   1.836   4.614
  903   HG13  ILE 116          2HG1      ILE 116   4.541   1.715   6.364
  904   HG21  ILE 116          1HG2      ILE 116   2.371   5.052   4.840
  905   HG22  ILE 116          2HG2      ILE 116   1.683   3.428   4.778
  906   HG23  ILE 116          3HG2      ILE 116   3.005   3.866   3.697
  907   HD11  ILE 116          1HD1      ILE 116   2.074   1.447   6.586
  908   HD12  ILE 116          2HD1      ILE 116   2.885   0.140   5.723
  909   HD13  ILE 116          3HD1      ILE 116   1.985   1.363   4.827
  910    H    LYS 117           H        LYS 117   4.526   5.745   7.623
  911    HA   LYS 117           HA       LYS 117   3.430   8.046   6.405
  912    HB2  LYS 117          1HB       LYS 117   4.630   7.589   9.132
  913    HB3  LYS 117          2HB       LYS 117   3.882   9.107   8.652
  914    HG2  LYS 117          1HG       LYS 117   1.769   7.929   8.252
  915    HG3  LYS 117          2HG       LYS 117   2.514   6.416   8.764
  916    HD2  LYS 117          1HD       LYS 117   2.905   7.337  10.984
  917    HD3  LYS 117          2HD       LYS 117   2.236   8.889  10.479
  918    HE2  LYS 117          1HE       LYS 117   0.073   7.773  10.046
  919    HE3  LYS 117          2HE       LYS 117   0.760   6.264  10.646
  920    HZ1  LYS 117          1HZ       LYS 117  -0.529   7.414  12.342
  921    HZ2  LYS 117          2HZ       LYS 117   0.476   8.767  12.218
  922    HZ3  LYS 117          3HZ       LYS 117   1.097   7.302  12.790
  923    H    ALA 118           H        ALA 118   6.677   7.116   7.363
  924    HA   ALA 118           HA       ALA 118   7.811   9.717   6.933
  925    HB1  ALA 118          1HB       ALA 118   9.922   8.648   7.419
  926    HB2  ALA 118          2HB       ALA 118   9.165   7.059   7.296
  927    HB3  ALA 118          3HB       ALA 118   8.697   8.161   8.589
  928    H    SER 119           H        SER 119   7.194   6.963   4.930
  929    HA   SER 119           HA       SER 119   9.224   7.439   3.012
  930    HB2  SER 119          1HB       SER 119   8.050   5.842   1.609
  931    HB3  SER 119          2HB       SER 119   8.063   5.259   3.271
  932    HG   SER 119           HG       SER 119   5.913   6.005   3.478
  933    H    ILE 120           H        ILE 120   5.988   8.652   3.457
  934    HA   ILE 120           HA       ILE 120   6.095  10.072   0.905
  935    HB   ILE 120           HB       ILE 120   3.754  10.715   1.409
  936   HG12  ILE 120          1HG1      ILE 120   3.970   8.828   3.755
  937   HG13  ILE 120          2HG1      ILE 120   4.037  10.582   3.911
  938   HG21  ILE 120          1HG2      ILE 120   4.208   8.735   0.087
  939   HG22  ILE 120          2HG2      ILE 120   2.790   8.478   1.106
  940   HG23  ILE 120          3HG2      ILE 120   4.340   7.767   1.556
  941   HD11  ILE 120          1HD1      ILE 120   1.823   9.751   4.414
  942   HD12  ILE 120          2HD1      ILE 120   1.731   8.988   2.828
  943   HD13  ILE 120          3HD1      ILE 120   1.796  10.745   2.956
  944    H    LYS 121           H        LYS 121   7.032  10.558   4.037
  945    HA   LYS 121           HA       LYS 121   6.382  13.393   4.165
  946    HB2  LYS 121          1HB       LYS 121   6.213  11.928   6.173
  947    HB3  LYS 121          2HB       LYS 121   7.945  11.660   6.085
  948    HG2  LYS 121          1HG       LYS 121   8.349  14.032   6.472
  949    HG3  LYS 121          2HG       LYS 121   6.609  14.324   6.517
  950    HD2  LYS 121          1HD       LYS 121   7.499  14.196   8.772
  951    HD3  LYS 121          2HD       LYS 121   6.419  12.836   8.463
  952    HE2  LYS 121          1HE       LYS 121   8.361  11.399   8.039
  953    HE3  LYS 121          2HE       LYS 121   9.436  12.761   8.346
  954    HZ1  LYS 121          1HZ       LYS 121   7.561  11.576  10.321
  955    HZ2  LYS 121          2HZ       LYS 121   8.626  12.856  10.610
  956    HZ3  LYS 121          3HZ       LYS 121   9.232  11.314  10.274
  957    H    LYS 122           H        LYS 122   7.689  14.849   3.288
  958    HA   LYS 122           HA       LYS 122   9.514  15.943   2.541
  959    HB2  LYS 122          1HB       LYS 122  10.795  15.838   4.410
  960    HB3  LYS 122          2HB       LYS 122  10.704  14.103   4.522
  961    HG2  LYS 122          1HG       LYS 122  12.293  14.067   2.511
  962    HG3  LYS 122          2HG       LYS 122  12.540  15.783   2.841
  963    HD2  LYS 122          1HD       LYS 122  13.357  15.286   5.055
  964    HD3  LYS 122          2HD       LYS 122  12.978  13.575   4.850
  965    HE2  LYS 122          1HE       LYS 122  14.568  13.533   2.929
  966    HE3  LYS 122          2HE       LYS 122  15.029  15.182   3.339
  967    HZ1  LYS 122          1HZ       LYS 122  16.572  13.587   4.267
  968    HZ2  LYS 122          2HZ       LYS 122  15.323  12.808   5.101
  969    HZ3  LYS 122          3HZ       LYS 122  15.754  14.390   5.507
  970    H    ASP 123           H        ASP 123  10.653  15.927   0.658
  971    HA   ASP 123           HA       ASP 123  10.634  13.446  -0.837
  972    HB2  ASP 123          1HB       ASP 123  11.276  14.791  -2.773
  973    HB3  ASP 123          2HB       ASP 123   9.893  15.507  -1.960
  974    H21  ACD 201           H21      ACD   1  -4.744   5.068   1.382
  975    H22  ACD 201           H22      ACD   1  -3.634   5.035   2.760
  976    H31  ACD 201           H31      ACD   1  -2.095   6.581   1.489
  977    H32  ACD 201           H32      ACD   1  -3.171   6.461   0.099
  978    H41  ACD 201           H41      ACD   1  -2.826   3.951   0.114
  979    H42  ACD 201           H42      ACD   1  -1.351   4.875  -0.219
  980    H5   ACD 201           H5       ACD   1  -1.947   3.267   2.312
  981    H6   ACD 201           H6       ACD   1   0.322   3.835   2.822
  982    H71  ACD 201           H71      ACD   1   0.759   4.993   0.198
  983    H72  ACD 201           H72      ACD   1  -0.147   6.231   1.069
  984    H8   ACD 201           H8       ACD   1   1.733   6.567   2.655
  985    H9   ACD 201           H9       ACD   1   3.830   5.587   2.078
  986   H101  ACD 201          H101      ACD   1   2.746   4.714  -0.483
  987   H102  ACD 201          H102      ACD   1   2.284   3.457   0.666
  988    H11  ACD 201           H11      ACD   1   5.250   4.321   0.508
  989    H12  ACD 201           H12      ACD   1   5.558   1.983   0.217
  990   H131  ACD 201          H131      ACD   1   2.577   2.021  -0.460
  991   H132  ACD 201          H132      ACD   1   3.671   0.641  -0.587
  992    H14  ACD 201           H14      ACD   1   2.579   1.681   2.129
  993    H15  ACD 201           H15      ACD   1   2.492  -0.662   2.565
  994   H161  ACD 201          H161      ACD   1   2.678  -1.304  -0.263
  995   H162  ACD 201          H162      ACD   1   4.339  -0.955   0.226
  996   H171  ACD 201          H171      ACD   1   4.313  -2.683   1.902
  997   H172  ACD 201          H172      ACD   1   2.567  -2.901   1.754
  998   H181  ACD 201          H181      ACD   1   4.581  -3.461  -0.471
  999   H182  ACD 201          H182      ACD   1   2.841  -3.757  -0.547
 1000   H191  ACD 201          H191      ACD   1   4.824  -5.093   1.349
 1001   H192  ACD 201          H192      ACD   1   3.076  -5.329   1.420
 1002   H201  ACD 201          H201      ACD   1   4.838  -5.977  -0.956
 1003   H202  ACD 201          H202      ACD   1   3.126  -6.207  -0.891
 1004   H203  ACD 201          H203      ACD   1   4.159  -7.128   0.144
  Start of MODEL   18
    1    H1   MET   1          1H        MET   1  12.922  13.108 -16.379
    2    H2   MET   1          2H        MET   1  13.924  13.265 -17.729
    3    H3   MET   1          3H        MET   1  14.454  13.809 -16.219
    4    HA   MET   1           HA       MET   1  13.921  11.002 -16.993
    5    HB2  MET   1          1HB       MET   1  16.293  10.648 -16.816
    6    HB3  MET   1          2HB       MET   1  16.015  11.991 -17.912
    7    HG2  MET   1          1HG       MET   1  16.804  12.263 -15.019
    8    HG3  MET   1          2HG       MET   1  17.917  12.339 -16.382
    9    HE1  MET   1          1HE       MET   1  16.311  13.960 -18.565
   10    HE2  MET   1          2HE       MET   1  17.987  14.295 -18.142
   11    HE3  MET   1          3HE       MET   1  16.814  15.610 -18.199
   12    H    GLU   2           H        GLU   2  14.026  13.292 -14.468
   13    HA   GLU   2           HA       GLU   2  14.884  11.519 -12.394
   14    HB2  GLU   2          1HB       GLU   2  13.562  14.219 -12.333
   15    HB3  GLU   2          2HB       GLU   2  14.023  13.334 -10.887
   16    HG2  GLU   2          1HG       GLU   2  15.913  14.157 -13.066
   17    HG3  GLU   2          2HG       GLU   2  15.667  15.034 -11.556
   18    H    PHE   3           H        PHE   3  13.754  10.194 -11.172
   19    HA   PHE   3           HA       PHE   3  10.925   9.854 -11.645
   20    HB2  PHE   3          1HB       PHE   3  12.348   7.890 -11.307
   21    HB3  PHE   3          2HB       PHE   3  12.787   8.467  -9.697
   22    HD1  PHE   3           HD1      PHE   3  11.297   8.206  -7.848
   23    HD2  PHE   3           HD2      PHE   3  10.114   7.033 -11.761
   24    HE1  PHE   3           HE1      PHE   3   9.383   6.988  -6.896
   25    HE2  PHE   3           HE2      PHE   3   8.195   5.811 -10.819
   26    HZ   PHE   3           HZ       PHE   3   7.828   5.787  -8.382
   27    H    THR   4           H        THR   4   9.337  10.690 -10.455
   28    HA   THR   4           HA       THR   4  10.094  12.367  -8.171
   29    HB   THR   4           HB       THR   4   7.295  12.472  -8.998
   30    HG1  THR   4           HG1      THR   4   9.292  13.313 -10.863
   31   HG21  THR   4          1HG2      THR   4   9.498  14.520  -8.801
   32   HG22  THR   4          2HG2      THR   4   8.320  14.120  -7.550
   33   HG23  THR   4          3HG2      THR   4   7.789  14.879  -9.048
   34    H    VAL   5           H        VAL   5   9.830  11.613  -6.220
   35    HA   VAL   5           HA       VAL   5   8.338   9.180  -5.747
   36    HB   VAL   5           HB       VAL   5   9.358   9.032  -3.710
   37   HG11  VAL   5          1HG1      VAL   5  11.630   9.814  -3.781
   38   HG12  VAL   5          2HG1      VAL   5  11.219  10.965  -5.049
   39   HG13  VAL   5          3HG1      VAL   5  11.114   9.233  -5.362
   40   HG21  VAL   5          1HG2      VAL   5  10.013  10.892  -2.262
   41   HG22  VAL   5          2HG2      VAL   5   8.307  10.989  -2.696
   42   HG23  VAL   5          3HG2      VAL   5   9.480  12.040  -3.490
   43    H    SER   6           H        SER   6   6.479   8.942  -4.621
   44    HA   SER   6           HA       SER   6   4.696  11.187  -4.768
   45    HB2  SER   6          1HB       SER   6   3.027   9.482  -3.917
   46    HB3  SER   6          2HB       SER   6   3.824   9.069  -5.436
   47    HG   SER   6           HG       SER   6   4.691   8.164  -2.889
   48    H    THR   7           H        THR   7   5.248  12.681  -3.222
   49    HA   THR   7           HA       THR   7   5.532  11.943  -0.455
   50    HB   THR   7           HB       THR   7   6.707  13.922  -1.482
   51    HG1  THR   7           HG1      THR   7   6.189  13.647   0.862
   52   HG21  THR   7          1HG2      THR   7   5.440  16.039  -1.642
   53   HG22  THR   7          2HG2      THR   7   3.946  15.138  -1.376
   54   HG23  THR   7          3HG2      THR   7   4.909  14.843  -2.822
   55    H    THR   8           H        THR   8   4.096  13.610   1.023
   56    HA   THR   8           HA       THR   8   1.641  12.394   1.284
   57    HB   THR   8           HB       THR   8   2.384  15.177   2.178
   58    HG1  THR   8           HG1      THR   8   3.289  12.752   2.913
   59   HG21  THR   8          1HG2      THR   8   0.677  14.818   3.910
   60   HG22  THR   8          2HG2      THR   8   0.250  13.284   3.148
   61   HG23  THR   8          3HG2      THR   8  -0.008  14.800   2.285
   62    H    GLU   9           H        GLU   9   2.259  15.590  -0.194
   63    HA   GLU   9           HA       GLU   9  -0.395  16.179  -0.779
   64    HB2  GLU   9          1HB       GLU   9   1.378  17.854  -0.868
   65    HB3  GLU   9          2HB       GLU   9   2.071  17.064  -2.279
   66    HG2  GLU   9          1HG       GLU   9   0.112  17.579  -3.578
   67    HG3  GLU   9          2HG       GLU   9  -0.682  18.261  -2.162
   68    H    ASP  10           H        ASP  10   2.052  14.628  -2.868
   69    HA   ASP  10           HA       ASP  10   0.424  14.253  -5.117
   70    HB2  ASP  10          1HB       ASP  10   2.686  12.494  -4.132
   71    HB3  ASP  10          2HB       ASP  10   1.929  12.395  -5.722
   72    H    LEU  11           H        LEU  11   0.880  12.278  -2.233
   73    HA   LEU  11           HA       LEU  11  -0.655  10.090  -3.071
   74    HB2  LEU  11          1HB       LEU  11   0.841   9.872  -1.218
   75    HB3  LEU  11          2HB       LEU  11  -0.032  11.100  -0.293
   76    HG   LEU  11           HG       LEU  11  -1.990   9.565  -0.250
   77   HD11  LEU  11          1HD1      LEU  11  -1.427   8.300  -2.270
   78   HD12  LEU  11          2HD1      LEU  11  -1.709   7.254  -0.882
   79   HD13  LEU  11          3HD1      LEU  11  -0.059   7.577  -1.420
   80   HD21  LEU  11          1HD2      LEU  11  -0.318   9.699   1.582
   81   HD22  LEU  11          2HD2      LEU  11   0.531   8.337   0.851
   82   HD23  LEU  11          3HD2      LEU  11  -1.108   8.129   1.462
   83    H    GLN  12           H        GLN  12  -1.532  13.053  -1.352
   84    HA   GLN  12           HA       GLN  12  -4.219  12.280  -0.858
   85    HB2  GLN  12          1HB       GLN  12  -2.932  15.005  -0.942
   86    HB3  GLN  12          2HB       GLN  12  -4.562  14.685  -0.358
   87    HG2  GLN  12          1HG       GLN  12  -2.065  13.473   0.790
   88    HG3  GLN  12          2HG       GLN  12  -2.889  14.883   1.452
   89   HE21  GLN  12          1HE2      GLN  12  -2.362  12.240   2.634
   90   HE22  GLN  12          2HE2      GLN  12  -3.905  11.605   3.084
   91    H    ARG  13           H        ARG  13  -2.554  13.796  -3.493
   92    HA   ARG  13           HA       ARG  13  -4.755  14.750  -4.966
   93    HB2  ARG  13          1HB       ARG  13  -2.419  15.375  -5.425
   94    HB3  ARG  13          2HB       ARG  13  -2.089  13.733  -5.960
   95    HG2  ARG  13          1HG       ARG  13  -3.843  14.062  -7.725
   96    HG3  ARG  13          2HG       ARG  13  -3.872  15.772  -7.257
   97    HD2  ARG  13          1HD       ARG  13  -1.521  14.212  -8.320
   98    HD3  ARG  13          2HD       ARG  13  -2.413  15.480  -9.154
   99    HE   ARG  13           HE       ARG  13  -1.559  16.998  -7.354
  100   HH11  ARG  13          1HH1      ARG  13   0.176  14.092  -8.241
  101   HH12  ARG  13          2HH1      ARG  13   1.719  14.693  -7.716
  102   HH21  ARG  13          1HH2      ARG  13   0.483  17.820  -6.717
  103   HH22  ARG  13          2HH2      ARG  13   1.895  16.827  -6.882
  104    H    TYR  14           H        TYR  14  -2.946  11.691  -5.177
  105    HA   TYR  14           HA       TYR  14  -4.513  10.534  -7.216
  106    HB2  TYR  14          1HB       TYR  14  -2.962   9.081  -5.066
  107    HB3  TYR  14          2HB       TYR  14  -3.488   8.425  -6.607
  108    HD1  TYR  14           HD1      TYR  14  -2.741  10.566  -8.482
  109    HD2  TYR  14           HD2      TYR  14  -0.635   8.991  -5.134
  110    HE1  TYR  14           HE1      TYR  14  -0.611  11.224  -9.517
  111    HE2  TYR  14           HE2      TYR  14   1.497   9.659  -6.156
  112    HH   TYR  14           HH       TYR  14   2.395  10.119  -8.394
  113    H    ARG  15           H        ARG  15  -4.826  10.592  -3.734
  114    HA   ARG  15           HA       ARG  15  -6.595   8.566  -3.276
  115    HB2  ARG  15          1HB       ARG  15  -6.132   9.456  -1.272
  116    HB3  ARG  15          2HB       ARG  15  -5.869  11.061  -1.930
  117    HG2  ARG  15          1HG       ARG  15  -8.492  11.094  -2.076
  118    HG3  ARG  15          2HG       ARG  15  -8.372   9.788  -0.893
  119    HD2  ARG  15          1HD       ARG  15  -8.609  11.792   0.353
  120    HD3  ARG  15          2HD       ARG  15  -6.909  11.336   0.477
  121    HE   ARG  15           HE       ARG  15  -6.767  12.998  -1.560
  122   HH11  ARG  15          1HH1      ARG  15  -8.607  13.316   1.399
  123   HH12  ARG  15          2HH1      ARG  15  -8.556  15.049   1.400
  124   HH21  ARG  15          1HH2      ARG  15  -6.689  15.284  -1.566
  125   HH22  ARG  15          2HH2      ARG  15  -7.451  16.168  -0.280
  126    H    THR  16           H        THR  16  -7.306  11.869  -4.323
  127    HA   THR  16           HA       THR  16 -10.093  11.731  -4.218
  128    HB   THR  16           HB       THR  16  -8.202  13.440  -5.813
  129    HG1  THR  16           HG1      THR  16  -8.650  14.939  -4.235
  130   HG21  THR  16          1HG2      THR  16 -10.271  13.326  -7.072
  131   HG22  THR  16          2HG2      THR  16 -10.127  14.909  -6.301
  132   HG23  THR  16          3HG2      THR  16 -11.207  13.690  -5.619
  133    H    GLU  17           H        GLU  17  -7.841  11.187  -6.911
  134    HA   GLU  17           HA       GLU  17  -9.800  10.861  -8.900
  135    HB2  GLU  17          1HB       GLU  17  -7.206   9.377  -9.090
  136    HB3  GLU  17          2HB       GLU  17  -8.084  10.244 -10.332
  137    HG2  GLU  17          1HG       GLU  17  -7.482  12.374  -9.199
  138    HG3  GLU  17          2HG       GLU  17  -6.433  11.443  -8.125
  139    H    CYS  18           H        CYS  18  -8.422   8.627  -6.588
  140    HA   CYS  18           HA       CYS  18  -9.733   6.343  -7.768
  141    HB2  CYS  18          1HB       CYS  18  -8.246   6.690  -5.164
  142    HB3  CYS  18          2HB       CYS  18  -8.952   5.163  -5.707
  143    H    VAL  19           H        VAL  19 -10.336   8.599  -5.155
  144    HA   VAL  19           HA       VAL  19 -12.411   7.150  -3.910
  145    HB   VAL  19           HB       VAL  19 -11.500   9.994  -3.781
  146   HG11  VAL  19          1HG1      VAL  19 -13.265  10.528  -2.186
  147   HG12  VAL  19          2HG1      VAL  19 -14.016   8.961  -2.481
  148   HG13  VAL  19          3HG1      VAL  19 -13.934  10.157  -3.777
  149   HG21  VAL  19          1HG2      VAL  19 -10.329   8.351  -2.459
  150   HG22  VAL  19          2HG2      VAL  19 -11.846   7.788  -1.758
  151   HG23  VAL  19          3HG2      VAL  19 -11.251   9.411  -1.395
  152    H    SER  20           H        SER  20 -12.478   9.899  -6.143
  153    HA   SER  20           HA       SER  20 -15.305   9.941  -6.341
  154    HB2  SER  20          1HB       SER  20 -13.706  11.843  -6.793
  155    HB3  SER  20          2HB       SER  20 -13.320  11.065  -8.324
  156    HG   SER  20           HG       SER  20 -15.966  11.740  -7.559
  157    H    SER  21           H        SER  21 -12.947   7.911  -7.799
  158    HA   SER  21           HA       SER  21 -14.604   7.282 -10.108
  159    HB2  SER  21          1HB       SER  21 -12.108   7.473 -10.271
  160    HB3  SER  21          2HB       SER  21 -11.979   6.040  -9.254
  161    HG   SER  21           HG       SER  21 -13.023   6.269 -11.873
  162    H    LEU  22           H        LEU  22 -13.345   5.639  -7.189
  163    HA   LEU  22           HA       LEU  22 -14.732   3.201  -7.881
  164    HB2  LEU  22          1HB       LEU  22 -13.012   3.999  -5.541
  165    HB3  LEU  22          2HB       LEU  22 -13.784   2.415  -5.667
  166    HG   LEU  22           HG       LEU  22 -11.856   3.506  -7.713
  167   HD11  LEU  22          1HD1      LEU  22 -10.701   3.265  -5.601
  168   HD12  LEU  22          2HD1      LEU  22 -10.232   1.952  -6.681
  169   HD13  LEU  22          3HD1      LEU  22 -11.385   1.656  -5.379
  170   HD21  LEU  22          1HD2      LEU  22 -11.748   1.184  -8.433
  171   HD22  LEU  22          2HD2      LEU  22 -13.398   1.802  -8.526
  172   HD23  LEU  22          3HD2      LEU  22 -12.928   0.739  -7.199
  173    H    ASN  23           H        ASN  23 -16.029   5.875  -6.897
  174    HA   ASN  23           HA       ASN  23 -17.824   6.548  -5.673
  175    HB2  ASN  23          1HB       ASN  23 -18.828   4.668  -6.985
  176    HB3  ASN  23          2HB       ASN  23 -18.547   3.618  -5.611
  177   HD21  ASN  23          1HD2      ASN  23 -20.741   3.200  -5.363
  178   HD22  ASN  23          2HD2      ASN  23 -21.841   4.385  -4.741
  179    H    ILE  24           H        ILE  24 -15.470   6.156  -4.197
  180    HA   ILE  24           HA       ILE  24 -16.005   4.730  -1.782
  181    HB   ILE  24           HB       ILE  24 -13.967   6.922  -2.187
  182   HG12  ILE  24          1HG1      ILE  24 -13.718   5.197  -3.942
  183   HG13  ILE  24          2HG1      ILE  24 -12.368   5.182  -2.813
  184   HG21  ILE  24          1HG2      ILE  24 -14.329   6.310   0.128
  185   HG22  ILE  24          2HG2      ILE  24 -12.750   5.738  -0.407
  186   HG23  ILE  24          3HG2      ILE  24 -14.096   4.605  -0.260
  187   HD11  ILE  24          1HD1      ILE  24 -13.068   2.937  -3.419
  188   HD12  ILE  24          2HD1      ILE  24 -14.691   3.270  -2.810
  189   HD13  ILE  24          3HD1      ILE  24 -13.319   3.237  -1.699
  190    HA   PRO  25           HA       PRO  25 -18.708   7.872  -0.040
  191    HB2  PRO  25          1HB       PRO  25 -18.233   6.349   2.433
  192    HB3  PRO  25          2HB       PRO  25 -19.751   6.728   1.615
  193    HG2  PRO  25          1HG       PRO  25 -18.711   4.257   1.617
  194    HG3  PRO  25          2HG       PRO  25 -19.626   4.905   0.245
  195    HD2  PRO  25          1HD       PRO  25 -16.675   4.552   0.562
  196    HD3  PRO  25          2HD       PRO  25 -17.693   4.358  -0.887
  197    H    ALA  26           H        ALA  26 -18.367   9.694   1.037
  198    HA   ALA  26           HA       ALA  26 -15.817  10.673   1.520
  199    HB1  ALA  26          1HB       ALA  26 -16.915  12.552   2.593
  200    HB2  ALA  26          2HB       ALA  26 -18.401  11.615   2.750
  201    HB3  ALA  26          3HB       ALA  26 -17.805  12.060   1.151
  202    H    ASP  27           H        ASP  27 -18.065   9.100   3.728
  203    HA   ASP  27           HA       ASP  27 -16.798   9.606   6.155
  204    HB2  ASP  27          1HB       ASP  27 -18.990   8.559   6.007
  205    HB3  ASP  27          2HB       ASP  27 -18.276   7.111   5.307
  206    H    TYR  28           H        TYR  28 -16.261   6.917   3.873
  207    HA   TYR  28           HA       TYR  28 -14.224   5.652   5.279
  208    HB2  TYR  28          1HB       TYR  28 -15.020   5.721   2.401
  209    HB3  TYR  28          2HB       TYR  28 -13.523   4.910   2.864
  210    HD1  TYR  28           HD1      TYR  28 -13.580   2.739   3.831
  211    HD2  TYR  28           HD2      TYR  28 -17.184   4.967   3.437
  212    HE1  TYR  28           HE1      TYR  28 -14.875   0.747   4.461
  213    HE2  TYR  28           HE2      TYR  28 -18.487   2.977   4.058
  214    HH   TYR  28           HH       TYR  28 -18.333   0.639   4.174
  215    H    VAL  29           H        VAL  29 -14.124   8.327   3.004
  216    HA   VAL  29           HA       VAL  29 -11.374   8.517   2.602
  217    HB   VAL  29           HB       VAL  29 -13.397  10.747   2.688
  218   HG11  VAL  29          1HG1      VAL  29 -11.161  11.637   2.791
  219   HG12  VAL  29          2HG1      VAL  29 -11.808  11.895   1.171
  220   HG13  VAL  29          3HG1      VAL  29 -10.650  10.595   1.464
  221   HG21  VAL  29          1HG2      VAL  29 -12.460   8.979   0.444
  222   HG22  VAL  29          2HG2      VAL  29 -13.448  10.425   0.234
  223   HG23  VAL  29          3HG2      VAL  29 -14.080   9.049   1.139
  224    H    GLU  30           H        GLU  30 -13.421   9.910   5.139
  225    HA   GLU  30           HA       GLU  30 -11.377  11.398   6.432
  226    HB2  GLU  30          1HB       GLU  30 -13.769  10.292   7.867
  227    HB3  GLU  30          2HB       GLU  30 -12.920  11.815   8.113
  228    HG2  GLU  30          1HG       GLU  30 -13.728  12.594   5.939
  229    HG3  GLU  30          2HG       GLU  30 -14.655  11.111   5.773
  230    H    LYS  31           H        LYS  31 -12.437   8.077   6.669
  231    HA   LYS  31           HA       LYS  31 -11.070   7.352   9.026
  232    HB2  LYS  31          1HB       LYS  31 -11.615   5.634   6.600
  233    HB3  LYS  31          2HB       LYS  31 -11.162   5.051   8.206
  234    HG2  LYS  31          1HG       LYS  31 -13.257   5.979   9.103
  235    HG3  LYS  31          2HG       LYS  31 -13.710   6.485   7.475
  236    HD2  LYS  31          1HD       LYS  31 -13.337   4.006   6.837
  237    HD3  LYS  31          2HD       LYS  31 -13.417   3.709   8.585
  238    HE2  LYS  31          1HE       LYS  31 -15.557   5.083   6.949
  239    HE3  LYS  31          2HE       LYS  31 -15.607   3.403   7.479
  240    HZ1  LYS  31          1HZ       LYS  31 -15.707   4.102   9.738
  241    HZ2  LYS  31          2HZ       LYS  31 -16.886   4.965   8.881
  242    HZ3  LYS  31          3HZ       LYS  31 -15.439   5.719   9.322
  243    H    PHE  32           H        PHE  32 -10.121   7.212   5.617
  244    HA   PHE  32           HA       PHE  32  -7.627   6.010   5.981
  245    HB2  PHE  32          1HB       PHE  32  -8.410   7.895   3.760
  246    HB3  PHE  32          2HB       PHE  32  -7.141   6.676   3.708
  247    HD1  PHE  32           HD1      PHE  32  -9.783   7.166   1.991
  248    HD2  PHE  32           HD2      PHE  32  -8.640   4.444   5.054
  249    HE1  PHE  32           HE1      PHE  32 -11.406   5.523   1.136
  250    HE2  PHE  32           HE2      PHE  32 -10.255   2.801   4.203
  251    HZ   PHE  32           HZ       PHE  32 -11.637   3.333   2.239
  252    H    LYS  33           H        LYS  33  -8.582   9.394   6.047
  253    HA   LYS  33           HA       LYS  33  -6.012  10.540   6.116
  254    HB2  LYS  33          1HB       LYS  33  -8.294  11.718   5.881
  255    HB3  LYS  33          2HB       LYS  33  -8.370  11.629   7.641
  256    HG2  LYS  33          1HG       LYS  33  -6.310  12.880   7.831
  257    HG3  LYS  33          2HG       LYS  33  -6.170  12.946   6.069
  258    HD2  LYS  33          1HD       LYS  33  -8.334  14.170   6.004
  259    HD3  LYS  33          2HD       LYS  33  -8.333  14.192   7.768
  260    HE2  LYS  33          1HE       LYS  33  -7.486  16.294   6.916
  261    HE3  LYS  33          2HE       LYS  33  -6.197  15.410   7.733
  262    HZ1  LYS  33          1HZ       LYS  33  -6.621  15.521   4.796
  263    HZ2  LYS  33          2HZ       LYS  33  -5.382  14.682   5.580
  264    HZ3  LYS  33          3HZ       LYS  33  -5.434  16.369   5.652
  265    H    LYS  34           H        LYS  34  -8.012   9.053   8.571
  266    HA   LYS  34           HA       LYS  34  -6.151   9.756  10.689
  267    HB2  LYS  34          1HB       LYS  34  -8.793   8.303  10.647
  268    HB3  LYS  34          2HB       LYS  34  -7.797   8.375  12.096
  269    HG2  LYS  34          1HG       LYS  34  -8.900  10.747  10.601
  270    HG3  LYS  34          2HG       LYS  34  -9.567  10.064  12.085
  271    HD2  LYS  34          1HD       LYS  34  -7.407  10.529  13.211
  272    HD3  LYS  34          2HD       LYS  34  -6.843  11.314  11.735
  273    HE2  LYS  34          1HE       LYS  34  -9.221  12.152  13.390
  274    HE3  LYS  34          2HE       LYS  34  -7.650  12.946  13.365
  275    HZ1  LYS  34          1HZ       LYS  34  -9.572  12.742  11.115
  276    HZ2  LYS  34          2HZ       LYS  34  -8.012  13.376  10.976
  277    HZ3  LYS  34          3HZ       LYS  34  -9.149  14.139  11.967
  278    H    TRP  35           H        TRP  35  -5.591   7.850   8.382
  279    HA   TRP  35           HA       TRP  35  -4.586   5.880   7.946
  280    HB2  TRP  35          1HB       TRP  35  -3.645   6.352  10.770
  281    HB3  TRP  35          2HB       TRP  35  -3.021   5.046   9.751
  282    HD1  TRP  35           HD1      TRP  35  -2.808   8.799  10.282
  283    HE1  TRP  35           HE1      TRP  35  -0.948   9.759   8.785
  284    HE3  TRP  35           HE3      TRP  35  -1.822   4.658   7.448
  285    HZ2  TRP  35           HZ2      TRP  35   0.711   8.882   6.684
  286    HZ3  TRP  35           HZ3      TRP  35  -0.088   4.803   5.719
  287    HH2  TRP  35           HH2      TRP  35   1.158   6.865   5.340
  288    H    GLU  36           H        GLU  36  -7.271   5.620   8.693
  289    HA   GLU  36           HA       GLU  36  -7.261   3.019  10.059
  290    HB2  GLU  36          1HB       GLU  36  -9.437   5.093   9.851
  291    HB3  GLU  36          2HB       GLU  36  -9.713   3.454  10.424
  292    HG2  GLU  36          1HG       GLU  36  -7.846   5.459  11.656
  293    HG3  GLU  36          2HG       GLU  36  -9.449   5.042  12.256
  294    H    PHE  37           H        PHE  37  -7.293   1.447   8.639
  295    HA   PHE  37           HA       PHE  37  -8.913   1.778   6.200
  296    HB2  PHE  37          1HB       PHE  37  -6.481   0.002   6.554
  297    HB3  PHE  37          2HB       PHE  37  -7.346   0.306   5.051
  298    HD1  PHE  37           HD1      PHE  37  -5.109   1.755   7.577
  299    HD2  PHE  37           HD2      PHE  37  -6.945   2.294   3.773
  300    HE1  PHE  37           HE1      PHE  37  -3.609   3.651   7.123
  301    HE2  PHE  37           HE2      PHE  37  -5.456   4.195   3.321
  302    HZ   PHE  37           HZ       PHE  37  -3.783   4.877   4.995
  303    HA   PRO  38           HA       PRO  38 -11.128  -1.531   8.545
  304    HB2  PRO  38          1HB       PRO  38 -13.068  -0.767   6.423
  305    HB3  PRO  38          2HB       PRO  38 -13.332  -1.062   8.153
  306    HG2  PRO  38          1HG       PRO  38 -13.333   1.419   7.231
  307    HG3  PRO  38          2HG       PRO  38 -12.523   1.035   8.762
  308    HD2  PRO  38          1HD       PRO  38 -11.311   1.482   6.047
  309    HD3  PRO  38          2HD       PRO  38 -10.750   2.053   7.648
  310    H    GLU  39           H        GLU  39 -11.333  -3.613   8.014
  311    HA   GLU  39           HA       GLU  39 -10.227  -4.524   5.533
  312    HB2  GLU  39          1HB       GLU  39  -9.831  -5.630   7.721
  313    HB3  GLU  39          2HB       GLU  39 -11.521  -6.107   7.758
  314    HG2  GLU  39          1HG       GLU  39 -11.210  -7.487   5.803
  315    HG3  GLU  39          2HG       GLU  39  -9.540  -6.936   5.654
  316    H    ASP  40           H        ASP  40 -11.741  -3.573   4.106
  317    HA   ASP  40           HA       ASP  40 -14.182  -5.127   3.702
  318    HB2  ASP  40          1HB       ASP  40 -14.916  -3.246   5.077
  319    HB3  ASP  40          2HB       ASP  40 -14.141  -2.110   3.981
  320    H    ASP  41           H        ASP  41 -14.969  -5.041   1.535
  321    HA   ASP  41           HA       ASP  41 -13.046  -5.087  -0.444
  322    HB2  ASP  41          1HB       ASP  41 -15.270  -6.100  -0.703
  323    HB3  ASP  41          2HB       ASP  41 -15.994  -4.498  -0.818
  324    H    THR  42           H        THR  42 -15.145  -2.397   0.470
  325    HA   THR  42           HA       THR  42 -14.660  -0.618  -1.593
  326    HB   THR  42           HB       THR  42 -14.918   0.160   1.302
  327    HG1  THR  42           HG1      THR  42 -16.582  -1.238   1.022
  328   HG21  THR  42          1HG2      THR  42 -16.186   2.057   0.345
  329   HG22  THR  42          2HG2      THR  42 -15.781   1.471  -1.270
  330   HG23  THR  42          3HG2      THR  42 -14.504   2.014  -0.181
  331    H    THR  43           H        THR  43 -13.004  -0.719   1.544
  332    HA   THR  43           HA       THR  43 -11.015   1.159   1.001
  333    HB   THR  43           HB       THR  43 -10.827  -1.222   2.852
  334    HG1  THR  43           HG1      THR  43 -11.547   0.548   4.378
  335   HG21  THR  43          1HG2      THR  43  -9.361   0.323   4.168
  336   HG22  THR  43          2HG2      THR  43  -9.400   1.437   2.800
  337   HG23  THR  43          3HG2      THR  43  -8.685  -0.162   2.611
  338    H    MET  44           H        MET  44 -11.195  -2.274   0.308
  339    HA   MET  44           HA       MET  44  -8.448  -2.727  -0.101
  340    HB2  MET  44          1HB       MET  44 -10.836  -4.207  -1.200
  341    HB3  MET  44          2HB       MET  44  -9.180  -4.794  -1.264
  342    HG2  MET  44          1HG       MET  44  -9.084  -4.858   1.153
  343    HG3  MET  44          2HG       MET  44 -10.706  -4.184   1.254
  344    HE1  MET  44          1HE       MET  44 -11.428  -6.077   2.859
  345    HE2  MET  44          2HE       MET  44  -9.824  -6.810   2.784
  346    HE3  MET  44          3HE       MET  44 -11.260  -7.803   2.519
  347    H    CYS  45           H        CYS  45 -11.069  -2.188  -2.470
  348    HA   CYS  45           HA       CYS  45  -9.328  -2.150  -4.701
  349    HB2  CYS  45          1HB       CYS  45 -12.108  -1.002  -4.372
  350    HB3  CYS  45          2HB       CYS  45 -11.235  -1.034  -5.896
  351    H    TYR  46           H        TYR  46 -10.338   0.309  -2.431
  352    HA   TYR  46           HA       TYR  46  -9.493   2.565  -3.839
  353    HB2  TYR  46          1HB       TYR  46 -10.757   2.965  -1.900
  354    HB3  TYR  46          2HB       TYR  46  -9.716   1.952  -0.899
  355    HD1  TYR  46           HD1      TYR  46  -9.594   5.074  -2.957
  356    HD2  TYR  46           HD2      TYR  46  -8.149   2.997   0.471
  357    HE1  TYR  46           HE1      TYR  46  -8.350   7.076  -2.269
  358    HE2  TYR  46           HE2      TYR  46  -6.900   5.000   1.162
  359    HH   TYR  46           HH       TYR  46  -6.038   7.040   0.311
  360    H    ILE  47           H        ILE  47  -7.763   0.556  -1.482
  361    HA   ILE  47           HA       ILE  47  -5.287   1.814  -1.604
  362    HB   ILE  47           HB       ILE  47  -5.968  -1.066  -1.048
  363   HG12  ILE  47          1HG1      ILE  47  -6.895   0.504   0.568
  364   HG13  ILE  47          2HG1      ILE  47  -5.583  -0.406   1.312
  365   HG21  ILE  47          1HG2      ILE  47  -3.673  -1.006  -1.780
  366   HG22  ILE  47          2HG2      ILE  47  -3.718  -1.242  -0.032
  367   HG23  ILE  47          3HG2      ILE  47  -3.327   0.343  -0.697
  368   HD11  ILE  47          1HD1      ILE  47  -5.393   1.851   2.006
  369   HD12  ILE  47          2HD1      ILE  47  -5.534   2.441   0.353
  370   HD13  ILE  47          3HD1      ILE  47  -4.093   1.553   0.854
  371    H    LYS  48           H        LYS  48  -6.630  -0.778  -3.579
  372    HA   LYS  48           HA       LYS  48  -4.289  -1.425  -4.976
  373    HB2  LYS  48          1HB       LYS  48  -6.395  -2.793  -4.833
  374    HB3  LYS  48          2HB       LYS  48  -7.134  -1.678  -5.967
  375    HG2  LYS  48          1HG       LYS  48  -4.581  -3.024  -6.704
  376    HG3  LYS  48          2HG       LYS  48  -6.094  -3.923  -6.796
  377    HD2  LYS  48          1HD       LYS  48  -7.018  -2.167  -8.255
  378    HD3  LYS  48          2HD       LYS  48  -5.467  -1.328  -8.196
  379    HE2  LYS  48          1HE       LYS  48  -4.373  -3.221  -9.239
  380    HE3  LYS  48          2HE       LYS  48  -5.885  -4.127  -9.228
  381    HZ1  LYS  48          1HZ       LYS  48  -5.379  -1.614 -10.721
  382    HZ2  LYS  48          2HZ       LYS  48  -6.841  -2.472 -10.705
  383    HZ3  LYS  48          3HZ       LYS  48  -5.456  -3.171 -11.392
  384    H    CYS  49           H        CYS  49  -6.962   0.773  -5.739
  385    HA   CYS  49           HA       CYS  49  -6.080   1.570  -8.256
  386    HB2  CYS  49          1HB       CYS  49  -8.295   2.073  -7.642
  387    HB3  CYS  49          2HB       CYS  49  -7.793   2.996  -6.226
  388    H    VAL  50           H        VAL  50  -5.409   3.085  -5.065
  389    HA   VAL  50           HA       VAL  50  -3.878   5.178  -6.268
  390    HB   VAL  50           HB       VAL  50  -3.589   6.124  -4.231
  391   HG11  VAL  50          1HG1      VAL  50  -5.827   4.279  -3.493
  392   HG12  VAL  50          2HG1      VAL  50  -5.979   5.694  -4.533
  393   HG13  VAL  50          3HG1      VAL  50  -5.498   5.886  -2.847
  394   HG21  VAL  50          1HG2      VAL  50  -3.543   3.430  -2.878
  395   HG22  VAL  50          2HG2      VAL  50  -3.278   4.992  -2.106
  396   HG23  VAL  50          3HG2      VAL  50  -2.127   4.397  -3.304
  397    H    PHE  51           H        PHE  51  -3.181   1.975  -5.124
  398    HA   PHE  51           HA       PHE  51  -0.365   2.266  -5.027
  399    HB2  PHE  51          1HB       PHE  51  -2.295   0.028  -4.973
  400    HB3  PHE  51          2HB       PHE  51  -0.702  -0.369  -5.590
  401    HD1  PHE  51           HD1      PHE  51  -1.329   2.164  -2.989
  402    HD2  PHE  51           HD2      PHE  51  -0.050  -1.806  -3.820
  403    HE1  PHE  51           HE1      PHE  51  -0.510   1.953  -0.681
  404    HE2  PHE  51           HE2      PHE  51   0.775  -2.026  -1.513
  405    HZ   PHE  51           HZ       PHE  51   0.544  -0.144   0.059
  406    H    ASN  52           H        ASN  52  -2.674   1.715  -7.558
  407    HA   ASN  52           HA       ASN  52  -0.751   1.186  -9.633
  408    HB2  ASN  52          1HB       ASN  52  -3.678   1.836  -9.563
  409    HB3  ASN  52          2HB       ASN  52  -2.798   2.085 -11.072
  410   HD21  ASN  52          1HD2      ASN  52  -1.007  -0.104 -10.828
  411   HD22  ASN  52          2HD2      ASN  52  -1.931  -1.549 -11.020
  412    H    LYS  53           H        LYS  53  -2.481   3.971  -8.407
  413    HA   LYS  53           HA       LYS  53  -1.679   5.865 -10.313
  414    HB2  LYS  53          1HB       LYS  53  -2.687   6.007  -7.502
  415    HB3  LYS  53          2HB       LYS  53  -2.165   7.475  -8.312
  416    HG2  LYS  53          1HG       LYS  53  -4.254   5.614  -9.432
  417    HG3  LYS  53          2HG       LYS  53  -4.632   6.980  -8.384
  418    HD2  LYS  53          1HD       LYS  53  -3.611   8.505 -10.007
  419    HD3  LYS  53          2HD       LYS  53  -3.222   7.134 -11.050
  420    HE2  LYS  53          1HE       LYS  53  -5.527   6.677 -11.432
  421    HE3  LYS  53          2HE       LYS  53  -6.023   7.818 -10.182
  422    HZ1  LYS  53          1HZ       LYS  53  -5.176   9.624 -11.513
  423    HZ2  LYS  53          2HZ       LYS  53  -6.291   8.723 -12.417
  424    HZ3  LYS  53          3HZ       LYS  53  -4.633   8.546 -12.704
  425    H    MET  54           H        MET  54  -0.138   4.657  -7.431
  426    HA   MET  54           HA       MET  54   1.853   6.769  -7.448
  427    HB2  MET  54          1HB       MET  54   1.335   4.456  -5.586
  428    HB3  MET  54          2HB       MET  54   2.674   5.584  -5.387
  429    HG2  MET  54          1HG       MET  54   1.216   7.382  -4.979
  430    HG3  MET  54          2HG       MET  54  -0.186   6.474  -5.534
  431    HE1  MET  54          1HE       MET  54   2.755   5.584  -2.862
  432    HE2  MET  54          2HE       MET  54   1.873   6.198  -1.461
  433    HE3  MET  54          3HE       MET  54   2.273   7.278  -2.792
  434    H    GLN  55           H        GLN  55   1.450   4.043  -9.137
  435    HA   GLN  55           HA       GLN  55   2.724   2.593 -10.273
  436    HB2  GLN  55          1HB       GLN  55   4.540   4.911  -9.900
  437    HB3  GLN  55          2HB       GLN  55   5.217   3.428 -10.580
  438    HG2  GLN  55          1HG       GLN  55   3.503   3.499 -12.338
  439    HG3  GLN  55          2HG       GLN  55   2.887   4.997 -11.654
  440   HE21  GLN  55          1HE2      GLN  55   4.046   6.894 -11.938
  441   HE22  GLN  55          2HE2      GLN  55   5.352   7.028 -13.067
  442    H    LEU  56           H        LEU  56   2.331   1.709  -7.823
  443    HA   LEU  56           HA       LEU  56   4.944   0.799  -6.878
  444    HB2  LEU  56          1HB       LEU  56   2.765   2.147  -5.466
  445    HB3  LEU  56          2HB       LEU  56   3.360   0.708  -4.624
  446    HG   LEU  56           HG       LEU  56   5.033   3.056  -5.525
  447   HD11  LEU  56          1HD1      LEU  56   4.062   2.288  -2.777
  448   HD12  LEU  56          2HD1      LEU  56   3.540   3.686  -3.708
  449   HD13  LEU  56          3HD1      LEU  56   5.202   3.580  -3.134
  450   HD21  LEU  56          1HD2      LEU  56   6.757   2.021  -4.093
  451   HD22  LEU  56          2HD2      LEU  56   6.334   1.027  -5.484
  452   HD23  LEU  56          3HD2      LEU  56   5.705   0.622  -3.886
  453    H    PHE  57           H        PHE  57   1.884  -0.061  -7.985
  454    HA   PHE  57           HA       PHE  57   2.397  -2.878  -7.375
  455    HB2  PHE  57          1HB       PHE  57   0.784  -2.140  -5.673
  456    HB3  PHE  57          2HB       PHE  57  -0.261  -1.481  -6.923
  457    HD1  PHE  57           HD1      PHE  57   1.046  -4.586  -5.434
  458    HD2  PHE  57           HD2      PHE  57  -1.780  -2.862  -8.112
  459    HE1  PHE  57           HE1      PHE  57  -0.165  -6.722  -5.531
  460    HE2  PHE  57           HE2      PHE  57  -2.988  -4.999  -8.218
  461    HZ   PHE  57           HZ       PHE  57  -2.181  -6.930  -6.924
  462    H    ASP  58           H        ASP  58   1.790  -4.244  -9.013
  463    HA   ASP  58           HA       ASP  58   0.520  -3.012 -11.368
  464    HB2  ASP  58          1HB       ASP  58   2.859  -3.327 -11.890
  465    HB3  ASP  58          2HB       ASP  58   2.813  -4.983 -11.296
  466    H    ASP  59           H        ASP  59  -0.837  -4.307 -12.591
  467    HA   ASP  59           HA       ASP  59  -2.464  -6.073 -11.098
  468    HB2  ASP  59          1HB       ASP  59  -2.389  -5.633 -14.087
  469    HB3  ASP  59          2HB       ASP  59  -3.684  -6.402 -13.197
  470    H    THR  60           H        THR  60   0.315  -6.582 -13.044
  471    HA   THR  60           HA       THR  60  -0.201  -9.455 -13.209
  472    HB   THR  60           HB       THR  60   1.753  -7.666 -14.633
  473    HG1  THR  60           HG1      THR  60  -0.179  -7.579 -15.641
  474   HG21  THR  60          1HG2      THR  60   2.492  -9.652 -15.874
  475   HG22  THR  60          2HG2      THR  60   1.522 -10.669 -14.809
  476   HG23  THR  60          3HG2      THR  60   2.887  -9.759 -14.159
  477    H    GLU  61           H        GLU  61   2.672  -7.381 -12.644
  478    HA   GLU  61           HA       GLU  61   4.143  -9.489 -11.439
  479    HB2  GLU  61          1HB       GLU  61   4.808  -6.590 -11.081
  480    HB3  GLU  61          2HB       GLU  61   5.886  -7.968 -11.194
  481    HG2  GLU  61          1HG       GLU  61   5.326  -8.219 -13.551
  482    HG3  GLU  61          2HG       GLU  61   4.260  -6.822 -13.441
  483    H    GLY  62           H        GLY  62   1.738  -7.471 -10.142
  484    HA2  GLY  62          1HA       GLY  62   0.940  -7.378  -7.962
  485    HA3  GLY  62          2HA       GLY  62   2.259  -8.455  -7.485
  486    HA   PRO  63           HA       PRO  63   3.369  -4.481  -5.464
  487    HB2  PRO  63          1HB       PRO  63   5.056  -6.370  -3.928
  488    HB3  PRO  63          2HB       PRO  63   3.930  -5.134  -3.349
  489    HG2  PRO  63          1HG       PRO  63   3.357  -7.755  -3.197
  490    HG3  PRO  63          2HG       PRO  63   2.110  -6.529  -3.488
  491    HD2  PRO  63          1HD       PRO  63   3.404  -8.422  -5.413
  492    HD3  PRO  63          2HD       PRO  63   1.719  -7.841  -5.354
  493    H    LEU  64           H        LEU  64   4.847  -3.307  -6.469
  494    HA   LEU  64           HA       LEU  64   7.072  -4.552  -7.843
  495    HB2  LEU  64          1HB       LEU  64   6.472  -1.604  -7.568
  496    HB3  LEU  64          2HB       LEU  64   7.518  -2.371  -8.745
  497    HG   LEU  64           HG       LEU  64   4.538  -2.802  -8.617
  498   HD11  LEU  64          1HD1      LEU  64   4.440  -1.417 -10.630
  499   HD12  LEU  64          2HD1      LEU  64   6.165  -1.080 -10.483
  500   HD13  LEU  64          3HD1      LEU  64   5.043  -0.503  -9.249
  501   HD21  LEU  64          1HD2      LEU  64   6.565  -3.554 -10.709
  502   HD22  LEU  64          2HD2      LEU  64   4.831  -3.881 -10.754
  503   HD23  LEU  64          3HD2      LEU  64   5.847  -4.660  -9.538
  504    H    VAL  65           H        VAL  65   8.355  -5.351  -6.283
  505    HA   VAL  65           HA       VAL  65   8.960  -4.332  -3.820
  506    HB   VAL  65           HB       VAL  65  10.671  -6.053  -5.587
  507   HG11  VAL  65          1HG1      VAL  65  10.911  -5.558  -2.622
  508   HG12  VAL  65          2HG1      VAL  65  12.046  -5.018  -3.861
  509   HG13  VAL  65          3HG1      VAL  65  11.835  -6.741  -3.552
  510   HG21  VAL  65          1HG2      VAL  65   8.549  -7.055  -5.131
  511   HG22  VAL  65          2HG2      VAL  65   8.686  -6.672  -3.416
  512   HG23  VAL  65          3HG2      VAL  65   9.765  -7.864  -4.145
  513    H    ASP  66           H        ASP  66  10.743  -3.744  -6.844
  514    HA   ASP  66           HA       ASP  66  12.909  -2.393  -5.683
  515    HB2  ASP  66          1HB       ASP  66  11.752  -2.408  -8.441
  516    HB3  ASP  66          2HB       ASP  66  13.043  -1.285  -8.030
  517    H    ASN  67           H        ASN  67   9.978  -1.004  -7.188
  518    HA   ASN  67           HA       ASN  67  10.582   1.660  -6.489
  519    HB2  ASN  67          1HB       ASN  67   7.987   0.292  -7.166
  520    HB3  ASN  67          2HB       ASN  67   8.071   2.002  -6.771
  521   HD21  ASN  67          1HD2      ASN  67   7.314   2.539  -8.817
  522   HD22  ASN  67          2HD2      ASN  67   8.328   2.448 -10.218
  523    H    LEU  68           H        LEU  68   8.967  -0.942  -4.832
  524    HA   LEU  68           HA       LEU  68   7.798   0.487  -2.734
  525    HB2  LEU  68          1HB       LEU  68   8.659  -2.345  -3.113
  526    HB3  LEU  68          2HB       LEU  68   8.163  -1.807  -1.519
  527    HG   LEU  68           HG       LEU  68   6.425  -1.441  -3.945
  528   HD11  LEU  68          1HD1      LEU  68   5.236  -3.456  -3.282
  529   HD12  LEU  68          2HD1      LEU  68   6.404  -3.735  -1.989
  530   HD13  LEU  68          3HD1      LEU  68   6.915  -3.826  -3.674
  531   HD21  LEU  68          1HD2      LEU  68   4.656  -1.266  -2.279
  532   HD22  LEU  68          2HD2      LEU  68   5.912  -0.059  -2.006
  533   HD23  LEU  68          3HD2      LEU  68   5.841  -1.499  -0.993
  534    H    VAL  69           H        VAL  69  10.964  -1.101  -2.930
  535    HA   VAL  69           HA       VAL  69  11.854  -0.310  -0.359
  536    HB   VAL  69           HB       VAL  69  13.437  -1.027  -2.822
  537   HG11  VAL  69          1HG1      VAL  69  14.256  -0.763   0.061
  538   HG12  VAL  69          2HG1      VAL  69  14.853   0.171  -1.312
  539   HG13  VAL  69          3HG1      VAL  69  15.236  -1.546  -1.180
  540   HG21  VAL  69          1HG2      VAL  69  13.600  -3.233  -1.827
  541   HG22  VAL  69          2HG2      VAL  69  11.910  -2.785  -2.059
  542   HG23  VAL  69          3HG2      VAL  69  12.633  -2.698  -0.452
  543    H    HIS  70           H        HIS  70  12.223   1.094  -3.589
  544    HA   HIS  70           HA       HIS  70  13.945   3.195  -2.923
  545    HB2  HIS  70          1HB       HIS  70  13.465   2.508  -5.229
  546    HB3  HIS  70          2HB       HIS  70  11.806   3.064  -5.059
  547    HD1  HIS  70           HD1      HIS  70  12.061   4.725  -6.997
  548    HD2  HIS  70           HD2      HIS  70  14.699   5.413  -3.856
  549    HE1  HIS  70           HE1      HIS  70  13.021   7.010  -7.406
  550    HE2  HIS  70           HE2      HIS  70  14.489   7.464  -5.413
  551    H    GLN  71           H        GLN  71  10.499   2.850  -2.502
  552    HA   GLN  71           HA       GLN  71  10.142   5.671  -1.852
  553    HB2  GLN  71          1HB       GLN  71   8.456   4.147  -3.118
  554    HB3  GLN  71          2HB       GLN  71   8.058   3.536  -1.514
  555    HG2  GLN  71          1HG       GLN  71   6.498   5.257  -2.106
  556    HG3  GLN  71          2HG       GLN  71   7.521   5.814  -0.783
  557   HE21  GLN  71          1HE2      GLN  71   7.195   7.975  -1.203
  558   HE22  GLN  71          2HE2      GLN  71   7.849   8.762  -2.588
  559    H    LEU  72           H        LEU  72   9.529   2.560  -0.251
  560    HA   LEU  72           HA       LEU  72   8.830   3.665   2.214
  561    HB2  LEU  72          1HB       LEU  72   9.778   0.904   1.494
  562    HB3  LEU  72          2HB       LEU  72   9.242   1.343   3.103
  563    HG   LEU  72           HG       LEU  72   7.531   1.589   0.632
  564   HD11  LEU  72          1HD1      LEU  72   7.552  -0.546   2.767
  565   HD12  LEU  72          2HD1      LEU  72   8.063  -0.752   1.092
  566   HD13  LEU  72          3HD1      LEU  72   6.372  -0.404   1.461
  567   HD21  LEU  72          1HD2      LEU  72   5.705   1.726   2.332
  568   HD22  LEU  72          2HD2      LEU  72   6.798   3.109   2.323
  569   HD23  LEU  72          3HD2      LEU  72   6.949   1.874   3.575
  570    H    ALA  73           H        ALA  73  11.956   2.372   1.106
  571    HA   ALA  73           HA       ALA  73  13.235   2.699   3.629
  572    HB1  ALA  73          1HB       ALA  73  14.504   2.443   0.918
  573    HB2  ALA  73          2HB       ALA  73  13.939   1.091   1.899
  574    HB3  ALA  73          3HB       ALA  73  15.254   2.117   2.482
  575    H    HIS  74           H        HIS  74  11.911   5.094   2.728
  576    HA   HIS  74           HA       HIS  74  13.848   7.006   1.852
  577    HB2  HIS  74          1HB       HIS  74  11.391   7.259   1.475
  578    HB3  HIS  74          2HB       HIS  74  11.175   7.458   3.211
  579    HD1  HIS  74           HD1      HIS  74  11.026   9.799   3.939
  580    HD2  HIS  74           HD2      HIS  74  13.196   9.421   0.407
  581    HE1  HIS  74           HE1      HIS  74  11.607  12.147   3.242
  582    HE2  HIS  74           HE2      HIS  74  12.795  11.896   1.035
  583    H    GLY  75           H        GLY  75  15.586   6.795   3.273
  584    HA2  GLY  75          1HA       GLY  75  16.680   7.979   5.032
  585    HA3  GLY  75          2HA       GLY  75  15.146   8.065   5.883
  586    H    ARG  76           H        ARG  76  16.008   5.047   4.445
  587    HA   ARG  76           HA       ARG  76  17.149   4.027   6.920
  588    HB2  ARG  76          1HB       ARG  76  14.400   3.482   6.059
  589    HB3  ARG  76          2HB       ARG  76  15.335   2.042   6.426
  590    HG2  ARG  76          1HG       ARG  76  15.939   3.209   8.614
  591    HG3  ARG  76          2HG       ARG  76  14.614   4.314   8.242
  592    HD2  ARG  76          1HD       ARG  76  13.928   2.440   9.700
  593    HD3  ARG  76          2HD       ARG  76  13.053   2.481   8.174
  594    HE   ARG  76           HE       ARG  76  15.386   0.751   8.275
  595   HH11  ARG  76          1HH1      ARG  76  11.906   0.997   8.611
  596   HH12  ARG  76          2HH1      ARG  76  11.626  -0.676   8.229
  597   HH21  ARG  76          1HH2      ARG  76  15.001  -1.464   7.783
  598   HH22  ARG  76          2HH2      ARG  76  13.360  -2.063   7.748
  599    H    ASP  77           H        ASP  77  17.679   1.693   6.735
  600    HA   ASP  77           HA       ASP  77  19.281   1.186   4.480
  601    HB2  ASP  77          1HB       ASP  77  18.335  -0.620   6.705
  602    HB3  ASP  77          2HB       ASP  77  19.535  -1.084   5.508
  603    H    ALA  78           H        ALA  78  18.571   0.767   2.564
  604    HA   ALA  78           HA       ALA  78  15.954   0.027   1.903
  605    HB1  ALA  78          1HB       ALA  78  18.456  -0.117   0.244
  606    HB2  ALA  78          2HB       ALA  78  17.407   1.290   0.432
  607    HB3  ALA  78          3HB       ALA  78  16.804  -0.159  -0.370
  608    H    GLU  79           H        GLU  79  18.883  -1.913   2.238
  609    HA   GLU  79           HA       GLU  79  17.867  -4.187   0.876
  610    HB2  GLU  79          1HB       GLU  79  20.113  -3.973   2.876
  611    HB3  GLU  79          2HB       GLU  79  19.788  -5.380   1.873
  612    HG2  GLU  79          1HG       GLU  79  20.117  -3.971  -0.131
  613    HG3  GLU  79          2HG       GLU  79  20.570  -2.633   0.919
  614    H    GLU  80           H        GLU  80  17.860  -3.154   4.217
  615    HA   GLU  80           HA       GLU  80  16.685  -5.516   5.278
  616    HB2  GLU  80          1HB       GLU  80  16.971  -2.693   6.244
  617    HB3  GLU  80          2HB       GLU  80  15.986  -3.847   7.132
  618    HG2  GLU  80          1HG       GLU  80  18.286  -3.640   7.998
  619    HG3  GLU  80          2HG       GLU  80  17.864  -5.268   7.503
  620    H    VAL  81           H        VAL  81  15.395  -2.384   4.237
  621    HA   VAL  81           HA       VAL  81  12.692  -2.792   4.692
  622    HB   VAL  81           HB       VAL  81  14.057  -1.227   2.507
  623   HG11  VAL  81          1HG1      VAL  81  11.778  -1.677   1.799
  624   HG12  VAL  81          2HG1      VAL  81  11.934   0.012   2.292
  625   HG13  VAL  81          3HG1      VAL  81  11.169  -1.158   3.371
  626   HG21  VAL  81          1HG2      VAL  81  13.478   0.669   3.985
  627   HG22  VAL  81          2HG2      VAL  81  14.628  -0.468   4.682
  628   HG23  VAL  81          3HG2      VAL  81  12.939  -0.497   5.193
  629    H    ARG  82           H        ARG  82  14.590  -3.587   1.790
  630    HA   ARG  82           HA       ARG  82  12.663  -4.668   0.150
  631    HB2  ARG  82          1HB       ARG  82  15.041  -4.318  -0.427
  632    HB3  ARG  82          2HB       ARG  82  15.468  -5.706   0.560
  633    HG2  ARG  82          1HG       ARG  82  14.119  -7.140  -0.894
  634    HG3  ARG  82          2HG       ARG  82  13.747  -5.739  -1.900
  635    HD2  ARG  82          1HD       ARG  82  16.128  -5.430  -2.340
  636    HD3  ARG  82          2HD       ARG  82  16.496  -6.836  -1.350
  637    HE   ARG  82           HE       ARG  82  14.838  -7.874  -3.180
  638   HH11  ARG  82          1HH1      ARG  82  17.647  -5.813  -3.473
  639   HH12  ARG  82          2HH1      ARG  82  18.112  -6.440  -5.024
  640   HH21  ARG  82          1HH2      ARG  82  15.440  -8.709  -5.227
  641   HH22  ARG  82          2HH2      ARG  82  16.849  -8.089  -6.025
  642    H    THR  83           H        THR  83  14.413  -6.224   2.788
  643    HA   THR  83           HA       THR  83  13.386  -8.819   2.385
  644    HB   THR  83           HB       THR  83  14.682  -7.422   4.704
  645    HG1  THR  83           HG1      THR  83  15.925  -8.110   2.864
  646   HG21  THR  83          1HG2      THR  83  13.779 -10.305   4.657
  647   HG22  THR  83          2HG2      THR  83  13.123  -9.031   5.688
  648   HG23  THR  83          3HG2      THR  83  14.794  -9.561   5.893
  649    H    GLU  84           H        GLU  84  12.478  -6.254   4.693
  650    HA   GLU  84           HA       GLU  84  10.333  -7.523   5.915
  651    HB2  GLU  84          1HB       GLU  84  10.531  -4.564   5.326
  652    HB3  GLU  84          2HB       GLU  84   9.613  -5.325   6.619
  653    HG2  GLU  84          1HG       GLU  84  11.754  -6.162   7.554
  654    HG3  GLU  84          2HG       GLU  84  12.603  -5.208   6.343
  655    H    VAL  85           H        VAL  85  10.344  -5.489   2.985
  656    HA   VAL  85           HA       VAL  85   7.612  -5.515   2.437
  657    HB   VAL  85           HB       VAL  85  10.016  -5.352   0.629
  658   HG11  VAL  85          1HG1      VAL  85   7.117  -5.088  -0.165
  659   HG12  VAL  85          2HG1      VAL  85   8.227  -6.360  -0.677
  660   HG13  VAL  85          3HG1      VAL  85   8.500  -4.693  -1.189
  661   HG21  VAL  85          1HG2      VAL  85   9.312  -3.020   0.410
  662   HG22  VAL  85          2HG2      VAL  85   9.615  -3.460   2.092
  663   HG23  VAL  85          3HG2      VAL  85   7.957  -3.332   1.498
  664    H    LEU  86           H        LEU  86  10.143  -7.775   1.350
  665    HA   LEU  86           HA       LEU  86   8.555  -9.390  -0.266
  666    HB2  LEU  86          1HB       LEU  86  11.058 -10.006   1.294
  667    HB3  LEU  86          2HB       LEU  86  10.317 -11.143   0.171
  668    HG   LEU  86           HG       LEU  86  11.185  -8.387  -0.660
  669   HD11  LEU  86          1HD1      LEU  86  12.748 -10.954  -0.874
  670   HD12  LEU  86          2HD1      LEU  86  13.095  -9.647   0.258
  671   HD13  LEU  86          3HD1      LEU  86  13.233  -9.369  -1.480
  672   HD21  LEU  86          1HD2      LEU  86   9.599  -9.444  -2.136
  673   HD22  LEU  86          2HD2      LEU  86  10.559 -10.922  -2.161
  674   HD23  LEU  86          3HD2      LEU  86  11.192  -9.444  -2.891
  675    H    LYS  87           H        LYS  87   8.919  -9.346   3.199
  676    HA   LYS  87           HA       LYS  87   7.734 -11.924   3.645
  677    HB2  LYS  87          1HB       LYS  87   8.285  -9.582   5.467
  678    HB3  LYS  87          2HB       LYS  87   7.548 -11.080   6.025
  679    HG2  LYS  87          1HG       LYS  87   9.513 -12.328   5.351
  680    HG3  LYS  87          2HG       LYS  87  10.256 -10.846   4.725
  681    HD2  LYS  87          1HD       LYS  87  10.258  -9.896   6.969
  682    HD3  LYS  87          2HD       LYS  87   9.476 -11.349   7.598
  683    HE2  LYS  87          1HE       LYS  87  12.205 -11.189   6.326
  684    HE3  LYS  87          2HE       LYS  87  11.862 -11.409   8.040
  685    HZ1  LYS  87          1HZ       LYS  87  12.401 -13.504   7.016
  686    HZ2  LYS  87          2HZ       LYS  87  11.182 -13.309   5.862
  687    HZ3  LYS  87          3HZ       LYS  87  10.779 -13.516   7.491
  688    H    CYS  88           H        CYS  88   6.520  -8.977   2.690
  689    HA   CYS  88           HA       CYS  88   3.843  -9.629   3.699
  690    HB2  CYS  88          1HB       CYS  88   5.177  -7.034   3.043
  691    HB3  CYS  88          2HB       CYS  88   3.407  -7.157   2.969
  692    H    VAL  89           H        VAL  89   5.810  -9.553   0.952
  693    HA   VAL  89           HA       VAL  89   3.827  -9.197  -1.046
  694    HB   VAL  89           HB       VAL  89   6.496 -10.607  -1.146
  695   HG11  VAL  89          1HG1      VAL  89   4.635  -9.839  -3.389
  696   HG12  VAL  89          2HG1      VAL  89   5.045 -11.480  -2.886
  697   HG13  VAL  89          3HG1      VAL  89   6.281 -10.440  -3.595
  698   HG21  VAL  89          1HG2      VAL  89   5.619  -7.865  -2.039
  699   HG22  VAL  89          2HG2      VAL  89   7.200  -8.578  -2.369
  700   HG23  VAL  89          3HG2      VAL  89   6.713  -8.245  -0.707
  701    H    ASP  90           H        ASP  90   2.097 -10.425  -1.061
  702    HA   ASP  90           HA       ASP  90   2.360 -13.292  -0.481
  703    HB2  ASP  90          1HB       ASP  90   0.915 -11.699   0.991
  704    HB3  ASP  90          2HB       ASP  90  -0.227 -11.766  -0.353
  705    H    LYS  91           H        LYS  91   0.324 -14.467  -1.557
  706    HA   LYS  91           HA       LYS  91   0.651 -13.872  -4.398
  707    HB2  LYS  91          1HB       LYS  91   1.377 -15.995  -4.261
  708    HB3  LYS  91          2HB       LYS  91   0.444 -16.377  -2.838
  709    HG2  LYS  91          1HG       LYS  91  -1.549 -16.620  -4.289
  710    HG3  LYS  91          2HG       LYS  91  -0.526 -16.298  -5.689
  711    HD2  LYS  91          1HD       LYS  91   0.876 -18.252  -5.021
  712    HD3  LYS  91          2HD       LYS  91  -0.311 -18.610  -3.767
  713    HE2  LYS  91          1HE       LYS  91  -0.741 -19.987  -5.700
  714    HE3  LYS  91          2HE       LYS  91  -2.043 -18.818  -5.509
  715    HZ1  LYS  91          1HZ       LYS  91  -1.297 -19.055  -7.821
  716    HZ2  LYS  91          2HZ       LYS  91   0.239 -18.506  -7.383
  717    HZ3  LYS  91          3HZ       LYS  91  -1.096 -17.479  -7.246
  718    H    ASN  92           H        ASN  92  -1.160 -14.026  -5.832
  719    HA   ASN  92           HA       ASN  92  -3.557 -12.885  -4.742
  720    HB2  ASN  92          1HB       ASN  92  -2.603 -12.271  -6.971
  721    HB3  ASN  92          2HB       ASN  92  -3.035 -13.871  -7.548
  722   HD21  ASN  92          1HD2      ASN  92  -4.267 -12.816  -9.151
  723   HD22  ASN  92          2HD2      ASN  92  -5.850 -12.209  -8.800
  724    H    THR  93           H        THR  93  -3.854 -14.800  -3.297
  725    HA   THR  93           HA       THR  93  -4.921 -17.206  -4.471
  726    HB   THR  93           HB       THR  93  -5.405 -17.820  -2.101
  727    HG1  THR  93           HG1      THR  93  -5.226 -16.361  -0.560
  728   HG21  THR  93          1HG2      THR  93  -3.267 -18.385  -3.127
  729   HG22  THR  93          2HG2      THR  93  -3.078 -18.018  -1.414
  730   HG23  THR  93          3HG2      THR  93  -2.613 -16.827  -2.627
  731    H    ASP  94           H        ASP  94  -6.186 -14.170  -3.490
  732    HA   ASP  94           HA       ASP  94  -8.873 -15.176  -3.056
  733    HB2  ASP  94          1HB       ASP  94  -7.989 -13.296  -1.693
  734    HB3  ASP  94          2HB       ASP  94  -7.900 -12.308  -3.155
  735    H    ASN  95           H        ASN  95  -6.991 -14.350  -5.652
  736    HA   ASN  95           HA       ASN  95  -7.335 -14.070  -7.861
  737    HB2  ASN  95          1HB       ASN  95  -8.876 -16.052  -7.283
  738    HB3  ASN  95          2HB       ASN  95 -10.191 -14.910  -7.460
  739   HD21  ASN  95          1HD2      ASN  95  -9.053 -13.431  -9.663
  740   HD22  ASN  95          2HD2      ASN  95  -9.092 -14.488 -11.044
  741    H    ASN  96           H        ASN  96  -7.610 -11.846  -6.204
  742    HA   ASN  96           HA       ASN  96  -9.266 -10.115  -7.832
  743    HB2  ASN  96          1HB       ASN  96 -10.922 -10.724  -6.255
  744    HB3  ASN  96          2HB       ASN  96  -9.782 -10.678  -4.916
  745   HD21  ASN  96          1HD2      ASN  96 -11.076  -9.346  -3.730
  746   HD22  ASN  96          2HD2      ASN  96 -11.306  -7.670  -4.103
  747    H    ALA  97           H        ALA  97  -8.097  -8.373  -8.240
  748    HA   ALA  97           HA       ALA  97  -5.528  -8.024  -7.153
  749    HB1  ALA  97          1HB       ALA  97  -6.185  -7.353  -9.435
  750    HB2  ALA  97          2HB       ALA  97  -5.368  -6.069  -8.544
  751    HB3  ALA  97          3HB       ALA  97  -7.118  -6.025  -8.748
  752    H    CYS  98           H        CYS  98  -8.614  -6.499  -6.391
  753    HA   CYS  98           HA       CYS  98  -7.644  -4.370  -4.827
  754    HB2  CYS  98          1HB       CYS  98 -10.199  -5.937  -4.425
  755    HB3  CYS  98          2HB       CYS  98  -9.837  -4.358  -3.742
  756    H    HIS  99           H        HIS  99  -8.259  -7.750  -4.040
  757    HA   HIS  99           HA       HIS  99  -7.756  -7.309  -1.225
  758    HB2  HIS  99          1HB       HIS  99  -9.375  -9.031  -2.290
  759    HB3  HIS  99          2HB       HIS  99  -7.931 -10.002  -2.555
  760    HD1  HIS  99           HD1      HIS  99 -10.563  -9.613  -0.228
  761    HD2  HIS  99           HD2      HIS  99  -6.482 -10.324   0.117
  762    HE1  HIS  99           HE1      HIS  99 -10.242 -10.604   2.058
  763    HE2  HIS  99           HE2      HIS  99  -7.749 -10.869   2.305
  764    H    TRP 100           H        TRP 100  -6.035  -8.355  -4.046
  765    HA   TRP 100           HA       TRP 100  -3.870  -9.654  -2.779
  766    HB2  TRP 100          1HB       TRP 100  -4.439  -9.870  -5.201
  767    HB3  TRP 100          2HB       TRP 100  -3.865  -8.222  -5.454
  768    HD1  TRP 100           HD1      TRP 100  -1.592  -9.872  -3.070
  769    HE1  TRP 100           HE1      TRP 100   0.523 -10.721  -4.259
  770    HE3  TRP 100           HE3      TRP 100  -3.165  -9.453  -7.925
  771    HZ2  TRP 100           HZ2      TRP 100   1.407 -11.158  -6.904
  772    HZ3  TRP 100           HZ3      TRP 100  -1.620 -10.105  -9.722
  773    HH2  TRP 100           HH2      TRP 100   0.618 -10.941  -9.225
  774    H    ALA 101           H        ALA 101  -4.194  -6.357  -4.087
  775    HA   ALA 101           HA       ALA 101  -1.675  -5.449  -3.173
  776    HB1  ALA 101          1HB       ALA 101  -4.150  -3.870  -3.856
  777    HB2  ALA 101          2HB       ALA 101  -2.877  -4.342  -4.979
  778    HB3  ALA 101          3HB       ALA 101  -2.528  -3.207  -3.673
  779    H    PHE 102           H        PHE 102  -4.901  -5.439  -1.788
  780    HA   PHE 102           HA       PHE 102  -4.341  -3.721   0.362
  781    HB2  PHE 102          1HB       PHE 102  -6.612  -4.188  -0.397
  782    HB3  PHE 102          2HB       PHE 102  -6.470  -5.851   0.157
  783    HD1  PHE 102           HD1      PHE 102  -6.250  -2.345   1.370
  784    HD2  PHE 102           HD2      PHE 102  -7.191  -6.390   2.308
  785    HE1  PHE 102           HE1      PHE 102  -7.070  -1.639   3.578
  786    HE2  PHE 102           HE2      PHE 102  -8.014  -5.689   4.516
  787    HZ   PHE 102           HZ       PHE 102  -7.952  -3.309   5.156
  788    H    ARG 103           H        ARG 103  -3.995  -7.187  -0.086
  789    HA   ARG 103           HA       ARG 103  -3.594  -7.869   2.637
  790    HB2  ARG 103          1HB       ARG 103  -4.157  -9.523   0.866
  791    HB3  ARG 103          2HB       ARG 103  -2.556  -9.280   0.180
  792    HG2  ARG 103          1HG       ARG 103  -1.518 -10.123   2.191
  793    HG3  ARG 103          2HG       ARG 103  -3.095 -10.290   2.954
  794    HD2  ARG 103          1HD       ARG 103  -2.303 -11.741   0.430
  795    HD3  ARG 103          2HD       ARG 103  -2.110 -12.416   2.043
  796    HE   ARG 103           HE       ARG 103  -4.717 -11.763   2.001
  797   HH11  ARG 103          1HH1      ARG 103  -2.673 -13.550  -0.214
  798   HH12  ARG 103          2HH1      ARG 103  -3.953 -14.602  -0.741
  799   HH21  ARG 103          1HH2      ARG 103  -6.400 -13.169   1.332
  800   HH22  ARG 103          2HH2      ARG 103  -6.070 -14.390   0.142
  801    H    GLY 104           H        GLY 104  -1.431  -6.936   0.016
  802    HA2  GLY 104          1HA       GLY 104   1.011  -7.305   1.418
  803    HA3  GLY 104          2HA       GLY 104   0.769  -6.264   0.010
  804    H    PHE 105           H        PHE 105  -1.048  -4.458   0.933
  805    HA   PHE 105           HA       PHE 105   0.572  -2.635   2.308
  806    HB2  PHE 105          1HB       PHE 105  -1.080  -1.767   0.850
  807    HB3  PHE 105          2HB       PHE 105  -2.359  -2.660   1.657
  808    HD1  PHE 105           HD1      PHE 105   0.329  -0.339   2.789
  809    HD2  PHE 105           HD2      PHE 105  -3.837  -1.223   2.710
  810    HE1  PHE 105           HE1      PHE 105  -0.124   1.649   4.165
  811    HE2  PHE 105           HE2      PHE 105  -4.286   0.756   4.091
  812    HZ   PHE 105           HZ       PHE 105  -2.427   2.195   4.824
  813    H    LYS 106           H        LYS 106  -2.187  -4.569   3.355
  814    HA   LYS 106           HA       LYS 106  -2.402  -3.484   5.929
  815    HB2  LYS 106          1HB       LYS 106  -4.313  -4.556   5.282
  816    HB3  LYS 106          2HB       LYS 106  -3.460  -5.918   4.560
  817    HG2  LYS 106          1HG       LYS 106  -2.977  -6.749   6.832
  818    HG3  LYS 106          2HG       LYS 106  -3.891  -5.388   7.493
  819    HD2  LYS 106          1HD       LYS 106  -5.906  -6.156   6.441
  820    HD3  LYS 106          2HD       LYS 106  -5.028  -7.416   5.575
  821    HE2  LYS 106          1HE       LYS 106  -5.279  -7.235   8.571
  822    HE3  LYS 106          2HE       LYS 106  -6.272  -8.264   7.540
  823    HZ1  LYS 106          1HZ       LYS 106  -4.230  -9.379   6.812
  824    HZ2  LYS 106          2HZ       LYS 106  -4.475  -9.529   8.476
  825    HZ3  LYS 106          3HZ       LYS 106  -3.329  -8.439   7.887
  826    H    CYS 107           H        CYS 107  -0.633  -6.291   4.709
  827    HA   CYS 107           HA       CYS 107   0.287  -7.270   7.162
  828    HB2  CYS 107          1HB       CYS 107   0.510  -8.680   5.282
  829    HB3  CYS 107          2HB       CYS 107   1.360  -7.458   4.346
  830    H    PHE 108           H        PHE 108   1.592  -4.832   4.963
  831    HA   PHE 108           HA       PHE 108   4.089  -4.668   6.332
  832    HB2  PHE 108          1HB       PHE 108   3.637  -4.187   3.869
  833    HB3  PHE 108          2HB       PHE 108   3.036  -2.619   4.411
  834    HD1  PHE 108           HD1      PHE 108   4.558  -0.925   5.196
  835    HD2  PHE 108           HD2      PHE 108   5.975  -4.792   4.114
  836    HE1  PHE 108           HE1      PHE 108   6.869  -0.085   5.221
  837    HE2  PHE 108           HE2      PHE 108   8.283  -3.956   4.141
  838    HZ   PHE 108           HZ       PHE 108   8.732  -1.602   4.691
  839    H    GLN 109           H        GLN 109   1.158  -2.639   6.242
  840    HA   GLN 109           HA       GLN 109   2.229  -0.686   8.017
  841    HB2  GLN 109          1HB       GLN 109  -0.076   0.135   8.208
  842    HB3  GLN 109          2HB       GLN 109   0.420  -0.092   6.539
  843    HG2  GLN 109          1HG       GLN 109  -1.316  -1.390   6.168
  844    HG3  GLN 109          2HG       GLN 109  -0.838  -2.476   7.478
  845   HE21  GLN 109          1HE2      GLN 109  -1.866  -2.335   9.436
  846   HE22  GLN 109          2HE2      GLN 109  -3.262  -1.352   9.703
  847    H    LYS 110           H        LYS 110   1.295  -3.821   8.536
  848    HA   LYS 110           HA       LYS 110   0.306  -3.465  11.229
  849    HB2  LYS 110          1HB       LYS 110  -0.447  -5.262   9.619
  850    HB3  LYS 110          2HB       LYS 110   1.134  -5.994   9.817
  851    HG2  LYS 110          1HG       LYS 110   0.718  -6.300  12.186
  852    HG3  LYS 110          2HG       LYS 110  -0.875  -5.569  12.007
  853    HD2  LYS 110          1HD       LYS 110  -1.459  -7.354  10.391
  854    HD3  LYS 110          2HD       LYS 110   0.105  -8.105  10.700
  855    HE2  LYS 110          1HE       LYS 110  -1.575  -9.222  12.008
  856    HE3  LYS 110          2HE       LYS 110  -0.514  -8.316  13.085
  857    HZ1  LYS 110          1HZ       LYS 110  -3.200  -7.446  12.163
  858    HZ2  LYS 110          2HZ       LYS 110  -2.185  -6.571  13.192
  859    HZ3  LYS 110          3HZ       LYS 110  -2.828  -8.049  13.699
  860    H    ASN 111           H        ASN 111   3.314  -3.815   9.633
  861    HA   ASN 111           HA       ASN 111   4.672  -4.367  12.195
  862    HB2  ASN 111          1HB       ASN 111   5.990  -6.026  11.293
  863    HB3  ASN 111          2HB       ASN 111   4.479  -6.288  10.455
  864   HD21  ASN 111          1HD2      ASN 111   4.282  -5.833   8.282
  865   HD22  ASN 111          2HD2      ASN 111   5.664  -5.583   7.273
  866    H    ASN 112           H        ASN 112   4.498  -2.435   9.379
  867    HA   ASN 112           HA       ASN 112   6.649  -0.766  10.428
  868    HB2  ASN 112          1HB       ASN 112   6.707  -2.090   7.758
  869    HB3  ASN 112          2HB       ASN 112   7.254  -0.420   7.868
  870   HD21  ASN 112          1HD2      ASN 112   7.978  -3.694   8.544
  871   HD22  ASN 112          2HD2      ASN 112   9.582  -3.434   9.150
  872    H    LEU 113           H        LEU 113   4.446   0.274  10.947
  873    HA   LEU 113           HA       LEU 113   3.189   1.550   8.672
  874    HB2  LEU 113          1HB       LEU 113   1.720   0.880  10.418
  875    HB3  LEU 113          2HB       LEU 113   2.658   1.732  11.629
  876    HG   LEU 113           HG       LEU 113   2.016   3.873  10.512
  877   HD11  LEU 113          1HD1      LEU 113   0.224   3.875   8.893
  878   HD12  LEU 113          2HD1      LEU 113   0.144   2.115   8.944
  879   HD13  LEU 113          3HD1      LEU 113   1.575   2.912   8.289
  880   HD21  LEU 113          1HD2      LEU 113   0.820   3.101  12.469
  881   HD22  LEU 113          2HD2      LEU 113  -0.219   2.094  11.464
  882   HD23  LEU 113          3HD2      LEU 113  -0.305   3.851  11.336
  883    H    SER 114           H        SER 114   5.339   2.407  11.293
  884    HA   SER 114           HA       SER 114   5.296   5.204  10.975
  885    HB2  SER 114          1HB       SER 114   7.685   3.580  11.864
  886    HB3  SER 114          2HB       SER 114   7.241   5.215  12.352
  887    HG   SER 114           HG       SER 114   6.048   4.391  13.860
  888    H    LEU 115           H        LEU 115   7.131   2.655   9.410
  889    HA   LEU 115           HA       LEU 115   8.902   4.298   7.962
  890    HB2  LEU 115          1HB       LEU 115   9.212   1.880   8.327
  891    HB3  LEU 115          2HB       LEU 115   7.854   1.556   7.267
  892    HG   LEU 115           HG       LEU 115   9.105   2.611   5.402
  893   HD11  LEU 115          1HD1      LEU 115  11.232   2.813   7.506
  894   HD12  LEU 115          2HD1      LEU 115  10.528   4.116   6.551
  895   HD13  LEU 115          3HD1      LEU 115  11.567   2.917   5.779
  896   HD21  LEU 115          1HD2      LEU 115   9.160   0.183   5.762
  897   HD22  LEU 115          2HD2      LEU 115  10.589   0.374   6.778
  898   HD23  LEU 115          3HD2      LEU 115  10.662   0.784   5.063
  899    H    ILE 116           H        ILE 116   5.646   3.140   7.363
  900    HA   ILE 116           HA       ILE 116   5.486   3.904   4.647
  901    HB   ILE 116           HB       ILE 116   3.268   3.595   6.687
  902   HG12  ILE 116          1HG1      ILE 116   4.358   1.687   4.600
  903   HG13  ILE 116          2HG1      ILE 116   4.556   1.541   6.353
  904   HG21  ILE 116          1HG2      ILE 116   2.519   4.953   4.828
  905   HG22  ILE 116          2HG2      ILE 116   1.797   3.345   4.726
  906   HG23  ILE 116          3HG2      ILE 116   3.150   3.772   3.679
  907   HD11  ILE 116          1HD1      ILE 116   2.049   1.252   4.734
  908   HD12  ILE 116          2HD1      ILE 116   2.044   1.415   6.491
  909   HD13  ILE 116          3HD1      ILE 116   2.852   0.042   5.731
  910    H    LYS 117           H        LYS 117   4.665   5.520   7.672
  911    HA   LYS 117           HA       LYS 117   3.607   7.872   6.546
  912    HB2  LYS 117          1HB       LYS 117   4.897   7.331   9.216
  913    HB3  LYS 117          2HB       LYS 117   4.175   8.878   8.796
  914    HG2  LYS 117          1HG       LYS 117   2.014   7.801   8.487
  915    HG3  LYS 117          2HG       LYS 117   2.722   6.232   8.861
  916    HD2  LYS 117          1HD       LYS 117   3.280   7.011  11.108
  917    HD3  LYS 117          2HD       LYS 117   2.615   8.599  10.736
  918    HE2  LYS 117          1HE       LYS 117   0.406   7.656  10.473
  919    HE3  LYS 117          2HE       LYS 117   1.042   6.028  10.690
  920    HZ1  LYS 117          1HZ       LYS 117   0.006   6.879  12.707
  921    HZ2  LYS 117          2HZ       LYS 117   1.090   8.175  12.741
  922    HZ3  LYS 117          3HZ       LYS 117   1.655   6.593  12.949
  923    H    ALA 118           H        ALA 118   6.873   6.922   7.483
  924    HA   ALA 118           HA       ALA 118   8.012   9.506   7.028
  925    HB1  ALA 118          1HB       ALA 118  10.136   8.398   7.430
  926    HB2  ALA 118          2HB       ALA 118   9.340   6.826   7.340
  927    HB3  ALA 118          3HB       ALA 118   8.939   7.945   8.642
  928    H    SER 119           H        SER 119   7.281   6.830   4.972
  929    HA   SER 119           HA       SER 119   9.287   7.314   3.025
  930    HB2  SER 119          1HB       SER 119   8.094   5.769   1.613
  931    HB3  SER 119          2HB       SER 119   8.059   5.150   3.262
  932    HG   SER 119           HG       SER 119   5.933   5.917   3.453
  933    H    ILE 120           H        ILE 120   6.036   8.514   3.522
  934    HA   ILE 120           HA       ILE 120   6.147  10.004   1.010
  935    HB   ILE 120           HB       ILE 120   3.800  10.620   1.499
  936   HG12  ILE 120          1HG1      ILE 120   4.008   8.704   3.825
  937   HG13  ILE 120          2HG1      ILE 120   4.054  10.457   4.001
  938   HG21  ILE 120          1HG2      ILE 120   4.254   8.666   0.151
  939   HG22  ILE 120          2HG2      ILE 120   2.851   8.367   1.179
  940   HG23  ILE 120          3HG2      ILE 120   4.417   7.675   1.600
  941   HD11  ILE 120          1HD1      ILE 120   1.823  10.611   3.041
  942   HD12  ILE 120          2HD1      ILE 120   1.846   9.579   4.472
  943   HD13  ILE 120          3HD1      ILE 120   1.778   8.858   2.863
  944    H    LYS 121           H        LYS 121   6.943  10.430   4.230
  945    HA   LYS 121           HA       LYS 121   6.215  13.241   4.351
  946    HB2  LYS 121          1HB       LYS 121   6.067  11.489   6.268
  947    HB3  LYS 121          2HB       LYS 121   7.792  11.778   6.435
  948    HG2  LYS 121          1HG       LYS 121   6.588  13.163   7.995
  949    HG3  LYS 121          2HG       LYS 121   7.310  14.188   6.751
  950    HD2  LYS 121          1HD       LYS 121   5.209  14.418   5.628
  951    HD3  LYS 121          2HD       LYS 121   4.460  13.212   6.673
  952    HE2  LYS 121          1HE       LYS 121   5.588  15.823   7.661
  953    HE3  LYS 121          2HE       LYS 121   3.900  15.596   7.216
  954    HZ1  LYS 121          1HZ       LYS 121   3.669  13.951   8.935
  955    HZ2  LYS 121          2HZ       LYS 121   4.301  15.365   9.612
  956    HZ3  LYS 121          3HZ       LYS 121   5.312  14.046   9.315
  957    H    LYS 122           H        LYS 122   7.583  14.824   3.829
  958    HA   LYS 122           HA       LYS 122  10.429  14.147   3.579
  959    HB2  LYS 122          1HB       LYS 122  10.535  16.018   1.929
  960    HB3  LYS 122          2HB       LYS 122   9.595  14.650   1.404
  961    HG2  LYS 122          1HG       LYS 122   7.531  15.881   2.072
  962    HG3  LYS 122          2HG       LYS 122   8.543  17.284   2.418
  963    HD2  LYS 122          1HD       LYS 122   9.320  17.280   0.088
  964    HD3  LYS 122          2HD       LYS 122   8.273  15.902  -0.250
  965    HE2  LYS 122          1HE       LYS 122   7.161  17.880  -1.005
  966    HE3  LYS 122          2HE       LYS 122   6.326  17.301   0.435
  967    HZ1  LYS 122          1HZ       LYS 122   7.548  18.959   1.732
  968    HZ2  LYS 122          2HZ       LYS 122   6.606  19.679   0.527
  969    HZ3  LYS 122          3HZ       LYS 122   8.278  19.534   0.319
  970    H    ASP 123           H        ASP 123  10.387  14.578   5.889
  971    HA   ASP 123           HA       ASP 123   9.831  17.211   6.865
  972    HB2  ASP 123          1HB       ASP 123   9.538  15.222   8.286
  973    HB3  ASP 123          2HB       ASP 123  11.275  14.931   8.226
  974    H21  ACD 201           H21      ACD   1  -4.673   4.776   1.295
  975    H22  ACD 201           H22      ACD   1  -3.580   4.762   2.684
  976    H31  ACD 201           H31      ACD   1  -2.076   6.355   1.400
  977    H32  ACD 201           H32      ACD   1  -3.111   6.122  -0.007
  978    H41  ACD 201           H41      ACD   1  -2.655   3.635   0.145
  979    H42  ACD 201           H42      ACD   1  -1.212   4.604  -0.193
  980    H5   ACD 201           H5       ACD   1  -1.832   3.109   2.403
  981    H6   ACD 201           H6       ACD   1   0.389   3.794   2.960
  982    H71  ACD 201           H71      ACD   1   0.811   4.844   0.271
  983    H72  ACD 201           H72      ACD   1  -0.070   6.106   1.131
  984    H8   ACD 201           H8       ACD   1   1.835   6.398   2.733
  985    H9   ACD 201           H9       ACD   1   3.930   5.510   2.015
  986   H101  ACD 201          H101      ACD   1   2.829   4.761  -0.553
  987   H102  ACD 201          H102      ACD   1   2.322   3.458   0.525
  988    H11  ACD 201           H11      ACD   1   5.311   4.239   0.404
  989    H12  ACD 201           H12      ACD   1   5.545   1.901   0.046
  990   H131  ACD 201          H131      ACD   1   2.572   2.053  -0.636
  991   H132  ACD 201          H132      ACD   1   3.612   0.632  -0.766
  992    H14  ACD 201           H14      ACD   1   2.503   1.688   1.936
  993    H15  ACD 201           H15      ACD   1   2.404  -0.646   2.381
  994   H161  ACD 201          H161      ACD   1   2.602  -1.385  -0.392
  995   H162  ACD 201          H162      ACD   1   4.256  -0.916   0.015
  996   H171  ACD 201          H171      ACD   1   4.391  -2.563   1.775
  997   H172  ACD 201          H172      ACD   1   2.663  -2.905   1.667
  998   H181  ACD 201          H181      ACD   1   4.693  -3.449  -0.540
  999   H182  ACD 201          H182      ACD   1   2.966  -3.807  -0.623
 1000   H191  ACD 201          H191      ACD   1   4.966  -4.995   1.350
 1001   H192  ACD 201          H192      ACD   1   3.226  -5.288   1.407
 1002   H201  ACD 201          H201      ACD   1   5.045  -5.981  -0.913
 1003   H202  ACD 201          H202      ACD   1   3.336  -6.259  -0.864
 1004   H203  ACD 201          H203      ACD   1   4.382  -7.099   0.232
  Start of MODEL   19
    1    H1   MET   1          1H        MET   1  16.903  14.875 -15.447
    2    H2   MET   1          2H        MET   1  17.505  15.327 -13.937
    3    H3   MET   1          3H        MET   1  15.869  14.949 -14.113
    4    HA   MET   1           HA       MET   1  16.408  12.672 -14.637
    5    HB2  MET   1          1HB       MET   1  19.249  13.574 -14.108
    6    HB3  MET   1          2HB       MET   1  18.747  11.901 -14.300
    7    HG2  MET   1          1HG       MET   1  18.011  12.408 -16.589
    8    HG3  MET   1          2HG       MET   1  18.579  14.064 -16.386
    9    HE1  MET   1          1HE       MET   1  21.185  12.417 -18.852
   10    HE2  MET   1          2HE       MET   1  20.035  13.735 -18.637
   11    HE3  MET   1          3HE       MET   1  19.458  12.073 -18.756
   12    H    GLU   2           H        GLU   2  15.012  13.149 -12.740
   13    HA   GLU   2           HA       GLU   2  16.384  12.364 -10.273
   14    HB2  GLU   2          1HB       GLU   2  14.325  14.559 -10.441
   15    HB3  GLU   2          2HB       GLU   2  15.042  13.935  -8.969
   16    HG2  GLU   2          1HG       GLU   2  17.226  14.762  -9.705
   17    HG3  GLU   2          2HG       GLU   2  16.469  15.412 -11.160
   18    H    PHE   3           H        PHE   3  15.471  10.607  -9.509
   19    HA   PHE   3           HA       PHE   3  12.991   9.579 -10.393
   20    HB2  PHE   3          1HB       PHE   3  14.711   8.102  -9.523
   21    HB3  PHE   3          2HB       PHE   3  14.643   8.897  -7.947
   22    HD1  PHE   3           HD1      PHE   3  12.693   6.839 -10.326
   23    HD2  PHE   3           HD2      PHE   3  13.146   8.176  -6.317
   24    HE1  PHE   3           HE1      PHE   3  10.992   5.215  -9.600
   25    HE2  PHE   3           HE2      PHE   3  11.443   6.557  -5.577
   26    HZ   PHE   3           HZ       PHE   3  10.366   5.072  -7.222
   27    H    THR   4           H        THR   4  11.015  10.146  -9.834
   28    HA   THR   4           HA       THR   4  10.692  12.007  -7.590
   29    HB   THR   4           HB       THR   4   8.347  11.518  -9.282
   30    HG1  THR   4           HG1      THR   4  10.837  12.253 -10.390
   31   HG21  THR   4          1HG2      THR   4   8.321  13.969  -9.305
   32   HG22  THR   4          2HG2      THR   4   9.886  13.984  -8.491
   33   HG23  THR   4          3HG2      THR   4   8.471  13.323  -7.673
   34    H    VAL   5           H        VAL   5   9.926  11.326  -5.770
   35    HA   VAL   5           HA       VAL   5   8.418   8.804  -5.643
   36    HB   VAL   5           HB       VAL   5   9.134   8.517  -3.497
   37   HG11  VAL   5          1HG1      VAL   5  11.220  10.407  -4.524
   38   HG12  VAL   5          2HG1      VAL   5  11.146   8.662  -4.756
   39   HG13  VAL   5          3HG1      VAL   5  11.414   9.325  -3.145
   40   HG21  VAL   5          1HG2      VAL   5   9.566  10.267  -1.862
   41   HG22  VAL   5          2HG2      VAL   5   7.976  10.474  -2.599
   42   HG23  VAL   5          3HG2      VAL   5   9.322  11.500  -3.100
   43    H    SER   6           H        SER   6   6.531   8.737  -4.257
   44    HA   SER   6           HA       SER   6   4.852  11.054  -4.835
   45    HB2  SER   6          1HB       SER   6   4.080   8.302  -3.821
   46    HB3  SER   6          2HB       SER   6   2.971   9.554  -4.380
   47    HG   SER   6           HG       SER   6   4.718   7.928  -5.848
   48    H    THR   7           H        THR   7   5.313  12.542  -3.244
   49    HA   THR   7           HA       THR   7   5.567  11.791  -0.493
   50    HB   THR   7           HB       THR   7   5.699  14.188  -0.022
   51    HG1  THR   7           HG1      THR   7   4.976  14.442  -2.776
   52   HG21  THR   7          1HG2      THR   7   7.706  13.013  -0.791
   53   HG22  THR   7          2HG2      THR   7   7.699  14.694  -1.324
   54   HG23  THR   7          3HG2      THR   7   7.298  13.409  -2.461
   55    H    THR   8           H        THR   8   4.187  13.552   0.990
   56    HA   THR   8           HA       THR   8   1.694  12.311   1.219
   57    HB   THR   8           HB       THR   8   2.392  15.013   2.361
   58    HG1  THR   8           HG1      THR   8   3.859  12.948   2.658
   59   HG21  THR   8          1HG2      THR   8   0.572  12.787   3.274
   60   HG22  THR   8          2HG2      THR   8   0.087  14.384   2.703
   61   HG23  THR   8          3HG2      THR   8   0.959  14.220   4.226
   62    H    GLU   9           H        GLU   9   2.574  15.454  -0.170
   63    HA   GLU   9           HA       GLU   9  -0.037  16.299  -0.758
   64    HB2  GLU   9          1HB       GLU   9   2.018  17.732  -0.773
   65    HB3  GLU   9          2HB       GLU   9   2.464  16.994  -2.300
   66    HG2  GLU   9          1HG       GLU   9  -0.143  18.418  -1.926
   67    HG3  GLU   9          2HG       GLU   9   1.333  19.272  -2.359
   68    H    ASP  10           H        ASP  10   2.340  14.538  -2.736
   69    HA   ASP  10           HA       ASP  10   0.755  14.266  -5.044
   70    HB2  ASP  10          1HB       ASP  10   2.832  12.315  -4.020
   71    HB3  ASP  10          2HB       ASP  10   2.192  12.396  -5.657
   72    H    LEU  11           H        LEU  11   1.015  12.325  -2.125
   73    HA   LEU  11           HA       LEU  11  -0.564  10.178  -2.984
   74    HB2  LEU  11          1HB       LEU  11   0.874   9.945  -1.082
   75    HB3  LEU  11          2HB       LEU  11   0.008  11.210  -0.205
   76    HG   LEU  11           HG       LEU  11  -1.989   9.739  -0.186
   77   HD11  LEU  11          1HD1      LEU  11  -0.107   7.673  -1.296
   78   HD12  LEU  11          2HD1      LEU  11  -1.423   8.439  -2.182
   79   HD13  LEU  11          3HD1      LEU  11  -1.781   7.417  -0.797
   80   HD21  LEU  11          1HD2      LEU  11  -1.200   8.290   1.553
   81   HD22  LEU  11          2HD2      LEU  11  -0.352   9.830   1.682
   82   HD23  LEU  11          3HD2      LEU  11   0.459   8.431   0.978
   83    H    GLN  12           H        GLN  12  -1.403  13.202  -1.342
   84    HA   GLN  12           HA       GLN  12  -4.126  12.535  -0.894
   85    HB2  GLN  12          1HB       GLN  12  -2.833  15.248  -1.152
   86    HB3  GLN  12          2HB       GLN  12  -4.442  14.944  -0.511
   87    HG2  GLN  12          1HG       GLN  12  -3.495  13.715   1.343
   88    HG3  GLN  12          2HG       GLN  12  -1.880  13.909   0.669
   89   HE21  GLN  12          1HE2      GLN  12  -2.467  16.685  -0.171
   90   HE22  GLN  12          2HE2      GLN  12  -2.388  17.621   1.285
   91    H    ARG  13           H        ARG  13  -2.349  13.617  -3.607
   92    HA   ARG  13           HA       ARG  13  -4.509  14.643  -5.143
   93    HB2  ARG  13          1HB       ARG  13  -2.072  15.090  -5.527
   94    HB3  ARG  13          2HB       ARG  13  -1.919  13.444  -6.122
   95    HG2  ARG  13          1HG       ARG  13  -3.594  14.000  -7.882
   96    HG3  ARG  13          2HG       ARG  13  -3.527  15.683  -7.323
   97    HD2  ARG  13          1HD       ARG  13  -1.336  14.031  -8.552
   98    HD3  ARG  13          2HD       ARG  13  -2.019  15.546  -9.139
   99    HE   ARG  13           HE       ARG  13  -1.002  16.533  -7.033
  100   HH11  ARG  13          1HH1      ARG  13   0.385  13.823  -8.767
  101   HH12  ARG  13          2HH1      ARG  13   1.980  14.075  -8.132
  102   HH21  ARG  13          1HH2      ARG  13   1.113  16.857  -6.181
  103   HH22  ARG  13          2HH2      ARG  13   2.392  15.773  -6.665
  104    H    TYR  14           H        TYR  14  -2.650  11.613  -5.450
  105    HA   TYR  14           HA       TYR  14  -4.342  10.381  -7.311
  106    HB2  TYR  14          1HB       TYR  14  -2.596   9.018  -5.251
  107    HB3  TYR  14          2HB       TYR  14  -3.227   8.299  -6.725
  108    HD1  TYR  14           HD1      TYR  14  -0.326   9.463  -5.363
  109    HD2  TYR  14           HD2      TYR  14  -2.683   9.960  -8.867
  110    HE1  TYR  14           HE1      TYR  14   1.670  10.190  -6.594
  111    HE2  TYR  14           HE2      TYR  14  -0.689  10.680 -10.112
  112    HH   TYR  14           HH       TYR  14   2.483  10.340  -8.852
  113    H    ARG  15           H        ARG  15  -4.407  10.380  -3.802
  114    HA   ARG  15           HA       ARG  15  -6.176   8.232  -3.490
  115    HB2  ARG  15          1HB       ARG  15  -5.356   8.505  -1.449
  116    HB3  ARG  15          2HB       ARG  15  -4.811  10.128  -1.831
  117    HG2  ARG  15          1HG       ARG  15  -6.873  11.074  -1.093
  118    HG3  ARG  15          2HG       ARG  15  -7.623   9.477  -0.970
  119    HD2  ARG  15          1HD       ARG  15  -6.131   8.858   0.824
  120    HD3  ARG  15          2HD       ARG  15  -5.231  10.360   0.650
  121    HE   ARG  15           HE       ARG  15  -7.729  11.222   1.189
  122   HH11  ARG  15          1HH1      ARG  15  -5.691   8.808   2.707
  123   HH12  ARG  15          2HH1      ARG  15  -6.247   9.171   4.309
  124   HH21  ARG  15          1HH2      ARG  15  -8.493  11.679   3.289
  125   HH22  ARG  15          2HH2      ARG  15  -7.872  10.787   4.640
  126    H    THR  16           H        THR  16  -6.747  11.684  -3.886
  127    HA   THR  16           HA       THR  16  -9.539  11.576  -3.367
  128    HB   THR  16           HB       THR  16  -8.047  13.569  -5.073
  129    HG1  THR  16           HG1      THR  16  -7.062  13.758  -3.135
  130   HG21  THR  16          1HG2      THR  16 -10.512  13.625  -5.249
  131   HG22  THR  16          2HG2      THR  16  -9.849  15.084  -4.510
  132   HG23  THR  16          3HG2      THR  16 -10.608  13.850  -3.502
  133    H    GLU  17           H        GLU  17  -7.584  11.425  -6.318
  134    HA   GLU  17           HA       GLU  17  -9.630  11.306  -8.219
  135    HB2  GLU  17          1HB       GLU  17  -7.168   9.605  -8.489
  136    HB3  GLU  17          2HB       GLU  17  -8.039  10.477  -9.729
  137    HG2  GLU  17          1HG       GLU  17  -6.412  11.798  -7.577
  138    HG3  GLU  17          2HG       GLU  17  -5.849  11.454  -9.214
  139    H    CYS  18           H        CYS  18  -8.010   8.626  -6.517
  140    HA   CYS  18           HA       CYS  18  -9.601   6.602  -7.659
  141    HB2  CYS  18          1HB       CYS  18  -8.002   6.636  -5.102
  142    HB3  CYS  18          2HB       CYS  18  -8.797   5.197  -5.754
  143    H    VAL  19           H        VAL  19  -9.996   8.537  -4.728
  144    HA   VAL  19           HA       VAL  19 -12.183   7.165  -3.660
  145    HB   VAL  19           HB       VAL  19 -11.182   9.969  -3.380
  146   HG11  VAL  19          1HG1      VAL  19 -13.763   8.964  -2.187
  147   HG12  VAL  19          2HG1      VAL  19 -13.614  10.200  -3.439
  148   HG13  VAL  19          3HG1      VAL  19 -12.975  10.499  -1.821
  149   HG21  VAL  19          1HG2      VAL  19 -11.054   9.262  -1.005
  150   HG22  VAL  19          2HG2      VAL  19 -10.090   8.266  -2.093
  151   HG23  VAL  19          3HG2      VAL  19 -11.637   7.667  -1.489
  152    H    SER  20           H        SER  20 -12.097  10.000  -5.777
  153    HA   SER  20           HA       SER  20 -14.885  10.250  -6.042
  154    HB2  SER  20          1HB       SER  20 -13.123  11.992  -6.535
  155    HB3  SER  20          2HB       SER  20 -12.797  11.137  -8.041
  156    HG   SER  20           HG       SER  20 -15.106  12.556  -7.257
  157    H    SER  21           H        SER  21 -12.504   8.395  -7.902
  158    HA   SER  21           HA       SER  21 -14.318   7.794 -10.037
  159    HB2  SER  21          1HB       SER  21 -11.661   6.581  -9.262
  160    HB3  SER  21          2HB       SER  21 -12.536   6.202 -10.745
  161    HG   SER  21           HG       SER  21 -12.044   8.896 -10.168
  162    H    LEU  22           H        LEU  22 -13.078   5.943  -7.232
  163    HA   LEU  22           HA       LEU  22 -14.575   3.616  -8.063
  164    HB2  LEU  22          1HB       LEU  22 -12.828   4.155  -5.668
  165    HB3  LEU  22          2HB       LEU  22 -13.642   2.615  -5.951
  166    HG   LEU  22           HG       LEU  22 -11.622   3.860  -7.814
  167   HD11  LEU  22          1HD1      LEU  22 -11.344   1.613  -5.821
  168   HD12  LEU  22          2HD1      LEU  22 -10.577   3.198  -5.726
  169   HD13  LEU  22          3HD1      LEU  22 -10.126   2.078  -7.011
  170   HD21  LEU  22          1HD2      LEU  22 -13.204   2.445  -8.966
  171   HD22  LEU  22          2HD2      LEU  22 -12.951   1.159  -7.786
  172   HD23  LEU  22          3HD2      LEU  22 -11.638   1.638  -8.862
  173    H    ASN  23           H        ASN  23 -15.718   6.286  -6.868
  174    HA   ASN  23           HA       ASN  23 -17.543   6.924  -5.665
  175    HB2  ASN  23          1HB       ASN  23 -18.561   5.211  -7.153
  176    HB3  ASN  23          2HB       ASN  23 -18.321   4.013  -5.899
  177   HD21  ASN  23          1HD2      ASN  23 -20.477   3.567  -5.688
  178   HD22  ASN  23          2HD2      ASN  23 -21.610   4.683  -4.997
  179    H    ILE  24           H        ILE  24 -15.233   6.285  -4.157
  180    HA   ILE  24           HA       ILE  24 -15.904   4.721  -1.870
  181    HB   ILE  24           HB       ILE  24 -13.766   6.845  -2.044
  182   HG12  ILE  24          1HG1      ILE  24 -13.525   5.272  -3.930
  183   HG13  ILE  24          2HG1      ILE  24 -12.229   5.068  -2.756
  184   HG21  ILE  24          1HG2      ILE  24 -14.026   4.372  -0.333
  185   HG22  ILE  24          2HG2      ILE  24 -14.241   6.037   0.204
  186   HG23  ILE  24          3HG2      ILE  24 -12.656   5.483  -0.333
  187   HD11  ILE  24          1HD1      ILE  24 -13.024   2.930  -3.588
  188   HD12  ILE  24          2HD1      ILE  24 -14.656   3.308  -3.037
  189   HD13  ILE  24          3HD1      ILE  24 -13.359   3.091  -1.861
  190    HA   PRO  25           HA       PRO  25 -18.512   7.813   0.048
  191    HB2  PRO  25          1HB       PRO  25 -18.204   6.140   2.435
  192    HB3  PRO  25          2HB       PRO  25 -19.663   6.572   1.543
  193    HG2  PRO  25          1HG       PRO  25 -18.615   4.093   1.496
  194    HG3  PRO  25          2HG       PRO  25 -19.487   4.797   0.125
  195    HD2  PRO  25          1HD       PRO  25 -16.549   4.424   0.517
  196    HD3  PRO  25          2HD       PRO  25 -17.524   4.310  -0.970
  197    H    ALA  26           H        ALA  26 -18.194   9.520   1.323
  198    HA   ALA  26           HA       ALA  26 -15.627  10.378   1.992
  199    HB1  ALA  26          1HB       ALA  26 -16.729  12.221   3.128
  200    HB2  ALA  26          2HB       ALA  26 -18.253  11.333   3.116
  201    HB3  ALA  26          3HB       ALA  26 -17.533  11.868   1.598
  202    H    ASP  27           H        ASP  27 -17.985   8.600   3.835
  203    HA   ASP  27           HA       ASP  27 -17.010   8.854   6.415
  204    HB2  ASP  27          1HB       ASP  27 -19.068   7.681   5.928
  205    HB3  ASP  27          2HB       ASP  27 -18.190   6.421   5.068
  206    H    TYR  28           H        TYR  28 -16.104   6.379   4.001
  207    HA   TYR  28           HA       TYR  28 -14.038   5.239   5.482
  208    HB2  TYR  28          1HB       TYR  28 -14.692   5.331   2.560
  209    HB3  TYR  28          2HB       TYR  28 -13.169   4.615   3.091
  210    HD1  TYR  28           HD1      TYR  28 -16.847   4.374   3.367
  211    HD2  TYR  28           HD2      TYR  28 -13.124   2.442   4.077
  212    HE1  TYR  28           HE1      TYR  28 -18.034   2.276   3.852
  213    HE2  TYR  28           HE2      TYR  28 -14.301   0.343   4.568
  214    HH   TYR  28           HH       TYR  28 -17.599  -0.121   3.862
  215    H    VAL  29           H        VAL  29 -14.030   7.951   3.216
  216    HA   VAL  29           HA       VAL  29 -11.275   8.377   3.031
  217    HB   VAL  29           HB       VAL  29 -13.444  10.463   2.963
  218   HG11  VAL  29          1HG1      VAL  29 -11.262  11.464   3.181
  219   HG12  VAL  29          2HG1      VAL  29 -11.841  11.688   1.530
  220   HG13  VAL  29          3HG1      VAL  29 -10.635  10.449   1.883
  221   HG21  VAL  29          1HG2      VAL  29 -13.951   8.723   1.393
  222   HG22  VAL  29          2HG2      VAL  29 -12.295   8.730   0.791
  223   HG23  VAL  29          3HG2      VAL  29 -13.343  10.123   0.509
  224    H    GLU  30           H        GLU  30 -13.654   9.567   5.358
  225    HA   GLU  30           HA       GLU  30 -11.970  11.236   6.851
  226    HB2  GLU  30          1HB       GLU  30 -14.018  11.637   7.641
  227    HB3  GLU  30          2HB       GLU  30 -14.623  10.070   7.123
  228    HG2  GLU  30          1HG       GLU  30 -13.807   9.063   9.163
  229    HG3  GLU  30          2HG       GLU  30 -13.073  10.592   9.650
  230    H    LYS  31           H        LYS  31 -12.627   7.793   7.025
  231    HA   LYS  31           HA       LYS  31 -11.128   7.289   9.370
  232    HB2  LYS  31          1HB       LYS  31 -11.844   5.409   7.113
  233    HB3  LYS  31          2HB       LYS  31 -11.220   4.931   8.698
  234    HG2  LYS  31          1HG       LYS  31 -13.195   6.025   9.735
  235    HG3  LYS  31          2HG       LYS  31 -13.838   6.292   8.114
  236    HD2  LYS  31          1HD       LYS  31 -13.771   3.844   7.726
  237    HD3  LYS  31          2HD       LYS  31 -13.243   3.624   9.408
  238    HE2  LYS  31          1HE       LYS  31 -15.319   4.765  10.161
  239    HE3  LYS  31          2HE       LYS  31 -15.846   4.864   8.483
  240    HZ1  LYS  31          1HZ       LYS  31 -15.814   2.439   8.392
  241    HZ2  LYS  31          2HZ       LYS  31 -16.862   3.003   9.588
  242    HZ3  LYS  31          3HZ       LYS  31 -15.354   2.373  10.020
  243    H    PHE  32           H        PHE  32 -10.328   6.970   5.920
  244    HA   PHE  32           HA       PHE  32  -7.708   6.079   6.183
  245    HB2  PHE  32          1HB       PHE  32  -8.728   7.923   4.015
  246    HB3  PHE  32          2HB       PHE  32  -7.331   6.861   3.921
  247    HD1  PHE  32           HD1      PHE  32  -8.704   4.471   5.284
  248    HD2  PHE  32           HD2      PHE  32  -9.857   7.071   2.122
  249    HE1  PHE  32           HE1      PHE  32 -10.110   2.695   4.337
  250    HE2  PHE  32           HE2      PHE  32 -11.273   5.299   1.176
  251    HZ   PHE  32           HZ       PHE  32 -11.400   3.103   2.283
  252    H    LYS  33           H        LYS  33  -9.037   9.215   6.736
  253    HA   LYS  33           HA       LYS  33  -6.720  10.801   6.421
  254    HB2  LYS  33          1HB       LYS  33  -9.261  11.420   6.765
  255    HB3  LYS  33          2HB       LYS  33  -8.808  11.433   8.464
  256    HG2  LYS  33          1HG       LYS  33  -7.132  13.114   8.060
  257    HG3  LYS  33          2HG       LYS  33  -7.465  13.063   6.322
  258    HD2  LYS  33          1HD       LYS  33  -9.793  13.778   6.799
  259    HD3  LYS  33          2HD       LYS  33  -9.365  13.931   8.504
  260    HE2  LYS  33          1HE       LYS  33  -8.087  15.446   6.232
  261    HE3  LYS  33          2HE       LYS  33  -9.306  16.089   7.329
  262    HZ1  LYS  33          1HZ       LYS  33  -7.054  16.736   7.959
  263    HZ2  LYS  33          2HZ       LYS  33  -6.627  15.114   8.147
  264    HZ3  LYS  33          3HZ       LYS  33  -7.786  15.802   9.161
  265    H    LYS  34           H        LYS  34  -7.915   8.781   9.020
  266    HA   LYS  34           HA       LYS  34  -5.632   9.594  10.681
  267    HB2  LYS  34          1HB       LYS  34  -8.254   8.289  11.398
  268    HB3  LYS  34          2HB       LYS  34  -6.911   8.392  12.529
  269    HG2  LYS  34          1HG       LYS  34  -8.367  10.700  11.255
  270    HG3  LYS  34          2HG       LYS  34  -8.520  10.155  12.926
  271    HD2  LYS  34          1HD       LYS  34  -6.106  10.643  13.248
  272    HD3  LYS  34          2HD       LYS  34  -6.062  11.308  11.613
  273    HE2  LYS  34          1HE       LYS  34  -6.308  13.091  13.231
  274    HE3  LYS  34          2HE       LYS  34  -7.764  12.953  12.248
  275    HZ1  LYS  34          1HZ       LYS  34  -8.835  11.763  14.039
  276    HZ2  LYS  34          2HZ       LYS  34  -8.276  13.257  14.593
  277    HZ3  LYS  34          3HZ       LYS  34  -7.434  11.846  14.982
  278    H    TRP  35           H        TRP  35  -5.415   7.841   8.424
  279    HA   TRP  35           HA       TRP  35  -4.700   5.816   7.721
  280    HB2  TRP  35          1HB       TRP  35  -3.418   5.916  10.450
  281    HB3  TRP  35          2HB       TRP  35  -2.972   4.765   9.182
  282    HD1  TRP  35           HD1      TRP  35  -2.754   8.483  10.072
  283    HE1  TRP  35           HE1      TRP  35  -0.952   9.587   8.603
  284    HE3  TRP  35           HE3      TRP  35  -1.760   4.567   6.943
  285    HZ2  TRP  35           HZ2      TRP  35   0.677   8.883   6.416
  286    HZ3  TRP  35           HZ3      TRP  35  -0.070   4.865   5.191
  287    HH2  TRP  35           HH2      TRP  35   1.129   6.971   4.927
  288    H    GLU  36           H        GLU  36  -7.290   5.672   8.730
  289    HA   GLU  36           HA       GLU  36  -7.365   3.052  10.049
  290    HB2  GLU  36          1HB       GLU  36  -9.512   5.134   9.669
  291    HB3  GLU  36          2HB       GLU  36  -9.781   3.556  10.390
  292    HG2  GLU  36          1HG       GLU  36  -8.301   4.108  12.213
  293    HG3  GLU  36          2HG       GLU  36  -7.915   5.649  11.454
  294    H    PHE  37           H        PHE  37  -7.356   1.469   8.611
  295    HA   PHE  37           HA       PHE  37  -8.986   1.777   6.174
  296    HB2  PHE  37          1HB       PHE  37  -6.568  -0.011   6.566
  297    HB3  PHE  37          2HB       PHE  37  -7.449   0.233   5.062
  298    HD1  PHE  37           HD1      PHE  37  -5.184   1.784   7.503
  299    HD2  PHE  37           HD2      PHE  37  -7.052   2.162   3.695
  300    HE1  PHE  37           HE1      PHE  37  -3.690   3.659   6.958
  301    HE2  PHE  37           HE2      PHE  37  -5.569   4.046   3.154
  302    HZ   PHE  37           HZ       PHE  37  -3.885   4.798   4.786
  303    HA   PRO  38           HA       PRO  38 -11.255  -1.478   8.535
  304    HB2  PRO  38          1HB       PRO  38 -13.202  -0.687   6.432
  305    HB3  PRO  38          2HB       PRO  38 -13.447  -0.950   8.170
  306    HG2  PRO  38          1HG       PRO  38 -13.410   1.517   7.206
  307    HG3  PRO  38          2HG       PRO  38 -12.597   1.138   8.736
  308    HD2  PRO  38          1HD       PRO  38 -11.395   1.511   6.006
  309    HD3  PRO  38          2HD       PRO  38 -10.817   2.109   7.593
  310    H    GLU  39           H        GLU  39 -11.443  -3.555   8.001
  311    HA   GLU  39           HA       GLU  39 -10.311  -4.423   5.521
  312    HB2  GLU  39          1HB       GLU  39  -9.858  -5.527   7.687
  313    HB3  GLU  39          2HB       GLU  39 -11.532  -6.052   7.751
  314    HG2  GLU  39          1HG       GLU  39 -11.243  -7.554   5.988
  315    HG3  GLU  39          2HG       GLU  39  -9.747  -6.782   5.461
  316    H    ASP  40           H        ASP  40 -11.658  -3.794   3.945
  317    HA   ASP  40           HA       ASP  40 -14.070  -5.323   3.477
  318    HB2  ASP  40          1HB       ASP  40 -14.900  -3.415   4.847
  319    HB3  ASP  40          2HB       ASP  40 -14.204  -2.295   3.682
  320    H    ASP  41           H        ASP  41 -14.628  -5.354   1.319
  321    HA   ASP  41           HA       ASP  41 -12.584  -5.197  -0.530
  322    HB2  ASP  41          1HB       ASP  41 -15.560  -5.148  -1.047
  323    HB3  ASP  41          2HB       ASP  41 -14.334  -5.415  -2.278
  324    H    THR  42           H        THR  42 -14.881  -2.716   0.384
  325    HA   THR  42           HA       THR  42 -14.585  -0.915  -1.734
  326    HB   THR  42           HB       THR  42 -14.812  -0.124   1.165
  327    HG1  THR  42           HG1      THR  42 -16.387  -1.669   0.878
  328   HG21  THR  42          1HG2      THR  42 -15.853   1.109  -1.384
  329   HG22  THR  42          2HG2      THR  42 -14.531   1.721  -0.388
  330   HG23  THR  42          3HG2      THR  42 -16.179   1.710   0.243
  331    H    THR  43           H        THR  43 -12.917  -0.871   1.396
  332    HA   THR  43           HA       THR  43 -10.983   1.047   0.842
  333    HB   THR  43           HB       THR  43 -10.630  -1.350   2.647
  334    HG1  THR  43           HG1      THR  43 -11.546   0.231   4.234
  335   HG21  THR  43          1HG2      THR  43  -9.478   1.437   2.654
  336   HG22  THR  43          2HG2      THR  43  -8.607  -0.087   2.475
  337   HG23  THR  43          3HG2      THR  43  -9.356   0.328   4.019
  338    H    MET  44           H        MET  44 -11.095  -2.367   0.130
  339    HA   MET  44           HA       MET  44  -8.327  -2.739  -0.309
  340    HB2  MET  44          1HB       MET  44 -10.677  -4.356  -1.271
  341    HB3  MET  44          2HB       MET  44  -9.003  -4.886  -1.317
  342    HG2  MET  44          1HG       MET  44  -8.904  -4.722   1.127
  343    HG3  MET  44          2HG       MET  44 -10.592  -4.229   1.150
  344    HE1  MET  44          1HE       MET  44 -11.139  -6.126   2.886
  345    HE2  MET  44          2HE       MET  44  -9.443  -6.613   2.877
  346    HE3  MET  44          3HE       MET  44 -10.708  -7.823   2.658
  347    H    CYS  45           H        CYS  45 -11.042  -2.387  -2.616
  348    HA   CYS  45           HA       CYS  45  -9.392  -2.402  -4.912
  349    HB2  CYS  45          1HB       CYS  45 -12.140  -1.186  -4.539
  350    HB3  CYS  45          2HB       CYS  45 -11.343  -1.419  -6.089
  351    H    TYR  46           H        TYR  46 -10.331   0.075  -2.670
  352    HA   TYR  46           HA       TYR  46  -9.535   2.326  -4.134
  353    HB2  TYR  46          1HB       TYR  46 -10.840   2.749  -2.244
  354    HB3  TYR  46          2HB       TYR  46  -9.854   1.717  -1.212
  355    HD1  TYR  46           HD1      TYR  46  -8.403   2.724   0.261
  356    HD2  TYR  46           HD2      TYR  46  -9.573   4.857  -3.230
  357    HE1  TYR  46           HE1      TYR  46  -7.174   4.694   1.060
  358    HE2  TYR  46           HE2      TYR  46  -8.340   6.832  -2.438
  359    HH   TYR  46           HH       TYR  46  -6.398   6.729   0.516
  360    H    ILE  47           H        ILE  47  -7.790   0.270  -1.839
  361    HA   ILE  47           HA       ILE  47  -5.402   1.694  -1.792
  362    HB   ILE  47           HB       ILE  47  -5.950  -1.221  -1.307
  363   HG12  ILE  47          1HG1      ILE  47  -6.958   0.293   0.314
  364   HG13  ILE  47          2HG1      ILE  47  -5.621  -0.568   1.070
  365   HG21  ILE  47          1HG2      ILE  47  -3.642  -1.074  -1.990
  366   HG22  ILE  47          2HG2      ILE  47  -3.712  -1.328  -0.246
  367   HG23  ILE  47          3HG2      ILE  47  -3.365   0.276  -0.890
  368   HD11  ILE  47          1HD1      ILE  47  -5.701   2.299   0.164
  369   HD12  ILE  47          2HD1      ILE  47  -4.210   1.475   0.624
  370   HD13  ILE  47          3HD1      ILE  47  -5.507   1.676   1.802
  371    H    LYS  48           H        LYS  48  -6.434  -0.907  -4.025
  372    HA   LYS  48           HA       LYS  48  -3.880  -1.144  -5.202
  373    HB2  LYS  48          1HB       LYS  48  -5.497  -1.887  -7.267
  374    HB3  LYS  48          2HB       LYS  48  -4.944  -2.964  -6.006
  375    HG2  LYS  48          1HG       LYS  48  -6.999  -2.903  -4.912
  376    HG3  LYS  48          2HG       LYS  48  -7.492  -1.416  -5.728
  377    HD2  LYS  48          1HD       LYS  48  -7.078  -4.063  -7.117
  378    HD3  LYS  48          2HD       LYS  48  -8.644  -3.462  -6.574
  379    HE2  LYS  48          1HE       LYS  48  -8.397  -1.507  -8.025
  380    HE3  LYS  48          2HE       LYS  48  -6.829  -2.098  -8.563
  381    HZ1  LYS  48          1HZ       LYS  48  -9.424  -3.476  -8.977
  382    HZ2  LYS  48          2HZ       LYS  48  -7.913  -4.031  -9.507
  383    HZ3  LYS  48          3HZ       LYS  48  -8.567  -2.610 -10.148
  384    H    CYS  49           H        CYS  49  -6.757   0.747  -6.097
  385    HA   CYS  49           HA       CYS  49  -5.812   1.830  -8.469
  386    HB2  CYS  49          1HB       CYS  49  -8.088   2.126  -7.882
  387    HB3  CYS  49          2HB       CYS  49  -7.684   2.992  -6.401
  388    H    VAL  50           H        VAL  50  -5.379   2.991  -5.142
  389    HA   VAL  50           HA       VAL  50  -3.989   5.345  -5.788
  390    HB   VAL  50           HB       VAL  50  -3.966   3.696  -3.260
  391   HG11  VAL  50          1HG1      VAL  50  -1.991   5.100  -3.333
  392   HG12  VAL  50          2HG1      VAL  50  -3.148   5.740  -2.164
  393   HG13  VAL  50          3HG1      VAL  50  -2.978   6.504  -3.745
  394   HG21  VAL  50          1HG2      VAL  50  -5.482   5.522  -2.478
  395   HG22  VAL  50          2HG2      VAL  50  -6.152   4.473  -3.727
  396   HG23  VAL  50          3HG2      VAL  50  -5.556   6.075  -4.151
  397    H    PHE  51           H        PHE  51  -2.898   2.137  -4.795
  398    HA   PHE  51           HA       PHE  51  -0.149   2.690  -4.836
  399    HB2  PHE  51          1HB       PHE  51  -1.851   0.250  -4.754
  400    HB3  PHE  51          2HB       PHE  51  -0.146   0.042  -5.143
  401    HD1  PHE  51           HD1      PHE  51  -1.289   2.703  -2.896
  402    HD2  PHE  51           HD2      PHE  51   0.256  -1.257  -3.148
  403    HE1  PHE  51           HE1      PHE  51  -0.793   2.744  -0.487
  404    HE2  PHE  51           HE2      PHE  51   0.753  -1.218  -0.742
  405    HZ   PHE  51           HZ       PHE  51   0.232   0.783   0.591
  406    H    ASN  52           H        ASN  52  -2.424   1.993  -7.298
  407    HA   ASN  52           HA       ASN  52  -0.572   1.070  -9.284
  408    HB2  ASN  52          1HB       ASN  52  -2.963   0.454  -9.343
  409    HB3  ASN  52          2HB       ASN  52  -3.392   2.150  -9.584
  410   HD21  ASN  52          1HD2      ASN  52  -0.732   0.327 -11.040
  411   HD22  ASN  52          2HD2      ASN  52  -1.289   0.492 -12.670
  412    H    LYS  53           H        LYS  53  -2.197   4.112  -8.532
  413    HA   LYS  53           HA       LYS  53  -1.137   5.518 -10.775
  414    HB2  LYS  53          1HB       LYS  53  -2.601   6.301  -8.283
  415    HB3  LYS  53          2HB       LYS  53  -1.913   7.540  -9.325
  416    HG2  LYS  53          1HG       LYS  53  -3.287   6.751 -11.180
  417    HG3  LYS  53          2HG       LYS  53  -3.924   5.451 -10.169
  418    HD2  LYS  53          1HD       LYS  53  -4.940   7.075  -8.677
  419    HD3  LYS  53          2HD       LYS  53  -4.247   8.402  -9.614
  420    HE2  LYS  53          1HE       LYS  53  -6.588   8.076 -10.188
  421    HE3  LYS  53          2HE       LYS  53  -5.550   7.707 -11.563
  422    HZ1  LYS  53          1HZ       LYS  53  -6.718   5.680  -9.733
  423    HZ2  LYS  53          2HZ       LYS  53  -5.811   5.369 -11.128
  424    HZ3  LYS  53          3HZ       LYS  53  -7.338   6.082 -11.255
  425    H    MET  54           H        MET  54  -0.038   4.837  -7.576
  426    HA   MET  54           HA       MET  54   2.009   6.884  -7.617
  427    HB2  MET  54          1HB       MET  54   1.278   4.717  -5.661
  428    HB3  MET  54          2HB       MET  54   2.704   5.733  -5.457
  429    HG2  MET  54          1HG       MET  54   1.407   7.665  -5.198
  430    HG3  MET  54          2HG       MET  54  -0.043   6.875  -5.806
  431    HE1  MET  54          1HE       MET  54   2.628   5.737  -3.000
  432    HE2  MET  54          2HE       MET  54   1.769   6.396  -1.606
  433    HE3  MET  54          3HE       MET  54   2.348   7.473  -2.876
  434    H    GLN  55           H        GLN  55   1.687   4.178  -9.270
  435    HA   GLN  55           HA       GLN  55   2.992   2.674 -10.284
  436    HB2  GLN  55          1HB       GLN  55   4.902   4.913  -9.773
  437    HB3  GLN  55          2HB       GLN  55   5.462   3.432 -10.561
  438    HG2  GLN  55          1HG       GLN  55   3.817   3.743 -12.310
  439    HG3  GLN  55          2HG       GLN  55   3.203   5.175 -11.495
  440   HE21  GLN  55          1HE2      GLN  55   4.304   4.895 -14.165
  441   HE22  GLN  55          2HE2      GLN  55   5.651   5.979 -14.255
  442    H    LEU  56           H        LEU  56   2.434   1.791  -7.891
  443    HA   LEU  56           HA       LEU  56   4.961   0.836  -6.770
  444    HB2  LEU  56          1HB       LEU  56   2.744   2.268  -5.513
  445    HB3  LEU  56          2HB       LEU  56   3.236   0.821  -4.621
  446    HG   LEU  56           HG       LEU  56   5.023   3.114  -5.429
  447   HD11  LEU  56          1HD1      LEU  56   3.813   2.366  -2.776
  448   HD12  LEU  56          2HD1      LEU  56   3.485   3.817  -3.718
  449   HD13  LEU  56          3HD1      LEU  56   5.072   3.573  -2.998
  450   HD21  LEU  56          1HD2      LEU  56   6.603   2.012  -3.838
  451   HD22  LEU  56          2HD2      LEU  56   6.323   1.117  -5.329
  452   HD23  LEU  56          3HD2      LEU  56   5.530   0.613  -3.836
  453    H    PHE  57           H        PHE  57   1.810   0.098  -7.873
  454    HA   PHE  57           HA       PHE  57   2.238  -2.734  -7.265
  455    HB2  PHE  57          1HB       PHE  57   0.702  -2.020  -5.525
  456    HB3  PHE  57          2HB       PHE  57  -0.307  -1.185  -6.695
  457    HD1  PHE  57           HD1      PHE  57  -1.951  -2.346  -7.968
  458    HD2  PHE  57           HD2      PHE  57   0.723  -4.488  -5.437
  459    HE1  PHE  57           HE1      PHE  57  -3.345  -4.359  -8.203
  460    HE2  PHE  57           HE2      PHE  57  -0.668  -6.503  -5.671
  461    HZ   PHE  57           HZ       PHE  57  -2.705  -6.440  -7.055
  462    H    ASP  58           H        ASP  58   1.619  -4.074  -8.859
  463    HA   ASP  58           HA       ASP  58   0.288  -2.887 -11.206
  464    HB2  ASP  58          1HB       ASP  58   2.668  -3.324 -11.660
  465    HB3  ASP  58          2HB       ASP  58   2.461  -5.000 -11.167
  466    H    ASP  59           H        ASP  59  -1.270  -4.110 -12.196
  467    HA   ASP  59           HA       ASP  59  -2.760  -5.826 -10.521
  468    HB2  ASP  59          1HB       ASP  59  -3.846  -4.440 -12.187
  469    HB3  ASP  59          2HB       ASP  59  -3.011  -5.273 -13.480
  470    H    THR  60           H        THR  60  -0.266  -6.456 -12.823
  471    HA   THR  60           HA       THR  60  -0.951  -9.287 -12.961
  472    HB   THR  60           HB       THR  60   1.060  -7.594 -14.421
  473    HG1  THR  60           HG1      THR  60  -1.293  -7.701 -14.973
  474   HG21  THR  60          1HG2      THR  60   1.665  -9.581 -15.712
  475   HG22  THR  60          2HG2      THR  60   0.648 -10.574 -14.668
  476   HG23  THR  60          3HG2      THR  60   2.077  -9.774 -14.008
  477    H    GLU  61           H        GLU  61   2.068  -7.427 -12.410
  478    HA   GLU  61           HA       GLU  61   3.388  -9.671 -11.240
  479    HB2  GLU  61          1HB       GLU  61   4.325  -6.838 -10.949
  480    HB3  GLU  61          2HB       GLU  61   5.268  -8.313 -11.050
  481    HG2  GLU  61          1HG       GLU  61   4.620  -8.557 -13.395
  482    HG3  GLU  61          2HG       GLU  61   3.737  -7.037 -13.292
  483    H    GLY  62           H        GLY  62   1.263  -7.341  -9.941
  484    HA2  GLY  62          1HA       GLY  62   0.531  -7.124  -7.741
  485    HA3  GLY  62          2HA       GLY  62   1.761  -8.297  -7.262
  486    HA   PRO  63           HA       PRO  63   3.223  -4.383  -5.368
  487    HB2  PRO  63          1HB       PRO  63   4.845  -6.383  -3.893
  488    HB3  PRO  63          2HB       PRO  63   3.848  -5.059  -3.275
  489    HG2  PRO  63          1HG       PRO  63   3.073  -7.624  -3.065
  490    HG3  PRO  63          2HG       PRO  63   1.914  -6.308  -3.327
  491    HD2  PRO  63          1HD       PRO  63   2.984  -8.317  -5.269
  492    HD3  PRO  63          2HD       PRO  63   1.352  -7.607  -5.155
  493    H    LEU  64           H        LEU  64   4.772  -3.284  -6.368
  494    HA   LEU  64           HA       LEU  64   6.906  -4.681  -7.779
  495    HB2  LEU  64          1HB       LEU  64   6.403  -1.706  -7.640
  496    HB3  LEU  64          2HB       LEU  64   7.400  -2.564  -8.797
  497    HG   LEU  64           HG       LEU  64   4.406  -2.857  -8.597
  498   HD11  LEU  64          1HD1      LEU  64   6.084  -1.349 -10.596
  499   HD12  LEU  64          2HD1      LEU  64   5.017  -0.636  -9.386
  500   HD13  LEU  64          3HD1      LEU  64   4.343  -1.606 -10.696
  501   HD21  LEU  64          1HD2      LEU  64   6.350  -3.853 -10.667
  502   HD22  LEU  64          2HD2      LEU  64   4.602  -4.089 -10.662
  503   HD23  LEU  64          3HD2      LEU  64   5.601  -4.840  -9.414
  504    H    VAL  65           H        VAL  65   8.339  -5.398  -6.373
  505    HA   VAL  65           HA       VAL  65   8.950  -4.432  -3.883
  506    HB   VAL  65           HB       VAL  65  10.665  -6.066  -5.736
  507   HG11  VAL  65          1HG1      VAL  65  10.979  -5.627  -2.769
  508   HG12  VAL  65          2HG1      VAL  65  12.063  -5.030  -4.027
  509   HG13  VAL  65          3HG1      VAL  65  11.905  -6.765  -3.748
  510   HG21  VAL  65          1HG2      VAL  65   8.563  -7.112  -5.218
  511   HG22  VAL  65          2HG2      VAL  65   8.789  -6.796  -3.500
  512   HG23  VAL  65          3HG2      VAL  65   9.849  -7.933  -4.335
  513    H    ASP  66           H        ASP  66  10.711  -3.732  -6.909
  514    HA   ASP  66           HA       ASP  66  12.857  -2.398  -5.699
  515    HB2  ASP  66          1HB       ASP  66  12.869  -3.197  -8.023
  516    HB3  ASP  66          2HB       ASP  66  11.732  -1.926  -8.458
  517    H    ASN  67           H        ASN  67   9.936  -1.017  -7.219
  518    HA   ASN  67           HA       ASN  67  10.486   1.652  -6.529
  519    HB2  ASN  67          1HB       ASN  67   7.894   0.236  -7.138
  520    HB3  ASN  67          2HB       ASN  67   7.987   1.963  -6.831
  521   HD21  ASN  67          1HD2      ASN  67   7.248   2.447  -8.876
  522   HD22  ASN  67          2HD2      ASN  67   8.234   2.260 -10.289
  523    H    LEU  68           H        LEU  68   8.957  -0.972  -4.825
  524    HA   LEU  68           HA       LEU  68   7.797   0.471  -2.723
  525    HB2  LEU  68          1HB       LEU  68   8.671  -2.359  -3.096
  526    HB3  LEU  68          2HB       LEU  68   8.198  -1.806  -1.496
  527    HG   LEU  68           HG       LEU  68   6.419  -1.454  -3.895
  528   HD11  LEU  68          1HD1      LEU  68   5.249  -3.472  -3.227
  529   HD12  LEU  68          2HD1      LEU  68   6.421  -3.747  -1.937
  530   HD13  LEU  68          3HD1      LEU  68   6.926  -3.841  -3.624
  531   HD21  LEU  68          1HD2      LEU  68   5.939  -0.074  -1.946
  532   HD22  LEU  68          2HD2      LEU  68   5.890  -1.515  -0.932
  533   HD23  LEU  68          3HD2      LEU  68   4.681  -1.284  -2.195
  534    H    VAL  69           H        VAL  69  10.992  -1.013  -3.030
  535    HA   VAL  69           HA       VAL  69  11.920  -0.248  -0.463
  536    HB   VAL  69           HB       VAL  69  13.492  -0.878  -2.953
  537   HG11  VAL  69          1HG1      VAL  69  14.311  -0.709  -0.062
  538   HG12  VAL  69          2HG1      VAL  69  14.882   0.301  -1.391
  539   HG13  VAL  69          3HG1      VAL  69  15.306  -1.410  -1.337
  540   HG21  VAL  69          1HG2      VAL  69  13.684  -3.110  -2.058
  541   HG22  VAL  69          2HG2      VAL  69  11.982  -2.678  -2.225
  542   HG23  VAL  69          3HG2      VAL  69  12.748  -2.647  -0.636
  543    H    HIS  70           H        HIS  70  12.300   1.208  -3.689
  544    HA   HIS  70           HA       HIS  70  13.984   3.306  -2.795
  545    HB2  HIS  70          1HB       HIS  70  12.336   2.920  -5.282
  546    HB3  HIS  70          2HB       HIS  70  13.238   4.408  -4.997
  547    HD1  HIS  70           HD1      HIS  70  15.785   4.322  -5.244
  548    HD2  HIS  70           HD2      HIS  70  13.944   0.632  -5.738
  549    HE1  HIS  70           HE1      HIS  70  17.563   2.796  -6.147
  550    HE2  HIS  70           HE2      HIS  70  16.478   0.525  -6.222
  551    H    GLN  71           H        GLN  71  10.648   2.806  -2.546
  552    HA   GLN  71           HA       GLN  71   9.988   5.618  -2.143
  553    HB2  GLN  71          1HB       GLN  71   8.544   3.610  -3.163
  554    HB3  GLN  71          2HB       GLN  71   8.094   3.422  -1.477
  555    HG2  GLN  71          1HG       GLN  71   6.442   4.772  -2.454
  556    HG3  GLN  71          2HG       GLN  71   7.449   5.847  -1.488
  557   HE21  GLN  71          1HE2      GLN  71   8.532   4.582  -4.543
  558   HE22  GLN  71          2HE2      GLN  71   8.439   6.069  -5.414
  559    H    LEU  72           H        LEU  72   9.662   2.605  -0.294
  560    HA   LEU  72           HA       LEU  72   8.969   3.908   2.103
  561    HB2  LEU  72          1HB       LEU  72   9.827   1.083   1.539
  562    HB3  LEU  72          2HB       LEU  72   9.305   1.631   3.121
  563    HG   LEU  72           HG       LEU  72   7.610   1.751   0.627
  564   HD11  LEU  72          1HD1      LEU  72   6.377  -0.129   1.635
  565   HD12  LEU  72          2HD1      LEU  72   7.591  -0.221   2.913
  566   HD13  LEU  72          3HD1      LEU  72   8.043  -0.560   1.243
  567   HD21  LEU  72          1HD2      LEU  72   6.915   3.420   2.188
  568   HD22  LEU  72          2HD2      LEU  72   7.021   2.282   3.532
  569   HD23  LEU  72          3HD2      LEU  72   5.779   2.073   2.296
  570    H    ALA  73           H        ALA  73  12.042   2.553   0.961
  571    HA   ALA  73           HA       ALA  73  13.387   2.844   3.456
  572    HB1  ALA  73          1HB       ALA  73  14.023   1.226   1.705
  573    HB2  ALA  73          2HB       ALA  73  15.368   2.222   2.270
  574    HB3  ALA  73          3HB       ALA  73  14.600   2.572   0.720
  575    H    HIS  74           H        HIS  74  12.103   5.261   2.610
  576    HA   HIS  74           HA       HIS  74  14.045   7.128   1.665
  577    HB2  HIS  74          1HB       HIS  74  11.594   7.450   1.372
  578    HB3  HIS  74          2HB       HIS  74  11.426   7.630   3.117
  579    HD1  HIS  74           HD1      HIS  74  11.344   9.968   3.867
  580    HD2  HIS  74           HD2      HIS  74  13.443   9.573   0.298
  581    HE1  HIS  74           HE1      HIS  74  11.999  12.301   3.204
  582    HE2  HIS  74           HE2      HIS  74  13.121  12.046   0.963
  583    H    GLY  75           H        GLY  75  15.832   6.830   3.020
  584    HA2  GLY  75          1HA       GLY  75  17.102   7.898   4.701
  585    HA3  GLY  75          2HA       GLY  75  15.616   8.249   5.572
  586    H    ARG  76           H        ARG  76  16.246   5.058   4.317
  587    HA   ARG  76           HA       ARG  76  17.237   4.098   6.873
  588    HB2  ARG  76          1HB       ARG  76  14.482   3.649   5.920
  589    HB3  ARG  76          2HB       ARG  76  15.316   2.216   6.509
  590    HG2  ARG  76          1HG       ARG  76  15.862   3.640   8.573
  591    HG3  ARG  76          2HG       ARG  76  14.595   4.719   7.990
  592    HD2  ARG  76          1HD       ARG  76  13.034   2.820   7.979
  593    HD3  ARG  76          2HD       ARG  76  14.299   1.790   8.629
  594    HE   ARG  76           HE       ARG  76  13.619   4.159  10.169
  595   HH11  ARG  76          1HH1      ARG  76  13.250   0.710   9.713
  596   HH12  ARG  76          2HH1      ARG  76  12.715   0.421  11.337
  597   HH21  ARG  76          1HH2      ARG  76  12.883   3.785  12.306
  598   HH22  ARG  76          2HH2      ARG  76  12.504   2.169  12.809
  599    H    ASP  77           H        ASP  77  17.658   1.705   6.788
  600    HA   ASP  77           HA       ASP  77  19.265   1.023   4.601
  601    HB2  ASP  77          1HB       ASP  77  18.059  -0.751   6.730
  602    HB3  ASP  77          2HB       ASP  77  19.320  -1.247   5.608
  603    H    ALA  78           H        ALA  78  18.497   0.823   2.655
  604    HA   ALA  78           HA       ALA  78  15.936   0.094   1.867
  605    HB1  ALA  78          1HB       ALA  78  17.522   1.260   0.442
  606    HB2  ALA  78          2HB       ALA  78  16.898  -0.185  -0.353
  607    HB3  ALA  78          3HB       ALA  78  18.515  -0.194   0.348
  608    H    GLU  79           H        GLU  79  18.731  -1.902   2.538
  609    HA   GLU  79           HA       GLU  79  17.821  -4.252   1.279
  610    HB2  GLU  79          1HB       GLU  79  19.758  -3.878   3.559
  611    HB3  GLU  79          2HB       GLU  79  19.482  -5.412   2.741
  612    HG2  GLU  79          1HG       GLU  79  20.134  -4.268   0.605
  613    HG3  GLU  79          2HG       GLU  79  20.634  -2.890   1.581
  614    H    GLU  80           H        GLU  80  17.526  -3.123   4.645
  615    HA   GLU  80           HA       GLU  80  16.090  -5.368   5.586
  616    HB2  GLU  80          1HB       GLU  80  17.094  -3.832   7.157
  617    HB3  GLU  80          2HB       GLU  80  16.115  -2.505   6.543
  618    HG2  GLU  80          1HG       GLU  80  14.104  -3.607   7.338
  619    HG3  GLU  80          2HG       GLU  80  15.060  -4.957   7.922
  620    H    VAL  81           H        VAL  81  15.114  -2.272   4.224
  621    HA   VAL  81           HA       VAL  81  12.361  -2.491   4.484
  622    HB   VAL  81           HB       VAL  81  13.975  -1.102   2.356
  623   HG11  VAL  81          1HG1      VAL  81  11.063  -0.783   3.076
  624   HG12  VAL  81          2HG1      VAL  81  11.694  -1.436   1.565
  625   HG13  VAL  81          3HG1      VAL  81  11.965   0.258   1.975
  626   HG21  VAL  81          1HG2      VAL  81  13.466   0.874   3.758
  627   HG22  VAL  81          2HG2      VAL  81  14.484  -0.324   4.546
  628   HG23  VAL  81          3HG2      VAL  81  12.773  -0.213   4.961
  629    H    ARG  82           H        ARG  82  14.424  -3.492   1.736
  630    HA   ARG  82           HA       ARG  82  12.434  -4.569   0.111
  631    HB2  ARG  82          1HB       ARG  82  14.866  -4.224  -0.475
  632    HB3  ARG  82          2HB       ARG  82  15.210  -5.709   0.400
  633    HG2  ARG  82          1HG       ARG  82  13.714  -6.930  -1.095
  634    HG3  ARG  82          2HG       ARG  82  13.411  -5.443  -1.983
  635    HD2  ARG  82          1HD       ARG  82  15.807  -5.295  -2.505
  636    HD3  ARG  82          2HD       ARG  82  16.065  -6.827  -1.676
  637    HE   ARG  82           HE       ARG  82  14.514  -7.798  -3.384
  638   HH11  ARG  82          1HH1      ARG  82  16.381  -4.913  -4.092
  639   HH12  ARG  82          2HH1      ARG  82  16.372  -5.182  -5.806
  640   HH21  ARG  82          1HH2      ARG  82  14.505  -8.147  -5.631
  641   HH22  ARG  82          2HH2      ARG  82  15.301  -7.013  -6.678
  642    H    THR  83           H        THR  83  14.331  -6.077   2.683
  643    HA   THR  83           HA       THR  83  13.356  -8.679   2.458
  644    HB   THR  83           HB       THR  83  14.429  -7.106   4.794
  645    HG1  THR  83           HG1      THR  83  15.457  -8.949   2.929
  646   HG21  THR  83          1HG2      THR  83  12.970  -8.838   5.707
  647   HG22  THR  83          2HG2      THR  83  14.664  -9.221   6.013
  648   HG23  THR  83          3HG2      THR  83  13.790 -10.059   4.731
  649    H    GLU  84           H        GLU  84  12.281  -6.061   4.620
  650    HA   GLU  84           HA       GLU  84  10.148  -7.372   5.820
  651    HB2  GLU  84          1HB       GLU  84  10.664  -4.467   5.306
  652    HB3  GLU  84          2HB       GLU  84   9.212  -5.012   6.124
  653    HG2  GLU  84          1HG       GLU  84  12.013  -5.604   7.019
  654    HG3  GLU  84          2HG       GLU  84  10.990  -4.330   7.674
  655    H    VAL  85           H        VAL  85  10.171  -5.419   2.856
  656    HA   VAL  85           HA       VAL  85   7.446  -5.560   2.259
  657    HB   VAL  85           HB       VAL  85   9.879  -5.333   0.492
  658   HG11  VAL  85          1HG1      VAL  85   8.355  -4.764  -1.355
  659   HG12  VAL  85          2HG1      VAL  85   6.984  -5.219  -0.340
  660   HG13  VAL  85          3HG1      VAL  85   8.166  -6.436  -0.821
  661   HG21  VAL  85          1HG2      VAL  85   9.391  -3.424   1.902
  662   HG22  VAL  85          2HG2      VAL  85   7.732  -3.378   1.302
  663   HG23  VAL  85          3HG2      VAL  85   9.076  -3.034   0.211
  664    H    LEU  86           H        LEU  86  10.104  -7.698   1.227
  665    HA   LEU  86           HA       LEU  86   8.606  -9.444  -0.341
  666    HB2  LEU  86          1HB       LEU  86  11.142  -9.882   1.227
  667    HB3  LEU  86          2HB       LEU  86  10.468 -11.073   0.117
  668    HG   LEU  86           HG       LEU  86  11.203  -8.283  -0.733
  669   HD11  LEU  86          1HD1      LEU  86  13.177  -9.402   0.160
  670   HD12  LEU  86          2HD1      LEU  86  13.273  -9.236  -1.594
  671   HD13  LEU  86          3HD1      LEU  86  12.863 -10.794  -0.876
  672   HD21  LEU  86          1HD2      LEU  86  11.249  -9.351  -2.959
  673   HD22  LEU  86          2HD2      LEU  86   9.658  -9.397  -2.203
  674   HD23  LEU  86          3HD2      LEU  86  10.665 -10.843  -2.222
  675    H    LYS  87           H        LYS  87   9.084  -9.319   3.112
  676    HA   LYS  87           HA       LYS  87   8.041 -11.923   3.675
  677    HB2  LYS  87          1HB       LYS  87   8.533  -9.484   5.380
  678    HB3  LYS  87          2HB       LYS  87   7.847 -10.967   6.031
  679    HG2  LYS  87          1HG       LYS  87   9.809 -12.192   5.602
  680    HG3  LYS  87          2HG       LYS  87  10.461 -10.928   4.549
  681    HD2  LYS  87          1HD       LYS  87  11.570 -10.974   6.738
  682    HD3  LYS  87          2HD       LYS  87  10.729  -9.452   6.463
  683    HE2  LYS  87          1HE       LYS  87   8.832 -10.327   7.813
  684    HE3  LYS  87          2HE       LYS  87   9.800 -11.758   8.166
  685    HZ1  LYS  87          1HZ       LYS  87  11.446 -10.349   9.223
  686    HZ2  LYS  87          2HZ       LYS  87   9.934 -10.114   9.942
  687    HZ3  LYS  87          3HZ       LYS  87  10.541  -8.963   8.858
  688    H    CYS  88           H        CYS  88   6.589  -9.144   2.587
  689    HA   CYS  88           HA       CYS  88   3.989  -9.950   3.692
  690    HB2  CYS  88          1HB       CYS  88   5.103  -7.290   2.904
  691    HB3  CYS  88          2HB       CYS  88   3.351  -7.558   2.800
  692    H    VAL  89           H        VAL  89   5.884  -9.874   0.880
  693    HA   VAL  89           HA       VAL  89   3.677  -9.736  -0.992
  694    HB   VAL  89           HB       VAL  89   6.577 -10.432  -1.473
  695   HG11  VAL  89          1HG1      VAL  89   5.123 -11.302  -3.205
  696   HG12  VAL  89          2HG1      VAL  89   6.057  -9.940  -3.825
  697   HG13  VAL  89          3HG1      VAL  89   4.361  -9.725  -3.385
  698   HG21  VAL  89          1HG2      VAL  89   6.803  -8.159  -2.324
  699   HG22  VAL  89          2HG2      VAL  89   6.324  -8.157  -0.629
  700   HG23  VAL  89          3HG2      VAL  89   5.131  -7.822  -1.882
  701    H    ASP  90           H        ASP  90   2.575 -11.442  -1.747
  702    HA   ASP  90           HA       ASP  90   3.822 -13.979  -2.127
  703    HB2  ASP  90          1HB       ASP  90   2.512 -15.345  -0.684
  704    HB3  ASP  90          2HB       ASP  90   3.115 -14.025   0.316
  705    H    LYS  91           H        LYS  91   1.764 -15.612  -2.652
  706    HA   LYS  91           HA       LYS  91   1.012 -14.588  -5.208
  707    HB2  LYS  91          1HB       LYS  91   0.007 -17.141  -3.968
  708    HB3  LYS  91          2HB       LYS  91   0.186 -16.748  -5.671
  709    HG2  LYS  91          1HG       LYS  91   2.622 -16.673  -5.371
  710    HG3  LYS  91          2HG       LYS  91   2.399 -17.190  -3.703
  711    HD2  LYS  91          1HD       LYS  91   2.873 -19.176  -4.814
  712    HD3  LYS  91          2HD       LYS  91   1.115 -19.178  -4.716
  713    HE2  LYS  91          1HE       LYS  91   2.697 -18.264  -7.118
  714    HE3  LYS  91          2HE       LYS  91   2.018 -19.877  -6.930
  715    HZ1  LYS  91          1HZ       LYS  91  -0.197 -18.769  -6.727
  716    HZ2  LYS  91          2HZ       LYS  91   0.530 -18.629  -8.244
  717    HZ3  LYS  91          3HZ       LYS  91   0.543 -17.317  -7.183
  718    H    ASN  92           H        ASN  92  -1.009 -14.391  -6.111
  719    HA   ASN  92           HA       ASN  92  -2.946 -13.169  -4.429
  720    HB2  ASN  92          1HB       ASN  92  -4.255 -13.171  -6.713
  721    HB3  ASN  92          2HB       ASN  92  -2.919 -12.078  -6.443
  722   HD21  ASN  92          1HD2      ASN  92  -4.166 -14.684  -8.280
  723   HD22  ASN  92          2HD2      ASN  92  -2.833 -14.867  -9.366
  724    H    THR  93           H        THR  93  -3.119 -15.300  -3.212
  725    HA   THR  93           HA       THR  93  -4.414 -17.547  -4.301
  726    HB   THR  93           HB       THR  93  -4.829 -18.135  -1.882
  727    HG1  THR  93           HG1      THR  93  -4.479 -16.641  -0.402
  728   HG21  THR  93          1HG2      THR  93  -2.031 -17.292  -2.628
  729   HG22  THR  93          2HG2      THR  93  -2.798 -18.819  -3.057
  730   HG23  THR  93          3HG2      THR  93  -2.463 -18.447  -1.368
  731    H    ASP  94           H        ASP  94  -5.700 -14.554  -3.078
  732    HA   ASP  94           HA       ASP  94  -8.374 -15.588  -2.733
  733    HB2  ASP  94          1HB       ASP  94  -7.184 -12.826  -2.621
  734    HB3  ASP  94          2HB       ASP  94  -8.936 -13.056  -2.638
  735    H    ASN  95           H        ASN  95  -6.499 -14.797  -5.341
  736    HA   ASN  95           HA       ASN  95  -6.826 -14.424  -7.542
  737    HB2  ASN  95          1HB       ASN  95  -9.490 -15.689  -6.897
  738    HB3  ASN  95          2HB       ASN  95  -8.923 -15.366  -8.526
  739   HD21  ASN  95          1HD2      ASN  95  -8.611 -17.350  -5.727
  740   HD22  ASN  95          2HD2      ASN  95  -7.564 -18.541  -6.438
  741    H    ASN  96           H        ASN  96  -7.618 -12.345  -5.602
  742    HA   ASN  96           HA       ASN  96  -9.351 -10.754  -7.350
  743    HB2  ASN  96          1HB       ASN  96 -10.798 -11.547  -5.598
  744    HB3  ASN  96          2HB       ASN  96  -9.625 -11.141  -4.353
  745   HD21  ASN  96          1HD2      ASN  96 -12.384 -10.396  -4.535
  746   HD22  ASN  96          2HD2      ASN  96 -12.448  -8.667  -4.587
  747    H    ALA  97           H        ALA  97  -8.304  -8.985  -7.920
  748    HA   ALA  97           HA       ALA  97  -5.731  -8.365  -7.004
  749    HB1  ALA  97          1HB       ALA  97  -7.600  -6.614  -8.590
  750    HB2  ALA  97          2HB       ALA  97  -6.542  -7.855  -9.259
  751    HB3  ALA  97          3HB       ALA  97  -5.850  -6.440  -8.468
  752    H    CYS  98           H        CYS  98  -8.874  -7.014  -6.129
  753    HA   CYS  98           HA       CYS  98  -7.890  -4.735  -4.763
  754    HB2  CYS  98          1HB       CYS  98 -10.443  -6.274  -4.231
  755    HB3  CYS  98          2HB       CYS  98 -10.068  -4.660  -3.644
  756    H    HIS  99           H        HIS  99  -8.556  -8.048  -3.704
  757    HA   HIS  99           HA       HIS  99  -7.954  -7.422  -0.953
  758    HB2  HIS  99          1HB       HIS  99  -9.514  -9.295  -1.920
  759    HB3  HIS  99          2HB       HIS  99  -8.020 -10.218  -2.042
  760    HD1  HIS  99           HD1      HIS  99 -10.744  -9.783   0.138
  761    HD2  HIS  99           HD2      HIS  99  -6.641 -10.109   0.710
  762    HE1  HIS  99           HE1      HIS  99 -10.450 -10.471   2.534
  763    HE2  HIS  99           HE2      HIS  99  -7.963 -10.429   2.909
  764    H    TRP 100           H        TRP 100  -6.259  -8.540  -3.748
  765    HA   TRP 100           HA       TRP 100  -4.017  -9.691  -2.449
  766    HB2  TRP 100          1HB       TRP 100  -4.633 -10.132  -4.816
  767    HB3  TRP 100          2HB       TRP 100  -4.169  -8.481  -5.224
  768    HD1  TRP 100           HD1      TRP 100  -1.848 -10.170  -2.791
  769    HE1  TRP 100           HE1      TRP 100   0.321 -10.848  -3.995
  770    HE3  TRP 100           HE3      TRP 100  -3.302  -9.347  -7.628
  771    HZ2  TRP 100           HZ2      TRP 100   1.287 -11.022  -6.636
  772    HZ3  TRP 100           HZ3      TRP 100  -1.696  -9.796  -9.431
  773    HH2  TRP 100           HH2      TRP 100   0.549 -10.619  -8.952
  774    H    ALA 101           H        ALA 101  -4.486  -6.528  -4.019
  775    HA   ALA 101           HA       ALA 101  -2.007  -5.424  -3.285
  776    HB1  ALA 101          1HB       ALA 101  -4.631  -4.069  -3.887
  777    HB2  ALA 101          2HB       ALA 101  -3.356  -4.456  -5.041
  778    HB3  ALA 101          3HB       ALA 101  -3.072  -3.250  -3.784
  779    H    PHE 102           H        PHE 102  -5.146  -5.466  -1.707
  780    HA   PHE 102           HA       PHE 102  -4.511  -3.698   0.374
  781    HB2  PHE 102          1HB       PHE 102  -6.811  -4.278  -0.210
  782    HB3  PHE 102          2HB       PHE 102  -6.545  -5.928   0.349
  783    HD1  PHE 102           HD1      PHE 102  -6.472  -2.391   1.482
  784    HD2  PHE 102           HD2      PHE 102  -7.008  -6.470   2.580
  785    HE1  PHE 102           HE1      PHE 102  -7.164  -1.690   3.736
  786    HE2  PHE 102           HE2      PHE 102  -7.702  -5.775   4.834
  787    HZ   PHE 102           HZ       PHE 102  -7.782  -3.380   5.415
  788    H    ARG 103           H        ARG 103  -4.021  -7.150  -0.054
  789    HA   ARG 103           HA       ARG 103  -3.486  -7.818   2.637
  790    HB2  ARG 103          1HB       ARG 103  -3.920  -9.509   0.866
  791    HB3  ARG 103          2HB       ARG 103  -2.358  -9.112   0.159
  792    HG2  ARG 103          1HG       ARG 103  -1.302  -9.722   2.344
  793    HG3  ARG 103          2HG       ARG 103  -2.878 -10.309   2.861
  794    HD2  ARG 103          1HD       ARG 103  -1.258 -11.343   0.526
  795    HD3  ARG 103          2HD       ARG 103  -1.491 -12.143   2.074
  796    HE   ARG 103           HE       ARG 103  -4.014 -11.866   1.222
  797   HH11  ARG 103          1HH1      ARG 103  -1.110 -12.974  -0.352
  798   HH12  ARG 103          2HH1      ARG 103  -1.924 -14.151  -1.333
  799   HH21  ARG 103          1HH2      ARG 103  -5.127 -13.435  -0.061
  800   HH22  ARG 103          2HH2      ARG 103  -4.198 -14.456  -1.121
  801    H    GLY 104           H        GLY 104  -1.388  -6.864  -0.055
  802    HA2  GLY 104          1HA       GLY 104   1.070  -7.150   1.285
  803    HA3  GLY 104          2HA       GLY 104   0.775  -6.087  -0.096
  804    H    PHE 105           H        PHE 105  -1.095  -4.379   0.964
  805    HA   PHE 105           HA       PHE 105   0.550  -2.567   2.361
  806    HB2  PHE 105          1HB       PHE 105  -1.081  -1.692   0.876
  807    HB3  PHE 105          2HB       PHE 105  -2.375  -2.572   1.673
  808    HD1  PHE 105           HD1      PHE 105  -3.849  -1.064   2.627
  809    HD2  PHE 105           HD2      PHE 105   0.339  -0.344   2.915
  810    HE1  PHE 105           HE1      PHE 105  -4.287   0.914   4.010
  811    HE2  PHE 105           HE2      PHE 105  -0.103   1.641   4.297
  812    HZ   PHE 105           HZ       PHE 105  -2.413   2.271   4.849
  813    H    LYS 106           H        LYS 106  -2.202  -4.551   3.325
  814    HA   LYS 106           HA       LYS 106  -2.461  -3.541   5.933
  815    HB2  LYS 106          1HB       LYS 106  -4.364  -4.595   5.188
  816    HB3  LYS 106          2HB       LYS 106  -3.492  -5.938   4.465
  817    HG2  LYS 106          1HG       LYS 106  -4.717  -6.789   6.284
  818    HG3  LYS 106          2HG       LYS 106  -3.036  -6.723   6.816
  819    HD2  LYS 106          1HD       LYS 106  -3.451  -4.763   8.112
  820    HD3  LYS 106          2HD       LYS 106  -5.059  -4.568   7.407
  821    HE2  LYS 106          1HE       LYS 106  -4.206  -6.927   9.082
  822    HE3  LYS 106          2HE       LYS 106  -5.062  -5.522   9.715
  823    HZ1  LYS 106          1HZ       LYS 106  -6.087  -7.323   7.583
  824    HZ2  LYS 106          2HZ       LYS 106  -6.914  -6.019   8.270
  825    HZ3  LYS 106          3HZ       LYS 106  -6.551  -7.376   9.205
  826    H    CYS 107           H        CYS 107  -0.710  -6.329   4.636
  827    HA   CYS 107           HA       CYS 107   0.161  -7.410   7.061
  828    HB2  CYS 107          1HB       CYS 107   0.364  -8.765   5.141
  829    HB3  CYS 107          2HB       CYS 107   1.248  -7.534   4.249
  830    H    PHE 108           H        PHE 108   1.549  -4.936   4.967
  831    HA   PHE 108           HA       PHE 108   4.054  -4.878   6.339
  832    HB2  PHE 108          1HB       PHE 108   3.626  -4.319   3.901
  833    HB3  PHE 108          2HB       PHE 108   2.985  -2.777   4.467
  834    HD1  PHE 108           HD1      PHE 108   4.472  -1.095   5.415
  835    HD2  PHE 108           HD2      PHE 108   5.965  -4.818   3.985
  836    HE1  PHE 108           HE1      PHE 108   6.755  -0.182   5.422
  837    HE2  PHE 108           HE2      PHE 108   8.245  -3.908   3.996
  838    HZ   PHE 108           HZ       PHE 108   8.642  -1.589   4.708
  839    H    GLN 109           H        GLN 109   1.240  -2.704   6.202
  840    HA   GLN 109           HA       GLN 109   2.336  -0.753   7.934
  841    HB2  GLN 109          1HB       GLN 109   0.141   0.229   7.967
  842    HB3  GLN 109          2HB       GLN 109   0.507  -0.300   6.334
  843    HG2  GLN 109          1HG       GLN 109  -1.517  -1.218   6.367
  844    HG3  GLN 109          2HG       GLN 109  -0.804  -2.466   7.394
  845   HE21  GLN 109          1HE2      GLN 109  -2.727  -2.849   8.461
  846   HE22  GLN 109          2HE2      GLN 109  -3.410  -1.735   9.592
  847    H    LYS 110           H        LYS 110   1.195  -3.837   8.572
  848    HA   LYS 110           HA       LYS 110  -0.099  -3.437  11.046
  849    HB2  LYS 110          1HB       LYS 110  -0.373  -5.469   9.714
  850    HB3  LYS 110          2HB       LYS 110   1.319  -5.865   9.954
  851    HG2  LYS 110          1HG       LYS 110   1.008  -6.279  12.245
  852    HG3  LYS 110          2HG       LYS 110  -0.610  -5.581  12.226
  853    HD2  LYS 110          1HD       LYS 110  -1.360  -7.398  10.754
  854    HD3  LYS 110          2HD       LYS 110   0.258  -8.099  10.812
  855    HE2  LYS 110          1HE       LYS 110  -1.329  -9.183  12.369
  856    HE3  LYS 110          2HE       LYS 110   0.069  -8.474  13.177
  857    HZ1  LYS 110          1HZ       LYS 110  -1.231  -6.639  13.891
  858    HZ2  LYS 110          2HZ       LYS 110  -2.106  -8.035  14.274
  859    HZ3  LYS 110          3HZ       LYS 110  -2.550  -7.103  12.939
  860    H    ASN 111           H        ASN 111   3.281  -3.850  10.153
  861    HA   ASN 111           HA       ASN 111   3.956  -3.385  12.978
  862    HB2  ASN 111          1HB       ASN 111   5.167  -5.254  13.135
  863    HB3  ASN 111          2HB       ASN 111   4.461  -5.755  11.608
  864   HD21  ASN 111          1HD2      ASN 111   5.691  -5.729   9.766
  865   HD22  ASN 111          2HD2      ASN 111   7.398  -5.448   9.778
  866    H    ASN 112           H        ASN 112   4.333  -2.436   9.748
  867    HA   ASN 112           HA       ASN 112   6.557  -0.669  10.530
  868    HB2  ASN 112          1HB       ASN 112   6.222  -2.198   7.947
  869    HB3  ASN 112          2HB       ASN 112   7.305  -0.810   8.109
  870   HD21  ASN 112          1HD2      ASN 112   7.660  -3.774   7.644
  871   HD22  ASN 112          2HD2      ASN 112   8.872  -4.240   8.792
  872    H    LEU 113           H        LEU 113   4.197   0.395  10.919
  873    HA   LEU 113           HA       LEU 113   3.162   1.622   8.508
  874    HB2  LEU 113          1HB       LEU 113   1.546   1.025  10.156
  875    HB3  LEU 113          2HB       LEU 113   2.397   1.908  11.406
  876    HG   LEU 113           HG       LEU 113   1.858   4.020  10.193
  877   HD11  LEU 113          1HD1      LEU 113   0.221   3.999   8.423
  878   HD12  LEU 113          2HD1      LEU 113   0.109   2.241   8.509
  879   HD13  LEU 113          3HD1      LEU 113   1.603   3.002   7.965
  880   HD21  LEU 113          1HD2      LEU 113   0.482   3.212  12.058
  881   HD22  LEU 113          2HD2      LEU 113  -0.520   2.313  10.918
  882   HD23  LEU 113          3HD2      LEU 113  -0.482   4.076  10.859
  883    H    SER 114           H        SER 114   5.182   2.482  11.215
  884    HA   SER 114           HA       SER 114   5.237   5.270  10.899
  885    HB2  SER 114          1HB       SER 114   6.139   4.130  12.874
  886    HB3  SER 114          2HB       SER 114   7.406   3.400  11.891
  887    HG   SER 114           HG       SER 114   8.312   5.169  12.812
  888    H    LEU 115           H        LEU 115   7.024   2.697   9.296
  889    HA   LEU 115           HA       LEU 115   8.886   4.319   7.934
  890    HB2  LEU 115          1HB       LEU 115   9.094   1.874   8.240
  891    HB3  LEU 115          2HB       LEU 115   7.762   1.644   7.127
  892    HG   LEU 115           HG       LEU 115   9.101   2.681   5.331
  893   HD11  LEU 115          1HD1      LEU 115  11.158   2.806   7.508
  894   HD12  LEU 115          2HD1      LEU 115  10.535   4.129   6.525
  895   HD13  LEU 115          3HD1      LEU 115  11.569   2.900   5.797
  896   HD21  LEU 115          1HD2      LEU 115   9.089   0.248   5.641
  897   HD22  LEU 115          2HD2      LEU 115  10.485   0.382   6.711
  898   HD23  LEU 115          3HD2      LEU 115  10.631   0.823   5.009
  899    H    ILE 116           H        ILE 116   5.621   3.287   7.263
  900    HA   ILE 116           HA       ILE 116   5.538   4.056   4.543
  901    HB   ILE 116           HB       ILE 116   3.263   3.778   6.521
  902   HG12  ILE 116          1HG1      ILE 116   4.460   1.790   4.572
  903   HG13  ILE 116          2HG1      ILE 116   4.580   1.723   6.336
  904   HG21  ILE 116          1HG2      ILE 116   1.879   3.416   4.510
  905   HG22  ILE 116          2HG2      ILE 116   3.270   3.822   3.506
  906   HG23  ILE 116          3HG2      ILE 116   2.571   5.039   4.577
  907   HD11  ILE 116          1HD1      ILE 116   2.157   1.322   4.615
  908   HD12  ILE 116          2HD1      ILE 116   2.062   1.574   6.357
  909   HD13  ILE 116          3HD1      ILE 116   2.922   0.175   5.713
  910    H    LYS 117           H        LYS 117   4.795   5.677   7.571
  911    HA   LYS 117           HA       LYS 117   3.756   8.050   6.433
  912    HB2  LYS 117          1HB       LYS 117   4.940   7.453   9.138
  913    HB3  LYS 117          2HB       LYS 117   4.283   9.029   8.712
  914    HG2  LYS 117          1HG       LYS 117   2.106   7.982   8.266
  915    HG3  LYS 117          2HG       LYS 117   2.763   6.418   8.739
  916    HD2  LYS 117          1HD       LYS 117   3.195   7.269  10.988
  917    HD3  LYS 117          2HD       LYS 117   2.584   8.856  10.519
  918    HE2  LYS 117          1HE       LYS 117   0.383   7.845  10.058
  919    HE3  LYS 117          2HE       LYS 117   1.007   6.283  10.583
  920    HZ1  LYS 117          1HZ       LYS 117  -0.216   7.351  12.348
  921    HZ2  LYS 117          2HZ       LYS 117   0.768   8.721  12.258
  922    HZ3  LYS 117          3HZ       LYS 117   1.419   7.248  12.775
  923    H    ALA 118           H        ALA 118   6.991   7.005   7.350
  924    HA   ALA 118           HA       ALA 118   8.250   9.533   6.893
  925    HB1  ALA 118          1HB       ALA 118   9.429   6.768   6.998
  926    HB2  ALA 118          2HB       ALA 118   9.197   7.847   8.374
  927    HB3  ALA 118          3HB       ALA 118  10.329   8.284   7.093
  928    H    SER 119           H        SER 119   7.511   6.748   4.949
  929    HA   SER 119           HA       SER 119   9.169   7.107   2.763
  930    HB2  SER 119          1HB       SER 119   7.739   5.131   3.124
  931    HB3  SER 119          2HB       SER 119   6.311   6.102   2.783
  932    HG   SER 119           HG       SER 119   8.433   5.852   0.933
  933    H    ILE 120           H        ILE 120   5.965   8.499   3.371
  934    HA   ILE 120           HA       ILE 120   6.076   9.988   0.872
  935    HB   ILE 120           HB       ILE 120   3.781  10.720   1.491
  936   HG12  ILE 120          1HG1      ILE 120   4.038   8.755   3.765
  937   HG13  ILE 120          2HG1      ILE 120   4.176  10.500   3.971
  938   HG21  ILE 120          1HG2      ILE 120   2.729   8.528   1.159
  939   HG22  ILE 120          2HG2      ILE 120   4.271   7.752   1.519
  940   HG23  ILE 120          3HG2      ILE 120   4.110   8.771   0.090
  941   HD11  ILE 120          1HD1      ILE 120   1.897  10.756   3.114
  942   HD12  ILE 120          2HD1      ILE 120   1.964   9.748   4.556
  943   HD13  ILE 120          3HD1      ILE 120   1.767   9.006   2.969
  944    H    LYS 121           H        LYS 121   7.391  10.494   3.769
  945    HA   LYS 121           HA       LYS 121   6.556  13.243   4.177
  946    HB2  LYS 121          1HB       LYS 121   6.902  11.786   6.113
  947    HB3  LYS 121          2HB       LYS 121   8.569  11.517   5.631
  948    HG2  LYS 121          1HG       LYS 121   8.484  13.107   7.445
  949    HG3  LYS 121          2HG       LYS 121   9.033  13.916   5.975
  950    HD2  LYS 121          1HD       LYS 121   6.792  14.815   5.626
  951    HD3  LYS 121          2HD       LYS 121   6.221  13.977   7.069
  952    HE2  LYS 121          1HE       LYS 121   8.340  16.120   6.991
  953    HE3  LYS 121          2HE       LYS 121   6.675  16.335   7.525
  954    HZ1  LYS 121          1HZ       LYS 121   8.722  14.601   8.798
  955    HZ2  LYS 121          2HZ       LYS 121   7.104  14.695   9.284
  956    HZ3  LYS 121          3HZ       LYS 121   8.107  16.050   9.414
  957    H    LYS 122           H        LYS 122   7.499  14.860   3.090
  958    HA   LYS 122           HA       LYS 122  10.096  14.594   1.877
  959    HB2  LYS 122          1HB       LYS 122   9.135  17.331   2.290
  960    HB3  LYS 122          2HB       LYS 122   9.668  16.538   0.834
  961    HG2  LYS 122          1HG       LYS 122   7.485  15.443   0.614
  962    HG3  LYS 122          2HG       LYS 122   6.930  16.299   2.051
  963    HD2  LYS 122          1HD       LYS 122   6.152  17.474   0.103
  964    HD3  LYS 122          2HD       LYS 122   7.395  18.446   0.890
  965    HE2  LYS 122          1HE       LYS 122   9.039  17.684  -0.738
  966    HE3  LYS 122          2HE       LYS 122   7.827  16.658  -1.501
  967    HZ1  LYS 122          1HZ       LYS 122   8.126  18.723  -2.710
  968    HZ2  LYS 122          2HZ       LYS 122   7.722  19.619  -1.337
  969    HZ3  LYS 122          3HZ       LYS 122   6.564  18.634  -2.072
  970    H    ASP 123           H        ASP 123  11.621  14.193   3.327
  971    HA   ASP 123           HA       ASP 123  11.699  15.703   5.812
  972    HB2  ASP 123          1HB       ASP 123  11.937  13.205   5.780
  973    HB3  ASP 123          2HB       ASP 123  13.478  13.420   4.959
  974    H21  ACD 201           H21      ACD   1  -4.658   4.795   1.486
  975    H22  ACD 201           H22      ACD   1  -3.542   5.106   2.823
  976    H31  ACD 201           H31      ACD   1  -2.164   6.535   1.368
  977    H32  ACD 201           H32      ACD   1  -3.290   6.313   0.032
  978    H41  ACD 201           H41      ACD   1  -2.813   3.845   0.077
  979    H42  ACD 201           H42      ACD   1  -1.364   4.809  -0.254
  980    H5   ACD 201           H5       ACD   1  -1.957   3.250   2.322
  981    H6   ACD 201           H6       ACD   1   0.315   3.828   2.807
  982    H71  ACD 201           H71      ACD   1   0.743   4.891   0.146
  983    H72  ACD 201           H72      ACD   1  -0.147   6.163   0.980
  984    H8   ACD 201           H8       ACD   1   1.740   6.484   2.596
  985    H9   ACD 201           H9       ACD   1   3.846   5.604   1.905
  986   H101  ACD 201          H101      ACD   1   2.774   4.813  -0.665
  987   H102  ACD 201          H102      ACD   1   2.287   3.509   0.424
  988    H11  ACD 201           H11      ACD   1   5.266   4.366   0.278
  989    H12  ACD 201           H12      ACD   1   5.572   2.021   0.045
  990   H131  ACD 201          H131      ACD   1   2.581   2.034  -0.598
  991   H132  ACD 201          H132      ACD   1   3.676   0.655  -0.704
  992    H14  ACD 201           H14      ACD   1   2.600   1.752   1.993
  993    H15  ACD 201           H15      ACD   1   2.538  -0.581   2.484
  994   H161  ACD 201          H161      ACD   1   2.703  -1.304  -0.322
  995   H162  ACD 201          H162      ACD   1   4.365  -0.903   0.129
  996   H171  ACD 201          H171      ACD   1   4.396  -2.575   1.871
  997   H172  ACD 201          H172      ACD   1   2.660  -2.850   1.721
  998   H181  ACD 201          H181      ACD   1   4.719  -3.436  -0.447
  999   H182  ACD 201          H182      ACD   1   2.983  -3.727  -0.579
 1000   H191  ACD 201          H191      ACD   1   4.907  -5.043   1.390
 1001   H192  ACD 201          H192      ACD   1   3.156  -5.246   1.450
 1002   H201  ACD 201          H201      ACD   1   4.933  -5.983  -0.883
 1003   H202  ACD 201          H202      ACD   1   3.215  -6.167  -0.850
 1004   H203  ACD 201          H203      ACD   1   4.204  -7.093   0.227
  Start of MODEL   20
    1    H1   MET   1          1H        MET   1  15.410  12.717 -18.354
    2    H2   MET   1          2H        MET   1  16.198  11.816 -17.158
    3    H3   MET   1          3H        MET   1  16.168  13.501 -17.065
    4    HA   MET   1           HA       MET   1  13.808  13.508 -16.743
    5    HB2  MET   1          1HB       MET   1  12.619  11.360 -16.388
    6    HB3  MET   1          2HB       MET   1  13.219  11.534 -18.030
    7    HG2  MET   1          1HG       MET   1  15.080  10.064 -17.532
    8    HG3  MET   1          2HG       MET   1  14.549   9.931 -15.856
    9    HE1  MET   1          1HE       MET   1  14.600   7.294 -16.005
   10    HE2  MET   1          2HE       MET   1  15.154   7.399 -17.676
   11    HE3  MET   1          3HE       MET   1  13.786   6.367 -17.265
   12    H    GLU   2           H        GLU   2  13.539  14.122 -14.702
   13    HA   GLU   2           HA       GLU   2  15.323  13.146 -12.659
   14    HB2  GLU   2          1HB       GLU   2  13.066  15.136 -12.552
   15    HB3  GLU   2          2HB       GLU   2  14.123  14.752 -11.203
   16    HG2  GLU   2          1HG       GLU   2  15.036  15.872 -13.834
   17    HG3  GLU   2          2HG       GLU   2  14.757  16.818 -12.372
   18    H    PHE   3           H        PHE   3  14.947  11.343 -11.608
   19    HA   PHE   3           HA       PHE   3  12.514   9.936 -11.709
   20    HB2  PHE   3          1HB       PHE   3  14.634   8.794 -11.323
   21    HB3  PHE   3          2HB       PHE   3  14.817   9.617  -9.770
   22    HD1  PHE   3           HD1      PHE   3  13.953   8.650  -7.830
   23    HD2  PHE   3           HD2      PHE   3  12.624   7.275 -11.628
   24    HE1  PHE   3           HE1      PHE   3  12.745   6.805  -6.735
   25    HE2  PHE   3           HE2      PHE   3  11.408   5.431 -10.541
   26    HZ   PHE   3           HZ       PHE   3  11.468   5.196  -8.090
   27    H    THR   4           H        THR   4  10.727  10.766 -10.918
   28    HA   THR   4           HA       THR   4  10.809  12.201  -8.362
   29    HB   THR   4           HB       THR   4   8.226  12.107  -9.729
   30    HG1  THR   4           HG1      THR   4  10.552  12.837 -11.120
   31   HG21  THR   4          1HG2      THR   4   8.768  13.595  -7.869
   32   HG22  THR   4          2HG2      THR   4   8.320  14.501  -9.313
   33   HG23  THR   4          3HG2      THR   4  10.015  14.363  -8.849
   34    H    VAL   5           H        VAL   5  10.475  11.023  -6.658
   35    HA   VAL   5           HA       VAL   5   8.935   8.577  -6.682
   36    HB   VAL   5           HB       VAL   5   9.572   8.266  -4.488
   37   HG11  VAL   5          1HG1      VAL   5  11.858   8.894  -4.201
   38   HG12  VAL   5          2HG1      VAL   5  11.697  10.164  -5.411
   39   HG13  VAL   5          3HG1      VAL   5  11.552   8.473  -5.885
   40   HG21  VAL   5          1HG2      VAL   5   9.935  11.229  -4.048
   41   HG22  VAL   5          2HG2      VAL   5   9.965   9.951  -2.829
   42   HG23  VAL   5          3HG2      VAL   5   8.460  10.349  -3.655
   43    H    SER   6           H        SER   6   6.960   8.243  -5.693
   44    HA   SER   6           HA       SER   6   5.057  10.274  -6.110
   45    HB2  SER   6          1HB       SER   6   4.787   7.707  -4.523
   46    HB3  SER   6          2HB       SER   6   3.453   8.690  -5.135
   47    HG   SER   6           HG       SER   6   4.564   6.736  -6.394
   48    H    THR   7           H        THR   7   5.051  12.081  -4.937
   49    HA   THR   7           HA       THR   7   5.941  12.050  -2.181
   50    HB   THR   7           HB       THR   7   5.775  14.499  -2.309
   51    HG1  THR   7           HG1      THR   7   4.671  13.937  -4.890
   52   HG21  THR   7          1HG2      THR   7   7.487  14.869  -4.010
   53   HG22  THR   7          2HG2      THR   7   7.128  13.300  -4.729
   54   HG23  THR   7          3HG2      THR   7   7.816  13.391  -3.108
   55    H    THR   8           H        THR   8   4.638  13.694  -0.720
   56    HA   THR   8           HA       THR   8   2.174  12.558  -0.075
   57    HB   THR   8           HB       THR   8   2.652  15.392   0.653
   58    HG1  THR   8           HG1      THR   8   4.279  13.647   2.054
   59   HG21  THR   8          1HG2      THR   8   0.911  14.069   1.745
   60   HG22  THR   8          2HG2      THR   8   2.161  14.523   2.902
   61   HG23  THR   8          3HG2      THR   8   2.114  12.885   2.250
   62    H    GLU   9           H        GLU   9   3.047  15.446  -1.880
   63    HA   GLU   9           HA       GLU   9   0.583  16.556  -2.413
   64    HB2  GLU   9          1HB       GLU   9   2.779  17.557  -2.971
   65    HB3  GLU   9          2HB       GLU   9   2.958  16.400  -4.280
   66    HG2  GLU   9          1HG       GLU   9   2.259  18.468  -5.208
   67    HG3  GLU   9          2HG       GLU   9   0.901  17.348  -5.304
   68    H    ASP  10           H        ASP  10   2.293  14.005  -4.173
   69    HA   ASP  10           HA       ASP  10   0.333  13.751  -6.219
   70    HB2  ASP  10          1HB       ASP  10   2.364  11.682  -5.340
   71    HB3  ASP  10          2HB       ASP  10   1.479  11.719  -6.864
   72    H    LEU  11           H        LEU  11   0.910  12.138  -3.141
   73    HA   LEU  11           HA       LEU  11  -0.936  10.061  -3.529
   74    HB2  LEU  11          1HB       LEU  11   0.815   9.917  -1.864
   75    HB3  LEU  11          2HB       LEU  11   0.092  11.242  -0.942
   76    HG   LEU  11           HG       LEU  11  -1.914   9.792  -0.606
   77   HD11  LEU  11          1HD1      LEU  11  -1.735   7.414  -1.062
   78   HD12  LEU  11          2HD1      LEU  11  -0.159   7.665  -1.809
   79   HD13  LEU  11          3HD1      LEU  11  -1.606   8.349  -2.551
   80   HD21  LEU  11          1HD2      LEU  11  -0.893   8.364   1.083
   81   HD22  LEU  11          2HD2      LEU  11  -0.167   9.973   1.104
   82   HD23  LEU  11          3HD2      LEU  11   0.694   8.627   0.360
   83    H    GLN  12           H        GLN  12  -1.278  13.309  -2.193
   84    HA   GLN  12           HA       GLN  12  -3.939  12.919  -1.249
   85    HB2  GLN  12          1HB       GLN  12  -2.528  15.497  -1.953
   86    HB3  GLN  12          2HB       GLN  12  -4.034  15.368  -1.057
   87    HG2  GLN  12          1HG       GLN  12  -2.698  13.987   0.629
   88    HG3  GLN  12          2HG       GLN  12  -1.267  14.613  -0.191
   89   HE21  GLN  12          1HE2      GLN  12  -0.796  16.822  -0.057
   90   HE22  GLN  12          2HE2      GLN  12  -1.525  17.838   1.138
   91    H    ARG  13           H        ARG  13  -2.530  13.587  -4.285
   92    HA   ARG  13           HA       ARG  13  -4.852  14.656  -5.569
   93    HB2  ARG  13          1HB       ARG  13  -2.547  15.070  -6.344
   94    HB3  ARG  13          2HB       ARG  13  -2.381  13.366  -6.737
   95    HG2  ARG  13          1HG       ARG  13  -4.207  13.599  -8.377
   96    HG3  ARG  13          2HG       ARG  13  -4.260  15.335  -8.018
   97    HD2  ARG  13          1HD       ARG  13  -2.003  13.757  -9.237
   98    HD3  ARG  13          2HD       ARG  13  -2.926  15.067  -9.970
   99    HE   ARG  13           HE       ARG  13  -1.863  16.558  -8.308
  100   HH11  ARG  13          1HH1      ARG  13  -0.323  13.508  -9.098
  101   HH12  ARG  13          2HH1      ARG  13   1.249  14.015  -8.556
  102   HH21  ARG  13          1HH2      ARG  13   0.209  17.228  -7.617
  103   HH22  ARG  13          2HH2      ARG  13   1.548  16.129  -7.739
  104    H    TYR  14           H        TYR  14  -3.208  11.503  -5.607
  105    HA   TYR  14           HA       TYR  14  -5.006  10.202  -7.330
  106    HB2  TYR  14          1HB       TYR  14  -3.366   8.891  -5.153
  107    HB3  TYR  14          2HB       TYR  14  -3.996   8.140  -6.611
  108    HD1  TYR  14           HD1      TYR  14  -3.286  10.175  -8.651
  109    HD2  TYR  14           HD2      TYR  14  -1.043   8.644  -5.373
  110    HE1  TYR  14           HE1      TYR  14  -1.200  10.680  -9.845
  111    HE2  TYR  14           HE2      TYR  14   1.047   9.152  -6.562
  112    HH   TYR  14           HH       TYR  14   1.834   9.499  -8.847
  113    H    ARG  15           H        ARG  15  -5.053  10.758  -3.885
  114    HA   ARG  15           HA       ARG  15  -6.923   8.937  -3.036
  115    HB2  ARG  15          1HB       ARG  15  -6.043  11.612  -2.156
  116    HB3  ARG  15          2HB       ARG  15  -7.617  11.123  -1.562
  117    HG2  ARG  15          1HG       ARG  15  -6.480   8.977  -0.790
  118    HG3  ARG  15          2HG       ARG  15  -4.954   9.799  -1.129
  119    HD2  ARG  15          1HD       ARG  15  -5.452  11.514   0.480
  120    HD3  ARG  15          2HD       ARG  15  -7.083  10.886   0.716
  121    HE   ARG  15           HE       ARG  15  -5.555   8.766   1.360
  122   HH11  ARG  15          1HH1      ARG  15  -5.343  12.122   2.368
  123   HH12  ARG  15          2HH1      ARG  15  -4.745  11.726   3.948
  124   HH21  ARG  15          1HH2      ARG  15  -4.805   8.248   3.409
  125   HH22  ARG  15          2HH2      ARG  15  -4.446   9.518   4.547
  126    H    THR  16           H        THR  16  -7.466  12.093  -4.530
  127    HA   THR  16           HA       THR  16 -10.260  12.132  -4.297
  128    HB   THR  16           HB       THR  16  -8.299  13.537  -6.082
  129    HG1  THR  16           HG1      THR  16 -10.031  14.395  -3.983
  130   HG21  THR  16          1HG2      THR  16 -10.174  14.991  -6.842
  131   HG22  THR  16          2HG2      THR  16 -11.303  13.839  -6.126
  132   HG23  THR  16          3HG2      THR  16 -10.262  13.341  -7.461
  133    H    GLU  17           H        GLU  17  -8.173  11.222  -7.041
  134    HA   GLU  17           HA       GLU  17 -10.286  10.733  -8.835
  135    HB2  GLU  17          1HB       GLU  17  -7.710   9.229  -9.097
  136    HB3  GLU  17          2HB       GLU  17  -8.696   9.969 -10.338
  137    HG2  GLU  17          1HG       GLU  17  -8.018  12.199  -9.473
  138    HG3  GLU  17          2HG       GLU  17  -6.876  11.377  -8.406
  139    H    CYS  18           H        CYS  18  -8.555   8.575  -6.625
  140    HA   CYS  18           HA       CYS  18  -9.866   6.220  -7.535
  141    HB2  CYS  18          1HB       CYS  18  -8.434   6.780  -4.928
  142    HB3  CYS  18          2HB       CYS  18  -8.976   5.187  -5.470
  143    H    VAL  19           H        VAL  19 -10.545   8.612  -5.059
  144    HA   VAL  19           HA       VAL  19 -12.621   7.193  -3.787
  145    HB   VAL  19           HB       VAL  19 -11.771  10.060  -3.796
  146   HG11  VAL  19          1HG1      VAL  19 -14.215  10.158  -3.892
  147   HG12  VAL  19          2HG1      VAL  19 -13.611  10.649  -2.307
  148   HG13  VAL  19          3HG1      VAL  19 -14.314   9.046  -2.524
  149   HG21  VAL  19          1HG2      VAL  19 -12.151   7.953  -1.670
  150   HG22  VAL  19          2HG2      VAL  19 -11.621   9.608  -1.365
  151   HG23  VAL  19          3HG2      VAL  19 -10.619   8.526  -2.334
  152    H    SER  20           H        SER  20 -12.685   9.777  -6.206
  153    HA   SER  20           HA       SER  20 -15.489   9.804  -6.477
  154    HB2  SER  20          1HB       SER  20 -13.966  11.661  -7.112
  155    HB3  SER  20          2HB       SER  20 -13.400  10.699  -8.476
  156    HG   SER  20           HG       SER  20 -15.729  12.127  -8.168
  157    H    SER  21           H        SER  21 -12.962   8.021  -8.215
  158    HA   SER  21           HA       SER  21 -14.698   7.121 -10.299
  159    HB2  SER  21          1HB       SER  21 -12.258   7.314 -10.605
  160    HB3  SER  21          2HB       SER  21 -12.009   6.043  -9.408
  161    HG   SER  21           HG       SER  21 -13.563   5.658 -11.747
  162    H    LEU  22           H        LEU  22 -13.471   5.656  -7.290
  163    HA   LEU  22           HA       LEU  22 -14.839   3.176  -7.906
  164    HB2  LEU  22          1HB       LEU  22 -13.093   4.046  -5.613
  165    HB3  LEU  22          2HB       LEU  22 -13.861   2.458  -5.688
  166    HG   LEU  22           HG       LEU  22 -11.991   3.490  -7.813
  167   HD11  LEU  22          1HD1      LEU  22 -11.388   1.680  -5.480
  168   HD12  LEU  22          2HD1      LEU  22 -10.825   3.341  -5.657
  169   HD13  LEU  22          3HD1      LEU  22 -10.274   2.099  -6.784
  170   HD21  LEU  22          1HD2      LEU  22 -13.521   1.734  -8.513
  171   HD22  LEU  22          2HD2      LEU  22 -13.022   0.740  -7.141
  172   HD23  LEU  22          3HD2      LEU  22 -11.869   1.127  -8.418
  173    H    ASN  23           H        ASN  23 -16.079   5.917  -6.978
  174    HA   ASN  23           HA       ASN  23 -17.874   6.641  -5.774
  175    HB2  ASN  23          1HB       ASN  23 -18.915   4.863  -7.158
  176    HB3  ASN  23          2HB       ASN  23 -18.666   3.726  -5.851
  177   HD21  ASN  23          1HD2      ASN  23 -20.864   3.321  -5.696
  178   HD22  ASN  23          2HD2      ASN  23 -21.964   4.465  -4.998
  179    H    ILE  24           H        ILE  24 -15.612   6.202  -4.228
  180    HA   ILE  24           HA       ILE  24 -16.169   4.650  -1.908
  181    HB   ILE  24           HB       ILE  24 -14.197   6.922  -2.155
  182   HG12  ILE  24          1HG1      ILE  24 -13.838   5.255  -3.947
  183   HG13  ILE  24          2HG1      ILE  24 -12.528   5.236  -2.770
  184   HG21  ILE  24          1HG2      ILE  24 -14.338   4.549  -0.297
  185   HG22  ILE  24          2HG2      ILE  24 -14.606   6.240   0.128
  186   HG23  ILE  24          3HG2      ILE  24 -13.005   5.701  -0.374
  187   HD11  ILE  24          1HD1      ILE  24 -13.500   3.239  -1.741
  188   HD12  ILE  24          2HD1      ILE  24 -13.131   2.993  -3.449
  189   HD13  ILE  24          3HD1      ILE  24 -14.796   3.268  -2.939
  190    HA   PRO  25           HA       PRO  25 -19.049   7.611  -0.152
  191    HB2  PRO  25          1HB       PRO  25 -18.861   5.861   2.193
  192    HB3  PRO  25          2HB       PRO  25 -20.265   6.282   1.215
  193    HG2  PRO  25          1HG       PRO  25 -19.135   3.838   1.164
  194    HG3  PRO  25          2HG       PRO  25 -19.943   4.562  -0.237
  195    HD2  PRO  25          1HD       PRO  25 -17.024   4.266   0.326
  196    HD3  PRO  25          2HD       PRO  25 -17.900   4.176  -1.221
  197    H    ALA  26           H        ALA  26 -18.922   9.220   1.276
  198    HA   ALA  26           HA       ALA  26 -16.446  10.308   1.844
  199    HB1  ALA  26          1HB       ALA  26 -19.076  10.929   3.176
  200    HB2  ALA  26          2HB       ALA  26 -18.524  11.582   1.632
  201    HB3  ALA  26          3HB       ALA  26 -17.661  11.981   3.118
  202    H    ASP  27           H        ASP  27 -18.524   8.353   3.921
  203    HA   ASP  27           HA       ASP  27 -17.249   8.883   6.352
  204    HB2  ASP  27          1HB       ASP  27 -18.345   7.015   7.267
  205    HB3  ASP  27          2HB       ASP  27 -19.436   7.649   6.047
  206    H    TYR  28           H        TYR  28 -16.468   6.464   3.858
  207    HA   TYR  28           HA       TYR  28 -14.343   5.300   5.287
  208    HB2  TYR  28          1HB       TYR  28 -15.066   5.404   2.376
  209    HB3  TYR  28          2HB       TYR  28 -13.562   4.645   2.900
  210    HD1  TYR  28           HD1      TYR  28 -17.223   4.467   3.004
  211    HD2  TYR  28           HD2      TYR  28 -13.601   2.509   4.048
  212    HE1  TYR  28           HE1      TYR  28 -18.480   2.406   3.461
  213    HE2  TYR  28           HE2      TYR  28 -14.849   0.442   4.518
  214    HH   TYR  28           HH       TYR  28 -18.087  -0.003   3.574
  215    H    VAL  29           H        VAL  29 -14.536   8.019   3.062
  216    HA   VAL  29           HA       VAL  29 -11.824   8.521   2.678
  217    HB   VAL  29           HB       VAL  29 -14.060  10.533   2.824
  218   HG11  VAL  29          1HG1      VAL  29 -12.604  11.862   1.326
  219   HG12  VAL  29          2HG1      VAL  29 -11.325  10.670   1.574
  220   HG13  VAL  29          3HG1      VAL  29 -11.915  11.626   2.932
  221   HG21  VAL  29          1HG2      VAL  29 -14.116  10.268   0.368
  222   HG22  VAL  29          2HG2      VAL  29 -14.583   8.807   1.236
  223   HG23  VAL  29          3HG2      VAL  29 -12.976   8.929   0.520
  224    H    GLU  30           H        GLU  30 -14.022   9.725   5.210
  225    HA   GLU  30           HA       GLU  30 -12.157  11.347   6.570
  226    HB2  GLU  30          1HB       GLU  30 -14.351   9.851   7.981
  227    HB3  GLU  30          2HB       GLU  30 -13.664  11.428   8.348
  228    HG2  GLU  30          1HG       GLU  30 -14.619  12.276   6.233
  229    HG3  GLU  30          2HG       GLU  30 -15.453  10.737   6.049
  230    H    LYS  31           H        LYS  31 -12.753   7.907   6.685
  231    HA   LYS  31           HA       LYS  31 -11.229   7.383   9.026
  232    HB2  LYS  31          1HB       LYS  31 -11.932   5.553   6.727
  233    HB3  LYS  31          2HB       LYS  31 -11.226   5.041   8.267
  234    HG2  LYS  31          1HG       LYS  31 -13.207   5.955   9.428
  235    HG3  LYS  31          2HG       LYS  31 -13.918   6.318   7.854
  236    HD2  LYS  31          1HD       LYS  31 -13.806   3.933   7.265
  237    HD3  LYS  31          2HD       LYS  31 -13.133   3.581   8.869
  238    HE2  LYS  31          1HE       LYS  31 -15.560   3.134   8.766
  239    HE3  LYS  31          2HE       LYS  31 -15.168   4.397   9.931
  240    HZ1  LYS  31          1HZ       LYS  31 -15.765   6.036   8.183
  241    HZ2  LYS  31          2HZ       LYS  31 -17.059   5.079   8.699
  242    HZ3  LYS  31          3HZ       LYS  31 -16.317   4.758   7.215
  243    H    PHE  32           H        PHE  32 -10.444   7.242   5.567
  244    HA   PHE  32           HA       PHE  32  -7.855   6.227   5.814
  245    HB2  PHE  32          1HB       PHE  32  -8.843   8.113   3.673
  246    HB3  PHE  32          2HB       PHE  32  -7.479   7.008   3.552
  247    HD1  PHE  32           HD1      PHE  32  -8.778   4.624   4.879
  248    HD2  PHE  32           HD2      PHE  32 -10.160   7.315   1.887
  249    HE1  PHE  32           HE1      PHE  32 -10.264   2.880   4.003
  250    HE2  PHE  32           HE2      PHE  32 -11.650   5.565   1.006
  251    HZ   PHE  32           HZ       PHE  32 -11.701   3.342   2.063
  252    H    LYS  33           H        LYS  33  -9.057   9.519   5.994
  253    HA   LYS  33           HA       LYS  33  -6.540  10.826   6.003
  254    HB2  LYS  33          1HB       LYS  33  -8.878  11.852   5.669
  255    HB3  LYS  33          2HB       LYS  33  -9.004  11.823   7.427
  256    HG2  LYS  33          1HG       LYS  33  -8.299  13.999   6.828
  257    HG3  LYS  33          2HG       LYS  33  -6.894  13.166   7.513
  258    HD2  LYS  33          1HD       LYS  33  -6.077  12.697   5.253
  259    HD3  LYS  33          2HD       LYS  33  -7.476  13.528   4.572
  260    HE2  LYS  33          1HE       LYS  33  -5.603  15.027   4.537
  261    HE3  LYS  33          2HE       LYS  33  -6.754  15.592   5.746
  262    HZ1  LYS  33          1HZ       LYS  33  -5.375  14.555   7.461
  263    HZ2  LYS  33          2HZ       LYS  33  -4.515  15.720   6.588
  264    HZ3  LYS  33          3HZ       LYS  33  -4.257  14.077   6.283
  265    H    LYS  34           H        LYS  34  -8.150   8.910   8.316
  266    HA   LYS  34           HA       LYS  34  -6.461   9.937  10.488
  267    HB2  LYS  34          1HB       LYS  34  -9.068   8.424  10.500
  268    HB3  LYS  34          2HB       LYS  34  -8.065   8.538  11.941
  269    HG2  LYS  34          1HG       LYS  34  -9.130  10.911  10.428
  270    HG3  LYS  34          2HG       LYS  34  -9.931  10.183  11.820
  271    HD2  LYS  34          1HD       LYS  34  -7.895  10.616  13.162
  272    HD3  LYS  34          2HD       LYS  34  -7.185  11.432  11.769
  273    HE2  LYS  34          1HE       LYS  34  -8.141  13.044  13.328
  274    HE3  LYS  34          2HE       LYS  34  -9.003  13.063  11.791
  275    HZ1  LYS  34          1HZ       LYS  34 -10.526  13.135  13.667
  276    HZ2  LYS  34          2HZ       LYS  34  -9.909  11.678  14.258
  277    HZ3  LYS  34          3HZ       LYS  34 -10.739  11.708  12.787
  278    H    TRP  35           H        TRP  35  -5.912   7.970   8.225
  279    HA   TRP  35           HA       TRP  35  -4.823   6.023   7.837
  280    HB2  TRP  35          1HB       TRP  35  -3.904   6.603  10.645
  281    HB3  TRP  35          2HB       TRP  35  -3.266   5.260   9.689
  282    HD1  TRP  35           HD1      TRP  35  -3.125   9.048  10.025
  283    HE1  TRP  35           HE1      TRP  35  -1.205   9.944   8.561
  284    HE3  TRP  35           HE3      TRP  35  -1.960   4.757   7.484
  285    HZ2  TRP  35           HZ2      TRP  35   0.555   8.966   6.599
  286    HZ3  TRP  35           HZ3      TRP  35  -0.147   4.829   5.826
  287    HH2  TRP  35           HH2      TRP  35   1.088   6.885   5.391
  288    H    GLU  36           H        GLU  36  -7.459   5.606   8.433
  289    HA   GLU  36           HA       GLU  36  -7.347   3.043   9.859
  290    HB2  GLU  36          1HB       GLU  36  -9.613   5.031   9.787
  291    HB3  GLU  36          2HB       GLU  36  -9.768   3.385  10.387
  292    HG2  GLU  36          1HG       GLU  36  -7.961   3.933  12.036
  293    HG3  GLU  36          2HG       GLU  36  -8.113   5.610  11.520
  294    H    PHE  37           H        PHE  37  -7.397   1.512   8.420
  295    HA   PHE  37           HA       PHE  37  -9.077   1.852   6.025
  296    HB2  PHE  37          1HB       PHE  37  -6.657   0.052   6.339
  297    HB3  PHE  37          2HB       PHE  37  -7.520   0.400   4.848
  298    HD1  PHE  37           HD1      PHE  37  -5.321   1.843   7.440
  299    HD2  PHE  37           HD2      PHE  37  -7.019   2.331   3.563
  300    HE1  PHE  37           HE1      PHE  37  -3.799   3.728   7.015
  301    HE2  PHE  37           HE2      PHE  37  -5.502   4.217   3.138
  302    HZ   PHE  37           HZ       PHE  37  -3.888   4.918   4.864
  303    HA   PRO  38           HA       PRO  38 -11.341  -1.447   8.295
  304    HB2  PRO  38          1HB       PRO  38 -13.157  -0.874   6.010
  305    HB3  PRO  38          2HB       PRO  38 -13.524  -1.052   7.737
  306    HG2  PRO  38          1HG       PRO  38 -13.523   1.357   6.643
  307    HG3  PRO  38          2HG       PRO  38 -12.800   1.101   8.243
  308    HD2  PRO  38          1HD       PRO  38 -11.431   1.374   5.581
  309    HD3  PRO  38          2HD       PRO  38 -10.992   2.094   7.158
  310    H    GLU  39           H        GLU  39 -11.649  -3.568   7.823
  311    HA   GLU  39           HA       GLU  39 -10.275  -4.551   5.481
  312    HB2  GLU  39          1HB       GLU  39  -9.940  -5.508   7.762
  313    HB3  GLU  39          2HB       GLU  39 -11.592  -6.102   7.714
  314    HG2  GLU  39          1HG       GLU  39 -11.092  -7.644   6.007
  315    HG3  GLU  39          2HG       GLU  39  -9.544  -6.872   5.658
  316    H    ASP  40           H        ASP  40 -11.831  -3.655   4.014
  317    HA   ASP  40           HA       ASP  40 -14.138  -5.388   3.557
  318    HB2  ASP  40          1HB       ASP  40 -15.734  -3.859   4.003
  319    HB3  ASP  40          2HB       ASP  40 -14.486  -2.930   4.822
  320    H    ASP  41           H        ASP  41 -15.034  -5.121   1.362
  321    HA   ASP  41           HA       ASP  41 -13.004  -5.155  -0.554
  322    HB2  ASP  41          1HB       ASP  41 -15.985  -4.842  -0.907
  323    HB3  ASP  41          2HB       ASP  41 -14.867  -5.003  -2.255
  324    H    THR  42           H        THR  42 -15.189  -2.529   0.340
  325    HA   THR  42           HA       THR  42 -14.702  -0.757  -1.751
  326    HB   THR  42           HB       THR  42 -15.085   0.083   1.112
  327    HG1  THR  42           HG1      THR  42 -16.691  -1.345   0.914
  328   HG21  THR  42          1HG2      THR  42 -16.444   1.863   0.042
  329   HG22  THR  42          2HG2      THR  42 -15.939   1.246  -1.532
  330   HG23  THR  42          3HG2      THR  42 -14.742   1.907  -0.417
  331    H    THR  43           H        THR  43 -13.188  -0.770   1.470
  332    HA   THR  43           HA       THR  43 -11.224   1.151   0.986
  333    HB   THR  43           HB       THR  43 -11.065  -1.236   2.835
  334    HG1  THR  43           HG1      THR  43 -12.892  -0.011   3.350
  335   HG21  THR  43          1HG2      THR  43  -9.559   0.267   4.150
  336   HG22  THR  43          2HG2      THR  43  -9.559   1.378   2.778
  337   HG23  THR  43          3HG2      THR  43  -8.894  -0.245   2.600
  338    H    MET  44           H        MET  44 -11.242  -2.301   0.335
  339    HA   MET  44           HA       MET  44  -8.464  -2.566  -0.106
  340    HB2  MET  44          1HB       MET  44 -10.777  -4.263  -1.024
  341    HB3  MET  44          2HB       MET  44  -9.087  -4.729  -1.180
  342    HG2  MET  44          1HG       MET  44  -8.869  -4.605   1.271
  343    HG3  MET  44          2HG       MET  44 -10.583  -4.218   1.379
  344    HE1  MET  44          1HE       MET  44  -9.344  -6.586   3.029
  345    HE2  MET  44          2HE       MET  44 -10.567  -7.833   2.766
  346    HE3  MET  44          3HE       MET  44 -11.055  -6.155   3.025
  347    H    CYS  45           H        CYS  45 -11.206  -2.132  -2.331
  348    HA   CYS  45           HA       CYS  45  -9.589  -2.135  -4.663
  349    HB2  CYS  45          1HB       CYS  45 -12.363  -1.012  -4.228
  350    HB3  CYS  45          2HB       CYS  45 -11.577  -1.157  -5.795
  351    H    TYR  46           H        TYR  46 -10.463   0.317  -2.364
  352    HA   TYR  46           HA       TYR  46  -9.659   2.574  -3.833
  353    HB2  TYR  46          1HB       TYR  46 -10.888   2.998  -1.884
  354    HB3  TYR  46          2HB       TYR  46  -9.882   1.940  -0.900
  355    HD1  TYR  46           HD1      TYR  46  -8.195   2.851   0.415
  356    HD2  TYR  46           HD2      TYR  46  -9.784   5.159  -2.790
  357    HE1  TYR  46           HE1      TYR  46  -6.910   4.795   1.189
  358    HE2  TYR  46           HE2      TYR  46  -8.502   7.112  -2.021
  359    HH   TYR  46           HH       TYR  46  -6.072   6.877   0.441
  360    H    ILE  47           H        ILE  47  -7.917   0.333  -1.738
  361    HA   ILE  47           HA       ILE  47  -5.458   1.675  -1.759
  362    HB   ILE  47           HB       ILE  47  -6.118  -1.211  -1.235
  363   HG12  ILE  47          1HG1      ILE  47  -6.996   0.360   0.414
  364   HG13  ILE  47          2HG1      ILE  47  -5.678  -0.567   1.123
  365   HG21  ILE  47          1HG2      ILE  47  -3.854  -1.435  -0.278
  366   HG22  ILE  47          2HG2      ILE  47  -3.458   0.174  -0.887
  367   HG23  ILE  47          3HG2      ILE  47  -3.823  -1.129  -2.017
  368   HD11  ILE  47          1HD1      ILE  47  -5.445   1.684   1.833
  369   HD12  ILE  47          2HD1      ILE  47  -5.626   2.292   0.190
  370   HD13  ILE  47          3HD1      ILE  47  -4.179   1.390   0.641
  371    H    LYS  48           H        LYS  48  -6.736  -0.849  -3.949
  372    HA   LYS  48           HA       LYS  48  -4.291  -1.304  -5.252
  373    HB2  LYS  48          1HB       LYS  48  -6.033  -1.767  -7.293
  374    HB3  LYS  48          2HB       LYS  48  -5.633  -2.947  -6.064
  375    HG2  LYS  48          1HG       LYS  48  -7.707  -2.892  -5.224
  376    HG3  LYS  48          2HG       LYS  48  -7.812  -1.140  -5.335
  377    HD2  LYS  48          1HD       LYS  48  -9.470  -2.195  -6.774
  378    HD3  LYS  48          2HD       LYS  48  -8.279  -1.315  -7.728
  379    HE2  LYS  48          1HE       LYS  48  -7.135  -3.392  -8.256
  380    HE3  LYS  48          2HE       LYS  48  -8.256  -4.291  -7.234
  381    HZ1  LYS  48          1HZ       LYS  48  -8.810  -4.426  -9.604
  382    HZ2  LYS  48          2HZ       LYS  48  -9.026  -2.749  -9.651
  383    HZ3  LYS  48          3HZ       LYS  48 -10.051  -3.705  -8.708
  384    H    CYS  49           H        CYS  49  -6.977   0.883  -6.045
  385    HA   CYS  49           HA       CYS  49  -5.942   1.942  -8.398
  386    HB2  CYS  49          1HB       CYS  49  -8.204   2.363  -7.872
  387    HB3  CYS  49          2HB       CYS  49  -7.808   3.115  -6.329
  388    H    VAL  50           H        VAL  50  -5.589   3.164  -5.059
  389    HA   VAL  50           HA       VAL  50  -4.034   5.394  -5.709
  390    HB   VAL  50           HB       VAL  50  -4.356   3.838  -3.156
  391   HG11  VAL  50          1HG1      VAL  50  -2.136   4.851  -3.122
  392   HG12  VAL  50          2HG1      VAL  50  -3.224   5.676  -2.005
  393   HG13  VAL  50          3HG1      VAL  50  -2.835   6.412  -3.558
  394   HG21  VAL  50          1HG2      VAL  50  -5.321   6.540  -4.062
  395   HG22  VAL  50          2HG2      VAL  50  -5.621   5.821  -2.478
  396   HG23  VAL  50          3HG2      VAL  50  -6.292   5.073  -3.928
  397    H    PHE  51           H        PHE  51  -3.114   2.141  -4.662
  398    HA   PHE  51           HA       PHE  51  -0.351   2.610  -4.512
  399    HB2  PHE  51          1HB       PHE  51  -2.132   0.259  -4.458
  400    HB3  PHE  51          2HB       PHE  51  -0.483  -0.055  -4.965
  401    HD1  PHE  51           HD1      PHE  51   0.191  -1.351  -3.120
  402    HD2  PHE  51           HD2      PHE  51  -1.466   2.522  -2.516
  403    HE1  PHE  51           HE1      PHE  51   0.903  -1.417  -0.769
  404    HE2  PHE  51           HE2      PHE  51  -0.755   2.460  -0.162
  405    HZ   PHE  51           HZ       PHE  51   0.432   0.491   0.713
  406    H    ASN  52           H        ASN  52  -2.461   1.869  -7.154
  407    HA   ASN  52           HA       ASN  52  -0.401   1.028  -8.969
  408    HB2  ASN  52          1HB       ASN  52  -2.760   0.321  -9.237
  409    HB3  ASN  52          2HB       ASN  52  -3.218   2.000  -9.551
  410   HD21  ASN  52          1HD2      ASN  52  -0.321   0.335 -10.695
  411   HD22  ASN  52          2HD2      ASN  52  -0.715   0.433 -12.375
  412    H    LYS  53           H        LYS  53  -2.183   3.991  -8.320
  413    HA   LYS  53           HA       LYS  53  -1.035   5.520 -10.417
  414    HB2  LYS  53          1HB       LYS  53  -2.560   6.162  -7.919
  415    HB3  LYS  53          2HB       LYS  53  -1.870   7.457  -8.891
  416    HG2  LYS  53          1HG       LYS  53  -3.225   6.827 -10.774
  417    HG3  LYS  53          2HG       LYS  53  -3.780   5.370  -9.945
  418    HD2  LYS  53          1HD       LYS  53  -4.909   6.736  -8.273
  419    HD3  LYS  53          2HD       LYS  53  -4.315   8.205  -9.052
  420    HE2  LYS  53          1HE       LYS  53  -6.054   6.164 -10.418
  421    HE3  LYS  53          2HE       LYS  53  -6.678   7.598  -9.607
  422    HZ1  LYS  53          1HZ       LYS  53  -4.786   7.592 -11.897
  423    HZ2  LYS  53          2HZ       LYS  53  -5.390   8.973 -11.118
  424    HZ3  LYS  53          3HZ       LYS  53  -6.437   7.955 -11.979
  425    H    MET  54           H        MET  54  -0.056   4.686  -7.221
  426    HA   MET  54           HA       MET  54   1.943   6.752  -6.997
  427    HB2  MET  54          1HB       MET  54   1.277   4.329  -5.327
  428    HB3  MET  54          2HB       MET  54   2.623   5.397  -4.962
  429    HG2  MET  54          1HG       MET  54  -0.091   6.554  -5.299
  430    HG3  MET  54          2HG       MET  54   0.289   5.689  -3.813
  431    HE1  MET  54          1HE       MET  54   2.929   7.804  -2.081
  432    HE2  MET  54          2HE       MET  54   3.084   6.270  -2.937
  433    HE3  MET  54          3HE       MET  54   1.677   6.571  -1.914
  434    H    GLN  55           H        GLN  55   1.736   4.180  -8.907
  435    HA   GLN  55           HA       GLN  55   3.099   2.756  -9.972
  436    HB2  GLN  55          1HB       GLN  55   4.765   5.150  -9.489
  437    HB3  GLN  55          2HB       GLN  55   5.593   3.706 -10.065
  438    HG2  GLN  55          1HG       GLN  55   3.260   5.063 -11.386
  439    HG3  GLN  55          2HG       GLN  55   4.942   5.180 -11.890
  440   HE21  GLN  55          1HE2      GLN  55   2.650   4.215 -13.381
  441   HE22  GLN  55          2HE2      GLN  55   3.012   2.584 -13.830
  442    H    LEU  56           H        LEU  56   2.601   1.847  -7.537
  443    HA   LEU  56           HA       LEU  56   5.180   0.890  -6.558
  444    HB2  LEU  56          1HB       LEU  56   3.021   2.300  -5.162
  445    HB3  LEU  56          2HB       LEU  56   3.622   0.877  -4.297
  446    HG   LEU  56           HG       LEU  56   5.275   3.207  -5.272
  447   HD11  LEU  56          1HD1      LEU  56   4.337   2.486  -2.502
  448   HD12  LEU  56          2HD1      LEU  56   3.833   3.884  -3.447
  449   HD13  LEU  56          3HD1      LEU  56   5.495   3.753  -2.887
  450   HD21  LEU  56          1HD2      LEU  56   6.628   1.237  -5.234
  451   HD22  LEU  56          2HD2      LEU  56   5.979   0.768  -3.663
  452   HD23  LEU  56          3HD2      LEU  56   7.010   2.190  -3.801
  453    H    PHE  57           H        PHE  57   1.975   0.187  -7.499
  454    HA   PHE  57           HA       PHE  57   2.466  -2.659  -7.065
  455    HB2  PHE  57          1HB       PHE  57   1.050  -2.041  -5.174
  456    HB3  PHE  57          2HB       PHE  57  -0.072  -1.219  -6.248
  457    HD1  PHE  57           HD1      PHE  57   1.161  -4.504  -5.146
  458    HD2  PHE  57           HD2      PHE  57  -1.739  -2.415  -7.466
  459    HE1  PHE  57           HE1      PHE  57  -0.163  -6.567  -5.351
  460    HE2  PHE  57           HE2      PHE  57  -3.063  -4.476  -7.672
  461    HZ   PHE  57           HZ       PHE  57  -2.274  -6.556  -6.615
  462    H    ASP  58           H        ASP  58   1.815  -3.887  -8.723
  463    HA   ASP  58           HA       ASP  58   0.161  -2.626 -10.809
  464    HB2  ASP  58          1HB       ASP  58   2.453  -2.994 -11.611
  465    HB3  ASP  58          2HB       ASP  58   2.365  -4.685 -11.132
  466    H    ASP  59           H        ASP  59  -1.528  -3.895 -11.659
  467    HA   ASP  59           HA       ASP  59  -2.513  -5.786  -9.720
  468    HB2  ASP  59          1HB       ASP  59  -4.589  -5.623 -10.772
  469    HB3  ASP  59          2HB       ASP  59  -3.893  -4.036 -11.012
  470    H    THR  60           H        THR  60  -0.530  -6.079 -12.367
  471    HA   THR  60           HA       THR  60  -1.304  -8.872 -12.792
  472    HB   THR  60           HB       THR  60   0.364  -6.974 -14.418
  473    HG1  THR  60           HG1      THR  60  -2.168  -8.101 -14.562
  474   HG21  THR  60          1HG2      THR  60   1.492  -9.162 -14.378
  475   HG22  THR  60          2HG2      THR  60   0.833  -8.783 -15.970
  476   HG23  THR  60          3HG2      THR  60  -0.002  -9.929 -14.919
  477    H    GLU  61           H        GLU  61   1.749  -6.985 -12.561
  478    HA   GLU  61           HA       GLU  61   3.235  -9.322 -11.809
  479    HB2  GLU  61          1HB       GLU  61   4.248  -6.511 -11.534
  480    HB3  GLU  61          2HB       GLU  61   5.138  -7.984 -11.886
  481    HG2  GLU  61          1HG       GLU  61   4.013  -8.102 -14.075
  482    HG3  GLU  61          2HG       GLU  61   3.255  -6.551 -13.729
  483    H    GLY  62           H        GLY  62   1.375  -7.104 -10.038
  484    HA2  GLY  62          1HA       GLY  62   0.895  -7.223  -7.761
  485    HA3  GLY  62          2HA       GLY  62   2.259  -8.326  -7.562
  486    HA   PRO  63           HA       PRO  63   3.462  -4.388  -5.444
  487    HB2  PRO  63          1HB       PRO  63   5.129  -6.375  -4.005
  488    HB3  PRO  63          2HB       PRO  63   4.087  -5.096  -3.362
  489    HG2  PRO  63          1HG       PRO  63   3.389  -7.684  -3.230
  490    HG3  PRO  63          2HG       PRO  63   2.190  -6.401  -3.476
  491    HD2  PRO  63          1HD       PRO  63   3.349  -8.327  -5.452
  492    HD3  PRO  63          2HD       PRO  63   1.697  -7.671  -5.344
  493    H    LEU  64           H        LEU  64   4.961  -3.226  -6.432
  494    HA   LEU  64           HA       LEU  64   7.116  -4.517  -7.885
  495    HB2  LEU  64          1HB       LEU  64   6.624  -1.552  -7.603
  496    HB3  LEU  64          2HB       LEU  64   7.548  -2.375  -8.843
  497    HG   LEU  64           HG       LEU  64   4.561  -2.646  -8.504
  498   HD11  LEU  64          1HD1      LEU  64   6.148  -1.037 -10.499
  499   HD12  LEU  64          2HD1      LEU  64   5.133  -0.392  -9.209
  500   HD13  LEU  64          3HD1      LEU  64   4.404  -1.291 -10.537
  501   HD21  LEU  64          1HD2      LEU  64   4.620  -3.777 -10.631
  502   HD22  LEU  64          2HD2      LEU  64   5.701  -4.595  -9.493
  503   HD23  LEU  64          3HD2      LEU  64   6.366  -3.540 -10.742
  504    H    VAL  65           H        VAL  65   8.411  -5.336  -6.347
  505    HA   VAL  65           HA       VAL  65   8.998  -4.360  -3.863
  506    HB   VAL  65           HB       VAL  65  10.721  -6.096  -5.608
  507   HG11  VAL  65          1HG1      VAL  65  10.842  -5.640  -2.627
  508   HG12  VAL  65          2HG1      VAL  65  12.053  -5.144  -3.811
  509   HG13  VAL  65          3HG1      VAL  65  11.759  -6.857  -3.515
  510   HG21  VAL  65          1HG2      VAL  65   8.635  -6.717  -3.533
  511   HG22  VAL  65          2HG2      VAL  65   9.714  -7.914  -4.251
  512   HG23  VAL  65          3HG2      VAL  65   8.553  -7.054  -5.262
  513    H    ASP  66           H        ASP  66  10.912  -3.824  -6.829
  514    HA   ASP  66           HA       ASP  66  13.058  -2.554  -5.555
  515    HB2  ASP  66          1HB       ASP  66  13.192  -3.382  -7.840
  516    HB3  ASP  66          2HB       ASP  66  12.069  -2.133  -8.372
  517    H    ASN  67           H        ASN  67  10.233  -1.078  -7.186
  518    HA   ASN  67           HA       ASN  67  10.833   1.580  -6.532
  519    HB2  ASN  67          1HB       ASN  67   8.217   0.196  -7.087
  520    HB3  ASN  67          2HB       ASN  67   8.305   1.910  -6.713
  521   HD21  ASN  67          1HD2      ASN  67   7.505   2.492  -8.684
  522   HD22  ASN  67          2HD2      ASN  67   8.435   2.389 -10.140
  523    H    LEU  68           H        LEU  68   9.221  -0.962  -4.771
  524    HA   LEU  68           HA       LEU  68   8.140   0.544  -2.682
  525    HB2  LEU  68          1HB       LEU  68   8.889  -2.325  -3.039
  526    HB3  LEU  68          2HB       LEU  68   8.442  -1.747  -1.442
  527    HG   LEU  68           HG       LEU  68   6.669  -1.293  -3.825
  528   HD11  LEU  68          1HD1      LEU  68   5.419  -3.286  -3.200
  529   HD12  LEU  68          2HD1      LEU  68   6.612  -3.655  -1.952
  530   HD13  LEU  68          3HD1      LEU  68   7.071  -3.701  -3.653
  531   HD21  LEU  68          1HD2      LEU  68   4.947  -1.109  -2.115
  532   HD22  LEU  68          2HD2      LEU  68   6.255   0.038  -1.825
  533   HD23  LEU  68          3HD2      LEU  68   6.147  -1.436  -0.864
  534    H    VAL  69           H        VAL  69  11.327  -0.920  -3.069
  535    HA   VAL  69           HA       VAL  69  12.266  -0.195  -0.470
  536    HB   VAL  69           HB       VAL  69  13.847  -0.841  -2.953
  537   HG11  VAL  69          1HG1      VAL  69  14.619  -0.772  -0.043
  538   HG12  VAL  69          2HG1      VAL  69  15.218   0.282  -1.326
  539   HG13  VAL  69          3HG1      VAL  69  15.624  -1.434  -1.335
  540   HG21  VAL  69          1HG2      VAL  69  13.022  -2.648  -0.692
  541   HG22  VAL  69          2HG2      VAL  69  13.969  -3.095  -2.112
  542   HG23  VAL  69          3HG2      VAL  69  12.281  -2.621  -2.292
  543    H    HIS  70           H        HIS  70  12.579   1.232  -3.712
  544    HA   HIS  70           HA       HIS  70  14.267   3.370  -3.030
  545    HB2  HIS  70          1HB       HIS  70  12.271   2.944  -5.227
  546    HB3  HIS  70          2HB       HIS  70  13.013   4.524  -5.018
  547    HD1  HIS  70           HD1      HIS  70  15.396   4.818  -5.812
  548    HD2  HIS  70           HD2      HIS  70  14.089   0.877  -6.008
  549    HE1  HIS  70           HE1      HIS  70  17.140   3.594  -7.138
  550    HE2  HIS  70           HE2      HIS  70  16.255   1.248  -7.370
  551    H    GLN  71           H        GLN  71  10.875   2.910  -2.564
  552    HA   GLN  71           HA       GLN  71  10.349   5.714  -1.999
  553    HB2  GLN  71          1HB       GLN  71   8.771   4.082  -3.200
  554    HB3  GLN  71          2HB       GLN  71   8.463   3.401  -1.606
  555    HG2  GLN  71          1HG       GLN  71   6.723   4.924  -2.057
  556    HG3  GLN  71          2HG       GLN  71   7.768   5.661  -0.846
  557   HE21  GLN  71          1HE2      GLN  71   7.151   7.736  -1.309
  558   HE22  GLN  71          2HE2      GLN  71   7.563   8.536  -2.777
  559    H    LEU  72           H        LEU  72   9.927   2.648  -0.250
  560    HA   LEU  72           HA       LEU  72   9.268   3.892   2.184
  561    HB2  LEU  72          1HB       LEU  72  10.107   1.077   1.542
  562    HB3  LEU  72          2HB       LEU  72   9.628   1.586   3.148
  563    HG   LEU  72           HG       LEU  72   7.864   1.773   0.707
  564   HD11  LEU  72          1HD1      LEU  72   8.325  -0.556   1.263
  565   HD12  LEU  72          2HD1      LEU  72   6.662  -0.137   1.679
  566   HD13  LEU  72          3HD1      LEU  72   7.886  -0.255   2.943
  567   HD21  LEU  72          1HD2      LEU  72   7.195   3.394   2.310
  568   HD22  LEU  72          2HD2      LEU  72   7.376   2.249   3.640
  569   HD23  LEU  72          3HD2      LEU  72   6.084   2.032   2.458
  570    H    ALA  73           H        ALA  73  12.317   2.427   1.062
  571    HA   ALA  73           HA       ALA  73  13.593   2.647   3.604
  572    HB1  ALA  73          1HB       ALA  73  15.566   1.858   2.469
  573    HB2  ALA  73          2HB       ALA  73  14.821   2.178   0.902
  574    HB3  ALA  73          3HB       ALA  73  14.157   0.931   1.955
  575    H    HIS  74           H        HIS  74  12.595   5.200   2.644
  576    HA   HIS  74           HA       HIS  74  14.827   6.750   1.736
  577    HB2  HIS  74          1HB       HIS  74  12.441   7.385   1.287
  578    HB3  HIS  74          2HB       HIS  74  12.264   7.754   3.004
  579    HD1  HIS  74           HD1      HIS  74  13.000  10.035   3.767
  580    HD2  HIS  74           HD2      HIS  74  14.306   9.133  -0.081
  581    HE1  HIS  74           HE1      HIS  74  14.027  12.154   2.881
  582    HE2  HIS  74           HE2      HIS  74  14.699  11.615   0.512
  583    H    GLY  75           H        GLY  75  16.526   6.625   3.089
  584    HA2  GLY  75          1HA       GLY  75  17.778   7.560   4.826
  585    HA3  GLY  75          2HA       GLY  75  16.284   8.070   5.594
  586    H    ARG  76           H        ARG  76  16.574   4.809   4.514
  587    HA   ARG  76           HA       ARG  76  17.436   3.855   7.121
  588    HB2  ARG  76          1HB       ARG  76  14.692   3.549   6.041
  589    HB3  ARG  76          2HB       ARG  76  15.391   2.136   6.823
  590    HG2  ARG  76          1HG       ARG  76  15.948   3.966   8.677
  591    HG3  ARG  76          2HG       ARG  76  14.520   4.719   7.964
  592    HD2  ARG  76          1HD       ARG  76  13.825   3.305   9.782
  593    HD3  ARG  76          2HD       ARG  76  13.320   2.569   8.260
  594    HE   ARG  76           HE       ARG  76  15.868   1.674   9.291
  595   HH11  ARG  76          1HH1      ARG  76  12.414   1.111   9.242
  596   HH12  ARG  76          2HH1      ARG  76  12.562  -0.590   9.554
  597   HH21  ARG  76          1HH2      ARG  76  16.072  -0.549   9.697
  598   HH22  ARG  76          2HH2      ARG  76  14.649  -1.548   9.799
  599    H    ASP  77           H        ASP  77  17.661   1.389   7.066
  600    HA   ASP  77           HA       ASP  77  19.326   0.689   4.916
  601    HB2  ASP  77          1HB       ASP  77  19.564  -0.282   7.154
  602    HB3  ASP  77          2HB       ASP  77  18.033  -1.132   6.951
  603    H    ALA  78           H        ALA  78  18.777   0.246   2.972
  604    HA   ALA  78           HA       ALA  78  16.144  -0.217   2.091
  605    HB1  ALA  78          1HB       ALA  78  17.858   0.875   0.744
  606    HB2  ALA  78          2HB       ALA  78  17.154  -0.502  -0.100
  607    HB3  ALA  78          3HB       ALA  78  18.747  -0.645   0.644
  608    H    GLU  79           H        GLU  79  18.745  -2.377   2.940
  609    HA   GLU  79           HA       GLU  79  17.780  -4.626   1.499
  610    HB2  GLU  79          1HB       GLU  79  19.685  -4.465   3.830
  611    HB3  GLU  79          2HB       GLU  79  19.362  -5.929   2.909
  612    HG2  GLU  79          1HG       GLU  79  20.093  -4.637   0.862
  613    HG3  GLU  79          2HG       GLU  79  20.683  -3.403   1.974
  614    H    GLU  80           H        GLU  80  17.490  -3.626   4.909
  615    HA   GLU  80           HA       GLU  80  15.880  -5.807   5.700
  616    HB2  GLU  80          1HB       GLU  80  16.961  -4.337   7.329
  617    HB3  GLU  80          2HB       GLU  80  15.957  -2.992   6.802
  618    HG2  GLU  80          1HG       GLU  80  13.976  -4.121   7.578
  619    HG3  GLU  80          2HG       GLU  80  14.910  -5.544   8.000
  620    H    VAL  81           H        VAL  81  15.097  -2.588   4.449
  621    HA   VAL  81           HA       VAL  81  12.326  -2.714   4.588
  622    HB   VAL  81           HB       VAL  81  14.091  -1.311   2.593
  623   HG11  VAL  81          1HG1      VAL  81  11.881  -1.558   1.619
  624   HG12  VAL  81          2HG1      VAL  81  12.132   0.112   2.128
  625   HG13  VAL  81          3HG1      VAL  81  11.138  -0.969   3.107
  626   HG21  VAL  81          1HG2      VAL  81  13.524   0.645   3.997
  627   HG22  VAL  81          2HG2      VAL  81  14.461  -0.591   4.830
  628   HG23  VAL  81          3HG2      VAL  81  12.726  -0.450   5.126
  629    H    ARG  82           H        ARG  82  14.433  -3.606   1.839
  630    HA   ARG  82           HA       ARG  82  12.508  -4.582   0.098
  631    HB2  ARG  82          1HB       ARG  82  14.952  -4.262  -0.368
  632    HB3  ARG  82          2HB       ARG  82  15.257  -5.756   0.506
  633    HG2  ARG  82          1HG       ARG  82  13.763  -6.922  -1.099
  634    HG3  ARG  82          2HG       ARG  82  13.679  -5.426  -2.022
  635    HD2  ARG  82          1HD       ARG  82  16.129  -5.462  -2.252
  636    HD3  ARG  82          2HD       ARG  82  16.167  -7.002  -1.398
  637    HE   ARG  82           HE       ARG  82  14.421  -7.222  -3.585
  638   HH11  ARG  82          1HH1      ARG  82  17.844  -6.862  -2.934
  639   HH12  ARG  82          2HH1      ARG  82  18.330  -7.700  -4.372
  640   HH21  ARG  82          1HH2      ARG  82  15.061  -8.315  -5.467
  641   HH22  ARG  82          2HH2      ARG  82  16.748  -8.513  -5.820
  642    H    THR  83           H        THR  83  14.198  -6.192   2.731
  643    HA   THR  83           HA       THR  83  13.234  -8.793   2.272
  644    HB   THR  83           HB       THR  83  14.376  -7.394   4.679
  645    HG1  THR  83           HG1      THR  83  15.827  -7.888   3.032
  646   HG21  THR  83          1HG2      THR  83  13.582 -10.304   4.499
  647   HG22  THR  83          2HG2      THR  83  12.867  -9.088   5.558
  648   HG23  THR  83          3HG2      THR  83  14.544  -9.585   5.791
  649    H    GLU  84           H        GLU  84  12.192  -6.292   4.587
  650    HA   GLU  84           HA       GLU  84  10.061  -7.614   5.755
  651    HB2  GLU  84          1HB       GLU  84  10.456  -4.684   5.215
  652    HB3  GLU  84          2HB       GLU  84   9.092  -5.304   6.127
  653    HG2  GLU  84          1HG       GLU  84  11.986  -5.653   6.842
  654    HG3  GLU  84          2HG       GLU  84  10.872  -4.509   7.581
  655    H    VAL  85           H        VAL  85  10.087  -5.661   2.801
  656    HA   VAL  85           HA       VAL  85   7.363  -5.804   2.191
  657    HB   VAL  85           HB       VAL  85   9.804  -5.558   0.433
  658   HG11  VAL  85          1HG1      VAL  85   8.305  -4.949  -1.402
  659   HG12  VAL  85          2HG1      VAL  85   6.915  -5.355  -0.393
  660   HG13  VAL  85          3HG1      VAL  85   8.050  -6.614  -0.877
  661   HG21  VAL  85          1HG2      VAL  85   9.366  -3.666   1.868
  662   HG22  VAL  85          2HG2      VAL  85   7.696  -3.590   1.303
  663   HG23  VAL  85          3HG2      VAL  85   9.022  -3.243   0.191
  664    H    LEU  86           H        LEU  86  10.044  -7.857   1.059
  665    HA   LEU  86           HA       LEU  86   8.580  -9.552  -0.576
  666    HB2  LEU  86          1HB       LEU  86  11.152  -9.983   0.930
  667    HB3  LEU  86          2HB       LEU  86  10.496 -11.156  -0.209
  668    HG   LEU  86           HG       LEU  86  11.095  -8.316  -0.988
  669   HD11  LEU  86          1HD1      LEU  86  12.886 -10.729  -1.210
  670   HD12  LEU  86          2HD1      LEU  86  13.136  -9.352  -0.136
  671   HD13  LEU  86          3HD1      LEU  86  13.208  -9.131  -1.886
  672   HD21  LEU  86          1HD2      LEU  86  11.168  -9.322  -3.239
  673   HD22  LEU  86          2HD2      LEU  86   9.594  -9.492  -2.464
  674   HD23  LEU  86          3HD2      LEU  86  10.694 -10.868  -2.536
  675    H    LYS  87           H        LYS  87   9.083  -9.624   2.877
  676    HA   LYS  87           HA       LYS  87   8.404 -12.258   3.463
  677    HB2  LYS  87          1HB       LYS  87   8.052  -9.692   4.990
  678    HB3  LYS  87          2HB       LYS  87   7.491 -11.221   5.648
  679    HG2  LYS  87          1HG       LYS  87   9.760 -12.116   5.520
  680    HG3  LYS  87          2HG       LYS  87  10.325 -10.572   4.858
  681    HD2  LYS  87          1HD       LYS  87   9.606  -9.443   6.909
  682    HD3  LYS  87          2HD       LYS  87   9.045 -10.979   7.561
  683    HE2  LYS  87          1HE       LYS  87  11.284 -11.848   7.581
  684    HE3  LYS  87          2HE       LYS  87  11.891 -10.412   6.758
  685    HZ1  LYS  87          1HZ       LYS  87  12.311 -10.373   9.155
  686    HZ2  LYS  87          2HZ       LYS  87  10.647 -10.419   9.453
  687    HZ3  LYS  87          3HZ       LYS  87  11.330  -9.082   8.665
  688    H    CYS  88           H        CYS  88   6.361  -9.618   2.461
  689    HA   CYS  88           HA       CYS  88   4.055 -11.392   2.859
  690    HB2  CYS  88          1HB       CYS  88   4.365  -8.514   3.512
  691    HB3  CYS  88          2HB       CYS  88   2.776  -9.090   2.959
  692    H    VAL  89           H        VAL  89   5.932 -10.439   0.481
  693    HA   VAL  89           HA       VAL  89   3.941  -9.668  -1.440
  694    HB   VAL  89           HB       VAL  89   6.752 -10.707  -1.805
  695   HG11  VAL  89          1HG1      VAL  89   4.801  -9.640  -3.835
  696   HG12  VAL  89          2HG1      VAL  89   5.457 -11.275  -3.763
  697   HG13  VAL  89          3HG1      VAL  89   6.515  -9.915  -4.143
  698   HG21  VAL  89          1HG2      VAL  89   5.572  -7.945  -2.049
  699   HG22  VAL  89          2HG2      VAL  89   7.237  -8.382  -2.437
  700   HG23  VAL  89          3HG2      VAL  89   6.654  -8.517  -0.778
  701    H    ASP  90           H        ASP  90   2.330 -11.088  -1.607
  702    HA   ASP  90           HA       ASP  90   3.003 -13.908  -2.084
  703    HB2  ASP  90          1HB       ASP  90   0.641 -12.657  -0.712
  704    HB3  ASP  90          2HB       ASP  90   0.539 -14.287  -1.382
  705    H    LYS  91           H        LYS  91   0.821 -14.925  -3.162
  706    HA   LYS  91           HA       LYS  91   0.729 -13.569  -5.765
  707    HB2  LYS  91          1HB       LYS  91  -0.123 -16.403  -5.184
  708    HB3  LYS  91          2HB       LYS  91   0.311 -15.686  -6.732
  709    HG2  LYS  91          1HG       LYS  91   2.621 -15.487  -6.015
  710    HG3  LYS  91          2HG       LYS  91   2.201 -16.204  -4.460
  711    HD2  LYS  91          1HD       LYS  91   1.533 -18.263  -5.579
  712    HD3  LYS  91          2HD       LYS  91   1.902 -17.544  -7.146
  713    HE2  LYS  91          1HE       LYS  91   3.735 -18.948  -6.506
  714    HE3  LYS  91          2HE       LYS  91   4.256 -17.269  -6.402
  715    HZ1  LYS  91          1HZ       LYS  91   5.019 -18.493  -4.496
  716    HZ2  LYS  91          2HZ       LYS  91   3.452 -19.001  -4.128
  717    HZ3  LYS  91          3HZ       LYS  91   3.864 -17.366  -3.996
  718    H    ASN  92           H        ASN  92  -1.277 -13.791  -7.008
  719    HA   ASN  92           HA       ASN  92  -3.483 -12.759  -5.486
  720    HB2  ASN  92          1HB       ASN  92  -2.833 -11.948  -7.762
  721    HB3  ASN  92          2HB       ASN  92  -3.367 -13.489  -8.414
  722   HD21  ASN  92          1HD2      ASN  92  -4.793 -12.247  -9.724
  723   HD22  ASN  92          2HD2      ASN  92  -6.301 -11.683  -9.089
  724    H    THR  93           H        THR  93  -3.546 -14.809  -4.207
  725    HA   THR  93           HA       THR  93  -4.693 -17.151  -5.397
  726    HB   THR  93           HB       THR  93  -4.872 -17.922  -3.026
  727    HG1  THR  93           HG1      THR  93  -4.073 -16.573  -1.400
  728   HG21  THR  93          1HG2      THR  93  -2.860 -18.375  -4.279
  729   HG22  THR  93          2HG2      THR  93  -2.439 -17.974  -2.614
  730   HG23  THR  93          3HG2      THR  93  -2.221 -16.778  -3.891
  731    H    ASP  94           H        ASP  94  -5.974 -14.211  -4.269
  732    HA   ASP  94           HA       ASP  94  -8.562 -15.362  -3.582
  733    HB2  ASP  94          1HB       ASP  94  -7.641 -13.551  -2.175
  734    HB3  ASP  94          2HB       ASP  94  -7.662 -12.470  -3.572
  735    H    ASN  95           H        ASN  95  -6.948 -14.230  -6.268
  736    HA   ASN  95           HA       ASN  95  -7.502 -13.834  -8.413
  737    HB2  ASN  95          1HB       ASN  95 -10.149 -14.972  -7.543
  738    HB3  ASN  95          2HB       ASN  95  -9.791 -14.516  -9.198
  739   HD21  ASN  95          1HD2      ASN  95 -10.069 -16.603  -9.926
  740   HD22  ASN  95          2HD2      ASN  95  -8.910 -17.859  -9.614
  741    H    ASN  96           H        ASN  96  -7.932 -11.818  -6.282
  742    HA   ASN  96           HA       ASN  96  -9.433  -9.918  -7.907
  743    HB2  ASN  96          1HB       ASN  96 -11.139 -10.587  -6.392
  744    HB3  ASN  96          2HB       ASN  96 -10.031 -10.594  -5.022
  745   HD21  ASN  96          1HD2      ASN  96 -11.344  -9.252  -3.836
  746   HD22  ASN  96          2HD2      ASN  96 -11.543  -7.569  -4.188
  747    H    ALA  97           H        ALA  97  -8.275  -8.131  -8.141
  748    HA   ALA  97           HA       ALA  97  -5.734  -7.868  -6.936
  749    HB1  ALA  97          1HB       ALA  97  -7.279  -5.806  -8.492
  750    HB2  ALA  97          2HB       ALA  97  -6.256  -7.057  -9.194
  751    HB3  ALA  97          3HB       ALA  97  -5.544  -5.802  -8.181
  752    H    CYS  98           H        CYS  98  -8.874  -6.641  -6.055
  753    HA   CYS  98           HA       CYS  98  -7.970  -4.495  -4.432
  754    HB2  CYS  98          1HB       CYS  98 -10.509  -6.105  -4.115
  755    HB3  CYS  98          2HB       CYS  98 -10.181  -4.533  -3.400
  756    H    HIS  99           H        HIS  99  -8.622  -7.905  -3.735
  757    HA   HIS  99           HA       HIS  99  -8.021  -7.593  -0.937
  758    HB2  HIS  99          1HB       HIS  99  -9.572  -9.344  -2.019
  759    HB3  HIS  99          2HB       HIS  99  -8.102 -10.208  -2.445
  760    HD1  HIS  99           HD1      HIS  99 -10.595 -10.594  -0.164
  761    HD2  HIS  99           HD2      HIS  99  -6.482 -10.237   0.331
  762    HE1  HIS  99           HE1      HIS  99 -10.089 -11.626   2.071
  763    HE2  HIS  99           HE2      HIS  99  -7.585 -11.536   2.275
  764    H    TRP 100           H        TRP 100  -6.312  -8.437  -3.842
  765    HA   TRP 100           HA       TRP 100  -4.067  -9.687  -2.670
  766    HB2  TRP 100          1HB       TRP 100  -4.706  -9.866  -5.072
  767    HB3  TRP 100          2HB       TRP 100  -4.202  -8.193  -5.302
  768    HD1  TRP 100           HD1      TRP 100  -1.815  -9.922  -3.046
  769    HE1  TRP 100           HE1      TRP 100   0.293 -10.626  -4.346
  770    HE3  TRP 100           HE3      TRP 100  -3.506  -9.179  -7.811
  771    HZ2  TRP 100           HZ2      TRP 100   1.121 -10.856  -7.026
  772    HZ3  TRP 100           HZ3      TRP 100  -1.998  -9.666  -9.685
  773    HH2  TRP 100           HH2      TRP 100   0.268 -10.486  -9.309
  774    H    ALA 101           H        ALA 101  -4.507  -6.379  -3.915
  775    HA   ALA 101           HA       ALA 101  -1.978  -5.431  -3.109
  776    HB1  ALA 101          1HB       ALA 101  -3.325  -4.341  -4.833
  777    HB2  ALA 101          2HB       ALA 101  -2.878  -3.210  -3.556
  778    HB3  ALA 101          3HB       ALA 101  -4.509  -3.877  -3.615
  779    H    PHE 102           H        PHE 102  -5.115  -5.533  -1.538
  780    HA   PHE 102           HA       PHE 102  -4.455  -3.829   0.604
  781    HB2  PHE 102          1HB       PHE 102  -6.768  -4.378  -0.062
  782    HB3  PHE 102          2HB       PHE 102  -6.540  -6.012   0.560
  783    HD1  PHE 102           HD1      PHE 102  -6.454  -2.435   1.545
  784    HD2  PHE 102           HD2      PHE 102  -7.005  -6.462   2.818
  785    HE1  PHE 102           HE1      PHE 102  -7.172  -1.634   3.755
  786    HE2  PHE 102           HE2      PHE 102  -7.726  -5.663   5.031
  787    HZ   PHE 102           HZ       PHE 102  -7.808  -3.245   5.503
  788    H    ARG 103           H        ARG 103  -3.996  -7.237   0.003
  789    HA   ARG 103           HA       ARG 103  -3.473  -8.107   2.635
  790    HB2  ARG 103          1HB       ARG 103  -3.864  -9.647   0.723
  791    HB3  ARG 103          2HB       ARG 103  -2.317  -9.153   0.049
  792    HG2  ARG 103          1HG       ARG 103  -1.210  -9.991   2.109
  793    HG3  ARG 103          2HG       ARG 103  -2.772 -10.602   2.640
  794    HD2  ARG 103          1HD       ARG 103  -1.329 -11.442   0.112
  795    HD3  ARG 103          2HD       ARG 103  -1.379 -12.354   1.613
  796    HE   ARG 103           HE       ARG 103  -3.963 -12.158   1.114
  797   HH11  ARG 103          1HH1      ARG 103  -1.326 -12.850  -1.065
  798   HH12  ARG 103          2HH1      ARG 103  -2.254 -13.901  -2.079
  799   HH21  ARG 103          1HH2      ARG 103  -5.204 -13.565  -0.209
  800   HH22  ARG 103          2HH2      ARG 103  -4.458 -14.340  -1.571
  801    H    GLY 104           H        GLY 104  -1.363  -6.887   0.071
  802    HA2  GLY 104          1HA       GLY 104   1.070  -7.216   1.493
  803    HA3  GLY 104          2HA       GLY 104   0.816  -6.172   0.090
  804    H    PHE 105           H        PHE 105  -1.065  -4.420   1.041
  805    HA   PHE 105           HA       PHE 105   0.570  -2.591   2.418
  806    HB2  PHE 105          1HB       PHE 105  -1.042  -1.720   0.912
  807    HB3  PHE 105          2HB       PHE 105  -2.353  -2.577   1.707
  808    HD1  PHE 105           HD1      PHE 105  -3.822  -1.080   2.681
  809    HD2  PHE 105           HD2      PHE 105   0.365  -0.318   2.896
  810    HE1  PHE 105           HE1      PHE 105  -4.259   0.923   4.034
  811    HE2  PHE 105           HE2      PHE 105  -0.075   1.691   4.247
  812    HZ   PHE 105           HZ       PHE 105  -2.384   2.310   4.821
  813    H    LYS 106           H        LYS 106  -2.121  -4.622   3.435
  814    HA   LYS 106           HA       LYS 106  -2.471  -3.524   5.995
  815    HB2  LYS 106          1HB       LYS 106  -4.286  -4.771   5.392
  816    HB3  LYS 106          2HB       LYS 106  -3.327  -6.036   4.627
  817    HG2  LYS 106          1HG       LYS 106  -2.674  -6.789   6.918
  818    HG3  LYS 106          2HG       LYS 106  -3.825  -5.611   7.564
  819    HD2  LYS 106          1HD       LYS 106  -5.648  -6.707   6.413
  820    HD3  LYS 106          2HD       LYS 106  -4.528  -7.829   5.640
  821    HE2  LYS 106          1HE       LYS 106  -3.932  -8.733   7.839
  822    HE3  LYS 106          2HE       LYS 106  -5.062  -7.616   8.603
  823    HZ1  LYS 106          1HZ       LYS 106  -6.874  -8.673   7.417
  824    HZ2  LYS 106          2HZ       LYS 106  -6.017  -9.815   8.330
  825    HZ3  LYS 106          3HZ       LYS 106  -5.791  -9.734   6.656
  826    H    CYS 107           H        CYS 107  -0.568  -6.308   4.883
  827    HA   CYS 107           HA       CYS 107   0.338  -7.134   7.396
  828    HB2  CYS 107          1HB       CYS 107   0.680  -8.672   5.676
  829    HB3  CYS 107          2HB       CYS 107   1.400  -7.473   4.605
  830    H    PHE 108           H        PHE 108   1.793  -4.916   5.035
  831    HA   PHE 108           HA       PHE 108   4.232  -4.691   6.436
  832    HB2  PHE 108          1HB       PHE 108   3.782  -4.224   3.970
  833    HB3  PHE 108          2HB       PHE 108   3.168  -2.656   4.493
  834    HD1  PHE 108           HD1      PHE 108   6.103  -4.728   3.971
  835    HD2  PHE 108           HD2      PHE 108   4.700  -1.004   5.491
  836    HE1  PHE 108           HE1      PHE 108   8.400  -3.863   3.973
  837    HE2  PHE 108           HE2      PHE 108   7.003  -0.138   5.492
  838    HZ   PHE 108           HZ       PHE 108   8.855  -1.569   4.732
  839    H    GLN 109           H        GLN 109   1.342  -2.628   6.296
  840    HA   GLN 109           HA       GLN 109   2.401  -0.579   7.935
  841    HB2  GLN 109          1HB       GLN 109   0.147   0.274   8.058
  842    HB3  GLN 109          2HB       GLN 109   0.484  -0.251   6.418
  843    HG2  GLN 109          1HG       GLN 109  -1.513  -1.233   6.556
  844    HG3  GLN 109          2HG       GLN 109  -0.667  -2.480   7.477
  845   HE21  GLN 109          1HE2      GLN 109  -3.447  -1.656   7.613
  846   HE22  GLN 109          2HE2      GLN 109  -3.726  -1.172   9.246
  847    H    LYS 110           H        LYS 110   0.989  -3.645   8.635
  848    HA   LYS 110           HA       LYS 110   0.055  -3.129  11.247
  849    HB2  LYS 110          1HB       LYS 110  -0.644  -5.054   9.880
  850    HB3  LYS 110          2HB       LYS 110   0.979  -5.709   9.981
  851    HG2  LYS 110          1HG       LYS 110   0.762  -5.998  12.359
  852    HG3  LYS 110          2HG       LYS 110  -0.848  -5.278  12.320
  853    HD2  LYS 110          1HD       LYS 110  -1.642  -7.090  10.901
  854    HD3  LYS 110          2HD       LYS 110  -0.023  -7.787  10.857
  855    HE2  LYS 110          1HE       LYS 110  -0.129  -8.119  13.297
  856    HE3  LYS 110          2HE       LYS 110  -1.775  -7.485  13.297
  857    HZ1  LYS 110          1HZ       LYS 110  -2.419  -9.298  11.824
  858    HZ2  LYS 110          2HZ       LYS 110  -1.783  -9.885  13.274
  859    HZ3  LYS 110          3HZ       LYS 110  -0.847  -9.914  11.870
  860    H    ASN 111           H        ASN 111   3.204  -3.855   9.943
  861    HA   ASN 111           HA       ASN 111   4.257  -4.059  12.690
  862    HB2  ASN 111          1HB       ASN 111   5.426  -5.259  10.173
  863    HB3  ASN 111          2HB       ASN 111   6.099  -5.390  11.794
  864   HD21  ASN 111          1HD2      ASN 111   5.035  -6.672  13.331
  865   HD22  ASN 111          2HD2      ASN 111   3.906  -7.893  12.864
  866    H    ASN 112           H        ASN 112   4.498  -2.431   9.631
  867    HA   ASN 112           HA       ASN 112   6.692  -0.792  10.699
  868    HB2  ASN 112          1HB       ASN 112   6.575  -2.018   7.934
  869    HB3  ASN 112          2HB       ASN 112   7.736  -0.782   8.437
  870   HD21  ASN 112          1HD2      ASN 112   7.878  -3.709   7.596
  871   HD22  ASN 112          2HD2      ASN 112   8.905  -4.425   8.788
  872    H    LEU 113           H        LEU 113   4.429   0.344  11.026
  873    HA   LEU 113           HA       LEU 113   3.419   1.641   8.646
  874    HB2  LEU 113          1HB       LEU 113   1.817   1.015  10.305
  875    HB3  LEU 113          2HB       LEU 113   2.675   1.890  11.553
  876    HG   LEU 113           HG       LEU 113   2.112   4.008  10.351
  877   HD11  LEU 113          1HD1      LEU 113   1.803   2.990   8.128
  878   HD12  LEU 113          2HD1      LEU 113   0.422   3.971   8.627
  879   HD13  LEU 113          3HD1      LEU 113   0.333   2.213   8.714
  880   HD21  LEU 113          1HD2      LEU 113  -0.237   4.017  11.055
  881   HD22  LEU 113          2HD2      LEU 113   0.797   3.232  12.251
  882   HD23  LEU 113          3HD2      LEU 113  -0.202   2.257  11.173
  883    H    SER 114           H        SER 114   5.608   2.340  11.222
  884    HA   SER 114           HA       SER 114   5.605   5.165  11.059
  885    HB2  SER 114          1HB       SER 114   6.595   3.867  12.955
  886    HB3  SER 114          2HB       SER 114   7.906   3.370  11.885
  887    HG   SER 114           HG       SER 114   7.248   6.030  12.639
  888    H    LEU 115           H        LEU 115   7.328   2.650   9.313
  889    HA   LEU 115           HA       LEU 115   9.114   4.351   7.928
  890    HB2  LEU 115          1HB       LEU 115   9.398   1.906   8.207
  891    HB3  LEU 115          2HB       LEU 115   8.055   1.652   7.110
  892    HG   LEU 115           HG       LEU 115   9.351   2.765   5.316
  893   HD11  LEU 115          1HD1      LEU 115  11.491   2.807   7.426
  894   HD12  LEU 115          2HD1      LEU 115  10.771   4.192   6.610
  895   HD13  LEU 115          3HD1      LEU 115  11.788   3.067   5.710
  896   HD21  LEU 115          1HD2      LEU 115  10.779   0.455   6.628
  897   HD22  LEU 115          2HD2      LEU 115  10.892   0.931   4.933
  898   HD23  LEU 115          3HD2      LEU 115   9.367   0.324   5.579
  899    H    ILE 116           H        ILE 116   5.847   3.246   7.330
  900    HA   ILE 116           HA       ILE 116   5.646   4.125   4.649
  901    HB   ILE 116           HB       ILE 116   3.462   3.736   6.712
  902   HG12  ILE 116          1HG1      ILE 116   4.529   1.892   4.557
  903   HG13  ILE 116          2HG1      ILE 116   4.760   1.700   6.301
  904   HG21  ILE 116          1HG2      ILE 116   1.952   3.544   4.777
  905   HG22  ILE 116          2HG2      ILE 116   3.285   3.986   3.710
  906   HG23  ILE 116          3HG2      ILE 116   2.682   5.147   4.894
  907   HD11  ILE 116          1HD1      ILE 116   2.305   1.468   6.531
  908   HD12  ILE 116          2HD1      ILE 116   3.054   0.199   5.561
  909   HD13  ILE 116          3HD1      ILE 116   2.179   1.511   4.774
  910    H    LYS 117           H        LYS 117   4.859   5.600   7.760
  911    HA   LYS 117           HA       LYS 117   3.886   8.050   6.772
  912    HB2  LYS 117          1HB       LYS 117   5.147   7.284   9.396
  913    HB3  LYS 117          2HB       LYS 117   4.540   8.903   9.078
  914    HG2  LYS 117          1HG       LYS 117   2.304   8.050   8.769
  915    HG3  LYS 117          2HG       LYS 117   2.872   6.390   8.932
  916    HD2  LYS 117          1HD       LYS 117   3.529   6.816  11.237
  917    HD3  LYS 117          2HD       LYS 117   3.057   8.507  11.081
  918    HE2  LYS 117          1HE       LYS 117   1.159   6.192  10.741
  919    HE3  LYS 117          2HE       LYS 117   1.396   7.046  12.262
  920    HZ1  LYS 117          1HZ       LYS 117  -0.524   7.871  11.059
  921    HZ2  LYS 117          2HZ       LYS 117   0.443   8.276   9.731
  922    HZ3  LYS 117          3HZ       LYS 117   0.651   9.077  11.204
  923    H    ALA 118           H        ALA 118   7.105   6.958   7.726
  924    HA   ALA 118           HA       ALA 118   8.482   9.385   7.408
  925    HB1  ALA 118          1HB       ALA 118   9.540   6.597   7.025
  926    HB2  ALA 118          2HB       ALA 118   9.356   7.407   8.578
  927    HB3  ALA 118          3HB       ALA 118  10.484   8.045   7.382
  928    H    SER 119           H        SER 119   7.744   6.795   5.149
  929    HA   SER 119           HA       SER 119   9.346   7.553   3.017
  930    HB2  SER 119          1HB       SER 119   8.150   5.411   3.145
  931    HB3  SER 119          2HB       SER 119   6.616   6.249   2.922
  932    HG   SER 119           HG       SER 119   8.755   5.971   1.085
  933    H    ILE 120           H        ILE 120   5.973   8.518   3.708
  934    HA   ILE 120           HA       ILE 120   6.078  10.344   1.443
  935    HB   ILE 120           HB       ILE 120   3.717  10.816   1.892
  936   HG12  ILE 120          1HG1      ILE 120   3.869   8.702   4.040
  937   HG13  ILE 120          2HG1      ILE 120   3.891  10.432   4.382
  938   HG21  ILE 120          1HG2      ILE 120   4.383   7.880   1.777
  939   HG22  ILE 120          2HG2      ILE 120   4.320   8.989   0.407
  940   HG23  ILE 120          3HG2      ILE 120   2.848   8.605   1.301
  941   HD11  ILE 120          1HD1      ILE 120   1.707  10.666   3.324
  942   HD12  ILE 120          2HD1      ILE 120   1.669   9.519   4.660
  943   HD13  ILE 120          3HD1      ILE 120   1.682   8.936   2.999
  944    H    LYS 121           H        LYS 121   7.068  10.514   4.568
  945    HA   LYS 121           HA       LYS 121   6.288  13.142   5.270
  946    HB2  LYS 121          1HB       LYS 121   7.324  11.617   6.889
  947    HB3  LYS 121          2HB       LYS 121   8.814  11.616   5.958
  948    HG2  LYS 121          1HG       LYS 121   9.100  14.002   6.412
  949    HG3  LYS 121          2HG       LYS 121   7.593  14.007   7.325
  950    HD2  LYS 121          1HD       LYS 121   9.203  13.845   8.989
  951    HD3  LYS 121          2HD       LYS 121   8.714  12.169   8.754
  952    HE2  LYS 121          1HE       LYS 121  11.086  13.364   7.343
  953    HE3  LYS 121          2HE       LYS 121  11.213  12.654   8.948
  954    HZ1  LYS 121          1HZ       LYS 121  10.406  11.277   6.446
  955    HZ2  LYS 121          2HZ       LYS 121  10.315  10.576   7.982
  956    HZ3  LYS 121          3HZ       LYS 121  11.813  11.025   7.347
  957    H    LYS 122           H        LYS 122   6.864  15.033   4.360
  958    HA   LYS 122           HA       LYS 122   9.362  15.326   2.975
  959    HB2  LYS 122          1HB       LYS 122   7.169  14.339   1.514
  960    HB3  LYS 122          2HB       LYS 122   7.361  16.008   1.036
  961    HG2  LYS 122          1HG       LYS 122   9.425  15.664   0.108
  962    HG3  LYS 122          2HG       LYS 122   9.780  14.293   1.155
  963    HD2  LYS 122          1HD       LYS 122   7.754  14.259  -1.075
  964    HD3  LYS 122          2HD       LYS 122   9.410  13.672  -1.223
  965    HE2  LYS 122          1HE       LYS 122   7.256  12.604   0.601
  966    HE3  LYS 122          2HE       LYS 122   7.937  11.808  -0.815
  967    HZ1  LYS 122          1HZ       LYS 122  10.101  11.797   0.347
  968    HZ2  LYS 122          2HZ       LYS 122   8.917  10.882   1.139
  969    HZ3  LYS 122          3HZ       LYS 122   9.343  12.413   1.729
  970    H    ASP 123           H        ASP 123  10.025  17.264   3.305
  971    HA   ASP 123           HA       ASP 123   8.149  19.394   3.940
  972    HB2  ASP 123          1HB       ASP 123  10.199  20.657   4.589
  973    HB3  ASP 123          2HB       ASP 123  10.007  19.148   5.472
  974    H21  ACD 201           H21      ACD   1  -4.240   4.527   1.576
  975    H22  ACD 201           H22      ACD   1  -3.152   5.196   2.800
  976    H31  ACD 201           H31      ACD   1  -1.924   6.454   1.131
  977    H32  ACD 201           H32      ACD   1  -3.105   6.075  -0.115
  978    H41  ACD 201           H41      ACD   1  -2.495   3.676  -0.003
  979    H42  ACD 201           H42      ACD   1  -1.068   4.672  -0.342
  980    H5   ACD 201           H5       ACD   1  -1.644   3.141   2.241
  981    H6   ACD 201           H6       ACD   1   0.561   3.872   2.800
  982    H71  ACD 201           H71      ACD   1   0.981   4.965   0.130
  983    H72  ACD 201           H72      ACD   1   0.040   6.189   0.983
  984    H8   ACD 201           H8       ACD   1   1.903   6.592   2.568
  985    H9   ACD 201           H9       ACD   1   4.024   5.648   2.020
  986   H101  ACD 201          H101      ACD   1   3.003   4.722  -0.537
  987   H102  ACD 201          H102      ACD   1   2.517   3.478   0.618
  988    H11  ACD 201           H11      ACD   1   5.481   4.347   0.538
  989    H12  ACD 201           H12      ACD   1   5.812   2.010   0.264
  990   H131  ACD 201          H131      ACD   1   2.851   2.026  -0.506
  991   H132  ACD 201          H132      ACD   1   3.958   0.655  -0.602
  992    H14  ACD 201           H14      ACD   1   2.807   1.681   2.091
  993    H15  ACD 201           H15      ACD   1   2.645  -0.663   2.492
  994   H161  ACD 201          H161      ACD   1   2.850  -1.311  -0.326
  995   H162  ACD 201          H162      ACD   1   4.515  -0.976   0.161
  996   H171  ACD 201          H171      ACD   1   4.467  -2.701   1.853
  997   H172  ACD 201          H172      ACD   1   2.725  -2.911   1.681
  998   H181  ACD 201          H181      ACD   1   4.781  -3.512  -0.489
  999   H182  ACD 201          H182      ACD   1   3.038  -3.754  -0.631
 1000   H191  ACD 201          H191      ACD   1   4.918  -5.168   1.319
 1001   H192  ACD 201          H192      ACD   1   3.163  -5.321   1.366
 1002   H201  ACD 201          H201      ACD   1   4.179  -7.175   0.108
 1003   H202  ACD 201          H202      ACD   1   4.920  -6.061  -0.989
 1004   H203  ACD 201          H203      ACD   1   3.199  -6.214  -0.943
  Start of MODEL   21
    1    H1   MET   1          1H        MET   1  15.603   7.371 -18.054
    2    H2   MET   1          2H        MET   1  16.398   7.824 -16.632
    3    H3   MET   1          3H        MET   1  15.233   8.842 -17.310
    4    HA   MET   1           HA       MET   1  13.501   7.280 -16.862
    5    HB2  MET   1          1HB       MET   1  15.741   5.612 -15.703
    6    HB3  MET   1          2HB       MET   1  14.034   5.267 -15.483
    7    HG2  MET   1          1HG       MET   1  15.482   5.329 -18.120
    8    HG3  MET   1          2HG       MET   1  15.034   3.880 -17.222
    9    HE1  MET   1          1HE       MET   1  14.234   4.313 -20.282
   10    HE2  MET   1          2HE       MET   1  12.564   3.748 -20.247
   11    HE3  MET   1          3HE       MET   1  13.804   2.889 -19.334
   12    H    GLU   2           H        GLU   2  12.665   8.825 -15.574
   13    HA   GLU   2           HA       GLU   2  14.028   9.431 -13.050
   14    HB2  GLU   2          1HB       GLU   2  11.777  10.900 -14.415
   15    HB3  GLU   2          2HB       GLU   2  12.598  11.404 -12.949
   16    HG2  GLU   2          1HG       GLU   2  14.690  11.605 -14.231
   17    HG3  GLU   2          2HG       GLU   2  13.794  11.192 -15.692
   18    H    PHE   3           H        PHE   3  13.333   8.540 -11.268
   19    HA   PHE   3           HA       PHE   3  10.556   7.622 -11.097
   20    HB2  PHE   3          1HB       PHE   3  12.234   5.972 -10.469
   21    HB3  PHE   3          2HB       PHE   3  12.924   7.087  -9.284
   22    HD1  PHE   3           HD1      PHE   3  12.034   7.242  -7.111
   23    HD2  PHE   3           HD2      PHE   3   9.928   5.101 -10.120
   24    HE1  PHE   3           HE1      PHE   3  10.495   6.364  -5.402
   25    HE2  PHE   3           HE2      PHE   3   8.384   4.220  -8.418
   26    HZ   PHE   3           HZ       PHE   3   8.666   4.852  -6.056
   27    H    THR   4           H        THR   4   9.113   8.674  -9.916
   28    HA   THR   4           HA       THR   4  10.056  10.892  -8.210
   29    HB   THR   4           HB       THR   4   7.211  10.864  -8.956
   30    HG1  THR   4           HG1      THR   4   9.289  11.117 -10.902
   31   HG21  THR   4          1HG2      THR   4   7.669  13.231  -9.341
   32   HG22  THR   4          2HG2      THR   4   9.389  12.935  -9.093
   33   HG23  THR   4          3HG2      THR   4   8.253  12.698  -7.767
   34    H    VAL   5           H        VAL   5   9.843  10.607  -6.118
   35    HA   VAL   5           HA       VAL   5   8.203   8.455  -5.081
   36    HB   VAL   5           HB       VAL   5   9.241   8.696  -3.066
   37   HG11  VAL   5          1HG1      VAL   5  11.235  10.128  -4.780
   38   HG12  VAL   5          2HG1      VAL   5  10.970   8.386  -4.740
   39   HG13  VAL   5          3HG1      VAL   5  11.557   9.221  -3.304
   40   HG21  VAL   5          1HG2      VAL   5  10.081  10.789  -2.095
   41   HG22  VAL   5          2HG2      VAL   5   8.370  10.891  -2.506
   42   HG23  VAL   5          3HG2      VAL   5   9.573  11.655  -3.545
   43    H    SER   6           H        SER   6   6.348   8.612  -3.992
   44    HA   SER   6           HA       SER   6   4.819  11.026  -4.522
   45    HB2  SER   6          1HB       SER   6   3.904   8.392  -3.346
   46    HB3  SER   6          2HB       SER   6   2.874   9.670  -3.985
   47    HG   SER   6           HG       SER   6   4.689   8.975  -5.828
   48    H    THR   7           H        THR   7   5.232  12.583  -3.013
   49    HA   THR   7           HA       THR   7   5.479  11.961  -0.213
   50    HB   THR   7           HB       THR   7   5.504  14.399   0.132
   51    HG1  THR   7           HG1      THR   7   4.919  14.456  -2.671
   52   HG21  THR   7          1HG2      THR   7   7.229  13.537  -2.193
   53   HG22  THR   7          2HG2      THR   7   7.586  13.260  -0.488
   54   HG23  THR   7          3HG2      THR   7   7.537  14.904  -1.123
   55    H    THR   8           H        THR   8   3.994  13.453   1.297
   56    HA   THR   8           HA       THR   8   1.429  12.407   1.262
   57    HB   THR   8           HB       THR   8   2.134  15.069   2.484
   58    HG1  THR   8           HG1      THR   8   2.418  12.774   4.018
   59   HG21  THR   8          1HG2      THR   8  -0.213  14.453   2.631
   60   HG22  THR   8          2HG2      THR   8   0.542  14.328   4.221
   61   HG23  THR   8          3HG2      THR   8   0.224  12.872   3.279
   62    H    GLU   9           H        GLU   9   2.635  15.463  -0.023
   63    HA   GLU   9           HA       GLU   9   0.194  16.632  -0.716
   64    HB2  GLU   9          1HB       GLU   9   2.895  16.979  -2.007
   65    HB3  GLU   9          2HB       GLU   9   1.523  18.059  -2.204
   66    HG2  GLU   9          1HG       GLU   9   1.575  18.557   0.184
   67    HG3  GLU   9          2HG       GLU   9   2.961  17.487   0.371
   68    H    ASP  10           H        ASP  10   2.231  14.331  -2.384
   69    HA   ASP  10           HA       ASP  10   0.733  14.452  -4.845
   70    HB2  ASP  10          1HB       ASP  10   2.712  12.343  -3.949
   71    HB3  ASP  10          2HB       ASP  10   2.124  12.613  -5.586
   72    H    LEU  11           H        LEU  11   0.889  12.440  -1.993
   73    HA   LEU  11           HA       LEU  11  -0.629  10.292  -2.926
   74    HB2  LEU  11          1HB       LEU  11   0.761  10.099  -0.971
   75    HB3  LEU  11          2HB       LEU  11  -0.219  11.292  -0.108
   76    HG   LEU  11           HG       LEU  11  -2.133   9.695  -0.263
   77   HD11  LEU  11          1HD1      LEU  11  -1.690   7.387  -0.837
   78   HD12  LEU  11          2HD1      LEU  11  -0.017   7.787  -1.230
   79   HD13  LEU  11          3HD1      LEU  11  -1.335   8.441  -2.203
   80   HD21  LEU  11          1HD2      LEU  11  -0.675   9.891   1.733
   81   HD22  LEU  11          2HD2      LEU  11   0.311   8.571   1.099
   82   HD23  LEU  11          3HD2      LEU  11  -1.374   8.287   1.533
   83    H    GLN  12           H        GLN  12  -1.577  13.318  -1.380
   84    HA   GLN  12           HA       GLN  12  -4.265  12.615  -0.882
   85    HB2  GLN  12          1HB       GLN  12  -4.642  14.888  -0.372
   86    HB3  GLN  12          2HB       GLN  12  -2.974  14.582   0.084
   87    HG2  GLN  12          1HG       GLN  12  -2.279  15.559  -2.101
   88    HG3  GLN  12          2HG       GLN  12  -3.958  16.018  -2.362
   89   HE21  GLN  12          1HE2      GLN  12  -1.614  17.696  -2.131
   90   HE22  GLN  12          2HE2      GLN  12  -1.902  18.763  -0.802
   91    H    ARG  13           H        ARG  13  -2.611  13.633  -3.733
   92    HA   ARG  13           HA       ARG  13  -4.877  14.448  -5.246
   93    HB2  ARG  13          1HB       ARG  13  -2.600  15.110  -5.855
   94    HB3  ARG  13          2HB       ARG  13  -2.178  13.430  -6.151
   95    HG2  ARG  13          1HG       ARG  13  -3.876  13.363  -7.949
   96    HG3  ARG  13          2HG       ARG  13  -4.158  15.095  -7.686
   97    HD2  ARG  13          1HD       ARG  13  -1.792  15.526  -8.192
   98    HD3  ARG  13          2HD       ARG  13  -1.558  13.808  -8.511
   99    HE   ARG  13           HE       ARG  13  -3.666  14.865 -10.097
  100   HH11  ARG  13          1HH1      ARG  13  -0.171  14.721  -9.861
  101   HH12  ARG  13          2HH1      ARG  13   0.077  15.017 -11.552
  102   HH21  ARG  13          1HH2      ARG  13  -3.338  15.233 -12.316
  103   HH22  ARG  13          2HH2      ARG  13  -1.720  15.306 -12.951
  104    H    TYR  14           H        TYR  14  -2.908  11.487  -5.258
  105    HA   TYR  14           HA       TYR  14  -4.520  10.065  -7.074
  106    HB2  TYR  14          1HB       TYR  14  -2.781   8.848  -4.923
  107    HB3  TYR  14          2HB       TYR  14  -3.249   8.128  -6.456
  108    HD1  TYR  14           HD1      TYR  14  -2.729  10.180  -8.410
  109    HD2  TYR  14           HD2      TYR  14  -0.466   9.141  -4.958
  110    HE1  TYR  14           HE1      TYR  14  -0.706  11.087  -9.470
  111    HE2  TYR  14           HE2      TYR  14   1.562  10.052  -6.007
  112    HH   TYR  14           HH       TYR  14   1.494  12.027  -8.726
  113    H    ARG  15           H        ARG  15  -4.596  10.401  -3.594
  114    HA   ARG  15           HA       ARG  15  -6.372   8.352  -2.997
  115    HB2  ARG  15          1HB       ARG  15  -5.662   9.096  -1.011
  116    HB3  ARG  15          2HB       ARG  15  -5.277  10.685  -1.645
  117    HG2  ARG  15          1HG       ARG  15  -7.684  11.299  -1.386
  118    HG3  ARG  15          2HG       ARG  15  -7.964   9.711  -0.662
  119    HD2  ARG  15          1HD       ARG  15  -6.178  11.903   0.411
  120    HD3  ARG  15          2HD       ARG  15  -7.700  11.341   1.103
  121    HE   ARG  15           HE       ARG  15  -6.165   9.101   1.063
  122   HH11  ARG  15          1HH1      ARG  15  -5.686  12.336   2.346
  123   HH12  ARG  15          2HH1      ARG  15  -4.624  11.802   3.610
  124   HH21  ARG  15          1HH2      ARG  15  -4.783   8.407   2.731
  125   HH22  ARG  15          2HH2      ARG  15  -4.115   9.583   3.833
  126    H    THR  16           H        THR  16  -6.976  11.749  -3.818
  127    HA   THR  16           HA       THR  16  -9.789  11.610  -3.578
  128    HB   THR  16           HB       THR  16  -8.054  13.532  -5.129
  129    HG1  THR  16           HG1      THR  16  -7.536  14.015  -3.114
  130   HG21  THR  16          1HG2      THR  16 -10.918  13.834  -4.216
  131   HG22  THR  16          2HG2      THR  16 -10.402  13.556  -5.880
  132   HG23  THR  16          3HG2      THR  16  -9.955  15.051  -5.055
  133    H    GLU  17           H        GLU  17  -7.579  11.381  -6.341
  134    HA   GLU  17           HA       GLU  17  -9.496  11.214  -8.356
  135    HB2  GLU  17          1HB       GLU  17  -6.646  10.670  -8.095
  136    HB3  GLU  17          2HB       GLU  17  -7.423   9.644  -9.275
  137    HG2  GLU  17          1HG       GLU  17  -6.546  11.621 -10.345
  138    HG3  GLU  17          2HG       GLU  17  -8.309  11.621 -10.417
  139    H    CYS  18           H        CYS  18  -8.058   8.645  -6.393
  140    HA   CYS  18           HA       CYS  18  -9.483   6.561  -7.723
  141    HB2  CYS  18          1HB       CYS  18  -8.041   6.618  -5.070
  142    HB3  CYS  18          2HB       CYS  18  -8.784   5.169  -5.764
  143    H    VAL  19           H        VAL  19 -10.074   8.562  -4.893
  144    HA   VAL  19           HA       VAL  19 -12.291   7.202  -3.881
  145    HB   VAL  19           HB       VAL  19 -11.366  10.037  -3.680
  146   HG11  VAL  19          1HG1      VAL  19 -13.221  10.567  -2.192
  147   HG12  VAL  19          2HG1      VAL  19 -13.955   9.001  -2.537
  148   HG13  VAL  19          3HG1      VAL  19 -13.793  10.204  -3.822
  149   HG21  VAL  19          1HG2      VAL  19 -11.286   9.435  -1.278
  150   HG22  VAL  19          2HG2      VAL  19 -10.263   8.427  -2.294
  151   HG23  VAL  19          3HG2      VAL  19 -11.804   7.804  -1.708
  152    H    SER  20           H        SER  20 -12.145   9.976  -6.061
  153    HA   SER  20           HA       SER  20 -14.888  10.219  -6.533
  154    HB2  SER  20          1HB       SER  20 -13.301  11.979  -7.053
  155    HB3  SER  20          2HB       SER  20 -12.506  10.958  -8.248
  156    HG   SER  20           HG       SER  20 -15.173  11.938  -8.367
  157    H    SER  21           H        SER  21 -12.465   8.173  -8.075
  158    HA   SER  21           HA       SER  21 -14.145   7.517 -10.313
  159    HB2  SER  21          1HB       SER  21 -11.640   7.604 -10.394
  160    HB3  SER  21          2HB       SER  21 -11.606   6.154  -9.395
  161    HG   SER  21           HG       SER  21 -12.787   6.407 -11.969
  162    H    LEU  22           H        LEU  22 -13.026   5.779  -7.391
  163    HA   LEU  22           HA       LEU  22 -14.534   3.433  -8.148
  164    HB2  LEU  22          1HB       LEU  22 -12.789   4.098  -5.791
  165    HB3  LEU  22          2HB       LEU  22 -13.664   2.570  -5.926
  166    HG   LEU  22           HG       LEU  22 -11.678   3.531  -7.978
  167   HD11  LEU  22          1HD1      LEU  22 -10.135   1.907  -6.949
  168   HD12  LEU  22          2HD1      LEU  22 -11.299   1.662  -5.644
  169   HD13  LEU  22          3HD1      LEU  22 -10.536   3.235  -5.860
  170   HD21  LEU  22          1HD2      LEU  22 -12.856   0.813  -7.429
  171   HD22  LEU  22          2HD2      LEU  22 -11.732   1.234  -8.723
  172   HD23  LEU  22          3HD2      LEU  22 -13.365   1.899  -8.722
  173    H    ASN  23           H        ASN  23 -15.645   6.187  -7.092
  174    HA   ASN  23           HA       ASN  23 -17.440   6.933  -5.904
  175    HB2  ASN  23          1HB       ASN  23 -18.268   4.058  -6.257
  176    HB3  ASN  23          2HB       ASN  23 -19.311   5.295  -5.587
  177   HD21  ASN  23          1HD2      ASN  23 -20.108   6.911  -6.907
  178   HD22  ASN  23          2HD2      ASN  23 -20.077   6.777  -8.637
  179    H    ILE  24           H        ILE  24 -15.184   6.259  -4.368
  180    HA   ILE  24           HA       ILE  24 -15.902   4.781  -2.054
  181    HB   ILE  24           HB       ILE  24 -13.770   6.903  -2.227
  182   HG12  ILE  24          1HG1      ILE  24 -13.520   5.292  -4.100
  183   HG13  ILE  24          2HG1      ILE  24 -12.208   5.162  -2.930
  184   HG21  ILE  24          1HG2      ILE  24 -14.053   4.447  -0.501
  185   HG22  ILE  24          2HG2      ILE  24 -14.267   6.120   0.017
  186   HG23  ILE  24          3HG2      ILE  24 -12.678   5.550  -0.493
  187   HD11  ILE  24          1HD1      ILE  24 -14.584   3.327  -3.140
  188   HD12  ILE  24          2HD1      ILE  24 -13.265   3.180  -1.976
  189   HD13  ILE  24          3HD1      ILE  24 -12.948   2.982  -3.702
  190    HA   PRO  25           HA       PRO  25 -18.525   7.942  -0.228
  191    HB2  PRO  25          1HB       PRO  25 -18.185   6.277   2.170
  192    HB3  PRO  25          2HB       PRO  25 -19.660   6.759   1.332
  193    HG2  PRO  25          1HG       PRO  25 -18.695   4.248   1.243
  194    HG3  PRO  25          2HG       PRO  25 -19.595   4.984  -0.092
  195    HD2  PRO  25          1HD       PRO  25 -16.669   4.475   0.167
  196    HD3  PRO  25          2HD       PRO  25 -17.702   4.468  -1.282
  197    H    ALA  26           H        ALA  26 -18.129   9.683   0.958
  198    HA   ALA  26           HA       ALA  26 -15.521  10.492   1.522
  199    HB1  ALA  26          1HB       ALA  26 -17.396  12.008   1.098
  200    HB2  ALA  26          2HB       ALA  26 -16.537  12.420   2.584
  201    HB3  ALA  26          3HB       ALA  26 -18.086  11.579   2.662
  202    H    ASP  27           H        ASP  27 -17.931   8.989   3.567
  203    HA   ASP  27           HA       ASP  27 -16.818   9.359   6.078
  204    HB2  ASP  27          1HB       ASP  27 -18.431   7.112   4.911
  205    HB3  ASP  27          2HB       ASP  27 -17.841   7.031   6.566
  206    H    TYR  28           H        TYR  28 -16.086   6.782   3.720
  207    HA   TYR  28           HA       TYR  28 -14.128   5.516   5.280
  208    HB2  TYR  28          1HB       TYR  28 -14.816   5.523   2.379
  209    HB3  TYR  28          2HB       TYR  28 -13.276   4.825   2.874
  210    HD1  TYR  28           HD1      TYR  28 -16.863   4.343   2.733
  211    HD2  TYR  28           HD2      TYR  28 -13.258   2.898   4.465
  212    HE1  TYR  28           HE1      TYR  28 -17.985   2.233   3.291
  213    HE2  TYR  28           HE2      TYR  28 -14.375   0.784   5.032
  214    HH   TYR  28           HH       TYR  28 -17.268  -0.175   3.711
  215    H    VAL  29           H        VAL  29 -13.981   8.211   3.042
  216    HA   VAL  29           HA       VAL  29 -11.216   8.415   2.716
  217    HB   VAL  29           HB       VAL  29 -13.249  10.637   2.739
  218   HG11  VAL  29          1HG1      VAL  29 -11.623  11.769   1.246
  219   HG12  VAL  29          2HG1      VAL  29 -10.470  10.476   1.588
  220   HG13  VAL  29          3HG1      VAL  29 -11.021  11.536   2.886
  221   HG21  VAL  29          1HG2      VAL  29 -13.226  10.291   0.281
  222   HG22  VAL  29          2HG2      VAL  29 -13.897   8.936   1.189
  223   HG23  VAL  29          3HG2      VAL  29 -12.260   8.839   0.545
  224    H    GLU  30           H        GLU  30 -13.353   9.851   5.171
  225    HA   GLU  30           HA       GLU  30 -11.384  11.334   6.551
  226    HB2  GLU  30          1HB       GLU  30 -13.755  10.087   7.917
  227    HB3  GLU  30          2HB       GLU  30 -12.950  11.617   8.252
  228    HG2  GLU  30          1HG       GLU  30 -13.739  12.467   6.085
  229    HG3  GLU  30          2HG       GLU  30 -14.657  10.982   5.873
  230    H    LYS  31           H        LYS  31 -12.276   7.963   6.675
  231    HA   LYS  31           HA       LYS  31 -10.800   7.283   9.003
  232    HB2  LYS  31          1HB       LYS  31 -11.541   5.557   6.633
  233    HB3  LYS  31          2HB       LYS  31 -10.887   4.970   8.169
  234    HG2  LYS  31          1HG       LYS  31 -12.874   5.893   9.315
  235    HG3  LYS  31          2HG       LYS  31 -13.534   6.336   7.740
  236    HD2  LYS  31          1HD       LYS  31 -13.431   3.966   7.056
  237    HD3  LYS  31          2HD       LYS  31 -12.840   3.551   8.676
  238    HE2  LYS  31          1HE       LYS  31 -15.469   4.942   8.167
  239    HE3  LYS  31          2HE       LYS  31 -15.307   3.192   8.332
  240    HZ1  LYS  31          1HZ       LYS  31 -15.941   4.211  10.418
  241    HZ2  LYS  31          2HZ       LYS  31 -14.575   5.206  10.389
  242    HZ3  LYS  31          3HZ       LYS  31 -14.398   3.531  10.548
  243    H    PHE  32           H        PHE  32 -10.048   7.011   5.541
  244    HA   PHE  32           HA       PHE  32  -7.507   5.921   5.770
  245    HB2  PHE  32          1HB       PHE  32  -8.424   7.823   3.613
  246    HB3  PHE  32          2HB       PHE  32  -7.142   6.623   3.486
  247    HD1  PHE  32           HD1      PHE  32  -8.644   4.398   4.945
  248    HD2  PHE  32           HD2      PHE  32  -9.762   7.051   1.814
  249    HE1  PHE  32           HE1      PHE  32 -10.269   2.746   4.131
  250    HE2  PHE  32           HE2      PHE  32 -11.391   5.400   0.996
  251    HZ   PHE  32           HZ       PHE  32 -11.644   3.241   2.151
  252    H    LYS  33           H        LYS  33  -8.508   9.298   5.716
  253    HA   LYS  33           HA       LYS  33  -5.928  10.447   5.685
  254    HB2  LYS  33          1HB       LYS  33  -8.290  11.490   5.268
  255    HB3  LYS  33          2HB       LYS  33  -8.273  11.761   7.008
  256    HG2  LYS  33          1HG       LYS  33  -6.296  13.103   6.852
  257    HG3  LYS  33          2HG       LYS  33  -6.133  12.730   5.127
  258    HD2  LYS  33          1HD       LYS  33  -8.249  13.868   4.679
  259    HD3  LYS  33          2HD       LYS  33  -8.435  14.221   6.397
  260    HE2  LYS  33          1HE       LYS  33  -6.426  15.585   6.357
  261    HE3  LYS  33          2HE       LYS  33  -6.166  15.184   4.659
  262    HZ1  LYS  33          1HZ       LYS  33  -8.479  16.691   5.754
  263    HZ2  LYS  33          2HZ       LYS  33  -8.258  16.286   4.128
  264    HZ3  LYS  33          3HZ       LYS  33  -7.184  17.350   4.886
  265    H    LYS  34           H        LYS  34  -7.683   8.861   8.165
  266    HA   LYS  34           HA       LYS  34  -5.866   9.950  10.215
  267    HB2  LYS  34          1HB       LYS  34  -7.536   9.755  11.780
  268    HB3  LYS  34          2HB       LYS  34  -8.510  10.010  10.352
  269    HG2  LYS  34          1HG       LYS  34  -8.670   7.476  10.181
  270    HG3  LYS  34          2HG       LYS  34  -8.044   7.447  11.830
  271    HD2  LYS  34          1HD       LYS  34 -10.563   8.804  10.869
  272    HD3  LYS  34          2HD       LYS  34 -10.456   7.371  11.893
  273    HE2  LYS  34          1HE       LYS  34  -9.465   8.662  13.671
  274    HE3  LYS  34          2HE       LYS  34  -9.389  10.089  12.643
  275    HZ1  LYS  34          1HZ       LYS  34 -11.880   8.744  13.537
  276    HZ2  LYS  34          2HZ       LYS  34 -11.798  10.126  12.563
  277    HZ3  LYS  34          3HZ       LYS  34 -11.260  10.186  14.166
  278    H    TRP  35           H        TRP  35  -5.655   7.740   8.124
  279    HA   TRP  35           HA       TRP  35  -4.500   5.826   7.870
  280    HB2  TRP  35          1HB       TRP  35  -3.672   6.428  10.706
  281    HB3  TRP  35          2HB       TRP  35  -2.994   5.098   9.756
  282    HD1  TRP  35           HD1      TRP  35  -2.747   8.824  10.278
  283    HE1  TRP  35           HE1      TRP  35  -0.867   9.782   8.802
  284    HE3  TRP  35           HE3      TRP  35  -1.824   4.714   7.383
  285    HZ2  TRP  35           HZ2      TRP  35   0.789   8.905   6.697
  286    HZ3  TRP  35           HZ3      TRP  35  -0.078   4.855   5.662
  287    HH2  TRP  35           HH2      TRP  35   1.206   6.902   5.321
  288    H    GLU  36           H        GLU  36  -7.165   5.519   8.386
  289    HA   GLU  36           HA       GLU  36  -7.184   2.968   9.840
  290    HB2  GLU  36          1HB       GLU  36  -9.243   5.136   9.772
  291    HB3  GLU  36          2HB       GLU  36  -9.699   3.469  10.099
  292    HG2  GLU  36          1HG       GLU  36  -7.713   5.091  11.664
  293    HG3  GLU  36          2HG       GLU  36  -9.372   4.751  12.145
  294    H    PHE  37           H        PHE  37  -7.316   1.364   8.487
  295    HA   PHE  37           HA       PHE  37  -8.983   1.671   6.074
  296    HB2  PHE  37          1HB       PHE  37  -6.548  -0.113   6.330
  297    HB3  PHE  37          2HB       PHE  37  -7.447   0.250   4.859
  298    HD1  PHE  37           HD1      PHE  37  -6.990   2.225   3.600
  299    HD2  PHE  37           HD2      PHE  37  -5.168   1.631   7.401
  300    HE1  PHE  37           HE1      PHE  37  -5.488   4.124   3.174
  301    HE2  PHE  37           HE2      PHE  37  -3.655   3.524   6.975
  302    HZ   PHE  37           HZ       PHE  37  -3.815   4.776   4.863
  303    HA   PRO  38           HA       PRO  38 -11.059  -1.596   8.571
  304    HB2  PRO  38          1HB       PRO  38 -13.149  -0.923   6.576
  305    HB3  PRO  38          2HB       PRO  38 -13.270  -1.087   8.338
  306    HG2  PRO  38          1HG       PRO  38 -13.339   1.319   7.225
  307    HG3  PRO  38          2HG       PRO  38 -12.428   1.043   8.723
  308    HD2  PRO  38          1HD       PRO  38 -11.395   1.257   5.905
  309    HD3  PRO  38          2HD       PRO  38 -10.741   1.973   7.412
  310    H    GLU  39           H        GLU  39 -11.608  -3.678   8.074
  311    HA   GLU  39           HA       GLU  39 -10.559  -4.775   5.653
  312    HB2  GLU  39          1HB       GLU  39 -10.474  -5.924   7.855
  313    HB3  GLU  39          2HB       GLU  39 -12.219  -6.114   7.791
  314    HG2  GLU  39          1HG       GLU  39 -12.017  -7.509   5.820
  315    HG3  GLU  39          2HG       GLU  39 -10.268  -7.272   5.816
  316    H    ASP  40           H        ASP  40 -11.739  -3.784   4.057
  317    HA   ASP  40           HA       ASP  40 -14.437  -4.768   3.596
  318    HB2  ASP  40          1HB       ASP  40 -15.247  -2.888   4.636
  319    HB3  ASP  40          2HB       ASP  40 -13.782  -1.959   4.345
  320    H    ASP  41           H        ASP  41 -14.930  -4.919   1.478
  321    HA   ASP  41           HA       ASP  41 -12.781  -5.095  -0.318
  322    HB2  ASP  41          1HB       ASP  41 -15.755  -5.286  -0.682
  323    HB3  ASP  41          2HB       ASP  41 -14.651  -5.419  -2.041
  324    H    THR  42           H        THR  42 -15.157  -2.546   0.174
  325    HA   THR  42           HA       THR  42 -14.580  -0.991  -2.095
  326    HB   THR  42           HB       THR  42 -15.380  -0.077   0.678
  327    HG1  THR  42           HG1      THR  42 -17.362  -0.591   0.098
  328   HG21  THR  42          1HG2      THR  42 -15.488   1.330  -1.986
  329   HG22  THR  42          2HG2      THR  42 -14.511   1.783  -0.589
  330   HG23  THR  42          3HG2      THR  42 -16.269   1.907  -0.514
  331    H    THR  43           H        THR  43 -13.272  -0.764   1.206
  332    HA   THR  43           HA       THR  43 -11.264   1.105   0.789
  333    HB   THR  43           HB       THR  43 -11.172  -1.294   2.630
  334    HG1  THR  43           HG1      THR  43 -13.054   0.071   2.904
  335   HG21  THR  43          1HG2      THR  43  -8.997  -0.283   2.495
  336   HG22  THR  43          2HG2      THR  43  -9.728   0.216   4.022
  337   HG23  THR  43          3HG2      THR  43  -9.683   1.331   2.655
  338    H    MET  44           H        MET  44 -11.312  -2.332   0.087
  339    HA   MET  44           HA       MET  44  -8.526  -2.662  -0.219
  340    HB2  MET  44          1HB       MET  44 -10.782  -4.311  -1.351
  341    HB3  MET  44          2HB       MET  44  -9.097  -4.806  -1.290
  342    HG2  MET  44          1HG       MET  44  -9.147  -4.741   1.135
  343    HG3  MET  44          2HG       MET  44 -10.814  -4.183   1.098
  344    HE1  MET  44          1HE       MET  44 -11.238  -7.765   2.507
  345    HE2  MET  44          2HE       MET  44 -11.594  -6.050   2.719
  346    HE3  MET  44          3HE       MET  44  -9.932  -6.628   2.849
  347    H    CYS  45           H        CYS  45 -11.119  -2.233  -2.638
  348    HA   CYS  45           HA       CYS  45  -9.353  -2.217  -4.852
  349    HB2  CYS  45          1HB       CYS  45 -12.149  -1.099  -4.567
  350    HB3  CYS  45          2HB       CYS  45 -11.256  -1.106  -6.080
  351    H    TYR  46           H        TYR  46 -10.383   0.242  -2.608
  352    HA   TYR  46           HA       TYR  46  -9.518   2.499  -4.007
  353    HB2  TYR  46          1HB       TYR  46 -10.822   2.891  -2.095
  354    HB3  TYR  46          2HB       TYR  46  -9.802   1.879  -1.072
  355    HD1  TYR  46           HD1      TYR  46  -8.219   2.902   0.293
  356    HD2  TYR  46           HD2      TYR  46  -9.699   5.024  -3.090
  357    HE1  TYR  46           HE1      TYR  46  -6.987   4.902   1.015
  358    HE2  TYR  46           HE2      TYR  46  -8.471   7.025  -2.372
  359    HH   TYR  46           HH       TYR  46  -6.169   6.957   0.233
  360    H    ILE  47           H        ILE  47  -7.826   0.478  -1.621
  361    HA   ILE  47           HA       ILE  47  -5.338   1.727  -1.742
  362    HB   ILE  47           HB       ILE  47  -6.045  -1.139  -1.145
  363   HG12  ILE  47          1HG1      ILE  47  -6.938   0.463   0.456
  364   HG13  ILE  47          2HG1      ILE  47  -5.628  -0.446   1.205
  365   HG21  ILE  47          1HG2      ILE  47  -3.786  -1.333  -0.143
  366   HG22  ILE  47          2HG2      ILE  47  -3.379   0.239  -0.835
  367   HG23  ILE  47          3HG2      ILE  47  -3.754  -1.120  -1.894
  368   HD11  ILE  47          1HD1      ILE  47  -5.378   1.803   1.867
  369   HD12  ILE  47          2HD1      ILE  47  -5.592   2.393   0.222
  370   HD13  ILE  47          3HD1      ILE  47  -4.127   1.507   0.659
  371    H    LYS  48           H        LYS  48  -6.743  -0.808  -3.726
  372    HA   LYS  48           HA       LYS  48  -4.503  -1.568  -5.192
  373    HB2  LYS  48          1HB       LYS  48  -6.726  -2.707  -5.179
  374    HB3  LYS  48          2HB       LYS  48  -7.355  -1.404  -6.175
  375    HG2  LYS  48          1HG       LYS  48  -5.582  -1.999  -7.867
  376    HG3  LYS  48          2HG       LYS  48  -5.275  -3.441  -6.895
  377    HD2  LYS  48          1HD       LYS  48  -7.526  -4.208  -7.214
  378    HD3  LYS  48          2HD       LYS  48  -7.973  -2.701  -8.015
  379    HE2  LYS  48          1HE       LYS  48  -5.913  -4.647  -9.040
  380    HE3  LYS  48          2HE       LYS  48  -7.589  -4.583  -9.581
  381    HZ1  LYS  48          1HZ       LYS  48  -5.937  -3.398 -11.010
  382    HZ2  LYS  48          2HZ       LYS  48  -5.755  -2.266  -9.763
  383    HZ3  LYS  48          3HZ       LYS  48  -7.257  -2.459 -10.511
  384    H    CYS  49           H        CYS  49  -7.032   0.795  -6.039
  385    HA   CYS  49           HA       CYS  49  -5.909   1.704  -8.415
  386    HB2  CYS  49          1HB       CYS  49  -8.157   2.231  -7.956
  387    HB3  CYS  49          2HB       CYS  49  -7.761   3.041  -6.442
  388    H    VAL  50           H        VAL  50  -5.512   2.984  -5.115
  389    HA   VAL  50           HA       VAL  50  -3.976   5.214  -5.771
  390    HB   VAL  50           HB       VAL  50  -4.131   3.602  -3.230
  391   HG11  VAL  50          1HG1      VAL  50  -3.108   5.538  -2.116
  392   HG12  VAL  50          2HG1      VAL  50  -2.822   6.279  -3.691
  393   HG13  VAL  50          3HG1      VAL  50  -2.005   4.775  -3.261
  394   HG21  VAL  50          1HG2      VAL  50  -5.370   6.194  -4.103
  395   HG22  VAL  50          2HG2      VAL  50  -5.482   5.523  -2.476
  396   HG23  VAL  50          3HG2      VAL  50  -6.196   4.660  -3.839
  397    H    PHE  51           H        PHE  51  -3.041   1.955  -4.790
  398    HA   PHE  51           HA       PHE  51  -0.267   2.381  -4.803
  399    HB2  PHE  51          1HB       PHE  51  -2.089   0.042  -4.716
  400    HB3  PHE  51          2HB       PHE  51  -0.426  -0.271  -5.202
  401    HD1  PHE  51           HD1      PHE  51   0.157  -1.572  -3.299
  402    HD2  PHE  51           HD2      PHE  51  -1.409   2.355  -2.810
  403    HE1  PHE  51           HE1      PHE  51   0.807  -1.612  -0.930
  404    HE2  PHE  51           HE2      PHE  51  -0.757   2.323  -0.439
  405    HZ   PHE  51           HZ       PHE  51   0.352   0.338   0.503
  406    H    ASN  52           H        ASN  52  -2.554   1.827  -7.302
  407    HA   ASN  52           HA       ASN  52  -0.660   0.882  -9.257
  408    HB2  ASN  52          1HB       ASN  52  -3.072   0.259  -9.304
  409    HB3  ASN  52          2HB       ASN  52  -3.474   1.943  -9.655
  410   HD21  ASN  52          1HD2      ASN  52  -0.748   0.103 -10.950
  411   HD22  ASN  52          2HD2      ASN  52  -1.284   0.137 -12.591
  412    H    LYS  53           H        LYS  53  -2.335   3.919  -8.537
  413    HA   LYS  53           HA       LYS  53  -1.239   5.360 -10.732
  414    HB2  LYS  53          1HB       LYS  53  -2.769   6.054  -8.275
  415    HB3  LYS  53          2HB       LYS  53  -1.948   7.351  -9.128
  416    HG2  LYS  53          1HG       LYS  53  -3.928   5.455 -10.387
  417    HG3  LYS  53          2HG       LYS  53  -4.328   7.061  -9.774
  418    HD2  LYS  53          1HD       LYS  53  -2.776   8.072 -11.369
  419    HD3  LYS  53          2HD       LYS  53  -2.324   6.472 -11.958
  420    HE2  LYS  53          1HE       LYS  53  -5.090   7.666 -12.099
  421    HE3  LYS  53          2HE       LYS  53  -3.940   7.610 -13.432
  422    HZ1  LYS  53          1HZ       LYS  53  -5.452   5.812 -13.669
  423    HZ2  LYS  53          2HZ       LYS  53  -5.221   5.305 -12.073
  424    HZ3  LYS  53          3HZ       LYS  53  -3.968   5.152 -13.199
  425    H    MET  54           H        MET  54  -0.103   4.611  -7.559
  426    HA   MET  54           HA       MET  54   1.935   6.671  -7.606
  427    HB2  MET  54          1HB       MET  54   1.197   4.517  -5.641
  428    HB3  MET  54          2HB       MET  54   2.632   5.522  -5.440
  429    HG2  MET  54          1HG       MET  54   1.342   7.472  -5.225
  430    HG3  MET  54          2HG       MET  54  -0.116   6.666  -5.792
  431    HE1  MET  54          1HE       MET  54   1.737   6.405  -1.609
  432    HE2  MET  54          2HE       MET  54   2.287   7.403  -2.953
  433    HE3  MET  54          3HE       MET  54   2.605   5.669  -2.957
  434    H    GLN  55           H        GLN  55   1.646   3.967  -9.270
  435    HA   GLN  55           HA       GLN  55   2.981   2.462 -10.264
  436    HB2  GLN  55          1HB       GLN  55   4.818   4.728  -9.724
  437    HB3  GLN  55          2HB       GLN  55   5.527   3.218 -10.290
  438    HG2  GLN  55          1HG       GLN  55   3.370   4.790 -11.673
  439    HG3  GLN  55          2HG       GLN  55   5.076   4.782 -12.107
  440   HE21  GLN  55          1HE2      GLN  55   2.853   4.064 -13.761
  441   HE22  GLN  55          2HE2      GLN  55   3.070   2.411 -14.222
  442    H    LEU  56           H        LEU  56   2.336   1.658  -7.790
  443    HA   LEU  56           HA       LEU  56   4.849   0.692  -6.660
  444    HB2  LEU  56          1HB       LEU  56   2.599   2.107  -5.415
  445    HB3  LEU  56          2HB       LEU  56   3.168   0.708  -4.492
  446    HG   LEU  56           HG       LEU  56   4.800   3.088  -5.384
  447   HD11  LEU  56          1HD1      LEU  56   4.935   3.594  -2.986
  448   HD12  LEU  56          2HD1      LEU  56   3.852   2.248  -2.649
  449   HD13  LEU  56          3HD1      LEU  56   3.273   3.632  -3.569
  450   HD21  LEU  56          1HD2      LEU  56   6.235   1.181  -5.366
  451   HD22  LEU  56          2HD2      LEU  56   5.557   0.626  -3.836
  452   HD23  LEU  56          3HD2      LEU  56   6.534   2.092  -3.886
  453    H    PHE  57           H        PHE  57   1.827  -0.111  -7.927
  454    HA   PHE  57           HA       PHE  57   2.231  -2.916  -7.213
  455    HB2  PHE  57          1HB       PHE  57   0.591  -2.184  -5.581
  456    HB3  PHE  57          2HB       PHE  57  -0.372  -1.405  -6.827
  457    HD1  PHE  57           HD1      PHE  57   0.698  -4.658  -5.459
  458    HD2  PHE  57           HD2      PHE  57  -1.952  -2.629  -8.105
  459    HE1  PHE  57           HE1      PHE  57  -0.636  -6.711  -5.698
  460    HE2  PHE  57           HE2      PHE  57  -3.284  -4.680  -8.349
  461    HZ   PHE  57           HZ       PHE  57  -2.628  -6.722  -7.144
  462    H    ASP  58           H        ASP  58   1.812  -4.284  -8.827
  463    HA   ASP  58           HA       ASP  58   0.586  -3.219 -11.293
  464    HB2  ASP  58          1HB       ASP  58   2.963  -3.603 -11.635
  465    HB3  ASP  58          2HB       ASP  58   2.838  -5.223 -10.962
  466    H    ASP  59           H        ASP  59  -0.948  -4.486 -12.281
  467    HA   ASP  59           HA       ASP  59  -2.450  -6.168 -10.582
  468    HB2  ASP  59          1HB       ASP  59  -2.651  -5.697 -13.552
  469    HB3  ASP  59          2HB       ASP  59  -3.809  -6.632 -12.633
  470    H    THR  60           H        THR  60   0.142  -6.870 -12.719
  471    HA   THR  60           HA       THR  60  -0.529  -9.713 -12.755
  472    HB   THR  60           HB       THR  60   1.507  -8.091 -14.260
  473    HG1  THR  60           HG1      THR  60  -0.789  -9.592 -15.019
  474   HG21  THR  60          1HG2      THR  60   2.528 -10.231 -13.699
  475   HG22  THR  60          2HG2      THR  60   2.147 -10.154 -15.419
  476   HG23  THR  60          3HG2      THR  60   1.117 -11.083 -14.329
  477    H    GLU  61           H        GLU  61   2.440  -7.777 -12.226
  478    HA   GLU  61           HA       GLU  61   3.768  -9.954 -10.929
  479    HB2  GLU  61          1HB       GLU  61   4.659  -7.090 -10.821
  480    HB3  GLU  61          2HB       GLU  61   5.627  -8.554 -10.795
  481    HG2  GLU  61          1HG       GLU  61   5.048  -9.001 -13.107
  482    HG3  GLU  61          2HG       GLU  61   4.072  -7.536 -13.147
  483    H    GLY  62           H        GLY  62   1.571  -7.628  -9.801
  484    HA2  GLY  62          1HA       GLY  62   0.747  -7.389  -7.638
  485    HA3  GLY  62          2HA       GLY  62   2.031  -8.464  -7.074
  486    HA   PRO  63           HA       PRO  63   3.211  -4.393  -5.298
  487    HB2  PRO  63          1HB       PRO  63   4.892  -6.261  -3.723
  488    HB3  PRO  63          2HB       PRO  63   3.829  -4.959  -3.170
  489    HG2  PRO  63          1HG       PRO  63   3.166  -7.553  -2.892
  490    HG3  PRO  63          2HG       PRO  63   1.955  -6.295  -3.198
  491    HD2  PRO  63          1HD       PRO  63   3.107  -8.328  -5.057
  492    HD3  PRO  63          2HD       PRO  63   1.461  -7.646  -5.002
  493    H    LEU  64           H        LEU  64   4.693  -3.277  -6.368
  494    HA   LEU  64           HA       LEU  64   6.886  -4.610  -7.717
  495    HB2  LEU  64          1HB       LEU  64   6.231  -1.662  -7.618
  496    HB3  LEU  64          2HB       LEU  64   7.353  -2.452  -8.709
  497    HG   LEU  64           HG       LEU  64   4.398  -3.030  -8.670
  498   HD11  LEU  64          1HD1      LEU  64   4.768  -0.735  -9.376
  499   HD12  LEU  64          2HD1      LEU  64   4.310  -1.737 -10.751
  500   HD13  LEU  64          3HD1      LEU  64   5.994  -1.269 -10.526
  501   HD21  LEU  64          1HD2      LEU  64   6.572  -3.750 -10.628
  502   HD22  LEU  64          2HD2      LEU  64   4.862  -4.156 -10.769
  503   HD23  LEU  64          3HD2      LEU  64   5.826  -4.846  -9.464
  504    H    VAL  65           H        VAL  65   8.241  -5.310  -6.231
  505    HA   VAL  65           HA       VAL  65   8.932  -4.228  -3.819
  506    HB   VAL  65           HB       VAL  65  10.603  -5.944  -5.634
  507   HG11  VAL  65          1HG1      VAL  65  10.944  -5.374  -2.691
  508   HG12  VAL  65          2HG1      VAL  65  12.028  -4.862  -3.986
  509   HG13  VAL  65          3HG1      VAL  65  11.846  -6.577  -3.613
  510   HG21  VAL  65          1HG2      VAL  65   8.518  -6.979  -5.075
  511   HG22  VAL  65          2HG2      VAL  65   8.723  -6.569  -3.373
  512   HG23  VAL  65          3HG2      VAL  65   9.794  -7.748  -4.131
  513    H    ASP  66           H        ASP  66  10.558  -3.680  -6.934
  514    HA   ASP  66           HA       ASP  66  12.777  -2.293  -5.931
  515    HB2  ASP  66          1HB       ASP  66  11.410  -2.088  -8.612
  516    HB3  ASP  66          2HB       ASP  66  12.948  -1.322  -8.231
  517    H    ASN  67           H        ASN  67   9.776  -0.946  -7.325
  518    HA   ASN  67           HA       ASN  67  10.380   1.731  -6.707
  519    HB2  ASN  67          1HB       ASN  67   7.775   0.327  -7.246
  520    HB3  ASN  67          2HB       ASN  67   7.868   2.051  -6.923
  521   HD21  ASN  67          1HD2      ASN  67   7.049   2.501  -8.975
  522   HD22  ASN  67          2HD2      ASN  67   8.028   2.354 -10.398
  523    H    LEU  68           H        LEU  68   8.859  -0.838  -4.910
  524    HA   LEU  68           HA       LEU  68   7.796   0.645  -2.788
  525    HB2  LEU  68          1HB       LEU  68   8.640  -2.198  -3.138
  526    HB3  LEU  68          2HB       LEU  68   8.227  -1.613  -1.534
  527    HG   LEU  68           HG       LEU  68   6.358  -1.280  -3.862
  528   HD11  LEU  68          1HD1      LEU  68   6.906  -3.671  -3.596
  529   HD12  LEU  68          2HD1      LEU  68   5.229  -3.304  -3.199
  530   HD13  LEU  68          3HD1      LEU  68   6.403  -3.575  -1.909
  531   HD21  LEU  68          1HD2      LEU  68   5.948  -1.350  -0.879
  532   HD22  LEU  68          2HD2      LEU  68   4.689  -1.118  -2.093
  533   HD23  LEU  68          3HD2      LEU  68   5.954   0.092  -1.893
  534    H    VAL  69           H        VAL  69  10.992  -0.830  -3.197
  535    HA   VAL  69           HA       VAL  69  12.019  -0.004  -0.687
  536    HB   VAL  69           HB       VAL  69  13.493  -0.625  -3.242
  537   HG11  VAL  69          1HG1      VAL  69  14.438  -0.437  -0.390
  538   HG12  VAL  69          2HG1      VAL  69  14.902   0.615  -1.729
  539   HG13  VAL  69          3HG1      VAL  69  15.393  -1.079  -1.727
  540   HG21  VAL  69          1HG2      VAL  69  12.872  -2.381  -0.875
  541   HG22  VAL  69          2HG2      VAL  69  13.794  -2.842  -2.307
  542   HG23  VAL  69          3HG2      VAL  69  12.077  -2.464  -2.449
  543    H    HIS  70           H        HIS  70  12.126   1.429  -3.935
  544    HA   HIS  70           HA       HIS  70  13.739   3.638  -3.349
  545    HB2  HIS  70          1HB       HIS  70  11.630   3.129  -5.407
  546    HB3  HIS  70          2HB       HIS  70  12.283   4.751  -5.225
  547    HD1  HIS  70           HD1      HIS  70  14.496   5.231  -6.284
  548    HD2  HIS  70           HD2      HIS  70  13.608   1.171  -6.213
  549    HE1  HIS  70           HE1      HIS  70  16.233   4.132  -7.729
  550    HE2  HIS  70           HE2      HIS  70  15.772   1.667  -7.535
  551    H    GLN  71           H        GLN  71  10.357   3.086  -2.744
  552    HA   GLN  71           HA       GLN  71   9.855   5.851  -2.015
  553    HB2  GLN  71          1HB       GLN  71   8.180   4.329  -3.182
  554    HB3  GLN  71          2HB       GLN  71   8.012   3.495  -1.640
  555    HG2  GLN  71          1HG       GLN  71   6.230   5.077  -1.873
  556    HG3  GLN  71          2HG       GLN  71   7.318   5.596  -0.587
  557   HE21  GLN  71          1HE2      GLN  71   6.731   7.731  -0.688
  558   HE22  GLN  71          2HE2      GLN  71   7.153   8.755  -2.011
  559    H    LEU  72           H        LEU  72   9.555   2.717  -0.352
  560    HA   LEU  72           HA       LEU  72   9.008   3.873   2.147
  561    HB2  LEU  72          1HB       LEU  72   9.879   1.098   1.393
  562    HB3  LEU  72          2HB       LEU  72   9.493   1.561   3.038
  563    HG   LEU  72           HG       LEU  72   7.578   1.734   0.714
  564   HD11  LEU  72          1HD1      LEU  72   6.477  -0.200   1.758
  565   HD12  LEU  72          2HD1      LEU  72   7.779  -0.291   2.947
  566   HD13  LEU  72          3HD1      LEU  72   8.120  -0.585   1.242
  567   HD21  LEU  72          1HD2      LEU  72   7.228   2.163   3.677
  568   HD22  LEU  72          2HD2      LEU  72   5.894   1.984   2.536
  569   HD23  LEU  72          3HD2      LEU  72   7.002   3.348   2.388
  570    H    ALA  73           H        ALA  73  12.040   2.600   0.799
  571    HA   ALA  73           HA       ALA  73  13.486   2.910   3.244
  572    HB1  ALA  73          1HB       ALA  73  14.556   2.558   0.459
  573    HB2  ALA  73          2HB       ALA  73  14.051   1.249   1.525
  574    HB3  ALA  73          3HB       ALA  73  15.420   2.272   1.972
  575    H    HIS  74           H        HIS  74  12.160   5.317   2.391
  576    HA   HIS  74           HA       HIS  74  14.017   7.168   1.284
  577    HB2  HIS  74          1HB       HIS  74  11.519   7.462   1.271
  578    HB3  HIS  74          2HB       HIS  74  11.592   7.762   3.007
  579    HD1  HIS  74           HD1      HIS  74  12.294  10.069   3.766
  580    HD2  HIS  74           HD2      HIS  74  12.619   9.543  -0.343
  581    HE1  HIS  74           HE1      HIS  74  12.685  12.361   2.821
  582    HE2  HIS  74           HE2      HIS  74  12.705  12.042   0.320
  583    H    GLY  75           H        GLY  75  15.935   6.973   2.446
  584    HA2  GLY  75          1HA       GLY  75  17.376   7.921   4.022
  585    HA3  GLY  75          2HA       GLY  75  15.980   8.429   4.962
  586    H    ARG  76           H        ARG  76  16.333   5.144   3.839
  587    HA   ARG  76           HA       ARG  76  17.333   4.259   6.426
  588    HB2  ARG  76          1HB       ARG  76  14.549   3.921   5.525
  589    HB3  ARG  76          2HB       ARG  76  15.310   2.464   6.152
  590    HG2  ARG  76          1HG       ARG  76  15.922   3.785   8.191
  591    HG3  ARG  76          2HG       ARG  76  14.905   5.087   7.575
  592    HD2  ARG  76          1HD       ARG  76  12.977   3.687   7.638
  593    HD3  ARG  76          2HD       ARG  76  13.943   2.274   8.048
  594    HE   ARG  76           HE       ARG  76  14.133   4.434   9.948
  595   HH11  ARG  76          1HH1      ARG  76  12.383   1.551   9.007
  596   HH12  ARG  76          2HH1      ARG  76  11.716   1.281  10.584
  597   HH21  ARG  76          1HH2      ARG  76  13.249   4.078  12.040
  598   HH22  ARG  76          2HH2      ARG  76  12.204   2.717  12.306
  599    H    ASP  77           H        ASP  77  17.720   1.877   6.441
  600    HA   ASP  77           HA       ASP  77  19.346   1.161   4.282
  601    HB2  ASP  77          1HB       ASP  77  18.188  -0.603   6.446
  602    HB3  ASP  77          2HB       ASP  77  19.538  -1.023   5.397
  603    H    ALA  78           H        ALA  78  18.643   0.807   2.347
  604    HA   ALA  78           HA       ALA  78  16.041   0.125   1.601
  605    HB1  ALA  78          1HB       ALA  78  16.952  -0.109  -0.634
  606    HB2  ALA  78          2HB       ALA  78  18.586  -0.159   0.026
  607    HB3  ALA  78          3HB       ALA  78  17.618   1.308   0.175
  608    H    GLU  79           H        GLU  79  18.894  -1.889   2.058
  609    HA   GLU  79           HA       GLU  79  17.906  -4.207   0.793
  610    HB2  GLU  79          1HB       GLU  79  19.971  -3.891   2.966
  611    HB3  GLU  79          2HB       GLU  79  19.651  -5.403   2.127
  612    HG2  GLU  79          1HG       GLU  79  20.205  -4.246  -0.010
  613    HG3  GLU  79          2HG       GLU  79  20.705  -2.848   0.938
  614    H    GLU  80           H        GLU  80  17.692  -3.053   4.112
  615    HA   GLU  80           HA       GLU  80  16.375  -5.343   5.152
  616    HB2  GLU  80          1HB       GLU  80  16.416  -2.472   6.082
  617    HB3  GLU  80          2HB       GLU  80  15.709  -3.798   6.994
  618    HG2  GLU  80          1HG       GLU  80  18.593  -3.463   6.234
  619    HG3  GLU  80          2HG       GLU  80  17.898  -3.312   7.840
  620    H    VAL  81           H        VAL  81  15.259  -2.218   3.942
  621    HA   VAL  81           HA       VAL  81  12.527  -2.513   4.289
  622    HB   VAL  81           HB       VAL  81  14.047  -1.042   2.145
  623   HG11  VAL  81          1HG1      VAL  81  11.772  -1.391   1.380
  624   HG12  VAL  81          2HG1      VAL  81  12.000   0.293   1.856
  625   HG13  VAL  81          3HG1      VAL  81  11.145  -0.820   2.926
  626   HG21  VAL  81          1HG2      VAL  81  12.913  -0.246   4.805
  627   HG22  VAL  81          2HG2      VAL  81  13.498   0.899   3.598
  628   HG23  VAL  81          3HG2      VAL  81  14.606  -0.269   4.311
  629    H    ARG  82           H        ARG  82  14.494  -3.346   1.434
  630    HA   ARG  82           HA       ARG  82  12.588  -4.413  -0.238
  631    HB2  ARG  82          1HB       ARG  82  15.033  -4.091  -0.699
  632    HB3  ARG  82          2HB       ARG  82  15.341  -5.564   0.209
  633    HG2  ARG  82          1HG       ARG  82  13.827  -6.751  -1.395
  634    HG3  ARG  82          2HG       ARG  82  13.824  -5.274  -2.357
  635    HD2  ARG  82          1HD       ARG  82  16.298  -5.392  -2.443
  636    HD3  ARG  82          2HD       ARG  82  16.214  -6.947  -1.620
  637    HE   ARG  82           HE       ARG  82  14.645  -6.818  -4.033
  638   HH11  ARG  82          1HH1      ARG  82  17.799  -7.493  -2.680
  639   HH12  ARG  82          2HH1      ARG  82  18.301  -8.486  -4.011
  640   HH21  ARG  82          1HH2      ARG  82  15.296  -8.114  -5.784
  641   HH22  ARG  82          2HH2      ARG  82  16.872  -8.838  -5.786
  642    H    THR  83           H        THR  83  14.273  -5.941   2.443
  643    HA   THR  83           HA       THR  83  13.328  -8.565   1.978
  644    HB   THR  83           HB       THR  83  14.577  -7.204   4.354
  645    HG1  THR  83           HG1      THR  83  16.161  -7.544   2.970
  646   HG21  THR  83          1HG2      THR  83  14.873  -9.416   5.364
  647   HG22  THR  83          2HG2      THR  83  13.920 -10.140   4.068
  648   HG23  THR  83          3HG2      THR  83  13.163  -9.015   5.198
  649    H    GLU  84           H        GLU  84  12.435  -6.139   4.454
  650    HA   GLU  84           HA       GLU  84  10.352  -7.526   5.639
  651    HB2  GLU  84          1HB       GLU  84  10.568  -4.538   5.251
  652    HB3  GLU  84          2HB       GLU  84   9.565  -5.358   6.441
  653    HG2  GLU  84          1HG       GLU  84  11.618  -6.321   7.424
  654    HG3  GLU  84          2HG       GLU  84  12.566  -5.341   6.312
  655    H    VAL  85           H        VAL  85  10.280  -5.426   2.776
  656    HA   VAL  85           HA       VAL  85   7.521  -5.476   2.309
  657    HB   VAL  85           HB       VAL  85   9.878  -5.201   0.452
  658   HG11  VAL  85          1HG1      VAL  85   8.289  -4.550  -1.311
  659   HG12  VAL  85          2HG1      VAL  85   6.955  -5.040  -0.264
  660   HG13  VAL  85          3HG1      VAL  85   8.110  -6.242  -0.839
  661   HG21  VAL  85          1HG2      VAL  85   7.767  -3.270   1.400
  662   HG22  VAL  85          2HG2      VAL  85   9.099  -2.891   0.305
  663   HG23  VAL  85          3HG2      VAL  85   9.434  -3.359   1.972
  664    H    LEU  86           H        LEU  86  10.079  -7.618   1.053
  665    HA   LEU  86           HA       LEU  86   8.488  -9.268  -0.513
  666    HB2  LEU  86          1HB       LEU  86  11.078  -9.783   0.932
  667    HB3  LEU  86          2HB       LEU  86  10.335 -10.964  -0.145
  668    HG   LEU  86           HG       LEU  86  11.026  -8.178  -1.041
  669   HD11  LEU  86          1HD1      LEU  86  12.706 -10.663  -1.299
  670   HD12  LEU  86          2HD1      LEU  86  13.043  -9.318  -0.210
  671   HD13  LEU  86          3HD1      LEU  86  13.077  -9.069  -1.958
  672   HD21  LEU  86          1HD2      LEU  86  10.991  -9.279  -3.257
  673   HD22  LEU  86          2HD2      LEU  86   9.431  -9.317  -2.433
  674   HD23  LEU  86          3HD2      LEU  86  10.444 -10.761  -2.473
  675    H    LYS  87           H        LYS  87   9.083  -9.341   2.941
  676    HA   LYS  87           HA       LYS  87   7.971 -11.919   3.414
  677    HB2  LYS  87          1HB       LYS  87   8.419  -9.540   5.214
  678    HB3  LYS  87          2HB       LYS  87   7.715 -11.045   5.788
  679    HG2  LYS  87          1HG       LYS  87   9.727 -12.252   5.164
  680    HG3  LYS  87          2HG       LYS  87  10.439 -10.757   4.532
  681    HD2  LYS  87          1HD       LYS  87  11.278 -11.279   6.772
  682    HD3  LYS  87          2HD       LYS  87  10.356  -9.775   6.767
  683    HE2  LYS  87          1HE       LYS  87   8.407 -10.967   7.645
  684    HE3  LYS  87          2HE       LYS  87   9.320 -12.474   7.636
  685    HZ1  LYS  87          1HZ       LYS  87  10.843 -11.517   9.246
  686    HZ2  LYS  87          2HZ       LYS  87   9.260 -11.485   9.836
  687    HZ3  LYS  87          3HZ       LYS  87   9.971 -10.069   9.248
  688    H    CYS  88           H        CYS  88   6.595  -8.917   2.637
  689    HA   CYS  88           HA       CYS  88   3.975  -9.752   3.662
  690    HB2  CYS  88          1HB       CYS  88   5.182  -7.082   3.088
  691    HB3  CYS  88          2HB       CYS  88   3.419  -7.271   2.994
  692    H    VAL  89           H        VAL  89   5.818  -9.616   0.863
  693    HA   VAL  89           HA       VAL  89   3.709  -9.265  -1.026
  694    HB   VAL  89           HB       VAL  89   6.424 -10.555  -1.335
  695   HG11  VAL  89          1HG1      VAL  89   6.049 -10.209  -3.761
  696   HG12  VAL  89          2HG1      VAL  89   4.388  -9.738  -3.395
  697   HG13  VAL  89          3HG1      VAL  89   4.936 -11.376  -3.045
  698   HG21  VAL  89          1HG2      VAL  89   6.626  -8.225  -0.774
  699   HG22  VAL  89          2HG2      VAL  89   5.427  -7.789  -1.989
  700   HG23  VAL  89          3HG2      VAL  89   6.992  -8.433  -2.487
  701    H    ASP  90           H        ASP  90   2.033 -10.598  -0.779
  702    HA   ASP  90           HA       ASP  90   2.550 -13.443  -0.306
  703    HB2  ASP  90          1HB       ASP  90   1.031 -11.909   1.213
  704    HB3  ASP  90          2HB       ASP  90  -0.170 -12.228  -0.040
  705    H    LYS  91           H        LYS  91   0.760 -14.869  -1.254
  706    HA   LYS  91           HA       LYS  91   0.793 -14.422  -4.127
  707    HB2  LYS  91          1HB       LYS  91  -0.394 -16.796  -2.724
  708    HB3  LYS  91          2HB       LYS  91   0.299 -16.700  -4.337
  709    HG2  LYS  91          1HG       LYS  91   2.509 -16.426  -3.376
  710    HG3  LYS  91          2HG       LYS  91   1.819 -16.515  -1.756
  711    HD2  LYS  91          1HD       LYS  91   1.013 -18.777  -2.227
  712    HD3  LYS  91          2HD       LYS  91   1.714 -18.687  -3.844
  713    HE2  LYS  91          1HE       LYS  91   3.248 -18.507  -1.254
  714    HE3  LYS  91          2HE       LYS  91   3.139 -19.934  -2.280
  715    HZ1  LYS  91          1HZ       LYS  91   5.182 -18.781  -2.709
  716    HZ2  LYS  91          2HZ       LYS  91   4.366 -17.331  -3.007
  717    HZ3  LYS  91          3HZ       LYS  91   4.184 -18.633  -4.066
  718    H    ASN  92           H        ASN  92  -1.047 -14.527  -5.446
  719    HA   ASN  92           HA       ASN  92  -3.402 -13.325  -4.247
  720    HB2  ASN  92          1HB       ASN  92  -2.408 -12.533  -6.423
  721    HB3  ASN  92          2HB       ASN  92  -2.928 -14.051  -7.140
  722   HD21  ASN  92          1HD2      ASN  92  -4.131 -12.728  -8.607
  723   HD22  ASN  92          2HD2      ASN  92  -5.678 -12.101  -8.147
  724    H    THR  93           H        THR  93  -3.593 -15.437  -3.020
  725    HA   THR  93           HA       THR  93  -4.572 -17.741  -4.392
  726    HB   THR  93           HB       THR  93  -5.168 -18.529  -2.084
  727    HG1  THR  93           HG1      THR  93  -5.158 -17.121  -0.499
  728   HG21  THR  93          1HG2      THR  93  -2.372 -17.481  -2.438
  729   HG22  THR  93          2HG2      THR  93  -2.992 -18.991  -3.099
  730   HG23  THR  93          3HG2      THR  93  -2.868 -18.778  -1.355
  731    H    ASP  94           H        ASP  94  -6.060 -14.931  -2.948
  732    HA   ASP  94           HA       ASP  94  -8.684 -16.160  -2.962
  733    HB2  ASP  94          1HB       ASP  94  -9.487 -14.074  -2.004
  734    HB3  ASP  94          2HB       ASP  94  -8.060 -14.638  -1.130
  735    H    ASN  95           H        ASN  95  -6.728 -14.659  -5.158
  736    HA   ASN  95           HA       ASN  95  -6.977 -14.077  -7.310
  737    HB2  ASN  95          1HB       ASN  95  -9.519 -15.617  -6.932
  738    HB3  ASN  95          2HB       ASN  95  -9.045 -14.945  -8.480
  739   HD21  ASN  95          1HD2      ASN  95  -8.430 -17.364  -6.104
  740   HD22  ASN  95          2HD2      ASN  95  -7.300 -18.289  -7.045
  741    H    ASN  96           H        ASN  96  -7.807 -12.155  -5.323
  742    HA   ASN  96           HA       ASN  96  -9.509 -10.553  -7.102
  743    HB2  ASN  96          1HB       ASN  96 -10.898 -11.160  -5.213
  744    HB3  ASN  96          2HB       ASN  96  -9.649 -10.660  -4.073
  745   HD21  ASN  96          1HD2      ASN  96 -12.105  -9.630  -6.294
  746   HD22  ASN  96          2HD2      ASN  96 -12.169  -7.980  -5.774
  747    H    ALA  97           H        ALA  97  -8.308  -8.948  -7.874
  748    HA   ALA  97           HA       ALA  97  -5.693  -8.474  -6.977
  749    HB1  ALA  97          1HB       ALA  97  -7.350  -6.721  -8.775
  750    HB2  ALA  97          2HB       ALA  97  -6.431  -8.134  -9.293
  751    HB3  ALA  97          3HB       ALA  97  -5.593  -6.727  -8.638
  752    H    CYS  98           H        CYS  98  -8.713  -6.797  -6.270
  753    HA   CYS  98           HA       CYS  98  -7.565  -4.525  -5.026
  754    HB2  CYS  98          1HB       CYS  98 -10.202  -5.866  -4.387
  755    HB3  CYS  98          2HB       CYS  98  -9.721  -4.255  -3.876
  756    H    HIS  99           H        HIS  99  -8.449  -7.728  -3.776
  757    HA   HIS  99           HA       HIS  99  -7.771  -7.001  -1.074
  758    HB2  HIS  99          1HB       HIS  99  -9.535  -8.646  -1.484
  759    HB3  HIS  99          2HB       HIS  99  -8.389  -9.700  -2.301
  760    HD1  HIS  99           HD1      HIS  99  -7.163 -11.355  -0.892
  761    HD2  HIS  99           HD2      HIS  99  -9.026  -8.407   1.386
  762    HE1  HIS  99           HE1      HIS  99  -6.850 -12.042   1.511
  763    HE2  HIS  99           HE2      HIS  99  -8.132 -10.336   2.848
  764    H    TRP 100           H        TRP 100  -6.176  -8.413  -3.791
  765    HA   TRP 100           HA       TRP 100  -3.998  -9.590  -2.443
  766    HB2  TRP 100          1HB       TRP 100  -4.561 -10.034  -4.819
  767    HB3  TRP 100          2HB       TRP 100  -4.045  -8.397  -5.231
  768    HD1  TRP 100           HD1      TRP 100  -1.760  -9.914  -2.719
  769    HE1  TRP 100           HE1      TRP 100   0.399 -10.724  -3.854
  770    HE3  TRP 100           HE3      TRP 100  -3.249  -9.598  -7.596
  771    HZ2  TRP 100           HZ2      TRP 100   1.341 -11.183  -6.479
  772    HZ3  TRP 100           HZ3      TRP 100  -1.666 -10.242  -9.356
  773    HH2  TRP 100           HH2      TRP 100   0.579 -11.017  -8.817
  774    H    ALA 101           H        ALA 101  -4.295  -6.433  -4.063
  775    HA   ALA 101           HA       ALA 101  -1.837  -5.367  -3.233
  776    HB1  ALA 101          1HB       ALA 101  -2.809  -3.188  -3.777
  777    HB2  ALA 101          2HB       ALA 101  -4.416  -3.913  -3.829
  778    HB3  ALA 101          3HB       ALA 101  -3.199  -4.384  -5.015
  779    H    PHE 102           H        PHE 102  -4.995  -5.448  -1.738
  780    HA   PHE 102           HA       PHE 102  -4.410  -3.718   0.406
  781    HB2  PHE 102          1HB       PHE 102  -6.683  -4.206  -0.358
  782    HB3  PHE 102          2HB       PHE 102  -6.524  -5.863   0.213
  783    HD1  PHE 102           HD1      PHE 102  -7.203  -6.390   2.384
  784    HD2  PHE 102           HD2      PHE 102  -6.381  -2.337   1.373
  785    HE1  PHE 102           HE1      PHE 102  -8.053  -5.673   4.577
  786    HE2  PHE 102           HE2      PHE 102  -7.223  -1.615   3.568
  787    HZ   PHE 102           HZ       PHE 102  -8.060  -3.283   5.173
  788    H    ARG 103           H        ARG 103  -3.967  -7.138  -0.133
  789    HA   ARG 103           HA       ARG 103  -3.579  -7.896   2.581
  790    HB2  ARG 103          1HB       ARG 103  -4.181  -9.522   0.815
  791    HB3  ARG 103          2HB       ARG 103  -2.623  -9.253   0.054
  792    HG2  ARG 103          1HG       ARG 103  -1.620 -10.705   1.381
  793    HG3  ARG 103          2HG       ARG 103  -2.286  -9.938   2.817
  794    HD2  ARG 103          1HD       ARG 103  -2.889 -12.332   2.568
  795    HD3  ARG 103          2HD       ARG 103  -4.271 -11.257   2.686
  796    HE   ARG 103           HE       ARG 103  -4.395 -11.487   0.180
  797   HH11  ARG 103          1HH1      ARG 103  -2.867 -13.959   2.130
  798   HH12  ARG 103          2HH1      ARG 103  -3.326 -15.257   1.081
  799   HH21  ARG 103          1HH2      ARG 103  -5.051 -13.228  -1.199
  800   HH22  ARG 103          2HH2      ARG 103  -4.545 -14.849  -0.802
  801    H    GLY 104           H        GLY 104  -1.422  -6.925  -0.042
  802    HA2  GLY 104          1HA       GLY 104   1.014  -7.346   1.361
  803    HA3  GLY 104          2HA       GLY 104   0.786  -6.277  -0.029
  804    H    PHE 105           H        PHE 105  -1.028  -4.483   0.941
  805    HA   PHE 105           HA       PHE 105   0.622  -2.701   2.348
  806    HB2  PHE 105          1HB       PHE 105  -0.994  -1.801   0.869
  807    HB3  PHE 105          2HB       PHE 105  -2.301  -2.679   1.645
  808    HD1  PHE 105           HD1      PHE 105  -3.786  -1.191   2.606
  809    HD2  PHE 105           HD2      PHE 105   0.394  -0.433   2.905
  810    HE1  PHE 105           HE1      PHE 105  -4.248   0.793   3.975
  811    HE2  PHE 105           HE2      PHE 105  -0.071   1.560   4.273
  812    HZ   PHE 105           HZ       PHE 105  -2.389   2.171   4.812
  813    H    LYS 106           H        LYS 106  -2.115  -4.690   3.347
  814    HA   LYS 106           HA       LYS 106  -2.365  -3.603   5.933
  815    HB2  LYS 106          1HB       LYS 106  -4.293  -4.617   5.245
  816    HB3  LYS 106          2HB       LYS 106  -3.470  -5.996   4.525
  817    HG2  LYS 106          1HG       LYS 106  -3.104  -6.931   6.737
  818    HG3  LYS 106          2HG       LYS 106  -3.820  -5.492   7.474
  819    HD2  LYS 106          1HD       LYS 106  -5.953  -5.980   6.458
  820    HD3  LYS 106          2HD       LYS 106  -5.262  -7.338   5.572
  821    HE2  LYS 106          1HE       LYS 106  -5.329  -7.165   8.578
  822    HE3  LYS 106          2HE       LYS 106  -6.585  -7.946   7.619
  823    HZ1  LYS 106          1HZ       LYS 106  -4.942  -9.477   6.760
  824    HZ2  LYS 106          2HZ       LYS 106  -4.945  -9.524   8.450
  825    HZ3  LYS 106          3HZ       LYS 106  -3.714  -8.705   7.629
  826    H    CYS 107           H        CYS 107  -0.627  -6.403   4.676
  827    HA   CYS 107           HA       CYS 107   0.233  -7.483   7.102
  828    HB2  CYS 107          1HB       CYS 107   0.491  -8.807   5.165
  829    HB3  CYS 107          2HB       CYS 107   1.375  -7.549   4.310
  830    H    PHE 108           H        PHE 108   1.558  -4.932   5.075
  831    HA   PHE 108           HA       PHE 108   4.081  -4.886   6.411
  832    HB2  PHE 108          1HB       PHE 108   3.593  -4.284   3.987
  833    HB3  PHE 108          2HB       PHE 108   3.010  -2.738   4.604
  834    HD1  PHE 108           HD1      PHE 108   5.925  -4.863   4.041
  835    HD2  PHE 108           HD2      PHE 108   4.564  -1.118   5.535
  836    HE1  PHE 108           HE1      PHE 108   8.234  -4.027   4.038
  837    HE2  PHE 108           HE2      PHE 108   6.873  -0.276   5.530
  838    HZ   PHE 108           HZ       PHE 108   8.711  -1.732   4.776
  839    H    GLN 109           H        GLN 109   1.245  -2.696   6.383
  840    HA   GLN 109           HA       GLN 109   2.418  -0.799   8.129
  841    HB2  GLN 109          1HB       GLN 109   0.168   0.113   8.370
  842    HB3  GLN 109          2HB       GLN 109   0.561  -0.199   6.683
  843    HG2  GLN 109          1HG       GLN 109  -0.953  -1.881   6.493
  844    HG3  GLN 109          2HG       GLN 109  -0.882  -2.300   8.208
  845   HE21  GLN 109          1HE2      GLN 109  -3.104  -2.286   8.445
  846   HE22  GLN 109          2HE2      GLN 109  -4.039  -0.829   8.420
  847    H    LYS 110           H        LYS 110   1.003  -3.861   8.669
  848    HA   LYS 110           HA       LYS 110  -0.025  -3.545  11.260
  849    HB2  LYS 110          1HB       LYS 110  -0.417  -5.507   9.788
  850    HB3  LYS 110          2HB       LYS 110   1.253  -5.985  10.024
  851    HG2  LYS 110          1HG       LYS 110   0.856  -6.242  12.406
  852    HG3  LYS 110          2HG       LYS 110  -0.832  -5.800  12.172
  853    HD2  LYS 110          1HD       LYS 110  -0.992  -7.743  10.574
  854    HD3  LYS 110          2HD       LYS 110   0.611  -8.226  11.124
  855    HE2  LYS 110          1HE       LYS 110  -1.094  -9.452  12.338
  856    HE3  LYS 110          2HE       LYS 110  -0.238  -8.362  13.427
  857    HZ1  LYS 110          1HZ       LYS 110  -2.564  -8.226  13.865
  858    HZ2  LYS 110          2HZ       LYS 110  -2.927  -7.939  12.242
  859    HZ3  LYS 110          3HZ       LYS 110  -2.094  -6.776  13.141
  860    H    ASN 111           H        ASN 111   3.219  -4.011  10.045
  861    HA   ASN 111           HA       ASN 111   4.220  -4.167  12.815
  862    HB2  ASN 111          1HB       ASN 111   5.515  -5.231  10.298
  863    HB3  ASN 111          2HB       ASN 111   6.187  -5.321  11.923
  864   HD21  ASN 111          1HD2      ASN 111   3.797  -6.569   9.737
  865   HD22  ASN 111          2HD2      ASN 111   3.358  -7.938  10.693
  866    H    ASN 112           H        ASN 112   4.406  -2.520   9.766
  867    HA   ASN 112           HA       ASN 112   6.532  -0.800  10.841
  868    HB2  ASN 112          1HB       ASN 112   6.458  -2.121   8.126
  869    HB3  ASN 112          2HB       ASN 112   7.515  -0.761   8.523
  870   HD21  ASN 112          1HD2      ASN 112   7.892  -3.710   7.859
  871   HD22  ASN 112          2HD2      ASN 112   9.035  -4.230   9.050
  872    H    LEU 113           H        LEU 113   4.319   0.344  11.185
  873    HA   LEU 113           HA       LEU 113   3.292   1.609   8.798
  874    HB2  LEU 113          1HB       LEU 113   1.709   1.031  10.507
  875    HB3  LEU 113          2HB       LEU 113   2.587   1.954  11.707
  876    HG   LEU 113           HG       LEU 113   2.020   4.023  10.420
  877   HD11  LEU 113          1HD1      LEU 113   0.314   3.917   8.711
  878   HD12  LEU 113          2HD1      LEU 113   0.229   2.164   8.871
  879   HD13  LEU 113          3HD1      LEU 113   1.693   2.921   8.244
  880   HD21  LEU 113          1HD2      LEU 113  -0.322   4.078  11.136
  881   HD22  LEU 113          2HD2      LEU 113   0.711   3.334  12.358
  882   HD23  LEU 113          3HD2      LEU 113  -0.300   2.325  11.325
  883    H    SER 114           H        SER 114   5.543   2.273  11.319
  884    HA   SER 114           HA       SER 114   5.669   5.083  11.137
  885    HB2  SER 114          1HB       SER 114   7.911   3.177  11.858
  886    HB3  SER 114          2HB       SER 114   7.810   4.886  12.273
  887    HG   SER 114           HG       SER 114   5.911   4.380  13.487
  888    H    LEU 115           H        LEU 115   7.316   2.512   9.352
  889    HA   LEU 115           HA       LEU 115   9.068   4.183   7.904
  890    HB2  LEU 115          1HB       LEU 115   9.332   1.741   8.132
  891    HB3  LEU 115          2HB       LEU 115   7.925   1.510   7.113
  892    HG   LEU 115           HG       LEU 115   9.135   2.638   5.256
  893   HD11  LEU 115          1HD1      LEU 115  10.661   3.983   6.553
  894   HD12  LEU 115          2HD1      LEU 115  11.569   2.909   5.487
  895   HD13  LEU 115          3HD1      LEU 115  11.418   2.530   7.203
  896   HD21  LEU 115          1HD2      LEU 115  10.547   0.256   6.450
  897   HD22  LEU 115          2HD2      LEU 115  10.632   0.778   4.767
  898   HD23  LEU 115          3HD2      LEU 115   9.106   0.203   5.436
  899    H    ILE 116           H        ILE 116   5.771   3.126   7.388
  900    HA   ILE 116           HA       ILE 116   5.527   3.991   4.707
  901    HB   ILE 116           HB       ILE 116   3.365   3.638   6.798
  902   HG12  ILE 116          1HG1      ILE 116   4.446   1.723   4.713
  903   HG13  ILE 116          2HG1      ILE 116   4.659   1.590   6.466
  904   HG21  ILE 116          1HG2      ILE 116   1.858   3.369   4.872
  905   HG22  ILE 116          2HG2      ILE 116   3.189   3.780   3.792
  906   HG23  ILE 116          3HG2      ILE 116   2.580   4.978   4.935
  907   HD11  ILE 116          1HD1      ILE 116   2.171   1.411   6.649
  908   HD12  ILE 116          2HD1      ILE 116   2.961   0.069   5.821
  909   HD13  ILE 116          3HD1      ILE 116   2.119   1.305   4.889
  910    H    LYS 117           H        LYS 117   4.848   5.482   7.818
  911    HA   LYS 117           HA       LYS 117   3.729   7.882   6.892
  912    HB2  LYS 117          1HB       LYS 117   5.188   7.144   9.418
  913    HB3  LYS 117          2HB       LYS 117   4.548   8.760   9.152
  914    HG2  LYS 117          1HG       LYS 117   2.305   7.897   8.996
  915    HG3  LYS 117          2HG       LYS 117   2.889   6.237   9.091
  916    HD2  LYS 117          1HD       LYS 117   3.586   6.522  11.345
  917    HD3  LYS 117          2HD       LYS 117   3.363   8.268  11.267
  918    HE2  LYS 117          1HE       LYS 117   1.134   6.259  10.992
  919    HE3  LYS 117          2HE       LYS 117   1.572   7.042  12.510
  920    HZ1  LYS 117          1HZ       LYS 117   0.697   8.456  10.048
  921    HZ2  LYS 117          2HZ       LYS 117   1.069   9.179  11.530
  922    HZ3  LYS 117          3HZ       LYS 117  -0.270   8.158  11.402
  923    H    ALA 118           H        ALA 118   7.062   7.006   7.709
  924    HA   ALA 118           HA       ALA 118   8.171   9.571   7.166
  925    HB1  ALA 118          1HB       ALA 118  10.302   8.462   7.398
  926    HB2  ALA 118          2HB       ALA 118   9.522   6.886   7.255
  927    HB3  ALA 118          3HB       ALA 118   9.195   7.909   8.652
  928    H    SER 119           H        SER 119   7.533   6.743   5.255
  929    HA   SER 119           HA       SER 119   9.215   7.105   3.094
  930    HB2  SER 119          1HB       SER 119   7.875   5.090   3.428
  931    HB3  SER 119          2HB       SER 119   6.397   5.997   3.118
  932    HG   SER 119           HG       SER 119   8.510   5.788   1.244
  933    H    ILE 120           H        ILE 120   6.012   8.524   3.659
  934    HA   ILE 120           HA       ILE 120   6.148   9.917   1.100
  935    HB   ILE 120           HB       ILE 120   3.850  10.697   1.651
  936   HG12  ILE 120          1HG1      ILE 120   4.049   8.819   4.011
  937   HG13  ILE 120          2HG1      ILE 120   4.172  10.573   4.143
  938   HG21  ILE 120          1HG2      ILE 120   2.784   8.514   1.371
  939   HG22  ILE 120          2HG2      ILE 120   4.297   7.725   1.817
  940   HG23  ILE 120          3HG2      ILE 120   4.205   8.683   0.340
  941   HD11  ILE 120          1HD1      ILE 120   1.800   9.016   3.150
  942   HD12  ILE 120          2HD1      ILE 120   1.917  10.774   3.191
  943   HD13  ILE 120          3HD1      ILE 120   1.943   9.854   4.694
  944    H    LYS 121           H        LYS 121   7.408  10.466   4.024
  945    HA   LYS 121           HA       LYS 121   6.733  13.288   4.259
  946    HB2  LYS 121          1HB       LYS 121   6.889  11.860   6.263
  947    HB3  LYS 121          2HB       LYS 121   8.568  11.516   5.887
  948    HG2  LYS 121          1HG       LYS 121   8.457  13.154   7.643
  949    HG3  LYS 121          2HG       LYS 121   9.091  13.912   6.181
  950    HD2  LYS 121          1HD       LYS 121   6.998  14.969   5.735
  951    HD3  LYS 121          2HD       LYS 121   6.200  14.052   7.015
  952    HE2  LYS 121          1HE       LYS 121   6.712  16.387   7.661
  953    HE3  LYS 121          2HE       LYS 121   7.484  15.192   8.702
  954    HZ1  LYS 121          1HZ       LYS 121   8.815  16.620   6.465
  955    HZ2  LYS 121          2HZ       LYS 121   9.547  15.522   7.521
  956    HZ3  LYS 121          3HZ       LYS 121   8.983  17.005   8.101
  957    H    LYS 122           H        LYS 122   7.806  14.729   3.099
  958    HA   LYS 122           HA       LYS 122   9.469  15.938   2.120
  959    HB2  LYS 122          1HB       LYS 122  10.690  14.907   4.363
  960    HB3  LYS 122          2HB       LYS 122  11.735  14.375   3.068
  961    HG2  LYS 122          1HG       LYS 122  12.480  16.499   3.997
  962    HG3  LYS 122          2HG       LYS 122  12.052  16.628   2.293
  963    HD2  LYS 122          1HD       LYS 122   9.830  17.523   2.992
  964    HD3  LYS 122          2HD       LYS 122  10.409  17.524   4.656
  965    HE2  LYS 122          1HE       LYS 122  12.129  19.100   4.119
  966    HE3  LYS 122          2HE       LYS 122  11.765  18.986   2.399
  967    HZ1  LYS 122          1HZ       LYS 122   9.953  20.072   4.483
  968    HZ2  LYS 122          2HZ       LYS 122   9.592  19.952   2.838
  969    HZ3  LYS 122          3HZ       LYS 122  10.826  20.983   3.359
  970    H    ASP 123           H        ASP 123  10.458  15.996   0.229
  971    HA   ASP 123           HA       ASP 123  10.711  13.502  -1.247
  972    HB2  ASP 123          1HB       ASP 123   9.630  15.410  -2.347
  973    HB3  ASP 123          2HB       ASP 123  11.093  16.365  -2.148
  974    H21  ACD 201           H21      ACD   1  -4.588   4.646   1.178
  975    H22  ACD 201           H22      ACD   1  -3.546   4.713   2.605
  976    H31  ACD 201           H31      ACD   1  -2.074   6.348   1.387
  977    H32  ACD 201           H32      ACD   1  -3.072   6.139  -0.050
  978    H41  ACD 201           H41      ACD   1  -2.545   3.670  -0.004
  979    H42  ACD 201           H42      ACD   1  -1.116   4.691  -0.241
  980    H5   ACD 201           H5       ACD   1  -1.761   3.026   2.237
  981    H6   ACD 201           H6       ACD   1   0.385   3.812   2.956
  982    H71  ACD 201           H71      ACD   1   0.793   5.087   0.337
  983    H72  ACD 201           H72      ACD   1  -0.126   6.234   1.313
  984    H8   ACD 201           H8       ACD   1   1.788   6.553   2.837
  985    H9   ACD 201           H9       ACD   1   3.874   5.559   2.243
  986   H101  ACD 201          H101      ACD   1   2.764   4.726  -0.324
  987   H102  ACD 201          H102      ACD   1   2.308   3.456   0.813
  988    H11  ACD 201           H11      ACD   1   5.268   4.310   0.659
  989    H12  ACD 201           H12      ACD   1   5.568   1.985   0.292
  990   H131  ACD 201          H131      ACD   1   2.599   2.063  -0.409
  991   H132  ACD 201          H132      ACD   1   3.677   0.667  -0.525
  992    H14  ACD 201           H14      ACD   1   2.558   1.710   2.176
  993    H15  ACD 201           H15      ACD   1   2.433  -0.628   2.599
  994   H161  ACD 201          H161      ACD   1   2.631  -1.302  -0.207
  995   H162  ACD 201          H162      ACD   1   4.293  -0.923   0.259
  996   H171  ACD 201          H171      ACD   1   4.291  -2.614   1.981
  997   H172  ACD 201          H172      ACD   1   2.554  -2.876   1.808
  998   H181  ACD 201          H181      ACD   1   4.600  -3.410  -0.388
  999   H182  ACD 201          H182      ACD   1   2.873  -3.778  -0.456
 1000   H191  ACD 201          H191      ACD   1   4.904  -4.987   1.472
 1001   H192  ACD 201          H192      ACD   1   3.167  -5.289   1.548
 1002   H201  ACD 201          H201      ACD   1   3.255  -6.224  -0.737
 1003   H202  ACD 201          H202      ACD   1   4.318  -7.076   0.329
 1004   H203  ACD 201          H203      ACD   1   4.960  -5.935  -0.803
  Start of MODEL   22
    1    H1   MET   1          1H        MET   1  12.596  14.306 -16.827
    2    H2   MET   1          2H        MET   1  11.240  13.336 -16.560
    3    H3   MET   1          3H        MET   1  11.972  13.363 -18.082
    4    HA   MET   1           HA       MET   1  12.543  11.351 -16.924
    5    HB2  MET   1          1HB       MET   1  14.812  13.329 -17.196
    6    HB3  MET   1          2HB       MET   1  15.031  11.598 -16.989
    7    HG2  MET   1          1HG       MET   1  13.629  12.942 -19.288
    8    HG3  MET   1          2HG       MET   1  15.254  12.259 -19.316
    9    HE1  MET   1          1HE       MET   1  15.779   9.700 -19.050
   10    HE2  MET   1          2HE       MET   1  14.557   8.440 -18.890
   11    HE3  MET   1          3HE       MET   1  14.830   9.575 -17.569
   12    H    GLU   2           H        GLU   2  12.181  13.949 -14.925
   13    HA   GLU   2           HA       GLU   2  13.933  13.053 -12.806
   14    HB2  GLU   2          1HB       GLU   2  13.636  15.434 -13.121
   15    HB3  GLU   2          2HB       GLU   2  11.901  15.274 -12.909
   16    HG2  GLU   2          1HG       GLU   2  12.180  14.668 -10.610
   17    HG3  GLU   2          2HG       GLU   2  13.933  14.639 -10.791
   18    H    PHE   3           H        PHE   3  13.381  11.301 -11.762
   19    HA   PHE   3           HA       PHE   3  10.705  10.437 -11.362
   20    HB2  PHE   3          1HB       PHE   3  12.567   8.848 -11.387
   21    HB3  PHE   3          2HB       PHE   3  13.248   9.604  -9.942
   22    HD1  PHE   3           HD1      PHE   3  12.262   9.229  -7.769
   23    HD2  PHE   3           HD2      PHE   3  10.633   7.424 -11.258
   24    HE1  PHE   3           HE1      PHE   3  10.965   7.689  -6.357
   25    HE2  PHE   3           HE2      PHE   3   9.330   5.877  -9.852
   26    HZ   PHE   3           HZ       PHE   3   9.494   6.010  -7.399
   27    H    THR   4           H        THR   4   9.327  11.476 -10.136
   28    HA   THR   4           HA       THR   4  10.303  12.884  -7.750
   29    HB   THR   4           HB       THR   4   7.491  13.269  -8.430
   30    HG1  THR   4           HG1      THR   4   9.466  13.513 -10.390
   31   HG21  THR   4          1HG2      THR   4   8.728  14.630  -6.832
   32   HG22  THR   4          2HG2      THR   4   8.126  15.610  -8.167
   33   HG23  THR   4          3HG2      THR   4   9.827  15.145  -8.110
   34    H    VAL   5           H        VAL   5  10.084  11.913  -5.898
   35    HA   VAL   5           HA       VAL   5   8.512   9.536  -5.566
   36    HB   VAL   5           HB       VAL   5   9.478   9.286  -3.507
   37   HG11  VAL   5          1HG1      VAL   5  11.397  11.282  -4.652
   38   HG12  VAL   5          2HG1      VAL   5  11.256   9.600  -5.158
   39   HG13  VAL   5          3HG1      VAL   5  11.749   9.986  -3.510
   40   HG21  VAL   5          1HG2      VAL   5  10.121  11.094  -1.973
   41   HG22  VAL   5          2HG2      VAL   5   8.418  11.188  -2.418
   42   HG23  VAL   5          3HG2      VAL   5   9.585  12.284  -3.159
   43    H    SER   6           H        SER   6   6.630   9.246  -4.469
   44    HA   SER   6           HA       SER   6   4.827  11.456  -4.609
   45    HB2  SER   6          1HB       SER   6   3.222   9.658  -3.670
   46    HB3  SER   6          2HB       SER   6   3.902   9.414  -5.280
   47    HG   SER   6           HG       SER   6   4.012   7.736  -3.330
   48    H    THR   7           H        THR   7   5.126  12.988  -3.078
   49    HA   THR   7           HA       THR   7   5.661  12.342  -0.332
   50    HB   THR   7           HB       THR   7   5.436  14.735   0.096
   51    HG1  THR   7           HG1      THR   7   4.629  14.911  -2.648
   52   HG21  THR   7          1HG2      THR   7   6.931  14.253  -2.482
   53   HG22  THR   7          2HG2      THR   7   7.541  13.872  -0.874
   54   HG23  THR   7          3HG2      THR   7   7.224  15.548  -1.323
   55    H    THR   8           H        THR   8   4.152  13.611   1.320
   56    HA   THR   8           HA       THR   8   1.733  12.297   1.526
   57    HB   THR   8           HB       THR   8   2.216  15.045   2.667
   58    HG1  THR   8           HG1      THR   8   3.056  12.670   3.962
   59   HG21  THR   8          1HG2      THR   8   0.960  14.110   4.579
   60   HG22  THR   8          2HG2      THR   8   0.747  12.608   3.676
   61   HG23  THR   8          3HG2      THR   8   0.022  14.102   3.087
   62    H    GLU   9           H        GLU   9   2.447  15.459   0.117
   63    HA   GLU   9           HA       GLU   9  -0.225  16.226  -0.337
   64    HB2  GLU   9          1HB       GLU   9   2.290  17.116  -1.743
   65    HB3  GLU   9          2HB       GLU   9   0.728  17.914  -1.851
   66    HG2  GLU   9          1HG       GLU   9   0.811  18.269   0.602
   67    HG3  GLU   9          2HG       GLU   9   2.451  17.624   0.590
   68    H    ASP  10           H        ASP  10   2.182  14.640  -2.406
   69    HA   ASP  10           HA       ASP  10   0.584  14.520  -4.735
   70    HB2  ASP  10          1HB       ASP  10   2.750  12.575  -3.897
   71    HB3  ASP  10          2HB       ASP  10   2.073  12.758  -5.513
   72    H    LEU  11           H        LEU  11   1.017  12.366  -1.997
   73    HA   LEU  11           HA       LEU  11  -0.437  10.205  -2.950
   74    HB2  LEU  11          1HB       LEU  11   0.962   9.979  -1.027
   75    HB3  LEU  11          2HB       LEU  11   0.004  11.156  -0.120
   76    HG   LEU  11           HG       LEU  11  -1.907   9.558  -0.236
   77   HD11  LEU  11          1HD1      LEU  11  -1.143   8.348  -2.240
   78   HD12  LEU  11          2HD1      LEU  11  -1.521   7.275  -0.895
   79   HD13  LEU  11          3HD1      LEU  11   0.161   7.638  -1.288
   80   HD21  LEU  11          1HD2      LEU  11  -1.129   8.195   1.544
   81   HD22  LEU  11          2HD2      LEU  11  -0.286   9.736   1.681
   82   HD23  LEU  11          3HD2      LEU  11   0.542   8.332   1.007
   83    H    GLN  12           H        GLN  12  -1.518  13.058  -1.136
   84    HA   GLN  12           HA       GLN  12  -4.165  12.171  -0.713
   85    HB2  GLN  12          1HB       GLN  12  -3.016  14.960  -0.832
   86    HB3  GLN  12          2HB       GLN  12  -4.664  14.603  -0.343
   87    HG2  GLN  12          1HG       GLN  12  -3.775  13.231   1.510
   88    HG3  GLN  12          2HG       GLN  12  -2.146  13.725   1.047
   89   HE21  GLN  12          1HE2      GLN  12  -3.630  14.159   3.523
   90   HE22  GLN  12          2HE2      GLN  12  -3.660  15.873   3.762
   91    H    ARG  13           H        ARG  13  -2.602  13.755  -3.377
   92    HA   ARG  13           HA       ARG  13  -4.885  14.567  -4.812
   93    HB2  ARG  13          1HB       ARG  13  -2.645  15.395  -5.320
   94    HB3  ARG  13          2HB       ARG  13  -2.138  13.782  -5.796
   95    HG2  ARG  13          1HG       ARG  13  -3.617  13.812  -7.690
   96    HG3  ARG  13          2HG       ARG  13  -4.303  15.361  -7.165
   97    HD2  ARG  13          1HD       ARG  13  -2.683  15.656  -8.973
   98    HD3  ARG  13          2HD       ARG  13  -2.150  16.437  -7.487
   99    HE   ARG  13           HE       ARG  13  -1.091  13.885  -8.520
  100   HH11  ARG  13          1HH1      ARG  13  -0.701  16.845  -6.680
  101   HH12  ARG  13          2HH1      ARG  13   0.983  16.577  -6.372
  102   HH21  ARG  13          1HH2      ARG  13   1.142  13.533  -8.099
  103   HH22  ARG  13          2HH2      ARG  13   2.027  14.697  -7.153
  104    H    TYR  14           H        TYR  14  -2.910  11.615  -4.975
  105    HA   TYR  14           HA       TYR  14  -4.382  10.429  -7.074
  106    HB2  TYR  14          1HB       TYR  14  -2.726   8.981  -4.999
  107    HB3  TYR  14          2HB       TYR  14  -3.166   8.400  -6.601
  108    HD1  TYR  14           HD1      TYR  14  -0.400   9.234  -4.982
  109    HD2  TYR  14           HD2      TYR  14  -2.597  10.637  -8.343
  110    HE1  TYR  14           HE1      TYR  14   1.652  10.220  -5.908
  111    HE2  TYR  14           HE2      TYR  14  -0.548  11.614  -9.279
  112    HH   TYR  14           HH       TYR  14   2.528  10.879  -8.165
  113    H    ARG  15           H        ARG  15  -4.706  10.297  -3.568
  114    HA   ARG  15           HA       ARG  15  -6.554   8.160  -3.484
  115    HB2  ARG  15          1HB       ARG  15  -6.646  10.379  -1.472
  116    HB3  ARG  15          2HB       ARG  15  -6.939   8.671  -1.246
  117    HG2  ARG  15          1HG       ARG  15  -4.506   8.266  -1.630
  118    HG3  ARG  15          2HG       ARG  15  -4.281  10.019  -1.627
  119    HD2  ARG  15          1HD       ARG  15  -5.335   8.310   0.625
  120    HD3  ARG  15          2HD       ARG  15  -3.795   9.163   0.575
  121    HE   ARG  15           HE       ARG  15  -5.695  11.114   0.273
  122   HH11  ARG  15          1HH1      ARG  15  -5.129   8.571   2.614
  123   HH12  ARG  15          2HH1      ARG  15  -5.680   9.517   3.965
  124   HH21  ARG  15          1HH2      ARG  15  -6.469  12.354   2.033
  125   HH22  ARG  15          2HH2      ARG  15  -6.452  11.672   3.626
  126    H    THR  16           H        THR  16  -6.929  11.601  -3.997
  127    HA   THR  16           HA       THR  16  -9.715  11.719  -3.593
  128    HB   THR  16           HB       THR  16  -7.945  13.468  -5.309
  129    HG1  THR  16           HG1      THR  16  -7.274  13.516  -3.154
  130   HG21  THR  16          1HG2      THR  16  -9.694  15.168  -5.019
  131   HG22  THR  16          2HG2      THR  16 -10.692  13.990  -4.164
  132   HG23  THR  16          3HG2      THR  16 -10.306  13.748  -5.869
  133    H    GLU  17           H        GLU  17  -7.741  11.278  -6.514
  134    HA   GLU  17           HA       GLU  17  -9.873  11.096  -8.328
  135    HB2  GLU  17          1HB       GLU  17  -7.014  10.506  -8.361
  136    HB3  GLU  17          2HB       GLU  17  -7.938   9.443  -9.396
  137    HG2  GLU  17          1HG       GLU  17  -7.179  11.317 -10.681
  138    HG3  GLU  17          2HG       GLU  17  -8.929  11.422 -10.494
  139    H    CYS  18           H        CYS  18  -8.167   8.577  -6.499
  140    HA   CYS  18           HA       CYS  18  -9.625   6.396  -7.526
  141    HB2  CYS  18          1HB       CYS  18  -8.179   6.711  -4.889
  142    HB3  CYS  18          2HB       CYS  18  -8.844   5.186  -5.492
  143    H    VAL  19           H        VAL  19 -10.253   8.633  -4.909
  144    HA   VAL  19           HA       VAL  19 -12.368   7.231  -3.713
  145    HB   VAL  19           HB       VAL  19 -11.486  10.086  -3.646
  146   HG11  VAL  19          1HG1      VAL  19 -13.312  10.651  -2.140
  147   HG12  VAL  19          2HG1      VAL  19 -14.025   9.057  -2.386
  148   HG13  VAL  19          3HG1      VAL  19 -13.928  10.196  -3.732
  149   HG21  VAL  19          1HG2      VAL  19 -11.879   7.945  -1.559
  150   HG22  VAL  19          2HG2      VAL  19 -11.298   9.581  -1.241
  151   HG23  VAL  19          3HG2      VAL  19 -10.343   8.485  -2.238
  152    H    SER  20           H        SER  20 -12.349   9.870  -6.072
  153    HA   SER  20           HA       SER  20 -15.133   9.958  -6.436
  154    HB2  SER  20          1HB       SER  20 -13.545  11.756  -7.070
  155    HB3  SER  20          2HB       SER  20 -12.965  10.746  -8.392
  156    HG   SER  20           HG       SER  20 -15.598  11.753  -8.045
  157    H    SER  21           H        SER  21 -12.614   8.090  -8.078
  158    HA   SER  21           HA       SER  21 -14.276   7.233 -10.229
  159    HB2  SER  21          1HB       SER  21 -11.686   6.082  -9.173
  160    HB3  SER  21          2HB       SER  21 -12.413   5.703 -10.735
  161    HG   SER  21           HG       SER  21 -11.490   8.252  -9.860
  162    H    LEU  22           H        LEU  22 -13.236   5.715  -7.177
  163    HA   LEU  22           HA       LEU  22 -14.732   3.316  -7.832
  164    HB2  LEU  22          1HB       LEU  22 -12.959   4.055  -5.509
  165    HB3  LEU  22          2HB       LEU  22 -13.786   2.500  -5.646
  166    HG   LEU  22           HG       LEU  22 -11.854   3.524  -7.718
  167   HD11  LEU  22          1HD1      LEU  22 -11.353   1.669  -5.396
  168   HD12  LEU  22          2HD1      LEU  22 -10.685   3.289  -5.595
  169   HD13  LEU  22          3HD1      LEU  22 -10.217   1.999  -6.704
  170   HD21  LEU  22          1HD2      LEU  22 -12.915   0.766  -7.137
  171   HD22  LEU  22          2HD2      LEU  22 -11.822   1.222  -8.447
  172   HD23  LEU  22          3HD2      LEU  22 -13.480   1.823  -8.430
  173    H    ASN  23           H        ASN  23 -15.779   6.132  -6.889
  174    HA   ASN  23           HA       ASN  23 -17.496   6.987  -5.658
  175    HB2  ASN  23          1HB       ASN  23 -18.445   4.163  -6.060
  176    HB3  ASN  23          2HB       ASN  23 -19.428   5.393  -5.293
  177   HD21  ASN  23          1HD2      ASN  23 -20.204   7.111  -6.505
  178   HD22  ASN  23          2HD2      ASN  23 -20.231   7.068  -8.239
  179    H    ILE  24           H        ILE  24 -15.286   6.250  -4.111
  180    HA   ILE  24           HA       ILE  24 -15.968   4.775  -1.807
  181    HB   ILE  24           HB       ILE  24 -13.924   6.987  -1.991
  182   HG12  ILE  24          1HG1      ILE  24 -13.600   5.348  -3.820
  183   HG13  ILE  24          2HG1      ILE  24 -12.300   5.273  -2.634
  184   HG21  ILE  24          1HG2      ILE  24 -12.786   5.696  -0.228
  185   HG22  ILE  24          2HG2      ILE  24 -14.153   4.580  -0.189
  186   HG23  ILE  24          3HG2      ILE  24 -14.376   6.269   0.269
  187   HD11  ILE  24          1HD1      ILE  24 -14.622   3.369  -2.834
  188   HD12  ILE  24          2HD1      ILE  24 -13.305   3.276  -1.663
  189   HD13  ILE  24          3HD1      ILE  24 -12.974   3.062  -3.383
  190    HA   PRO  25           HA       PRO  25 -18.809   7.769  -0.024
  191    HB2  PRO  25          1HB       PRO  25 -18.554   6.024   2.331
  192    HB3  PRO  25          2HB       PRO  25 -19.991   6.472   1.410
  193    HG2  PRO  25          1HG       PRO  25 -18.932   4.014   1.294
  194    HG3  PRO  25          2HG       PRO  25 -19.722   4.777  -0.098
  195    HD2  PRO  25          1HD       PRO  25 -16.807   4.413   0.467
  196    HD3  PRO  25          2HD       PRO  25 -17.685   4.331  -1.081
  197    H    ALA  26           H        ALA  26 -18.692   9.397   1.416
  198    HA   ALA  26           HA       ALA  26 -16.223  10.447   2.117
  199    HB1  ALA  26          1HB       ALA  26 -18.283  11.755   1.878
  200    HB2  ALA  26          2HB       ALA  26 -17.465  12.090   3.404
  201    HB3  ALA  26          3HB       ALA  26 -18.893  11.053   3.376
  202    H    ASP  27           H        ASP  27 -18.306   8.302   3.907
  203    HA   ASP  27           HA       ASP  27 -17.249   8.483   6.467
  204    HB2  ASP  27          1HB       ASP  27 -19.171   7.093   5.961
  205    HB3  ASP  27          2HB       ASP  27 -18.180   6.022   4.979
  206    H    TYR  28           H        TYR  28 -16.235   6.229   3.897
  207    HA   TYR  28           HA       TYR  28 -14.020   5.243   5.271
  208    HB2  TYR  28          1HB       TYR  28 -14.841   5.231   2.392
  209    HB3  TYR  28          2HB       TYR  28 -13.294   4.540   2.886
  210    HD1  TYR  28           HD1      TYR  28 -16.957   4.288   3.250
  211    HD2  TYR  28           HD2      TYR  28 -13.206   2.436   4.035
  212    HE1  TYR  28           HE1      TYR  28 -18.116   2.222   3.900
  213    HE2  TYR  28           HE2      TYR  28 -14.359   0.367   4.684
  214    HH   TYR  28           HH       TYR  28 -16.545  -0.339   5.500
  215    H    VAL  29           H        VAL  29 -14.324   7.909   2.959
  216    HA   VAL  29           HA       VAL  29 -11.614   8.490   2.612
  217    HB   VAL  29           HB       VAL  29 -13.867  10.486   2.702
  218   HG11  VAL  29          1HG1      VAL  29 -12.424  11.757   1.151
  219   HG12  VAL  29          2HG1      VAL  29 -11.157  10.551   1.390
  220   HG13  VAL  29          3HG1      VAL  29 -11.699  11.543   2.743
  221   HG21  VAL  29          1HG2      VAL  29 -14.479   8.763   1.179
  222   HG22  VAL  29          2HG2      VAL  29 -12.863   8.739   0.474
  223   HG23  VAL  29          3HG2      VAL  29 -13.911  10.137   0.231
  224    H    GLU  30           H        GLU  30 -13.914   9.560   5.072
  225    HA   GLU  30           HA       GLU  30 -12.177  11.312   6.437
  226    HB2  GLU  30          1HB       GLU  30 -14.208  11.795   7.206
  227    HB3  GLU  30          2HB       GLU  30 -14.847  10.221   6.756
  228    HG2  GLU  30          1HG       GLU  30 -13.951   9.312   8.855
  229    HG3  GLU  30          2HG       GLU  30 -13.403  10.930   9.293
  230    H    LYS  31           H        LYS  31 -12.801   7.867   6.686
  231    HA   LYS  31           HA       LYS  31 -11.259   7.343   8.996
  232    HB2  LYS  31          1HB       LYS  31 -11.852   5.556   6.635
  233    HB3  LYS  31          2HB       LYS  31 -11.104   5.028   8.146
  234    HG2  LYS  31          1HG       LYS  31 -13.143   5.803   9.344
  235    HG3  LYS  31          2HG       LYS  31 -13.882   6.110   7.771
  236    HD2  LYS  31          1HD       LYS  31 -13.567   3.748   7.171
  237    HD3  LYS  31          2HD       LYS  31 -12.849   3.453   8.767
  238    HE2  LYS  31          1HE       LYS  31 -15.652   4.474   8.304
  239    HE3  LYS  31          2HE       LYS  31 -15.237   2.792   8.647
  240    HZ1  LYS  31          1HZ       LYS  31 -14.177   3.642  10.738
  241    HZ2  LYS  31          2HZ       LYS  31 -15.865   3.773  10.676
  242    HZ3  LYS  31          3HZ       LYS  31 -14.904   5.140  10.422
  243    H    PHE  32           H        PHE  32 -10.399   7.413   5.558
  244    HA   PHE  32           HA       PHE  32  -7.738   6.532   5.935
  245    HB2  PHE  32          1HB       PHE  32  -8.804   8.162   3.629
  246    HB3  PHE  32          2HB       PHE  32  -7.370   7.139   3.627
  247    HD1  PHE  32           HD1      PHE  32  -9.996   7.122   1.869
  248    HD2  PHE  32           HD2      PHE  32  -8.586   4.803   5.148
  249    HE1  PHE  32           HE1      PHE  32 -11.372   5.226   1.120
  250    HE2  PHE  32           HE2      PHE  32  -9.963   2.906   4.404
  251    HZ   PHE  32           HZ       PHE  32 -11.352   3.114   2.382
  252    H    LYS  33           H        LYS  33  -9.239   9.459   6.608
  253    HA   LYS  33           HA       LYS  33  -6.933  11.165   6.395
  254    HB2  LYS  33          1HB       LYS  33  -9.415  11.857   6.373
  255    HB3  LYS  33          2HB       LYS  33  -9.360  11.632   8.119
  256    HG2  LYS  33          1HG       LYS  33  -7.610  13.292   8.308
  257    HG3  LYS  33          2HG       LYS  33  -7.621  13.519   6.553
  258    HD2  LYS  33          1HD       LYS  33  -9.879  14.350   6.627
  259    HD3  LYS  33          2HD       LYS  33 -10.011  13.966   8.343
  260    HE2  LYS  33          1HE       LYS  33  -8.129  15.983   7.127
  261    HE3  LYS  33          2HE       LYS  33  -9.629  16.356   7.973
  262    HZ1  LYS  33          1HZ       LYS  33  -8.686  15.312   9.964
  263    HZ2  LYS  33          2HZ       LYS  33  -7.762  16.628   9.443
  264    HZ3  LYS  33          3HZ       LYS  33  -7.232  15.054   9.142
  265    H    LYS  34           H        LYS  34  -8.198   8.901   8.657
  266    HA   LYS  34           HA       LYS  34  -6.345   9.803  10.777
  267    HB2  LYS  34          1HB       LYS  34  -7.821   8.906  12.376
  268    HB3  LYS  34          2HB       LYS  34  -8.901   9.563  11.168
  269    HG2  LYS  34          1HG       LYS  34  -9.214   7.377  10.170
  270    HG3  LYS  34          2HG       LYS  34  -8.106   6.670  11.343
  271    HD2  LYS  34          1HD       LYS  34 -10.577   8.143  12.195
  272    HD3  LYS  34          2HD       LYS  34 -10.623   6.435  11.760
  273    HE2  LYS  34          1HE       LYS  34  -8.710   6.165  13.453
  274    HE3  LYS  34          2HE       LYS  34  -9.183   7.761  14.033
  275    HZ1  LYS  34          1HZ       LYS  34 -10.943   5.370  13.879
  276    HZ2  LYS  34          2HZ       LYS  34 -11.416   6.903  14.427
  277    HZ3  LYS  34          3HZ       LYS  34 -10.269   6.013  15.294
  278    H    TRP  35           H        TRP  35  -6.156   7.942   8.278
  279    HA   TRP  35           HA       TRP  35  -5.221   5.987   7.631
  280    HB2  TRP  35          1HB       TRP  35  -3.774   6.398  10.247
  281    HB3  TRP  35          2HB       TRP  35  -3.347   5.135   9.086
  282    HD1  TRP  35           HD1      TRP  35  -3.575   8.986   9.286
  283    HE1  TRP  35           HE1      TRP  35  -1.825   9.990   7.697
  284    HE3  TRP  35           HE3      TRP  35  -1.845   4.667   7.152
  285    HZ2  TRP  35           HZ2      TRP  35   0.038   9.080   5.797
  286    HZ3  TRP  35           HZ3      TRP  35  -0.074   4.828   5.456
  287    HH2  TRP  35           HH2      TRP  35   0.849   6.982   4.790
  288    H    GLU  36           H        GLU  36  -7.660   5.476   8.427
  289    HA   GLU  36           HA       GLU  36  -7.430   2.980   9.965
  290    HB2  GLU  36          1HB       GLU  36  -8.796   4.654  11.136
  291    HB3  GLU  36          2HB       GLU  36  -9.821   4.810   9.720
  292    HG2  GLU  36          1HG       GLU  36 -10.530   2.507   9.967
  293    HG3  GLU  36          2HG       GLU  36  -9.488   2.324  11.374
  294    H    PHE  37           H        PHE  37  -7.446   1.353   8.608
  295    HA   PHE  37           HA       PHE  37  -9.078   1.565   6.163
  296    HB2  PHE  37          1HB       PHE  37  -6.599  -0.132   6.581
  297    HB3  PHE  37          2HB       PHE  37  -7.462   0.108   5.065
  298    HD1  PHE  37           HD1      PHE  37  -5.313   1.712   7.585
  299    HD2  PHE  37           HD2      PHE  37  -7.101   2.062   3.736
  300    HE1  PHE  37           HE1      PHE  37  -3.900   3.668   7.107
  301    HE2  PHE  37           HE2      PHE  37  -5.699   4.021   3.262
  302    HZ   PHE  37           HZ       PHE  37  -4.092   4.826   4.944
  303    HA   PRO  38           HA       PRO  38 -11.191  -1.743   8.548
  304    HB2  PRO  38          1HB       PRO  38 -13.352  -0.975   6.693
  305    HB3  PRO  38          2HB       PRO  38 -13.369  -1.116   8.460
  306    HG2  PRO  38          1HG       PRO  38 -13.446   1.276   7.286
  307    HG3  PRO  38          2HG       PRO  38 -12.510   1.007   8.769
  308    HD2  PRO  38          1HD       PRO  38 -11.528   1.145   5.925
  309    HD3  PRO  38          2HD       PRO  38 -10.843   1.889   7.403
  310    H    GLU  39           H        GLU  39 -11.785  -3.773   7.957
  311    HA   GLU  39           HA       GLU  39 -10.831  -4.740   5.444
  312    HB2  GLU  39          1HB       GLU  39 -10.604  -6.040   7.506
  313    HB3  GLU  39          2HB       GLU  39 -12.352  -6.158   7.630
  314    HG2  GLU  39          1HG       GLU  39 -12.412  -7.412   5.536
  315    HG3  GLU  39          2HG       GLU  39 -10.655  -7.304   5.426
  316    H    ASP  40           H        ASP  40 -12.031  -3.836   3.875
  317    HA   ASP  40           HA       ASP  40 -14.634  -4.981   3.341
  318    HB2  ASP  40          1HB       ASP  40 -15.165  -2.953   4.727
  319    HB3  ASP  40          2HB       ASP  40 -14.332  -1.962   3.533
  320    H    ASP  41           H        ASP  41 -15.079  -4.956   1.139
  321    HA   ASP  41           HA       ASP  41 -12.822  -4.953  -0.531
  322    HB2  ASP  41          1HB       ASP  41 -15.754  -4.976  -1.269
  323    HB3  ASP  41          2HB       ASP  41 -14.446  -5.189  -2.425
  324    H    THR  42           H        THR  42 -15.097  -2.443   0.239
  325    HA   THR  42           HA       THR  42 -14.611  -0.637  -1.845
  326    HB   THR  42           HB       THR  42 -15.096  -0.018   1.075
  327    HG1  THR  42           HG1      THR  42 -16.837  -1.168   0.489
  328   HG21  THR  42          1HG2      THR  42 -14.353   1.934  -0.124
  329   HG22  THR  42          2HG2      THR  42 -16.084   2.067   0.188
  330   HG23  THR  42          3HG2      THR  42 -15.507   1.620  -1.419
  331    H    THR  43           H        THR  43 -13.064  -0.790   1.358
  332    HA   THR  43           HA       THR  43 -11.056   1.099   0.913
  333    HB   THR  43           HB       THR  43 -10.843  -1.329   2.694
  334    HG1  THR  43           HG1      THR  43 -11.734   0.327   4.259
  335   HG21  THR  43          1HG2      THR  43  -9.636   1.435   2.849
  336   HG22  THR  43          2HG2      THR  43  -8.777  -0.069   2.524
  337   HG23  THR  43          3HG2      THR  43  -9.503   0.208   4.108
  338    H    MET  44           H        MET  44 -11.244  -2.308   0.145
  339    HA   MET  44           HA       MET  44  -8.478  -2.747  -0.198
  340    HB2  MET  44          1HB       MET  44 -10.815  -4.275  -1.328
  341    HB3  MET  44          2HB       MET  44  -9.154  -4.849  -1.299
  342    HG2  MET  44          1HG       MET  44  -9.182  -4.796   1.141
  343    HG3  MET  44          2HG       MET  44 -10.839  -4.207   1.111
  344    HE1  MET  44          1HE       MET  44 -11.226  -7.841   2.468
  345    HE2  MET  44          2HE       MET  44 -11.556  -6.130   2.749
  346    HE3  MET  44          3HE       MET  44  -9.896  -6.726   2.786
  347    H    CYS  45           H        CYS  45 -11.076  -2.267  -2.595
  348    HA   CYS  45           HA       CYS  45  -9.325  -2.221  -4.815
  349    HB2  CYS  45          1HB       CYS  45 -12.105  -1.068  -4.499
  350    HB3  CYS  45          2HB       CYS  45 -11.234  -1.147  -6.025
  351    H    TYR  46           H        TYR  46 -10.363   0.210  -2.549
  352    HA   TYR  46           HA       TYR  46  -9.514   2.503  -3.892
  353    HB2  TYR  46          1HB       TYR  46 -10.805   2.847  -1.973
  354    HB3  TYR  46          2HB       TYR  46  -9.815   1.767  -0.995
  355    HD1  TYR  46           HD1      TYR  46  -8.275   2.679   0.464
  356    HD2  TYR  46           HD2      TYR  46  -9.603   5.016  -2.839
  357    HE1  TYR  46           HE1      TYR  46  -7.036   4.611   1.340
  358    HE2  TYR  46           HE2      TYR  46  -8.364   6.952  -1.968
  359    HH   TYR  46           HH       TYR  46  -6.226   6.681   0.808
  360    H    ILE  47           H        ILE  47  -7.792   0.439  -1.573
  361    HA   ILE  47           HA       ILE  47  -5.328   1.736  -1.660
  362    HB   ILE  47           HB       ILE  47  -5.994  -1.148  -1.106
  363   HG12  ILE  47          1HG1      ILE  47  -6.924   0.431   0.505
  364   HG13  ILE  47          2HG1      ILE  47  -5.625  -0.493   1.254
  365   HG21  ILE  47          1HG2      ILE  47  -3.744  -1.316  -0.085
  366   HG22  ILE  47          2HG2      ILE  47  -3.355   0.266  -0.763
  367   HG23  ILE  47          3HG2      ILE  47  -3.703  -1.092  -1.834
  368   HD11  ILE  47          1HD1      ILE  47  -5.536   2.359   0.300
  369   HD12  ILE  47          2HD1      ILE  47  -4.114   1.454   0.821
  370   HD13  ILE  47          3HD1      ILE  47  -5.426   1.765   1.957
  371    H    LYS  48           H        LYS  48  -6.657  -0.823  -3.691
  372    HA   LYS  48           HA       LYS  48  -4.315  -1.459  -5.081
  373    HB2  LYS  48          1HB       LYS  48  -6.460  -2.780  -5.045
  374    HB3  LYS  48          2HB       LYS  48  -7.134  -1.609  -6.163
  375    HG2  LYS  48          1HG       LYS  48  -4.589  -3.011  -6.847
  376    HG3  LYS  48          2HG       LYS  48  -6.131  -3.844  -7.041
  377    HD2  LYS  48          1HD       LYS  48  -6.917  -2.089  -8.528
  378    HD3  LYS  48          2HD       LYS  48  -5.424  -1.182  -8.281
  379    HE2  LYS  48          1HE       LYS  48  -4.139  -2.909  -9.356
  380    HE3  LYS  48          2HE       LYS  48  -5.557  -3.950  -9.467
  381    HZ1  LYS  48          1HZ       LYS  48  -6.573  -2.372 -10.970
  382    HZ2  LYS  48          2HZ       LYS  48  -5.067  -2.849 -11.571
  383    HZ3  LYS  48          3HZ       LYS  48  -5.243  -1.337 -10.841
  384    H    CYS  49           H        CYS  49  -6.959   0.774  -5.898
  385    HA   CYS  49           HA       CYS  49  -5.942   1.740  -8.295
  386    HB2  CYS  49          1HB       CYS  49  -8.173   2.260  -7.737
  387    HB3  CYS  49          2HB       CYS  49  -7.718   3.040  -6.224
  388    H    VAL  50           H        VAL  50  -5.465   3.019  -5.001
  389    HA   VAL  50           HA       VAL  50  -3.957   5.256  -5.707
  390    HB   VAL  50           HB       VAL  50  -4.047   3.665  -3.148
  391   HG11  VAL  50          1HG1      VAL  50  -3.040   5.621  -2.064
  392   HG12  VAL  50          2HG1      VAL  50  -2.803   6.368  -3.646
  393   HG13  VAL  50          3HG1      VAL  50  -1.948   4.880  -3.234
  394   HG21  VAL  50          1HG2      VAL  50  -5.388   6.185  -4.065
  395   HG22  VAL  50          2HG2      VAL  50  -5.400   5.616  -2.396
  396   HG23  VAL  50          3HG2      VAL  50  -6.149   4.647  -3.665
  397    H    PHE  51           H        PHE  51  -2.985   2.020  -4.698
  398    HA   PHE  51           HA       PHE  51  -0.213   2.507  -4.709
  399    HB2  PHE  51          1HB       PHE  51  -1.990   0.135  -4.528
  400    HB3  PHE  51          2HB       PHE  51  -0.317  -0.160  -4.991
  401    HD1  PHE  51           HD1      PHE  51  -1.432   2.509  -2.698
  402    HD2  PHE  51           HD2      PHE  51   0.336  -1.347  -3.051
  403    HE1  PHE  51           HE1      PHE  51  -0.812   2.578  -0.319
  404    HE2  PHE  51           HE2      PHE  51   0.959  -1.280  -0.674
  405    HZ   PHE  51           HZ       PHE  51   0.387   0.684   0.695
  406    H    ASN  52           H        ASN  52  -2.496   1.700  -7.174
  407    HA   ASN  52           HA       ASN  52  -0.543   0.699  -9.045
  408    HB2  ASN  52          1HB       ASN  52  -2.895  -0.097  -9.042
  409    HB3  ASN  52          2HB       ASN  52  -3.422   1.524  -9.515
  410   HD21  ASN  52          1HD2      ASN  52  -0.552  -0.173 -10.697
  411   HD22  ASN  52          2HD2      ASN  52  -1.093  -0.295 -12.335
  412    H    LYS  53           H        LYS  53  -2.303   3.706  -8.492
  413    HA   LYS  53           HA       LYS  53  -1.396   4.960 -10.877
  414    HB2  LYS  53          1HB       LYS  53  -2.760   5.947  -8.396
  415    HB3  LYS  53          2HB       LYS  53  -2.151   7.091  -9.584
  416    HG2  LYS  53          1HG       LYS  53  -4.184   4.916 -10.064
  417    HG3  LYS  53          2HG       LYS  53  -4.509   6.644  -9.946
  418    HD2  LYS  53          1HD       LYS  53  -2.805   5.314 -12.059
  419    HD3  LYS  53          2HD       LYS  53  -4.465   5.860 -12.275
  420    HE2  LYS  53          1HE       LYS  53  -2.158   7.657 -11.535
  421    HE3  LYS  53          2HE       LYS  53  -2.764   7.433 -13.174
  422    HZ1  LYS  53          1HZ       LYS  53  -4.418   8.420 -10.921
  423    HZ2  LYS  53          2HZ       LYS  53  -4.852   8.365 -12.552
  424    HZ3  LYS  53          3HZ       LYS  53  -3.642   9.428 -12.033
  425    H    MET  54           H        MET  54  -0.183   4.752  -7.602
  426    HA   MET  54           HA       MET  54   1.920   6.658  -8.099
  427    HB2  MET  54          1HB       MET  54   1.257   4.831  -5.813
  428    HB3  MET  54          2HB       MET  54   2.814   5.650  -5.883
  429    HG2  MET  54          1HG       MET  54   1.509   7.800  -6.122
  430    HG3  MET  54          2HG       MET  54   0.078   6.860  -5.720
  431    HE1  MET  54          1HE       MET  54  -0.077   5.405  -3.483
  432    HE2  MET  54          2HE       MET  54   1.037   5.559  -2.128
  433    HE3  MET  54          3HE       MET  54   1.559   4.762  -3.612
  434    H    GLN  55           H        GLN  55   1.397   3.795  -9.367
  435    HA   GLN  55           HA       GLN  55   2.566   2.121 -10.276
  436    HB2  GLN  55          1HB       GLN  55   4.396   4.446 -10.411
  437    HB3  GLN  55          2HB       GLN  55   5.037   2.865 -10.875
  438    HG2  GLN  55          1HG       GLN  55   3.305   2.629 -12.537
  439    HG3  GLN  55          2HG       GLN  55   2.547   4.121 -12.000
  440   HE21  GLN  55          1HE2      GLN  55   5.200   2.725 -13.746
  441   HE22  GLN  55          2HE2      GLN  55   5.723   4.183 -14.522
  442    H    LEU  56           H        LEU  56   2.320   1.688  -7.700
  443    HA   LEU  56           HA       LEU  56   4.951   0.785  -6.797
  444    HB2  LEU  56          1HB       LEU  56   2.782   2.216  -5.437
  445    HB3  LEU  56          2HB       LEU  56   3.406   0.844  -4.511
  446    HG   LEU  56           HG       LEU  56   5.030   3.151  -5.592
  447   HD11  LEU  56          1HD1      LEU  56   5.239   3.814  -3.233
  448   HD12  LEU  56          2HD1      LEU  56   4.110   2.537  -2.786
  449   HD13  LEU  56          3HD1      LEU  56   3.568   3.877  -3.793
  450   HD21  LEU  56          1HD2      LEU  56   6.382   1.174  -5.463
  451   HD22  LEU  56          2HD2      LEU  56   5.765   0.810  -3.852
  452   HD23  LEU  56          3HD2      LEU  56   6.788   2.224  -4.106
  453    H    PHE  57           H        PHE  57   1.798  -0.076  -7.692
  454    HA   PHE  57           HA       PHE  57   2.350  -2.877  -7.110
  455    HB2  PHE  57          1HB       PHE  57   0.924  -2.218  -5.247
  456    HB3  PHE  57          2HB       PHE  57  -0.223  -1.463  -6.346
  457    HD1  PHE  57           HD1      PHE  57  -1.846  -2.758  -7.533
  458    HD2  PHE  57           HD2      PHE  57   1.090  -4.664  -5.107
  459    HE1  PHE  57           HE1      PHE  57  -3.109  -4.863  -7.665
  460    HE2  PHE  57           HE2      PHE  57  -0.171  -6.771  -5.236
  461    HZ   PHE  57           HZ       PHE  57  -2.271  -6.871  -6.513
  462    H    ASP  58           H        ASP  58   1.620  -4.244  -8.647
  463    HA   ASP  58           HA       ASP  58  -0.030  -3.147 -10.825
  464    HB2  ASP  58          1HB       ASP  58   2.266  -3.278 -11.630
  465    HB3  ASP  58          2HB       ASP  58   2.411  -4.933 -11.044
  466    H    ASP  59           H        ASP  59  -1.489  -4.656 -11.782
  467    HA   ASP  59           HA       ASP  59  -2.349  -6.655  -9.890
  468    HB2  ASP  59          1HB       ASP  59  -4.299  -6.925 -11.255
  469    HB3  ASP  59          2HB       ASP  59  -3.952  -5.213 -11.145
  470    H    THR  60           H        THR  60  -0.210  -6.675 -12.486
  471    HA   THR  60           HA       THR  60  -0.624  -9.513 -13.018
  472    HB   THR  60           HB       THR  60   1.127  -7.434 -14.316
  473    HG1  THR  60           HG1      THR  60  -0.766  -7.276 -15.288
  474   HG21  THR  60          1HG2      THR  60   0.999 -10.382 -14.959
  475   HG22  THR  60          2HG2      THR  60   2.373  -9.536 -14.245
  476   HG23  THR  60          3HG2      THR  60   1.858  -9.155 -15.888
  477    H    GLU  61           H        GLU  61   2.239  -7.446 -12.347
  478    HA   GLU  61           HA       GLU  61   3.740  -9.704 -11.388
  479    HB2  GLU  61          1HB       GLU  61   4.547  -6.839 -10.995
  480    HB3  GLU  61          2HB       GLU  61   5.559  -8.259 -11.197
  481    HG2  GLU  61          1HG       GLU  61   4.667  -8.426 -13.536
  482    HG3  GLU  61          2HG       GLU  61   3.968  -6.829 -13.290
  483    H    GLY  62           H        GLY  62   1.585  -7.488  -9.944
  484    HA2  GLY  62          1HA       GLY  62   0.860  -7.443  -7.732
  485    HA3  GLY  62          2HA       GLY  62   2.195  -8.514  -7.303
  486    HA   PRO  63           HA       PRO  63   3.347  -4.487  -5.489
  487    HB2  PRO  63          1HB       PRO  63   5.068  -5.603  -3.653
  488    HB3  PRO  63          2HB       PRO  63   3.338  -5.353  -3.382
  489    HG2  PRO  63          1HG       PRO  63   4.814  -7.821  -4.135
  490    HG3  PRO  63          2HG       PRO  63   3.420  -7.630  -3.066
  491    HD2  PRO  63          1HD       PRO  63   3.256  -8.567  -5.606
  492    HD3  PRO  63          2HD       PRO  63   1.927  -7.694  -4.812
  493    H    LEU  64           H        LEU  64   4.806  -3.294  -6.473
  494    HA   LEU  64           HA       LEU  64   6.978  -4.532  -7.930
  495    HB2  LEU  64          1HB       LEU  64   6.390  -1.583  -7.657
  496    HB3  LEU  64          2HB       LEU  64   7.366  -2.365  -8.882
  497    HG   LEU  64           HG       LEU  64   4.385  -2.730  -8.589
  498   HD11  LEU  64          1HD1      LEU  64   5.962  -1.143 -10.612
  499   HD12  LEU  64          2HD1      LEU  64   4.963  -0.470  -9.323
  500   HD13  LEU  64          3HD1      LEU  64   4.217  -1.400 -10.621
  501   HD21  LEU  64          1HD2      LEU  64   5.586  -4.665  -9.517
  502   HD22  LEU  64          2HD2      LEU  64   6.260  -3.620 -10.769
  503   HD23  LEU  64          3HD2      LEU  64   4.517  -3.892 -10.693
  504    H    VAL  65           H        VAL  65   8.317  -5.311  -6.406
  505    HA   VAL  65           HA       VAL  65   9.059  -4.271  -3.992
  506    HB   VAL  65           HB       VAL  65  10.666  -5.994  -5.864
  507   HG11  VAL  65          1HG1      VAL  65  11.976  -6.655  -3.909
  508   HG12  VAL  65          2HG1      VAL  65  11.111  -5.471  -2.926
  509   HG13  VAL  65          3HG1      VAL  65  12.152  -4.932  -4.246
  510   HG21  VAL  65          1HG2      VAL  65   9.881  -7.800  -4.364
  511   HG22  VAL  65          2HG2      VAL  65   8.578  -6.993  -5.232
  512   HG23  VAL  65          3HG2      VAL  65   8.867  -6.619  -3.534
  513    H    ASP  66           H        ASP  66  10.659  -3.722  -7.117
  514    HA   ASP  66           HA       ASP  66  12.900  -2.364  -6.170
  515    HB2  ASP  66          1HB       ASP  66  12.786  -3.175  -8.429
  516    HB3  ASP  66          2HB       ASP  66  11.445  -2.100  -8.799
  517    H    ASN  67           H        ASN  67   9.831  -0.964  -7.365
  518    HA   ASN  67           HA       ASN  67  10.546   1.705  -6.718
  519    HB2  ASN  67          1HB       ASN  67   7.879   0.408  -7.255
  520    HB3  ASN  67          2HB       ASN  67   8.046   2.118  -6.888
  521   HD21  ASN  67          1HD2      ASN  67   7.283   2.779  -8.866
  522   HD22  ASN  67          2HD2      ASN  67   8.190   2.587 -10.327
  523    H    LEU  68           H        LEU  68   8.929  -0.871  -5.001
  524    HA   LEU  68           HA       LEU  68   7.863   0.567  -2.868
  525    HB2  LEU  68          1HB       LEU  68   8.730  -2.267  -3.244
  526    HB3  LEU  68          2HB       LEU  68   8.269  -1.710  -1.642
  527    HG   LEU  68           HG       LEU  68   6.465  -1.377  -4.028
  528   HD11  LEU  68          1HD1      LEU  68   7.001  -3.762  -3.743
  529   HD12  LEU  68          2HD1      LEU  68   5.319  -3.402  -3.352
  530   HD13  LEU  68          3HD1      LEU  68   6.492  -3.660  -2.058
  531   HD21  LEU  68          1HD2      LEU  68   6.014   0.003  -2.057
  532   HD22  LEU  68          2HD2      LEU  68   5.943  -1.452  -1.064
  533   HD23  LEU  68          3HD2      LEU  68   4.744  -1.189  -2.330
  534    H    VAL  69           H        VAL  69  11.007  -1.067  -3.109
  535    HA   VAL  69           HA       VAL  69  11.963  -0.188  -0.587
  536    HB   VAL  69           HB       VAL  69  13.501  -1.053  -3.028
  537   HG11  VAL  69          1HG1      VAL  69  14.938   0.149  -1.518
  538   HG12  VAL  69          2HG1      VAL  69  15.292  -1.574  -1.399
  539   HG13  VAL  69          3HG1      VAL  69  14.333  -0.780  -0.148
  540   HG21  VAL  69          1HG2      VAL  69  13.575  -3.234  -1.989
  541   HG22  VAL  69          2HG2      VAL  69  11.901  -2.726  -2.211
  542   HG23  VAL  69          3HG2      VAL  69  12.648  -2.634  -0.614
  543    H    HIS  70           H        HIS  70  12.129   1.128  -3.853
  544    HA   HIS  70           HA       HIS  70  14.023   3.140  -3.381
  545    HB2  HIS  70          1HB       HIS  70  13.133   2.331  -5.617
  546    HB3  HIS  70          2HB       HIS  70  11.714   3.323  -5.319
  547    HD1  HIS  70           HD1      HIS  70  14.964   3.427  -6.855
  548    HD2  HIS  70           HD2      HIS  70  12.479   6.191  -4.996
  549    HE1  HIS  70           HE1      HIS  70  15.810   5.683  -7.568
  550    HE2  HIS  70           HE2      HIS  70  14.403   7.337  -6.289
  551    H    GLN  71           H        GLN  71  10.619   2.940  -2.725
  552    HA   GLN  71           HA       GLN  71  10.367   5.781  -2.128
  553    HB2  GLN  71          1HB       GLN  71   8.585   4.291  -3.266
  554    HB3  GLN  71          2HB       GLN  71   8.281   3.667  -1.648
  555    HG2  GLN  71          1HG       GLN  71   6.698   5.412  -2.207
  556    HG3  GLN  71          2HG       GLN  71   7.725   5.885  -0.855
  557   HE21  GLN  71          1HE2      GLN  71   7.314   8.073  -1.201
  558   HE22  GLN  71          2HE2      GLN  71   7.999   8.933  -2.526
  559    H    LEU  72           H        LEU  72   9.806   2.725  -0.403
  560    HA   LEU  72           HA       LEU  72   9.299   3.920   2.076
  561    HB2  LEU  72          1HB       LEU  72  10.139   1.115   1.390
  562    HB3  LEU  72          2HB       LEU  72   9.674   1.614   3.000
  563    HG   LEU  72           HG       LEU  72   7.878   1.772   0.578
  564   HD11  LEU  72          1HD1      LEU  72   6.727  -0.161   1.548
  565   HD12  LEU  72          2HD1      LEU  72   7.944  -0.248   2.822
  566   HD13  LEU  72          3HD1      LEU  72   8.400  -0.550   1.145
  567   HD21  LEU  72          1HD2      LEU  72   6.106   2.009   2.327
  568   HD22  LEU  72          2HD2      LEU  72   7.205   3.383   2.203
  569   HD23  LEU  72          3HD2      LEU  72   7.392   2.221   3.518
  570    H    ALA  73           H        ALA  73  12.293   2.514   0.773
  571    HA   ALA  73           HA       ALA  73  13.710   2.760   3.238
  572    HB1  ALA  73          1HB       ALA  73  15.618   1.958   2.021
  573    HB2  ALA  73          2HB       ALA  73  14.808   2.275   0.487
  574    HB3  ALA  73          3HB       ALA  73  14.189   1.027   1.567
  575    H    HIS  74           H        HIS  74  12.617   5.284   2.297
  576    HA   HIS  74           HA       HIS  74  14.721   6.927   1.289
  577    HB2  HIS  74          1HB       HIS  74  12.288   7.526   1.155
  578    HB3  HIS  74          2HB       HIS  74  12.296   7.786   2.896
  579    HD1  HIS  74           HD1      HIS  74  12.158   9.738   0.087
  580    HD2  HIS  74           HD2      HIS  74  14.761   9.752   3.325
  581    HE1  HIS  74           HE1      HIS  74  13.126  12.058   0.169
  582    HE2  HIS  74           HE2      HIS  74  14.771  12.016   2.076
  583    H    GLY  75           H        GLY  75  16.578   6.834   2.436
  584    HA2  GLY  75          1HA       GLY  75  18.028   7.532   4.095
  585    HA3  GLY  75          2HA       GLY  75  16.653   8.185   4.973
  586    H    ARG  76           H        ARG  76  16.803   4.871   3.884
  587    HA   ARG  76           HA       ARG  76  17.552   3.918   6.524
  588    HB2  ARG  76          1HB       ARG  76  14.825   3.659   5.350
  589    HB3  ARG  76          2HB       ARG  76  15.451   2.309   6.297
  590    HG2  ARG  76          1HG       ARG  76  15.864   3.939   8.149
  591    HG3  ARG  76          2HG       ARG  76  15.007   5.150   7.195
  592    HD2  ARG  76          1HD       ARG  76  13.069   3.570   7.121
  593    HD3  ARG  76          2HD       ARG  76  13.925   2.567   8.288
  594    HE   ARG  76           HE       ARG  76  13.579   5.329   9.070
  595   HH11  ARG  76          1HH1      ARG  76  12.275   2.083   9.203
  596   HH12  ARG  76          2HH1      ARG  76  11.268   2.412  10.575
  597   HH21  ARG  76          1HH2      ARG  76  12.254   5.764  10.862
  598   HH22  ARG  76          2HH2      ARG  76  11.256   4.508  11.523
  599    H    ASP  77           H        ASP  77  17.845   1.516   6.515
  600    HA   ASP  77           HA       ASP  77  19.451   0.818   4.305
  601    HB2  ASP  77          1HB       ASP  77  18.462  -0.848   6.618
  602    HB3  ASP  77          2HB       ASP  77  19.620  -1.416   5.417
  603    H    ALA  78           H        ALA  78  18.696   0.447   2.418
  604    HA   ALA  78           HA       ALA  78  16.151  -0.350   1.683
  605    HB1  ALA  78          1HB       ALA  78  17.072  -0.707  -0.517
  606    HB2  ALA  78          2HB       ALA  78  18.702  -0.777   0.152
  607    HB3  ALA  78          3HB       ALA  78  17.789   0.731   0.212
  608    H    GLU  79           H        GLU  79  18.960  -2.305   2.472
  609    HA   GLU  79           HA       GLU  79  18.115  -4.762   1.432
  610    HB2  GLU  79          1HB       GLU  79  19.848  -4.129   3.812
  611    HB3  GLU  79          2HB       GLU  79  19.562  -5.769   3.250
  612    HG2  GLU  79          1HG       GLU  79  20.448  -5.026   1.012
  613    HG3  GLU  79          2HG       GLU  79  20.964  -3.541   1.808
  614    H    GLU  80           H        GLU  80  17.589  -3.380   4.667
  615    HA   GLU  80           HA       GLU  80  16.053  -5.559   5.628
  616    HB2  GLU  80          1HB       GLU  80  16.269  -2.689   6.509
  617    HB3  GLU  80          2HB       GLU  80  15.275  -3.875   7.346
  618    HG2  GLU  80          1HG       GLU  80  17.381  -5.247   7.591
  619    HG3  GLU  80          2HG       GLU  80  18.253  -3.823   7.041
  620    H    VAL  81           H        VAL  81  15.213  -2.415   4.249
  621    HA   VAL  81           HA       VAL  81  12.455  -2.530   4.456
  622    HB   VAL  81           HB       VAL  81  14.130  -1.253   2.300
  623   HG11  VAL  81          1HG1      VAL  81  12.183   0.208   1.928
  624   HG12  VAL  81          2HG1      VAL  81  11.244  -0.792   3.041
  625   HG13  VAL  81          3HG1      VAL  81  11.840  -1.475   1.528
  626   HG21  VAL  81          1HG2      VAL  81  14.725  -0.429   4.442
  627   HG22  VAL  81          2HG2      VAL  81  13.033  -0.269   4.914
  628   HG23  VAL  81          3HG2      VAL  81  13.706   0.783   3.670
  629    H    ARG  82           H        ARG  82  14.490  -3.610   1.725
  630    HA   ARG  82           HA       ARG  82  12.481  -4.623   0.085
  631    HB2  ARG  82          1HB       ARG  82  14.902  -4.306  -0.493
  632    HB3  ARG  82          2HB       ARG  82  15.250  -5.777   0.404
  633    HG2  ARG  82          1HG       ARG  82  13.800  -7.034  -1.088
  634    HG3  ARG  82          2HG       ARG  82  13.468  -5.563  -1.997
  635    HD2  ARG  82          1HD       ARG  82  15.938  -5.368  -2.378
  636    HD3  ARG  82          2HD       ARG  82  16.097  -6.985  -1.699
  637    HE   ARG  82           HE       ARG  82  14.430  -7.585  -3.570
  638   HH11  ARG  82          1HH1      ARG  82  16.987  -5.208  -3.792
  639   HH12  ARG  82          2HH1      ARG  82  17.145  -5.349  -5.511
  640   HH21  ARG  82          1HH2      ARG  82  14.626  -7.775  -5.838
  641   HH22  ARG  82          2HH2      ARG  82  15.788  -6.802  -6.683
  642    H    THR  83           H        THR  83  14.277  -6.119   2.707
  643    HA   THR  83           HA       THR  83  13.334  -8.740   2.423
  644    HB   THR  83           HB       THR  83  14.452  -7.178   4.739
  645    HG1  THR  83           HG1      THR  83  16.005  -7.700   3.298
  646   HG21  THR  83          1HG2      THR  83  12.958  -8.854   5.704
  647   HG22  THR  83          2HG2      THR  83  14.648  -9.272   5.995
  648   HG23  THR  83          3HG2      THR  83  13.735 -10.110   4.742
  649    H    GLU  84           H        GLU  84  12.279  -6.158   4.650
  650    HA   GLU  84           HA       GLU  84  10.142  -7.549   5.773
  651    HB2  GLU  84          1HB       GLU  84  10.441  -4.566   5.459
  652    HB3  GLU  84          2HB       GLU  84   9.375  -5.392   6.589
  653    HG2  GLU  84          1HG       GLU  84  11.462  -6.487   7.515
  654    HG3  GLU  84          2HG       GLU  84  12.367  -5.292   6.594
  655    H    VAL  85           H        VAL  85  10.235  -5.480   2.896
  656    HA   VAL  85           HA       VAL  85   7.491  -5.501   2.319
  657    HB   VAL  85           HB       VAL  85   9.921  -5.317   0.546
  658   HG11  VAL  85          1HG1      VAL  85   8.190  -6.371  -0.785
  659   HG12  VAL  85          2HG1      VAL  85   8.405  -4.694  -1.298
  660   HG13  VAL  85          3HG1      VAL  85   7.028  -5.143  -0.286
  661   HG21  VAL  85          1HG2      VAL  85   9.166  -3.000   0.283
  662   HG22  VAL  85          2HG2      VAL  85   9.468  -3.414   1.972
  663   HG23  VAL  85          3HG2      VAL  85   7.812  -3.327   1.368
  664    H    LEU  86           H        LEU  86  10.073  -7.715   1.257
  665    HA   LEU  86           HA       LEU  86   8.536  -9.366  -0.361
  666    HB2  LEU  86          1HB       LEU  86  11.029  -9.933   1.233
  667    HB3  LEU  86          2HB       LEU  86  10.322 -11.082   0.099
  668    HG   LEU  86           HG       LEU  86  11.161  -8.311  -0.709
  669   HD11  LEU  86          1HD1      LEU  86  13.212  -9.319  -1.559
  670   HD12  LEU  86          2HD1      LEU  86  12.747 -10.870  -0.857
  671   HD13  LEU  86          3HD1      LEU  86  13.093  -9.493   0.192
  672   HD21  LEU  86          1HD2      LEU  86  11.181  -9.337  -2.945
  673   HD22  LEU  86          2HD2      LEU  86   9.588  -9.387  -2.194
  674   HD23  LEU  86          3HD2      LEU  86  10.586 -10.839  -2.239
  675    H    LYS  87           H        LYS  87   8.950  -9.366   3.110
  676    HA   LYS  87           HA       LYS  87   7.831 -11.942   3.592
  677    HB2  LYS  87          1HB       LYS  87   8.225  -9.516   5.343
  678    HB3  LYS  87          2HB       LYS  87   7.500 -11.002   5.942
  679    HG2  LYS  87          1HG       LYS  87   9.490 -12.232   5.558
  680    HG3  LYS  87          2HG       LYS  87  10.213 -10.896   4.645
  681    HD2  LYS  87          1HD       LYS  87  11.140 -11.073   6.905
  682    HD3  LYS  87          2HD       LYS  87  10.299  -9.548   6.667
  683    HE2  LYS  87          1HE       LYS  87   8.349 -10.438   7.842
  684    HE3  LYS  87          2HE       LYS  87   9.188 -11.973   8.066
  685    HZ1  LYS  87          1HZ       LYS  87  10.117  -9.363   9.141
  686    HZ2  LYS  87          2HZ       LYS  87  10.834 -10.870   9.413
  687    HZ3  LYS  87          3HZ       LYS  87   9.299 -10.543  10.037
  688    H    CYS  88           H        CYS  88   6.484  -9.014   2.620
  689    HA   CYS  88           HA       CYS  88   3.812  -9.802   3.545
  690    HB2  CYS  88          1HB       CYS  88   5.038  -7.154   2.846
  691    HB3  CYS  88          2HB       CYS  88   3.276  -7.359   2.817
  692    H    VAL  89           H        VAL  89   5.796  -9.925   0.876
  693    HA   VAL  89           HA       VAL  89   3.825  -9.391  -1.157
  694    HB   VAL  89           HB       VAL  89   6.597 -10.568  -1.343
  695   HG11  VAL  89          1HG1      VAL  89   4.667  -9.749  -3.501
  696   HG12  VAL  89          2HG1      VAL  89   5.301 -11.366  -3.198
  697   HG13  VAL  89          3HG1      VAL  89   6.375 -10.091  -3.775
  698   HG21  VAL  89          1HG2      VAL  89   6.599  -8.242  -0.641
  699   HG22  VAL  89          2HG2      VAL  89   5.562  -7.810  -2.001
  700   HG23  VAL  89          3HG2      VAL  89   7.203  -8.388  -2.291
  701    H    ASP  90           H        ASP  90   2.213 -10.782  -1.360
  702    HA   ASP  90           HA       ASP  90   2.773 -13.661  -1.215
  703    HB2  ASP  90          1HB       ASP  90   0.117 -12.218  -1.052
  704    HB3  ASP  90          2HB       ASP  90   0.327 -13.966  -0.954
  705    H    LYS  91           H        LYS  91   1.453 -15.006  -2.723
  706    HA   LYS  91           HA       LYS  91   1.629 -13.964  -5.436
  707    HB2  LYS  91          1HB       LYS  91   0.704 -16.720  -4.644
  708    HB3  LYS  91          2HB       LYS  91   1.418 -16.192  -6.163
  709    HG2  LYS  91          1HG       LYS  91   3.540 -15.784  -4.976
  710    HG3  LYS  91          2HG       LYS  91   2.816 -16.474  -3.529
  711    HD2  LYS  91          1HD       LYS  91   2.870 -18.004  -6.104
  712    HD3  LYS  91          2HD       LYS  91   4.272 -17.982  -5.040
  713    HE2  LYS  91          1HE       LYS  91   3.016 -19.934  -4.525
  714    HE3  LYS  91          2HE       LYS  91   2.785 -18.799  -3.201
  715    HZ1  LYS  91          1HZ       LYS  91   0.739 -19.953  -3.953
  716    HZ2  LYS  91          2HZ       LYS  91   0.854 -19.133  -5.426
  717    HZ3  LYS  91          3HZ       LYS  91   0.627 -18.271  -3.990
  718    H    ASN  92           H        ASN  92  -0.137 -14.227  -6.947
  719    HA   ASN  92           HA       ASN  92  -2.602 -13.268  -5.798
  720    HB2  ASN  92          1HB       ASN  92  -1.665 -12.386  -7.941
  721    HB3  ASN  92          2HB       ASN  92  -2.018 -13.943  -8.678
  722   HD21  ASN  92          1HD2      ASN  92  -3.373 -12.860 -10.165
  723   HD22  ASN  92          2HD2      ASN  92  -4.967 -12.346  -9.722
  724    H    THR  93           H        THR  93  -2.922 -15.292  -4.567
  725    HA   THR  93           HA       THR  93  -4.102 -17.469  -6.099
  726    HB   THR  93           HB       THR  93  -4.484 -18.493  -3.866
  727    HG1  THR  93           HG1      THR  93  -4.618 -16.966  -2.346
  728   HG21  THR  93          1HG2      THR  93  -2.120 -18.845  -3.313
  729   HG22  THR  93          2HG2      THR  93  -1.683 -17.484  -4.350
  730   HG23  THR  93          3HG2      THR  93  -2.410 -18.931  -5.050
  731    H    ASP  94           H        ASP  94  -5.013 -14.561  -4.607
  732    HA   ASP  94           HA       ASP  94  -7.676 -15.243  -3.841
  733    HB2  ASP  94          1HB       ASP  94  -6.534 -12.499  -4.413
  734    HB3  ASP  94          2HB       ASP  94  -7.981 -12.865  -3.465
  735    H    ASN  95           H        ASN  95  -6.162 -14.062  -6.716
  736    HA   ASN  95           HA       ASN  95  -6.852 -13.640  -8.811
  737    HB2  ASN  95          1HB       ASN  95  -9.197 -15.248  -7.870
  738    HB3  ASN  95          2HB       ASN  95  -9.166 -14.533  -9.473
  739   HD21  ASN  95          1HD2      ASN  95  -7.750 -16.888  -7.361
  740   HD22  ASN  95          2HD2      ASN  95  -6.897 -17.767  -8.590
  741    H    ASN  96           H        ASN  96  -7.549 -11.862  -6.464
  742    HA   ASN  96           HA       ASN  96  -9.131 -10.017  -8.089
  743    HB2  ASN  96          1HB       ASN  96  -9.717  -9.437  -5.348
  744    HB3  ASN  96          2HB       ASN  96 -10.837  -9.855  -6.638
  745   HD21  ASN  96          1HD2      ASN  96 -11.588 -11.965  -6.789
  746   HD22  ASN  96          2HD2      ASN  96 -11.380 -13.106  -5.508
  747    H    ALA  97           H        ALA  97  -7.970  -8.277  -8.415
  748    HA   ALA  97           HA       ALA  97  -5.449  -7.881  -7.262
  749    HB1  ALA  97          1HB       ALA  97  -7.132  -5.882  -8.762
  750    HB2  ALA  97          2HB       ALA  97  -6.068  -7.083  -9.494
  751    HB3  ALA  97          3HB       ALA  97  -5.391  -5.796  -8.498
  752    H    CYS  98           H        CYS  98  -8.603  -6.618  -6.387
  753    HA   CYS  98           HA       CYS  98  -7.702  -4.483  -4.760
  754    HB2  CYS  98          1HB       CYS  98 -10.254  -6.082  -4.481
  755    HB3  CYS  98          2HB       CYS  98  -9.929  -4.512  -3.758
  756    H    HIS  99           H        HIS  99  -8.389  -7.889  -4.030
  757    HA   HIS  99           HA       HIS  99  -7.929  -7.486  -1.211
  758    HB2  HIS  99          1HB       HIS  99  -9.532  -9.196  -2.221
  759    HB3  HIS  99          2HB       HIS  99  -8.109 -10.142  -2.640
  760    HD1  HIS  99           HD1      HIS  99  -7.670 -11.930  -0.970
  761    HD2  HIS  99           HD2      HIS  99  -9.381  -8.554   0.774
  762    HE1  HIS  99           HE1      HIS  99  -7.946 -12.479   1.466
  763    HE2  HIS  99           HE2      HIS  99  -9.132 -10.497   2.458
  764    H    TRP 100           H        TRP 100  -6.127  -8.436  -3.988
  765    HA   TRP 100           HA       TRP 100  -3.968  -9.726  -2.689
  766    HB2  TRP 100          1HB       TRP 100  -4.506  -9.909  -5.129
  767    HB3  TRP 100          2HB       TRP 100  -3.928  -8.258  -5.345
  768    HD1  TRP 100           HD1      TRP 100  -1.729 -10.024  -2.946
  769    HE1  TRP 100           HE1      TRP 100   0.412 -10.835  -4.119
  770    HE3  TRP 100           HE3      TRP 100  -3.143  -9.337  -7.817
  771    HZ2  TRP 100           HZ2      TRP 100   1.373 -11.160  -6.747
  772    HZ3  TRP 100           HZ3      TRP 100  -1.556  -9.922  -9.597
  773    HH2  TRP 100           HH2      TRP 100   0.655 -10.817  -9.081
  774    H    ALA 101           H        ALA 101  -4.294  -6.433  -4.015
  775    HA   ALA 101           HA       ALA 101  -1.818  -5.466  -3.087
  776    HB1  ALA 101          1HB       ALA 101  -2.716  -3.247  -3.567
  777    HB2  ALA 101          2HB       ALA 101  -4.336  -3.928  -3.703
  778    HB3  ALA 101          3HB       ALA 101  -3.093  -4.378  -4.867
  779    H    PHE 102           H        PHE 102  -5.014  -5.566  -1.670
  780    HA   PHE 102           HA       PHE 102  -4.525  -3.763   0.423
  781    HB2  PHE 102          1HB       PHE 102  -6.769  -4.344  -0.322
  782    HB3  PHE 102          2HB       PHE 102  -6.561  -5.986   0.277
  783    HD1  PHE 102           HD1      PHE 102  -6.484  -2.440   1.403
  784    HD2  PHE 102           HD2      PHE 102  -7.266  -6.497   2.442
  785    HE1  PHE 102           HE1      PHE 102  -7.341  -1.714   3.592
  786    HE2  PHE 102           HE2      PHE 102  -8.123  -5.775   4.629
  787    HZ   PHE 102           HZ       PHE 102  -8.162  -3.381   5.208
  788    H    ARG 103           H        ARG 103  -4.031  -7.244   0.116
  789    HA   ARG 103           HA       ARG 103  -3.609  -7.665   2.910
  790    HB2  ARG 103          1HB       ARG 103  -4.280  -9.466   1.295
  791    HB3  ARG 103          2HB       ARG 103  -2.642  -9.414   0.659
  792    HG2  ARG 103          1HG       ARG 103  -1.718 -10.082   2.758
  793    HG3  ARG 103          2HG       ARG 103  -3.287  -9.957   3.539
  794    HD2  ARG 103          1HD       ARG 103  -2.598 -12.284   3.044
  795    HD3  ARG 103          2HD       ARG 103  -4.119 -11.829   2.292
  796    HE   ARG 103           HE       ARG 103  -1.542 -11.933   0.848
  797   HH11  ARG 103          1HH1      ARG 103  -4.985 -12.559   1.048
  798   HH12  ARG 103          2HH1      ARG 103  -5.119 -13.098  -0.598
  799   HH21  ARG 103          1HH2      ARG 103  -1.728 -12.684  -1.330
  800   HH22  ARG 103          2HH2      ARG 103  -3.286 -13.168  -1.940
  801    H    GLY 104           H        GLY 104  -1.566  -6.916   0.161
  802    HA2  GLY 104          1HA       GLY 104   0.943  -7.268   1.439
  803    HA3  GLY 104          2HA       GLY 104   0.631  -6.235   0.039
  804    H    PHE 105           H        PHE 105  -1.098  -4.395   0.993
  805    HA   PHE 105           HA       PHE 105   0.580  -2.608   2.363
  806    HB2  PHE 105          1HB       PHE 105  -1.031  -1.688   0.901
  807    HB3  PHE 105          2HB       PHE 105  -2.345  -2.555   1.681
  808    HD1  PHE 105           HD1      PHE 105  -3.803  -1.073   2.695
  809    HD2  PHE 105           HD2      PHE 105   0.386  -0.330   2.901
  810    HE1  PHE 105           HE1      PHE 105  -4.226   0.904   4.090
  811    HE2  PHE 105           HE2      PHE 105  -0.038   1.653   4.293
  812    HZ   PHE 105           HZ       PHE 105  -2.342   2.271   4.892
  813    H    LYS 106           H        LYS 106  -2.233  -4.472   3.402
  814    HA   LYS 106           HA       LYS 106  -2.422  -3.412   5.989
  815    HB2  LYS 106          1HB       LYS 106  -4.344  -4.472   5.362
  816    HB3  LYS 106          2HB       LYS 106  -3.508  -5.820   4.602
  817    HG2  LYS 106          1HG       LYS 106  -2.971  -6.670   6.875
  818    HG3  LYS 106          2HG       LYS 106  -3.943  -5.352   7.543
  819    HD2  LYS 106          1HD       LYS 106  -5.913  -6.180   6.416
  820    HD3  LYS 106          2HD       LYS 106  -4.964  -7.430   5.609
  821    HE2  LYS 106          1HE       LYS 106  -5.358  -7.188   8.587
  822    HE3  LYS 106          2HE       LYS 106  -6.237  -8.295   7.536
  823    HZ1  LYS 106          1HZ       LYS 106  -4.120  -9.336   6.963
  824    HZ2  LYS 106          2HZ       LYS 106  -4.421  -9.419   8.623
  825    HZ3  LYS 106          3HZ       LYS 106  -3.306  -8.299   8.024
  826    H    CYS 107           H        CYS 107  -0.691  -6.218   4.725
  827    HA   CYS 107           HA       CYS 107   0.217  -7.282   7.138
  828    HB2  CYS 107          1HB       CYS 107   0.416  -8.611   5.199
  829    HB3  CYS 107          2HB       CYS 107   1.293  -7.369   4.319
  830    H    PHE 108           H        PHE 108   1.610  -4.837   5.004
  831    HA   PHE 108           HA       PHE 108   4.084  -4.719   6.410
  832    HB2  PHE 108          1HB       PHE 108   3.645  -4.206   3.949
  833    HB3  PHE 108          2HB       PHE 108   3.052  -2.639   4.501
  834    HD1  PHE 108           HD1      PHE 108   5.975  -4.788   4.071
  835    HD2  PHE 108           HD2      PHE 108   4.594  -0.984   5.391
  836    HE1  PHE 108           HE1      PHE 108   8.283  -3.950   4.066
  837    HE2  PHE 108           HE2      PHE 108   6.903  -0.142   5.382
  838    HZ   PHE 108           HZ       PHE 108   8.749  -1.625   4.717
  839    H    GLN 109           H        GLN 109   1.219  -2.603   6.246
  840    HA   GLN 109           HA       GLN 109   2.303  -0.567   7.874
  841    HB2  GLN 109          1HB       GLN 109   0.077   0.350   7.967
  842    HB3  GLN 109          2HB       GLN 109   0.417  -0.199   6.335
  843    HG2  GLN 109          1HG       GLN 109  -1.573  -1.179   6.430
  844    HG3  GLN 109          2HG       GLN 109  -0.806  -2.381   7.475
  845   HE21  GLN 109          1HE2      GLN 109  -3.573  -1.455   7.416
  846   HE22  GLN 109          2HE2      GLN 109  -3.911  -0.854   9.000
  847    H    LYS 110           H        LYS 110   0.683  -3.546   8.634
  848    HA   LYS 110           HA       LYS 110  -0.164  -2.870  11.246
  849    HB2  LYS 110          1HB       LYS 110  -1.045  -4.761   9.891
  850    HB3  LYS 110          2HB       LYS 110   0.490  -5.584  10.100
  851    HG2  LYS 110          1HG       LYS 110   0.152  -5.782  12.443
  852    HG3  LYS 110          2HG       LYS 110  -1.299  -4.787  12.372
  853    HD2  LYS 110          1HD       LYS 110  -2.337  -6.506  10.911
  854    HD3  LYS 110          2HD       LYS 110  -0.907  -7.513  11.143
  855    HE2  LYS 110          1HE       LYS 110  -1.324  -7.578  13.542
  856    HE3  LYS 110          2HE       LYS 110  -2.725  -6.529  13.341
  857    HZ1  LYS 110          1HZ       LYS 110  -3.738  -8.260  11.958
  858    HZ2  LYS 110          2HZ       LYS 110  -3.428  -8.801  13.528
  859    HZ3  LYS 110          3HZ       LYS 110  -2.418  -9.274  12.256
  860    H    ASN 111           H        ASN 111   2.895  -3.595   9.924
  861    HA   ASN 111           HA       ASN 111   3.986  -4.045  12.624
  862    HB2  ASN 111          1HB       ASN 111   5.052  -5.073   9.987
  863    HB3  ASN 111          2HB       ASN 111   5.843  -5.261  11.550
  864   HD21  ASN 111          1HD2      ASN 111   3.163  -6.253   9.557
  865   HD22  ASN 111          2HD2      ASN 111   2.725  -7.629  10.503
  866    H    ASN 112           H        ASN 112   4.251  -2.267   9.631
  867    HA   ASN 112           HA       ASN 112   6.422  -0.664  10.805
  868    HB2  ASN 112          1HB       ASN 112   6.352  -1.908   8.056
  869    HB3  ASN 112          2HB       ASN 112   7.416  -0.558   8.475
  870   HD21  ASN 112          1HD2      ASN 112   7.753  -3.515   7.780
  871   HD22  ASN 112          2HD2      ASN 112   8.881  -4.072   8.974
  872    H    LEU 113           H        LEU 113   4.065   0.428  11.060
  873    HA   LEU 113           HA       LEU 113   3.143   1.754   8.690
  874    HB2  LEU 113          1HB       LEU 113   1.536   1.184  10.374
  875    HB3  LEU 113          2HB       LEU 113   2.397   2.113  11.586
  876    HG   LEU 113           HG       LEU 113   1.849   4.178  10.301
  877   HD11  LEU 113          1HD1      LEU 113   0.213   4.076   8.527
  878   HD12  LEU 113          2HD1      LEU 113   0.121   2.323   8.673
  879   HD13  LEU 113          3HD1      LEU 113   1.609   3.082   8.105
  880   HD21  LEU 113          1HD2      LEU 113   0.469   3.493  12.181
  881   HD22  LEU 113          2HD2      LEU 113  -0.480   2.449  11.125
  882   HD23  LEU 113          3HD2      LEU 113  -0.535   4.200  10.913
  883    H    SER 114           H        SER 114   5.199   2.579  11.402
  884    HA   SER 114           HA       SER 114   5.306   5.378  10.965
  885    HB2  SER 114          1HB       SER 114   6.046   4.214  13.061
  886    HB3  SER 114          2HB       SER 114   7.448   3.609  12.183
  887    HG   SER 114           HG       SER 114   7.973   5.493  13.323
  888    H    LEU 115           H        LEU 115   7.005   2.652   9.572
  889    HA   LEU 115           HA       LEU 115   8.996   4.132   8.195
  890    HB2  LEU 115          1HB       LEU 115   9.280   1.777   8.600
  891    HB3  LEU 115          2HB       LEU 115   7.819   1.395   7.711
  892    HG   LEU 115           HG       LEU 115   8.892   2.125   5.626
  893   HD11  LEU 115          1HD1      LEU 115  11.290   2.570   7.381
  894   HD12  LEU 115          2HD1      LEU 115  10.375   3.810   6.526
  895   HD13  LEU 115          3HD1      LEU 115  11.298   2.611   5.618
  896   HD21  LEU 115          1HD2      LEU 115   9.065  -0.221   6.385
  897   HD22  LEU 115          2HD2      LEU 115  10.606   0.168   7.151
  898   HD23  LEU 115          3HD2      LEU 115  10.436   0.288   5.400
  899    H    ILE 116           H        ILE 116   5.713   3.160   7.455
  900    HA   ILE 116           HA       ILE 116   5.760   3.835   4.704
  901    HB   ILE 116           HB       ILE 116   3.417   3.649   6.611
  902   HG12  ILE 116          1HG1      ILE 116   4.576   1.648   4.654
  903   HG13  ILE 116          2HG1      ILE 116   4.659   1.552   6.420
  904   HG21  ILE 116          1HG2      ILE 116   3.458   3.695   3.596
  905   HG22  ILE 116          2HG2      ILE 116   2.846   4.973   4.647
  906   HG23  ILE 116          3HG2      ILE 116   2.039   3.404   4.603
  907   HD11  ILE 116          1HD1      ILE 116   2.950   0.082   5.695
  908   HD12  ILE 116          2HD1      ILE 116   2.233   1.321   4.669
  909   HD13  ILE 116          3HD1      ILE 116   2.157   1.480   6.425
  910    H    LYS 117           H        LYS 117   4.768   5.565   7.618
  911    HA   LYS 117           HA       LYS 117   3.844   7.892   6.322
  912    HB2  LYS 117          1HB       LYS 117   4.794   7.366   9.125
  913    HB3  LYS 117          2HB       LYS 117   4.206   8.941   8.606
  914    HG2  LYS 117          1HG       LYS 117   2.055   7.961   8.025
  915    HG3  LYS 117          2HG       LYS 117   2.631   6.368   8.508
  916    HD2  LYS 117          1HD       LYS 117   2.875   7.092  10.793
  917    HD3  LYS 117          2HD       LYS 117   2.477   8.754  10.350
  918    HE2  LYS 117          1HE       LYS 117   0.230   8.027   9.682
  919    HE3  LYS 117          2HE       LYS 117   0.637   6.374  10.142
  920    HZ1  LYS 117          1HZ       LYS 117   0.613   8.698  11.991
  921    HZ2  LYS 117          2HZ       LYS 117   0.906   7.088  12.414
  922    HZ3  LYS 117          3HZ       LYS 117  -0.621   7.550  11.862
  923    H    ALA 118           H        ALA 118   6.991   6.916   7.546
  924    HA   ALA 118           HA       ALA 118   8.319   9.386   7.112
  925    HB1  ALA 118          1HB       ALA 118  10.358   8.097   7.365
  926    HB2  ALA 118          2HB       ALA 118   9.444   6.598   7.190
  927    HB3  ALA 118          3HB       ALA 118   9.175   7.637   8.589
  928    H    SER 119           H        SER 119   7.652   6.601   5.118
  929    HA   SER 119           HA       SER 119   9.410   7.013   3.020
  930    HB2  SER 119          1HB       SER 119   8.050   4.989   3.295
  931    HB3  SER 119          2HB       SER 119   6.597   5.907   2.904
  932    HG   SER 119           HG       SER 119   8.817   5.680   1.157
  933    H    ILE 120           H        ILE 120   6.155   8.347   3.487
  934    HA   ILE 120           HA       ILE 120   6.319   9.804   0.981
  935    HB   ILE 120           HB       ILE 120   4.042  10.640   1.622
  936   HG12  ILE 120          1HG1      ILE 120   4.257   8.598   3.834
  937   HG13  ILE 120          2HG1      ILE 120   4.416  10.335   4.088
  938   HG21  ILE 120          1HG2      ILE 120   4.275   8.753   0.146
  939   HG22  ILE 120          2HG2      ILE 120   2.934   8.458   1.255
  940   HG23  ILE 120          3HG2      ILE 120   4.487   7.667   1.518
  941   HD11  ILE 120          1HD1      ILE 120   1.989   8.927   3.008
  942   HD12  ILE 120          2HD1      ILE 120   2.149  10.661   3.278
  943   HD13  ILE 120          3HD1      ILE 120   2.190   9.552   4.645
  944    H    LYS 121           H        LYS 121   7.560  10.328   3.955
  945    HA   LYS 121           HA       LYS 121   6.831  13.092   4.266
  946    HB2  LYS 121          1HB       LYS 121   7.304  11.679   6.221
  947    HB3  LYS 121          2HB       LYS 121   8.967  11.484   5.675
  948    HG2  LYS 121          1HG       LYS 121   9.333  13.884   5.907
  949    HG3  LYS 121          2HG       LYS 121   7.660  14.091   6.419
  950    HD2  LYS 121          1HD       LYS 121   8.114  12.625   8.359
  951    HD3  LYS 121          2HD       LYS 121   9.808  12.547   7.862
  952    HE2  LYS 121          1HE       LYS 121   9.485  14.226   9.607
  953    HE3  LYS 121          2HE       LYS 121   9.992  14.972   8.093
  954    HZ1  LYS 121          1HZ       LYS 121   8.216  16.238   9.089
  955    HZ2  LYS 121          2HZ       LYS 121   7.220  14.875   9.152
  956    HZ3  LYS 121          3HZ       LYS 121   7.660  15.529   7.658
  957    H    LYS 122           H        LYS 122   7.698  14.702   3.219
  958    HA   LYS 122           HA       LYS 122  10.545  14.858   2.764
  959    HB2  LYS 122          1HB       LYS 122   8.990  13.865   0.670
  960    HB3  LYS 122          2HB       LYS 122   9.180  15.564   0.305
  961    HG2  LYS 122          1HG       LYS 122  11.613  15.341   0.503
  962    HG3  LYS 122          2HG       LYS 122  11.412  13.612   0.791
  963    HD2  LYS 122          1HD       LYS 122  10.497  13.282  -1.388
  964    HD3  LYS 122          2HD       LYS 122  10.400  15.020  -1.672
  965    HE2  LYS 122          1HE       LYS 122  12.928  13.413  -1.325
  966    HE3  LYS 122          2HE       LYS 122  12.301  14.037  -2.849
  967    HZ1  LYS 122          1HZ       LYS 122  13.220  15.655  -0.535
  968    HZ2  LYS 122          2HZ       LYS 122  12.542  16.290  -1.947
  969    HZ3  LYS 122          3HZ       LYS 122  14.020  15.477  -2.013
  970    H    ASP 123           H        ASP 123  11.136  16.827   3.228
  971    HA   ASP 123           HA       ASP 123   9.503  19.084   2.428
  972    HB2  ASP 123          1HB       ASP 123   8.702  18.435   4.702
  973    HB3  ASP 123          2HB       ASP 123  10.328  18.714   5.310
  974    H21  ACD 201           H21      ACD   1  -4.110   4.525   2.277
  975    H22  ACD 201           H22      ACD   1  -2.755   5.088   3.265
  976    H31  ACD 201           H31      ACD   1  -1.887   6.405   1.401
  977    H32  ACD 201           H32      ACD   1  -3.295   6.035   0.415
  978    H41  ACD 201           H41      ACD   1  -2.678   3.680   0.304
  979    H42  ACD 201           H42      ACD   1  -1.262   4.641  -0.134
  980    H5   ACD 201           H5       ACD   1  -1.603   2.977   2.397
  981    H6   ACD 201           H6       ACD   1   0.658   3.631   2.789
  982    H71  ACD 201           H71      ACD   1   0.936   4.864   0.199
  983    H72  ACD 201           H72      ACD   1   0.000   6.042   1.118
  984    H8   ACD 201           H8       ACD   1   1.908   6.407   2.682
  985    H9   ACD 201           H9       ACD   1   4.034   5.598   1.964
  986   H101  ACD 201          H101      ACD   1   2.987   4.822  -0.611
  987   H102  ACD 201          H102      ACD   1   2.504   3.497   0.454
  988    H11  ACD 201           H11      ACD   1   5.474   4.377   0.348
  989    H12  ACD 201           H12      ACD   1   5.792   2.040   0.062
  990   H131  ACD 201          H131      ACD   1   2.824   2.060  -0.642
  991   H132  ACD 201          H132      ACD   1   3.915   0.674  -0.705
  992    H14  ACD 201           H14      ACD   1   2.777   1.793   1.959
  993    H15  ACD 201           H15      ACD   1   2.644  -0.537   2.446
  994   H161  ACD 201          H161      ACD   1   2.870  -1.254  -0.358
  995   H162  ACD 201          H162      ACD   1   4.527  -0.908   0.147
  996   H171  ACD 201          H171      ACD   1   4.461  -2.594   1.864
  997   H172  ACD 201          H172      ACD   1   2.716  -2.790   1.696
  998   H181  ACD 201          H181      ACD   1   4.751  -3.454  -0.469
  999   H182  ACD 201          H182      ACD   1   3.006  -3.699  -0.581
 1000   H191  ACD 201          H191      ACD   1   4.899  -5.038   1.400
 1001   H192  ACD 201          H192      ACD   1   3.141  -5.216   1.436
 1002   H201  ACD 201          H201      ACD   1   4.931  -5.990  -0.879
 1003   H202  ACD 201          H202      ACD   1   3.211  -6.169  -0.836
 1004   H203  ACD 201          H203      ACD   1   4.201  -7.085   0.245
  Start of MODEL   23
    1    H1   MET   1          1H        MET   1  17.325  13.839 -13.591
    2    H2   MET   1          2H        MET   1  18.581  13.030 -12.804
    3    H3   MET   1          3H        MET   1  18.860  13.775 -14.294
    4    HA   MET   1           HA       MET   1  19.785  15.091 -12.533
    5    HB2  MET   1          1HB       MET   1  17.350  16.231 -13.899
    6    HB3  MET   1          2HB       MET   1  18.435  17.216 -12.928
    7    HG2  MET   1          1HG       MET   1  20.291  16.616 -14.407
    8    HG3  MET   1          2HG       MET   1  19.191  15.651 -15.387
    9    HE1  MET   1          1HE       MET   1  20.084  18.840 -17.569
   10    HE2  MET   1          2HE       MET   1  20.210  17.084 -17.456
   11    HE3  MET   1          3HE       MET   1  21.141  18.106 -16.363
   12    H    GLU   2           H        GLU   2  16.322  14.476 -12.093
   13    HA   GLU   2           HA       GLU   2  16.679  14.525  -9.237
   14    HB2  GLU   2          1HB       GLU   2  14.934  16.216  -8.816
   15    HB3  GLU   2          2HB       GLU   2  16.334  16.908  -9.624
   16    HG2  GLU   2          1HG       GLU   2  15.181  16.954 -11.715
   17    HG3  GLU   2          2HG       GLU   2  13.806  16.090 -11.030
   18    H    PHE   3           H        PHE   3  15.407  13.070  -8.334
   19    HA   PHE   3           HA       PHE   3  13.113  12.088  -9.880
   20    HB2  PHE   3          1HB       PHE   3  14.817  10.394  -9.446
   21    HB3  PHE   3          2HB       PHE   3  14.707  10.702  -7.710
   22    HD1  PHE   3           HD1      PHE   3  12.912   9.379 -10.642
   23    HD2  PHE   3           HD2      PHE   3  13.009   9.709  -6.405
   24    HE1  PHE   3           HE1      PHE   3  11.131   7.685 -10.474
   25    HE2  PHE   3           HE2      PHE   3  11.231   8.016  -6.224
   26    HZ   PHE   3           HZ       PHE   3  10.290   7.001  -8.262
   27    H    THR   4           H        THR   4  11.167  12.514  -9.143
   28    HA   THR   4           HA       THR   4  10.916  13.540  -6.427
   29    HB   THR   4           HB       THR   4   9.458  14.058  -8.949
   30    HG1  THR   4           HG1      THR   4  10.258  15.914  -8.453
   31   HG21  THR   4          1HG2      THR   4   7.604  13.202  -7.643
   32   HG22  THR   4          2HG2      THR   4   7.494  14.959  -7.727
   33   HG23  THR   4          3HG2      THR   4   8.089  14.181  -6.259
   34    H    VAL   5           H        VAL   5   9.751  12.551  -4.918
   35    HA   VAL   5           HA       VAL   5   8.439  10.004  -5.620
   36    HB   VAL   5           HB       VAL   5   8.945   9.170  -3.547
   37   HG11  VAL   5          1HG1      VAL   5  11.034   9.574  -4.586
   38   HG12  VAL   5          2HG1      VAL   5  11.197   9.852  -2.853
   39   HG13  VAL   5          3HG1      VAL   5  11.086  11.221  -3.960
   40   HG21  VAL   5          1HG2      VAL   5   9.176  11.943  -2.381
   41   HG22  VAL   5          2HG2      VAL   5   9.231  10.417  -1.496
   42   HG23  VAL   5          3HG2      VAL   5   7.739  10.927  -2.285
   43    H    SER   6           H        SER   6   6.383   9.560  -4.869
   44    HA   SER   6           HA       SER   6   4.606  11.763  -4.784
   45    HB2  SER   6          1HB       SER   6   2.931   9.909  -4.201
   46    HB3  SER   6          2HB       SER   6   3.781   9.764  -5.741
   47    HG   SER   6           HG       SER   6   4.508   8.474  -3.317
   48    H    THR   7           H        THR   7   5.067  13.085  -3.052
   49    HA   THR   7           HA       THR   7   5.389  12.075  -0.387
   50    HB   THR   7           HB       THR   7   5.398  14.431   0.304
   51    HG1  THR   7           HG1      THR   7   4.669  14.881  -2.424
   52   HG21  THR   7          1HG2      THR   7   7.037  13.955  -2.186
   53   HG22  THR   7          2HG2      THR   7   7.467  13.441  -0.555
   54   HG23  THR   7          3HG2      THR   7   7.368  15.158  -0.940
   55    H    THR   8           H        THR   8   3.993  13.613   1.259
   56    HA   THR   8           HA       THR   8   1.542  12.441   1.582
   57    HB   THR   8           HB       THR   8   2.297  15.228   2.461
   58    HG1  THR   8           HG1      THR   8   3.363  12.846   3.084
   59   HG21  THR   8          1HG2      THR   8   0.760  14.741   4.341
   60   HG22  THR   8          2HG2      THR   8   0.296  13.245   3.528
   61   HG23  THR   8          3HG2      THR   8  -0.050  14.802   2.775
   62    H    GLU   9           H        GLU   9   2.092  15.707   0.229
   63    HA   GLU   9           HA       GLU   9  -0.576  16.262  -0.351
   64    HB2  GLU   9          1HB       GLU   9   1.932  17.288  -1.676
   65    HB3  GLU   9          2HB       GLU   9   0.327  17.947  -1.951
   66    HG2  GLU   9          1HG       GLU   9   0.152  18.587   0.365
   67    HG3  GLU   9          2HG       GLU   9   1.712  17.846   0.711
   68    H    ASP  10           H        ASP  10   1.944  14.797  -2.373
   69    HA   ASP  10           HA       ASP  10   0.418  14.594  -4.730
   70    HB2  ASP  10          1HB       ASP  10   2.616  12.715  -3.829
   71    HB3  ASP  10          2HB       ASP  10   2.013  12.925  -5.471
   72    H    LEU  11           H        LEU  11   0.860  12.431  -1.985
   73    HA   LEU  11           HA       LEU  11  -0.645  10.287  -2.941
   74    HB2  LEU  11          1HB       LEU  11   0.766   9.959  -1.058
   75    HB3  LEU  11          2HB       LEU  11  -0.071  11.202  -0.122
   76    HG   LEU  11           HG       LEU  11  -2.094   9.757  -0.148
   77   HD11  LEU  11          1HD1      LEU  11  -1.530   8.501  -2.184
   78   HD12  LEU  11          2HD1      LEU  11  -1.924   7.454  -0.822
   79   HD13  LEU  11          3HD1      LEU  11  -0.241   7.687  -1.297
   80   HD21  LEU  11          1HD2      LEU  11   0.342   8.393   0.984
   81   HD22  LEU  11          2HD2      LEU  11  -1.321   8.247   1.555
   82   HD23  LEU  11          3HD2      LEU  11  -0.462   9.777   1.723
   83    H    GLN  12           H        GLN  12  -1.598  13.089  -0.987
   84    HA   GLN  12           HA       GLN  12  -4.271  12.343  -0.557
   85    HB2  GLN  12          1HB       GLN  12  -2.972  15.065  -0.703
   86    HB3  GLN  12          2HB       GLN  12  -4.640  14.816  -0.215
   87    HG2  GLN  12          1HG       GLN  12  -3.927  13.543   1.707
   88    HG3  GLN  12          2HG       GLN  12  -2.249  13.638   1.183
   89   HE21  GLN  12          1HE2      GLN  12  -4.907  15.351   2.611
   90   HE22  GLN  12          2HE2      GLN  12  -3.999  16.725   3.143
   91    H    ARG  13           H        ARG  13  -2.672  13.933  -3.197
   92    HA   ARG  13           HA       ARG  13  -4.960  14.869  -4.561
   93    HB2  ARG  13          1HB       ARG  13  -2.650  15.696  -4.899
   94    HB3  ARG  13          2HB       ARG  13  -2.237  14.169  -5.664
   95    HG2  ARG  13          1HG       ARG  13  -3.732  14.607  -7.483
   96    HG3  ARG  13          2HG       ARG  13  -4.348  16.062  -6.673
   97    HD2  ARG  13          1HD       ARG  13  -2.751  16.664  -8.391
   98    HD3  ARG  13          2HD       ARG  13  -2.118  17.058  -6.796
   99    HE   ARG  13           HE       ARG  13  -1.261  14.762  -8.437
  100   HH11  ARG  13          1HH1      ARG  13  -0.643  17.110  -5.905
  101   HH12  ARG  13          2HH1      ARG  13   1.036  16.703  -5.763
  102   HH21  ARG  13          1HH2      ARG  13   0.969  14.230  -8.240
  103   HH22  ARG  13          2HH2      ARG  13   1.949  15.057  -7.064
  104    H    TYR  14           H        TYR  14  -3.084  11.862  -4.749
  105    HA   TYR  14           HA       TYR  14  -4.497  10.809  -6.990
  106    HB2  TYR  14          1HB       TYR  14  -2.914   9.332  -4.877
  107    HB3  TYR  14          2HB       TYR  14  -3.447   8.676  -6.416
  108    HD1  TYR  14           HD1      TYR  14  -2.824  10.908  -8.253
  109    HD2  TYR  14           HD2      TYR  14  -0.575   9.283  -5.023
  110    HE1  TYR  14           HE1      TYR  14  -0.748  11.672  -9.321
  111    HE2  TYR  14           HE2      TYR  14   1.506  10.056  -6.083
  112    HH   TYR  14           HH       TYR  14   2.318  10.628  -8.348
  113    H    ARG  15           H        ARG  15  -4.929  10.587  -3.510
  114    HA   ARG  15           HA       ARG  15  -6.815   8.490  -3.534
  115    HB2  ARG  15          1HB       ARG  15  -6.796  10.662  -1.451
  116    HB3  ARG  15          2HB       ARG  15  -7.240   8.976  -1.278
  117    HG2  ARG  15          1HG       ARG  15  -4.849   8.390  -1.776
  118    HG3  ARG  15          2HG       ARG  15  -4.487  10.108  -1.614
  119    HD2  ARG  15          1HD       ARG  15  -5.751   8.380   0.509
  120    HD3  ARG  15          2HD       ARG  15  -4.058   8.859   0.464
  121    HE   ARG  15           HE       ARG  15  -5.651  11.168   0.413
  122   HH11  ARG  15          1HH1      ARG  15  -4.914   8.492   2.546
  123   HH12  ARG  15          2HH1      ARG  15  -5.017   9.454   3.989
  124   HH21  ARG  15          1HH2      ARG  15  -5.826  12.428   2.321
  125   HH22  ARG  15          2HH2      ARG  15  -5.530  11.691   3.862
  126    H    THR  16           H        THR  16  -7.062  11.903  -4.088
  127    HA   THR  16           HA       THR  16  -9.819  12.231  -3.827
  128    HB   THR  16           HB       THR  16  -7.732  13.615  -5.491
  129    HG1  THR  16           HG1      THR  16  -7.585  14.815  -3.768
  130   HG21  THR  16          1HG2      THR  16  -9.388  15.350  -6.020
  131   HG22  THR  16          2HG2      THR  16 -10.651  14.359  -5.288
  132   HG23  THR  16          3HG2      THR  16  -9.816  13.795  -6.738
  133    H    GLU  17           H        GLU  17  -7.849  11.405  -6.671
  134    HA   GLU  17           HA       GLU  17 -10.055  11.275  -8.446
  135    HB2  GLU  17          1HB       GLU  17  -7.554   9.734  -9.017
  136    HB3  GLU  17          2HB       GLU  17  -8.543  10.693 -10.098
  137    HG2  GLU  17          1HG       GLU  17  -7.732  12.735  -8.903
  138    HG3  GLU  17          2HG       GLU  17  -6.574  11.701  -8.065
  139    H    CYS  18           H        CYS  18  -8.322   8.817  -6.563
  140    HA   CYS  18           HA       CYS  18  -9.696   6.606  -7.684
  141    HB2  CYS  18          1HB       CYS  18  -8.225   6.901  -5.061
  142    HB3  CYS  18          2HB       CYS  18  -8.930   5.382  -5.631
  143    H    VAL  19           H        VAL  19 -10.410   8.765  -5.027
  144    HA   VAL  19           HA       VAL  19 -12.485   7.242  -3.890
  145    HB   VAL  19           HB       VAL  19 -11.675  10.110  -3.703
  146   HG11  VAL  19          1HG1      VAL  19 -14.206   8.988  -2.511
  147   HG12  VAL  19          2HG1      VAL  19 -14.111  10.193  -3.800
  148   HG13  VAL  19          3HG1      VAL  19 -13.518  10.579  -2.181
  149   HG21  VAL  19          1HG2      VAL  19 -10.504   8.480  -2.358
  150   HG22  VAL  19          2HG2      VAL  19 -12.029   7.880  -1.707
  151   HG23  VAL  19          3HG2      VAL  19 -11.486   9.514  -1.321
  152    H    SER  20           H        SER  20 -12.527   9.972  -6.130
  153    HA   SER  20           HA       SER  20 -15.325  10.024  -6.455
  154    HB2  SER  20          1HB       SER  20 -13.663  11.867  -6.942
  155    HB3  SER  20          2HB       SER  20 -13.266  11.014  -8.432
  156    HG   SER  20           HG       SER  20 -15.342  11.341  -9.164
  157    H    SER  21           H        SER  21 -12.824   8.126  -8.021
  158    HA   SER  21           HA       SER  21 -14.500   7.418 -10.267
  159    HB2  SER  21          1HB       SER  21 -11.804   6.356  -9.403
  160    HB3  SER  21          2HB       SER  21 -12.589   6.031 -10.951
  161    HG   SER  21           HG       SER  21 -11.338   8.345 -10.017
  162    H    LEU  22           H        LEU  22 -13.212   5.760  -7.370
  163    HA   LEU  22           HA       LEU  22 -14.625   3.336  -8.069
  164    HB2  LEU  22          1HB       LEU  22 -12.892   4.108  -5.729
  165    HB3  LEU  22          2HB       LEU  22 -13.700   2.543  -5.841
  166    HG   LEU  22           HG       LEU  22 -11.764   3.557  -7.917
  167   HD11  LEU  22          1HD1      LEU  22 -10.143   2.022  -6.871
  168   HD12  LEU  22          2HD1      LEU  22 -11.287   1.739  -5.558
  169   HD13  LEU  22          3HD1      LEU  22 -10.599   3.345  -5.798
  170   HD21  LEU  22          1HD2      LEU  22 -13.371   1.843  -8.634
  171   HD22  LEU  22          2HD2      LEU  22 -12.824   0.801  -7.317
  172   HD23  LEU  22          3HD2      LEU  22 -11.713   1.243  -8.616
  173    H    ASN  23           H        ASN  23 -15.846   6.050  -7.109
  174    HA   ASN  23           HA       ASN  23 -17.646   6.783  -5.925
  175    HB2  ASN  23          1HB       ASN  23 -18.420   3.876  -6.169
  176    HB3  ASN  23          2HB       ASN  23 -19.491   5.146  -5.616
  177   HD21  ASN  23          1HD2      ASN  23 -20.946   4.909  -7.254
  178   HD22  ASN  23          2HD2      ASN  23 -20.599   5.347  -8.896
  179    H    ILE  24           H        ILE  24 -15.379   6.186  -4.368
  180    HA   ILE  24           HA       ILE  24 -16.050   4.756  -2.008
  181    HB   ILE  24           HB       ILE  24 -13.988   6.942  -2.270
  182   HG12  ILE  24          1HG1      ILE  24 -13.680   5.278  -4.077
  183   HG13  ILE  24          2HG1      ILE  24 -12.370   5.216  -2.902
  184   HG21  ILE  24          1HG2      ILE  24 -14.179   4.555  -0.438
  185   HG22  ILE  24          2HG2      ILE  24 -14.435   6.242   0.009
  186   HG23  ILE  24          3HG2      ILE  24 -12.834   5.696  -0.493
  187   HD11  ILE  24          1HD1      ILE  24 -13.381   3.238  -1.888
  188   HD12  ILE  24          2HD1      ILE  24 -13.048   2.994  -3.604
  189   HD13  ILE  24          3HD1      ILE  24 -14.697   3.313  -3.061
  190    HA   PRO  25           HA       PRO  25 -18.745   7.902  -0.265
  191    HB2  PRO  25          1HB       PRO  25 -18.367   6.386   2.218
  192    HB3  PRO  25          2HB       PRO  25 -19.849   6.733   1.325
  193    HG2  PRO  25          1HG       PRO  25 -18.752   4.279   1.414
  194    HG3  PRO  25          2HG       PRO  25 -19.656   4.882   0.015
  195    HD2  PRO  25          1HD       PRO  25 -16.707   4.588   0.386
  196    HD3  PRO  25          2HD       PRO  25 -17.696   4.367  -1.078
  197    H    ALA  26           H        ALA  26 -18.431   9.707   0.879
  198    HA   ALA  26           HA       ALA  26 -15.912  10.661   1.559
  199    HB1  ALA  26          1HB       ALA  26 -18.564  11.522   2.707
  200    HB2  ALA  26          2HB       ALA  26 -17.884  12.073   1.177
  201    HB3  ALA  26          3HB       ALA  26 -17.076  12.469   2.694
  202    H    ASP  27           H        ASP  27 -18.304   8.994   3.498
  203    HA   ASP  27           HA       ASP  27 -17.326   9.150   6.049
  204    HB2  ASP  27          1HB       ASP  27 -19.328   7.954   5.633
  205    HB3  ASP  27          2HB       ASP  27 -18.525   6.824   4.553
  206    H    TYR  28           H        TYR  28 -16.345   6.692   3.643
  207    HA   TYR  28           HA       TYR  28 -14.293   5.564   5.149
  208    HB2  TYR  28          1HB       TYR  28 -14.958   5.638   2.245
  209    HB3  TYR  28          2HB       TYR  28 -13.394   4.990   2.738
  210    HD1  TYR  28           HD1      TYR  28 -13.228   2.775   3.506
  211    HD2  TYR  28           HD2      TYR  28 -17.050   4.626   3.300
  212    HE1  TYR  28           HE1      TYR  28 -14.291   0.624   4.020
  213    HE2  TYR  28           HE2      TYR  28 -18.127   2.471   3.805
  214    HH   TYR  28           HH       TYR  28 -16.176  -0.420   4.523
  215    H    VAL  29           H        VAL  29 -14.295   8.324   2.979
  216    HA   VAL  29           HA       VAL  29 -11.543   8.678   2.682
  217    HB   VAL  29           HB       VAL  29 -13.686  10.791   2.713
  218   HG11  VAL  29          1HG1      VAL  29 -12.100  12.043   1.284
  219   HG12  VAL  29          2HG1      VAL  29 -10.890  10.797   1.600
  220   HG13  VAL  29          3HG1      VAL  29 -11.503  11.787   2.924
  221   HG21  VAL  29          1HG2      VAL  29 -14.218   9.088   1.117
  222   HG22  VAL  29          2HG2      VAL  29 -12.567   9.092   0.501
  223   HG23  VAL  29          3HG2      VAL  29 -13.605  10.497   0.248
  224    H    GLU  30           H        GLU  30 -13.770   9.960   5.147
  225    HA   GLU  30           HA       GLU  30 -11.832  11.523   6.513
  226    HB2  GLU  30          1HB       GLU  30 -14.185  10.285   7.903
  227    HB3  GLU  30          2HB       GLU  30 -13.425  11.851   8.166
  228    HG2  GLU  30          1HG       GLU  30 -14.230  12.511   5.896
  229    HG3  GLU  30          2HG       GLU  30 -15.191  11.036   5.891
  230    H    LYS  31           H        LYS  31 -12.749   8.164   6.679
  231    HA   LYS  31           HA       LYS  31 -11.412   7.491   9.072
  232    HB2  LYS  31          1HB       LYS  31 -11.979   5.752   6.666
  233    HB3  LYS  31          2HB       LYS  31 -11.463   5.176   8.244
  234    HG2  LYS  31          1HG       LYS  31 -13.520   6.181   9.213
  235    HG3  LYS  31          2HG       LYS  31 -14.048   6.546   7.570
  236    HD2  LYS  31          1HD       LYS  31 -13.839   4.116   7.038
  237    HD3  LYS  31          2HD       LYS  31 -13.498   3.827   8.757
  238    HE2  LYS  31          1HE       LYS  31 -15.999   5.152   7.702
  239    HE3  LYS  31          2HE       LYS  31 -15.882   3.450   8.148
  240    HZ1  LYS  31          1HZ       LYS  31 -16.821   4.759   9.933
  241    HZ2  LYS  31          2HZ       LYS  31 -15.461   5.760   9.967
  242    HZ3  LYS  31          3HZ       LYS  31 -15.323   4.132  10.406
  243    H    PHE  32           H        PHE  32 -10.393   7.310   5.672
  244    HA   PHE  32           HA       PHE  32  -7.867   6.220   6.075
  245    HB2  PHE  32          1HB       PHE  32  -8.652   8.163   3.902
  246    HB3  PHE  32          2HB       PHE  32  -7.304   7.031   3.858
  247    HD1  PHE  32           HD1      PHE  32  -9.918   7.433   2.058
  248    HD2  PHE  32           HD2      PHE  32  -8.679   4.632   5.012
  249    HE1  PHE  32           HE1      PHE  32 -11.383   5.728   1.056
  250    HE2  PHE  32           HE2      PHE  32 -10.138   2.926   4.013
  251    HZ   PHE  32           HZ       PHE  32 -11.490   3.467   2.028
  252    H    LYS  33           H        LYS  33  -8.962   9.533   6.316
  253    HA   LYS  33           HA       LYS  33  -6.497  10.853   6.479
  254    HB2  LYS  33          1HB       LYS  33  -8.905  11.821   6.436
  255    HB3  LYS  33          2HB       LYS  33  -8.863  11.593   8.182
  256    HG2  LYS  33          1HG       LYS  33  -6.921  13.031   8.359
  257    HG3  LYS  33          2HG       LYS  33  -6.908  13.247   6.601
  258    HD2  LYS  33          1HD       LYS  33  -9.167  14.246   6.750
  259    HD3  LYS  33          2HD       LYS  33  -9.097  14.094   8.506
  260    HE2  LYS  33          1HE       LYS  33  -7.177  15.695   6.818
  261    HE3  LYS  33          2HE       LYS  33  -8.536  16.364   7.717
  262    HZ1  LYS  33          1HZ       LYS  33  -7.516  15.572   9.764
  263    HZ2  LYS  33          2HZ       LYS  33  -6.482  16.618   8.934
  264    HZ3  LYS  33          3HZ       LYS  33  -6.204  14.953   8.895
  265    H    LYS  34           H        LYS  34  -8.342   9.049   8.865
  266    HA   LYS  34           HA       LYS  34  -6.396   9.616  10.963
  267    HB2  LYS  34          1HB       LYS  34  -8.985   8.059  10.956
  268    HB3  LYS  34          2HB       LYS  34  -7.951   8.219  12.368
  269    HG2  LYS  34          1HG       LYS  34  -8.364  10.553  12.500
  270    HG3  LYS  34          2HG       LYS  34  -9.135  10.568  10.911
  271    HD2  LYS  34          1HD       LYS  34 -10.819  10.647  12.663
  272    HD3  LYS  34          2HD       LYS  34 -10.924   9.123  11.781
  273    HE2  LYS  34          1HE       LYS  34  -9.370   8.229  13.657
  274    HE3  LYS  34          2HE       LYS  34  -9.920   9.645  14.550
  275    HZ1  LYS  34          1HZ       LYS  34 -11.301   7.776  15.067
  276    HZ2  LYS  34          2HZ       LYS  34 -11.613   7.479  13.431
  277    HZ3  LYS  34          3HZ       LYS  34 -12.215   8.882  14.170
  278    H    TRP  35           H        TRP  35  -5.906   7.894   8.512
  279    HA   TRP  35           HA       TRP  35  -5.115   5.879   7.859
  280    HB2  TRP  35          1HB       TRP  35  -3.906   6.127  10.613
  281    HB3  TRP  35          2HB       TRP  35  -3.425   4.885   9.448
  282    HD1  TRP  35           HD1      TRP  35  -3.282   8.681  10.014
  283    HE1  TRP  35           HE1      TRP  35  -1.441   9.678   8.508
  284    HE3  TRP  35           HE3      TRP  35  -2.094   4.505   7.302
  285    HZ2  TRP  35           HZ2      TRP  35   0.272   8.810   6.449
  286    HZ3  TRP  35           HZ3      TRP  35  -0.351   4.680   5.581
  287    HH2  TRP  35           HH2      TRP  35   0.812   6.778   5.160
  288    H    GLU  36           H        GLU  36  -7.719   5.662   8.706
  289    HA   GLU  36           HA       GLU  36  -7.821   3.055  10.051
  290    HB2  GLU  36          1HB       GLU  36  -9.968   5.112   9.546
  291    HB3  GLU  36          2HB       GLU  36 -10.302   3.498  10.141
  292    HG2  GLU  36          1HG       GLU  36  -8.873   3.999  12.106
  293    HG3  GLU  36          2HG       GLU  36  -8.720   5.647  11.507
  294    H    PHE  37           H        PHE  37  -7.777   1.411   8.675
  295    HA   PHE  37           HA       PHE  37  -9.187   1.716   6.105
  296    HB2  PHE  37          1HB       PHE  37  -6.842  -0.098   6.728
  297    HB3  PHE  37          2HB       PHE  37  -7.610   0.094   5.156
  298    HD1  PHE  37           HD1      PHE  37  -5.525   1.735   7.701
  299    HD2  PHE  37           HD2      PHE  37  -7.101   1.962   3.752
  300    HE1  PHE  37           HE1      PHE  37  -3.996   3.595   7.199
  301    HE2  PHE  37           HE2      PHE  37  -5.582   3.825   3.252
  302    HZ   PHE  37           HZ       PHE  37  -4.025   4.644   4.972
  303    HA   PRO  38           HA       PRO  38 -11.786  -1.380   8.325
  304    HB2  PRO  38          1HB       PRO  38 -13.489  -0.597   6.019
  305    HB3  PRO  38          2HB       PRO  38 -13.905  -0.776   7.735
  306    HG2  PRO  38          1HG       PRO  38 -13.664   1.641   6.685
  307    HG3  PRO  38          2HG       PRO  38 -13.014   1.293   8.298
  308    HD2  PRO  38          1HD       PRO  38 -11.547   1.507   5.682
  309    HD3  PRO  38          2HD       PRO  38 -11.094   2.137   7.298
  310    H    GLU  39           H        GLU  39 -12.218  -3.460   7.837
  311    HA   GLU  39           HA       GLU  39 -10.877  -4.548   5.528
  312    HB2  GLU  39          1HB       GLU  39 -10.632  -5.577   7.751
  313    HB3  GLU  39          2HB       GLU  39 -12.348  -5.956   7.757
  314    HG2  GLU  39          1HG       GLU  39 -11.999  -7.352   5.743
  315    HG3  GLU  39          2HG       GLU  39 -10.270  -7.039   5.872
  316    H    ASP  40           H        ASP  40 -12.299  -3.653   3.947
  317    HA   ASP  40           HA       ASP  40 -14.290  -5.580   3.175
  318    HB2  ASP  40          1HB       ASP  40 -16.127  -4.020   2.865
  319    HB3  ASP  40          2HB       ASP  40 -15.635  -4.024   4.551
  320    H    ASP  41           H        ASP  41 -15.172  -5.025   0.989
  321    HA   ASP  41           HA       ASP  41 -12.882  -5.022  -0.645
  322    HB2  ASP  41          1HB       ASP  41 -14.406  -5.344  -2.526
  323    HB3  ASP  41          2HB       ASP  41 -14.841  -6.384  -1.177
  324    H    THR  42           H        THR  42 -15.021  -2.457   0.254
  325    HA   THR  42           HA       THR  42 -14.604  -0.703  -1.915
  326    HB   THR  42           HB       THR  42 -15.109  -0.023   0.984
  327    HG1  THR  42           HG1      THR  42 -16.998  -0.859   0.586
  328   HG21  THR  42          1HG2      THR  42 -14.355   1.911  -0.252
  329   HG22  THR  42          2HG2      THR  42 -16.085   2.049   0.057
  330   HG23  THR  42          3HG2      THR  42 -15.508   1.572  -1.541
  331    H    THR  43           H        THR  43 -13.077  -0.646   1.311
  332    HA   THR  43           HA       THR  43 -11.067   1.194   0.775
  333    HB   THR  43           HB       THR  43 -10.908  -1.173   2.649
  334    HG1  THR  43           HG1      THR  43 -11.793   0.320   4.178
  335   HG21  THR  43          1HG2      THR  43  -9.438   0.368   3.965
  336   HG22  THR  43          2HG2      THR  43  -9.457   1.474   2.590
  337   HG23  THR  43          3HG2      THR  43  -8.753  -0.133   2.418
  338    H    MET  44           H        MET  44 -11.249  -2.235   0.115
  339    HA   MET  44           HA       MET  44  -8.487  -2.681  -0.240
  340    HB2  MET  44          1HB       MET  44 -10.836  -4.233  -1.308
  341    HB3  MET  44          2HB       MET  44  -9.175  -4.808  -1.282
  342    HG2  MET  44          1HG       MET  44  -9.180  -4.687   1.160
  343    HG3  MET  44          2HG       MET  44 -10.841  -4.108   1.123
  344    HE1  MET  44          1HE       MET  44  -9.935  -6.567   2.878
  345    HE2  MET  44          2HE       MET  44 -11.279  -7.671   2.578
  346    HE3  MET  44          3HE       MET  44 -11.584  -5.946   2.788
  347    H    CYS  45           H        CYS  45 -11.086  -2.281  -2.674
  348    HA   CYS  45           HA       CYS  45  -9.321  -2.335  -4.889
  349    HB2  CYS  45          1HB       CYS  45 -12.072  -1.087  -4.673
  350    HB3  CYS  45          2HB       CYS  45 -11.212  -1.393  -6.174
  351    H    TYR  46           H        TYR  46 -10.384   0.164  -2.728
  352    HA   TYR  46           HA       TYR  46  -9.536   2.431  -4.118
  353    HB2  TYR  46          1HB       TYR  46 -10.872   2.817  -2.246
  354    HB3  TYR  46          2HB       TYR  46  -9.922   1.744  -1.225
  355    HD1  TYR  46           HD1      TYR  46  -9.665   4.998  -3.054
  356    HD2  TYR  46           HD2      TYR  46  -8.412   2.642   0.264
  357    HE1  TYR  46           HE1      TYR  46  -8.471   6.940  -2.127
  358    HE2  TYR  46           HE2      TYR  46  -7.211   4.572   1.192
  359    HH   TYR  46           HH       TYR  46  -6.392   6.659   0.689
  360    H    ILE  47           H        ILE  47  -7.820   0.274  -1.905
  361    HA   ILE  47           HA       ILE  47  -5.439   1.719  -1.761
  362    HB   ILE  47           HB       ILE  47  -5.973  -1.215  -1.375
  363   HG12  ILE  47          1HG1      ILE  47  -7.019   0.253   0.273
  364   HG13  ILE  47          2HG1      ILE  47  -5.702  -0.644   1.022
  365   HG21  ILE  47          1HG2      ILE  47  -3.745  -1.322  -0.272
  366   HG22  ILE  47          2HG2      ILE  47  -3.411   0.299  -0.886
  367   HG23  ILE  47          3HG2      ILE  47  -3.658  -1.035  -2.011
  368   HD11  ILE  47          1HD1      ILE  47  -5.602   1.575   1.834
  369   HD12  ILE  47          2HD1      ILE  47  -5.737   2.252   0.213
  370   HD13  ILE  47          3HD1      ILE  47  -4.268   1.399   0.691
  371    H    LYS  48           H        LYS  48  -6.440  -0.803  -4.105
  372    HA   LYS  48           HA       LYS  48  -3.833  -0.912  -5.210
  373    HB2  LYS  48          1HB       LYS  48  -5.259  -1.790  -7.303
  374    HB3  LYS  48          2HB       LYS  48  -4.740  -2.805  -5.984
  375    HG2  LYS  48          1HG       LYS  48  -6.924  -2.629  -4.967
  376    HG3  LYS  48          2HG       LYS  48  -7.434  -1.474  -6.203
  377    HD2  LYS  48          1HD       LYS  48  -6.591  -4.330  -6.721
  378    HD3  LYS  48          2HD       LYS  48  -8.257  -3.752  -6.676
  379    HE2  LYS  48          1HE       LYS  48  -7.824  -2.294  -8.575
  380    HE3  LYS  48          2HE       LYS  48  -6.133  -2.780  -8.593
  381    HZ1  LYS  48          1HZ       LYS  48  -6.665  -4.899  -9.363
  382    HZ2  LYS  48          2HZ       LYS  48  -7.701  -3.883 -10.237
  383    HZ3  LYS  48          3HZ       LYS  48  -8.297  -4.761  -8.924
  384    H    CYS  49           H        CYS  49  -6.775   0.876  -6.097
  385    HA   CYS  49           HA       CYS  49  -5.875   2.013  -8.460
  386    HB2  CYS  49          1HB       CYS  49  -8.143   2.309  -7.853
  387    HB3  CYS  49          2HB       CYS  49  -7.727   3.130  -6.351
  388    H    VAL  50           H        VAL  50  -5.466   3.190  -5.130
  389    HA   VAL  50           HA       VAL  50  -4.030   5.507  -5.751
  390    HB   VAL  50           HB       VAL  50  -4.117   3.820  -3.255
  391   HG11  VAL  50          1HG1      VAL  50  -3.116   5.726  -2.086
  392   HG12  VAL  50          2HG1      VAL  50  -2.882   6.547  -3.630
  393   HG13  VAL  50          3HG1      VAL  50  -2.011   5.051  -3.285
  394   HG21  VAL  50          1HG2      VAL  50  -5.429   6.402  -4.055
  395   HG22  VAL  50          2HG2      VAL  50  -5.497   5.704  -2.437
  396   HG23  VAL  50          3HG2      VAL  50  -6.212   4.843  -3.801
  397    H    PHE  51           H        PHE  51  -3.010   2.235  -4.949
  398    HA   PHE  51           HA       PHE  51  -0.243   2.748  -4.952
  399    HB2  PHE  51          1HB       PHE  51  -1.988   0.350  -4.915
  400    HB3  PHE  51          2HB       PHE  51  -0.312   0.112  -5.392
  401    HD1  PHE  51           HD1      PHE  51  -1.419   2.638  -2.948
  402    HD2  PHE  51           HD2      PHE  51   0.315  -1.207  -3.516
  403    HE1  PHE  51           HE1      PHE  51  -0.797   2.568  -0.569
  404    HE2  PHE  51           HE2      PHE  51   0.937  -1.281  -1.140
  405    HZ   PHE  51           HZ       PHE  51   0.384   0.608   0.338
  406    H    ASN  52           H        ASN  52  -2.523   2.232  -7.455
  407    HA   ASN  52           HA       ASN  52  -0.632   1.523  -9.516
  408    HB2  ASN  52          1HB       ASN  52  -3.536   2.353  -9.535
  409    HB3  ASN  52          2HB       ASN  52  -2.613   2.256 -11.035
  410   HD21  ASN  52          1HD2      ASN  52  -1.052   0.006 -10.464
  411   HD22  ASN  52          2HD2      ASN  52  -2.092  -1.368 -10.384
  412    H    LYS  53           H        LYS  53  -2.316   4.401  -8.433
  413    HA   LYS  53           HA       LYS  53  -1.395   6.163 -10.432
  414    HB2  LYS  53          1HB       LYS  53  -2.544   6.511  -7.684
  415    HB3  LYS  53          2HB       LYS  53  -1.992   7.904  -8.605
  416    HG2  LYS  53          1HG       LYS  53  -3.951   5.970  -9.783
  417    HG3  LYS  53          2HG       LYS  53  -4.485   7.233  -8.673
  418    HD2  LYS  53          1HD       LYS  53  -3.513   8.933 -10.128
  419    HD3  LYS  53          2HD       LYS  53  -2.944   7.676 -11.229
  420    HE2  LYS  53          1HE       LYS  53  -5.164   7.071 -11.822
  421    HE3  LYS  53          2HE       LYS  53  -5.846   8.036 -10.513
  422    HZ1  LYS  53          1HZ       LYS  53  -6.047   9.090 -12.711
  423    HZ2  LYS  53          2HZ       LYS  53  -4.361   9.161 -12.825
  424    HZ3  LYS  53          3HZ       LYS  53  -5.168  10.031 -11.612
  425    H    MET  54           H        MET  54  -0.040   5.040  -7.431
  426    HA   MET  54           HA       MET  54   2.031   7.074  -7.426
  427    HB2  MET  54          1HB       MET  54   1.376   4.805  -5.560
  428    HB3  MET  54          2HB       MET  54   2.794   5.831  -5.360
  429    HG2  MET  54          1HG       MET  54   1.430   7.756  -5.043
  430    HG3  MET  54          2HG       MET  54  -0.024   6.863  -5.475
  431    HE1  MET  54          1HE       MET  54   2.659   7.654  -2.899
  432    HE2  MET  54          2HE       MET  54   3.017   5.928  -2.961
  433    HE3  MET  54          3HE       MET  54   2.288   6.628  -1.516
  434    H    GLN  55           H        GLN  55   1.536   4.254  -8.998
  435    HA   GLN  55           HA       GLN  55   2.761   2.738 -10.089
  436    HB2  GLN  55          1HB       GLN  55   4.739   4.970  -9.820
  437    HB3  GLN  55          2HB       GLN  55   5.157   3.474 -10.670
  438    HG2  GLN  55          1HG       GLN  55   3.344   3.829 -12.214
  439    HG3  GLN  55          2HG       GLN  55   2.815   5.240 -11.310
  440   HE21  GLN  55          1HE2      GLN  55   3.582   5.037 -14.088
  441   HE22  GLN  55          2HE2      GLN  55   4.904   6.133 -14.318
  442    H    LEU  56           H        LEU  56   2.404   1.777  -7.778
  443    HA   LEU  56           HA       LEU  56   5.007   0.950  -6.742
  444    HB2  LEU  56          1HB       LEU  56   2.804   2.304  -5.377
  445    HB3  LEU  56          2HB       LEU  56   3.372   0.867  -4.517
  446    HG   LEU  56           HG       LEU  56   5.079   3.200  -5.386
  447   HD11  LEU  56          1HD1      LEU  56   4.036   2.443  -2.660
  448   HD12  LEU  56          2HD1      LEU  56   3.536   3.838  -3.612
  449   HD13  LEU  56          3HD1      LEU  56   5.184   3.735  -2.997
  450   HD21  LEU  56          1HD2      LEU  56   5.681   0.741  -3.761
  451   HD22  LEU  56          2HD2      LEU  56   6.738   2.147  -3.862
  452   HD23  LEU  56          3HD2      LEU  56   6.395   1.198  -5.308
  453    H    PHE  57           H        PHE  57   1.826   0.073  -7.696
  454    HA   PHE  57           HA       PHE  57   2.417  -2.735  -7.068
  455    HB2  PHE  57          1HB       PHE  57   0.865  -2.054  -5.325
  456    HB3  PHE  57          2HB       PHE  57  -0.203  -1.314  -6.504
  457    HD1  PHE  57           HD1      PHE  57  -1.805  -2.597  -7.704
  458    HD2  PHE  57           HD2      PHE  57   1.022  -4.520  -5.167
  459    HE1  PHE  57           HE1      PHE  57  -3.099  -4.680  -7.851
  460    HE2  PHE  57           HE2      PHE  57  -0.271  -6.608  -5.314
  461    HZ   PHE  57           HZ       PHE  57  -2.330  -6.691  -6.658
  462    H    ASP  58           H        ASP  58   1.927  -4.116  -8.667
  463    HA   ASP  58           HA       ASP  58   0.476  -3.048 -11.000
  464    HB2  ASP  58          1HB       ASP  58   2.798  -3.560 -11.557
  465    HB3  ASP  58          2HB       ASP  58   2.637  -5.171 -10.869
  466    H    ASP  59           H        ASP  59  -1.187  -4.293 -11.844
  467    HA   ASP  59           HA       ASP  59  -2.511  -5.885  -9.864
  468    HB2  ASP  59          1HB       ASP  59  -3.644  -4.324 -11.496
  469    HB3  ASP  59          2HB       ASP  59  -3.338  -5.513 -12.744
  470    H    THR  60           H        THR  60  -0.406  -6.528 -12.471
  471    HA   THR  60           HA       THR  60  -1.186  -9.312 -12.697
  472    HB   THR  60           HB       THR  60   0.907  -7.664 -14.104
  473    HG1  THR  60           HG1      THR  60  -1.567  -7.649 -14.489
  474   HG21  THR  60          1HG2      THR  60   1.244  -9.586 -15.577
  475   HG22  THR  60          2HG2      THR  60   0.160 -10.550 -14.575
  476   HG23  THR  60          3HG2      THR  60   1.689  -9.968 -13.914
  477    H    GLU  61           H        GLU  61   1.949  -7.645 -12.138
  478    HA   GLU  61           HA       GLU  61   3.110 -10.069 -11.079
  479    HB2  GLU  61          1HB       GLU  61   4.326  -7.311 -11.052
  480    HB3  GLU  61          2HB       GLU  61   5.144  -8.865 -10.938
  481    HG2  GLU  61          1HG       GLU  61   4.537  -9.399 -13.206
  482    HG3  GLU  61          2HG       GLU  61   3.651  -7.881 -13.339
  483    H    GLY  62           H        GLY  62   1.328  -7.534  -9.707
  484    HA2  GLY  62          1HA       GLY  62   0.667  -7.414  -7.465
  485    HA3  GLY  62          2HA       GLY  62   1.963  -8.540  -7.057
  486    HA   PRO  63           HA       PRO  63   3.272  -4.505  -5.255
  487    HB2  PRO  63          1HB       PRO  63   4.969  -6.400  -3.739
  488    HB3  PRO  63          2HB       PRO  63   3.925  -5.100  -3.149
  489    HG2  PRO  63          1HG       PRO  63   3.267  -7.698  -2.886
  490    HG3  PRO  63          2HG       PRO  63   2.051  -6.431  -3.130
  491    HD2  PRO  63          1HD       PRO  63   3.123  -8.444  -5.054
  492    HD3  PRO  63          2HD       PRO  63   1.489  -7.741  -4.941
  493    H    LEU  64           H        LEU  64   4.780  -3.389  -6.311
  494    HA   LEU  64           HA       LEU  64   6.911  -4.782  -7.709
  495    HB2  LEU  64          1HB       LEU  64   6.311  -1.821  -7.649
  496    HB3  LEU  64          2HB       LEU  64   7.394  -2.652  -8.749
  497    HG   LEU  64           HG       LEU  64   4.417  -3.113  -8.643
  498   HD11  LEU  64          1HD1      LEU  64   6.075  -1.557 -10.622
  499   HD12  LEU  64          2HD1      LEU  64   4.932  -0.875  -9.464
  500   HD13  LEU  64          3HD1      LEU  64   4.355  -1.912 -10.769
  501   HD21  LEU  64          1HD2      LEU  64   5.707  -5.050  -9.373
  502   HD22  LEU  64          2HD2      LEU  64   6.519  -4.059 -10.584
  503   HD23  LEU  64          3HD2      LEU  64   4.783  -4.353 -10.704
  504    H    VAL  65           H        VAL  65   8.281  -5.480  -6.248
  505    HA   VAL  65           HA       VAL  65   9.040  -4.432  -3.849
  506    HB   VAL  65           HB       VAL  65  10.656  -6.123  -5.741
  507   HG11  VAL  65          1HG1      VAL  65  11.102  -5.598  -2.805
  508   HG12  VAL  65          2HG1      VAL  65  12.147  -5.084  -4.132
  509   HG13  VAL  65          3HG1      VAL  65  11.955  -6.800  -3.774
  510   HG21  VAL  65          1HG2      VAL  65   9.894  -7.950  -4.239
  511   HG22  VAL  65          2HG2      VAL  65   8.594  -7.168  -5.135
  512   HG23  VAL  65          3HG2      VAL  65   8.844  -6.782  -3.433
  513    H    ASP  66           H        ASP  66  10.594  -3.830  -6.991
  514    HA   ASP  66           HA       ASP  66  12.855  -2.499  -6.000
  515    HB2  ASP  66          1HB       ASP  66  12.649  -3.375  -8.287
  516    HB3  ASP  66          2HB       ASP  66  11.492  -2.104  -8.663
  517    H    ASN  67           H        ASN  67   9.823  -1.129  -7.297
  518    HA   ASN  67           HA       ASN  67  10.473   1.554  -6.707
  519    HB2  ASN  67          1HB       ASN  67   7.835   0.174  -7.166
  520    HB3  ASN  67          2HB       ASN  67   7.963   1.901  -6.868
  521   HD21  ASN  67          1HD2      ASN  67   7.067   2.326  -8.885
  522   HD22  ASN  67          2HD2      ASN  67   7.978   2.138 -10.349
  523    H    LEU  68           H        LEU  68   8.952  -1.009  -4.900
  524    HA   LEU  68           HA       LEU  68   7.881   0.473  -2.787
  525    HB2  LEU  68          1HB       LEU  68   8.726  -2.371  -3.133
  526    HB3  LEU  68          2HB       LEU  68   8.285  -1.788  -1.535
  527    HG   LEU  68           HG       LEU  68   6.462  -1.470  -3.907
  528   HD11  LEU  68          1HD1      LEU  68   5.310  -3.480  -3.201
  529   HD12  LEU  68          2HD1      LEU  68   6.487  -3.732  -1.911
  530   HD13  LEU  68          3HD1      LEU  68   6.986  -3.857  -3.597
  531   HD21  LEU  68          1HD2      LEU  68   5.984  -1.496  -0.935
  532   HD22  LEU  68          2HD2      LEU  68   4.758  -1.264  -2.184
  533   HD23  LEU  68          3HD2      LEU  68   6.031  -0.065  -1.961
  534    H    VAL  69           H        VAL  69  11.047  -1.075  -3.126
  535    HA   VAL  69           HA       VAL  69  12.035  -0.275  -0.590
  536    HB   VAL  69           HB       VAL  69  13.522  -1.022  -3.101
  537   HG11  VAL  69          1HG1      VAL  69  14.977   0.183  -1.599
  538   HG12  VAL  69          2HG1      VAL  69  15.384  -1.534  -1.557
  539   HG13  VAL  69          3HG1      VAL  69  14.447  -0.815  -0.246
  540   HG21  VAL  69          1HG2      VAL  69  12.804  -2.687  -0.697
  541   HG22  VAL  69          2HG2      VAL  69  13.681  -3.227  -2.131
  542   HG23  VAL  69          3HG2      VAL  69  11.988  -2.750  -2.259
  543    H    HIS  70           H        HIS  70  12.147   1.160  -3.816
  544    HA   HIS  70           HA       HIS  70  13.964   3.240  -3.195
  545    HB2  HIS  70          1HB       HIS  70  11.905   2.898  -5.362
  546    HB3  HIS  70          2HB       HIS  70  12.853   4.374  -5.222
  547    HD1  HIS  70           HD1      HIS  70  13.918   3.825  -7.547
  548    HD2  HIS  70           HD2      HIS  70  14.766   1.072  -4.551
  549    HE1  HIS  70           HE1      HIS  70  15.820   2.441  -8.422
  550    HE2  HIS  70           HE2      HIS  70  16.395   0.858  -6.545
  551    H    GLN  71           H        GLN  71  10.564   2.869  -2.703
  552    HA   GLN  71           HA       GLN  71  10.119   5.673  -2.089
  553    HB2  GLN  71          1HB       GLN  71   8.434   4.148  -3.229
  554    HB3  GLN  71          2HB       GLN  71   8.231   3.358  -1.670
  555    HG2  GLN  71          1HG       GLN  71   6.467   4.945  -1.997
  556    HG3  GLN  71          2HG       GLN  71   7.519   5.481  -0.687
  557   HE21  GLN  71          1HE2      GLN  71   6.870   7.617  -0.883
  558   HE22  GLN  71          2HE2      GLN  71   7.348   8.607  -2.209
  559    H    LEU  72           H        LEU  72   9.686   2.616  -0.335
  560    HA   LEU  72           HA       LEU  72   9.258   3.834   2.155
  561    HB2  LEU  72          1HB       LEU  72  10.058   1.015   1.456
  562    HB3  LEU  72          2HB       LEU  72   9.637   1.531   3.076
  563    HG   LEU  72           HG       LEU  72   7.782   1.695   0.700
  564   HD11  LEU  72          1HD1      LEU  72   6.618  -0.206   1.758
  565   HD12  LEU  72          2HD1      LEU  72   7.918  -0.321   2.946
  566   HD13  LEU  72          3HD1      LEU  72   8.253  -0.628   1.241
  567   HD21  LEU  72          1HD2      LEU  72   7.348   2.138   3.651
  568   HD22  LEU  72          2HD2      LEU  72   6.055   2.009   2.457
  569   HD23  LEU  72          3HD2      LEU  72   7.213   3.334   2.361
  570    H    ALA  73           H        ALA  73  12.159   2.189   0.868
  571    HA   ALA  73           HA       ALA  73  13.703   2.811   3.206
  572    HB1  ALA  73          1HB       ALA  73  14.699   1.812   0.559
  573    HB2  ALA  73          2HB       ALA  73  14.009   0.784   1.810
  574    HB3  ALA  73          3HB       ALA  73  15.492   1.681   2.130
  575    H    HIS  74           H        HIS  74  12.573   5.074   1.626
  576    HA   HIS  74           HA       HIS  74  14.787   6.372   0.350
  577    HB2  HIS  74          1HB       HIS  74  12.153   6.677   0.082
  578    HB3  HIS  74          2HB       HIS  74  12.423   7.904   1.314
  579    HD1  HIS  74           HD1      HIS  74  13.182   7.078  -2.253
  580    HD2  HIS  74           HD2      HIS  74  13.755  10.212   0.427
  581    HE1  HIS  74           HE1      HIS  74  13.959   9.029  -3.639
  582    HE2  HIS  74           HE2      HIS  74  14.460  10.849  -1.977
  583    H    GLY  75           H        GLY  75  16.430   6.444   1.856
  584    HA2  GLY  75          1HA       GLY  75  17.572   7.859   3.405
  585    HA3  GLY  75          2HA       GLY  75  16.019   8.288   4.107
  586    H    ARG  76           H        ARG  76  16.815   5.001   3.325
  587    HA   ARG  76           HA       ARG  76  17.790   4.310   5.941
  588    HB2  ARG  76          1HB       ARG  76  14.965   3.884   5.205
  589    HB3  ARG  76          2HB       ARG  76  15.773   2.480   5.890
  590    HG2  ARG  76          1HG       ARG  76  16.458   3.920   7.809
  591    HG3  ARG  76          2HG       ARG  76  15.431   5.192   7.149
  592    HD2  ARG  76          1HD       ARG  76  13.498   3.729   7.317
  593    HD3  ARG  76          2HD       ARG  76  14.516   2.437   7.944
  594    HE   ARG  76           HE       ARG  76  14.767   4.751   9.550
  595   HH11  ARG  76          1HH1      ARG  76  12.557   2.138   8.824
  596   HH12  ARG  76          2HH1      ARG  76  11.773   2.198  10.372
  597   HH21  ARG  76          1HH2      ARG  76  13.756   4.816  11.605
  598   HH22  ARG  76          2HH2      ARG  76  12.460   3.715  11.952
  599    H    ASP  77           H        ASP  77  18.098   1.825   6.050
  600    HA   ASP  77           HA       ASP  77  19.607   1.063   3.799
  601    HB2  ASP  77          1HB       ASP  77  20.121   0.261   6.055
  602    HB3  ASP  77          2HB       ASP  77  18.624  -0.667   6.072
  603    H    ALA  78           H        ALA  78  19.051   0.221   2.003
  604    HA   ALA  78           HA       ALA  78  16.371  -0.223   1.279
  605    HB1  ALA  78          1HB       ALA  78  18.075   0.601  -0.253
  606    HB2  ALA  78          2HB       ALA  78  17.274  -0.835  -0.886
  607    HB3  ALA  78          3HB       ALA  78  18.888  -0.960  -0.187
  608    H    GLU  79           H        GLU  79  18.976  -2.423   2.132
  609    HA   GLU  79           HA       GLU  79  17.772  -4.753   1.055
  610    HB2  GLU  79          1HB       GLU  79  19.970  -4.372   3.074
  611    HB3  GLU  79          2HB       GLU  79  19.465  -5.952   2.486
  612    HG2  GLU  79          1HG       GLU  79  20.049  -5.339   0.228
  613    HG3  GLU  79          2HG       GLU  79  20.466  -3.710   0.748
  614    H    GLU  80           H        GLU  80  17.915  -3.425   4.349
  615    HA   GLU  80           HA       GLU  80  16.440  -5.433   5.623
  616    HB2  GLU  80          1HB       GLU  80  16.804  -2.506   6.171
  617    HB3  GLU  80          2HB       GLU  80  15.748  -3.491   7.176
  618    HG2  GLU  80          1HG       GLU  80  18.675  -3.968   6.699
  619    HG3  GLU  80          2HG       GLU  80  17.963  -3.278   8.148
  620    H    VAL  81           H        VAL  81  15.320  -2.394   4.181
  621    HA   VAL  81           HA       VAL  81  12.591  -2.737   4.626
  622    HB   VAL  81           HB       VAL  81  14.055  -1.242   2.470
  623   HG11  VAL  81          1HG1      VAL  81  11.824  -1.646   1.657
  624   HG12  VAL  81          2HG1      VAL  81  11.949   0.035   2.180
  625   HG13  VAL  81          3HG1      VAL  81  11.136  -1.152   3.204
  626   HG21  VAL  81          1HG2      VAL  81  14.551  -0.450   4.661
  627   HG22  VAL  81          2HG2      VAL  81  12.841  -0.436   5.094
  628   HG23  VAL  81          3HG2      VAL  81  13.456   0.702   3.894
  629    H    ARG  82           H        ARG  82  14.547  -3.578   1.762
  630    HA   ARG  82           HA       ARG  82  12.584  -4.643   0.133
  631    HB2  ARG  82          1HB       ARG  82  14.978  -4.254  -0.465
  632    HB3  ARG  82          2HB       ARG  82  15.390  -5.710   0.433
  633    HG2  ARG  82          1HG       ARG  82  14.036  -7.042  -1.053
  634    HG3  ARG  82          2HG       ARG  82  13.543  -5.596  -1.930
  635    HD2  ARG  82          1HD       ARG  82  16.340  -6.684  -1.700
  636    HD3  ARG  82          2HD       ARG  82  15.305  -6.762  -3.123
  637    HE   ARG  82           HE       ARG  82  16.633  -4.375  -2.051
  638   HH11  ARG  82          1HH1      ARG  82  14.649  -5.859  -4.524
  639   HH12  ARG  82          2HH1      ARG  82  14.906  -4.588  -5.677
  640   HH21  ARG  82          1HH2      ARG  82  16.975  -2.695  -3.564
  641   HH22  ARG  82          2HH2      ARG  82  16.230  -2.781  -5.127
  642    H    THR  83           H        THR  83  14.437  -6.214   2.693
  643    HA   THR  83           HA       THR  83  13.546  -8.839   2.281
  644    HB   THR  83           HB       THR  83  14.637  -7.380   4.676
  645    HG1  THR  83           HG1      THR  83  16.390  -7.841   3.632
  646   HG21  THR  83          1HG2      THR  83  14.917  -9.552   5.794
  647   HG22  THR  83          2HG2      THR  83  13.998 -10.328   4.504
  648   HG23  THR  83          3HG2      THR  83  13.215  -9.151   5.559
  649    H    GLU  84           H        GLU  84  12.443  -6.403   4.631
  650    HA   GLU  84           HA       GLU  84  10.352  -7.923   5.711
  651    HB2  GLU  84          1HB       GLU  84  10.679  -4.922   5.593
  652    HB3  GLU  84          2HB       GLU  84   9.556  -5.786   6.638
  653    HG2  GLU  84          1HG       GLU  84  11.375  -6.868   7.776
  654    HG3  GLU  84          2HG       GLU  84  12.541  -6.127   6.684
  655    H    VAL  85           H        VAL  85  10.384  -5.659   2.972
  656    HA   VAL  85           HA       VAL  85   7.649  -5.637   2.407
  657    HB   VAL  85           HB       VAL  85  10.070  -5.383   0.633
  658   HG11  VAL  85          1HG1      VAL  85   8.302  -6.384  -0.720
  659   HG12  VAL  85          2HG1      VAL  85   8.584  -4.706  -1.194
  660   HG13  VAL  85          3HG1      VAL  85   7.183  -5.122  -0.203
  661   HG21  VAL  85          1HG2      VAL  85   7.961  -3.428   1.535
  662   HG22  VAL  85          2HG2      VAL  85   9.333  -3.056   0.488
  663   HG23  VAL  85          3HG2      VAL  85   9.608  -3.552   2.159
  664    H    LEU  86           H        LEU  86  10.195  -7.828   1.226
  665    HA   LEU  86           HA       LEU  86   8.638  -9.389  -0.466
  666    HB2  LEU  86          1HB       LEU  86  11.125 -10.044   1.106
  667    HB3  LEU  86          2HB       LEU  86  10.412 -11.140  -0.076
  668    HG   LEU  86           HG       LEU  86  11.281  -8.345  -0.766
  669   HD11  LEU  86          1HD1      LEU  86  13.333  -9.311  -1.628
  670   HD12  LEU  86          2HD1      LEU  86  12.844 -10.905  -1.053
  671   HD13  LEU  86          3HD1      LEU  86  13.189  -9.618   0.103
  672   HD21  LEU  86          1HD2      LEU  86   9.708  -9.342  -2.305
  673   HD22  LEU  86          2HD2      LEU  86  10.686 -10.803  -2.399
  674   HD23  LEU  86          3HD2      LEU  86  11.308  -9.283  -3.043
  675    H    LYS  87           H        LYS  87   9.027  -9.530   3.006
  676    HA   LYS  87           HA       LYS  87   7.851 -12.131   3.306
  677    HB2  LYS  87          1HB       LYS  87   8.413  -9.918   5.279
  678    HB3  LYS  87          2HB       LYS  87   7.732 -11.474   5.736
  679    HG2  LYS  87          1HG       LYS  87   9.707 -12.612   4.918
  680    HG3  LYS  87          2HG       LYS  87  10.389 -11.070   4.378
  681    HD2  LYS  87          1HD       LYS  87  10.465 -10.286   6.674
  682    HD3  LYS  87          2HD       LYS  87   9.722 -11.787   7.230
  683    HE2  LYS  87          1HE       LYS  87  11.658 -13.013   6.246
  684    HE3  LYS  87          2HE       LYS  87  12.413 -11.456   5.922
  685    HZ1  LYS  87          1HZ       LYS  87  11.643 -12.473   8.602
  686    HZ2  LYS  87          2HZ       LYS  87  12.384 -10.987   8.288
  687    HZ3  LYS  87          3HZ       LYS  87  13.216 -12.427   7.980
  688    H    CYS  88           H        CYS  88   6.649  -9.107   2.612
  689    HA   CYS  88           HA       CYS  88   3.980  -9.788   3.612
  690    HB2  CYS  88          1HB       CYS  88   5.326  -7.199   2.951
  691    HB3  CYS  88          2HB       CYS  88   3.553  -7.306   2.881
  692    H    VAL  89           H        VAL  89   5.897  -9.858   0.879
  693    HA   VAL  89           HA       VAL  89   3.817  -9.482  -1.068
  694    HB   VAL  89           HB       VAL  89   6.568 -10.699  -1.357
  695   HG11  VAL  89          1HG1      VAL  89   4.557  -9.841  -3.431
  696   HG12  VAL  89          2HG1      VAL  89   5.092 -11.489  -3.104
  697   HG13  VAL  89          3HG1      VAL  89   6.221 -10.313  -3.775
  698   HG21  VAL  89          1HG2      VAL  89   7.135  -8.544  -2.425
  699   HG22  VAL  89          2HG2      VAL  89   6.707  -8.373  -0.724
  700   HG23  VAL  89          3HG2      VAL  89   5.544  -7.931  -1.974
  701    H    ASP  90           H        ASP  90   2.189 -10.876  -0.839
  702    HA   ASP  90           HA       ASP  90   2.822 -13.731  -0.630
  703    HB2  ASP  90          1HB       ASP  90   0.503 -12.120   0.345
  704    HB3  ASP  90          2HB       ASP  90   0.255 -13.822  -0.049
  705    H    LYS  91           H        LYS  91   1.083 -15.126  -1.623
  706    HA   LYS  91           HA       LYS  91   0.904 -14.437  -4.438
  707    HB2  LYS  91          1HB       LYS  91   1.339 -16.777  -3.038
  708    HB3  LYS  91          2HB       LYS  91  -0.337 -16.925  -3.544
  709    HG2  LYS  91          1HG       LYS  91   0.263 -16.658  -5.837
  710    HG3  LYS  91          2HG       LYS  91   1.943 -16.346  -5.394
  711    HD2  LYS  91          1HD       LYS  91   0.466 -18.909  -4.816
  712    HD3  LYS  91          2HD       LYS  91   1.545 -18.664  -6.190
  713    HE2  LYS  91          1HE       LYS  91   2.301 -18.471  -3.276
  714    HE3  LYS  91          2HE       LYS  91   2.701 -19.795  -4.364
  715    HZ1  LYS  91          1HZ       LYS  91   3.602 -16.987  -4.693
  716    HZ2  LYS  91          2HZ       LYS  91   4.018 -18.287  -5.689
  717    HZ3  LYS  91          3HZ       LYS  91   4.544 -18.249  -4.083
  718    H    ASN  92           H        ASN  92  -1.007 -14.418  -5.619
  719    HA   ASN  92           HA       ASN  92  -3.293 -13.370  -4.231
  720    HB2  ASN  92          1HB       ASN  92  -2.569 -12.568  -6.479
  721    HB3  ASN  92          2HB       ASN  92  -3.001 -14.137  -7.138
  722   HD21  ASN  92          1HD2      ASN  92  -4.438 -13.123  -8.546
  723   HD22  ASN  92          2HD2      ASN  92  -5.990 -12.563  -8.016
  724    H    THR  93           H        THR  93  -3.259 -15.535  -2.970
  725    HA   THR  93           HA       THR  93  -4.629 -17.740  -4.202
  726    HB   THR  93           HB       THR  93  -4.891 -18.551  -1.851
  727    HG1  THR  93           HG1      THR  93  -4.719 -17.090  -0.332
  728   HG21  THR  93          1HG2      THR  93  -2.116 -17.675  -2.617
  729   HG22  THR  93          2HG2      THR  93  -2.923 -19.145  -3.153
  730   HG23  THR  93          3HG2      THR  93  -2.513 -18.934  -1.453
  731    H    ASP  94           H        ASP  94  -5.516 -14.749  -2.874
  732    HA   ASP  94           HA       ASP  94  -8.152 -15.429  -2.009
  733    HB2  ASP  94          1HB       ASP  94  -7.005 -12.719  -2.733
  734    HB3  ASP  94          2HB       ASP  94  -8.512 -13.004  -1.852
  735    H    ASN  95           H        ASN  95  -6.655 -14.750  -4.971
  736    HA   ASN  95           HA       ASN  95  -7.327 -14.684  -7.111
  737    HB2  ASN  95          1HB       ASN  95  -9.875 -15.818  -5.968
  738    HB3  ASN  95          2HB       ASN  95  -9.546 -15.667  -7.685
  739   HD21  ASN  95          1HD2      ASN  95 -10.034 -18.024  -6.054
  740   HD22  ASN  95          2HD2      ASN  95  -8.652 -19.049  -6.279
  741    H    ASN  96           H        ASN  96  -7.901 -12.460  -5.157
  742    HA   ASN  96           HA       ASN  96  -9.617 -10.923  -6.964
  743    HB2  ASN  96          1HB       ASN  96 -11.113 -11.445  -5.176
  744    HB3  ASN  96          2HB       ASN  96  -9.892 -11.099  -3.955
  745   HD21  ASN  96          1HD2      ASN  96 -12.201  -9.760  -6.171
  746   HD22  ASN  96          2HD2      ASN  96 -12.158  -8.145  -5.553
  747    H    ALA  97           H        ALA  97  -8.546  -9.227  -7.656
  748    HA   ALA  97           HA       ALA  97  -5.916  -8.695  -6.832
  749    HB1  ALA  97          1HB       ALA  97  -6.748  -8.328  -9.108
  750    HB2  ALA  97          2HB       ALA  97  -5.956  -6.897  -8.446
  751    HB3  ALA  97          3HB       ALA  97  -7.716  -6.975  -8.522
  752    H    CYS  98           H        CYS  98  -8.970  -7.126  -6.003
  753    HA   CYS  98           HA       CYS  98  -7.838  -4.820  -4.817
  754    HB2  CYS  98          1HB       CYS  98 -10.452  -6.175  -4.131
  755    HB3  CYS  98          2HB       CYS  98  -9.970  -4.556  -3.638
  756    H    HIS  99           H        HIS  99  -8.565  -8.034  -3.513
  757    HA   HIS  99           HA       HIS  99  -7.812  -7.252  -0.847
  758    HB2  HIS  99          1HB       HIS  99  -9.431  -9.127  -1.378
  759    HB3  HIS  99          2HB       HIS  99  -8.041 -10.072  -1.904
  760    HD1  HIS  99           HD1      HIS  99  -6.522 -11.079  -0.090
  761    HD2  HIS  99           HD2      HIS  99  -9.591  -8.706   1.425
  762    HE1  HIS  99           HE1      HIS  99  -6.513 -11.452   2.393
  763    HE2  HIS  99           HE2      HIS  99  -8.478 -10.145   3.259
  764    H    TRP 100           H        TRP 100  -6.195  -8.460  -3.648
  765    HA   TRP 100           HA       TRP 100  -3.928  -9.558  -2.357
  766    HB2  TRP 100          1HB       TRP 100  -4.579 -10.017  -4.729
  767    HB3  TRP 100          2HB       TRP 100  -4.047  -8.388  -5.149
  768    HD1  TRP 100           HD1      TRP 100  -1.773  -9.927  -2.642
  769    HE1  TRP 100           HE1      TRP 100   0.372 -10.771  -3.776
  770    HE3  TRP 100           HE3      TRP 100  -3.252  -9.592  -7.526
  771    HZ2  TRP 100           HZ2      TRP 100   1.311 -11.252  -6.395
  772    HZ3  TRP 100           HZ3      TRP 100  -1.673 -10.266  -9.281
  773    HH2  TRP 100           HH2      TRP 100   0.560 -11.078  -8.735
  774    H    ALA 101           H        ALA 101  -4.431  -6.410  -3.948
  775    HA   ALA 101           HA       ALA 101  -1.964  -5.271  -3.219
  776    HB1  ALA 101          1HB       ALA 101  -3.042  -3.114  -3.724
  777    HB2  ALA 101          2HB       ALA 101  -4.609  -3.926  -3.784
  778    HB3  ALA 101          3HB       ALA 101  -3.363  -4.325  -4.966
  779    H    PHE 102           H        PHE 102  -5.084  -5.392  -1.643
  780    HA   PHE 102           HA       PHE 102  -4.457  -3.681   0.513
  781    HB2  PHE 102          1HB       PHE 102  -6.739  -4.190  -0.212
  782    HB3  PHE 102          2HB       PHE 102  -6.547  -5.853   0.323
  783    HD1  PHE 102           HD1      PHE 102  -6.448  -2.349   1.551
  784    HD2  PHE 102           HD2      PHE 102  -7.180  -6.435   2.490
  785    HE1  PHE 102           HE1      PHE 102  -7.276  -1.685   3.770
  786    HE2  PHE 102           HE2      PHE 102  -8.012  -5.779   4.710
  787    HZ   PHE 102           HZ       PHE 102  -8.058  -3.400   5.355
  788    H    ARG 103           H        ARG 103  -3.901  -7.014  -0.162
  789    HA   ARG 103           HA       ARG 103  -3.523  -7.974   2.491
  790    HB2  ARG 103          1HB       ARG 103  -4.048  -9.345   0.430
  791    HB3  ARG 103          2HB       ARG 103  -2.389  -9.081  -0.073
  792    HG2  ARG 103          1HG       ARG 103  -1.548 -10.294   1.795
  793    HG3  ARG 103          2HG       ARG 103  -3.160 -10.405   2.499
  794    HD2  ARG 103          1HD       ARG 103  -3.916 -11.785   0.660
  795    HD3  ARG 103          2HD       ARG 103  -2.371 -11.594  -0.164
  796    HE   ARG 103           HE       ARG 103  -1.780 -12.701   2.288
  797   HH11  ARG 103          1HH1      ARG 103  -3.846 -13.558  -0.406
  798   HH12  ARG 103          2HH1      ARG 103  -3.535 -15.264  -0.276
  799   HH21  ARG 103          1HH2      ARG 103  -1.388 -14.942   2.495
  800   HH22  ARG 103          2HH2      ARG 103  -2.161 -16.053   1.410
  801    H    GLY 104           H        GLY 104  -1.338  -6.912  -0.090
  802    HA2  GLY 104          1HA       GLY 104   1.081  -7.287   1.340
  803    HA3  GLY 104          2HA       GLY 104   0.856  -6.220  -0.051
  804    H    PHE 105           H        PHE 105  -0.981  -4.433   0.898
  805    HA   PHE 105           HA       PHE 105   0.637  -2.630   2.303
  806    HB2  PHE 105          1HB       PHE 105  -1.005  -1.733   0.861
  807    HB3  PHE 105          2HB       PHE 105  -2.287  -2.658   1.623
  808    HD1  PHE 105           HD1      PHE 105  -3.809  -1.172   2.539
  809    HD2  PHE 105           HD2      PHE 105   0.360  -0.429   3.005
  810    HE1  PHE 105           HE1      PHE 105  -4.317   0.763   3.964
  811    HE2  PHE 105           HE2      PHE 105  -0.152   1.509   4.431
  812    HZ   PHE 105           HZ       PHE 105  -2.486   2.107   4.915
  813    H    LYS 106           H        LYS 106  -2.064  -4.648   3.351
  814    HA   LYS 106           HA       LYS 106  -2.239  -3.557   5.943
  815    HB2  LYS 106          1HB       LYS 106  -4.194  -4.560   5.295
  816    HB3  LYS 106          2HB       LYS 106  -3.392  -5.953   4.570
  817    HG2  LYS 106          1HG       LYS 106  -2.970  -6.854   6.786
  818    HG3  LYS 106          2HG       LYS 106  -3.674  -5.411   7.520
  819    HD2  LYS 106          1HD       LYS 106  -5.825  -5.929   6.493
  820    HD3  LYS 106          2HD       LYS 106  -5.123  -7.355   5.727
  821    HE2  LYS 106          1HE       LYS 106  -5.325  -6.887   8.699
  822    HE3  LYS 106          2HE       LYS 106  -6.402  -7.914   7.755
  823    HZ1  LYS 106          1HZ       LYS 106  -4.469  -9.268   7.155
  824    HZ2  LYS 106          2HZ       LYS 106  -4.726  -9.240   8.823
  825    HZ3  LYS 106          3HZ       LYS 106  -3.485  -8.312   8.144
  826    H    CYS 107           H        CYS 107  -0.406  -6.212   4.581
  827    HA   CYS 107           HA       CYS 107   0.419  -7.356   7.018
  828    HB2  CYS 107          1HB       CYS 107   0.627  -8.685   5.085
  829    HB3  CYS 107          2HB       CYS 107   1.546  -7.462   4.223
  830    H    PHE 108           H        PHE 108   1.884  -4.920   4.907
  831    HA   PHE 108           HA       PHE 108   4.339  -4.851   6.343
  832    HB2  PHE 108          1HB       PHE 108   3.988  -4.256   3.913
  833    HB3  PHE 108          2HB       PHE 108   3.307  -2.729   4.475
  834    HD1  PHE 108           HD1      PHE 108   4.732  -0.995   5.352
  835    HD2  PHE 108           HD2      PHE 108   6.344  -4.772   4.224
  836    HE1  PHE 108           HE1      PHE 108   7.003  -0.059   5.465
  837    HE2  PHE 108           HE2      PHE 108   8.615  -3.838   4.341
  838    HZ   PHE 108           HZ       PHE 108   8.945  -1.478   4.956
  839    H    GLN 109           H        GLN 109   1.478  -2.744   6.250
  840    HA   GLN 109           HA       GLN 109   2.490  -0.789   8.002
  841    HB2  GLN 109          1HB       GLN 109   0.235   0.022   8.184
  842    HB3  GLN 109          2HB       GLN 109   0.546  -0.437   6.519
  843    HG2  GLN 109          1HG       GLN 109  -1.434  -1.444   6.661
  844    HG3  GLN 109          2HG       GLN 109  -0.555  -2.717   7.516
  845   HE21  GLN 109          1HE2      GLN 109  -3.350  -1.907   7.733
  846   HE22  GLN 109          2HE2      GLN 109  -3.597  -1.496   9.394
  847    H    LYS 110           H        LYS 110   1.230  -3.927   8.539
  848    HA   LYS 110           HA       LYS 110   0.290  -3.722  11.173
  849    HB2  LYS 110          1HB       LYS 110  -0.131  -5.634   9.701
  850    HB3  LYS 110          2HB       LYS 110   1.571  -6.049   9.728
  851    HG2  LYS 110          1HG       LYS 110   0.584  -7.528  11.211
  852    HG3  LYS 110          2HG       LYS 110   1.291  -6.282  12.241
  853    HD2  LYS 110          1HD       LYS 110  -0.882  -5.203  12.454
  854    HD3  LYS 110          2HD       LYS 110  -1.600  -6.414  11.391
  855    HE2  LYS 110          1HE       LYS 110  -0.368  -6.903  14.103
  856    HE3  LYS 110          2HE       LYS 110  -2.083  -6.934  13.709
  857    HZ1  LYS 110          1HZ       LYS 110  -1.688  -8.826  12.264
  858    HZ2  LYS 110          2HZ       LYS 110  -1.158  -9.156  13.834
  859    HZ3  LYS 110          3HZ       LYS 110  -0.035  -8.791  12.628
  860    H    ASN 111           H        ASN 111   3.510  -3.872   9.852
  861    HA   ASN 111           HA       ASN 111   4.590  -4.117  12.585
  862    HB2  ASN 111          1HB       ASN 111   5.813  -5.135  10.014
  863    HB3  ASN 111          2HB       ASN 111   6.584  -5.179  11.597
  864   HD21  ASN 111          1HD2      ASN 111   4.066  -6.512   9.602
  865   HD22  ASN 111          2HD2      ASN 111   3.744  -7.889  10.593
  866    H    ASN 112           H        ASN 112   4.642  -2.382   9.578
  867    HA   ASN 112           HA       ASN 112   6.684  -0.569  10.671
  868    HB2  ASN 112          1HB       ASN 112   6.699  -1.880   7.949
  869    HB3  ASN 112          2HB       ASN 112   7.655  -0.446   8.341
  870   HD21  ASN 112          1HD2      ASN 112   8.213  -3.373   7.681
  871   HD22  ASN 112          2HD2      ASN 112   9.392  -3.832   8.871
  872    H    LEU 113           H        LEU 113   4.271   0.343  10.945
  873    HA   LEU 113           HA       LEU 113   3.243   1.575   8.556
  874    HB2  LEU 113          1HB       LEU 113   1.659   0.904  10.207
  875    HB3  LEU 113          2HB       LEU 113   2.465   1.832  11.453
  876    HG   LEU 113           HG       LEU 113   1.803   3.909  10.255
  877   HD11  LEU 113          1HD1      LEU 113   0.187   3.807   8.470
  878   HD12  LEU 113          2HD1      LEU 113   0.171   2.048   8.543
  879   HD13  LEU 113          3HD1      LEU 113   1.624   2.892   8.013
  880   HD21  LEU 113          1HD2      LEU 113  -0.579   3.771  10.855
  881   HD22  LEU 113          2HD2      LEU 113   0.460   3.071  12.096
  882   HD23  LEU 113          3HD2      LEU 113  -0.426   2.021  10.993
  883    H    SER 114           H        SER 114   5.321   2.473  11.179
  884    HA   SER 114           HA       SER 114   5.263   5.266  10.924
  885    HB2  SER 114          1HB       SER 114   7.617   5.065  11.936
  886    HB3  SER 114          2HB       SER 114   6.284   4.374  12.861
  887    HG   SER 114           HG       SER 114   7.652   2.729  12.849
  888    H    LEU 115           H        LEU 115   7.162   2.807   9.239
  889    HA   LEU 115           HA       LEU 115   8.856   4.597   7.851
  890    HB2  LEU 115          1HB       LEU 115   9.297   2.175   8.161
  891    HB3  LEU 115          2HB       LEU 115   7.991   1.826   7.046
  892    HG   LEU 115           HG       LEU 115   9.251   3.052   5.275
  893   HD11  LEU 115          1HD1      LEU 115  10.610   4.478   6.649
  894   HD12  LEU 115          2HD1      LEU 115  11.655   3.440   5.678
  895   HD13  LEU 115          3HD1      LEU 115  11.391   3.081   7.386
  896   HD21  LEU 115          1HD2      LEU 115  10.891   1.273   4.903
  897   HD22  LEU 115          2HD2      LEU 115   9.331   0.626   5.414
  898   HD23  LEU 115          3HD2      LEU 115  10.665   0.722   6.563
  899    H    ILE 116           H        ILE 116   5.688   3.257   7.225
  900    HA   ILE 116           HA       ILE 116   5.442   4.042   4.529
  901    HB   ILE 116           HB       ILE 116   3.298   3.625   6.626
  902   HG12  ILE 116          1HG1      ILE 116   4.421   1.776   4.504
  903   HG13  ILE 116          2HG1      ILE 116   4.664   1.634   6.250
  904   HG21  ILE 116          1HG2      ILE 116   3.061   3.799   3.628
  905   HG22  ILE 116          2HG2      ILE 116   2.432   4.962   4.797
  906   HG23  ILE 116          3HG2      ILE 116   1.765   3.329   4.727
  907   HD11  ILE 116          1HD1      ILE 116   2.128   1.241   4.696
  908   HD12  ILE 116          2HD1      ILE 116   2.177   1.365   6.453
  909   HD13  ILE 116          3HD1      ILE 116   3.022   0.050   5.638
  910    H    LYS 117           H        LYS 117   4.649   5.614   7.579
  911    HA   LYS 117           HA       LYS 117   3.515   7.945   6.440
  912    HB2  LYS 117          1HB       LYS 117   4.638   7.333   9.165
  913    HB3  LYS 117          2HB       LYS 117   3.927   8.890   8.759
  914    HG2  LYS 117          1HG       LYS 117   1.804   7.844   8.287
  915    HG3  LYS 117          2HG       LYS 117   2.492   6.243   8.547
  916    HD2  LYS 117          1HD       LYS 117   2.883   6.750  10.881
  917    HD3  LYS 117          2HD       LYS 117   2.330   8.409  10.648
  918    HE2  LYS 117          1HE       LYS 117   0.099   7.622  10.122
  919    HE3  LYS 117          2HE       LYS 117   0.636   5.949  10.231
  920    HZ1  LYS 117          1HZ       LYS 117  -0.485   6.589  12.239
  921    HZ2  LYS 117          2HZ       LYS 117   0.542   7.911  12.452
  922    HZ3  LYS 117          3HZ       LYS 117   1.153   6.340  12.583
  923    H    ALA 118           H        ALA 118   6.748   7.075   7.540
  924    HA   ALA 118           HA       ALA 118   7.869   9.671   7.272
  925    HB1  ALA 118          1HB       ALA 118   9.997   8.567   7.582
  926    HB2  ALA 118          2HB       ALA 118   9.244   6.998   7.288
  927    HB3  ALA 118          3HB       ALA 118   8.802   7.935   8.715
  928    H    SER 119           H        SER 119   7.629   6.916   5.087
  929    HA   SER 119           HA       SER 119   9.519   7.750   3.206
  930    HB2  SER 119          1HB       SER 119   8.374   6.210   1.638
  931    HB3  SER 119          2HB       SER 119   8.657   5.476   3.216
  932    HG   SER 119           HG       SER 119   6.504   5.789   3.723
  933    H    ILE 120           H        ILE 120   6.080   8.532   3.492
  934    HA   ILE 120           HA       ILE 120   6.136  10.051   1.016
  935    HB   ILE 120           HB       ILE 120   3.762  10.582   1.540
  936   HG12  ILE 120          1HG1      ILE 120   4.061   8.631   3.821
  937   HG13  ILE 120          2HG1      ILE 120   4.087  10.379   4.042
  938   HG21  ILE 120          1HG2      ILE 120   4.322   8.665   0.162
  939   HG22  ILE 120          2HG2      ILE 120   2.918   8.309   1.170
  940   HG23  ILE 120          3HG2      ILE 120   4.501   7.663   1.603
  941   HD11  ILE 120          1HD1      ILE 120   1.897   9.430   4.519
  942   HD12  ILE 120          2HD1      ILE 120   1.811   8.804   2.874
  943   HD13  ILE 120          3HD1      ILE 120   1.842  10.541   3.153
  944    H    LYS 121           H        LYS 121   6.936  10.624   4.219
  945    HA   LYS 121           HA       LYS 121   6.139  13.423   4.185
  946    HB2  LYS 121          1HB       LYS 121   6.130  11.715   6.210
  947    HB3  LYS 121          2HB       LYS 121   7.805  12.219   6.349
  948    HG2  LYS 121          1HG       LYS 121   5.441  14.093   6.383
  949    HG3  LYS 121          2HG       LYS 121   6.254  13.479   7.821
  950    HD2  LYS 121          1HD       LYS 121   8.329  14.560   7.106
  951    HD3  LYS 121          2HD       LYS 121   7.524  15.158   5.655
  952    HE2  LYS 121          1HE       LYS 121   6.802  15.845   8.500
  953    HE3  LYS 121          2HE       LYS 121   7.657  16.890   7.371
  954    HZ1  LYS 121          1HZ       LYS 121   4.882  15.889   7.019
  955    HZ2  LYS 121          2HZ       LYS 121   5.703  16.923   5.963
  956    HZ3  LYS 121          3HZ       LYS 121   5.305  17.447   7.517
  957    H    LYS 122           H        LYS 122   7.474  14.946   3.426
  958    HA   LYS 122           HA       LYS 122  10.351  14.615   3.734
  959    HB2  LYS 122          1HB       LYS 122   9.114  14.051   1.270
  960    HB3  LYS 122          2HB       LYS 122   9.832  15.632   1.090
  961    HG2  LYS 122          1HG       LYS 122  11.327  13.202   2.047
  962    HG3  LYS 122          2HG       LYS 122  11.319  13.788   0.384
  963    HD2  LYS 122          1HD       LYS 122  12.279  15.915   1.131
  964    HD3  LYS 122          2HD       LYS 122  12.289  15.326   2.793
  965    HE2  LYS 122          1HE       LYS 122  13.771  14.034   0.511
  966    HE3  LYS 122          2HE       LYS 122  14.492  15.163   1.655
  967    HZ1  LYS 122          1HZ       LYS 122  14.904  12.828   2.223
  968    HZ2  LYS 122          2HZ       LYS 122  13.243  12.574   2.398
  969    HZ3  LYS 122          3HZ       LYS 122  14.048  13.634   3.437
  970    H    ASP 123           H        ASP 123  10.806  16.349   4.855
  971    HA   ASP 123           HA       ASP 123   9.844  18.934   3.847
  972    HB2  ASP 123          1HB       ASP 123   8.832  18.201   6.041
  973    HB3  ASP 123          2HB       ASP 123  10.441  18.335   6.738
  974    H21  ACD 201           H21      ACD   1  -4.320   4.405   1.875
  975    H22  ACD 201           H22      ACD   1  -3.015   4.749   3.017
  976    H31  ACD 201           H31      ACD   1  -2.000   6.319   1.410
  977    H32  ACD 201           H32      ACD   1  -3.322   6.055   0.274
  978    H41  ACD 201           H41      ACD   1  -2.691   3.684   0.034
  979    H42  ACD 201           H42      ACD   1  -1.289   4.711  -0.299
  980    H5   ACD 201           H5       ACD   1  -1.649   2.866   2.106
  981    H6   ACD 201           H6       ACD   1   0.590   3.553   2.594
  982    H71  ACD 201           H71      ACD   1   0.866   4.970   0.088
  983    H72  ACD 201           H72      ACD   1  -0.101   6.058   1.084
  984    H8   ACD 201           H8       ACD   1   1.797   6.464   2.587
  985    H9   ACD 201           H9       ACD   1   3.914   5.504   2.056
  986   H101  ACD 201          H101      ACD   1   2.876   4.594  -0.510
  987   H102  ACD 201          H102      ACD   1   2.417   3.342   0.644
  988    H11  ACD 201           H11      ACD   1   5.369   4.243   0.552
  989    H12  ACD 201           H12      ACD   1   5.714   1.915   0.218
  990   H131  ACD 201          H131      ACD   1   2.759   1.952  -0.554
  991   H132  ACD 201          H132      ACD   1   3.857   0.573  -0.650
  992    H14  ACD 201           H14      ACD   1   2.689   1.606   2.036
  993    H15  ACD 201           H15      ACD   1   2.535  -0.728   2.454
  994   H161  ACD 201          H161      ACD   1   2.725  -1.462  -0.312
  995   H162  ACD 201          H162      ACD   1   4.385  -1.005   0.083
  996   H171  ACD 201          H171      ACD   1   4.527  -2.653   1.832
  997   H172  ACD 201          H172      ACD   1   2.795  -2.980   1.754
  998   H181  ACD 201          H181      ACD   1   4.775  -3.532  -0.494
  999   H182  ACD 201          H182      ACD   1   3.046  -3.894  -0.529
 1000   H191  ACD 201          H191      ACD   1   5.097  -5.075   1.399
 1001   H192  ACD 201          H192      ACD   1   3.360  -5.375   1.490
 1002   H201  ACD 201          H201      ACD   1   3.425  -6.349  -0.771
 1003   H202  ACD 201          H202      ACD   1   4.511  -7.180   0.290
 1004   H203  ACD 201          H203      ACD   1   5.127  -6.051  -0.868
  Start of MODEL   24
    1    H1   MET   1          1H        MET   1  17.543   9.529 -12.661
    2    H2   MET   1          2H        MET   1  18.463  10.945 -12.621
    3    H3   MET   1          3H        MET   1  18.720   9.805 -13.839
    4    HA   MET   1           HA       MET   1  17.488  11.725 -14.638
    5    HB2  MET   1          1HB       MET   1  15.721  10.491 -15.763
    6    HB3  MET   1          2HB       MET   1  17.179   9.515 -15.686
    7    HG2  MET   1          1HG       MET   1  16.253   8.244 -13.834
    8    HG3  MET   1          2HG       MET   1  14.802   9.242 -13.861
    9    HE1  MET   1          1HE       MET   1  16.025   6.324 -17.222
   10    HE2  MET   1          2HE       MET   1  16.921   6.533 -15.719
   11    HE3  MET   1          3HE       MET   1  16.887   7.831 -16.911
   12    H    GLU   2           H        GLU   2  17.101  11.613 -11.659
   13    HA   GLU   2           HA       GLU   2  15.803  12.635 -10.127
   14    HB2  GLU   2          1HB       GLU   2  15.637  14.402 -11.862
   15    HB3  GLU   2          2HB       GLU   2  14.174  13.635 -12.455
   16    HG2  GLU   2          1HG       GLU   2  13.144  13.998 -10.235
   17    HG3  GLU   2          2HG       GLU   2  14.587  14.893  -9.759
   18    H    PHE   3           H        PHE   3  15.305  10.177  -9.938
   19    HA   PHE   3           HA       PHE   3  12.600   9.423 -10.441
   20    HB2  PHE   3          1HB       PHE   3  14.325   7.720 -10.110
   21    HB3  PHE   3          2HB       PHE   3  14.587   8.286  -8.454
   22    HD1  PHE   3           HD1      PHE   3  12.229   6.603 -10.721
   23    HD2  PHE   3           HD2      PHE   3  13.137   7.619  -6.693
   24    HE1  PHE   3           HE1      PHE   3  10.489   5.045  -9.940
   25    HE2  PHE   3           HE2      PHE   3  11.401   6.065  -5.902
   26    HZ   PHE   3           HZ       PHE   3  10.073   4.775  -7.528
   27    H    THR   4           H        THR   4  10.997  10.519  -9.573
   28    HA   THR   4           HA       THR   4  11.329  11.706  -6.910
   29    HB   THR   4           HB       THR   4   8.857  12.352  -8.321
   30    HG1  THR   4           HG1      THR   4  11.313  12.510  -9.652
   31   HG21  THR   4          1HG2      THR   4  11.140  14.015  -7.272
   32   HG22  THR   4          2HG2      THR   4   9.693  13.555  -6.375
   33   HG23  THR   4          3HG2      THR   4   9.562  14.622  -7.771
   34    H    VAL   5           H        VAL   5  10.473  10.752  -5.240
   35    HA   VAL   5           HA       VAL   5   8.576   8.574  -5.567
   36    HB   VAL   5           HB       VAL   5   9.014   7.960  -3.400
   37   HG11  VAL   5          1HG1      VAL   5  11.347   8.210  -2.894
   38   HG12  VAL   5          2HG1      VAL   5  11.468   9.560  -4.021
   39   HG13  VAL   5          3HG1      VAL   5  11.098   7.941  -4.619
   40   HG21  VAL   5          1HG2      VAL   5   8.169  10.027  -2.351
   41   HG22  VAL   5          2HG2      VAL   5   9.727  10.796  -2.653
   42   HG23  VAL   5          3HG2      VAL   5   9.621   9.417  -1.559
   43    H    SER   6           H        SER   6   6.508   8.529  -4.844
   44    HA   SER   6           HA       SER   6   5.035  10.937  -4.984
   45    HB2  SER   6          1HB       SER   6   4.176   8.217  -3.963
   46    HB3  SER   6          2HB       SER   6   3.094   9.527  -4.432
   47    HG   SER   6           HG       SER   6   4.668   9.235  -6.469
   48    H    THR   7           H        THR   7   5.454  12.437  -3.445
   49    HA   THR   7           HA       THR   7   5.798  11.734  -0.680
   50    HB   THR   7           HB       THR   7   5.937  14.155  -0.282
   51    HG1  THR   7           HG1      THR   7   5.206  14.299  -3.042
   52   HG21  THR   7          1HG2      THR   7   7.937  12.945  -1.012
   53   HG22  THR   7          2HG2      THR   7   7.935  14.601  -1.619
   54   HG23  THR   7          3HG2      THR   7   7.521  13.267  -2.695
   55    H    THR   8           H        THR   8   4.468  13.521   0.795
   56    HA   THR   8           HA       THR   8   1.927  12.402   1.078
   57    HB   THR   8           HB       THR   8   2.732  15.129   2.086
   58    HG1  THR   8           HG1      THR   8   4.096  12.990   2.498
   59   HG21  THR   8          1HG2      THR   8   1.263  14.512   3.978
   60   HG22  THR   8          2HG2      THR   8   0.843  13.023   3.132
   61   HG23  THR   8          3HG2      THR   8   0.398  14.583   2.443
   62    H    GLU   9           H        GLU   9   2.961  15.370  -0.552
   63    HA   GLU   9           HA       GLU   9   0.376  16.346  -1.091
   64    HB2  GLU   9          1HB       GLU   9   2.984  16.833  -2.521
   65    HB3  GLU   9          2HB       GLU   9   1.496  17.706  -2.853
   66    HG2  GLU   9          1HG       GLU   9   1.480  18.410  -0.458
   67    HG3  GLU   9          2HG       GLU   9   3.093  17.710  -0.315
   68    H    ASP  10           H        ASP  10   2.598  14.374  -3.023
   69    HA   ASP  10           HA       ASP  10   0.973  14.183  -5.318
   70    HB2  ASP  10          1HB       ASP  10   2.969  12.140  -4.323
   71    HB3  ASP  10          2HB       ASP  10   2.347  12.294  -5.964
   72    H    LEU  11           H        LEU  11   1.200  12.269  -2.387
   73    HA   LEU  11           HA       LEU  11  -0.445  10.150  -3.173
   74    HB2  LEU  11          1HB       LEU  11   1.003   9.948  -1.271
   75    HB3  LEU  11          2HB       LEU  11   0.154  11.248  -0.422
   76    HG   LEU  11           HG       LEU  11  -1.867   9.790  -0.394
   77   HD11  LEU  11          1HD1      LEU  11  -1.256   8.410  -2.329
   78   HD12  LEU  11          2HD1      LEU  11  -1.647   7.445  -0.908
   79   HD13  LEU  11          3HD1      LEU  11   0.039   7.680  -1.377
   80   HD21  LEU  11          1HD2      LEU  11   0.564   8.532   0.868
   81   HD22  LEU  11          2HD2      LEU  11  -1.107   8.404   1.417
   82   HD23  LEU  11          3HD2      LEU  11  -0.269   9.952   1.502
   83    H    GLN  12           H        GLN  12  -1.174  13.291  -1.795
   84    HA   GLN  12           HA       GLN  12  -3.900  12.743  -1.188
   85    HB2  GLN  12          1HB       GLN  12  -2.408  15.332  -1.592
   86    HB3  GLN  12          2HB       GLN  12  -4.098  15.257  -1.119
   87    HG2  GLN  12          1HG       GLN  12  -3.512  14.132   0.934
   88    HG3  GLN  12          2HG       GLN  12  -1.822  14.058   0.439
   89   HE21  GLN  12          1HE2      GLN  12  -0.576  15.892   0.502
   90   HE22  GLN  12          2HE2      GLN  12  -1.051  17.318   1.357
   91    H    ARG  13           H        ARG  13  -2.205  13.483  -4.062
   92    HA   ARG  13           HA       ARG  13  -4.435  14.548  -5.511
   93    HB2  ARG  13          1HB       ARG  13  -1.955  14.937  -5.988
   94    HB3  ARG  13          2HB       ARG  13  -1.955  13.333  -6.708
   95    HG2  ARG  13          1HG       ARG  13  -2.256  14.795  -8.509
   96    HG3  ARG  13          2HG       ARG  13  -3.883  14.181  -8.153
   97    HD2  ARG  13          1HD       ARG  13  -3.945  16.578  -8.525
   98    HD3  ARG  13          2HD       ARG  13  -4.349  16.201  -6.851
   99    HE   ARG  13           HE       ARG  13  -1.562  16.797  -7.272
  100   HH11  ARG  13          1HH1      ARG  13  -4.713  18.153  -6.569
  101   HH12  ARG  13          2HH1      ARG  13  -4.073  19.617  -5.902
  102   HH21  ARG  13          1HH2      ARG  13  -0.720  18.713  -6.389
  103   HH22  ARG  13          2HH2      ARG  13  -1.797  19.940  -5.800
  104    H    TYR  14           H        TYR  14  -2.645  11.460  -5.569
  105    HA   TYR  14           HA       TYR  14  -4.305  10.172  -7.444
  106    HB2  TYR  14          1HB       TYR  14  -2.691   8.857  -5.250
  107    HB3  TYR  14          2HB       TYR  14  -3.261   8.107  -6.734
  108    HD1  TYR  14           HD1      TYR  14  -2.589   9.786  -8.863
  109    HD2  TYR  14           HD2      TYR  14  -0.383   9.128  -5.285
  110    HE1  TYR  14           HE1      TYR  14  -0.522  10.407 -10.031
  111    HE2  TYR  14           HE2      TYR  14   1.693   9.761  -6.445
  112    HH   TYR  14           HH       TYR  14   2.590   9.896  -8.678
  113    H    ARG  15           H        ARG  15  -4.415  10.320  -3.933
  114    HA   ARG  15           HA       ARG  15  -6.347   8.316  -3.577
  115    HB2  ARG  15          1HB       ARG  15  -5.482   8.615  -1.549
  116    HB3  ARG  15          2HB       ARG  15  -4.899  10.218  -1.953
  117    HG2  ARG  15          1HG       ARG  15  -7.038  11.178  -1.323
  118    HG3  ARG  15          2HG       ARG  15  -7.703   9.563  -1.050
  119    HD2  ARG  15          1HD       ARG  15  -5.940   9.200   0.676
  120    HD3  ARG  15          2HD       ARG  15  -5.459  10.884   0.480
  121    HE   ARG  15           HE       ARG  15  -7.919  11.316   1.111
  122   HH11  ARG  15          1HH1      ARG  15  -5.930   8.702   2.354
  123   HH12  ARG  15          2HH1      ARG  15  -6.749   8.647   3.883
  124   HH21  ARG  15          1HH2      ARG  15  -9.005  11.233   3.095
  125   HH22  ARG  15          2HH2      ARG  15  -8.533  10.075   4.295
  126    H    THR  16           H        THR  16  -6.569  11.737  -4.186
  127    HA   THR  16           HA       THR  16  -9.288  12.130  -3.678
  128    HB   THR  16           HB       THR  16  -7.312  13.479  -5.502
  129    HG1  THR  16           HG1      THR  16  -6.906  14.148  -3.508
  130   HG21  THR  16          1HG2      THR  16  -8.961  15.272  -5.856
  131   HG22  THR  16          2HG2      THR  16 -10.187  14.291  -5.049
  132   HG23  THR  16          3HG2      THR  16  -9.477  13.744  -6.571
  133    H    GLU  17           H        GLU  17  -7.581  11.338  -6.700
  134    HA   GLU  17           HA       GLU  17  -9.904  11.279  -8.306
  135    HB2  GLU  17          1HB       GLU  17  -7.525   9.633  -9.052
  136    HB3  GLU  17          2HB       GLU  17  -8.540  10.642 -10.055
  137    HG2  GLU  17          1HG       GLU  17  -7.529  12.641  -9.116
  138    HG3  GLU  17          2HG       GLU  17  -6.493  11.641  -8.092
  139    H    CYS  18           H        CYS  18  -8.146   8.742  -6.560
  140    HA   CYS  18           HA       CYS  18  -9.585   6.567  -7.632
  141    HB2  CYS  18          1HB       CYS  18  -8.099   6.835  -5.014
  142    HB3  CYS  18          2HB       CYS  18  -8.798   5.322  -5.609
  143    H    VAL  19           H        VAL  19 -10.204   8.730  -4.940
  144    HA   VAL  19           HA       VAL  19 -12.351   7.300  -3.824
  145    HB   VAL  19           HB       VAL  19 -11.453  10.146  -3.668
  146   HG11  VAL  19          1HG1      VAL  19 -14.035   9.119  -2.500
  147   HG12  VAL  19          2HG1      VAL  19 -13.887  10.289  -3.815
  148   HG13  VAL  19          3HG1      VAL  19 -13.310  10.699  -2.197
  149   HG21  VAL  19          1HG2      VAL  19 -11.905   7.948  -1.654
  150   HG22  VAL  19          2HG2      VAL  19 -11.351   9.577  -1.262
  151   HG23  VAL  19          3HG2      VAL  19 -10.351   8.523  -2.263
  152    H    SER  20           H        SER  20 -12.275   9.987  -6.122
  153    HA   SER  20           HA       SER  20 -15.065  10.087  -6.510
  154    HB2  SER  20          1HB       SER  20 -13.450  11.922  -7.002
  155    HB3  SER  20          2HB       SER  20 -12.896  11.010  -8.404
  156    HG   SER  20           HG       SER  20 -14.486  11.898  -9.435
  157    H    SER  21           H        SER  21 -12.547   8.168  -8.060
  158    HA   SER  21           HA       SER  21 -14.185   7.409 -10.294
  159    HB2  SER  21          1HB       SER  21 -11.611   6.226  -9.237
  160    HB3  SER  21          2HB       SER  21 -12.355   5.818 -10.783
  161    HG   SER  21           HG       SER  21 -11.552   8.443 -10.033
  162    H    LEU  22           H        LEU  22 -13.102   5.793  -7.303
  163    HA   LEU  22           HA       LEU  22 -14.636   3.433  -7.954
  164    HB2  LEU  22          1HB       LEU  22 -12.969   4.188  -5.558
  165    HB3  LEU  22          2HB       LEU  22 -13.775   2.628  -5.739
  166    HG   LEU  22           HG       LEU  22 -11.748   3.671  -7.709
  167   HD11  LEU  22          1HD1      LEU  22 -11.361   1.817  -5.363
  168   HD12  LEU  22          2HD1      LEU  22 -10.682   3.436  -5.537
  169   HD13  LEU  22          3HD1      LEU  22 -10.163   2.141  -6.617
  170   HD21  LEU  22          1HD2      LEU  22 -11.669   1.379  -8.451
  171   HD22  LEU  22          2HD2      LEU  22 -13.335   1.960  -8.501
  172   HD23  LEU  22          3HD2      LEU  22 -12.809   0.900  -7.191
  173    H    ASN  23           H        ASN  23 -15.702   6.257  -7.110
  174    HA   ASN  23           HA       ASN  23 -17.488   7.138  -6.005
  175    HB2  ASN  23          1HB       ASN  23 -18.464   4.285  -6.177
  176    HB3  ASN  23          2HB       ASN  23 -19.462   5.676  -5.802
  177   HD21  ASN  23          1HD2      ASN  23 -19.657   3.776  -7.988
  178   HD22  ASN  23          2HD2      ASN  23 -19.579   4.711  -9.446
  179    H    ILE  24           H        ILE  24 -15.307   6.328  -4.340
  180    HA   ILE  24           HA       ILE  24 -16.127   4.897  -2.063
  181    HB   ILE  24           HB       ILE  24 -14.020   7.059  -2.157
  182   HG12  ILE  24          1HG1      ILE  24 -13.662   5.392  -3.963
  183   HG13  ILE  24          2HG1      ILE  24 -12.410   5.313  -2.726
  184   HG21  ILE  24          1HG2      ILE  24 -14.381   4.659  -0.364
  185   HG22  ILE  24          2HG2      ILE  24 -14.608   6.352   0.083
  186   HG23  ILE  24          3HG2      ILE  24 -13.000   5.759  -0.334
  187   HD11  ILE  24          1HD1      ILE  24 -14.750   3.439  -3.011
  188   HD12  ILE  24          2HD1      ILE  24 -13.510   3.352  -1.759
  189   HD13  ILE  24          3HD1      ILE  24 -13.074   3.099  -3.450
  190    HA   PRO  25           HA       PRO  25 -18.991   7.933  -0.400
  191    HB2  PRO  25          1HB       PRO  25 -18.750   6.208   1.982
  192    HB3  PRO  25          2HB       PRO  25 -20.186   6.692   1.077
  193    HG2  PRO  25          1HG       PRO  25 -19.208   4.212   0.934
  194    HG3  PRO  25          2HG       PRO  25 -19.953   5.013  -0.461
  195    HD2  PRO  25          1HD       PRO  25 -17.060   4.543   0.137
  196    HD3  PRO  25          2HD       PRO  25 -17.920   4.506  -1.423
  197    H    ALA  26           H        ALA  26 -18.851   9.629   0.924
  198    HA   ALA  26           HA       ALA  26 -16.379  10.684   1.596
  199    HB1  ALA  26          1HB       ALA  26 -19.056  11.395   2.780
  200    HB2  ALA  26          2HB       ALA  26 -18.415  11.998   1.252
  201    HB3  ALA  26          3HB       ALA  26 -17.616  12.414   2.770
  202    H    ASP  27           H        ASP  27 -18.646   8.885   3.608
  203    HA   ASP  27           HA       ASP  27 -17.529   9.261   6.111
  204    HB2  ASP  27          1HB       ASP  27 -19.602   8.079   5.848
  205    HB3  ASP  27          2HB       ASP  27 -18.811   6.787   4.950
  206    H    TYR  28           H        TYR  28 -16.694   6.764   3.710
  207    HA   TYR  28           HA       TYR  28 -14.632   5.590   5.182
  208    HB2  TYR  28          1HB       TYR  28 -15.270   5.692   2.252
  209    HB3  TYR  28          2HB       TYR  28 -13.828   4.861   2.834
  210    HD1  TYR  28           HD1      TYR  28 -17.511   4.925   2.943
  211    HD2  TYR  28           HD2      TYR  28 -14.004   2.706   3.874
  212    HE1  TYR  28           HE1      TYR  28 -18.887   2.946   3.387
  213    HE2  TYR  28           HE2      TYR  28 -15.377   0.717   4.325
  214    HH   TYR  28           HH       TYR  28 -17.667   0.157   4.924
  215    H    VAL  29           H        VAL  29 -14.649   8.300   2.923
  216    HA   VAL  29           HA       VAL  29 -11.914   8.651   2.576
  217    HB   VAL  29           HB       VAL  29 -14.042  10.781   2.690
  218   HG11  VAL  29          1HG1      VAL  29 -11.267  10.804   1.519
  219   HG12  VAL  29          2HG1      VAL  29 -11.839  11.761   2.884
  220   HG13  VAL  29          3HG1      VAL  29 -12.476  12.062   1.267
  221   HG21  VAL  29          1HG2      VAL  29 -12.945   9.159   0.404
  222   HG22  VAL  29          2HG2      VAL  29 -14.038  10.535   0.236
  223   HG23  VAL  29          3HG2      VAL  29 -14.575   9.077   1.073
  224    H    GLU  30           H        GLU  30 -14.051  10.013   5.087
  225    HA   GLU  30           HA       GLU  30 -12.085  11.495   6.458
  226    HB2  GLU  30          1HB       GLU  30 -14.365  10.170   7.896
  227    HB3  GLU  30          2HB       GLU  30 -13.623  11.738   8.180
  228    HG2  GLU  30          1HG       GLU  30 -14.556  12.515   6.033
  229    HG3  GLU  30          2HG       GLU  30 -15.420  10.987   5.902
  230    H    LYS  31           H        LYS  31 -13.117   8.145   6.746
  231    HA   LYS  31           HA       LYS  31 -11.595   7.619   9.090
  232    HB2  LYS  31          1HB       LYS  31 -12.953   5.871   9.172
  233    HB3  LYS  31          2HB       LYS  31 -13.636   6.368   7.644
  234    HG2  LYS  31          1HG       LYS  31 -12.022   4.951   6.464
  235    HG3  LYS  31          2HG       LYS  31 -11.361   4.423   8.018
  236    HD2  LYS  31          1HD       LYS  31 -14.210   4.054   7.069
  237    HD3  LYS  31          2HD       LYS  31 -12.968   2.791   7.132
  238    HE2  LYS  31          1HE       LYS  31 -12.889   2.931   9.544
  239    HE3  LYS  31          2HE       LYS  31 -13.957   4.332   9.541
  240    HZ1  LYS  31          1HZ       LYS  31 -15.734   2.962   8.698
  241    HZ2  LYS  31          2HZ       LYS  31 -15.119   2.289  10.121
  242    HZ3  LYS  31          3HZ       LYS  31 -14.716   1.612   8.628
  243    H    PHE  32           H        PHE  32 -10.883   7.451   5.661
  244    HA   PHE  32           HA       PHE  32  -8.481   5.921   6.023
  245    HB2  PHE  32          1HB       PHE  32  -9.342   7.583   3.649
  246    HB3  PHE  32          2HB       PHE  32  -7.997   6.452   3.681
  247    HD1  PHE  32           HD1      PHE  32 -10.483   6.546   1.842
  248    HD2  PHE  32           HD2      PHE  32  -9.506   4.313   5.330
  249    HE1  PHE  32           HE1      PHE  32 -11.975   4.739   1.101
  250    HE2  PHE  32           HE2      PHE  32 -10.998   2.506   4.595
  251    HZ   PHE  32           HZ       PHE  32 -12.233   2.715   2.477
  252    H    LYS  33           H        LYS  33  -9.384   9.203   6.357
  253    HA   LYS  33           HA       LYS  33  -6.741  10.301   5.958
  254    HB2  LYS  33          1HB       LYS  33  -9.106  11.461   5.769
  255    HB3  LYS  33          2HB       LYS  33  -8.888  11.705   7.499
  256    HG2  LYS  33          1HG       LYS  33  -6.742  12.822   7.059
  257    HG3  LYS  33          2HG       LYS  33  -7.035  12.653   5.323
  258    HD2  LYS  33          1HD       LYS  33  -8.770  14.169   7.278
  259    HD3  LYS  33          2HD       LYS  33  -7.642  14.888   6.131
  260    HE2  LYS  33          1HE       LYS  33  -8.931  13.977   4.275
  261    HE3  LYS  33          2HE       LYS  33 -10.043  13.211   5.409
  262    HZ1  LYS  33          1HZ       LYS  33 -10.936  15.276   4.544
  263    HZ2  LYS  33          2HZ       LYS  33  -9.604  16.134   5.133
  264    HZ3  LYS  33          3HZ       LYS  33 -10.676  15.393   6.211
  265    H    LYS  34           H        LYS  34  -8.319   8.579   8.362
  266    HA   LYS  34           HA       LYS  34  -6.565   9.611  10.468
  267    HB2  LYS  34          1HB       LYS  34  -9.142   8.054  10.542
  268    HB3  LYS  34          2HB       LYS  34  -8.100   8.167  11.954
  269    HG2  LYS  34          1HG       LYS  34  -9.263  10.525  10.489
  270    HG3  LYS  34          2HG       LYS  34  -9.965   9.792  11.931
  271    HD2  LYS  34          1HD       LYS  34  -7.209  11.010  11.754
  272    HD3  LYS  34          2HD       LYS  34  -8.625  11.788  12.457
  273    HE2  LYS  34          1HE       LYS  34  -7.303   9.254  13.423
  274    HE3  LYS  34          2HE       LYS  34  -7.236  10.833  14.203
  275    HZ1  LYS  34          1HZ       LYS  34  -9.634  10.718  14.530
  276    HZ2  LYS  34          2HZ       LYS  34  -8.853   9.416  15.268
  277    HZ3  LYS  34          3HZ       LYS  34  -9.677   9.187  13.811
  278    H    TRP  35           H        TRP  35  -5.949   7.771   8.207
  279    HA   TRP  35           HA       TRP  35  -4.943   5.807   7.705
  280    HB2  TRP  35          1HB       TRP  35  -3.808   6.393  10.433
  281    HB3  TRP  35          2HB       TRP  35  -3.200   5.096   9.396
  282    HD1  TRP  35           HD1      TRP  35  -3.362   8.918   9.640
  283    HE1  TRP  35           HE1      TRP  35  -1.566   9.921   8.089
  284    HE3  TRP  35           HE3      TRP  35  -1.852   4.637   7.272
  285    HZ2  TRP  35           HZ2      TRP  35   0.242   9.014   6.128
  286    HZ3  TRP  35           HZ3      TRP  35  -0.087   4.798   5.573
  287    HH2  TRP  35           HH2      TRP  35   0.944   6.932   5.010
  288    H    GLU  36           H        GLU  36  -7.504   5.280   8.448
  289    HA   GLU  36           HA       GLU  36  -7.188   2.745   9.903
  290    HB2  GLU  36          1HB       GLU  36  -8.606   4.361  11.120
  291    HB3  GLU  36          2HB       GLU  36  -9.670   4.453   9.725
  292    HG2  GLU  36          1HG       GLU  36 -10.309   2.179   9.981
  293    HG3  GLU  36          2HG       GLU  36  -9.108   1.926  11.241
  294    H    PHE  37           H        PHE  37  -7.286   1.090   8.587
  295    HA   PHE  37           HA       PHE  37  -8.990   1.303   6.194
  296    HB2  PHE  37          1HB       PHE  37  -6.360  -0.195   6.318
  297    HB3  PHE  37          2HB       PHE  37  -7.334   0.123   4.888
  298    HD1  PHE  37           HD1      PHE  37  -7.276   2.291   3.795
  299    HD2  PHE  37           HD2      PHE  37  -5.003   1.552   7.325
  300    HE1  PHE  37           HE1      PHE  37  -5.987   4.349   3.400
  301    HE2  PHE  37           HE2      PHE  37  -3.716   3.606   6.931
  302    HZ   PHE  37           HZ       PHE  37  -4.204   5.008   4.971
  303    HA   PRO  38           HA       PRO  38 -10.458  -2.299   8.713
  304    HB2  PRO  38          1HB       PRO  38 -12.957  -1.530   7.333
  305    HB3  PRO  38          2HB       PRO  38 -12.659  -1.840   9.053
  306    HG2  PRO  38          1HG       PRO  38 -13.060   0.641   8.187
  307    HG3  PRO  38          2HG       PRO  38 -11.843   0.296   9.431
  308    HD2  PRO  38          1HD       PRO  38 -11.436   0.760   6.482
  309    HD3  PRO  38          2HD       PRO  38 -10.518   1.423   7.872
  310    H    GLU  39           H        GLU  39 -11.143  -4.314   8.061
  311    HA   GLU  39           HA       GLU  39 -10.473  -5.115   5.428
  312    HB2  GLU  39          1HB       GLU  39 -10.187  -6.583   7.377
  313    HB3  GLU  39          2HB       GLU  39 -11.931  -6.649   7.586
  314    HG2  GLU  39          1HG       GLU  39 -12.190  -7.801   5.497
  315    HG3  GLU  39          2HG       GLU  39 -10.476  -7.607   5.132
  316    H    ASP  40           H        ASP  40 -11.737  -3.997   4.024
  317    HA   ASP  40           HA       ASP  40 -14.440  -4.996   3.642
  318    HB2  ASP  40          1HB       ASP  40 -14.752  -2.995   5.086
  319    HB3  ASP  40          2HB       ASP  40 -13.900  -2.018   3.891
  320    H    ASP  41           H        ASP  41 -15.112  -4.855   1.531
  321    HA   ASP  41           HA       ASP  41 -13.030  -5.029  -0.362
  322    HB2  ASP  41          1HB       ASP  41 -14.733  -5.474  -2.007
  323    HB3  ASP  41          2HB       ASP  41 -15.169  -6.305  -0.520
  324    H    THR  42           H        THR  42 -15.083  -2.377   0.590
  325    HA   THR  42           HA       THR  42 -14.700  -0.758  -1.720
  326    HB   THR  42           HB       THR  42 -15.127   0.307   1.058
  327    HG1  THR  42           HG1      THR  42 -16.671  -1.235   0.992
  328   HG21  THR  42          1HG2      THR  42 -14.862   1.972  -0.669
  329   HG22  THR  42          2HG2      THR  42 -16.552   1.933  -0.163
  330   HG23  THR  42          3HG2      THR  42 -16.065   1.165  -1.675
  331    H    THR  43           H        THR  43 -13.163  -0.917   1.455
  332    HA   THR  43           HA       THR  43 -11.200   1.050   1.087
  333    HB   THR  43           HB       THR  43 -10.947  -1.443   2.776
  334    HG1  THR  43           HG1      THR  43 -11.864   0.158   4.402
  335   HG21  THR  43          1HG2      THR  43  -8.908  -0.118   2.641
  336   HG22  THR  43          2HG2      THR  43  -9.624   0.032   4.248
  337   HG23  THR  43          3HG2      THR  43  -9.805   1.337   3.076
  338    H    MET  44           H        MET  44 -11.318  -2.347   0.233
  339    HA   MET  44           HA       MET  44  -8.547  -2.703  -0.139
  340    HB2  MET  44          1HB       MET  44 -10.875  -4.267  -1.241
  341    HB3  MET  44          2HB       MET  44  -9.196  -4.783  -1.335
  342    HG2  MET  44          1HG       MET  44  -9.094  -4.781   1.124
  343    HG3  MET  44          2HG       MET  44 -10.796  -4.338   1.172
  344    HE1  MET  44          1HE       MET  44 -11.282  -6.371   2.757
  345    HE2  MET  44          2HE       MET  44  -9.573  -6.812   2.712
  346    HE3  MET  44          3HE       MET  44 -10.808  -8.035   2.402
  347    H    CYS  45           H        CYS  45 -11.167  -2.183  -2.506
  348    HA   CYS  45           HA       CYS  45  -9.424  -2.135  -4.732
  349    HB2  CYS  45          1HB       CYS  45 -12.199  -0.967  -4.427
  350    HB3  CYS  45          2HB       CYS  45 -11.328  -1.088  -5.950
  351    H    TYR  46           H        TYR  46 -10.481   0.326  -2.475
  352    HA   TYR  46           HA       TYR  46  -9.609   2.591  -3.853
  353    HB2  TYR  46          1HB       TYR  46 -10.901   2.994  -1.946
  354    HB3  TYR  46          2HB       TYR  46  -9.924   1.928  -0.936
  355    HD1  TYR  46           HD1      TYR  46  -8.464   2.909   0.562
  356    HD2  TYR  46           HD2      TYR  46  -9.574   5.090  -2.927
  357    HE1  TYR  46           HE1      TYR  46  -7.193   4.849   1.375
  358    HE2  TYR  46           HE2      TYR  46  -8.301   7.032  -2.118
  359    HH   TYR  46           HH       TYR  46  -6.152   6.860   0.557
  360    H    ILE  47           H        ILE  47  -7.895   0.531  -1.527
  361    HA   ILE  47           HA       ILE  47  -5.427   1.838  -1.640
  362    HB   ILE  47           HB       ILE  47  -6.089  -1.030  -1.005
  363   HG12  ILE  47          1HG1      ILE  47  -7.046   0.569   0.560
  364   HG13  ILE  47          2HG1      ILE  47  -5.722  -0.288   1.342
  365   HG21  ILE  47          1HG2      ILE  47  -3.785  -0.950  -1.731
  366   HG22  ILE  47          2HG2      ILE  47  -3.844  -1.169   0.020
  367   HG23  ILE  47          3HG2      ILE  47  -3.464   0.413  -0.658
  368   HD11  ILE  47          1HD1      ILE  47  -4.267   1.682   0.858
  369   HD12  ILE  47          2HD1      ILE  47  -5.607   2.010   1.956
  370   HD13  ILE  47          3HD1      ILE  47  -5.702   2.526   0.273
  371    H    LYS  48           H        LYS  48  -6.810  -0.698  -3.648
  372    HA   LYS  48           HA       LYS  48  -4.510  -1.417  -5.058
  373    HB2  LYS  48          1HB       LYS  48  -6.743  -2.601  -5.062
  374    HB3  LYS  48          2HB       LYS  48  -7.324  -1.366  -6.164
  375    HG2  LYS  48          1HG       LYS  48  -4.943  -3.105  -6.758
  376    HG3  LYS  48          2HG       LYS  48  -6.591  -3.542  -7.206
  377    HD2  LYS  48          1HD       LYS  48  -6.767  -1.518  -8.563
  378    HD3  LYS  48          2HD       LYS  48  -5.135  -1.046  -8.086
  379    HE2  LYS  48          1HE       LYS  48  -4.910  -2.012 -10.215
  380    HE3  LYS  48          2HE       LYS  48  -4.364  -3.244  -9.082
  381    HZ1  LYS  48          1HZ       LYS  48  -5.736  -4.333 -10.624
  382    HZ2  LYS  48          2HZ       LYS  48  -6.928  -3.134 -10.552
  383    HZ3  LYS  48          3HZ       LYS  48  -6.690  -4.160  -9.233
  384    H    CYS  49           H        CYS  49  -7.089   0.878  -5.963
  385    HA   CYS  49           HA       CYS  49  -5.995   1.805  -8.325
  386    HB2  CYS  49          1HB       CYS  49  -8.228   2.373  -7.809
  387    HB3  CYS  49          2HB       CYS  49  -7.776   3.186  -6.312
  388    H    VAL  50           H        VAL  50  -5.506   3.071  -5.037
  389    HA   VAL  50           HA       VAL  50  -3.950   5.280  -5.743
  390    HB   VAL  50           HB       VAL  50  -4.056   3.702  -3.174
  391   HG11  VAL  50          1HG1      VAL  50  -2.833   6.406  -3.709
  392   HG12  VAL  50          2HG1      VAL  50  -1.970   4.932  -3.266
  393   HG13  VAL  50          3HG1      VAL  50  -3.074   5.689  -2.116
  394   HG21  VAL  50          1HG2      VAL  50  -6.168   4.653  -3.669
  395   HG22  VAL  50          2HG2      VAL  50  -5.435   6.183  -4.139
  396   HG23  VAL  50          3HG2      VAL  50  -5.413   5.679  -2.449
  397    H    PHE  51           H        PHE  51  -3.045   2.029  -4.692
  398    HA   PHE  51           HA       PHE  51  -0.271   2.446  -4.693
  399    HB2  PHE  51          1HB       PHE  51  -2.096   0.111  -4.538
  400    HB3  PHE  51          2HB       PHE  51  -0.422  -0.214  -4.983
  401    HD1  PHE  51           HD1      PHE  51  -1.515   2.481  -2.708
  402    HD2  PHE  51           HD2      PHE  51   0.191  -1.408  -3.027
  403    HE1  PHE  51           HE1      PHE  51  -0.913   2.552  -0.324
  404    HE2  PHE  51           HE2      PHE  51   0.796  -1.340  -0.644
  405    HZ   PHE  51           HZ       PHE  51   0.247   0.642   0.709
  406    H    ASN  52           H        ASN  52  -2.535   1.770  -7.187
  407    HA   ASN  52           HA       ASN  52  -0.621   0.720  -9.065
  408    HB2  ASN  52          1HB       ASN  52  -3.011   0.072  -9.125
  409    HB3  ASN  52          2HB       ASN  52  -3.441   1.739  -9.526
  410   HD21  ASN  52          1HD2      ASN  52  -0.653  -0.032 -10.761
  411   HD22  ASN  52          2HD2      ASN  52  -1.178  -0.059 -12.407
  412    H    LYS  53           H        LYS  53  -2.226   3.804  -8.462
  413    HA   LYS  53           HA       LYS  53  -1.103   5.081 -10.764
  414    HB2  LYS  53          1HB       LYS  53  -2.689   5.995  -8.401
  415    HB3  LYS  53          2HB       LYS  53  -1.926   7.186  -9.445
  416    HG2  LYS  53          1HG       LYS  53  -3.148   6.176 -11.368
  417    HG3  LYS  53          2HG       LYS  53  -3.981   5.123 -10.220
  418    HD2  LYS  53          1HD       LYS  53  -4.969   7.023  -9.123
  419    HD3  LYS  53          2HD       LYS  53  -4.019   8.136 -10.111
  420    HE2  LYS  53          1HE       LYS  53  -5.151   7.272 -12.120
  421    HE3  LYS  53          2HE       LYS  53  -6.136   6.230 -11.098
  422    HZ1  LYS  53          1HZ       LYS  53  -7.154   8.106 -10.111
  423    HZ2  LYS  53          2HZ       LYS  53  -7.208   8.353 -11.781
  424    HZ3  LYS  53          3HZ       LYS  53  -6.070   9.185 -10.837
  425    H    MET  54           H        MET  54  -0.054   4.490  -7.559
  426    HA   MET  54           HA       MET  54   1.987   6.542  -7.633
  427    HB2  MET  54          1HB       MET  54   1.249   4.414  -5.642
  428    HB3  MET  54          2HB       MET  54   2.695   5.405  -5.458
  429    HG2  MET  54          1HG       MET  54   1.413   7.375  -5.258
  430    HG3  MET  54          2HG       MET  54  -0.057   6.554  -5.777
  431    HE1  MET  54          1HE       MET  54   2.762   5.678  -3.028
  432    HE2  MET  54          2HE       MET  54   1.899   6.317  -1.626
  433    HE3  MET  54          3HE       MET  54   2.365   7.392  -2.945
  434    H    GLN  55           H        GLN  55   1.694   3.834  -9.285
  435    HA   GLN  55           HA       GLN  55   3.029   2.306 -10.251
  436    HB2  GLN  55          1HB       GLN  55   4.842   4.603  -9.770
  437    HB3  GLN  55          2HB       GLN  55   5.580   3.086 -10.280
  438    HG2  GLN  55          1HG       GLN  55   5.165   4.511 -12.182
  439    HG3  GLN  55          2HG       GLN  55   4.138   3.086 -12.263
  440   HE21  GLN  55          1HE2      GLN  55   4.227   6.526 -11.723
  441   HE22  GLN  55          2HE2      GLN  55   2.526   6.795 -11.899
  442    H    LEU  56           H        LEU  56   2.399   1.641  -7.709
  443    HA   LEU  56           HA       LEU  56   4.902   0.647  -6.577
  444    HB2  LEU  56          1HB       LEU  56   2.651   2.099  -5.370
  445    HB3  LEU  56          2HB       LEU  56   3.214   0.719  -4.415
  446    HG   LEU  56           HG       LEU  56   4.847   3.081  -5.349
  447   HD11  LEU  56          1HD1      LEU  56   3.979   2.286  -2.579
  448   HD12  LEU  56          2HD1      LEU  56   3.275   3.587  -3.528
  449   HD13  LEU  56          3HD1      LEU  56   4.955   3.687  -3.010
  450   HD21  LEU  56          1HD2      LEU  56   6.551   2.089  -3.772
  451   HD22  LEU  56          2HD2      LEU  56   6.328   1.249  -5.305
  452   HD23  LEU  56          3HD2      LEU  56   5.601   0.604  -3.832
  453    H    PHE  57           H        PHE  57   1.825  -0.119  -7.776
  454    HA   PHE  57           HA       PHE  57   2.252  -2.936  -7.181
  455    HB2  PHE  57          1HB       PHE  57   0.756  -2.279  -5.385
  456    HB3  PHE  57          2HB       PHE  57  -0.308  -1.452  -6.514
  457    HD1  PHE  57           HD1      PHE  57   0.892  -4.756  -5.399
  458    HD2  PHE  57           HD2      PHE  57  -1.986  -2.630  -7.708
  459    HE1  PHE  57           HE1      PHE  57  -0.440  -6.812  -5.633
  460    HE2  PHE  57           HE2      PHE  57  -3.317  -4.683  -7.944
  461    HZ   PHE  57           HZ       PHE  57  -2.545  -6.772  -6.905
  462    H    ASP  58           H        ASP  58   1.630  -4.248  -8.793
  463    HA   ASP  58           HA       ASP  58   0.211  -3.073 -11.091
  464    HB2  ASP  58          1HB       ASP  58   2.596  -3.187 -11.617
  465    HB3  ASP  58          2HB       ASP  58   2.649  -4.875 -11.123
  466    H    ASP  59           H        ASP  59  -1.129  -4.506 -12.242
  467    HA   ASP  59           HA       ASP  59  -2.409  -6.462 -10.623
  468    HB2  ASP  59          1HB       ASP  59  -2.736  -5.670 -13.499
  469    HB3  ASP  59          2HB       ASP  59  -3.608  -7.027 -12.827
  470    H    THR  60           H        THR  60   0.132  -6.651 -12.950
  471    HA   THR  60           HA       THR  60  -0.167  -9.534 -13.190
  472    HB   THR  60           HB       THR  60   1.638  -7.549 -14.554
  473    HG1  THR  60           HG1      THR  60  -0.759  -8.080 -15.063
  474   HG21  THR  60          1HG2      THR  60   1.547 -10.541 -14.945
  475   HG22  THR  60          2HG2      THR  60   2.876  -9.629 -14.227
  476   HG23  THR  60          3HG2      THR  60   2.462  -9.398 -15.925
  477    H    GLU  61           H        GLU  61   2.571  -7.329 -12.536
  478    HA   GLU  61           HA       GLU  61   4.154  -9.452 -11.469
  479    HB2  GLU  61          1HB       GLU  61   4.746  -6.533 -11.123
  480    HB3  GLU  61          2HB       GLU  61   5.864  -7.880 -11.259
  481    HG2  GLU  61          1HG       GLU  61   5.181  -8.190 -13.591
  482    HG3  GLU  61          2HG       GLU  61   4.135  -6.784 -13.450
  483    H    GLY  62           H        GLY  62   1.766  -7.461 -10.078
  484    HA2  GLY  62          1HA       GLY  62   0.992  -7.469  -7.884
  485    HA3  GLY  62          2HA       GLY  62   2.364  -8.497  -7.447
  486    HA   PRO  63           HA       PRO  63   3.281  -4.466  -5.390
  487    HB2  PRO  63          1HB       PRO  63   4.989  -6.345  -3.857
  488    HB3  PRO  63          2HB       PRO  63   3.866  -5.107  -3.275
  489    HG2  PRO  63          1HG       PRO  63   3.290  -7.729  -3.119
  490    HG3  PRO  63          2HG       PRO  63   2.043  -6.504  -3.409
  491    HD2  PRO  63          1HD       PRO  63   3.318  -8.411  -5.325
  492    HD3  PRO  63          2HD       PRO  63   1.646  -7.799  -5.282
  493    H    LEU  64           H        LEU  64   4.737  -3.285  -6.442
  494    HA   LEU  64           HA       LEU  64   6.947  -4.522  -7.828
  495    HB2  LEU  64          1HB       LEU  64   6.354  -1.574  -7.539
  496    HB3  LEU  64          2HB       LEU  64   7.388  -2.339  -8.729
  497    HG   LEU  64           HG       LEU  64   4.404  -2.734  -8.567
  498   HD11  LEU  64          1HD1      LEU  64   4.312  -1.397 -10.606
  499   HD12  LEU  64          2HD1      LEU  64   6.045  -1.096 -10.493
  500   HD13  LEU  64          3HD1      LEU  64   4.957  -0.463  -9.258
  501   HD21  LEU  64          1HD2      LEU  64   4.670  -3.844 -10.707
  502   HD22  LEU  64          2HD2      LEU  64   5.622  -4.650  -9.455
  503   HD23  LEU  64          3HD2      LEU  64   6.416  -3.601 -10.630
  504    H    VAL  65           H        VAL  65   8.232  -5.334  -6.277
  505    HA   VAL  65           HA       VAL  65   8.932  -4.327  -3.839
  506    HB   VAL  65           HB       VAL  65  10.585  -6.030  -5.687
  507   HG11  VAL  65          1HG1      VAL  65  10.948  -5.521  -2.735
  508   HG12  VAL  65          2HG1      VAL  65  12.034  -5.003  -4.027
  509   HG13  VAL  65          3HG1      VAL  65  11.826  -6.721  -3.683
  510   HG21  VAL  65          1HG2      VAL  65   9.754  -7.854  -4.233
  511   HG22  VAL  65          2HG2      VAL  65   8.476  -7.033  -5.124
  512   HG23  VAL  65          3HG2      VAL  65   8.722  -6.680  -3.415
  513    H    ASP  66           H        ASP  66  10.597  -3.740  -6.913
  514    HA   ASP  66           HA       ASP  66  12.824  -2.407  -5.898
  515    HB2  ASP  66          1HB       ASP  66  12.690  -3.210  -8.189
  516    HB3  ASP  66          2HB       ASP  66  11.441  -2.025  -8.554
  517    H    ASN  67           H        ASN  67   9.826  -0.982  -7.224
  518    HA   ASN  67           HA       ASN  67  10.508   1.673  -6.546
  519    HB2  ASN  67          1HB       ASN  67   7.832   0.396  -7.090
  520    HB3  ASN  67          2HB       ASN  67   8.060   2.124  -6.858
  521   HD21  ASN  67          1HD2      ASN  67   7.044   0.795  -9.183
  522   HD22  ASN  67          2HD2      ASN  67   8.117   1.159 -10.492
  523    H    LEU  68           H        LEU  68   8.960  -0.922  -4.839
  524    HA   LEU  68           HA       LEU  68   7.826   0.524  -2.720
  525    HB2  LEU  68          1HB       LEU  68   8.648  -2.320  -3.120
  526    HB3  LEU  68          2HB       LEU  68   8.189  -1.772  -1.515
  527    HG   LEU  68           HG       LEU  68   6.402  -1.374  -3.900
  528   HD11  LEU  68          1HD1      LEU  68   5.218  -3.394  -3.256
  529   HD12  LEU  68          2HD1      LEU  68   6.395  -3.697  -1.977
  530   HD13  LEU  68          3HD1      LEU  68   6.890  -3.771  -3.667
  531   HD21  LEU  68          1HD2      LEU  68   4.677  -1.203  -2.191
  532   HD22  LEU  68          2HD2      LEU  68   5.957  -0.021  -1.920
  533   HD23  LEU  68          3HD2      LEU  68   5.885  -1.482  -0.936
  534    H    VAL  69           H        VAL  69  11.022  -0.914  -3.132
  535    HA   VAL  69           HA       VAL  69  11.968  -0.204  -0.540
  536    HB   VAL  69           HB       VAL  69  13.504  -0.835  -3.052
  537   HG11  VAL  69          1HG1      VAL  69  14.922   0.337  -1.525
  538   HG12  VAL  69          2HG1      VAL  69  15.334  -1.376  -1.450
  539   HG13  VAL  69          3HG1      VAL  69  14.355  -0.645  -0.176
  540   HG21  VAL  69          1HG2      VAL  69  11.998  -2.630  -2.291
  541   HG22  VAL  69          2HG2      VAL  69  12.804  -2.603  -0.719
  542   HG23  VAL  69          3HG2      VAL  69  13.701  -3.067  -2.166
  543    H    HIS  70           H        HIS  70  12.212   1.276  -3.753
  544    HA   HIS  70           HA       HIS  70  13.895   3.414  -2.972
  545    HB2  HIS  70          1HB       HIS  70  12.051   2.976  -5.297
  546    HB3  HIS  70          2HB       HIS  70  12.822   4.539  -5.057
  547    HD1  HIS  70           HD1      HIS  70  15.100   4.794  -6.007
  548    HD2  HIS  70           HD2      HIS  70  14.039   0.800  -5.585
  549    HE1  HIS  70           HE1      HIS  70  16.951   3.486  -7.088
  550    HE2  HIS  70           HE2      HIS  70  16.226   1.082  -6.932
  551    H    GLN  71           H        GLN  71  10.551   2.842  -2.565
  552    HA   GLN  71           HA       GLN  71   9.900   5.618  -1.986
  553    HB2  GLN  71          1HB       GLN  71   8.332   4.054  -3.174
  554    HB3  GLN  71          2HB       GLN  71   8.191   3.145  -1.674
  555    HG2  GLN  71          1HG       GLN  71   6.303   4.544  -1.790
  556    HG3  GLN  71          2HG       GLN  71   7.385   5.234  -0.580
  557   HE21  GLN  71          1HE2      GLN  71   6.490   7.271  -0.759
  558   HE22  GLN  71          2HE2      GLN  71   6.741   8.274  -2.138
  559    H    LEU  72           H        LEU  72   9.610   2.532  -0.240
  560    HA   LEU  72           HA       LEU  72   8.972   3.737   2.216
  561    HB2  LEU  72          1HB       LEU  72   9.875   0.948   1.547
  562    HB3  LEU  72          2HB       LEU  72   9.411   1.443   3.163
  563    HG   LEU  72           HG       LEU  72   7.606   1.572   0.746
  564   HD11  LEU  72          1HD1      LEU  72   8.108  -0.739   1.324
  565   HD12  LEU  72          2HD1      LEU  72   6.452  -0.340   1.785
  566   HD13  LEU  72          3HD1      LEU  72   7.716  -0.421   3.015
  567   HD21  LEU  72          1HD2      LEU  72   6.942   3.212   2.350
  568   HD22  LEU  72          2HD2      LEU  72   7.134   2.065   3.679
  569   HD23  LEU  72          3HD2      LEU  72   5.842   1.838   2.498
  570    H    ALA  73           H        ALA  73  12.021   2.418   0.979
  571    HA   ALA  73           HA       ALA  73  13.466   2.805   3.396
  572    HB1  ALA  73          1HB       ALA  73  14.077   1.172   1.648
  573    HB2  ALA  73          2HB       ALA  73  15.413   2.216   2.142
  574    HB3  ALA  73          3HB       ALA  73  14.572   2.514   0.619
  575    H    HIS  74           H        HIS  74  12.074   5.151   2.679
  576    HA   HIS  74           HA       HIS  74  13.661   7.137   1.455
  577    HB2  HIS  74          1HB       HIS  74  11.128   7.103   2.040
  578    HB3  HIS  74          2HB       HIS  74  11.648   7.681   3.616
  579    HD1  HIS  74           HD1      HIS  74  10.045   9.102   1.061
  580    HD2  HIS  74           HD2      HIS  74  13.749   9.988   2.719
  581    HE1  HIS  74           HE1      HIS  74  10.523  11.479   0.410
  582    HE2  HIS  74           HE2      HIS  74  12.865  11.917   1.227
  583    H    GLY  75           H        GLY  75  15.755   6.773   2.403
  584    HA2  GLY  75          1HA       GLY  75  17.396   7.765   3.734
  585    HA3  GLY  75          2HA       GLY  75  16.139   8.354   4.812
  586    H    ARG  76           H        ARG  76  16.553   5.020   3.737
  587    HA   ARG  76           HA       ARG  76  17.662   4.240   6.301
  588    HB2  ARG  76          1HB       ARG  76  14.870   3.682   5.477
  589    HB3  ARG  76          2HB       ARG  76  15.735   2.376   6.279
  590    HG2  ARG  76          1HG       ARG  76  16.264   4.076   8.094
  591    HG3  ARG  76          2HG       ARG  76  15.046   5.101   7.333
  592    HD2  ARG  76          1HD       ARG  76  13.455   3.172   7.549
  593    HD3  ARG  76          2HD       ARG  76  14.670   2.375   8.541
  594    HE   ARG  76           HE       ARG  76  14.153   4.965   9.538
  595   HH11  ARG  76          1HH1      ARG  76  12.728   1.775   9.345
  596   HH12  ARG  76          2HH1      ARG  76  11.740   1.993  10.755
  597   HH21  ARG  76          1HH2      ARG  76  12.860   5.251  11.405
  598   HH22  ARG  76          2HH2      ARG  76  11.808   3.972  11.921
  599    H    ASP  77           H        ASP  77  18.036   1.802   6.347
  600    HA   ASP  77           HA       ASP  77  19.572   0.991   4.164
  601    HB2  ASP  77          1HB       ASP  77  18.347  -0.701   6.350
  602    HB3  ASP  77          2HB       ASP  77  19.611  -1.234   5.249
  603    H    ALA  78           H        ALA  78  18.712   0.814   2.236
  604    HA   ALA  78           HA       ALA  78  16.116   0.061   1.567
  605    HB1  ALA  78          1HB       ALA  78  17.623   1.287   0.094
  606    HB2  ALA  78          2HB       ALA  78  16.967  -0.142  -0.701
  607    HB3  ALA  78          3HB       ALA  78  18.619  -0.156  -0.088
  608    H    GLU  79           H        GLU  79  19.045  -1.857   1.896
  609    HA   GLU  79           HA       GLU  79  18.120  -4.246   0.759
  610    HB2  GLU  79          1HB       GLU  79  20.197  -3.714   2.870
  611    HB3  GLU  79          2HB       GLU  79  19.900  -5.316   2.202
  612    HG2  GLU  79          1HG       GLU  79  20.450  -4.508  -0.019
  613    HG3  GLU  79          2HG       GLU  79  20.714  -2.888   0.619
  614    H    GLU  80           H        GLU  80  17.906  -3.033   4.067
  615    HA   GLU  80           HA       GLU  80  16.723  -5.384   5.148
  616    HB2  GLU  80          1HB       GLU  80  17.909  -3.681   6.497
  617    HB3  GLU  80          2HB       GLU  80  16.622  -2.536   6.154
  618    HG2  GLU  80          1HG       GLU  80  16.269  -3.424   8.331
  619    HG3  GLU  80          2HG       GLU  80  15.037  -4.090   7.271
  620    H    VAL  81           H        VAL  81  15.493  -2.296   3.964
  621    HA   VAL  81           HA       VAL  81  12.781  -2.622   4.481
  622    HB   VAL  81           HB       VAL  81  14.161  -1.141   2.250
  623   HG11  VAL  81          1HG1      VAL  81  12.072   0.165   2.072
  624   HG12  VAL  81          2HG1      VAL  81  11.295  -0.977   3.173
  625   HG13  VAL  81          3HG1      VAL  81  11.862  -1.520   1.593
  626   HG21  VAL  81          1HG2      VAL  81  13.679   0.800   3.709
  627   HG22  VAL  81          2HG2      VAL  81  14.808  -0.360   4.396
  628   HG23  VAL  81          3HG2      VAL  81  13.132  -0.327   4.948
  629    H    ARG  82           H        ARG  82  14.625  -3.503   1.562
  630    HA   ARG  82           HA       ARG  82  12.619  -4.550  -0.010
  631    HB2  ARG  82          1HB       ARG  82  15.017  -4.257  -0.637
  632    HB3  ARG  82          2HB       ARG  82  15.389  -5.705   0.288
  633    HG2  ARG  82          1HG       ARG  82  13.769  -6.935  -1.168
  634    HG3  ARG  82          2HG       ARG  82  13.692  -5.489  -2.171
  635    HD2  ARG  82          1HD       ARG  82  16.104  -5.609  -2.523
  636    HD3  ARG  82          2HD       ARG  82  16.177  -7.061  -1.530
  637    HE   ARG  82           HE       ARG  82  14.370  -7.256  -3.765
  638   HH11  ARG  82          1HH1      ARG  82  17.686  -7.659  -2.704
  639   HH12  ARG  82          2HH1      ARG  82  18.059  -8.840  -3.918
  640   HH21  ARG  82          1HH2      ARG  82  14.869  -8.803  -5.366
  641   HH22  ARG  82          2HH2      ARG  82  16.466  -9.477  -5.442
  642    H    THR  83           H        THR  83  14.405  -6.093   2.605
  643    HA   THR  83           HA       THR  83  13.452  -8.705   2.211
  644    HB   THR  83           HB       THR  83  14.697  -7.261   4.528
  645    HG1  THR  83           HG1      THR  83  16.296  -7.871   3.278
  646   HG21  THR  83          1HG2      THR  83  13.155  -8.885   5.530
  647   HG22  THR  83          2HG2      THR  83  14.834  -9.367   5.762
  648   HG23  THR  83          3HG2      THR  83  13.852 -10.163   4.532
  649    H    GLU  84           H        GLU  84  12.447  -6.245   4.611
  650    HA   GLU  84           HA       GLU  84  10.328  -7.700   5.689
  651    HB2  GLU  84          1HB       GLU  84  10.602  -4.698   5.491
  652    HB3  GLU  84          2HB       GLU  84   9.510  -5.566   6.565
  653    HG2  GLU  84          1HG       GLU  84  11.608  -6.697   7.472
  654    HG3  GLU  84          2HG       GLU  84  12.495  -5.414   6.657
  655    H    VAL  85           H        VAL  85  10.371  -5.517   2.895
  656    HA   VAL  85           HA       VAL  85   7.628  -5.506   2.346
  657    HB   VAL  85           HB       VAL  85  10.038  -5.270   0.553
  658   HG11  VAL  85          1HG1      VAL  85   8.270  -6.255  -0.792
  659   HG12  VAL  85          2HG1      VAL  85   8.512  -4.566  -1.246
  660   HG13  VAL  85          3HG1      VAL  85   7.138  -5.022  -0.238
  661   HG21  VAL  85          1HG2      VAL  85   9.621  -3.425   2.067
  662   HG22  VAL  85          2HG2      VAL  85   7.957  -3.300   1.488
  663   HG23  VAL  85          3HG2      VAL  85   9.302  -2.936   0.402
  664    H    LEU  86           H        LEU  86  10.177  -7.695   1.162
  665    HA   LEU  86           HA       LEU  86   8.624  -9.275  -0.504
  666    HB2  LEU  86          1HB       LEU  86  11.118  -9.906   1.064
  667    HB3  LEU  86          2HB       LEU  86  10.397 -11.032  -0.084
  668    HG   LEU  86           HG       LEU  86  11.263  -8.255  -0.852
  669   HD11  LEU  86          1HD1      LEU  86  12.815 -10.828  -1.090
  670   HD12  LEU  86          2HD1      LEU  86  13.174  -9.515   0.031
  671   HD13  LEU  86          3HD1      LEU  86  13.304  -9.249  -1.709
  672   HD21  LEU  86          1HD2      LEU  86   9.679  -9.268  -2.358
  673   HD22  LEU  86          2HD2      LEU  86  10.632 -10.751  -2.411
  674   HD23  LEU  86          3HD2      LEU  86  11.277  -9.263  -3.106
  675    H    LYS  87           H        LYS  87   9.017  -9.370   2.958
  676    HA   LYS  87           HA       LYS  87   7.903 -11.978   3.335
  677    HB2  LYS  87          1HB       LYS  87   8.313  -9.666   5.237
  678    HB3  LYS  87          2HB       LYS  87   7.714 -11.245   5.733
  679    HG2  LYS  87          1HG       LYS  87   9.776 -12.283   4.970
  680    HG3  LYS  87          2HG       LYS  87  10.384 -10.708   4.441
  681    HD2  LYS  87          1HD       LYS  87  10.297  -9.905   6.745
  682    HD3  LYS  87          2HD       LYS  87   9.673 -11.468   7.269
  683    HE2  LYS  87          1HE       LYS  87  12.353 -10.980   5.980
  684    HE3  LYS  87          2HE       LYS  87  12.072 -11.269   7.695
  685    HZ1  LYS  87          1HZ       LYS  87  11.452 -13.185   5.513
  686    HZ2  LYS  87          2HZ       LYS  87  11.243 -13.463   7.169
  687    HZ3  LYS  87          3HZ       LYS  87  12.797 -13.267   6.535
  688    H    CYS  88           H        CYS  88   6.606  -8.985   2.566
  689    HA   CYS  88           HA       CYS  88   3.939  -9.765   3.499
  690    HB2  CYS  88          1HB       CYS  88   5.214  -7.122   2.922
  691    HB3  CYS  88          2HB       CYS  88   3.448  -7.284   2.821
  692    H    VAL  89           H        VAL  89   5.903  -9.829   0.834
  693    HA   VAL  89           HA       VAL  89   3.853  -9.455  -1.162
  694    HB   VAL  89           HB       VAL  89   6.653 -10.564  -1.397
  695   HG11  VAL  89          1HG1      VAL  89   4.640  -9.815  -3.505
  696   HG12  VAL  89          2HG1      VAL  89   5.273 -11.428  -3.171
  697   HG13  VAL  89          3HG1      VAL  89   6.336 -10.180  -3.823
  698   HG21  VAL  89          1HG2      VAL  89   7.151  -8.390  -2.459
  699   HG22  VAL  89          2HG2      VAL  89   6.680  -8.233  -0.768
  700   HG23  VAL  89          3HG2      VAL  89   5.526  -7.844  -2.044
  701    H    ASP  90           H        ASP  90   2.337 -10.920  -1.378
  702    HA   ASP  90           HA       ASP  90   3.039 -13.756  -1.091
  703    HB2  ASP  90          1HB       ASP  90   0.661 -12.269  -0.029
  704    HB3  ASP  90          2HB       ASP  90   0.547 -13.994  -0.381
  705    H    LYS  91           H        LYS  91   1.138 -15.116  -2.029
  706    HA   LYS  91           HA       LYS  91   0.977 -14.381  -4.835
  707    HB2  LYS  91          1HB       LYS  91  -0.139 -16.871  -3.560
  708    HB3  LYS  91          2HB       LYS  91   0.336 -16.620  -5.233
  709    HG2  LYS  91          1HG       LYS  91   2.213 -16.702  -2.895
  710    HG3  LYS  91          2HG       LYS  91   1.909 -18.026  -4.017
  711    HD2  LYS  91          1HD       LYS  91   2.981 -15.324  -4.821
  712    HD3  LYS  91          2HD       LYS  91   3.984 -16.741  -4.509
  713    HE2  LYS  91          1HE       LYS  91   2.808 -17.947  -6.301
  714    HE3  LYS  91          2HE       LYS  91   1.844 -16.507  -6.624
  715    HZ1  LYS  91          1HZ       LYS  91   3.862 -15.321  -7.202
  716    HZ2  LYS  91          2HZ       LYS  91   3.697 -16.704  -8.161
  717    HZ3  LYS  91          3HZ       LYS  91   4.796 -16.693  -6.877
  718    H    ASN  92           H        ASN  92  -0.955 -14.372  -6.027
  719    HA   ASN  92           HA       ASN  92  -3.155 -13.102  -4.672
  720    HB2  ASN  92          1HB       ASN  92  -2.358 -12.428  -6.944
  721    HB3  ASN  92          2HB       ASN  92  -2.914 -13.977  -7.553
  722   HD21  ASN  92          1HD2      ASN  92  -4.202 -12.786  -9.015
  723   HD22  ASN  92          2HD2      ASN  92  -5.722 -12.117  -8.518
  724    H    THR  93           H        THR  93  -3.433 -15.104  -3.301
  725    HA   THR  93           HA       THR  93  -4.695 -17.380  -4.530
  726    HB   THR  93           HB       THR  93  -5.031 -18.183  -2.223
  727    HG1  THR  93           HG1      THR  93  -5.190 -16.650  -0.764
  728   HG21  THR  93          1HG2      THR  93  -2.904 -18.588  -3.355
  729   HG22  THR  93          2HG2      THR  93  -2.689 -18.401  -1.616
  730   HG23  THR  93          3HG2      THR  93  -2.274 -17.077  -2.705
  731    H    ASP  94           H        ASP  94  -5.739 -14.354  -3.310
  732    HA   ASP  94           HA       ASP  94  -8.446 -15.150  -2.753
  733    HB2  ASP  94          1HB       ASP  94  -7.241 -12.402  -3.162
  734    HB3  ASP  94          2HB       ASP  94  -8.908 -12.701  -2.655
  735    H    ASN  95           H        ASN  95  -6.628 -14.356  -5.488
  736    HA   ASN  95           HA       ASN  95  -7.048 -14.212  -7.687
  737    HB2  ASN  95          1HB       ASN  95  -8.393 -16.272  -7.126
  738    HB3  ASN  95          2HB       ASN  95  -9.814 -15.244  -7.098
  739   HD21  ASN  95          1HD2      ASN  95 -10.722 -16.409  -8.785
  740   HD22  ASN  95          2HD2      ASN  95 -10.169 -16.231 -10.421
  741    H    ASN  96           H        ASN  96  -7.704 -12.038  -5.824
  742    HA   ASN  96           HA       ASN  96  -9.340 -10.432  -7.635
  743    HB2  ASN  96          1HB       ASN  96 -10.958 -11.047  -6.000
  744    HB3  ASN  96          2HB       ASN  96  -9.828 -10.798  -4.675
  745   HD21  ASN  96          1HD2      ASN  96 -11.893  -9.269  -7.014
  746   HD22  ASN  96          2HD2      ASN  96 -11.928  -7.714  -6.258
  747    H    ALA  97           H        ALA  97  -8.358  -8.584  -8.078
  748    HA   ALA  97           HA       ALA  97  -5.743  -8.126  -7.140
  749    HB1  ALA  97          1HB       ALA  97  -6.510  -7.549  -9.399
  750    HB2  ALA  97          2HB       ALA  97  -5.731  -6.193  -8.583
  751    HB3  ALA  97          3HB       ALA  97  -7.487  -6.250  -8.719
  752    H    CYS  98           H        CYS  98  -8.827  -6.636  -6.259
  753    HA   CYS  98           HA       CYS  98  -7.759  -4.445  -4.834
  754    HB2  CYS  98          1HB       CYS  98 -10.337  -5.931  -4.278
  755    HB3  CYS  98          2HB       CYS  98  -9.916  -4.332  -3.680
  756    H    HIS  99           H        HIS  99  -8.445  -7.778  -3.866
  757    HA   HIS  99           HA       HIS  99  -7.824  -7.275  -1.096
  758    HB2  HIS  99          1HB       HIS  99  -9.402  -9.077  -2.057
  759    HB3  HIS  99          2HB       HIS  99  -7.942  -9.989  -2.407
  760    HD1  HIS  99           HD1      HIS  99 -10.468  -9.987  -0.044
  761    HD2  HIS  99           HD2      HIS  99  -6.326 -10.016   0.291
  762    HE1  HIS  99           HE1      HIS  99  -9.982 -10.930   2.232
  763    HE2  HIS  99           HE2      HIS  99  -7.475 -11.133   2.318
  764    H    TRP 100           H        TRP 100  -6.118  -8.329  -3.936
  765    HA   TRP 100           HA       TRP 100  -3.897  -9.528  -2.667
  766    HB2  TRP 100          1HB       TRP 100  -4.515  -9.814  -5.081
  767    HB3  TRP 100          2HB       TRP 100  -3.935  -8.175  -5.381
  768    HD1  TRP 100           HD1      TRP 100  -1.674  -9.816  -2.966
  769    HE1  TRP 100           HE1      TRP 100   0.437 -10.692  -4.144
  770    HE3  TRP 100           HE3      TRP 100  -3.231  -9.421  -7.825
  771    HZ2  TRP 100           HZ2      TRP 100   1.325 -11.162  -6.783
  772    HZ3  TRP 100           HZ3      TRP 100  -1.689 -10.105  -9.614
  773    HH2  TRP 100           HH2      TRP 100   0.537 -10.959  -9.109
  774    H    ALA 101           H        ALA 101  -4.340  -6.272  -4.043
  775    HA   ALA 101           HA       ALA 101  -1.836  -5.253  -3.219
  776    HB1  ALA 101          1HB       ALA 101  -2.823  -3.045  -3.674
  777    HB2  ALA 101          2HB       ALA 101  -4.410  -3.801  -3.820
  778    HB3  ALA 101          3HB       ALA 101  -3.139  -4.195  -4.975
  779    H    PHE 102           H        PHE 102  -5.006  -5.347  -1.732
  780    HA   PHE 102           HA       PHE 102  -4.419  -3.631   0.418
  781    HB2  PHE 102          1HB       PHE 102  -6.694  -4.119  -0.309
  782    HB3  PHE 102          2HB       PHE 102  -6.523  -5.786   0.229
  783    HD1  PHE 102           HD1      PHE 102  -7.102  -6.358   2.423
  784    HD2  PHE 102           HD2      PHE 102  -6.421  -2.276   1.429
  785    HE1  PHE 102           HE1      PHE 102  -7.898  -5.690   4.650
  786    HE2  PHE 102           HE2      PHE 102  -7.213  -1.601   3.658
  787    HZ   PHE 102           HZ       PHE 102  -7.953  -3.306   5.273
  788    H    ARG 103           H        ARG 103  -3.964  -7.051  -0.129
  789    HA   ARG 103           HA       ARG 103  -3.504  -7.862   2.539
  790    HB2  ARG 103          1HB       ARG 103  -3.885  -9.449   0.654
  791    HB3  ARG 103          2HB       ARG 103  -2.309  -9.004   0.012
  792    HG2  ARG 103          1HG       ARG 103  -1.321  -9.739   2.200
  793    HG3  ARG 103          2HG       ARG 103  -2.901 -10.390   2.601
  794    HD2  ARG 103          1HD       ARG 103  -1.191 -11.222   0.250
  795    HD3  ARG 103          2HD       ARG 103  -1.405 -12.123   1.746
  796    HE   ARG 103           HE       ARG 103  -3.885 -11.588   0.423
  797   HH11  ARG 103          1HH1      ARG 103  -1.115 -13.696   0.551
  798   HH12  ARG 103          2HH1      ARG 103  -1.934 -15.044  -0.161
  799   HH21  ARG 103          1HH2      ARG 103  -4.990 -13.354  -0.532
  800   HH22  ARG 103          2HH2      ARG 103  -4.132 -14.857  -0.782
  801    H    GLY 104           H        GLY 104  -1.310  -6.852  -0.062
  802    HA2  GLY 104          1HA       GLY 104   1.098  -7.138   1.369
  803    HA3  GLY 104          2HA       GLY 104   0.852  -6.079  -0.025
  804    H    PHE 105           H        PHE 105  -1.062  -4.363   0.985
  805    HA   PHE 105           HA       PHE 105   0.570  -2.512   2.322
  806    HB2  PHE 105          1HB       PHE 105  -1.111  -1.674   0.880
  807    HB3  PHE 105          2HB       PHE 105  -2.371  -2.569   1.715
  808    HD1  PHE 105           HD1      PHE 105   0.336  -0.335   2.961
  809    HD2  PHE 105           HD2      PHE 105  -3.854  -1.016   2.596
  810    HE1  PHE 105           HE1      PHE 105  -0.114   1.667   4.316
  811    HE2  PHE 105           HE2      PHE 105  -4.299   0.978   3.958
  812    HZ   PHE 105           HZ       PHE 105  -2.429   2.324   4.819
  813    H    LYS 106           H        LYS 106  -2.120  -4.529   3.437
  814    HA   LYS 106           HA       LYS 106  -2.236  -3.393   6.007
  815    HB2  LYS 106          1HB       LYS 106  -4.193  -4.459   5.419
  816    HB3  LYS 106          2HB       LYS 106  -3.378  -5.898   4.797
  817    HG2  LYS 106          1HG       LYS 106  -2.791  -6.475   7.140
  818    HG3  LYS 106          2HG       LYS 106  -3.701  -5.064   7.676
  819    HD2  LYS 106          1HD       LYS 106  -5.144  -6.914   7.942
  820    HD3  LYS 106          2HD       LYS 106  -5.704  -6.054   6.508
  821    HE2  LYS 106          1HE       LYS 106  -4.718  -7.665   5.061
  822    HE3  LYS 106          2HE       LYS 106  -3.860  -8.433   6.396
  823    HZ1  LYS 106          1HZ       LYS 106  -6.797  -8.394   5.982
  824    HZ2  LYS 106          2HZ       LYS 106  -6.025  -9.043   7.337
  825    HZ3  LYS 106          3HZ       LYS 106  -5.771  -9.731   5.813
  826    H    CYS 107           H        CYS 107  -0.604  -6.231   4.706
  827    HA   CYS 107           HA       CYS 107   0.307  -7.377   7.064
  828    HB2  CYS 107          1HB       CYS 107   0.470  -8.638   5.076
  829    HB3  CYS 107          2HB       CYS 107   1.383  -7.389   4.244
  830    H    PHE 108           H        PHE 108   1.742  -4.862   5.035
  831    HA   PHE 108           HA       PHE 108   4.219  -4.855   6.461
  832    HB2  PHE 108          1HB       PHE 108   3.836  -4.253   4.017
  833    HB3  PHE 108          2HB       PHE 108   3.227  -2.705   4.602
  834    HD1  PHE 108           HD1      PHE 108   6.160  -4.807   4.106
  835    HD2  PHE 108           HD2      PHE 108   4.747  -1.090   5.632
  836    HE1  PHE 108           HE1      PHE 108   8.464  -3.957   4.171
  837    HE2  PHE 108           HE2      PHE 108   7.054  -0.239   5.693
  838    HZ   PHE 108           HZ       PHE 108   8.912  -1.672   4.958
  839    H    GLN 109           H        GLN 109   1.412  -2.655   6.328
  840    HA   GLN 109           HA       GLN 109   2.489  -0.731   8.082
  841    HB2  GLN 109          1HB       GLN 109   0.282   0.205   8.205
  842    HB3  GLN 109          2HB       GLN 109   0.591  -0.300   6.552
  843    HG2  GLN 109          1HG       GLN 109  -1.450  -1.189   6.690
  844    HG3  GLN 109          2HG       GLN 109  -0.643  -2.499   7.560
  845   HE21  GLN 109          1HE2      GLN 109  -3.390  -1.557   7.762
  846   HE22  GLN 109          2HE2      GLN 109  -3.624  -1.112   9.416
  847    H    LYS 110           H        LYS 110   1.020  -3.784   8.617
  848    HA   LYS 110           HA       LYS 110   0.010  -3.476  11.204
  849    HB2  LYS 110          1HB       LYS 110  -0.470  -5.389   9.749
  850    HB3  LYS 110          2HB       LYS 110   1.204  -5.898   9.853
  851    HG2  LYS 110          1HG       LYS 110   0.978  -6.390  12.178
  852    HG3  LYS 110          2HG       LYS 110  -0.665  -5.751  12.196
  853    HD2  LYS 110          1HD       LYS 110  -1.373  -7.495  10.646
  854    HD3  LYS 110          2HD       LYS 110   0.276  -8.112  10.570
  855    HE2  LYS 110          1HE       LYS 110   0.192  -8.643  12.953
  856    HE3  LYS 110          2HE       LYS 110  -1.451  -8.010  13.040
  857    HZ1  LYS 110          1HZ       LYS 110  -2.171  -9.733  11.525
  858    HZ2  LYS 110          2HZ       LYS 110  -1.407 -10.425  12.863
  859    HZ3  LYS 110          3HZ       LYS 110  -0.592 -10.323  11.388
  860    H    ASN 111           H        ASN 111   3.259  -3.937  10.014
  861    HA   ASN 111           HA       ASN 111   4.236  -4.135  12.790
  862    HB2  ASN 111          1HB       ASN 111   5.600  -5.103  10.272
  863    HB3  ASN 111          2HB       ASN 111   6.211  -5.260  11.914
  864   HD21  ASN 111          1HD2      ASN 111   5.536  -7.275   9.870
  865   HD22  ASN 111          2HD2      ASN 111   4.414  -8.342  10.637
  866    H    ASN 112           H        ASN 112   4.456  -2.412   9.768
  867    HA   ASN 112           HA       ASN 112   6.506  -0.656  10.940
  868    HB2  ASN 112          1HB       ASN 112   6.571  -1.872   8.173
  869    HB3  ASN 112          2HB       ASN 112   7.636  -0.579   8.729
  870   HD21  ASN 112          1HD2      ASN 112   7.961  -3.474   7.877
  871   HD22  ASN 112          2HD2      ASN 112   9.006  -4.136   9.090
  872    H    LEU 113           H        LEU 113   4.150   0.374  11.129
  873    HA   LEU 113           HA       LEU 113   3.226   1.618   8.710
  874    HB2  LEU 113          1HB       LEU 113   1.604   1.118  10.401
  875    HB3  LEU 113          2HB       LEU 113   2.471   2.062  11.594
  876    HG   LEU 113           HG       LEU 113   1.957   4.107  10.249
  877   HD11  LEU 113          1HD1      LEU 113   1.665   2.911   8.097
  878   HD12  LEU 113          2HD1      LEU 113   0.330   3.996   8.488
  879   HD13  LEU 113          3HD1      LEU 113   0.145   2.256   8.710
  880   HD21  LEU 113          1HD2      LEU 113  -0.400   4.206  10.908
  881   HD22  LEU 113          2HD2      LEU 113   0.590   3.470  12.168
  882   HD23  LEU 113          3HD2      LEU 113  -0.408   2.457  11.130
  883    H    SER 114           H        SER 114   5.343   2.435  11.326
  884    HA   SER 114           HA       SER 114   5.516   5.208  11.022
  885    HB2  SER 114          1HB       SER 114   6.490   3.980  12.924
  886    HB3  SER 114          2HB       SER 114   7.692   3.266  11.851
  887    HG   SER 114           HG       SER 114   8.504   5.087  12.968
  888    H    LEU 115           H        LEU 115   7.181   2.596   9.304
  889    HA   LEU 115           HA       LEU 115   8.982   4.295   7.918
  890    HB2  LEU 115          1HB       LEU 115   9.321   1.863   8.277
  891    HB3  LEU 115          2HB       LEU 115   8.025   1.550   7.139
  892    HG   LEU 115           HG       LEU 115   9.348   2.667   5.368
  893   HD11  LEU 115          1HD1      LEU 115  11.403   2.813   7.557
  894   HD12  LEU 115          2HD1      LEU 115  10.682   4.159   6.674
  895   HD13  LEU 115          3HD1      LEU 115  11.765   3.039   5.846
  896   HD21  LEU 115          1HD2      LEU 115   9.429   0.231   5.672
  897   HD22  LEU 115          2HD2      LEU 115  10.802   0.422   6.763
  898   HD23  LEU 115          3HD2      LEU 115  10.954   0.875   5.067
  899    H    ILE 116           H        ILE 116   5.740   3.155   7.341
  900    HA   ILE 116           HA       ILE 116   5.561   3.932   4.618
  901    HB   ILE 116           HB       ILE 116   3.368   3.579   6.676
  902   HG12  ILE 116          1HG1      ILE 116   4.460   1.687   4.576
  903   HG13  ILE 116          2HG1      ILE 116   4.695   1.547   6.325
  904   HG21  ILE 116          1HG2      ILE 116   3.219   3.761   3.672
  905   HG22  ILE 116          2HG2      ILE 116   2.576   4.931   4.828
  906   HG23  ILE 116          3HG2      ILE 116   1.882   3.310   4.728
  907   HD11  ILE 116          1HD1      ILE 116   2.237   1.308   6.556
  908   HD12  ILE 116          2HD1      ILE 116   3.007   0.011   5.643
  909   HD13  ILE 116          3HD1      ILE 116   2.123   1.280   4.797
  910    H    LYS 117           H        LYS 117   4.732   5.480   7.680
  911    HA   LYS 117           HA       LYS 117   3.705   7.872   6.626
  912    HB2  LYS 117          1HB       LYS 117   4.962   7.168   9.266
  913    HB3  LYS 117          2HB       LYS 117   4.388   8.793   8.918
  914    HG2  LYS 117          1HG       LYS 117   2.139   7.952   8.568
  915    HG3  LYS 117          2HG       LYS 117   2.688   6.299   8.823
  916    HD2  LYS 117          1HD       LYS 117   3.205   6.748  11.114
  917    HD3  LYS 117          2HD       LYS 117   2.946   8.480  10.894
  918    HE2  LYS 117          1HE       LYS 117   0.792   6.404  10.527
  919    HE3  LYS 117          2HE       LYS 117   1.074   7.255  12.045
  920    HZ1  LYS 117          1HZ       LYS 117   0.400   8.555   9.457
  921    HZ2  LYS 117          2HZ       LYS 117   0.629   9.341  10.934
  922    HZ3  LYS 117          3HZ       LYS 117  -0.679   8.292  10.732
  923    H    ALA 118           H        ALA 118   6.976   6.920   7.593
  924    HA   ALA 118           HA       ALA 118   8.178   9.447   7.072
  925    HB1  ALA 118          1HB       ALA 118   9.145   7.785   8.574
  926    HB2  ALA 118          2HB       ALA 118  10.278   8.254   7.306
  927    HB3  ALA 118          3HB       ALA 118   9.424   6.713   7.204
  928    H    SER 119           H        SER 119   7.471   6.644   5.153
  929    HA   SER 119           HA       SER 119   9.178   6.967   3.003
  930    HB2  SER 119          1HB       SER 119   7.789   4.984   3.315
  931    HB3  SER 119          2HB       SER 119   6.334   5.929   3.011
  932    HG   SER 119           HG       SER 119   8.452   5.574   1.156
  933    H    ILE 120           H        ILE 120   5.995   8.437   3.534
  934    HA   ILE 120           HA       ILE 120   6.224   9.899   1.015
  935    HB   ILE 120           HB       ILE 120   3.910  10.644   1.490
  936   HG12  ILE 120          1HG1      ILE 120   4.017   8.739   3.833
  937   HG13  ILE 120          2HG1      ILE 120   4.155  10.490   3.993
  938   HG21  ILE 120          1HG2      ILE 120   2.848   8.457   1.158
  939   HG22  ILE 120          2HG2      ILE 120   4.355   7.670   1.624
  940   HG23  ILE 120          3HG2      ILE 120   4.290   8.652   0.160
  941   HD11  ILE 120          1HD1      ILE 120   1.930  10.721   2.971
  942   HD12  ILE 120          2HD1      ILE 120   1.909   9.799   4.473
  943   HD13  ILE 120          3HD1      ILE 120   1.796   8.963   2.924
  944    H    LYS 121           H        LYS 121   7.207  10.332   4.108
  945    HA   LYS 121           HA       LYS 121   6.526  13.149   4.347
  946    HB2  LYS 121          1HB       LYS 121   6.406  11.549   6.277
  947    HB3  LYS 121          2HB       LYS 121   8.152  11.395   6.194
  948    HG2  LYS 121          1HG       LYS 121   8.408  13.752   6.721
  949    HG3  LYS 121          2HG       LYS 121   6.653  13.951   6.732
  950    HD2  LYS 121          1HD       LYS 121   6.465  12.405   8.598
  951    HD3  LYS 121          2HD       LYS 121   8.206  12.120   8.563
  952    HE2  LYS 121          1HE       LYS 121   6.871  14.767   9.124
  953    HE3  LYS 121          2HE       LYS 121   7.551  13.687  10.340
  954    HZ1  LYS 121          1HZ       LYS 121   9.104  15.428   9.811
  955    HZ2  LYS 121          2HZ       LYS 121   9.048  15.046   8.169
  956    HZ3  LYS 121          3HZ       LYS 121   9.722  13.950   9.267
  957    H    LYS 122           H        LYS 122   7.876  14.749   3.802
  958    HA   LYS 122           HA       LYS 122   9.780  15.940   3.361
  959    HB2  LYS 122          1HB       LYS 122  10.631  14.021   5.209
  960    HB3  LYS 122          2HB       LYS 122  11.785  13.951   3.905
  961    HG2  LYS 122          1HG       LYS 122  12.190  16.357   4.115
  962    HG3  LYS 122          2HG       LYS 122  11.046  16.418   5.458
  963    HD2  LYS 122          1HD       LYS 122  13.323  16.306   6.300
  964    HD3  LYS 122          2HD       LYS 122  12.449  14.830   6.706
  965    HE2  LYS 122          1HE       LYS 122  13.499  13.722   4.753
  966    HE3  LYS 122          2HE       LYS 122  14.421  15.193   4.451
  967    HZ1  LYS 122          1HZ       LYS 122  14.586  13.460   6.854
  968    HZ2  LYS 122          2HZ       LYS 122  15.392  14.934   6.684
  969    HZ3  LYS 122          3HZ       LYS 122  15.768  13.645   5.656
  970    H    ASP 123           H        ASP 123  11.709  15.950   1.977
  971    HA   ASP 123           HA       ASP 123  11.434  14.061  -0.253
  972    HB2  ASP 123          1HB       ASP 123  11.048  16.391  -0.873
  973    HB3  ASP 123          2HB       ASP 123  12.607  16.848  -0.199
  974    H21  ACD 201           H21      ACD   1  -4.631   5.028   1.556
  975    H22  ACD 201           H22      ACD   1  -3.458   5.095   2.881
  976    H31  ACD 201           H31      ACD   1  -1.991   6.551   1.459
  977    H32  ACD 201           H32      ACD   1  -3.138   6.393   0.133
  978    H41  ACD 201           H41      ACD   1  -2.795   3.903   0.166
  979    H42  ACD 201           H42      ACD   1  -1.307   4.798  -0.189
  980    H5   ACD 201           H5       ACD   1  -1.904   3.214   2.355
  981    H6   ACD 201           H6       ACD   1   0.364   3.788   2.870
  982    H71  ACD 201           H71      ACD   1   0.796   4.939   0.243
  983    H72  ACD 201           H72      ACD   1  -0.103   6.180   1.113
  984    H8   ACD 201           H8       ACD   1   1.779   6.499   2.708
  985    H9   ACD 201           H9       ACD   1   3.873   5.537   2.095
  986   H101  ACD 201          H101      ACD   1   2.800   4.709  -0.473
  987   H102  ACD 201          H102      ACD   1   2.299   3.440   0.649
  988    H11  ACD 201           H11      ACD   1   5.277   4.254   0.533
  989    H12  ACD 201           H12      ACD   1   5.561   1.915   0.250
  990   H131  ACD 201          H131      ACD   1   2.578   1.997  -0.440
  991   H132  ACD 201          H132      ACD   1   3.659   0.607  -0.582
  992    H14  ACD 201           H14      ACD   1   2.549   1.628   2.131
  993    H15  ACD 201           H15      ACD   1   2.517  -0.716   2.563
  994   H161  ACD 201          H161      ACD   1   2.731  -1.377  -0.246
  995   H162  ACD 201          H162      ACD   1   4.376  -0.932   0.216
  996   H171  ACD 201          H171      ACD   1   4.482  -2.641   1.896
  997   H172  ACD 201          H172      ACD   1   2.747  -2.952   1.789
  998   H181  ACD 201          H181      ACD   1   4.751  -3.441  -0.454
  999   H182  ACD 201          H182      ACD   1   3.021  -3.791  -0.525
 1000   H191  ACD 201          H191      ACD   1   5.049  -5.050   1.371
 1001   H192  ACD 201          H192      ACD   1   3.310  -5.333   1.457
 1002   H201  ACD 201          H201      ACD   1   5.079  -5.967  -0.918
 1003   H202  ACD 201          H202      ACD   1   3.369  -6.226  -0.856
 1004   H203  ACD 201          H203      ACD   1   4.418  -7.118   0.192
  Start of MODEL   25
    1    H1   MET   1          1H        MET   1  17.933   5.908 -15.619
    2    H2   MET   1          2H        MET   1  18.307   7.040 -14.417
    3    H3   MET   1          3H        MET   1  17.430   7.513 -15.781
    4    HA   MET   1           HA       MET   1  15.578   6.185 -15.155
    5    HB2  MET   1          1HB       MET   1  15.538   4.975 -13.026
    6    HB3  MET   1          2HB       MET   1  16.799   4.355 -14.080
    7    HG2  MET   1          1HG       MET   1  18.486   5.538 -12.816
    8    HG3  MET   1          2HG       MET   1  17.246   6.274 -11.803
    9    HE1  MET   1          1HE       MET   1  18.513   5.466  -9.617
   10    HE2  MET   1          2HE       MET   1  19.770   4.745 -10.623
   11    HE3  MET   1          3HE       MET   1  19.016   3.800  -9.339
   12    H    GLU   2           H        GLU   2  14.003   7.454 -14.394
   13    HA   GLU   2           HA       GLU   2  14.723   9.452 -12.357
   14    HB2  GLU   2          1HB       GLU   2  12.889   9.829 -14.718
   15    HB3  GLU   2          2HB       GLU   2  13.119  10.997 -13.430
   16    HG2  GLU   2          1HG       GLU   2  15.521  11.101 -14.044
   17    HG3  GLU   2          2HG       GLU   2  15.161  10.058 -15.417
   18    H    PHE   3           H        PHE   3  13.886   8.567 -10.598
   19    HA   PHE   3           HA       PHE   3  11.067   7.748 -10.671
   20    HB2  PHE   3          1HB       PHE   3  12.564   5.967  -9.973
   21    HB3  PHE   3          2HB       PHE   3  13.246   6.999  -8.714
   22    HD1  PHE   3           HD1      PHE   3  10.175   5.264  -9.812
   23    HD2  PHE   3           HD2      PHE   3  12.221   7.169  -6.608
   24    HE1  PHE   3           HE1      PHE   3   8.459   4.456  -8.242
   25    HE2  PHE   3           HE2      PHE   3  10.511   6.365  -5.030
   26    HZ   PHE   3           HZ       PHE   3   8.626   5.006  -5.847
   27    H    THR   4           H        THR   4   9.685   9.110  -9.821
   28    HA   THR   4           HA       THR   4  10.596  11.032  -7.788
   29    HB   THR   4           HB       THR   4   7.813  11.214  -8.749
   30    HG1  THR   4           HG1      THR   4   9.341  12.461 -10.574
   31   HG21  THR   4          1HG2      THR   4  10.051  13.211  -8.513
   32   HG22  THR   4          2HG2      THR   4   8.888  12.823  -7.247
   33   HG23  THR   4          3HG2      THR   4   8.341  13.571  -8.748
   34    H    VAL   5           H        VAL   5  10.004  10.858  -5.757
   35    HA   VAL   5           HA       VAL   5   8.422   8.532  -4.993
   36    HB   VAL   5           HB       VAL   5   9.294   8.673  -2.887
   37   HG11  VAL   5          1HG1      VAL   5  11.632   9.302  -2.952
   38   HG12  VAL   5          2HG1      VAL   5  11.360  10.151  -4.472
   39   HG13  VAL   5          3HG1      VAL   5  11.140   8.405  -4.385
   40   HG21  VAL   5          1HG2      VAL   5   9.656  11.654  -3.190
   41   HG22  VAL   5          2HG2      VAL   5  10.061  10.710  -1.755
   42   HG23  VAL   5          3HG2      VAL   5   8.382  10.843  -2.278
   43    H    SER   6           H        SER   6   6.478   8.540  -4.113
   44    HA   SER   6           HA       SER   6   4.853  10.878  -4.540
   45    HB2  SER   6          1HB       SER   6   4.054   8.236  -3.301
   46    HB3  SER   6          2HB       SER   6   2.986   9.433  -4.033
   47    HG   SER   6           HG       SER   6   4.468   8.995  -5.970
   48    H    THR   7           H        THR   7   5.217  12.462  -3.031
   49    HA   THR   7           HA       THR   7   5.486  11.804  -0.234
   50    HB   THR   7           HB       THR   7   5.566  14.220   0.161
   51    HG1  THR   7           HG1      THR   7   4.897  14.360  -2.615
   52   HG21  THR   7          1HG2      THR   7   7.243  13.382  -2.203
   53   HG22  THR   7          2HG2      THR   7   7.622  13.085  -0.507
   54   HG23  THR   7          3HG2      THR   7   7.584  14.735  -1.126
   55    H    THR   8           H        THR   8   4.064  13.326   1.269
   56    HA   THR   8           HA       THR   8   1.480  12.375   1.349
   57    HB   THR   8           HB       THR   8   2.492  15.013   2.425
   58    HG1  THR   8           HG1      THR   8   3.577  12.991   3.105
   59   HG21  THR   8          1HG2      THR   8   0.079  14.968   2.404
   60   HG22  THR   8          2HG2      THR   8   0.654  14.765   4.061
   61   HG23  THR   8          3HG2      THR   8   0.070  13.370   3.149
   62    H    GLU   9           H        GLU   9   2.658  15.396  -0.074
   63    HA   GLU   9           HA       GLU   9   0.191  16.487  -0.765
   64    HB2  GLU   9          1HB       GLU   9   2.848  16.842  -2.151
   65    HB3  GLU   9          2HB       GLU   9   1.449  17.890  -2.332
   66    HG2  GLU   9          1HG       GLU   9   1.575  18.443   0.051
   67    HG3  GLU   9          2HG       GLU   9   3.014  17.435   0.193
   68    H    ASP  10           H        ASP  10   2.360  14.352  -2.571
   69    HA   ASP  10           HA       ASP  10   0.861  14.328  -4.977
   70    HB2  ASP  10          1HB       ASP  10   2.710  12.166  -3.945
   71    HB3  ASP  10          2HB       ASP  10   2.173  12.392  -5.607
   72    H    LEU  11           H        LEU  11   0.839  12.364  -2.067
   73    HA   LEU  11           HA       LEU  11  -0.846  10.334  -3.015
   74    HB2  LEU  11          1HB       LEU  11   0.526  10.037  -1.048
   75    HB3  LEU  11          2HB       LEU  11  -0.379  11.288  -0.186
   76    HG   LEU  11           HG       LEU  11  -2.394   9.822  -0.364
   77   HD11  LEU  11          1HD1      LEU  11  -0.417   7.775  -1.344
   78   HD12  LEU  11          2HD1      LEU  11  -1.668   8.539  -2.323
   79   HD13  LEU  11          3HD1      LEU  11  -2.118   7.498  -0.976
   80   HD21  LEU  11          1HD2      LEU  11  -1.741   8.333   1.411
   81   HD22  LEU  11          2HD2      LEU  11  -0.928   9.883   1.640
   82   HD23  LEU  11          3HD2      LEU  11  -0.039   8.505   0.985
   83    H    GLN  12           H        GLN  12  -1.479  13.496  -1.710
   84    HA   GLN  12           HA       GLN  12  -4.236  13.197  -1.174
   85    HB2  GLN  12          1HB       GLN  12  -2.580  15.613  -1.870
   86    HB3  GLN  12          2HB       GLN  12  -4.291  15.712  -1.486
   87    HG2  GLN  12          1HG       GLN  12  -3.868  14.839   0.733
   88    HG3  GLN  12          2HG       GLN  12  -2.159  14.647   0.348
   89   HE21  GLN  12          1HE2      GLN  12  -3.502  16.247   2.410
   90   HE22  GLN  12          2HE2      GLN  12  -2.953  17.869   2.173
   91    H    ARG  13           H        ARG  13  -2.437  13.759  -4.078
   92    HA   ARG  13           HA       ARG  13  -4.613  14.605  -5.712
   93    HB2  ARG  13          1HB       ARG  13  -1.970  13.330  -6.428
   94    HB3  ARG  13          2HB       ARG  13  -3.116  13.953  -7.602
   95    HG2  ARG  13          1HG       ARG  13  -2.849  16.196  -6.699
   96    HG3  ARG  13          2HG       ARG  13  -1.704  15.573  -5.490
   97    HD2  ARG  13          1HD       ARG  13  -0.205  14.860  -7.250
   98    HD3  ARG  13          2HD       ARG  13  -1.361  15.367  -8.478
   99    HE   ARG  13           HE       ARG  13  -0.662  17.545  -6.801
  100   HH11  ARG  13          1HH1      ARG  13   0.574  15.538  -9.389
  101   HH12  ARG  13          2HH1      ARG  13   1.621  16.766 -10.024
  102   HH21  ARG  13          1HH2      ARG  13   0.730  19.175  -7.626
  103   HH22  ARG  13          2HH2      ARG  13   1.708  18.843  -9.019
  104    H    TYR  14           H        TYR  14  -2.848  11.537  -5.489
  105    HA   TYR  14           HA       TYR  14  -4.458  10.093  -7.259
  106    HB2  TYR  14          1HB       TYR  14  -2.927   8.933  -4.925
  107    HB3  TYR  14          2HB       TYR  14  -3.378   8.121  -6.415
  108    HD1  TYR  14           HD1      TYR  14  -2.633   9.995  -8.497
  109    HD2  TYR  14           HD2      TYR  14  -0.586   9.035  -4.891
  110    HE1  TYR  14           HE1      TYR  14  -0.507  10.668  -9.530
  111    HE2  TYR  14           HE2      TYR  14   1.543   9.715  -5.914
  112    HH   TYR  14           HH       TYR  14   1.711  11.451  -8.826
  113    H    ARG  15           H        ARG  15  -4.821  10.740  -3.847
  114    HA   ARG  15           HA       ARG  15  -6.658   8.818  -3.125
  115    HB2  ARG  15          1HB       ARG  15  -5.909  11.487  -2.160
  116    HB3  ARG  15          2HB       ARG  15  -7.537  11.004  -1.729
  117    HG2  ARG  15          1HG       ARG  15  -6.524   8.864  -0.837
  118    HG3  ARG  15          2HG       ARG  15  -4.949   9.632  -1.048
  119    HD2  ARG  15          1HD       ARG  15  -5.593  11.421   0.474
  120    HD3  ARG  15          2HD       ARG  15  -7.212  10.738   0.622
  121    HE   ARG  15           HE       ARG  15  -5.523   8.710   1.361
  122   HH11  ARG  15          1HH1      ARG  15  -6.084  11.994   2.459
  123   HH12  ARG  15          2HH1      ARG  15  -5.606  11.655   4.092
  124   HH21  ARG  15          1HH2      ARG  15  -4.953   8.247   3.481
  125   HH22  ARG  15          2HH2      ARG  15  -4.974   9.506   4.684
  126    H    THR  16           H        THR  16  -7.318  12.054  -4.458
  127    HA   THR  16           HA       THR  16 -10.135  11.786  -4.401
  128    HB   THR  16           HB       THR  16  -8.746  13.576  -6.353
  129    HG1  THR  16           HG1      THR  16  -7.680  14.503  -4.772
  130   HG21  THR  16          1HG2      THR  16 -11.109  13.930  -4.509
  131   HG22  THR  16          2HG2      THR  16 -11.182  13.594  -6.240
  132   HG23  THR  16          3HG2      THR  16 -10.517  15.124  -5.667
  133    H    GLU  17           H        GLU  17  -7.725  11.268  -6.954
  134    HA   GLU  17           HA       GLU  17  -9.543  10.870  -9.063
  135    HB2  GLU  17          1HB       GLU  17  -6.977   9.326  -8.992
  136    HB3  GLU  17          2HB       GLU  17  -7.753  10.131 -10.340
  137    HG2  GLU  17          1HG       GLU  17  -7.194  12.313  -9.273
  138    HG3  GLU  17          2HG       GLU  17  -6.214  11.419  -8.108
  139    H    CYS  18           H        CYS  18  -8.349   8.695  -6.588
  140    HA   CYS  18           HA       CYS  18  -9.643   6.404  -7.774
  141    HB2  CYS  18          1HB       CYS  18  -8.254   6.764  -5.112
  142    HB3  CYS  18          2HB       CYS  18  -8.921   5.234  -5.702
  143    H    VAL  19           H        VAL  19 -10.287   8.686  -5.176
  144    HA   VAL  19           HA       VAL  19 -12.411   7.261  -4.004
  145    HB   VAL  19           HB       VAL  19 -11.515  10.111  -3.847
  146   HG11  VAL  19          1HG1      VAL  19 -13.278  10.625  -2.270
  147   HG12  VAL  19          2HG1      VAL  19 -13.979   9.023  -2.496
  148   HG13  VAL  19          3HG1      VAL  19 -13.973  10.180  -3.829
  149   HG21  VAL  19          1HG2      VAL  19 -11.276   9.486  -1.450
  150   HG22  VAL  19          2HG2      VAL  19 -10.279   8.528  -2.544
  151   HG23  VAL  19          3HG2      VAL  19 -11.762   7.844  -1.880
  152    H    SER  20           H        SER  20 -12.423  10.036  -6.230
  153    HA   SER  20           HA       SER  20 -15.220  10.124  -6.543
  154    HB2  SER  20          1HB       SER  20 -13.011  11.082  -8.371
  155    HB3  SER  20          2HB       SER  20 -14.704  11.565  -8.492
  156    HG   SER  20           HG       SER  20 -14.405  12.277  -6.214
  157    H    SER  21           H        SER  21 -12.835   8.039  -7.951
  158    HA   SER  21           HA       SER  21 -14.459   7.375 -10.262
  159    HB2  SER  21          1HB       SER  21 -11.976   7.501 -10.401
  160    HB3  SER  21          2HB       SER  21 -11.871   6.137  -9.292
  161    HG   SER  21           HG       SER  21 -11.712   5.356 -11.376
  162    H    LEU  22           H        LEU  22 -13.325   5.775  -7.279
  163    HA   LEU  22           HA       LEU  22 -14.798   3.372  -7.968
  164    HB2  LEU  22          1HB       LEU  22 -13.027   4.069  -5.631
  165    HB3  LEU  22          2HB       LEU  22 -13.790   2.493  -5.855
  166    HG   LEU  22           HG       LEU  22 -11.873   3.718  -7.832
  167   HD11  LEU  22          1HD1      LEU  22 -10.715   3.328  -5.738
  168   HD12  LEU  22          2HD1      LEU  22 -10.238   2.112  -6.922
  169   HD13  LEU  22          3HD1      LEU  22 -11.385   1.702  -5.646
  170   HD21  LEU  22          1HD2      LEU  22 -12.872   0.897  -7.504
  171   HD22  LEU  22          2HD2      LEU  22 -11.794   1.503  -8.766
  172   HD23  LEU  22          3HD2      LEU  22 -13.470   2.051  -8.699
  173    H    ASN  23           H        ASN  23 -15.956   6.100  -6.966
  174    HA   ASN  23           HA       ASN  23 -17.686   6.854  -5.685
  175    HB2  ASN  23          1HB       ASN  23 -18.464   3.948  -5.868
  176    HB3  ASN  23          2HB       ASN  23 -19.494   5.197  -5.199
  177   HD21  ASN  23          1HD2      ASN  23 -19.926   3.482  -7.490
  178   HD22  ASN  23          2HD2      ASN  23 -20.182   4.542  -8.837
  179    H    ILE  24           H        ILE  24 -15.308   6.231  -4.264
  180    HA   ILE  24           HA       ILE  24 -15.886   4.827  -1.867
  181    HB   ILE  24           HB       ILE  24 -13.782   6.953  -2.236
  182   HG12  ILE  24          1HG1      ILE  24 -13.615   5.269  -4.041
  183   HG13  ILE  24          2HG1      ILE  24 -12.251   5.176  -2.930
  184   HG21  ILE  24          1HG2      ILE  24 -14.145   6.287   0.064
  185   HG22  ILE  24          2HG2      ILE  24 -12.592   5.673  -0.502
  186   HG23  ILE  24          3HG2      ILE  24 -13.978   4.588  -0.376
  187   HD11  ILE  24          1HD1      ILE  24 -13.027   2.967  -3.568
  188   HD12  ILE  24          2HD1      ILE  24 -14.642   3.346  -2.968
  189   HD13  ILE  24          3HD1      ILE  24 -13.286   3.241  -1.843
  190    HA   PRO  25           HA       PRO  25 -18.437   8.076  -0.101
  191    HB2  PRO  25          1HB       PRO  25 -18.205   6.453   2.327
  192    HB3  PRO  25          2HB       PRO  25 -19.643   6.924   1.424
  193    HG2  PRO  25          1HG       PRO  25 -18.694   4.399   1.448
  194    HG3  PRO  25          2HG       PRO  25 -19.557   5.097   0.068
  195    HD2  PRO  25          1HD       PRO  25 -16.634   4.603   0.425
  196    HD3  PRO  25          2HD       PRO  25 -17.634   4.518  -1.048
  197    H    ALA  26           H        ALA  26 -17.957   9.832   1.044
  198    HA   ALA  26           HA       ALA  26 -15.371  10.534   1.759
  199    HB1  ALA  26          1HB       ALA  26 -17.202  12.124   1.360
  200    HB2  ALA  26          2HB       ALA  26 -16.357  12.446   2.875
  201    HB3  ALA  26          3HB       ALA  26 -17.929  11.647   2.893
  202    H    ASP  27           H        ASP  27 -17.881   8.981   3.596
  203    HA   ASP  27           HA       ASP  27 -17.041   9.081   6.195
  204    HB2  ASP  27          1HB       ASP  27 -19.063   7.944   5.496
  205    HB3  ASP  27          2HB       ASP  27 -18.128   6.710   4.663
  206    H    TYR  28           H        TYR  28 -15.928   6.737   3.742
  207    HA   TYR  28           HA       TYR  28 -13.981   5.534   5.375
  208    HB2  TYR  28          1HB       TYR  28 -14.477   5.620   2.423
  209    HB3  TYR  28          2HB       TYR  28 -13.011   4.866   3.045
  210    HD1  TYR  28           HD1      TYR  28 -13.087   2.682   3.990
  211    HD2  TYR  28           HD2      TYR  28 -16.701   4.747   3.127
  212    HE1  TYR  28           HE1      TYR  28 -14.355   0.616   4.387
  213    HE2  TYR  28           HE2      TYR  28 -17.977   2.686   3.514
  214    HH   TYR  28           HH       TYR  28 -17.556   0.221   3.445
  215    H    VAL  29           H        VAL  29 -13.864   8.252   3.137
  216    HA   VAL  29           HA       VAL  29 -11.108   8.558   2.897
  217    HB   VAL  29           HB       VAL  29 -13.209  10.713   2.867
  218   HG11  VAL  29          1HG1      VAL  29 -10.388  10.666   1.821
  219   HG12  VAL  29          2HG1      VAL  29 -11.020  11.687   3.112
  220   HG13  VAL  29          3HG1      VAL  29 -11.570  11.921   1.452
  221   HG21  VAL  29          1HG2      VAL  29 -13.126  10.398   0.423
  222   HG22  VAL  29          2HG2      VAL  29 -13.702   8.965   1.277
  223   HG23  VAL  29          3HG2      VAL  29 -12.049   9.021   0.666
  224    H    GLU  30           H        GLU  30 -13.341   9.910   5.321
  225    HA   GLU  30           HA       GLU  30 -11.454  11.446   6.746
  226    HB2  GLU  30          1HB       GLU  30 -13.693  10.032   8.146
  227    HB3  GLU  30          2HB       GLU  30 -13.029  11.635   8.430
  228    HG2  GLU  30          1HG       GLU  30 -13.994  12.390   6.317
  229    HG3  GLU  30          2HG       GLU  30 -14.724  10.801   6.103
  230    H    LYS  31           H        LYS  31 -12.317   8.058   6.884
  231    HA   LYS  31           HA       LYS  31 -10.857   7.408   9.224
  232    HB2  LYS  31          1HB       LYS  31 -11.679   5.628   6.922
  233    HB3  LYS  31          2HB       LYS  31 -11.064   5.075   8.485
  234    HG2  LYS  31          1HG       LYS  31 -12.995   6.231   9.563
  235    HG3  LYS  31          2HG       LYS  31 -13.637   6.534   7.946
  236    HD2  LYS  31          1HD       LYS  31 -13.615   4.089   7.520
  237    HD3  LYS  31          2HD       LYS  31 -13.095   3.834   9.197
  238    HE2  LYS  31          1HE       LYS  31 -15.164   5.011   9.953
  239    HE3  LYS  31          2HE       LYS  31 -15.692   5.086   8.272
  240    HZ1  LYS  31          1HZ       LYS  31 -15.173   2.612   9.828
  241    HZ2  LYS  31          2HZ       LYS  31 -15.646   2.662   8.207
  242    HZ3  LYS  31          3HZ       LYS  31 -16.690   3.223   9.409
  243    H    PHE  32           H        PHE  32 -10.084   7.146   5.773
  244    HA   PHE  32           HA       PHE  32  -7.545   6.033   6.016
  245    HB2  PHE  32          1HB       PHE  32  -8.455   7.974   3.891
  246    HB3  PHE  32          2HB       PHE  32  -7.133   6.821   3.759
  247    HD1  PHE  32           HD1      PHE  32  -8.642   4.527   5.152
  248    HD2  PHE  32           HD2      PHE  32  -9.673   7.194   2.002
  249    HE1  PHE  32           HE1      PHE  32 -10.183   2.848   4.241
  250    HE2  PHE  32           HE2      PHE  32 -11.220   5.514   1.086
  251    HZ   PHE  32           HZ       PHE  32 -11.474   3.334   2.203
  252    H    LYS  33           H        LYS  33  -8.604   9.371   6.187
  253    HA   LYS  33           HA       LYS  33  -6.116  10.644   6.169
  254    HB2  LYS  33          1HB       LYS  33  -8.625  11.537   6.217
  255    HB3  LYS  33          2HB       LYS  33  -8.300  11.651   7.939
  256    HG2  LYS  33          1HG       LYS  33  -6.534  12.916   5.861
  257    HG3  LYS  33          2HG       LYS  33  -7.909  13.745   6.608
  258    HD2  LYS  33          1HD       LYS  33  -6.897  13.500   8.797
  259    HD3  LYS  33          2HD       LYS  33  -5.564  12.573   8.108
  260    HE2  LYS  33          1HE       LYS  33  -4.887  14.520   6.795
  261    HE3  LYS  33          2HE       LYS  33  -6.229  15.446   7.464
  262    HZ1  LYS  33          1HZ       LYS  33  -4.152  15.927   8.599
  263    HZ2  LYS  33          2HZ       LYS  33  -3.977  14.301   9.029
  264    HZ3  LYS  33          3HZ       LYS  33  -5.260  15.212   9.659
  265    H    LYS  34           H        LYS  34  -7.961   9.156   8.786
  266    HA   LYS  34           HA       LYS  34  -5.863   9.785  10.729
  267    HB2  LYS  34          1HB       LYS  34  -7.433   9.310  12.403
  268    HB3  LYS  34          2HB       LYS  34  -8.406   9.993  11.127
  269    HG2  LYS  34          1HG       LYS  34  -9.009   7.710  10.380
  270    HG3  LYS  34          2HG       LYS  34  -8.153   7.073  11.786
  271    HD2  LYS  34          1HD       LYS  34  -9.650   8.251  13.278
  272    HD3  LYS  34          2HD       LYS  34 -10.457   9.020  11.909
  273    HE2  LYS  34          1HE       LYS  34 -11.160   6.801  11.107
  274    HE3  LYS  34          2HE       LYS  34 -10.394   6.064  12.511
  275    HZ1  LYS  34          1HZ       LYS  34 -11.921   7.231  13.941
  276    HZ2  LYS  34          2HZ       LYS  34 -12.790   6.351  12.788
  277    HZ3  LYS  34          3HZ       LYS  34 -12.621   8.025  12.620
  278    H    TRP  35           H        TRP  35  -5.572   7.841   8.478
  279    HA   TRP  35           HA       TRP  35  -4.651   5.825   8.032
  280    HB2  TRP  35          1HB       TRP  35  -3.589   6.285  10.815
  281    HB3  TRP  35          2HB       TRP  35  -3.032   4.976   9.767
  282    HD1  TRP  35           HD1      TRP  35  -2.714   8.716  10.329
  283    HE1  TRP  35           HE1      TRP  35  -0.862   9.650   8.803
  284    HE3  TRP  35           HE3      TRP  35  -1.892   4.583   7.425
  285    HZ2  TRP  35           HZ2      TRP  35   0.730   8.754   6.660
  286    HZ3  TRP  35           HZ3      TRP  35  -0.189   4.709   5.659
  287    HH2  TRP  35           HH2      TRP  35   1.098   6.746   5.281
  288    H    GLU  36           H        GLU  36  -7.255   5.466   8.631
  289    HA   GLU  36           HA       GLU  36  -7.242   2.942  10.134
  290    HB2  GLU  36          1HB       GLU  36  -8.576   5.144  10.945
  291    HB3  GLU  36          2HB       GLU  36  -9.783   4.420   9.901
  292    HG2  GLU  36          1HG       GLU  36  -8.457   3.029  12.214
  293    HG3  GLU  36          2HG       GLU  36 -10.029   3.809  12.273
  294    H    PHE  37           H        PHE  37  -7.374   1.380   8.699
  295    HA   PHE  37           HA       PHE  37  -9.035   1.785   6.296
  296    HB2  PHE  37          1HB       PHE  37  -6.660  -0.075   6.591
  297    HB3  PHE  37          2HB       PHE  37  -7.539   0.276   5.108
  298    HD1  PHE  37           HD1      PHE  37  -7.022   2.192   3.801
  299    HD2  PHE  37           HD2      PHE  37  -5.270   1.692   7.650
  300    HE1  PHE  37           HE1      PHE  37  -5.479   4.049   3.339
  301    HE2  PHE  37           HE2      PHE  37  -3.718   3.543   7.188
  302    HZ   PHE  37           HZ       PHE  37  -3.823   4.726   5.030
  303    HA   PRO  38           HA       PRO  38 -11.343  -1.539   8.465
  304    HB2  PRO  38          1HB       PRO  38 -13.272  -0.766   6.355
  305    HB3  PRO  38          2HB       PRO  38 -13.516  -0.977   8.098
  306    HG2  PRO  38          1HG       PRO  38 -13.478   1.461   7.040
  307    HG3  PRO  38          2HG       PRO  38 -12.698   1.135   8.600
  308    HD2  PRO  38          1HD       PRO  38 -11.433   1.408   5.885
  309    HD3  PRO  38          2HD       PRO  38 -10.904   2.082   7.459
  310    H    GLU  39           H        GLU  39 -11.524  -3.614   7.893
  311    HA   GLU  39           HA       GLU  39 -10.459  -4.459   5.375
  312    HB2  GLU  39          1HB       GLU  39  -9.987  -5.667   7.464
  313    HB3  GLU  39          2HB       GLU  39 -11.685  -6.094   7.600
  314    HG2  GLU  39          1HG       GLU  39 -11.577  -7.497   5.701
  315    HG3  GLU  39          2HG       GLU  39  -9.991  -6.876   5.247
  316    H    ASP  40           H        ASP  40 -11.891  -3.586   3.929
  317    HA   ASP  40           HA       ASP  40 -14.323  -5.110   3.449
  318    HB2  ASP  40          1HB       ASP  40 -15.117  -3.240   4.864
  319    HB3  ASP  40          2HB       ASP  40 -14.379  -2.087   3.754
  320    H    ASP  41           H        ASP  41 -15.052  -4.923   1.299
  321    HA   ASP  41           HA       ASP  41 -12.905  -4.917  -0.514
  322    HB2  ASP  41          1HB       ASP  41 -14.530  -5.388  -2.248
  323    HB3  ASP  41          2HB       ASP  41 -14.921  -6.319  -0.809
  324    H    THR  42           H        THR  42 -15.048  -2.373   0.453
  325    HA   THR  42           HA       THR  42 -14.752  -0.655  -1.774
  326    HB   THR  42           HB       THR  42 -15.047   0.174   1.114
  327    HG1  THR  42           HG1      THR  42 -16.717  -1.206   0.824
  328   HG21  THR  42          1HG2      THR  42 -15.869   1.466  -1.481
  329   HG22  THR  42          2HG2      THR  42 -14.601   2.014  -0.384
  330   HG23  THR  42          3HG2      THR  42 -16.289   2.066   0.124
  331    H    THR  43           H        THR  43 -13.098  -0.706   1.358
  332    HA   THR  43           HA       THR  43 -11.133   1.206   0.840
  333    HB   THR  43           HB       THR  43 -10.849  -1.211   2.630
  334    HG1  THR  43           HG1      THR  43 -11.699   0.425   4.217
  335   HG21  THR  43          1HG2      THR  43  -8.781  -0.008   2.434
  336   HG22  THR  43          2HG2      THR  43  -9.490   0.392   4.003
  337   HG23  THR  43          3HG2      THR  43  -9.600   1.535   2.663
  338    H    MET  44           H        MET  44 -11.308  -2.193   0.052
  339    HA   MET  44           HA       MET  44  -8.541  -2.608  -0.299
  340    HB2  MET  44          1HB       MET  44 -10.867  -4.168  -1.410
  341    HB3  MET  44          2HB       MET  44  -9.197  -4.717  -1.393
  342    HG2  MET  44          1HG       MET  44  -9.195  -4.644   1.045
  343    HG3  MET  44          2HG       MET  44 -10.864  -4.085   1.030
  344    HE1  MET  44          1HE       MET  44 -11.193  -7.688   2.439
  345    HE2  MET  44          2HE       MET  44 -11.543  -5.976   2.688
  346    HE3  MET  44          3HE       MET  44  -9.876  -6.551   2.730
  347    H    CYS  45           H        CYS  45 -11.139  -2.113  -2.716
  348    HA   CYS  45           HA       CYS  45  -9.334  -2.066  -4.902
  349    HB2  CYS  45          1HB       CYS  45 -12.141  -0.967  -4.661
  350    HB3  CYS  45          2HB       CYS  45 -11.219  -0.975  -6.158
  351    H    TYR  46           H        TYR  46 -10.431   0.366  -2.648
  352    HA   TYR  46           HA       TYR  46  -9.533   2.654  -3.970
  353    HB2  TYR  46          1HB       TYR  46 -10.820   3.039  -2.053
  354    HB3  TYR  46          2HB       TYR  46  -9.862   1.934  -1.070
  355    HD1  TYR  46           HD1      TYR  46  -9.570   5.175  -2.917
  356    HD2  TYR  46           HD2      TYR  46  -8.266   2.801   0.369
  357    HE1  TYR  46           HE1      TYR  46  -8.258   7.072  -2.069
  358    HE2  TYR  46           HE2      TYR  46  -6.952   4.693   1.223
  359    HH   TYR  46           HH       TYR  46  -5.975   6.738   0.508
  360    H    ILE  47           H        ILE  47  -7.865   0.546  -1.650
  361    HA   ILE  47           HA       ILE  47  -5.370   1.794  -1.737
  362    HB   ILE  47           HB       ILE  47  -6.076  -1.083  -1.181
  363   HG12  ILE  47          1HG1      ILE  47  -7.014   0.519   0.416
  364   HG13  ILE  47          2HG1      ILE  47  -5.748  -0.435   1.182
  365   HG21  ILE  47          1HG2      ILE  47  -3.780  -1.054  -1.872
  366   HG22  ILE  47          2HG2      ILE  47  -3.826  -1.231  -0.116
  367   HG23  ILE  47          3HG2      ILE  47  -3.437   0.331  -0.836
  368   HD11  ILE  47          1HD1      ILE  47  -5.527   1.821   1.892
  369   HD12  ILE  47          2HD1      ILE  47  -5.575   2.411   0.233
  370   HD13  ILE  47          3HD1      ILE  47  -4.189   1.474   0.796
  371    H    LYS  48           H        LYS  48  -6.784  -0.720  -3.751
  372    HA   LYS  48           HA       LYS  48  -4.498  -1.450  -5.176
  373    HB2  LYS  48          1HB       LYS  48  -6.721  -2.636  -5.166
  374    HB3  LYS  48          2HB       LYS  48  -7.320  -1.395  -6.255
  375    HG2  LYS  48          1HG       LYS  48  -5.356  -2.043  -7.765
  376    HG3  LYS  48          2HG       LYS  48  -5.233  -3.482  -6.751
  377    HD2  LYS  48          1HD       LYS  48  -7.532  -4.075  -7.280
  378    HD3  LYS  48          2HD       LYS  48  -7.702  -2.610  -8.250
  379    HE2  LYS  48          1HE       LYS  48  -5.842  -3.430  -9.686
  380    HE3  LYS  48          2HE       LYS  48  -5.859  -4.935  -8.773
  381    HZ1  LYS  48          1HZ       LYS  48  -8.111  -3.849 -10.374
  382    HZ2  LYS  48          2HZ       LYS  48  -8.155  -5.279  -9.477
  383    HZ3  LYS  48          3HZ       LYS  48  -7.117  -5.146 -10.806
  384    H    CYS  49           H        CYS  49  -7.095   0.822  -6.076
  385    HA   CYS  49           HA       CYS  49  -6.004   1.759  -8.441
  386    HB2  CYS  49          1HB       CYS  49  -8.243   2.289  -7.964
  387    HB3  CYS  49          2HB       CYS  49  -7.839   3.070  -6.438
  388    H    VAL  50           H        VAL  50  -5.595   3.088  -5.155
  389    HA   VAL  50           HA       VAL  50  -4.020   5.276  -5.869
  390    HB   VAL  50           HB       VAL  50  -4.323   3.751  -3.295
  391   HG11  VAL  50          1HG1      VAL  50  -2.739   6.282  -3.723
  392   HG12  VAL  50          2HG1      VAL  50  -2.068   4.701  -3.313
  393   HG13  VAL  50          3HG1      VAL  50  -3.111   5.542  -2.166
  394   HG21  VAL  50          1HG2      VAL  50  -5.199   6.489  -4.180
  395   HG22  VAL  50          2HG2      VAL  50  -5.523   5.755  -2.607
  396   HG23  VAL  50          3HG2      VAL  50  -6.222   5.056  -4.069
  397    H    PHE  51           H        PHE  51  -3.163   1.997  -4.886
  398    HA   PHE  51           HA       PHE  51  -0.379   2.363  -4.865
  399    HB2  PHE  51          1HB       PHE  51  -2.240   0.062  -4.814
  400    HB3  PHE  51          2HB       PHE  51  -0.597  -0.280  -5.341
  401    HD1  PHE  51           HD1      PHE  51  -1.510   2.292  -2.857
  402    HD2  PHE  51           HD2      PHE  51   0.047  -1.618  -3.493
  403    HE1  PHE  51           HE1      PHE  51  -0.810   2.192  -0.500
  404    HE2  PHE  51           HE2      PHE  51   0.751  -1.725  -1.139
  405    HZ   PHE  51           HZ       PHE  51   0.323   0.181   0.361
  406    H    ASN  52           H        ASN  52  -2.650   1.837  -7.406
  407    HA   ASN  52           HA       ASN  52  -0.720   1.025  -9.381
  408    HB2  ASN  52          1HB       ASN  52  -3.594   1.949  -9.591
  409    HB3  ASN  52          2HB       ASN  52  -2.609   1.562 -11.006
  410   HD21  ASN  52          1HD2      ASN  52  -5.032   0.294 -10.155
  411   HD22  ASN  52          2HD2      ASN  52  -4.648  -1.367  -9.874
  412    H    LYS  53           H        LYS  53  -2.393   4.009  -8.520
  413    HA   LYS  53           HA       LYS  53  -1.298   5.565 -10.622
  414    HB2  LYS  53          1HB       LYS  53  -2.762   6.148  -8.092
  415    HB3  LYS  53          2HB       LYS  53  -1.988   7.475  -8.943
  416    HG2  LYS  53          1HG       LYS  53  -4.033   5.596 -10.127
  417    HG3  LYS  53          2HG       LYS  53  -4.374   7.216  -9.516
  418    HD2  LYS  53          1HD       LYS  53  -2.813   8.147 -11.191
  419    HD3  LYS  53          2HD       LYS  53  -2.544   6.519 -11.818
  420    HE2  LYS  53          1HE       LYS  53  -4.159   7.746 -13.181
  421    HE3  LYS  53          2HE       LYS  53  -4.900   6.346 -12.411
  422    HZ1  LYS  53          1HZ       LYS  53  -5.075   9.079 -11.266
  423    HZ2  LYS  53          2HZ       LYS  53  -5.994   7.711 -10.862
  424    HZ3  LYS  53          3HZ       LYS  53  -6.218   8.463 -12.357
  425    H    MET  54           H        MET  54  -0.180   4.685  -7.456
  426    HA   MET  54           HA       MET  54   1.965   6.633  -7.491
  427    HB2  MET  54          1HB       MET  54   1.187   4.448  -5.566
  428    HB3  MET  54          2HB       MET  54   2.653   5.405  -5.372
  429    HG2  MET  54          1HG       MET  54   1.408   7.392  -5.082
  430    HG3  MET  54          2HG       MET  54  -0.084   6.611  -5.594
  431    HE1  MET  54          1HE       MET  54   1.990   6.133  -1.516
  432    HE2  MET  54          2HE       MET  54   2.439   7.271  -2.781
  433    HE3  MET  54          3HE       MET  54   2.774   5.554  -2.984
  434    H    GLN  55           H        GLN  55   1.422   3.890  -9.092
  435    HA   GLN  55           HA       GLN  55   2.592   2.295 -10.129
  436    HB2  GLN  55          1HB       GLN  55   4.592   4.497  -9.907
  437    HB3  GLN  55          2HB       GLN  55   5.050   2.960 -10.653
  438    HG2  GLN  55          1HG       GLN  55   3.222   3.225 -12.252
  439    HG3  GLN  55          2HG       GLN  55   2.792   4.753 -11.497
  440   HE21  GLN  55          1HE2      GLN  55   3.145   5.972 -13.317
  441   HE22  GLN  55          2HE2      GLN  55   4.723   6.257 -13.967
  442    H    LEU  56           H        LEU  56   2.251   1.629  -7.585
  443    HA   LEU  56           HA       LEU  56   4.860   0.686  -6.664
  444    HB2  LEU  56          1HB       LEU  56   2.648   2.023  -5.284
  445    HB3  LEU  56          2HB       LEU  56   3.276   0.616  -4.413
  446    HG   LEU  56           HG       LEU  56   4.885   2.994  -5.355
  447   HD11  LEU  56          1HD1      LEU  56   3.336   3.542  -3.526
  448   HD12  LEU  56          2HD1      LEU  56   5.019   3.605  -3.011
  449   HD13  LEU  56          3HD1      LEU  56   4.015   2.227  -2.574
  450   HD21  LEU  56          1HD2      LEU  56   6.639   2.023  -3.910
  451   HD22  LEU  56          2HD2      LEU  56   6.249   1.010  -5.299
  452   HD23  LEU  56          3HD2      LEU  56   5.630   0.594  -3.700
  453    H    PHE  57           H        PHE  57   1.814  -0.187  -7.775
  454    HA   PHE  57           HA       PHE  57   2.327  -2.993  -7.132
  455    HB2  PHE  57          1HB       PHE  57   0.681  -2.271  -5.466
  456    HB3  PHE  57          2HB       PHE  57  -0.336  -1.581  -6.728
  457    HD1  PHE  57           HD1      PHE  57   0.933  -4.735  -5.286
  458    HD2  PHE  57           HD2      PHE  57  -1.849  -2.920  -7.946
  459    HE1  PHE  57           HE1      PHE  57  -0.290  -6.860  -5.455
  460    HE2  PHE  57           HE2      PHE  57  -3.073  -5.044  -8.123
  461    HZ   PHE  57           HZ       PHE  57  -2.293  -7.013  -6.874
  462    H    ASP  58           H        ASP  58   1.726  -4.389  -8.744
  463    HA   ASP  58           HA       ASP  58   0.421  -3.229 -11.115
  464    HB2  ASP  58          1HB       ASP  58   2.779  -3.444 -11.627
  465    HB3  ASP  58          2HB       ASP  58   2.798  -5.101 -11.033
  466    H    ASP  59           H        ASP  59  -1.095  -4.480 -12.095
  467    HA   ASP  59           HA       ASP  59  -2.424  -6.453 -10.614
  468    HB2  ASP  59          1HB       ASP  59  -2.591  -5.659 -13.507
  469    HB3  ASP  59          2HB       ASP  59  -3.557  -6.964 -12.860
  470    H    THR  60           H        THR  60   0.198  -6.749 -12.871
  471    HA   THR  60           HA       THR  60  -0.242  -9.610 -13.151
  472    HB   THR  60           HB       THR  60   1.702  -7.710 -14.446
  473    HG1  THR  60           HG1      THR  60  -0.267  -7.547 -15.393
  474   HG21  THR  60          1HG2      THR  60   2.438  -9.578 -15.841
  475   HG22  THR  60          2HG2      THR  60   1.442 -10.684 -14.892
  476   HG23  THR  60          3HG2      THR  60   2.812  -9.860 -14.141
  477    H    GLU  61           H        GLU  61   2.636  -7.587 -12.425
  478    HA   GLU  61           HA       GLU  61   4.029  -9.810 -11.294
  479    HB2  GLU  61          1HB       GLU  61   4.800  -6.939 -10.877
  480    HB3  GLU  61          2HB       GLU  61   5.823  -8.362 -10.952
  481    HG2  GLU  61          1HG       GLU  61   5.194  -8.593 -13.349
  482    HG3  GLU  61          2HG       GLU  61   4.410  -7.021 -13.223
  483    H    GLY  62           H        GLY  62   1.770  -7.599  -9.995
  484    HA2  GLY  62          1HA       GLY  62   0.945  -7.526  -7.812
  485    HA3  GLY  62          2HA       GLY  62   2.262  -8.599  -7.318
  486    HA   PRO  63           HA       PRO  63   3.389  -4.584  -5.373
  487    HB2  PRO  63          1HB       PRO  63   5.134  -6.487  -3.907
  488    HB3  PRO  63          2HB       PRO  63   4.063  -5.225  -3.283
  489    HG2  PRO  63          1HG       PRO  63   3.429  -7.826  -3.090
  490    HG3  PRO  63          2HG       PRO  63   2.197  -6.579  -3.365
  491    HD2  PRO  63          1HD       PRO  63   3.405  -8.522  -5.296
  492    HD3  PRO  63          2HD       PRO  63   1.735  -7.904  -5.201
  493    H    LEU  64           H        LEU  64   4.842  -3.372  -6.375
  494    HA   LEU  64           HA       LEU  64   7.049  -4.587  -7.817
  495    HB2  LEU  64          1HB       LEU  64   6.371  -1.653  -7.565
  496    HB3  LEU  64          2HB       LEU  64   7.439  -2.397  -8.738
  497    HG   LEU  64           HG       LEU  64   4.471  -2.904  -8.598
  498   HD11  LEU  64          1HD1      LEU  64   6.064  -1.202 -10.512
  499   HD12  LEU  64          2HD1      LEU  64   4.934  -0.613  -9.292
  500   HD13  LEU  64          3HD1      LEU  64   4.346  -1.576 -10.645
  501   HD21  LEU  64          1HD2      LEU  64   4.799  -4.021 -10.721
  502   HD22  LEU  64          2HD2      LEU  64   5.795  -4.767  -9.469
  503   HD23  LEU  64          3HD2      LEU  64   6.529  -3.685 -10.651
  504    H    VAL  65           H        VAL  65   8.474  -5.307  -6.397
  505    HA   VAL  65           HA       VAL  65   9.122  -4.330  -3.917
  506    HB   VAL  65           HB       VAL  65  10.826  -5.912  -5.824
  507   HG11  VAL  65          1HG1      VAL  65  11.217  -5.450  -2.868
  508   HG12  VAL  65          2HG1      VAL  65  12.254  -4.850  -4.166
  509   HG13  VAL  65          3HG1      VAL  65  12.133  -6.584  -3.863
  510   HG21  VAL  65          1HG2      VAL  65  10.105  -7.804  -4.406
  511   HG22  VAL  65          2HG2      VAL  65   8.773  -7.019  -5.249
  512   HG23  VAL  65          3HG2      VAL  65   9.040  -6.701  -3.535
  513    H    ASP  66           H        ASP  66  10.726  -3.588  -7.003
  514    HA   ASP  66           HA       ASP  66  12.884  -2.166  -5.943
  515    HB2  ASP  66          1HB       ASP  66  12.862  -2.899  -8.241
  516    HB3  ASP  66          2HB       ASP  66  11.496  -1.852  -8.603
  517    H    ASN  67           H        ASN  67   9.863  -0.840  -7.325
  518    HA   ASN  67           HA       ASN  67  10.355   1.815  -6.579
  519    HB2  ASN  67          1HB       ASN  67   7.793   0.346  -7.151
  520    HB3  ASN  67          2HB       ASN  67   7.835   2.061  -6.771
  521   HD21  ASN  67          1HD2      ASN  67   7.048   2.655  -8.752
  522   HD22  ASN  67          2HD2      ASN  67   7.990   2.559 -10.201
  523    H    LEU  68           H        LEU  68   8.945  -0.871  -4.863
  524    HA   LEU  68           HA       LEU  68   7.817   0.519  -2.710
  525    HB2  LEU  68          1HB       LEU  68   8.746  -2.287  -3.139
  526    HB3  LEU  68          2HB       LEU  68   8.308  -1.764  -1.521
  527    HG   LEU  68           HG       LEU  68   6.443  -1.412  -3.852
  528   HD11  LEU  68          1HD1      LEU  68   6.557  -3.760  -1.966
  529   HD12  LEU  68          2HD1      LEU  68   7.038  -3.792  -3.661
  530   HD13  LEU  68          3HD1      LEU  68   5.357  -3.482  -3.230
  531   HD21  LEU  68          1HD2      LEU  68   6.005  -1.582  -0.877
  532   HD22  LEU  68          2HD2      LEU  68   4.757  -1.336  -2.100
  533   HD23  LEU  68          3HD2      LEU  68   5.994  -0.106  -1.842
  534    H    VAL  69           H        VAL  69  11.051  -0.880  -3.108
  535    HA   VAL  69           HA       VAL  69  11.997  -0.052  -0.555
  536    HB   VAL  69           HB       VAL  69  13.558  -0.714  -3.046
  537   HG11  VAL  69          1HG1      VAL  69  14.910   0.526  -1.476
  538   HG12  VAL  69          2HG1      VAL  69  15.398  -1.169  -1.461
  539   HG13  VAL  69          3HG1      VAL  69  14.394  -0.527  -0.160
  540   HG21  VAL  69          1HG2      VAL  69  12.075  -2.526  -2.280
  541   HG22  VAL  69          2HG2      VAL  69  12.850  -2.463  -0.696
  542   HG23  VAL  69          3HG2      VAL  69  13.782  -2.933  -2.119
  543    H    HIS  70           H        HIS  70  12.195   1.351  -3.812
  544    HA   HIS  70           HA       HIS  70  13.832   3.541  -3.202
  545    HB2  HIS  70          1HB       HIS  70  11.727   3.101  -5.296
  546    HB3  HIS  70          2HB       HIS  70  12.491   4.675  -5.122
  547    HD1  HIS  70           HD1      HIS  70  14.807   4.961  -6.083
  548    HD2  HIS  70           HD2      HIS  70  13.497   1.022  -6.153
  549    HE1  HIS  70           HE1      HIS  70  16.461   3.722  -7.514
  550    HE2  HIS  70           HE2      HIS  70  15.567   1.372  -7.652
  551    H    GLN  71           H        GLN  71  10.419   3.037  -2.691
  552    HA   GLN  71           HA       GLN  71   9.914   5.810  -2.005
  553    HB2  GLN  71          1HB       GLN  71   8.253   4.270  -3.168
  554    HB3  GLN  71          2HB       GLN  71   8.074   3.451  -1.619
  555    HG2  GLN  71          1HG       GLN  71   6.283   5.025  -1.908
  556    HG3  GLN  71          2HG       GLN  71   7.337   5.540  -0.592
  557   HE21  GLN  71          1HE2      GLN  71   6.713   7.670  -0.718
  558   HE22  GLN  71          2HE2      GLN  71   7.179   8.700  -2.022
  559    H    LEU  72           H        LEU  72   9.560   2.710  -0.299
  560    HA   LEU  72           HA       LEU  72   8.949   3.881   2.169
  561    HB2  LEU  72          1HB       LEU  72   9.895   1.117   1.472
  562    HB3  LEU  72          2HB       LEU  72   9.438   1.586   3.096
  563    HG   LEU  72           HG       LEU  72   7.609   1.705   0.700
  564   HD11  LEU  72          1HD1      LEU  72   8.177  -0.600   1.245
  565   HD12  LEU  72          2HD1      LEU  72   6.512  -0.251   1.712
  566   HD13  LEU  72          3HD1      LEU  72   7.779  -0.313   2.940
  567   HD21  LEU  72          1HD2      LEU  72   7.134   2.124   3.647
  568   HD22  LEU  72          2HD2      LEU  72   5.852   1.924   2.450
  569   HD23  LEU  72          3HD2      LEU  72   6.939   3.309   2.352
  570    H    ALA  73           H        ALA  73  12.026   2.658   0.903
  571    HA   ALA  73           HA       ALA  73  13.427   2.974   3.366
  572    HB1  ALA  73          1HB       ALA  73  15.393   2.382   2.124
  573    HB2  ALA  73          2HB       ALA  73  14.552   2.668   0.599
  574    HB3  ALA  73          3HB       ALA  73  14.050   1.340   1.647
  575    H    HIS  74           H        HIS  74  12.098   5.380   2.600
  576    HA   HIS  74           HA       HIS  74  13.813   7.340   1.522
  577    HB2  HIS  74          1HB       HIS  74  11.347   7.625   1.858
  578    HB3  HIS  74          2HB       HIS  74  11.631   7.733   3.593
  579    HD1  HIS  74           HD1      HIS  74  12.727   9.914   4.483
  580    HD2  HIS  74           HD2      HIS  74  11.960   9.932   0.396
  581    HE1  HIS  74           HE1      HIS  74  12.946  12.313   3.765
  582    HE2  HIS  74           HE2      HIS  74  12.383  12.315   1.312
  583    H    GLY  75           H        GLY  75  15.876   7.033   2.436
  584    HA2  GLY  75          1HA       GLY  75  17.536   7.844   3.834
  585    HA3  GLY  75          2HA       GLY  75  16.289   8.503   4.882
  586    H    ARG  76           H        ARG  76  16.485   5.143   3.865
  587    HA   ARG  76           HA       ARG  76  17.497   4.350   6.478
  588    HB2  ARG  76          1HB       ARG  76  14.713   3.961   5.560
  589    HB3  ARG  76          2HB       ARG  76  15.467   2.573   6.338
  590    HG2  ARG  76          1HG       ARG  76  16.036   4.097   8.250
  591    HG3  ARG  76          2HG       ARG  76  15.019   5.319   7.486
  592    HD2  ARG  76          1HD       ARG  76  13.142   3.719   7.542
  593    HD3  ARG  76          2HD       ARG  76  14.164   2.590   8.424
  594    HE   ARG  76           HE       ARG  76  14.012   5.150   9.685
  595   HH11  ARG  76          1HH1      ARG  76  12.403   2.069   9.312
  596   HH12  ARG  76          2HH1      ARG  76  11.495   2.214  10.784
  597   HH21  ARG  76          1HH2      ARG  76  12.821   5.357  11.624
  598   HH22  ARG  76          2HH2      ARG  76  11.735   4.090  12.102
  599    H    ASP  77           H        ASP  77  17.751   1.905   6.575
  600    HA   ASP  77           HA       ASP  77  19.367   0.990   4.499
  601    HB2  ASP  77          1HB       ASP  77  17.875  -0.647   6.551
  602    HB3  ASP  77          2HB       ASP  77  19.235  -1.207   5.589
  603    H    ALA  78           H        ALA  78  18.670   0.788   2.510
  604    HA   ALA  78           HA       ALA  78  16.087   0.192   1.643
  605    HB1  ALA  78          1HB       ALA  78  17.088  -0.151  -0.535
  606    HB2  ALA  78          2HB       ALA  78  18.684  -0.289   0.200
  607    HB3  ALA  78          3HB       ALA  78  17.815   1.244   0.262
  608    H    GLU  79           H        GLU  79  18.808  -1.898   2.375
  609    HA   GLU  79           HA       GLU  79  17.758  -4.265   1.252
  610    HB2  GLU  79          1HB       GLU  79  19.768  -3.856   3.460
  611    HB3  GLU  79          2HB       GLU  79  19.391  -5.423   2.757
  612    HG2  GLU  79          1HG       GLU  79  20.062  -4.502   0.541
  613    HG3  GLU  79          2HG       GLU  79  20.611  -3.049   1.373
  614    H    GLU  80           H        GLU  80  17.660  -2.998   4.573
  615    HA   GLU  80           HA       GLU  80  16.192  -5.057   5.760
  616    HB2  GLU  80          1HB       GLU  80  17.291  -3.266   7.016
  617    HB3  GLU  80          2HB       GLU  80  16.167  -2.100   6.345
  618    HG2  GLU  80          1HG       GLU  80  14.329  -3.204   7.484
  619    HG3  GLU  80          2HG       GLU  80  15.445  -4.384   8.151
  620    H    VAL  81           H        VAL  81  15.129  -2.059   4.223
  621    HA   VAL  81           HA       VAL  81  12.383  -2.352   4.533
  622    HB   VAL  81           HB       VAL  81  13.990  -0.947   2.409
  623   HG11  VAL  81          1HG1      VAL  81  11.944   0.337   1.936
  624   HG12  VAL  81          2HG1      VAL  81  11.038  -0.748   2.996
  625   HG13  VAL  81          3HG1      VAL  81  11.770  -1.368   1.516
  626   HG21  VAL  81          1HG2      VAL  81  12.635  -0.045   4.933
  627   HG22  VAL  81          2HG2      VAL  81  13.365   1.030   3.743
  628   HG23  VAL  81          3HG2      VAL  81  14.369  -0.122   4.616
  629    H    ARG  82           H        ARG  82  14.443  -3.288   1.782
  630    HA   ARG  82           HA       ARG  82  12.554  -4.438   0.129
  631    HB2  ARG  82          1HB       ARG  82  14.938  -4.020  -0.421
  632    HB3  ARG  82          2HB       ARG  82  15.378  -5.402   0.573
  633    HG2  ARG  82          1HG       ARG  82  14.177  -6.884  -0.878
  634    HG3  ARG  82          2HG       ARG  82  13.588  -5.525  -1.830
  635    HD2  ARG  82          1HD       ARG  82  16.488  -6.248  -1.488
  636    HD3  ARG  82          2HD       ARG  82  15.498  -6.712  -2.869
  637    HE   ARG  82           HE       ARG  82  15.261  -4.332  -3.370
  638   HH11  ARG  82          1HH1      ARG  82  17.871  -5.261  -1.208
  639   HH12  ARG  82          2HH1      ARG  82  18.836  -3.865  -1.585
  640   HH21  ARG  82          1HH2      ARG  82  16.527  -2.501  -3.850
  641   HH22  ARG  82          2HH2      ARG  82  18.065  -2.295  -3.073
  642    H    THR  83           H        THR  83  14.351  -5.924   2.798
  643    HA   THR  83           HA       THR  83  13.437  -8.578   2.396
  644    HB   THR  83           HB       THR  83  14.163  -7.457   5.101
  645    HG1  THR  83           HG1      THR  83  15.845  -6.754   3.785
  646   HG21  THR  83          1HG2      THR  83  13.405  -9.759   5.028
  647   HG22  THR  83          2HG2      THR  83  15.125  -9.689   5.408
  648   HG23  THR  83          3HG2      THR  83  14.598 -10.134   3.785
  649    H    GLU  84           H        GLU  84  12.299  -6.002   4.568
  650    HA   GLU  84           HA       GLU  84  10.203  -7.437   5.738
  651    HB2  GLU  84          1HB       GLU  84  10.619  -4.494   5.309
  652    HB3  GLU  84          2HB       GLU  84   9.193  -5.125   6.116
  653    HG2  GLU  84          1HG       GLU  84  12.020  -5.626   6.986
  654    HG3  GLU  84          2HG       GLU  84  10.954  -4.405   7.674
  655    H    VAL  85           H        VAL  85  10.220  -5.386   2.827
  656    HA   VAL  85           HA       VAL  85   7.516  -5.557   2.177
  657    HB   VAL  85           HB       VAL  85   9.970  -5.274   0.449
  658   HG11  VAL  85          1HG1      VAL  85   8.297  -6.381  -0.910
  659   HG12  VAL  85          2HG1      VAL  85   8.455  -4.695  -1.409
  660   HG13  VAL  85          3HG1      VAL  85   7.082  -5.200  -0.419
  661   HG21  VAL  85          1HG2      VAL  85   9.134  -2.983   0.190
  662   HG22  VAL  85          2HG2      VAL  85   9.431  -3.395   1.880
  663   HG23  VAL  85          3HG2      VAL  85   7.780  -3.366   1.254
  664    H    LEU  86           H        LEU  86  10.200  -7.643   1.097
  665    HA   LEU  86           HA       LEU  86   8.723  -9.384  -0.498
  666    HB2  LEU  86          1HB       LEU  86  11.259  -9.825   1.079
  667    HB3  LEU  86          2HB       LEU  86  10.612 -10.984  -0.081
  668    HG   LEU  86           HG       LEU  86  11.296  -8.158  -0.841
  669   HD11  LEU  86          1HD1      LEU  86  13.418  -9.022  -1.672
  670   HD12  LEU  86          2HD1      LEU  86  13.038 -10.611  -1.012
  671   HD13  LEU  86          3HD1      LEU  86  13.287  -9.244   0.073
  672   HD21  LEU  86          1HD2      LEU  86  11.417  -9.170  -3.090
  673   HD22  LEU  86          2HD2      LEU  86   9.816  -9.303  -2.364
  674   HD23  LEU  86          3HD2      LEU  86  10.887 -10.704  -2.399
  675    H    LYS  87           H        LYS  87   9.171  -9.277   2.944
  676    HA   LYS  87           HA       LYS  87   8.247 -11.901   3.557
  677    HB2  LYS  87          1HB       LYS  87   9.602 -10.504   5.090
  678    HB3  LYS  87          2HB       LYS  87   8.246  -9.399   5.252
  679    HG2  LYS  87          1HG       LYS  87   6.912 -11.203   6.244
  680    HG3  LYS  87          2HG       LYS  87   8.318 -12.279   6.124
  681    HD2  LYS  87          1HD       LYS  87   8.176 -11.381   8.366
  682    HD3  LYS  87          2HD       LYS  87   9.588 -10.709   7.551
  683    HE2  LYS  87          1HE       LYS  87   8.214  -8.691   7.008
  684    HE3  LYS  87          2HE       LYS  87   6.937  -9.359   8.024
  685    HZ1  LYS  87          1HZ       LYS  87   8.514  -9.346   9.884
  686    HZ2  LYS  87          2HZ       LYS  87   8.250  -7.796   9.264
  687    HZ3  LYS  87          3HZ       LYS  87   9.680  -8.617   8.890
  688    H    CYS  88           H        CYS  88   6.693  -9.015   2.612
  689    HA   CYS  88           HA       CYS  88   4.107  -9.968   3.610
  690    HB2  CYS  88          1HB       CYS  88   5.178  -7.264   2.938
  691    HB3  CYS  88          2HB       CYS  88   3.430  -7.553   2.807
  692    H    VAL  89           H        VAL  89   5.998  -9.706   0.806
  693    HA   VAL  89           HA       VAL  89   3.921  -9.557  -1.125
  694    HB   VAL  89           HB       VAL  89   6.700 -10.721  -1.366
  695   HG11  VAL  89          1HG1      VAL  89   6.331 -10.407  -3.807
  696   HG12  VAL  89          2HG1      VAL  89   4.640 -10.033  -3.454
  697   HG13  VAL  89          3HG1      VAL  89   5.286 -11.630  -3.083
  698   HG21  VAL  89          1HG2      VAL  89   5.595  -8.000  -2.055
  699   HG22  VAL  89          2HG2      VAL  89   7.185  -8.586  -2.548
  700   HG23  VAL  89          3HG2      VAL  89   6.813  -8.381  -0.837
  701    H    ASP  90           H        ASP  90   2.531 -11.059  -1.706
  702    HA   ASP  90           HA       ASP  90   3.094 -13.877  -1.209
  703    HB2  ASP  90          1HB       ASP  90   1.823 -12.735   0.745
  704    HB3  ASP  90          2HB       ASP  90   0.456 -12.701  -0.371
  705    H    LYS  91           H        LYS  91   1.238 -15.229  -2.182
  706    HA   LYS  91           HA       LYS  91   0.897 -14.252  -4.905
  707    HB2  LYS  91          1HB       LYS  91   0.160 -16.976  -3.849
  708    HB3  LYS  91          2HB       LYS  91   0.446 -16.494  -5.514
  709    HG2  LYS  91          1HG       LYS  91   2.530 -16.573  -3.359
  710    HG3  LYS  91          2HG       LYS  91   2.290 -17.798  -4.603
  711    HD2  LYS  91          1HD       LYS  91   2.994 -14.905  -5.093
  712    HD3  LYS  91          2HD       LYS  91   4.122 -16.258  -5.161
  713    HE2  LYS  91          1HE       LYS  91   2.778 -17.243  -6.981
  714    HE3  LYS  91          2HE       LYS  91   1.723 -15.834  -6.937
  715    HZ1  LYS  91          1HZ       LYS  91   4.614 -15.837  -7.605
  716    HZ2  LYS  91          2HZ       LYS  91   3.654 -14.451  -7.482
  717    HZ3  LYS  91          3HZ       LYS  91   3.333 -15.597  -8.685
  718    H    ASN  92           H        ASN  92  -1.084 -14.365  -6.019
  719    HA   ASN  92           HA       ASN  92  -3.303 -13.446  -4.404
  720    HB2  ASN  92          1HB       ASN  92  -2.634 -12.363  -6.559
  721    HB3  ASN  92          2HB       ASN  92  -3.125 -13.826  -7.394
  722   HD21  ASN  92          1HD2      ASN  92  -4.528 -12.442  -8.581
  723   HD22  ASN  92          2HD2      ASN  92  -6.070 -11.998  -7.931
  724    H    THR  93           H        THR  93  -3.298 -15.676  -3.398
  725    HA   THR  93           HA       THR  93  -4.499 -17.821  -4.885
  726    HB   THR  93           HB       THR  93  -4.645 -18.941  -2.668
  727    HG1  THR  93           HG1      THR  93  -3.317 -17.586  -1.026
  728   HG21  THR  93          1HG2      THR  93  -2.230 -19.095  -2.273
  729   HG22  THR  93          2HG2      THR  93  -1.981 -17.675  -3.289
  730   HG23  THR  93          3HG2      THR  93  -2.621 -19.160  -3.990
  731    H    ASP  94           H        ASP  94  -5.621 -15.165  -2.959
  732    HA   ASP  94           HA       ASP  94  -8.225 -16.309  -2.475
  733    HB2  ASP  94          1HB       ASP  94  -8.762 -14.197  -1.399
  734    HB3  ASP  94          2HB       ASP  94  -7.184 -14.767  -0.847
  735    H    ASN  95           H        ASN  95  -6.705 -14.598  -4.960
  736    HA   ASN  95           HA       ASN  95  -7.336 -14.222  -7.083
  737    HB2  ASN  95          1HB       ASN  95  -8.468 -16.400  -6.803
  738    HB3  ASN  95          2HB       ASN  95  -9.926 -15.559  -6.322
  739   HD21  ASN  95          1HD2      ASN  95 -11.108 -16.399  -7.983
  740   HD22  ASN  95          2HD2      ASN  95 -10.898 -15.900  -9.632
  741    H    ASN  96           H        ASN  96  -7.753 -12.149  -5.158
  742    HA   ASN  96           HA       ASN  96  -9.532 -10.586  -6.866
  743    HB2  ASN  96          1HB       ASN  96 -10.987 -11.042  -5.020
  744    HB3  ASN  96          2HB       ASN  96  -9.723 -10.673  -3.847
  745   HD21  ASN  96          1HD2      ASN  96 -11.107  -9.159  -2.857
  746   HD22  ASN  96          2HD2      ASN  96 -11.431  -7.616  -3.571
  747    H    ALA  97           H        ALA  97  -8.279  -9.055  -7.685
  748    HA   ALA  97           HA       ALA  97  -5.682  -8.575  -6.705
  749    HB1  ALA  97          1HB       ALA  97  -7.174  -6.908  -8.714
  750    HB2  ALA  97          2HB       ALA  97  -6.347  -8.419  -9.084
  751    HB3  ALA  97          3HB       ALA  97  -5.427  -7.029  -8.509
  752    H    CYS  98           H        CYS  98  -8.708  -6.776  -6.282
  753    HA   CYS  98           HA       CYS  98  -7.570  -4.471  -5.089
  754    HB2  CYS  98          1HB       CYS  98 -10.236  -5.777  -4.479
  755    HB3  CYS  98          2HB       CYS  98  -9.741  -4.180  -3.938
  756    H    HIS  99           H        HIS  99  -8.358  -7.654  -3.818
  757    HA   HIS  99           HA       HIS  99  -7.744  -6.855  -1.103
  758    HB2  HIS  99          1HB       HIS  99  -9.522  -8.491  -1.534
  759    HB3  HIS  99          2HB       HIS  99  -8.353  -9.578  -2.272
  760    HD1  HIS  99           HD1      HIS  99  -7.697 -11.387  -0.774
  761    HD2  HIS  99           HD2      HIS  99  -8.599  -7.916   1.331
  762    HE1  HIS  99           HE1      HIS  99  -7.386 -11.963   1.663
  763    HE2  HIS  99           HE2      HIS  99  -8.149  -9.908   2.910
  764    H    TRP 100           H        TRP 100  -6.171  -8.310  -3.797
  765    HA   TRP 100           HA       TRP 100  -3.982  -9.509  -2.508
  766    HB2  TRP 100          1HB       TRP 100  -4.606  -9.854  -4.899
  767    HB3  TRP 100          2HB       TRP 100  -4.050  -8.221  -5.256
  768    HD1  TRP 100           HD1      TRP 100  -1.705  -9.795  -2.867
  769    HE1  TRP 100           HE1      TRP 100   0.374 -10.676  -4.097
  770    HE3  TRP 100           HE3      TRP 100  -3.418  -9.498  -7.680
  771    HZ2  TRP 100           HZ2      TRP 100   1.181 -11.188  -6.753
  772    HZ3  TRP 100           HZ3      TRP 100  -1.929 -10.203  -9.506
  773    HH2  TRP 100           HH2      TRP 100   0.318 -11.031  -9.056
  774    H    ALA 101           H        ALA 101  -4.272  -6.315  -4.056
  775    HA   ALA 101           HA       ALA 101  -1.811  -5.280  -3.179
  776    HB1  ALA 101          1HB       ALA 101  -4.358  -3.811  -3.859
  777    HB2  ALA 101          2HB       ALA 101  -3.096  -4.281  -4.996
  778    HB3  ALA 101          3HB       ALA 101  -2.753  -3.088  -3.741
  779    H    PHE 102           H        PHE 102  -5.011  -5.329  -1.749
  780    HA   PHE 102           HA       PHE 102  -4.466  -3.572   0.381
  781    HB2  PHE 102          1HB       PHE 102  -6.729  -4.070  -0.363
  782    HB3  PHE 102          2HB       PHE 102  -6.558  -5.737   0.174
  783    HD1  PHE 102           HD1      PHE 102  -6.505  -2.232   1.383
  784    HD2  PHE 102           HD2      PHE 102  -7.164  -6.322   2.361
  785    HE1  PHE 102           HE1      PHE 102  -7.339  -1.564   3.599
  786    HE2  PHE 102           HE2      PHE 102  -8.001  -5.661   4.577
  787    HZ   PHE 102           HZ       PHE 102  -8.088  -3.277   5.201
  788    H    ARG 103           H        ARG 103  -4.036  -7.009  -0.075
  789    HA   ARG 103           HA       ARG 103  -3.663  -7.636   2.689
  790    HB2  ARG 103          1HB       ARG 103  -4.445  -9.283   0.991
  791    HB3  ARG 103          2HB       ARG 103  -2.844  -9.235   0.267
  792    HG2  ARG 103          1HG       ARG 103  -1.848 -10.299   2.054
  793    HG3  ARG 103          2HG       ARG 103  -3.165  -9.905   3.149
  794    HD2  ARG 103          1HD       ARG 103  -2.954 -12.321   2.340
  795    HD3  ARG 103          2HD       ARG 103  -4.542 -11.573   2.289
  796    HE   ARG 103           HE       ARG 103  -4.285 -11.345  -0.098
  797   HH11  ARG 103          1HH1      ARG 103  -1.926 -13.376   1.489
  798   HH12  ARG 103          2HH1      ARG 103  -1.522 -14.264   0.052
  799   HH21  ARG 103          1HH2      ARG 103  -3.831 -12.560  -1.978
  800   HH22  ARG 103          2HH2      ARG 103  -2.598 -13.786  -1.924
  801    H    GLY 104           H        GLY 104  -1.545  -6.901  -0.035
  802    HA2  GLY 104          1HA       GLY 104   0.919  -7.341   1.305
  803    HA3  GLY 104          2HA       GLY 104   0.676  -6.283  -0.091
  804    H    PHE 105           H        PHE 105  -1.128  -4.478   0.940
  805    HA   PHE 105           HA       PHE 105   0.567  -2.683   2.270
  806    HB2  PHE 105          1HB       PHE 105  -1.105  -1.789   0.852
  807    HB3  PHE 105          2HB       PHE 105  -2.379  -2.661   1.688
  808    HD1  PHE 105           HD1      PHE 105   0.379  -0.481   2.918
  809    HD2  PHE 105           HD2      PHE 105  -3.824  -1.098   2.607
  810    HE1  PHE 105           HE1      PHE 105  -0.021   1.519   4.295
  811    HE2  PHE 105           HE2      PHE 105  -4.223   0.892   3.989
  812    HZ   PHE 105           HZ       PHE 105  -2.321   2.204   4.837
  813    H    LYS 106           H        LYS 106  -2.227  -4.544   3.390
  814    HA   LYS 106           HA       LYS 106  -2.299  -3.501   5.984
  815    HB2  LYS 106          1HB       LYS 106  -4.265  -4.532   5.397
  816    HB3  LYS 106          2HB       LYS 106  -3.467  -5.931   4.678
  817    HG2  LYS 106          1HG       LYS 106  -2.845  -6.627   7.001
  818    HG3  LYS 106          2HG       LYS 106  -3.849  -5.300   7.596
  819    HD2  LYS 106          1HD       LYS 106  -5.792  -6.287   6.431
  820    HD3  LYS 106          2HD       LYS 106  -4.775  -7.633   5.913
  821    HE2  LYS 106          1HE       LYS 106  -4.329  -8.133   8.312
  822    HE3  LYS 106          2HE       LYS 106  -5.493  -6.882   8.744
  823    HZ1  LYS 106          1HZ       LYS 106  -7.197  -8.141   7.530
  824    HZ2  LYS 106          2HZ       LYS 106  -6.524  -9.033   8.804
  825    HZ3  LYS 106          3HZ       LYS 106  -6.062  -9.359   7.213
  826    H    CYS 107           H        CYS 107  -0.654  -6.323   4.639
  827    HA   CYS 107           HA       CYS 107   0.232  -7.482   7.010
  828    HB2  CYS 107          1HB       CYS 107   0.390  -8.759   5.030
  829    HB3  CYS 107          2HB       CYS 107   1.320  -7.524   4.195
  830    H    PHE 108           H        PHE 108   1.684  -4.999   4.971
  831    HA   PHE 108           HA       PHE 108   4.179  -5.001   6.359
  832    HB2  PHE 108          1HB       PHE 108   3.792  -4.400   3.934
  833    HB3  PHE 108          2HB       PHE 108   3.123  -2.872   4.506
  834    HD1  PHE 108           HD1      PHE 108   4.590  -1.225   5.603
  835    HD2  PHE 108           HD2      PHE 108   6.123  -4.825   3.928
  836    HE1  PHE 108           HE1      PHE 108   6.857  -0.275   5.638
  837    HE2  PHE 108           HE2      PHE 108   8.387  -3.880   3.966
  838    HZ   PHE 108           HZ       PHE 108   8.759  -1.605   4.816
  839    H    GLN 109           H        GLN 109   1.414  -2.763   6.222
  840    HA   GLN 109           HA       GLN 109   2.478  -0.865   8.007
  841    HB2  GLN 109          1HB       GLN 109   0.236   0.046   8.114
  842    HB3  GLN 109          2HB       GLN 109   0.657  -0.358   6.459
  843    HG2  GLN 109          1HG       GLN 109  -1.392  -1.254   6.433
  844    HG3  GLN 109          2HG       GLN 109  -0.601  -2.622   7.220
  845   HE21  GLN 109          1HE2      GLN 109  -2.666   0.128   7.656
  846   HE22  GLN 109          2HE2      GLN 109  -3.249  -0.308   9.222
  847    H    LYS 110           H        LYS 110   1.080  -3.933   8.553
  848    HA   LYS 110           HA       LYS 110   0.110  -3.584  11.177
  849    HB2  LYS 110          1HB       LYS 110  -0.471  -5.508   9.780
  850    HB3  LYS 110          2HB       LYS 110   1.203  -6.025   9.770
  851    HG2  LYS 110          1HG       LYS 110   1.128  -6.449  12.142
  852    HG3  LYS 110          2HG       LYS 110  -0.547  -5.895  12.203
  853    HD2  LYS 110          1HD       LYS 110  -1.251  -7.710  10.784
  854    HD3  LYS 110          2HD       LYS 110   0.419  -8.198  10.507
  855    HE2  LYS 110          1HE       LYS 110   0.628  -8.720  12.918
  856    HE3  LYS 110          2HE       LYS 110  -1.077  -8.316  13.127
  857    HZ1  LYS 110          1HZ       LYS 110  -0.024 -10.472  11.379
  858    HZ2  LYS 110          2HZ       LYS 110  -1.652 -10.094  11.607
  859    HZ3  LYS 110          3HZ       LYS 110  -0.740 -10.697  12.893
  860    H    ASN 111           H        ASN 111   3.293  -4.054   9.841
  861    HA   ASN 111           HA       ASN 111   4.398  -4.378  12.556
  862    HB2  ASN 111          1HB       ASN 111   5.664  -5.183   9.930
  863    HB3  ASN 111          2HB       ASN 111   6.315  -5.464  11.540
  864   HD21  ASN 111          1HD2      ASN 111   5.520  -7.300   9.341
  865   HD22  ASN 111          2HD2      ASN 111   4.441  -8.428  10.076
  866    H    ASN 112           H        ASN 112   4.571  -2.560   9.569
  867    HA   ASN 112           HA       ASN 112   6.605  -0.803  10.763
  868    HB2  ASN 112          1HB       ASN 112   6.682  -1.920   7.947
  869    HB3  ASN 112          2HB       ASN 112   7.794  -0.720   8.611
  870   HD21  ASN 112          1HD2      ASN 112   7.917  -3.635   7.618
  871   HD22  ASN 112          2HD2      ASN 112   8.903  -4.415   8.811
  872    H    LEU 113           H        LEU 113   4.453   0.358  11.063
  873    HA   LEU 113           HA       LEU 113   3.318   1.471   8.641
  874    HB2  LEU 113          1HB       LEU 113   1.750   0.845  10.312
  875    HB3  LEU 113          2HB       LEU 113   2.586   1.768  11.543
  876    HG   LEU 113           HG       LEU 113   1.952   3.848  10.326
  877   HD11  LEU 113          1HD1      LEU 113   0.301   3.767   8.580
  878   HD12  LEU 113          2HD1      LEU 113   0.234   2.010   8.679
  879   HD13  LEU 113          3HD1      LEU 113   1.701   2.803   8.107
  880   HD21  LEU 113          1HD2      LEU 113  -0.407   3.793  10.991
  881   HD22  LEU 113          2HD2      LEU 113   0.632   3.052  12.209
  882   HD23  LEU 113          3HD2      LEU 113  -0.318   2.035  11.128
  883    H    SER 114           H        SER 114   5.369   2.503  11.288
  884    HA   SER 114           HA       SER 114   5.174   5.285  10.798
  885    HB2  SER 114          1HB       SER 114   7.428   3.739  12.095
  886    HB3  SER 114          2HB       SER 114   7.181   5.483  12.195
  887    HG   SER 114           HG       SER 114   6.320   4.039  13.959
  888    H    LEU 115           H        LEU 115   7.181   2.757   9.443
  889    HA   LEU 115           HA       LEU 115   8.974   4.386   8.009
  890    HB2  LEU 115          1HB       LEU 115   9.266   1.967   8.342
  891    HB3  LEU 115          2HB       LEU 115   7.887   1.663   7.304
  892    HG   LEU 115           HG       LEU 115   9.131   2.699   5.417
  893   HD11  LEU 115          1HD1      LEU 115  10.609   4.136   6.667
  894   HD12  LEU 115          2HD1      LEU 115  11.561   3.011   5.696
  895   HD13  LEU 115          3HD1      LEU 115  11.365   2.738   7.428
  896   HD21  LEU 115          1HD2      LEU 115   9.120   0.264   5.782
  897   HD22  LEU 115          2HD2      LEU 115  10.579   0.419   6.760
  898   HD23  LEU 115          3HD2      LEU 115  10.619   0.826   5.044
  899    H    ILE 116           H        ILE 116   5.728   3.255   7.380
  900    HA   ILE 116           HA       ILE 116   5.569   4.059   4.673
  901    HB   ILE 116           HB       ILE 116   3.346   3.669   6.694
  902   HG12  ILE 116          1HG1      ILE 116   4.543   1.780   4.650
  903   HG13  ILE 116          2HG1      ILE 116   4.700   1.655   6.408
  904   HG21  ILE 116          1HG2      ILE 116   2.608   4.995   4.785
  905   HG22  ILE 116          2HG2      ILE 116   1.893   3.381   4.741
  906   HG23  ILE 116          3HG2      ILE 116   3.246   3.774   3.682
  907   HD11  ILE 116          1HD1      ILE 116   3.069   0.083   5.677
  908   HD12  ILE 116          2HD1      ILE 116   2.214   1.315   4.756
  909   HD13  ILE 116          3HD1      ILE 116   2.226   1.384   6.517
  910    H    LYS 117           H        LYS 117   4.712   5.602   7.734
  911    HA   LYS 117           HA       LYS 117   3.608   7.957   6.651
  912    HB2  LYS 117          1HB       LYS 117   4.915   7.411   9.311
  913    HB3  LYS 117          2HB       LYS 117   4.145   8.938   8.915
  914    HG2  LYS 117          1HG       LYS 117   2.013   7.806   8.609
  915    HG3  LYS 117          2HG       LYS 117   2.767   6.251   8.949
  916    HD2  LYS 117          1HD       LYS 117   3.329   7.020  11.209
  917    HD3  LYS 117          2HD       LYS 117   2.590   8.581  10.867
  918    HE2  LYS 117          1HE       LYS 117   0.424   7.580  10.660
  919    HE3  LYS 117          2HE       LYS 117   1.108   5.960  10.747
  920    HZ1  LYS 117          1HZ       LYS 117   1.113   7.972  12.931
  921    HZ2  LYS 117          2HZ       LYS 117   1.819   6.438  13.018
  922    HZ3  LYS 117          3HZ       LYS 117   0.143   6.588  12.854
  923    H    ALA 118           H        ALA 118   6.889   7.056   7.569
  924    HA   ALA 118           HA       ALA 118   8.019   9.645   7.200
  925    HB1  ALA 118          1HB       ALA 118  10.147   8.518   7.465
  926    HB2  ALA 118          2HB       ALA 118   9.355   6.953   7.271
  927    HB3  ALA 118          3HB       ALA 118   8.990   7.958   8.672
  928    H    SER 119           H        SER 119   7.580   6.854   5.118
  929    HA   SER 119           HA       SER 119   9.435   7.534   3.140
  930    HB2  SER 119          1HB       SER 119   8.257   5.969   1.697
  931    HB3  SER 119          2HB       SER 119   8.376   5.310   3.326
  932    HG   SER 119           HG       SER 119   6.203   6.031   3.661
  933    H    ILE 120           H        ILE 120   6.071   8.497   3.559
  934    HA   ILE 120           HA       ILE 120   6.114   9.990   1.058
  935    HB   ILE 120           HB       ILE 120   3.754  10.517   1.557
  936   HG12  ILE 120          1HG1      ILE 120   4.004   8.655   3.916
  937   HG13  ILE 120          2HG1      ILE 120   4.094  10.408   4.076
  938   HG21  ILE 120          1HG2      ILE 120   4.312   8.526   0.278
  939   HG22  ILE 120          2HG2      ILE 120   2.883   8.254   1.275
  940   HG23  ILE 120          3HG2      ILE 120   4.443   7.595   1.770
  941   HD11  ILE 120          1HD1      ILE 120   1.763   8.860   2.978
  942   HD12  ILE 120          2HD1      ILE 120   1.854  10.611   3.148
  943   HD13  ILE 120          3HD1      ILE 120   1.870   9.584   4.582
  944    H    LYS 121           H        LYS 121   7.245  10.557   4.051
  945    HA   LYS 121           HA       LYS 121   6.281  13.284   4.302
  946    HB2  LYS 121          1HB       LYS 121   6.522  11.894   6.314
  947    HB3  LYS 121          2HB       LYS 121   8.243  11.736   5.999
  948    HG2  LYS 121          1HG       LYS 121   8.524  14.147   6.277
  949    HG3  LYS 121          2HG       LYS 121   6.794  14.314   6.572
  950    HD2  LYS 121          1HD       LYS 121   8.660  12.652   8.257
  951    HD3  LYS 121          2HD       LYS 121   8.170  14.303   8.642
  952    HE2  LYS 121          1HE       LYS 121   6.360  11.904   8.378
  953    HE3  LYS 121          2HE       LYS 121   6.823  12.708   9.877
  954    HZ1  LYS 121          1HZ       LYS 121   5.722  14.726   9.048
  955    HZ2  LYS 121          2HZ       LYS 121   4.651  13.430   9.215
  956    HZ3  LYS 121          3HZ       LYS 121   5.200  13.877   7.681
  957    H    LYS 122           H        LYS 122   7.275  14.946   3.436
  958    HA   LYS 122           HA       LYS 122   9.788  14.681   2.066
  959    HB2  LYS 122          1HB       LYS 122   8.836  17.405   2.584
  960    HB3  LYS 122          2HB       LYS 122   9.269  16.640   1.081
  961    HG2  LYS 122          1HG       LYS 122   7.092  15.502   1.021
  962    HG3  LYS 122          2HG       LYS 122   6.631  16.356   2.492
  963    HD2  LYS 122          1HD       LYS 122   7.458  17.728  -0.060
  964    HD3  LYS 122          2HD       LYS 122   5.782  17.387   0.376
  965    HE2  LYS 122          1HE       LYS 122   6.046  18.730   2.408
  966    HE3  LYS 122          2HE       LYS 122   7.715  19.074   1.960
  967    HZ1  LYS 122          1HZ       LYS 122   5.421  19.770   0.218
  968    HZ2  LYS 122          2HZ       LYS 122   7.018  20.328   0.116
  969    HZ3  LYS 122          3HZ       LYS 122   6.030  20.828   1.394
  970    H    ASP 123           H        ASP 123  11.753  15.493   2.611
  971    HA   ASP 123           HA       ASP 123  12.340  15.592   5.378
  972    HB2  ASP 123          1HB       ASP 123  14.646  15.961   4.721
  973    HB3  ASP 123          2HB       ASP 123  13.937  14.722   3.696
  974    H21  ACD 201           H21      ACD   1  -4.416   4.447   1.622
  975    H22  ACD 201           H22      ACD   1  -3.174   4.908   2.793
  976    H31  ACD 201           H31      ACD   1  -2.061   6.296   1.074
  977    H32  ACD 201           H32      ACD   1  -3.306   5.884  -0.097
  978    H41  ACD 201           H41      ACD   1  -2.643   3.524  -0.049
  979    H42  ACD 201           H42      ACD   1  -1.217   4.525  -0.368
  980    H5   ACD 201           H5       ACD   1  -1.758   2.901   2.154
  981    H6   ACD 201           H6       ACD   1   0.391   3.723   2.804
  982    H71  ACD 201           H71      ACD   1   0.715   4.984   0.171
  983    H72  ACD 201           H72      ACD   1  -0.194   6.124   1.161
  984    H8   ACD 201           H8       ACD   1   1.742   6.494   2.621
  985    H9   ACD 201           H9       ACD   1   3.819   5.473   2.053
  986   H101  ACD 201          H101      ACD   1   2.701   4.554  -0.480
  987   H102  ACD 201          H102      ACD   1   2.249   3.323   0.704
  988    H11  ACD 201           H11      ACD   1   5.207   4.179   0.535
  989    H12  ACD 201           H12      ACD   1   5.528   1.849   0.224
  990   H131  ACD 201          H131      ACD   1   2.547   1.887  -0.466
  991   H132  ACD 201          H132      ACD   1   3.647   0.513  -0.615
  992    H14  ACD 201           H14      ACD   1   2.555   1.506   2.113
  993    H15  ACD 201           H15      ACD   1   2.480  -0.836   2.518
  994   H161  ACD 201          H161      ACD   1   2.631  -1.507  -0.287
  995   H162  ACD 201          H162      ACD   1   4.294  -1.072   0.124
  996   H171  ACD 201          H171      ACD   1   4.420  -2.769   1.830
  997   H172  ACD 201          H172      ACD   1   2.687  -3.076   1.746
  998   H181  ACD 201          H181      ACD   1   4.658  -3.598  -0.517
  999   H182  ACD 201          H182      ACD   1   2.926  -3.941  -0.559
 1000   H191  ACD 201          H191      ACD   1   4.968  -5.185   1.336
 1001   H192  ACD 201          H192      ACD   1   3.228  -5.465   1.433
 1002   H201  ACD 201          H201      ACD   1   3.272  -6.398  -0.853
 1003   H202  ACD 201          H202      ACD   1   4.344  -7.264   0.193
 1004   H203  ACD 201          H203      ACD   1   4.979  -6.125  -0.946
  Start of MODEL   26
    1    H1   MET   1          1H        MET   1  18.837  13.998 -13.838
    2    H2   MET   1          2H        MET   1  19.595  12.999 -12.707
    3    H3   MET   1          3H        MET   1  18.780  14.387 -12.191
    4    HA   MET   1           HA       MET   1  16.692  13.442 -13.021
    5    HB2  MET   1          1HB       MET   1  18.482  11.049 -13.463
    6    HB3  MET   1          2HB       MET   1  16.731  10.934 -13.371
    7    HG2  MET   1          1HG       MET   1  16.518  12.390 -15.306
    8    HG3  MET   1          2HG       MET   1  18.270  12.553 -15.385
    9    HE1  MET   1          1HE       MET   1  17.410  10.342 -18.520
   10    HE2  MET   1          2HE       MET   1  18.155  11.838 -17.954
   11    HE3  MET   1          3HE       MET   1  16.407  11.626 -17.845
   12    H    GLU   2           H        GLU   2  16.716  14.241 -10.839
   13    HA   GLU   2           HA       GLU   2  17.602  12.549  -8.698
   14    HB2  GLU   2          1HB       GLU   2  16.063  15.138  -8.758
   15    HB3  GLU   2          2HB       GLU   2  16.482  14.302  -7.273
   16    HG2  GLU   2          1HG       GLU   2  18.067  16.032  -7.613
   17    HG3  GLU   2          2HG       GLU   2  18.882  14.504  -7.921
   18    H    PHE   3           H        PHE   3  16.437  11.225  -7.454
   19    HA   PHE   3           HA       PHE   3  13.983  10.244  -8.487
   20    HB2  PHE   3          1HB       PHE   3  15.532   8.739  -7.394
   21    HB3  PHE   3          2HB       PHE   3  15.391   9.641  -5.882
   22    HD1  PHE   3           HD1      PHE   3  13.248   7.856  -8.351
   23    HD2  PHE   3           HD2      PHE   3  13.974   8.818  -4.276
   24    HE1  PHE   3           HE1      PHE   3  11.388   6.391  -7.682
   25    HE2  PHE   3           HE2      PHE   3  12.115   7.355  -3.595
   26    HZ   PHE   3           HZ       PHE   3  10.820   6.139  -5.299
   27    H    THR   4           H        THR   4  12.142  11.215  -8.308
   28    HA   THR   4           HA       THR   4  11.538  12.818  -5.934
   29    HB   THR   4           HB       THR   4   9.708  13.763  -7.178
   30    HG1  THR   4           HG1      THR   4   9.864  11.518  -8.617
   31   HG21  THR   4          1HG2      THR   4  10.913  14.903  -8.912
   32   HG22  THR   4          2HG2      THR   4  12.139  13.635  -8.938
   33   HG23  THR   4          3HG2      THR   4  11.961  14.662  -7.516
   34    H    VAL   5           H        VAL   5  10.449  11.970  -4.382
   35    HA   VAL   5           HA       VAL   5   9.112   9.401  -4.739
   36    HB   VAL   5           HB       VAL   5   9.282   9.092  -2.481
   37   HG11  VAL   5          1HG1      VAL   5  11.520   9.490  -3.295
   38   HG12  VAL   5          2HG1      VAL   5  11.351   9.956  -1.606
   39   HG13  VAL   5          3HG1      VAL   5  11.387  11.191  -2.859
   40   HG21  VAL   5          1HG2      VAL   5   9.172  10.792  -0.757
   41   HG22  VAL   5          2HG2      VAL   5   7.807  10.967  -1.860
   42   HG23  VAL   5          3HG2      VAL   5   9.183  12.064  -1.978
   43    H    SER   6           H        SER   6   6.943   9.030  -4.274
   44    HA   SER   6           HA       SER   6   5.156  11.164  -4.839
   45    HB2  SER   6          1HB       SER   6   3.414   9.407  -4.145
   46    HB3  SER   6          2HB       SER   6   4.430   9.031  -5.534
   47    HG   SER   6           HG       SER   6   5.051   7.329  -4.491
   48    H    THR   7           H        THR   7   5.440  12.760  -3.353
   49    HA   THR   7           HA       THR   7   5.743  12.353  -0.573
   50    HB   THR   7           HB       THR   7   5.402  14.804  -0.385
   51    HG1  THR   7           HG1      THR   7   4.854  14.579  -3.188
   52   HG21  THR   7          1HG2      THR   7   7.618  13.925  -0.935
   53   HG22  THR   7          2HG2      THR   7   7.335  15.474  -1.728
   54   HG23  THR   7          3HG2      THR   7   7.219  13.979  -2.653
   55    H    THR   8           H        THR   8   4.242  13.663   0.980
   56    HA   THR   8           HA       THR   8   1.760  12.452   1.184
   57    HB   THR   8           HB       THR   8   2.324  15.219   2.237
   58    HG1  THR   8           HG1      THR   8   3.671  12.867   2.736
   59   HG21  THR   8          1HG2      THR   8   0.093  14.337   2.651
   60   HG22  THR   8          2HG2      THR   8   1.010  14.398   4.156
   61   HG23  THR   8          3HG2      THR   8   0.782  12.861   3.320
   62    H    GLU   9           H        GLU   9   2.668  15.544  -0.267
   63    HA   GLU   9           HA       GLU   9   0.090  16.419  -0.927
   64    HB2  GLU   9          1HB       GLU   9   2.779  17.059  -2.124
   65    HB3  GLU   9          2HB       GLU   9   1.293  17.857  -2.614
   66    HG2  GLU   9          1HG       GLU   9   2.415  19.260  -1.049
   67    HG3  GLU   9          2HG       GLU   9   0.977  18.604  -0.273
   68    H    ASP  10           H        ASP  10   2.456  14.515  -2.781
   69    HA   ASP  10           HA       ASP  10   0.911  14.295  -5.141
   70    HB2  ASP  10          1HB       ASP  10   2.948  12.334  -4.047
   71    HB3  ASP  10          2HB       ASP  10   2.259  12.301  -5.667
   72    H    LEU  11           H        LEU  11   1.044  12.388  -2.191
   73    HA   LEU  11           HA       LEU  11  -0.628  10.309  -3.030
   74    HB2  LEU  11          1HB       LEU  11   0.767  10.084  -1.083
   75    HB3  LEU  11          2HB       LEU  11  -0.109  11.377  -0.254
   76    HG   LEU  11           HG       LEU  11  -2.129   9.932  -0.286
   77   HD11  LEU  11          1HD1      LEU  11  -1.873   7.565  -0.826
   78   HD12  LEU  11          2HD1      LEU  11  -0.221   7.870  -1.367
   79   HD13  LEU  11          3HD1      LEU  11  -1.583   8.587  -2.229
   80   HD21  LEU  11          1HD2      LEU  11  -1.423   8.495   1.500
   81   HD22  LEU  11          2HD2      LEU  11  -0.542  10.017   1.633
   82   HD23  LEU  11          3HD2      LEU  11   0.257   8.589   0.972
   83    H    GLN  12           H        GLN  12  -1.301  13.475  -1.707
   84    HA   GLN  12           HA       GLN  12  -4.044  13.064  -1.143
   85    HB2  GLN  12          1HB       GLN  12  -2.458  15.567  -1.668
   86    HB3  GLN  12          2HB       GLN  12  -4.159  15.587  -1.232
   87    HG2  GLN  12          1HG       GLN  12  -3.631  14.484   0.882
   88    HG3  GLN  12          2HG       GLN  12  -1.925  14.465   0.442
   89   HE21  GLN  12          1HE2      GLN  12  -3.281  15.713   2.703
   90   HE22  GLN  12          2HE2      GLN  12  -2.880  17.394   2.626
   91    H    ARG  13           H        ARG  13  -2.336  13.538  -4.046
   92    HA   ARG  13           HA       ARG  13  -4.494  14.583  -5.607
   93    HB2  ARG  13          1HB       ARG  13  -2.150  14.912  -6.243
   94    HB3  ARG  13          2HB       ARG  13  -1.948  13.177  -6.434
   95    HG2  ARG  13          1HG       ARG  13  -3.610  13.205  -8.248
   96    HG3  ARG  13          2HG       ARG  13  -3.723  14.966  -8.078
   97    HD2  ARG  13          1HD       ARG  13  -1.279  13.373  -8.843
   98    HD3  ARG  13          2HD       ARG  13  -2.237  14.406  -9.902
   99    HE   ARG  13           HE       ARG  13  -1.421  16.040  -7.856
  100   HH11  ARG  13          1HH1      ARG  13   0.181  14.026 -10.230
  101   HH12  ARG  13          2HH1      ARG  13   1.586  15.037 -10.320
  102   HH21  ARG  13          1HH2      ARG  13   0.434  17.359  -7.963
  103   HH22  ARG  13          2HH2      ARG  13   1.731  16.928  -9.033
  104    H    TYR  14           H        TYR  14  -3.121  11.386  -5.007
  105    HA   TYR  14           HA       TYR  14  -4.803  10.086  -6.928
  106    HB2  TYR  14          1HB       TYR  14  -3.182   8.804  -4.724
  107    HB3  TYR  14          2HB       TYR  14  -3.795   8.033  -6.183
  108    HD1  TYR  14           HD1      TYR  14  -3.140   9.665  -8.358
  109    HD2  TYR  14           HD2      TYR  14  -0.858   9.028  -4.828
  110    HE1  TYR  14           HE1      TYR  14  -1.096  10.269  -9.574
  111    HE2  TYR  14           HE2      TYR  14   1.192   9.641  -6.034
  112    HH   TYR  14           HH       TYR  14   1.143  11.098  -9.118
  113    H    ARG  15           H        ARG  15  -5.065  10.895  -3.588
  114    HA   ARG  15           HA       ARG  15  -7.067   9.232  -2.644
  115    HB2  ARG  15          1HB       ARG  15  -7.153  12.243  -2.310
  116    HB3  ARG  15          2HB       ARG  15  -7.844  11.027  -1.258
  117    HG2  ARG  15          1HG       ARG  15  -4.907  10.962  -1.647
  118    HG3  ARG  15          2HG       ARG  15  -5.604  12.248  -0.655
  119    HD2  ARG  15          1HD       ARG  15  -6.078   9.290  -0.258
  120    HD3  ARG  15          2HD       ARG  15  -4.979  10.290   0.700
  121    HE   ARG  15           HE       ARG  15  -7.548  11.442   0.704
  122   HH11  ARG  15          1HH1      ARG  15  -5.836   8.689   2.023
  123   HH12  ARG  15          2HH1      ARG  15  -6.858   8.573   3.414
  124   HH21  ARG  15          1HH2      ARG  15  -8.883  11.302   2.513
  125   HH22  ARG  15          2HH2      ARG  15  -8.615  10.061   3.693
  126    H    THR  16           H        THR  16  -7.670  12.357  -4.176
  127    HA   THR  16           HA       THR  16 -10.389  12.123  -4.507
  128    HB   THR  16           HB       THR  16  -8.312  13.643  -6.062
  129    HG1  THR  16           HG1      THR  16 -10.228  14.389  -4.091
  130   HG21  THR  16          1HG2      THR  16 -10.233  13.310  -7.531
  131   HG22  THR  16          2HG2      THR  16 -10.129  14.992  -7.003
  132   HG23  THR  16          3HG2      THR  16 -11.312  13.909  -6.269
  133    H    GLU  17           H        GLU  17  -7.842  11.314  -6.851
  134    HA   GLU  17           HA       GLU  17  -9.423  10.695  -9.003
  135    HB2  GLU  17          1HB       GLU  17  -7.276  10.687  -9.671
  136    HB3  GLU  17          2HB       GLU  17  -6.684  10.078  -8.144
  137    HG2  GLU  17          1HG       GLU  17  -6.115   8.455  -9.726
  138    HG3  GLU  17          2HG       GLU  17  -7.544   7.807  -8.919
  139    H    CYS  18           H        CYS  18  -8.207   8.443  -6.531
  140    HA   CYS  18           HA       CYS  18  -9.638   6.219  -7.576
  141    HB2  CYS  18          1HB       CYS  18  -8.267   6.630  -4.915
  142    HB3  CYS  18          2HB       CYS  18  -8.911   5.086  -5.498
  143    H    VAL  19           H        VAL  19 -10.311   8.626  -5.133
  144    HA   VAL  19           HA       VAL  19 -12.490   7.300  -3.937
  145    HB   VAL  19           HB       VAL  19 -11.552  10.139  -3.954
  146   HG11  VAL  19          1HG1      VAL  19 -13.982  10.304  -4.108
  147   HG12  VAL  19          2HG1      VAL  19 -13.408  10.786  -2.509
  148   HG13  VAL  19          3HG1      VAL  19 -14.148   9.200  -2.739
  149   HG21  VAL  19          1HG2      VAL  19 -12.024   8.069  -1.812
  150   HG22  VAL  19          2HG2      VAL  19 -11.449   9.714  -1.520
  151   HG23  VAL  19          3HG2      VAL  19 -10.464   8.589  -2.458
  152    H    SER  20           H        SER  20 -12.344   9.868  -6.360
  153    HA   SER  20           HA       SER  20 -15.114  10.033  -6.805
  154    HB2  SER  20          1HB       SER  20 -13.391  11.750  -7.407
  155    HB3  SER  20          2HB       SER  20 -12.891  10.717  -8.743
  156    HG   SER  20           HG       SER  20 -14.936  12.453  -8.615
  157    H    SER  21           H        SER  21 -12.602   8.049  -8.338
  158    HA   SER  21           HA       SER  21 -14.306   7.181 -10.471
  159    HB2  SER  21          1HB       SER  21 -11.644   6.143  -9.485
  160    HB3  SER  21          2HB       SER  21 -12.441   5.613 -10.969
  161    HG   SER  21           HG       SER  21 -10.817   7.642 -10.710
  162    H    LEU  22           H        LEU  22 -13.177   5.701  -7.421
  163    HA   LEU  22           HA       LEU  22 -14.650   3.279  -8.002
  164    HB2  LEU  22          1HB       LEU  22 -13.005   4.136  -5.628
  165    HB3  LEU  22          2HB       LEU  22 -13.815   2.572  -5.740
  166    HG   LEU  22           HG       LEU  22 -11.749   3.534  -7.715
  167   HD11  LEU  22          1HD1      LEU  22 -10.220   1.990  -6.568
  168   HD12  LEU  22          2HD1      LEU  22 -11.453   1.701  -5.340
  169   HD13  LEU  22          3HD1      LEU  22 -10.743   3.303  -5.512
  170   HD21  LEU  22          1HD2      LEU  22 -12.915   0.806  -7.188
  171   HD22  LEU  22          2HD2      LEU  22 -11.697   1.210  -8.400
  172   HD23  LEU  22          3HD2      LEU  22 -13.332   1.855  -8.543
  173    H    ASN  23           H        ASN  23 -15.741   6.134  -7.179
  174    HA   ASN  23           HA       ASN  23 -17.567   6.989  -6.121
  175    HB2  ASN  23          1HB       ASN  23 -18.502   4.121  -6.188
  176    HB3  ASN  23          2HB       ASN  23 -19.513   5.524  -5.917
  177   HD21  ASN  23          1HD2      ASN  23 -19.647   3.493  -7.995
  178   HD22  ASN  23          2HD2      ASN  23 -19.546   4.350  -9.497
  179    H    ILE  24           H        ILE  24 -15.367   6.213  -4.451
  180    HA   ILE  24           HA       ILE  24 -16.146   4.869  -2.118
  181    HB   ILE  24           HB       ILE  24 -14.103   7.084  -2.318
  182   HG12  ILE  24          1HG1      ILE  24 -13.711   5.345  -4.045
  183   HG13  ILE  24          2HG1      ILE  24 -12.447   5.365  -2.820
  184   HG21  ILE  24          1HG2      ILE  24 -14.323   4.746  -0.425
  185   HG22  ILE  24          2HG2      ILE  24 -14.696   6.426  -0.041
  186   HG23  ILE  24          3HG2      ILE  24 -13.043   5.959  -0.435
  187   HD11  ILE  24          1HD1      ILE  24 -13.073   3.098  -3.461
  188   HD12  ILE  24          2HD1      ILE  24 -14.733   3.409  -2.951
  189   HD13  ILE  24          3HD1      ILE  24 -13.430   3.407  -1.760
  190    HA   PRO  25           HA       PRO  25 -19.001   7.905  -0.450
  191    HB2  PRO  25          1HB       PRO  25 -18.588   6.366   2.025
  192    HB3  PRO  25          2HB       PRO  25 -20.080   6.717   1.152
  193    HG2  PRO  25          1HG       PRO  25 -18.974   4.273   1.165
  194    HG3  PRO  25          2HG       PRO  25 -19.857   4.912  -0.232
  195    HD2  PRO  25          1HD       PRO  25 -16.911   4.621   0.185
  196    HD3  PRO  25          2HD       PRO  25 -17.872   4.439  -1.305
  197    H    ALA  26           H        ALA  26 -18.739   9.729   0.641
  198    HA   ALA  26           HA       ALA  26 -16.214  10.750   1.187
  199    HB1  ALA  26          1HB       ALA  26 -17.364  12.642   2.175
  200    HB2  ALA  26          2HB       ALA  26 -18.845  11.692   2.307
  201    HB3  ALA  26          3HB       ALA  26 -18.204  12.106   0.717
  202    H    ASP  27           H        ASP  27 -18.514   9.187   3.341
  203    HA   ASP  27           HA       ASP  27 -17.377   9.727   5.812
  204    HB2  ASP  27          1HB       ASP  27 -19.488   8.552   5.585
  205    HB3  ASP  27          2HB       ASP  27 -18.673   7.164   4.869
  206    H    TYR  28           H        TYR  28 -16.673   6.953   3.674
  207    HA   TYR  28           HA       TYR  28 -14.587   5.872   5.141
  208    HB2  TYR  28          1HB       TYR  28 -15.288   5.822   2.225
  209    HB3  TYR  28          2HB       TYR  28 -13.813   5.045   2.794
  210    HD1  TYR  28           HD1      TYR  28 -13.908   2.956   3.976
  211    HD2  TYR  28           HD2      TYR  28 -17.492   5.017   2.975
  212    HE1  TYR  28           HE1      TYR  28 -15.213   0.950   4.541
  213    HE2  TYR  28           HE2      TYR  28 -18.805   3.017   3.533
  214    HH   TYR  28           HH       TYR  28 -17.511   0.379   5.219
  215    H    VAL  29           H        VAL  29 -14.587   8.461   2.748
  216    HA   VAL  29           HA       VAL  29 -11.847   8.714   2.316
  217    HB   VAL  29           HB       VAL  29 -13.927  10.893   2.307
  218   HG11  VAL  29          1HG1      VAL  29 -11.707  11.838   2.380
  219   HG12  VAL  29          2HG1      VAL  29 -12.368  12.022   0.754
  220   HG13  VAL  29          3HG1      VAL  29 -11.177  10.761   1.088
  221   HG21  VAL  29          1HG2      VAL  29 -13.981  10.459  -0.122
  222   HG22  VAL  29          2HG2      VAL  29 -14.537   9.087   0.839
  223   HG23  VAL  29          3HG2      VAL  29 -12.921   9.073   0.136
  224    H    GLU  30           H        GLU  30 -13.907  10.363   4.723
  225    HA   GLU  30           HA       GLU  30 -11.855  11.879   5.932
  226    HB2  GLU  30          1HB       GLU  30 -14.161  10.818   7.525
  227    HB3  GLU  30          2HB       GLU  30 -13.371  12.387   7.606
  228    HG2  GLU  30          1HG       GLU  30 -14.357  12.981   5.458
  229    HG3  GLU  30          2HG       GLU  30 -15.186  11.427   5.421
  230    H    LYS  31           H        LYS  31 -13.030   8.628   6.426
  231    HA   LYS  31           HA       LYS  31 -11.622   8.170   8.842
  232    HB2  LYS  31          1HB       LYS  31 -13.028   6.461   8.944
  233    HB3  LYS  31          2HB       LYS  31 -13.635   6.927   7.361
  234    HG2  LYS  31          1HG       LYS  31 -12.188   5.389   6.271
  235    HG3  LYS  31          2HG       LYS  31 -11.330   5.054   7.769
  236    HD2  LYS  31          1HD       LYS  31 -14.278   4.546   7.469
  237    HD3  LYS  31          2HD       LYS  31 -13.069   3.342   6.991
  238    HE2  LYS  31          1HE       LYS  31 -13.871   2.861   9.237
  239    HE3  LYS  31          2HE       LYS  31 -12.186   3.359   9.310
  240    HZ1  LYS  31          1HZ       LYS  31 -14.397   5.264   9.789
  241    HZ2  LYS  31          2HZ       LYS  31 -12.764   5.414  10.233
  242    HZ3  LYS  31          3HZ       LYS  31 -13.764   4.301  11.023
  243    H    PHE  32           H        PHE  32 -10.899   7.454   5.424
  244    HA   PHE  32           HA       PHE  32  -8.507   6.027   5.913
  245    HB2  PHE  32          1HB       PHE  32  -9.208   7.720   3.508
  246    HB3  PHE  32          2HB       PHE  32  -7.915   6.531   3.589
  247    HD1  PHE  32           HD1      PHE  32  -9.453   4.390   5.091
  248    HD2  PHE  32           HD2      PHE  32 -10.447   6.808   1.733
  249    HE1  PHE  32           HE1      PHE  32 -10.981   2.643   4.287
  250    HE2  PHE  32           HE2      PHE  32 -11.980   5.061   0.930
  251    HZ   PHE  32           HZ       PHE  32 -12.249   2.977   2.206
  252    H    LYS  33           H        LYS  33  -9.301   9.400   5.736
  253    HA   LYS  33           HA       LYS  33  -6.749  10.544   5.531
  254    HB2  LYS  33          1HB       LYS  33  -9.175  11.567   5.494
  255    HB3  LYS  33          2HB       LYS  33  -8.905  11.752   7.221
  256    HG2  LYS  33          1HG       LYS  33  -7.003  13.154   6.850
  257    HG3  LYS  33          2HG       LYS  33  -7.086  12.866   5.102
  258    HD2  LYS  33          1HD       LYS  33  -9.302  13.925   5.046
  259    HD3  LYS  33          2HD       LYS  33  -9.201  14.224   6.781
  260    HE2  LYS  33          1HE       LYS  33  -7.279  15.666   6.442
  261    HE3  LYS  33          2HE       LYS  33  -7.302  15.326   4.713
  262    HZ1  LYS  33          1HZ       LYS  33  -8.344  17.445   5.223
  263    HZ2  LYS  33          2HZ       LYS  33  -9.463  16.682   6.232
  264    HZ3  LYS  33          3HZ       LYS  33  -9.475  16.369   4.572
  265    H    LYS  34           H        LYS  34  -8.549   9.257   8.247
  266    HA   LYS  34           HA       LYS  34  -6.522  10.053  10.165
  267    HB2  LYS  34          1HB       LYS  34  -9.096   8.497  10.473
  268    HB3  LYS  34          2HB       LYS  34  -8.032   8.901  11.813
  269    HG2  LYS  34          1HG       LYS  34  -8.385  11.290  11.333
  270    HG3  LYS  34          2HG       LYS  34  -9.486  10.848  10.029
  271    HD2  LYS  34          1HD       LYS  34  -9.850  10.130  12.937
  272    HD3  LYS  34          2HD       LYS  34 -10.671  11.449  12.105
  273    HE2  LYS  34          1HE       LYS  34 -11.727   9.852  10.595
  274    HE3  LYS  34          2HE       LYS  34 -10.881   8.526  11.389
  275    HZ1  LYS  34          1HZ       LYS  34 -13.124   8.694  12.213
  276    HZ2  LYS  34          2HZ       LYS  34 -12.898  10.312  12.639
  277    HZ3  LYS  34          3HZ       LYS  34 -12.045   9.097  13.449
  278    H    TRP  35           H        TRP  35  -6.025   8.083   7.969
  279    HA   TRP  35           HA       TRP  35  -5.137   6.051   7.533
  280    HB2  TRP  35          1HB       TRP  35  -3.984   6.610  10.261
  281    HB3  TRP  35          2HB       TRP  35  -3.440   5.280   9.230
  282    HD1  TRP  35           HD1      TRP  35  -3.479   9.120   9.395
  283    HE1  TRP  35           HE1      TRP  35  -1.622  10.032   7.860
  284    HE3  TRP  35           HE3      TRP  35  -1.990   4.736   7.211
  285    HZ2  TRP  35           HZ2      TRP  35   0.220   9.031   5.988
  286    HZ3  TRP  35           HZ3      TRP  35  -0.177   4.806   5.559
  287    HH2  TRP  35           HH2      TRP  35   0.912   6.903   4.957
  288    H    GLU  36           H        GLU  36  -7.757   5.830   8.430
  289    HA   GLU  36           HA       GLU  36  -7.722   3.358  10.007
  290    HB2  GLU  36          1HB       GLU  36 -10.084   5.056   9.200
  291    HB3  GLU  36          2HB       GLU  36 -10.126   3.659  10.264
  292    HG2  GLU  36          1HG       GLU  36  -8.720   4.876  11.861
  293    HG3  GLU  36          2HG       GLU  36  -8.756   6.272  10.792
  294    H    PHE  37           H        PHE  37  -7.499   1.624   8.758
  295    HA   PHE  37           HA       PHE  37  -8.994   1.574   6.223
  296    HB2  PHE  37          1HB       PHE  37  -6.422   0.084   6.807
  297    HB3  PHE  37          2HB       PHE  37  -7.258   0.167   5.260
  298    HD1  PHE  37           HD1      PHE  37  -7.172   2.215   3.908
  299    HD2  PHE  37           HD2      PHE  37  -5.065   1.895   7.596
  300    HE1  PHE  37           HE1      PHE  37  -5.842   4.196   3.320
  301    HE2  PHE  37           HE2      PHE  37  -3.734   3.874   7.009
  302    HZ   PHE  37           HZ       PHE  37  -4.120   5.028   4.872
  303    HA   PRO  38           HA       PRO  38 -10.879  -1.768   8.801
  304    HB2  PRO  38          1HB       PRO  38 -13.104  -1.088   6.973
  305    HB3  PRO  38          2HB       PRO  38 -13.103  -1.294   8.735
  306    HG2  PRO  38          1HG       PRO  38 -13.315   1.129   7.669
  307    HG3  PRO  38          2HG       PRO  38 -12.326   0.854   9.115
  308    HD2  PRO  38          1HD       PRO  38 -11.433   1.149   6.257
  309    HD3  PRO  38          2HD       PRO  38 -10.737   1.871   7.742
  310    H    GLU  39           H        GLU  39 -11.494  -3.813   8.186
  311    HA   GLU  39           HA       GLU  39 -10.402  -4.703   5.693
  312    HB2  GLU  39          1HB       GLU  39 -10.128  -5.932   7.822
  313    HB3  GLU  39          2HB       GLU  39 -11.854  -6.260   7.831
  314    HG2  GLU  39          1HG       GLU  39 -11.695  -7.684   5.971
  315    HG3  GLU  39          2HG       GLU  39 -10.068  -7.118   5.579
  316    H    ASP  40           H        ASP  40 -11.757  -3.633   4.256
  317    HA   ASP  40           HA       ASP  40 -14.267  -5.012   3.693
  318    HB2  ASP  40          1HB       ASP  40 -14.915  -3.037   5.083
  319    HB3  ASP  40          2HB       ASP  40 -14.133  -1.983   3.905
  320    H    ASP  41           H        ASP  41 -14.828  -4.957   1.558
  321    HA   ASP  41           HA       ASP  41 -12.705  -4.998  -0.245
  322    HB2  ASP  41          1HB       ASP  41 -15.621  -4.751  -0.997
  323    HB3  ASP  41          2HB       ASP  41 -14.324  -5.459  -1.956
  324    H    THR  42           H        THR  42 -14.961  -2.436   0.540
  325    HA   THR  42           HA       THR  42 -14.518  -0.711  -1.631
  326    HB   THR  42           HB       THR  42 -14.967   0.144   1.227
  327    HG1  THR  42           HG1      THR  42 -16.605  -1.243   0.963
  328   HG21  THR  42          1HG2      THR  42 -16.238   1.973   0.146
  329   HG22  THR  42          2HG2      THR  42 -15.740   1.348  -1.428
  330   HG23  THR  42          3HG2      THR  42 -14.532   1.968  -0.303
  331    H    THR  43           H        THR  43 -13.038  -0.656   1.601
  332    HA   THR  43           HA       THR  43 -11.018   1.187   1.162
  333    HB   THR  43           HB       THR  43 -10.843  -1.263   2.924
  334    HG1  THR  43           HG1      THR  43 -11.618   0.524   4.479
  335   HG21  THR  43          1HG2      THR  43  -9.528   1.452   3.118
  336   HG22  THR  43          2HG2      THR  43  -8.727  -0.069   2.723
  337   HG23  THR  43          3HG2      THR  43  -9.412   0.177   4.330
  338    H    MET  44           H        MET  44 -11.160  -2.241   0.431
  339    HA   MET  44           HA       MET  44  -8.399  -2.612  -0.019
  340    HB2  MET  44          1HB       MET  44 -10.744  -4.204  -1.040
  341    HB3  MET  44          2HB       MET  44  -9.071  -4.734  -1.085
  342    HG2  MET  44          1HG       MET  44  -8.982  -4.697   1.345
  343    HG3  MET  44          2HG       MET  44 -10.640  -4.111   1.407
  344    HE1  MET  44          1HE       MET  44 -10.945  -7.752   2.775
  345    HE2  MET  44          2HE       MET  44 -11.228  -6.038   3.091
  346    HE3  MET  44          3HE       MET  44  -9.578  -6.660   3.010
  347    H    CYS  45           H        CYS  45 -11.116  -2.089  -2.273
  348    HA   CYS  45           HA       CYS  45  -9.483  -2.079  -4.587
  349    HB2  CYS  45          1HB       CYS  45 -12.230  -0.899  -4.121
  350    HB3  CYS  45          2HB       CYS  45 -11.434  -0.943  -5.687
  351    H    TYR  46           H        TYR  46 -10.426   0.398  -2.299
  352    HA   TYR  46           HA       TYR  46  -9.538   2.640  -3.704
  353    HB2  TYR  46          1HB       TYR  46 -10.804   3.061  -1.774
  354    HB3  TYR  46          2HB       TYR  46  -9.802   2.009  -0.771
  355    HD1  TYR  46           HD1      TYR  46  -9.645   5.186  -2.734
  356    HD2  TYR  46           HD2      TYR  46  -8.167   2.957   0.579
  357    HE1  TYR  46           HE1      TYR  46  -8.353   7.144  -1.997
  358    HE2  TYR  46           HE2      TYR  46  -6.869   4.907   1.320
  359    HH   TYR  46           HH       TYR  46  -5.989   6.946   0.540
  360    H    ILE  47           H        ILE  47  -7.836   0.568  -1.370
  361    HA   ILE  47           HA       ILE  47  -5.330   1.785  -1.524
  362    HB   ILE  47           HB       ILE  47  -6.063  -1.073  -0.915
  363   HG12  ILE  47          1HG1      ILE  47  -6.948   0.540   0.684
  364   HG13  ILE  47          2HG1      ILE  47  -5.656  -0.391   1.432
  365   HG21  ILE  47          1HG2      ILE  47  -3.395   0.295  -0.592
  366   HG22  ILE  47          2HG2      ILE  47  -3.769  -1.050  -1.669
  367   HG23  ILE  47          3HG2      ILE  47  -3.807  -1.284   0.080
  368   HD11  ILE  47          1HD1      ILE  47  -4.121   1.525   0.961
  369   HD12  ILE  47          2HD1      ILE  47  -5.421   1.874   2.100
  370   HD13  ILE  47          3HD1      ILE  47  -5.534   2.444   0.435
  371    H    LYS  48           H        LYS  48  -6.792  -0.760  -3.467
  372    HA   LYS  48           HA       LYS  48  -4.542  -1.538  -4.929
  373    HB2  LYS  48          1HB       LYS  48  -6.668  -2.794  -4.851
  374    HB3  LYS  48          2HB       LYS  48  -7.443  -1.526  -5.778
  375    HG2  LYS  48          1HG       LYS  48  -5.044  -2.783  -6.970
  376    HG3  LYS  48          2HG       LYS  48  -6.514  -3.757  -6.889
  377    HD2  LYS  48          1HD       LYS  48  -7.734  -1.883  -7.997
  378    HD3  LYS  48          2HD       LYS  48  -6.188  -1.061  -8.200
  379    HE2  LYS  48          1HE       LYS  48  -5.363  -2.835  -9.594
  380    HE3  LYS  48          2HE       LYS  48  -6.797  -3.811  -9.273
  381    HZ1  LYS  48          1HZ       LYS  48  -6.920  -2.733 -11.432
  382    HZ2  LYS  48          2HZ       LYS  48  -6.763  -1.212 -10.713
  383    HZ3  LYS  48          3HZ       LYS  48  -8.137  -2.151 -10.411
  384    H    CYS  49           H        CYS  49  -7.118   0.757  -5.786
  385    HA   CYS  49           HA       CYS  49  -6.031   1.627  -8.191
  386    HB2  CYS  49          1HB       CYS  49  -8.267   2.183  -7.742
  387    HB3  CYS  49          2HB       CYS  49  -7.867   2.983  -6.223
  388    H    VAL  50           H        VAL  50  -5.605   3.000  -4.923
  389    HA   VAL  50           HA       VAL  50  -4.078   5.204  -5.687
  390    HB   VAL  50           HB       VAL  50  -4.291   3.732  -3.072
  391   HG11  VAL  50          1HG1      VAL  50  -2.095   4.801  -3.147
  392   HG12  VAL  50          2HG1      VAL  50  -3.170   5.639  -2.024
  393   HG13  VAL  50          3HG1      VAL  50  -2.851   6.325  -3.616
  394   HG21  VAL  50          1HG2      VAL  50  -5.326   6.393  -4.010
  395   HG22  VAL  50          2HG2      VAL  50  -5.588   5.683  -2.416
  396   HG23  VAL  50          3HG2      VAL  50  -6.271   4.913  -3.848
  397    H    PHE  51           H        PHE  51  -3.085   2.007  -4.520
  398    HA   PHE  51           HA       PHE  51  -0.324   2.473  -4.564
  399    HB2  PHE  51          1HB       PHE  51  -2.086   0.080  -4.454
  400    HB3  PHE  51          2HB       PHE  51  -0.399  -0.182  -4.887
  401    HD1  PHE  51           HD1      PHE  51   0.176  -1.423  -2.939
  402    HD2  PHE  51           HD2      PHE  51  -1.545   2.452  -2.589
  403    HE1  PHE  51           HE1      PHE  51   0.750  -1.387  -0.548
  404    HE2  PHE  51           HE2      PHE  51  -0.972   2.496  -0.199
  405    HZ   PHE  51           HZ       PHE  51   0.178   0.575   0.825
  406    H    ASN  52           H        ASN  52  -2.605   1.598  -7.015
  407    HA   ASN  52           HA       ASN  52  -0.721   0.810  -9.014
  408    HB2  ASN  52          1HB       ASN  52  -2.963   0.002  -9.230
  409    HB3  ASN  52          2HB       ASN  52  -3.631   1.634  -9.120
  410   HD21  ASN  52          1HD2      ASN  52  -1.864  -0.601 -11.136
  411   HD22  ASN  52          2HD2      ASN  52  -2.181   0.199 -12.634
  412    H    LYS  53           H        LYS  53  -2.421   3.778  -8.195
  413    HA   LYS  53           HA       LYS  53  -1.550   5.224 -10.482
  414    HB2  LYS  53          1HB       LYS  53  -2.868   5.977  -7.895
  415    HB3  LYS  53          2HB       LYS  53  -2.362   7.215  -9.033
  416    HG2  LYS  53          1HG       LYS  53  -4.103   4.970  -9.958
  417    HG3  LYS  53          2HG       LYS  53  -4.804   6.299  -9.040
  418    HD2  LYS  53          1HD       LYS  53  -5.084   6.874 -11.302
  419    HD3  LYS  53          2HD       LYS  53  -3.739   7.855 -10.730
  420    HE2  LYS  53          1HE       LYS  53  -3.308   6.938 -12.953
  421    HE3  LYS  53          2HE       LYS  53  -2.159   6.317 -11.778
  422    HZ1  LYS  53          1HZ       LYS  53  -4.566   4.874 -12.756
  423    HZ2  LYS  53          2HZ       LYS  53  -3.420   4.263 -11.676
  424    HZ3  LYS  53          3HZ       LYS  53  -2.982   4.592 -13.273
  425    H    MET  54           H        MET  54  -0.215   4.571  -7.385
  426    HA   MET  54           HA       MET  54   1.726   6.720  -7.533
  427    HB2  MET  54          1HB       MET  54   1.215   4.530  -5.527
  428    HB3  MET  54          2HB       MET  54   2.575   5.646  -5.398
  429    HG2  MET  54          1HG       MET  54   1.144   7.494  -5.135
  430    HG3  MET  54          2HG       MET  54  -0.270   6.562  -5.611
  431    HE1  MET  54          1HE       MET  54   2.165   7.604  -2.914
  432    HE2  MET  54          2HE       MET  54   2.685   5.918  -2.908
  433    HE3  MET  54          3HE       MET  54   1.803   6.579  -1.529
  434    H    GLN  55           H        GLN  55   1.465   3.997  -9.172
  435    HA   GLN  55           HA       GLN  55   2.818   2.546 -10.232
  436    HB2  GLN  55          1HB       GLN  55   4.532   4.924  -9.822
  437    HB3  GLN  55          2HB       GLN  55   5.340   3.442 -10.329
  438    HG2  GLN  55          1HG       GLN  55   4.808   4.815 -12.239
  439    HG3  GLN  55          2HG       GLN  55   3.857   3.336 -12.283
  440   HE21  GLN  55          1HE2      GLN  55   1.649   3.441 -12.043
  441   HE22  GLN  55          2HE2      GLN  55   0.770   4.928 -12.103
  442    H    LEU  56           H        LEU  56   2.356   1.866  -7.621
  443    HA   LEU  56           HA       LEU  56   4.959   0.912  -6.695
  444    HB2  LEU  56          1HB       LEU  56   2.787   2.302  -5.307
  445    HB3  LEU  56          2HB       LEU  56   3.395   0.890  -4.429
  446    HG   LEU  56           HG       LEU  56   5.035   3.234  -5.404
  447   HD11  LEU  56          1HD1      LEU  56   5.244   3.783  -3.015
  448   HD12  LEU  56          2HD1      LEU  56   4.101   2.498  -2.634
  449   HD13  LEU  56          3HD1      LEU  56   3.578   3.888  -3.581
  450   HD21  LEU  56          1HD2      LEU  56   5.765   0.805  -3.784
  451   HD22  LEU  56          2HD2      LEU  56   6.784   2.235  -3.941
  452   HD23  LEU  56          3HD2      LEU  56   6.402   1.267  -5.363
  453    H    PHE  57           H        PHE  57   1.823   0.081  -7.684
  454    HA   PHE  57           HA       PHE  57   2.361  -2.735  -7.100
  455    HB2  PHE  57          1HB       PHE  57   0.849  -2.101  -5.313
  456    HB3  PHE  57          2HB       PHE  57  -0.225  -1.295  -6.447
  457    HD1  PHE  57           HD1      PHE  57  -1.920  -2.479  -7.576
  458    HD2  PHE  57           HD2      PHE  57   1.046  -4.598  -5.374
  459    HE1  PHE  57           HE1      PHE  57  -3.226  -4.547  -7.813
  460    HE2  PHE  57           HE2      PHE  57  -0.260  -6.668  -5.608
  461    HZ   PHE  57           HZ       PHE  57  -2.395  -6.642  -6.828
  462    H    ASP  58           H        ASP  58   1.810  -4.070  -8.708
  463    HA   ASP  58           HA       ASP  58   0.271  -2.975 -10.970
  464    HB2  ASP  58          1HB       ASP  58   2.632  -3.199 -11.589
  465    HB3  ASP  58          2HB       ASP  58   2.639  -4.869 -11.043
  466    H    ASP  59           H        ASP  59  -1.224  -4.412 -11.930
  467    HA   ASP  59           HA       ASP  59  -2.289  -6.269 -10.000
  468    HB2  ASP  59          1HB       ASP  59  -4.208  -6.415 -11.438
  469    HB3  ASP  59          2HB       ASP  59  -3.720  -4.735 -11.354
  470    H    THR  60           H        THR  60  -0.154  -6.503 -12.594
  471    HA   THR  60           HA       THR  60  -0.716  -9.335 -13.020
  472    HB   THR  60           HB       THR  60   1.027  -7.347 -14.450
  473    HG1  THR  60           HG1      THR  60  -1.418  -8.605 -14.888
  474   HG21  THR  60          1HG2      THR  60   2.265  -9.445 -14.357
  475   HG22  THR  60          2HG2      THR  60   1.679  -9.135 -15.992
  476   HG23  THR  60          3HG2      THR  60   0.858 -10.316 -14.971
  477    H    GLU  61           H        GLU  61   2.200  -7.321 -12.497
  478    HA   GLU  61           HA       GLU  61   3.782  -9.534 -11.639
  479    HB2  GLU  61          1HB       GLU  61   4.428  -6.662 -11.066
  480    HB3  GLU  61          2HB       GLU  61   5.520  -8.002 -11.371
  481    HG2  GLU  61          1HG       GLU  61   4.797  -8.072 -13.695
  482    HG3  GLU  61          2HG       GLU  61   3.719  -6.714 -13.396
  483    H    GLY  62           H        GLY  62   1.707  -7.292 -10.016
  484    HA2  GLY  62          1HA       GLY  62   0.975  -7.484  -7.786
  485    HA3  GLY  62          2HA       GLY  62   2.382  -8.499  -7.442
  486    HA   PRO  63           HA       PRO  63   3.347  -4.455  -5.424
  487    HB2  PRO  63          1HB       PRO  63   5.101  -6.346  -3.957
  488    HB3  PRO  63          2HB       PRO  63   4.019  -5.094  -3.333
  489    HG2  PRO  63          1HG       PRO  63   3.407  -7.699  -3.147
  490    HG3  PRO  63          2HG       PRO  63   2.167  -6.461  -3.413
  491    HD2  PRO  63          1HD       PRO  63   3.374  -8.394  -5.350
  492    HD3  PRO  63          2HD       PRO  63   1.707  -7.772  -5.260
  493    H    LEU  64           H        LEU  64   4.810  -3.230  -6.404
  494    HA   LEU  64           HA       LEU  64   6.998  -4.440  -7.867
  495    HB2  LEU  64          1HB       LEU  64   6.387  -1.500  -7.530
  496    HB3  LEU  64          2HB       LEU  64   7.422  -2.240  -8.736
  497    HG   LEU  64           HG       LEU  64   4.445  -2.684  -8.568
  498   HD11  LEU  64          1HD1      LEU  64   6.046  -0.953 -10.447
  499   HD12  LEU  64          2HD1      LEU  64   4.945  -0.381  -9.193
  500   HD13  LEU  64          3HD1      LEU  64   4.320  -1.288 -10.570
  501   HD21  LEU  64          1HD2      LEU  64   5.727  -4.543  -9.525
  502   HD22  LEU  64          2HD2      LEU  64   6.445  -3.432 -10.691
  503   HD23  LEU  64          3HD2      LEU  64   4.709  -3.744 -10.724
  504    H    VAL  65           H        VAL  65   8.223  -5.291  -6.258
  505    HA   VAL  65           HA       VAL  65   8.943  -4.254  -3.843
  506    HB   VAL  65           HB       VAL  65  10.564  -6.044  -5.631
  507   HG11  VAL  65          1HG1      VAL  65  11.998  -5.029  -3.944
  508   HG12  VAL  65          2HG1      VAL  65  11.741  -6.740  -3.597
  509   HG13  VAL  65          3HG1      VAL  65  10.869  -5.514  -2.676
  510   HG21  VAL  65          1HG2      VAL  65   8.426  -6.988  -5.122
  511   HG22  VAL  65          2HG2      VAL  65   8.605  -6.584  -3.416
  512   HG23  VAL  65          3HG2      VAL  65   9.641  -7.811  -4.146
  513    H    ASP  66           H        ASP  66  10.598  -3.756  -6.939
  514    HA   ASP  66           HA       ASP  66  12.877  -2.485  -5.947
  515    HB2  ASP  66          1HB       ASP  66  12.646  -3.317  -8.240
  516    HB3  ASP  66          2HB       ASP  66  11.503  -2.031  -8.594
  517    H    ASN  67           H        ASN  67   9.919  -0.953  -7.279
  518    HA   ASN  67           HA       ASN  67  10.652   1.673  -6.558
  519    HB2  ASN  67          1HB       ASN  67   7.950   0.448  -7.086
  520    HB3  ASN  67          2HB       ASN  67   8.183   2.159  -6.762
  521   HD21  ASN  67          1HD2      ASN  67   7.071   1.050  -9.114
  522   HD22  ASN  67          2HD2      ASN  67   8.112   1.459 -10.434
  523    H    LEU  68           H        LEU  68   9.016  -0.898  -4.883
  524    HA   LEU  68           HA       LEU  68   7.934   0.529  -2.744
  525    HB2  LEU  68          1HB       LEU  68   8.712  -2.314  -3.177
  526    HB3  LEU  68          2HB       LEU  68   8.280  -1.784  -1.562
  527    HG   LEU  68           HG       LEU  68   6.478  -1.335  -3.928
  528   HD11  LEU  68          1HD1      LEU  68   5.253  -3.328  -3.252
  529   HD12  LEU  68          2HD1      LEU  68   6.463  -3.663  -2.012
  530   HD13  LEU  68          3HD1      LEU  68   6.904  -3.735  -3.717
  531   HD21  LEU  68          1HD2      LEU  68   6.066   0.030  -1.956
  532   HD22  LEU  68          2HD2      LEU  68   5.990  -1.421  -0.958
  533   HD23  LEU  68          3HD2      LEU  68   4.769  -1.138  -2.201
  534    H    VAL  69           H        VAL  69  11.098  -1.064  -3.056
  535    HA   VAL  69           HA       VAL  69  12.010  -0.320  -0.470
  536    HB   VAL  69           HB       VAL  69  13.614  -0.995  -2.927
  537   HG11  VAL  69          1HG1      VAL  69  14.369  -0.853  -0.015
  538   HG12  VAL  69          2HG1      VAL  69  14.996   0.146  -1.327
  539   HG13  VAL  69          3HG1      VAL  69  15.375  -1.574  -1.270
  540   HG21  VAL  69          1HG2      VAL  69  12.743  -2.737  -0.631
  541   HG22  VAL  69          2HG2      VAL  69  13.741  -3.229  -2.000
  542   HG23  VAL  69          3HG2      VAL  69  12.058  -2.767  -2.258
  543    H    HIS  70           H        HIS  70  12.336   1.144  -3.682
  544    HA   HIS  70           HA       HIS  70  14.097   3.202  -2.929
  545    HB2  HIS  70          1HB       HIS  70  12.169   2.865  -5.193
  546    HB3  HIS  70          2HB       HIS  70  12.939   4.428  -4.934
  547    HD1  HIS  70           HD1      HIS  70  15.125   4.728  -6.046
  548    HD2  HIS  70           HD2      HIS  70  14.231   0.713  -5.458
  549    HE1  HIS  70           HE1      HIS  70  16.976   3.452  -7.163
  550    HE2  HIS  70           HE2      HIS  70  16.375   1.023  -6.858
  551    H    GLN  71           H        GLN  71  10.660   2.870  -2.533
  552    HA   GLN  71           HA       GLN  71  10.361   5.649  -1.733
  553    HB2  GLN  71          1HB       GLN  71   8.595   4.464  -3.060
  554    HB3  GLN  71          2HB       GLN  71   8.290   3.455  -1.653
  555    HG2  GLN  71          1HG       GLN  71   6.665   5.242  -1.801
  556    HG3  GLN  71          2HG       GLN  71   7.664   5.408  -0.362
  557   HE21  GLN  71          1HE2      GLN  71   6.087   7.415  -1.725
  558   HE22  GLN  71          2HE2      GLN  71   7.184   8.668  -2.167
  559    H    LEU  72           H        LEU  72   9.732   2.478  -0.230
  560    HA   LEU  72           HA       LEU  72   9.126   3.563   2.284
  561    HB2  LEU  72          1HB       LEU  72   9.918   0.774   1.484
  562    HB3  LEU  72          2HB       LEU  72   9.425   1.206   3.108
  563    HG   LEU  72           HG       LEU  72   7.696   1.568   0.661
  564   HD11  LEU  72          1HD1      LEU  72   6.459  -0.381   1.469
  565   HD12  LEU  72          2HD1      LEU  72   7.631  -0.589   2.772
  566   HD13  LEU  72          3HD1      LEU  72   8.132  -0.801   1.095
  567   HD21  LEU  72          1HD2      LEU  72   7.166   1.853   3.612
  568   HD22  LEU  72          2HD2      LEU  72   5.894   1.745   2.395
  569   HD23  LEU  72          3HD2      LEU  72   7.029   3.095   2.364
  570    H    ALA  73           H        ALA  73  12.176   2.347   0.962
  571    HA   ALA  73           HA       ALA  73  13.569   2.590   3.455
  572    HB1  ALA  73          1HB       ALA  73  15.546   2.026   2.219
  573    HB2  ALA  73          2HB       ALA  73  14.724   2.348   0.691
  574    HB3  ALA  73          3HB       ALA  73  14.217   0.988   1.693
  575    H    HIS  74           H        HIS  74  12.185   4.966   2.666
  576    HA   HIS  74           HA       HIS  74  14.009   6.928   1.681
  577    HB2  HIS  74          1HB       HIS  74  11.499   7.123   1.590
  578    HB3  HIS  74          2HB       HIS  74  11.501   7.360   3.335
  579    HD1  HIS  74           HD1      HIS  74  11.589   9.724   4.083
  580    HD2  HIS  74           HD2      HIS  74  12.999   9.271   0.195
  581    HE1  HIS  74           HE1      HIS  74  11.999  12.054   3.232
  582    HE2  HIS  74           HE2      HIS  74  12.677  11.752   0.824
  583    H    GLY  75           H        GLY  75  15.851   6.440   3.025
  584    HA2  GLY  75          1HA       GLY  75  17.190   7.545   4.655
  585    HA3  GLY  75          2HA       GLY  75  15.735   7.878   5.582
  586    H    ARG  76           H        ARG  76  16.342   4.721   4.231
  587    HA   ARG  76           HA       ARG  76  17.318   3.703   6.779
  588    HB2  ARG  76          1HB       ARG  76  14.601   3.256   5.761
  589    HB3  ARG  76          2HB       ARG  76  15.449   1.794   6.240
  590    HG2  ARG  76          1HG       ARG  76  15.943   2.997   8.426
  591    HG3  ARG  76          2HG       ARG  76  14.716   4.165   7.925
  592    HD2  ARG  76          1HD       ARG  76  13.088   2.372   7.732
  593    HD3  ARG  76          2HD       ARG  76  14.305   1.193   8.194
  594    HE   ARG  76           HE       ARG  76  13.894   3.295  10.123
  595   HH11  ARG  76          1HH1      ARG  76  12.898   0.118   9.035
  596   HH12  ARG  76          2HH1      ARG  76  12.236  -0.341  10.570
  597   HH21  ARG  76          1HH2      ARG  76  13.023   2.695  12.151
  598   HH22  ARG  76          2HH2      ARG  76  12.302   1.126  12.344
  599    H    ASP  77           H        ASP  77  17.942   1.452   6.686
  600    HA   ASP  77           HA       ASP  77  19.526   0.766   4.502
  601    HB2  ASP  77          1HB       ASP  77  18.393  -1.025   6.660
  602    HB3  ASP  77          2HB       ASP  77  19.752  -1.419   5.612
  603    H    ALA  78           H        ALA  78  18.861   0.308   2.568
  604    HA   ALA  78           HA       ALA  78  16.259  -0.327   1.803
  605    HB1  ALA  78          1HB       ALA  78  18.809  -0.843   0.290
  606    HB2  ALA  78          2HB       ALA  78  17.934   0.686   0.339
  607    HB3  ALA  78          3HB       ALA  78  17.188  -0.731  -0.394
  608    H    GLU  79           H        GLU  79  19.004  -2.431   2.485
  609    HA   GLU  79           HA       GLU  79  17.982  -4.804   1.399
  610    HB2  GLU  79          1HB       GLU  79  19.922  -4.306   3.644
  611    HB3  GLU  79          2HB       GLU  79  19.525  -5.923   3.075
  612    HG2  GLU  79          1HG       GLU  79  20.345  -5.389   0.872
  613    HG3  GLU  79          2HG       GLU  79  20.658  -3.727   1.357
  614    H    GLU  80           H        GLU  80  17.727  -3.518   4.704
  615    HA   GLU  80           HA       GLU  80  16.164  -5.587   5.778
  616    HB2  GLU  80          1HB       GLU  80  16.439  -2.670   6.453
  617    HB3  GLU  80          2HB       GLU  80  15.350  -3.724   7.343
  618    HG2  GLU  80          1HG       GLU  80  18.302  -4.177   7.039
  619    HG3  GLU  80          2HG       GLU  80  17.537  -3.427   8.432
  620    H    VAL  81           H        VAL  81  15.272  -2.546   4.235
  621    HA   VAL  81           HA       VAL  81  12.503  -2.729   4.480
  622    HB   VAL  81           HB       VAL  81  14.146  -1.377   2.347
  623   HG11  VAL  81          1HG1      VAL  81  11.245  -1.015   3.086
  624   HG12  VAL  81          2HG1      VAL  81  11.866  -1.653   1.564
  625   HG13  VAL  81          3HG1      VAL  81  12.156   0.034   1.998
  626   HG21  VAL  81          1HG2      VAL  81  12.968  -0.417   4.936
  627   HG22  VAL  81          2HG2      VAL  81  13.730   0.613   3.726
  628   HG23  VAL  81          3HG2      VAL  81  14.678  -0.617   4.552
  629    H    ARG  82           H        ARG  82  14.574  -3.708   1.735
  630    HA   ARG  82           HA       ARG  82  12.593  -4.696   0.056
  631    HB2  ARG  82          1HB       ARG  82  15.051  -4.349  -0.445
  632    HB3  ARG  82          2HB       ARG  82  15.340  -5.895   0.339
  633    HG2  ARG  82          1HG       ARG  82  13.811  -6.955  -1.285
  634    HG3  ARG  82          2HG       ARG  82  13.677  -5.407  -2.110
  635    HD2  ARG  82          1HD       ARG  82  16.158  -5.415  -2.361
  636    HD3  ARG  82          2HD       ARG  82  16.159  -7.057  -1.725
  637    HE   ARG  82           HE       ARG  82  14.501  -6.540  -4.072
  638   HH11  ARG  82          1HH1      ARG  82  17.480  -7.806  -2.752
  639   HH12  ARG  82          2HH1      ARG  82  17.859  -8.748  -4.156
  640   HH21  ARG  82          1HH2      ARG  82  14.999  -7.772  -5.942
  641   HH22  ARG  82          2HH2      ARG  82  16.448  -8.728  -5.972
  642    H    THR  83           H        THR  83  14.393  -6.317   2.635
  643    HA   THR  83           HA       THR  83  13.368  -8.894   2.196
  644    HB   THR  83           HB       THR  83  14.635  -7.541   4.555
  645    HG1  THR  83           HG1      THR  83  16.374  -8.464   3.777
  646   HG21  THR  83          1HG2      THR  83  13.060  -9.139   5.513
  647   HG22  THR  83          2HG2      THR  83  14.715  -9.715   5.707
  648   HG23  THR  83          3HG2      THR  83  13.681 -10.408   4.457
  649    H    GLU  84           H        GLU  84  12.405  -6.396   4.567
  650    HA   GLU  84           HA       GLU  84  10.248  -7.798   5.660
  651    HB2  GLU  84          1HB       GLU  84  10.657  -4.814   5.441
  652    HB3  GLU  84          2HB       GLU  84   9.442  -5.592   6.443
  653    HG2  GLU  84          1HG       GLU  84  11.254  -6.762   7.651
  654    HG3  GLU  84          2HG       GLU  84  12.425  -5.831   6.720
  655    H    VAL  85           H        VAL  85  10.363  -5.601   2.870
  656    HA   VAL  85           HA       VAL  85   7.625  -5.602   2.276
  657    HB   VAL  85           HB       VAL  85  10.064  -5.310   0.528
  658   HG11  VAL  85          1HG1      VAL  85   8.342  -6.297  -0.863
  659   HG12  VAL  85          2HG1      VAL  85   8.557  -4.594  -1.283
  660   HG13  VAL  85          3HG1      VAL  85   7.175  -5.096  -0.305
  661   HG21  VAL  85          1HG2      VAL  85   9.300  -2.987   0.390
  662   HG22  VAL  85          2HG2      VAL  85   9.595  -3.489   2.055
  663   HG23  VAL  85          3HG2      VAL  85   7.941  -3.379   1.447
  664    H    LEU  86           H        LEU  86  10.227  -7.734   1.097
  665    HA   LEU  86           HA       LEU  86   8.688  -9.327  -0.574
  666    HB2  LEU  86          1HB       LEU  86  11.219  -9.921   0.943
  667    HB3  LEU  86          2HB       LEU  86  10.501 -11.049  -0.203
  668    HG   LEU  86           HG       LEU  86  11.269  -8.246  -0.965
  669   HD11  LEU  86          1HD1      LEU  86  12.910 -10.764  -1.191
  670   HD12  LEU  86          2HD1      LEU  86  13.250  -9.399  -0.127
  671   HD13  LEU  86          3HD1      LEU  86  13.325  -9.192  -1.879
  672   HD21  LEU  86          1HD2      LEU  86   9.706  -9.308  -2.454
  673   HD22  LEU  86          2HD2      LEU  86  10.705 -10.761  -2.520
  674   HD23  LEU  86          3HD2      LEU  86  11.293  -9.252  -3.222
  675    H    LYS  87           H        LYS  87   9.197  -9.520   2.897
  676    HA   LYS  87           HA       LYS  87   8.061 -12.097   3.278
  677    HB2  LYS  87          1HB       LYS  87   8.400  -9.742   5.131
  678    HB3  LYS  87          2HB       LYS  87   7.687 -11.260   5.652
  679    HG2  LYS  87          1HG       LYS  87   9.745 -12.432   5.063
  680    HG3  LYS  87          2HG       LYS  87  10.470 -10.895   4.557
  681    HD2  LYS  87          1HD       LYS  87  10.283 -10.036   6.809
  682    HD3  LYS  87          2HD       LYS  87   9.441 -11.496   7.329
  683    HE2  LYS  87          1HE       LYS  87  11.484 -12.792   6.659
  684    HE3  LYS  87          2HE       LYS  87  12.300 -11.248   6.417
  685    HZ1  LYS  87          1HZ       LYS  87  11.133 -12.227   8.964
  686    HZ2  LYS  87          2HZ       LYS  87  11.861 -10.716   8.746
  687    HZ3  LYS  87          3HZ       LYS  87  12.780 -12.127   8.594
  688    H    CYS  88           H        CYS  88   6.727  -9.102   2.492
  689    HA   CYS  88           HA       CYS  88   4.062  -9.888   3.409
  690    HB2  CYS  88          1HB       CYS  88   5.315  -7.258   2.694
  691    HB3  CYS  88          2HB       CYS  88   3.546  -7.437   2.706
  692    H    VAL  89           H        VAL  89   6.051  -9.691   0.668
  693    HA   VAL  89           HA       VAL  89   3.966  -9.547  -1.305
  694    HB   VAL  89           HB       VAL  89   6.825 -10.483  -1.585
  695   HG11  VAL  89          1HG1      VAL  89   5.482 -11.334  -3.376
  696   HG12  VAL  89          2HG1      VAL  89   6.459 -10.001  -3.993
  697   HG13  VAL  89          3HG1      VAL  89   4.751  -9.751  -3.632
  698   HG21  VAL  89          1HG2      VAL  89   5.586  -7.783  -2.077
  699   HG22  VAL  89          2HG2      VAL  89   7.207  -8.247  -2.591
  700   HG23  VAL  89          3HG2      VAL  89   6.810  -8.189  -0.875
  701    H    ASP  90           H        ASP  90   2.646 -11.175  -1.748
  702    HA   ASP  90           HA       ASP  90   3.685 -13.880  -1.788
  703    HB2  ASP  90          1HB       ASP  90   2.662 -13.374   0.509
  704    HB3  ASP  90          2HB       ASP  90   1.109 -13.318  -0.327
  705    H    LYS  91           H        LYS  91   1.560 -15.331  -2.427
  706    HA   LYS  91           HA       LYS  91   1.094 -14.448  -5.126
  707    HB2  LYS  91          1HB       LYS  91  -0.060 -16.901  -3.809
  708    HB3  LYS  91          2HB       LYS  91   0.253 -16.620  -5.518
  709    HG2  LYS  91          1HG       LYS  91   2.416 -16.784  -3.445
  710    HG3  LYS  91          2HG       LYS  91   1.862 -18.154  -4.405
  711    HD2  LYS  91          1HD       LYS  91   2.871 -15.592  -5.623
  712    HD3  LYS  91          2HD       LYS  91   3.924 -16.958  -5.254
  713    HE2  LYS  91          1HE       LYS  91   1.489 -17.128  -7.028
  714    HE3  LYS  91          2HE       LYS  91   3.127 -16.863  -7.623
  715    HZ1  LYS  91          1HZ       LYS  91   2.219 -19.237  -6.080
  716    HZ2  LYS  91          2HZ       LYS  91   3.783 -18.982  -6.671
  717    HZ3  LYS  91          3HZ       LYS  91   2.498 -19.194  -7.747
  718    H    ASN  92           H        ASN  92  -0.961 -14.393  -6.145
  719    HA   ASN  92           HA       ASN  92  -2.955 -12.969  -4.624
  720    HB2  ASN  92          1HB       ASN  92  -2.339 -12.370  -6.964
  721    HB3  ASN  92          2HB       ASN  92  -2.997 -13.906  -7.497
  722   HD21  ASN  92          1HD2      ASN  92  -4.359 -12.716  -8.869
  723   HD22  ASN  92          2HD2      ASN  92  -5.809 -11.985  -8.270
  724    H    THR  93           H        THR  93  -3.274 -14.859  -3.177
  725    HA   THR  93           HA       THR  93  -4.669 -17.153  -4.189
  726    HB   THR  93           HB       THR  93  -4.944 -17.712  -1.768
  727    HG1  THR  93           HG1      THR  93  -4.781 -16.054  -0.442
  728   HG21  THR  93          1HG2      THR  93  -2.562 -18.080  -1.345
  729   HG22  THR  93          2HG2      THR  93  -2.161 -16.949  -2.638
  730   HG23  THR  93          3HG2      THR  93  -2.986 -18.460  -3.012
  731    H    ASP  94           H        ASP  94  -5.575 -14.019  -3.134
  732    HA   ASP  94           HA       ASP  94  -8.276 -14.689  -2.413
  733    HB2  ASP  94          1HB       ASP  94  -6.794 -12.109  -2.826
  734    HB3  ASP  94          2HB       ASP  94  -8.557 -12.110  -2.701
  735    H    ASN  95           H        ASN  95  -6.600 -14.215  -5.310
  736    HA   ASN  95           HA       ASN  95  -7.173 -14.131  -7.482
  737    HB2  ASN  95          1HB       ASN  95  -9.754 -15.214  -6.379
  738    HB3  ASN  95          2HB       ASN  95  -9.447 -15.028  -8.099
  739   HD21  ASN  95          1HD2      ASN  95  -9.918 -17.421  -6.479
  740   HD22  ASN  95          2HD2      ASN  95  -8.543 -18.448  -6.756
  741    H    ASN  96           H        ASN  96  -7.735 -11.815  -5.653
  742    HA   ASN  96           HA       ASN  96  -9.326 -10.288  -7.570
  743    HB2  ASN  96          1HB       ASN  96 -10.963 -10.843  -5.908
  744    HB3  ASN  96          2HB       ASN  96  -9.855 -10.451  -4.592
  745   HD21  ASN  96          1HD2      ASN  96 -11.976  -9.196  -7.041
  746   HD22  ASN  96          2HD2      ASN  96 -12.028  -7.573  -6.445
  747    H    ALA  97           H        ALA  97  -8.400  -8.383  -8.020
  748    HA   ALA  97           HA       ALA  97  -5.778  -7.892  -7.119
  749    HB1  ALA  97          1HB       ALA  97  -6.559  -7.301  -9.359
  750    HB2  ALA  97          2HB       ALA  97  -5.835  -5.923  -8.531
  751    HB3  ALA  97          3HB       ALA  97  -7.589  -6.048  -8.666
  752    H    CYS  98           H        CYS  98  -8.874  -6.431  -6.211
  753    HA   CYS  98           HA       CYS  98  -7.814  -4.312  -4.669
  754    HB2  CYS  98          1HB       CYS  98 -10.388  -5.828  -4.192
  755    HB3  CYS  98          2HB       CYS  98  -9.979  -4.246  -3.539
  756    H    HIS  99           H        HIS  99  -8.487  -7.673  -3.952
  757    HA   HIS  99           HA       HIS  99  -7.924  -7.458  -1.147
  758    HB2  HIS  99          1HB       HIS  99  -8.381  -9.741  -3.046
  759    HB3  HIS  99          2HB       HIS  99  -7.832 -10.042  -1.407
  760    HD1  HIS  99           HD1      HIS  99  -9.811 -11.024  -0.322
  761    HD2  HIS  99           HD2      HIS  99 -10.779  -7.604  -2.490
  762    HE1  HIS  99           HE1      HIS  99 -12.238 -10.567   0.167
  763    HE2  HIS  99           HE2      HIS  99 -12.755  -8.403  -1.020
  764    H    TRP 100           H        TRP 100  -6.100  -8.195  -4.025
  765    HA   TRP 100           HA       TRP 100  -3.923  -9.481  -2.729
  766    HB2  TRP 100          1HB       TRP 100  -4.495  -9.730  -5.154
  767    HB3  TRP 100          2HB       TRP 100  -3.896  -8.093  -5.422
  768    HD1  TRP 100           HD1      TRP 100  -1.688  -9.772  -2.979
  769    HE1  TRP 100           HE1      TRP 100   0.436 -10.658  -4.130
  770    HE3  TRP 100           HE3      TRP 100  -3.162  -9.325  -7.856
  771    HZ2  TRP 100           HZ2      TRP 100   1.360 -11.112  -6.756
  772    HZ3  TRP 100           HZ3      TRP 100  -1.600 -10.008  -9.623
  773    HH2  TRP 100           HH2      TRP 100   0.613 -10.884  -9.092
  774    H    ALA 101           H        ALA 101  -4.304  -6.208  -4.082
  775    HA   ALA 101           HA       ALA 101  -1.810  -5.225  -3.230
  776    HB1  ALA 101          1HB       ALA 101  -2.713  -3.024  -3.677
  777    HB2  ALA 101          2HB       ALA 101  -4.352  -3.675  -3.687
  778    HB3  ALA 101          3HB       ALA 101  -3.210  -4.147  -4.944
  779    H    PHE 102           H        PHE 102  -4.943  -5.402  -1.682
  780    HA   PHE 102           HA       PHE 102  -4.295  -3.754   0.517
  781    HB2  PHE 102          1HB       PHE 102  -6.597  -4.213  -0.218
  782    HB3  PHE 102          2HB       PHE 102  -6.432  -5.878   0.333
  783    HD1  PHE 102           HD1      PHE 102  -6.952  -6.423   2.557
  784    HD2  PHE 102           HD2      PHE 102  -6.305  -2.354   1.482
  785    HE1  PHE 102           HE1      PHE 102  -7.707  -5.718   4.788
  786    HE2  PHE 102           HE2      PHE 102  -7.057  -1.642   3.713
  787    HZ   PHE 102           HZ       PHE 102  -7.757  -3.321   5.369
  788    H    ARG 103           H        ARG 103  -3.804  -7.102  -0.235
  789    HA   ARG 103           HA       ARG 103  -3.398  -8.075   2.405
  790    HB2  ARG 103          1HB       ARG 103  -3.902  -9.528   0.432
  791    HB3  ARG 103          2HB       ARG 103  -2.294  -9.170  -0.181
  792    HG2  ARG 103          1HG       ARG 103  -1.270 -10.238   1.710
  793    HG3  ARG 103          2HG       ARG 103  -2.842 -10.475   2.464
  794    HD2  ARG 103          1HD       ARG 103  -3.502 -11.953   0.615
  795    HD3  ARG 103          2HD       ARG 103  -1.912 -11.738  -0.122
  796    HE   ARG 103           HE       ARG 103  -2.043 -12.791   2.603
  797   HH11  ARG 103          1HH1      ARG 103  -1.515 -13.443  -0.814
  798   HH12  ARG 103          2HH1      ARG 103  -0.638 -14.910  -0.520
  799   HH21  ARG 103          1HH2      ARG 103  -0.922 -14.740   2.968
  800   HH22  ARG 103          2HH2      ARG 103  -0.329 -15.659   1.621
  801    H    GLY 104           H        GLY 104  -1.256  -6.851  -0.118
  802    HA2  GLY 104          1HA       GLY 104   1.175  -7.269   1.298
  803    HA3  GLY 104          2HA       GLY 104   0.934  -6.149  -0.050
  804    H    PHE 105           H        PHE 105  -1.028  -4.521   1.034
  805    HA   PHE 105           HA       PHE 105   0.536  -2.696   2.483
  806    HB2  PHE 105          1HB       PHE 105  -1.184  -1.886   1.046
  807    HB3  PHE 105          2HB       PHE 105  -2.411  -2.814   1.891
  808    HD1  PHE 105           HD1      PHE 105   0.264  -0.503   3.073
  809    HD2  PHE 105           HD2      PHE 105  -3.909  -1.331   2.845
  810    HE1  PHE 105           HE1      PHE 105  -0.214   1.495   4.431
  811    HE2  PHE 105           HE2      PHE 105  -4.384   0.656   4.207
  812    HZ   PHE 105           HZ       PHE 105  -2.534   2.074   5.001
  813    H    LYS 106           H        LYS 106  -2.133  -4.818   3.443
  814    HA   LYS 106           HA       LYS 106  -2.401  -4.108   6.135
  815    HB2  LYS 106          1HB       LYS 106  -3.593  -5.999   4.548
  816    HB3  LYS 106          2HB       LYS 106  -2.542  -6.994   5.538
  817    HG2  LYS 106          1HG       LYS 106  -3.513  -5.962   7.566
  818    HG3  LYS 106          2HG       LYS 106  -4.706  -5.166   6.533
  819    HD2  LYS 106          1HD       LYS 106  -5.543  -7.294   5.776
  820    HD3  LYS 106          2HD       LYS 106  -4.261  -8.149   6.636
  821    HE2  LYS 106          1HE       LYS 106  -6.261  -8.338   7.927
  822    HE3  LYS 106          2HE       LYS 106  -5.180  -7.230   8.768
  823    HZ1  LYS 106          1HZ       LYS 106  -7.496  -6.463   7.082
  824    HZ2  LYS 106          2HZ       LYS 106  -6.443  -5.376   7.836
  825    HZ3  LYS 106          3HZ       LYS 106  -7.421  -6.390   8.765
  826    H    CYS 107           H        CYS 107  -0.433  -6.679   4.719
  827    HA   CYS 107           HA       CYS 107   0.643  -7.656   7.076
  828    HB2  CYS 107          1HB       CYS 107   0.826  -8.987   5.144
  829    HB3  CYS 107          2HB       CYS 107   1.610  -7.709   4.222
  830    H    PHE 108           H        PHE 108   1.789  -5.056   4.977
  831    HA   PHE 108           HA       PHE 108   4.328  -4.892   6.278
  832    HB2  PHE 108          1HB       PHE 108   3.855  -4.326   3.860
  833    HB3  PHE 108          2HB       PHE 108   3.150  -2.819   4.450
  834    HD1  PHE 108           HD1      PHE 108   6.237  -4.777   4.107
  835    HD2  PHE 108           HD2      PHE 108   4.549  -1.047   5.284
  836    HE1  PHE 108           HE1      PHE 108   8.484  -3.785   4.180
  837    HE2  PHE 108           HE2      PHE 108   6.797  -0.052   5.350
  838    HZ   PHE 108           HZ       PHE 108   8.765  -1.420   4.796
  839    H    GLN 109           H        GLN 109   1.379  -2.848   6.308
  840    HA   GLN 109           HA       GLN 109   2.500  -0.867   7.993
  841    HB2  GLN 109          1HB       GLN 109   0.208  -0.099   8.337
  842    HB3  GLN 109          2HB       GLN 109   0.533  -0.403   6.636
  843    HG2  GLN 109          1HG       GLN 109  -0.812  -2.270   6.573
  844    HG3  GLN 109          2HG       GLN 109  -0.734  -2.514   8.321
  845   HE21  GLN 109          1HE2      GLN 109  -2.979  -2.634   8.470
  846   HE22  GLN 109          2HE2      GLN 109  -3.991  -1.238   8.323
  847    H    LYS 110           H        LYS 110   1.217  -3.984   8.580
  848    HA   LYS 110           HA       LYS 110   0.365  -3.709  11.243
  849    HB2  LYS 110          1HB       LYS 110  -0.087  -5.612   9.639
  850    HB3  LYS 110          2HB       LYS 110   1.549  -6.163   9.934
  851    HG2  LYS 110          1HG       LYS 110  -0.367  -5.804  12.194
  852    HG3  LYS 110          2HG       LYS 110  -0.402  -7.257  11.203
  853    HD2  LYS 110          1HD       LYS 110   2.028  -7.566  11.717
  854    HD3  LYS 110          2HD       LYS 110   1.893  -6.230  12.863
  855    HE2  LYS 110          1HE       LYS 110   1.679  -8.343  14.027
  856    HE3  LYS 110          2HE       LYS 110   0.149  -7.475  14.074
  857    HZ1  LYS 110          1HZ       LYS 110  -0.151  -9.823  13.582
  858    HZ2  LYS 110          2HZ       LYS 110   0.809  -9.679  12.200
  859    HZ3  LYS 110          3HZ       LYS 110  -0.668  -8.865  12.290
  860    H    ASN 111           H        ASN 111   3.506  -4.083   9.777
  861    HA   ASN 111           HA       ASN 111   4.731  -4.259  12.452
  862    HB2  ASN 111          1HB       ASN 111   5.872  -5.059   9.767
  863    HB3  ASN 111          2HB       ASN 111   6.766  -5.069  11.286
  864   HD21  ASN 111          1HD2      ASN 111   4.305  -6.630   9.398
  865   HD22  ASN 111          2HD2      ASN 111   4.199  -8.056  10.366
  866    H    ASN 112           H        ASN 112   4.532  -2.386   9.519
  867    HA   ASN 112           HA       ASN 112   6.496  -0.487  10.604
  868    HB2  ASN 112          1HB       ASN 112   6.487  -1.640   7.811
  869    HB3  ASN 112          2HB       ASN 112   7.423  -0.221   8.292
  870   HD21  ASN 112          1HD2      ASN 112   8.001  -3.077   7.388
  871   HD22  ASN 112          2HD2      ASN 112   9.223  -3.611   8.500
  872    H    LEU 113           H        LEU 113   4.140   0.439  11.001
  873    HA   LEU 113           HA       LEU 113   3.008   1.620   8.618
  874    HB2  LEU 113          1HB       LEU 113   1.450   0.939  10.287
  875    HB3  LEU 113          2HB       LEU 113   2.255   1.889  11.519
  876    HG   LEU 113           HG       LEU 113   1.591   3.947  10.288
  877   HD11  LEU 113          1HD1      LEU 113   0.014   2.024   8.589
  878   HD12  LEU 113          2HD1      LEU 113   1.420   2.950   8.065
  879   HD13  LEU 113          3HD1      LEU 113  -0.068   3.784   8.519
  880   HD21  LEU 113          1HD2      LEU 113  -0.750   3.874  10.936
  881   HD22  LEU 113          2HD2      LEU 113   0.251   3.072  12.149
  882   HD23  LEU 113          3HD2      LEU 113  -0.690   2.112  11.007
  883    H    SER 114           H        SER 114   4.938   2.657  11.359
  884    HA   SER 114           HA       SER 114   4.822   5.435  10.880
  885    HB2  SER 114          1HB       SER 114   7.050   3.834  12.167
  886    HB3  SER 114          2HB       SER 114   6.806   5.573  12.310
  887    HG   SER 114           HG       SER 114   5.406   3.468  13.489
  888    H    LEU 115           H        LEU 115   6.855   2.891   9.578
  889    HA   LEU 115           HA       LEU 115   8.695   4.536   8.214
  890    HB2  LEU 115          1HB       LEU 115   9.095   2.171   8.647
  891    HB3  LEU 115          2HB       LEU 115   7.758   1.735   7.599
  892    HG   LEU 115           HG       LEU 115   8.994   2.760   5.691
  893   HD11  LEU 115          1HD1      LEU 115  11.144   3.022   7.775
  894   HD12  LEU 115          2HD1      LEU 115  10.393   4.312   6.837
  895   HD13  LEU 115          3HD1      LEU 115  11.432   3.132   6.039
  896   HD21  LEU 115          1HD2      LEU 115  10.422   0.556   7.176
  897   HD22  LEU 115          2HD2      LEU 115  10.614   0.935   5.464
  898   HD23  LEU 115          3HD2      LEU 115   9.062   0.358   6.070
  899    H    ILE 116           H        ILE 116   5.545   3.223   7.381
  900    HA   ILE 116           HA       ILE 116   5.525   3.888   4.652
  901    HB   ILE 116           HB       ILE 116   3.229   3.629   6.612
  902   HG12  ILE 116          1HG1      ILE 116   4.367   1.704   4.567
  903   HG13  ILE 116          2HG1      ILE 116   4.550   1.584   6.323
  904   HG21  ILE 116          1HG2      ILE 116   1.807   3.339   4.618
  905   HG22  ILE 116          2HG2      ILE 116   3.178   3.789   3.605
  906   HG23  ILE 116          3HG2      ILE 116   2.496   4.961   4.736
  907   HD11  ILE 116          1HD1      ILE 116   2.051   1.263   4.693
  908   HD12  ILE 116          2HD1      ILE 116   2.046   1.419   6.449
  909   HD13  ILE 116          3HD1      ILE 116   2.866   0.056   5.686
  910    H    LYS 117           H        LYS 117   4.512   5.646   7.532
  911    HA   LYS 117           HA       LYS 117   3.577   7.960   6.215
  912    HB2  LYS 117          1HB       LYS 117   4.567   7.505   9.025
  913    HB3  LYS 117          2HB       LYS 117   3.888   9.032   8.478
  914    HG2  LYS 117          1HG       LYS 117   1.777   7.930   7.972
  915    HG3  LYS 117          2HG       LYS 117   2.445   6.377   8.470
  916    HD2  LYS 117          1HD       LYS 117   2.755   7.229  10.741
  917    HD3  LYS 117          2HD       LYS 117   2.130   8.802  10.246
  918    HE2  LYS 117          1HE       LYS 117  -0.032   7.794   9.735
  919    HE3  LYS 117          2HE       LYS 117   0.592   6.204  10.181
  920    HZ1  LYS 117          1HZ       LYS 117   0.370   8.529  12.015
  921    HZ2  LYS 117          2HZ       LYS 117   0.907   6.980  12.430
  922    HZ3  LYS 117          3HZ       LYS 117  -0.700   7.219  11.968
  923    H    ALA 118           H        ALA 118   6.734   6.908   7.289
  924    HA   ALA 118           HA       ALA 118   8.021   9.449   6.988
  925    HB1  ALA 118          1HB       ALA 118   9.190   6.685   7.162
  926    HB2  ALA 118          2HB       ALA 118   8.847   7.751   8.523
  927    HB3  ALA 118          3HB       ALA 118  10.078   8.199   7.343
  928    H    SER 119           H        SER 119   7.442   6.693   4.933
  929    HA   SER 119           HA       SER 119   9.363   7.183   2.958
  930    HB2  SER 119          1HB       SER 119   6.637   5.918   2.596
  931    HB3  SER 119          2HB       SER 119   8.038   5.719   1.544
  932    HG   SER 119           HG       SER 119   8.244   5.088   4.277
  933    H    ILE 120           H        ILE 120   6.063   8.388   3.326
  934    HA   ILE 120           HA       ILE 120   6.267   9.917   0.855
  935    HB   ILE 120           HB       ILE 120   3.949  10.634   1.363
  936   HG12  ILE 120          1HG1      ILE 120   4.104   8.706   3.678
  937   HG13  ILE 120          2HG1      ILE 120   4.237  10.452   3.859
  938   HG21  ILE 120          1HG2      ILE 120   2.904   8.435   1.027
  939   HG22  ILE 120          2HG2      ILE 120   4.430   7.663   1.456
  940   HG23  ILE 120          3HG2      ILE 120   4.325   8.661   0.007
  941   HD11  ILE 120          1HD1      ILE 120   1.868   8.979   2.742
  942   HD12  ILE 120          2HD1      ILE 120   2.002  10.723   2.947
  943   HD13  ILE 120          3HD1      ILE 120   1.996   9.668   4.360
  944    H    LYS 121           H        LYS 121   7.499  10.371   3.791
  945    HA   LYS 121           HA       LYS 121   6.582  13.035   4.365
  946    HB2  LYS 121          1HB       LYS 121   7.256  11.484   6.157
  947    HB3  LYS 121          2HB       LYS 121   8.893  11.472   5.520
  948    HG2  LYS 121          1HG       LYS 121   9.187  13.790   6.042
  949    HG3  LYS 121          2HG       LYS 121   7.496  13.943   6.515
  950    HD2  LYS 121          1HD       LYS 121   9.508  12.157   7.880
  951    HD3  LYS 121          2HD       LYS 121   9.051  13.765   8.441
  952    HE2  LYS 121          1HE       LYS 121   7.233  11.375   8.160
  953    HE3  LYS 121          2HE       LYS 121   7.830  12.064   9.666
  954    HZ1  LYS 121          1HZ       LYS 121   5.961  13.321   7.738
  955    HZ2  LYS 121          2HZ       LYS 121   6.663  14.154   9.027
  956    HZ3  LYS 121          3HZ       LYS 121   5.631  12.850   9.326
  957    H    LYS 122           H        LYS 122   7.502  14.898   3.821
  958    HA   LYS 122           HA       LYS 122   9.893  14.815   2.123
  959    HB2  LYS 122          1HB       LYS 122   8.482  17.383   2.433
  960    HB3  LYS 122          2HB       LYS 122   9.165  16.639   1.021
  961    HG2  LYS 122          1HG       LYS 122   6.944  16.645   0.482
  962    HG3  LYS 122          2HG       LYS 122   7.154  15.025   1.136
  963    HD2  LYS 122          1HD       LYS 122   5.114  15.973   1.995
  964    HD3  LYS 122          2HD       LYS 122   6.280  15.832   3.308
  965    HE2  LYS 122          1HE       LYS 122   6.727  18.156   3.283
  966    HE3  LYS 122          2HE       LYS 122   5.885  18.371   1.750
  967    HZ1  LYS 122          1HZ       LYS 122   4.532  17.474   4.228
  968    HZ2  LYS 122          2HZ       LYS 122   3.808  17.991   2.782
  969    HZ3  LYS 122          3HZ       LYS 122   4.637  19.098   3.765
  970    H    ASP 123           H        ASP 123  11.516  14.699   3.528
  971    HA   ASP 123           HA       ASP 123  11.772  16.209   5.898
  972    HB2  ASP 123          1HB       ASP 123  13.905  14.956   4.156
  973    HB3  ASP 123          2HB       ASP 123  14.197  15.643   5.748
  974    H21  ACD 201           H21      ACD   1  -4.580   4.766   1.507
  975    H22  ACD 201           H22      ACD   1  -3.461   5.070   2.841
  976    H31  ACD 201           H31      ACD   1  -2.115   6.553   1.396
  977    H32  ACD 201           H32      ACD   1  -3.245   6.318   0.062
  978    H41  ACD 201           H41      ACD   1  -2.719   3.868   0.072
  979    H42  ACD 201           H42      ACD   1  -1.281   4.860  -0.233
  980    H5   ACD 201           H5       ACD   1  -1.866   3.246   2.306
  981    H6   ACD 201           H6       ACD   1   0.391   3.850   2.816
  982    H71  ACD 201           H71      ACD   1   0.807   4.979   0.171
  983    H72  ACD 201           H72      ACD   1  -0.087   6.223   1.047
  984    H8   ACD 201           H8       ACD   1   1.809   6.575   2.595
  985    H9   ACD 201           H9       ACD   1   3.891   5.557   2.040
  986   H101  ACD 201          H101      ACD   1   2.790   4.631  -0.496
  987   H102  ACD 201          H102      ACD   1   2.334   3.402   0.686
  988    H11  ACD 201           H11      ACD   1   5.296   4.253   0.546
  989    H12  ACD 201           H12      ACD   1   5.607   1.926   0.192
  990   H131  ACD 201          H131      ACD   1   2.640   2.002  -0.543
  991   H132  ACD 201          H132      ACD   1   3.724   0.614  -0.677
  992    H14  ACD 201           H14      ACD   1   2.566   1.612   2.026
  993    H15  ACD 201           H15      ACD   1   2.491  -0.733   2.435
  994   H161  ACD 201          H161      ACD   1   2.737  -1.394  -0.366
  995   H162  ACD 201          H162      ACD   1   4.383  -0.956   0.105
  996   H171  ACD 201          H171      ACD   1   4.451  -2.656   1.812
  997   H172  ACD 201          H172      ACD   1   2.719  -2.968   1.661
  998   H181  ACD 201          H181      ACD   1   4.769  -3.458  -0.543
  999   H182  ACD 201          H182      ACD   1   3.045  -3.833  -0.629
 1000   H191  ACD 201          H191      ACD   1   5.077  -5.058   1.287
 1001   H192  ACD 201          H192      ACD   1   3.341  -5.359   1.374
 1002   H201  ACD 201          H201      ACD   1   3.410  -6.263  -0.931
 1003   H202  ACD 201          H202      ACD   1   4.473  -7.137   0.117
 1004   H203  ACD 201          H203      ACD   1   5.117  -5.982  -0.999
  Start of MODEL   27
    1    H1   MET   1          1H        MET   1  14.285  11.080 -17.723
    2    H2   MET   1          2H        MET   1  13.672  12.208 -16.626
    3    H3   MET   1          3H        MET   1  13.793  10.582 -16.183
    4    HA   MET   1           HA       MET   1  16.179  10.672 -16.333
    5    HB2  MET   1          1HB       MET   1  17.304  12.848 -16.599
    6    HB3  MET   1          2HB       MET   1  16.397  12.390 -18.029
    7    HG2  MET   1          1HG       MET   1  14.592  13.902 -17.358
    8    HG3  MET   1          2HG       MET   1  15.531  14.376 -15.944
    9    HE1  MET   1          1HE       MET   1  15.716  17.548 -18.259
   10    HE2  MET   1          2HE       MET   1  15.226  16.920 -16.685
   11    HE3  MET   1          3HE       MET   1  14.349  16.440 -18.138
   12    H    GLU   2           H        GLU   2  13.803  12.795 -14.868
   13    HA   GLU   2           HA       GLU   2  15.366  12.803 -12.391
   14    HB2  GLU   2          1HB       GLU   2  12.911  14.369 -13.160
   15    HB3  GLU   2          2HB       GLU   2  13.705  14.455 -11.596
   16    HG2  GLU   2          1HG       GLU   2  15.752  15.246 -12.738
   17    HG3  GLU   2          2HG       GLU   2  14.846  15.270 -14.251
   18    H    PHE   3           H        PHE   3  14.933  11.411 -10.886
   19    HA   PHE   3           HA       PHE   3  12.764   9.571 -11.146
   20    HB2  PHE   3          1HB       PHE   3  14.953   8.875 -10.300
   21    HB3  PHE   3          2HB       PHE   3  14.767   9.942  -8.904
   22    HD1  PHE   3           HD1      PHE   3  13.305   7.004 -10.604
   23    HD2  PHE   3           HD2      PHE   3  13.734   9.159  -6.966
   24    HE1  PHE   3           HE1      PHE   3  12.238   5.152  -9.388
   25    HE2  PHE   3           HE2      PHE   3  12.665   7.311  -5.738
   26    HZ   PHE   3           HZ       PHE   3  11.916   5.302  -6.952
   27    H    THR   4           H        THR   4  10.765  10.080 -10.611
   28    HA   THR   4           HA       THR   4  10.290  12.031  -8.471
   29    HB   THR   4           HB       THR   4   7.936  10.999  -9.884
   30    HG1  THR   4           HG1      THR   4   9.900  12.537 -11.301
   31   HG21  THR   4          1HG2      THR   4   9.020  13.772  -9.432
   32   HG22  THR   4          2HG2      THR   4   7.936  12.902  -8.349
   33   HG23  THR   4          3HG2      THR   4   7.389  13.358  -9.962
   34    H    VAL   5           H        VAL   5   9.514  11.514  -6.604
   35    HA   VAL   5           HA       VAL   5   8.499   8.774  -6.149
   36    HB   VAL   5           HB       VAL   5   9.450   8.735  -4.073
   37   HG11  VAL   5          1HG1      VAL   5  11.293   9.063  -5.557
   38   HG12  VAL   5          2HG1      VAL   5  11.624   9.836  -4.008
   39   HG13  VAL   5          3HG1      VAL   5  11.155  10.813  -5.401
   40   HG21  VAL   5          1HG2      VAL   5   9.798  10.653  -2.605
   41   HG22  VAL   5          2HG2      VAL   5   8.129  10.589  -3.179
   42   HG23  VAL   5          3HG2      VAL   5   9.265  11.741  -3.887
   43    H    SER   6           H        SER   6   6.731   8.612  -4.593
   44    HA   SER   6           HA       SER   6   4.823  10.756  -5.098
   45    HB2  SER   6          1HB       SER   6   3.161   9.082  -4.232
   46    HB3  SER   6          2HB       SER   6   4.041   8.564  -5.668
   47    HG   SER   6           HG       SER   6   4.914   7.894  -3.064
   48    H    THR   7           H        THR   7   5.337  12.346  -3.632
   49    HA   THR   7           HA       THR   7   5.681  11.796  -0.837
   50    HB   THR   7           HB       THR   7   5.569  14.260  -0.553
   51    HG1  THR   7           HG1      THR   7   4.993  14.158  -3.350
   52   HG21  THR   7          1HG2      THR   7   7.703  13.181  -1.070
   53   HG22  THR   7          2HG2      THR   7   7.607  14.785  -1.800
   54   HG23  THR   7          3HG2      THR   7   7.373  13.348  -2.794
   55    H    THR   8           H        THR   8   4.239  13.321   0.676
   56    HA   THR   8           HA       THR   8   1.681  12.228   0.778
   57    HB   THR   8           HB       THR   8   2.417  14.896   1.968
   58    HG1  THR   8           HG1      THR   8   4.064  13.653   2.682
   59   HG21  THR   8          1HG2      THR   8   0.599  12.664   2.874
   60   HG22  THR   8          2HG2      THR   8   0.094  14.226   2.233
   61   HG23  THR   8          3HG2      THR   8   0.930  14.139   3.783
   62    H    GLU   9           H        GLU   9   2.832  15.269  -0.594
   63    HA   GLU   9           HA       GLU   9   0.371  16.381  -1.279
   64    HB2  GLU   9          1HB       GLU   9   3.022  16.666  -2.695
   65    HB3  GLU   9          2HB       GLU   9   1.626  17.701  -2.945
   66    HG2  GLU   9          1HG       GLU   9   2.915  18.945  -1.505
   67    HG3  GLU   9          2HG       GLU   9   1.792  18.143  -0.409
   68    H    ASP  10           H        ASP  10   2.521  14.270  -3.168
   69    HA   ASP  10           HA       ASP  10   0.889  14.085  -5.461
   70    HB2  ASP  10          1HB       ASP  10   2.816  12.014  -4.366
   71    HB3  ASP  10          2HB       ASP  10   2.105  12.014  -5.977
   72    H    LEU  11           H        LEU  11   1.005  12.261  -2.465
   73    HA   LEU  11           HA       LEU  11  -0.651  10.155  -3.197
   74    HB2  LEU  11          1HB       LEU  11   0.710  10.048  -1.224
   75    HB3  LEU  11          2HB       LEU  11  -0.187  11.376  -0.480
   76    HG   LEU  11           HG       LEU  11  -2.196   9.925  -0.453
   77   HD11  LEU  11          1HD1      LEU  11  -1.986   7.565  -0.914
   78   HD12  LEU  11          2HD1      LEU  11  -0.289   7.776  -1.346
   79   HD13  LEU  11          3HD1      LEU  11  -1.552   8.497  -2.345
   80   HD21  LEU  11          1HD2      LEU  11  -1.546   8.670   1.443
   81   HD22  LEU  11          2HD2      LEU  11  -0.528  10.109   1.443
   82   HD23  LEU  11          3HD2      LEU  11   0.124   8.565   0.892
   83    H    GLN  12           H        GLN  12  -1.452  13.314  -1.830
   84    HA   GLN  12           HA       GLN  12  -4.164  12.832  -1.294
   85    HB2  GLN  12          1HB       GLN  12  -2.741  15.391  -2.020
   86    HB3  GLN  12          2HB       GLN  12  -4.393  15.316  -1.422
   87    HG2  GLN  12          1HG       GLN  12  -3.609  14.366   0.670
   88    HG3  GLN  12          2HG       GLN  12  -1.953  14.377   0.064
   89   HE21  GLN  12          1HE2      GLN  12  -0.841  16.297  -0.052
   90   HE22  GLN  12          2HE2      GLN  12  -1.391  17.749   0.709
   91    H    ARG  13           H        ARG  13  -2.498  13.757  -4.214
   92    HA   ARG  13           HA       ARG  13  -4.738  14.437  -5.781
   93    HB2  ARG  13          1HB       ARG  13  -2.482  15.058  -6.428
   94    HB3  ARG  13          2HB       ARG  13  -2.019  13.369  -6.559
   95    HG2  ARG  13          1HG       ARG  13  -3.486  13.067  -8.453
   96    HG3  ARG  13          2HG       ARG  13  -4.085  14.726  -8.279
   97    HD2  ARG  13          1HD       ARG  13  -2.429  14.558 -10.061
   98    HD3  ARG  13          2HD       ARG  13  -1.860  15.589  -8.754
   99    HE   ARG  13           HE       ARG  13  -0.931  12.838  -9.275
  100   HH11  ARG  13          1HH1      ARG  13  -0.439  16.023  -7.903
  101   HH12  ARG  13          2HH1      ARG  13   1.230  15.745  -7.533
  102   HH21  ARG  13          1HH2      ARG  13   1.278  12.462  -8.774
  103   HH22  ARG  13          2HH2      ARG  13   2.205  13.718  -7.996
  104    H    TYR  14           H        TYR  14  -3.034  11.377  -5.235
  105    HA   TYR  14           HA       TYR  14  -4.504   9.986  -7.247
  106    HB2  TYR  14          1HB       TYR  14  -2.809   8.864  -5.011
  107    HB3  TYR  14          2HB       TYR  14  -3.384   7.983  -6.425
  108    HD1  TYR  14           HD1      TYR  14  -2.902   9.615  -8.670
  109    HD2  TYR  14           HD2      TYR  14  -0.516   9.222  -5.175
  110    HE1  TYR  14           HE1      TYR  14  -0.929  10.323  -9.946
  111    HE2  TYR  14           HE2      TYR  14   1.466   9.939  -6.439
  112    HH   TYR  14           HH       TYR  14   2.238   9.999  -8.773
  113    H    ARG  15           H        ARG  15  -4.868  10.345  -3.745
  114    HA   ARG  15           HA       ARG  15  -6.810   8.317  -3.447
  115    HB2  ARG  15          1HB       ARG  15  -6.988  10.801  -1.789
  116    HB3  ARG  15          2HB       ARG  15  -7.280   9.144  -1.334
  117    HG2  ARG  15          1HG       ARG  15  -4.798   8.760  -1.514
  118    HG3  ARG  15          2HG       ARG  15  -4.631  10.514  -1.680
  119    HD2  ARG  15          1HD       ARG  15  -5.645   8.928   0.664
  120    HD3  ARG  15          2HD       ARG  15  -4.355  10.130   0.623
  121    HE   ARG  15           HE       ARG  15  -6.300  11.735   0.101
  122   HH11  ARG  15          1HH1      ARG  15  -6.527   8.918   2.188
  123   HH12  ARG  15          2HH1      ARG  15  -7.829   9.582   3.131
  124   HH21  ARG  15          1HH2      ARG  15  -8.000  12.601   1.345
  125   HH22  ARG  15          2HH2      ARG  15  -8.662  11.680   2.662
  126    H    THR  16           H        THR  16  -6.981  11.694  -4.353
  127    HA   THR  16           HA       THR  16  -9.733  12.074  -4.181
  128    HB   THR  16           HB       THR  16  -7.625  13.339  -5.920
  129    HG1  THR  16           HG1      THR  16  -7.302  13.975  -3.868
  130   HG21  THR  16          1HG2      THR  16  -9.225  15.126  -6.399
  131   HG22  THR  16          2HG2      THR  16 -10.485  14.230  -5.551
  132   HG23  THR  16          3HG2      THR  16  -9.786  13.578  -7.035
  133    H    GLU  17           H        GLU  17  -7.735  11.144  -6.968
  134    HA   GLU  17           HA       GLU  17  -9.868  10.886  -8.806
  135    HB2  GLU  17          1HB       GLU  17  -7.322   9.290  -8.997
  136    HB3  GLU  17          2HB       GLU  17  -8.318   9.925 -10.293
  137    HG2  GLU  17          1HG       GLU  17  -6.720  11.646  -8.416
  138    HG3  GLU  17          2HG       GLU  17  -6.190  11.141 -10.024
  139    H    CYS  18           H        CYS  18  -8.247   8.493  -6.742
  140    HA   CYS  18           HA       CYS  18  -9.674   6.273  -7.760
  141    HB2  CYS  18          1HB       CYS  18  -8.229   6.657  -5.136
  142    HB3  CYS  18          2HB       CYS  18  -8.933   5.123  -5.665
  143    H    VAL  19           H        VAL  19 -10.373   8.584  -5.228
  144    HA   VAL  19           HA       VAL  19 -12.439   7.118  -3.994
  145    HB   VAL  19           HB       VAL  19 -11.645  10.002  -3.957
  146   HG11  VAL  19          1HG1      VAL  19 -14.084  10.039  -3.991
  147   HG12  VAL  19          2HG1      VAL  19 -13.458  10.503  -2.406
  148   HG13  VAL  19          3HG1      VAL  19 -14.124   8.890  -2.650
  149   HG21  VAL  19          1HG2      VAL  19 -11.409   9.506  -1.544
  150   HG22  VAL  19          2HG2      VAL  19 -10.398   8.491  -2.571
  151   HG23  VAL  19          3HG2      VAL  19 -11.883   7.839  -1.876
  152    H    SER  20           H        SER  20 -12.491   9.754  -6.351
  153    HA   SER  20           HA       SER  20 -15.288   9.756  -6.686
  154    HB2  SER  20          1HB       SER  20 -14.691  11.039  -8.811
  155    HB3  SER  20          2HB       SER  20 -14.101  11.706  -7.288
  156    HG   SER  20           HG       SER  20 -12.131  11.416  -7.942
  157    H    SER  21           H        SER  21 -12.708   8.008  -8.341
  158    HA   SER  21           HA       SER  21 -14.343   7.084 -10.494
  159    HB2  SER  21          1HB       SER  21 -11.865   7.293 -10.606
  160    HB3  SER  21          2HB       SER  21 -11.727   5.961  -9.462
  161    HG   SER  21           HG       SER  21 -13.236   5.590 -11.802
  162    H    LEU  22           H        LEU  22 -13.180   5.596  -7.460
  163    HA   LEU  22           HA       LEU  22 -14.677   3.183  -8.014
  164    HB2  LEU  22          1HB       LEU  22 -12.881   4.058  -5.770
  165    HB3  LEU  22          2HB       LEU  22 -13.778   2.537  -5.709
  166    HG   LEU  22           HG       LEU  22 -11.836   3.255  -7.901
  167   HD11  LEU  22          1HD1      LEU  22 -11.418   1.577  -5.432
  168   HD12  LEU  22          2HD1      LEU  22 -10.664   3.133  -5.770
  169   HD13  LEU  22          3HD1      LEU  22 -10.278   1.733  -6.770
  170   HD21  LEU  22          1HD2      LEU  22 -13.531   1.604  -8.499
  171   HD22  LEU  22          2HD2      LEU  22 -13.100   0.645  -7.082
  172   HD23  LEU  22          3HD2      LEU  22 -11.932   0.870  -8.385
  173    H    ASN  23           H        ASN  23 -15.699   6.056  -7.121
  174    HA   ASN  23           HA       ASN  23 -17.444   6.939  -5.956
  175    HB2  ASN  23          1HB       ASN  23 -18.457   4.112  -6.248
  176    HB3  ASN  23          2HB       ASN  23 -19.430   5.458  -5.686
  177   HD21  ASN  23          1HD2      ASN  23 -20.021   7.075  -7.122
  178   HD22  ASN  23          2HD2      ASN  23 -19.917   6.853  -8.838
  179    H    ILE  24           H        ILE  24 -15.248   6.052  -4.368
  180    HA   ILE  24           HA       ILE  24 -16.036   4.687  -2.036
  181    HB   ILE  24           HB       ILE  24 -13.913   6.826  -2.247
  182   HG12  ILE  24          1HG1      ILE  24 -13.609   5.087  -3.988
  183   HG13  ILE  24          2HG1      ILE  24 -12.330   5.048  -2.778
  184   HG21  ILE  24          1HG2      ILE  24 -14.461   6.209   0.037
  185   HG22  ILE  24          2HG2      ILE  24 -12.861   5.607  -0.393
  186   HG23  ILE  24          3HG2      ILE  24 -14.236   4.502  -0.350
  187   HD11  ILE  24          1HD1      ILE  24 -14.683   3.179  -2.969
  188   HD12  ILE  24          2HD1      ILE  24 -13.465   3.146  -1.694
  189   HD13  ILE  24          3HD1      ILE  24 -13.005   2.807  -3.363
  190    HA   PRO  25           HA       PRO  25 -18.675   7.866  -0.299
  191    HB2  PRO  25          1HB       PRO  25 -18.479   6.279   2.151
  192    HB3  PRO  25          2HB       PRO  25 -19.896   6.688   1.188
  193    HG2  PRO  25          1HG       PRO  25 -18.861   4.198   1.285
  194    HG3  PRO  25          2HG       PRO  25 -19.698   4.846  -0.136
  195    HD2  PRO  25          1HD       PRO  25 -16.773   4.478   0.341
  196    HD3  PRO  25          2HD       PRO  25 -17.710   4.308  -1.164
  197    H    ALA  26           H        ALA  26 -18.289   9.634   0.830
  198    HA   ALA  26           HA       ALA  26 -15.680  10.454   1.258
  199    HB1  ALA  26          1HB       ALA  26 -17.589  11.936   0.837
  200    HB2  ALA  26          2HB       ALA  26 -16.625  12.453   2.220
  201    HB3  ALA  26          3HB       ALA  26 -18.163  11.631   2.476
  202    H    ASP  27           H        ASP  27 -17.929   9.042   3.567
  203    HA   ASP  27           HA       ASP  27 -16.640   9.817   5.923
  204    HB2  ASP  27          1HB       ASP  27 -17.856   8.102   7.051
  205    HB3  ASP  27          2HB       ASP  27 -18.904   8.781   5.817
  206    H    TYR  28           H        TYR  28 -16.136   6.861   3.961
  207    HA   TYR  28           HA       TYR  28 -14.061   5.788   5.477
  208    HB2  TYR  28          1HB       TYR  28 -14.757   5.636   2.558
  209    HB3  TYR  28          2HB       TYR  28 -13.301   4.855   3.167
  210    HD1  TYR  28           HD1      TYR  28 -16.968   4.858   3.218
  211    HD2  TYR  28           HD2      TYR  28 -13.455   2.845   4.516
  212    HE1  TYR  28           HE1      TYR  28 -18.321   2.895   3.812
  213    HE2  TYR  28           HE2      TYR  28 -14.802   0.878   5.120
  214    HH   TYR  28           HH       TYR  28 -17.148   0.357   5.711
  215    H    VAL  29           H        VAL  29 -14.041   8.217   2.927
  216    HA   VAL  29           HA       VAL  29 -11.311   8.315   2.397
  217    HB   VAL  29           HB       VAL  29 -13.279  10.585   2.222
  218   HG11  VAL  29          1HG1      VAL  29 -10.633  10.109   0.864
  219   HG12  VAL  29          2HG1      VAL  29 -10.994  11.360   2.052
  220   HG13  VAL  29          3HG1      VAL  29 -11.754  11.410   0.462
  221   HG21  VAL  29          1HG2      VAL  29 -14.115   8.682   1.025
  222   HG22  VAL  29          2HG2      VAL  29 -12.546   8.427   0.263
  223   HG23  VAL  29          3HG2      VAL  29 -13.498   9.857  -0.138
  224    H    GLU  30           H        GLU  30 -13.236  10.264   4.674
  225    HA   GLU  30           HA       GLU  30 -11.099  11.828   5.657
  226    HB2  GLU  30          1HB       GLU  30 -13.407  11.014   7.394
  227    HB3  GLU  30          2HB       GLU  30 -12.544  12.546   7.325
  228    HG2  GLU  30          1HG       GLU  30 -13.541  13.017   5.163
  229    HG3  GLU  30          2HG       GLU  30 -14.416  11.490   5.234
  230    H    LYS  31           H        LYS  31 -12.325   8.666   6.509
  231    HA   LYS  31           HA       LYS  31 -10.910   8.500   8.966
  232    HB2  LYS  31          1HB       LYS  31 -12.417   6.925   9.340
  233    HB3  LYS  31          2HB       LYS  31 -13.009   7.129   7.695
  234    HG2  LYS  31          1HG       LYS  31 -11.564   5.370   6.911
  235    HG3  LYS  31          2HG       LYS  31 -10.813   5.224   8.503
  236    HD2  LYS  31          1HD       LYS  31 -13.728   4.732   7.870
  237    HD3  LYS  31          2HD       LYS  31 -12.506   3.472   8.113
  238    HE2  LYS  31          1HE       LYS  31 -12.177   4.244  10.422
  239    HE3  LYS  31          2HE       LYS  31 -13.372   5.516  10.173
  240    HZ1  LYS  31          1HZ       LYS  31 -14.347   3.647  11.311
  241    HZ2  LYS  31          2HZ       LYS  31 -13.887   2.594  10.073
  242    HZ3  LYS  31          3HZ       LYS  31 -15.038   3.795   9.777
  243    H    PHE  32           H        PHE  32 -10.117   7.708   5.663
  244    HA   PHE  32           HA       PHE  32  -7.992   5.911   6.215
  245    HB2  PHE  32          1HB       PHE  32  -8.381   7.714   3.822
  246    HB3  PHE  32          2HB       PHE  32  -7.220   6.399   3.931
  247    HD1  PHE  32           HD1      PHE  32  -9.752   7.032   2.067
  248    HD2  PHE  32           HD2      PHE  32  -8.905   4.329   5.242
  249    HE1  PHE  32           HE1      PHE  32 -11.411   5.457   1.166
  250    HE2  PHE  32           HE2      PHE  32 -10.563   2.754   4.342
  251    HZ   PHE  32           HZ       PHE  32 -11.814   3.310   2.299
  252    H    LYS  33           H        LYS  33  -8.258   9.392   6.114
  253    HA   LYS  33           HA       LYS  33  -5.460   9.911   6.004
  254    HB2  LYS  33          1HB       LYS  33  -7.400  11.506   5.425
  255    HB3  LYS  33          2HB       LYS  33  -7.483  11.807   7.160
  256    HG2  LYS  33          1HG       LYS  33  -5.241  12.625   7.205
  257    HG3  LYS  33          2HG       LYS  33  -4.985  12.154   5.520
  258    HD2  LYS  33          1HD       LYS  33  -7.019  14.193   6.419
  259    HD3  LYS  33          2HD       LYS  33  -5.399  14.596   5.862
  260    HE2  LYS  33          1HE       LYS  33  -5.891  13.526   3.708
  261    HE3  LYS  33          2HE       LYS  33  -7.520  13.162   4.269
  262    HZ1  LYS  33          1HZ       LYS  33  -6.377  15.883   3.960
  263    HZ2  LYS  33          2HZ       LYS  33  -7.949  15.525   4.467
  264    HZ3  LYS  33          3HZ       LYS  33  -7.460  15.149   2.891
  265    H    LYS  34           H        LYS  34  -7.593   8.979   8.530
  266    HA   LYS  34           HA       LYS  34  -5.775   9.815  10.628
  267    HB2  LYS  34          1HB       LYS  34  -8.397   8.348  10.626
  268    HB3  LYS  34          2HB       LYS  34  -7.383   8.343  12.061
  269    HG2  LYS  34          1HG       LYS  34  -8.894  10.071  12.420
  270    HG3  LYS  34          2HG       LYS  34  -7.433  10.892  11.871
  271    HD2  LYS  34          1HD       LYS  34  -8.362  11.063   9.623
  272    HD3  LYS  34          2HD       LYS  34  -9.810  10.200  10.146
  273    HE2  LYS  34          1HE       LYS  34 -10.233  12.016  11.785
  274    HE3  LYS  34          2HE       LYS  34  -8.859  12.893  11.110
  275    HZ1  LYS  34          1HZ       LYS  34 -11.365  12.154   9.713
  276    HZ2  LYS  34          2HZ       LYS  34 -10.018  12.816   8.941
  277    HZ3  LYS  34          3HZ       LYS  34 -10.843  13.712  10.111
  278    H    TRP  35           H        TRP  35  -5.399   7.718   8.384
  279    HA   TRP  35           HA       TRP  35  -4.275   5.809   8.012
  280    HB2  TRP  35          1HB       TRP  35  -3.241   6.420  10.777
  281    HB3  TRP  35          2HB       TRP  35  -2.603   5.119   9.762
  282    HD1  TRP  35           HD1      TRP  35  -2.338   8.818  10.354
  283    HE1  TRP  35           HE1      TRP  35  -0.640   9.838   8.706
  284    HE3  TRP  35           HE3      TRP  35  -1.757   4.829   7.216
  285    HZ2  TRP  35           HZ2      TRP  35   0.751   9.054   6.379
  286    HZ3  TRP  35           HZ3      TRP  35  -0.231   5.039   5.306
  287    HH2  TRP  35           HH2      TRP  35   1.001   7.104   4.891
  288    H    GLU  36           H        GLU  36  -6.899   5.396   8.720
  289    HA   GLU  36           HA       GLU  36  -6.658   2.827  10.127
  290    HB2  GLU  36          1HB       GLU  36  -8.985   4.746  10.227
  291    HB3  GLU  36          2HB       GLU  36  -8.984   3.128  10.915
  292    HG2  GLU  36          1HG       GLU  36  -7.075   3.819  12.348
  293    HG3  GLU  36          2HG       GLU  36  -7.282   5.456  11.736
  294    H    PHE  37           H        PHE  37  -6.807   1.299   8.675
  295    HA   PHE  37           HA       PHE  37  -8.628   1.681   6.389
  296    HB2  PHE  37          1HB       PHE  37  -6.146  -0.055   6.517
  297    HB3  PHE  37          2HB       PHE  37  -7.134   0.251   5.090
  298    HD1  PHE  37           HD1      PHE  37  -6.897   2.279   3.833
  299    HD2  PHE  37           HD2      PHE  37  -4.742   1.717   7.462
  300    HE1  PHE  37           HE1      PHE  37  -5.507   4.239   3.311
  301    HE2  PHE  37           HE2      PHE  37  -3.346   3.669   6.939
  302    HZ   PHE  37           HZ       PHE  37  -3.728   4.936   4.864
  303    HA   PRO  38           HA       PRO  38 -10.681  -1.731   8.662
  304    HB2  PRO  38          1HB       PRO  38 -12.772  -0.977   6.702
  305    HB3  PRO  38          2HB       PRO  38 -12.890  -1.211   8.455
  306    HG2  PRO  38          1HG       PRO  38 -12.968   1.237   7.425
  307    HG3  PRO  38          2HG       PRO  38 -12.077   0.911   8.923
  308    HD2  PRO  38          1HD       PRO  38 -11.009   1.235   6.135
  309    HD3  PRO  38          2HD       PRO  38 -10.379   1.897   7.671
  310    H    GLU  39           H        GLU  39 -11.019  -3.787   8.071
  311    HA   GLU  39           HA       GLU  39  -9.987  -4.622   5.525
  312    HB2  GLU  39          1HB       GLU  39  -9.455  -5.796   7.627
  313    HB3  GLU  39          2HB       GLU  39 -11.143  -6.240   7.797
  314    HG2  GLU  39          1HG       GLU  39 -11.046  -7.686   5.933
  315    HG3  GLU  39          2HG       GLU  39  -9.475  -7.051   5.439
  316    H    ASP  40           H        ASP  40 -11.530  -3.694   4.159
  317    HA   ASP  40           HA       ASP  40 -13.978  -5.240   3.828
  318    HB2  ASP  40          1HB       ASP  40 -14.728  -3.417   5.270
  319    HB3  ASP  40          2HB       ASP  40 -13.988  -2.229   4.201
  320    H    ASP  41           H        ASP  41 -14.809  -5.164   1.704
  321    HA   ASP  41           HA       ASP  41 -12.968  -5.143  -0.338
  322    HB2  ASP  41          1HB       ASP  41 -15.190  -6.178  -0.506
  323    HB3  ASP  41          2HB       ASP  41 -15.930  -4.584  -0.598
  324    H    THR  42           H        THR  42 -15.080  -2.478   0.654
  325    HA   THR  42           HA       THR  42 -14.679  -0.672  -1.399
  326    HB   THR  42           HB       THR  42 -14.846   0.077   1.517
  327    HG1  THR  42           HG1      THR  42 -16.518  -1.304   1.286
  328   HG21  THR  42          1HG2      THR  42 -15.825   1.412  -1.004
  329   HG22  THR  42          2HG2      THR  42 -14.479   1.942   0.006
  330   HG23  THR  42          3HG2      THR  42 -16.126   1.989   0.634
  331    H    THR  43           H        THR  43 -12.901  -0.753   1.680
  332    HA   THR  43           HA       THR  43 -10.964   1.155   1.058
  333    HB   THR  43           HB       THR  43 -10.605  -1.222   2.887
  334    HG1  THR  43           HG1      THR  43 -11.396   0.513   4.448
  335   HG21  THR  43          1HG2      THR  43  -8.557   0.032   2.558
  336   HG22  THR  43          2HG2      THR  43  -9.187   0.369   4.173
  337   HG23  THR  43          3HG2      THR  43  -9.398   1.548   2.878
  338    H    MET  44           H        MET  44 -11.151  -2.257   0.318
  339    HA   MET  44           HA       MET  44  -8.389  -2.676  -0.114
  340    HB2  MET  44          1HB       MET  44 -10.769  -4.247  -1.086
  341    HB3  MET  44          2HB       MET  44  -9.100  -4.795  -1.181
  342    HG2  MET  44          1HG       MET  44  -8.942  -4.695   1.257
  343    HG3  MET  44          2HG       MET  44 -10.618  -4.166   1.336
  344    HE1  MET  44          1HE       MET  44  -9.433  -6.595   2.950
  345    HE2  MET  44          2HE       MET  44 -10.707  -7.800   2.757
  346    HE3  MET  44          3HE       MET  44 -11.126  -6.111   3.051
  347    H    CYS  45           H        CYS  45 -11.067  -2.306  -2.460
  348    HA   CYS  45           HA       CYS  45  -9.372  -2.281  -4.716
  349    HB2  CYS  45          1HB       CYS  45 -12.150  -1.137  -4.354
  350    HB3  CYS  45          2HB       CYS  45 -11.307  -1.202  -5.897
  351    H    TYR  46           H        TYR  46 -10.381   0.195  -2.482
  352    HA   TYR  46           HA       TYR  46  -9.556   2.450  -3.908
  353    HB2  TYR  46          1HB       TYR  46 -10.864   2.835  -2.000
  354    HB3  TYR  46          2HB       TYR  46  -9.836   1.834  -0.975
  355    HD1  TYR  46           HD1      TYR  46  -8.296   2.869   0.413
  356    HD2  TYR  46           HD2      TYR  46  -9.744   4.981  -2.992
  357    HE1  TYR  46           HE1      TYR  46  -7.097   4.880   1.156
  358    HE2  TYR  46           HE2      TYR  46  -8.549   6.995  -2.249
  359    HH   TYR  46           HH       TYR  46  -6.394   6.947   0.539
  360    H    ILE  47           H        ILE  47  -7.820   0.460  -1.532
  361    HA   ILE  47           HA       ILE  47  -5.367   1.777  -1.632
  362    HB   ILE  47           HB       ILE  47  -6.024  -1.094  -1.011
  363   HG12  ILE  47          1HG1      ILE  47  -6.935   0.513   0.574
  364   HG13  ILE  47          2HG1      ILE  47  -5.614  -0.372   1.332
  365   HG21  ILE  47          1HG2      ILE  47  -3.371   0.305  -0.684
  366   HG22  ILE  47          2HG2      ILE  47  -3.724  -1.046  -1.762
  367   HG23  ILE  47          3HG2      ILE  47  -3.772  -1.277  -0.013
  368   HD11  ILE  47          1HD1      ILE  47  -5.389   1.887   1.976
  369   HD12  ILE  47          2HD1      ILE  47  -5.611   2.461   0.325
  370   HD13  ILE  47          3HD1      ILE  47  -4.138   1.597   0.769
  371    H    LYS  48           H        LYS  48  -6.669  -0.811  -3.641
  372    HA   LYS  48           HA       LYS  48  -4.283  -1.449  -4.977
  373    HB2  LYS  48          1HB       LYS  48  -6.445  -2.794  -4.898
  374    HB3  LYS  48          2HB       LYS  48  -7.055  -1.715  -6.140
  375    HG2  LYS  48          1HG       LYS  48  -4.454  -3.076  -6.602
  376    HG3  LYS  48          2HG       LYS  48  -5.932  -4.023  -6.731
  377    HD2  LYS  48          1HD       LYS  48  -5.500  -1.440  -8.214
  378    HD3  LYS  48          2HD       LYS  48  -5.063  -3.015  -8.878
  379    HE2  LYS  48          1HE       LYS  48  -7.446  -3.720  -8.479
  380    HE3  LYS  48          2HE       LYS  48  -7.804  -2.036  -8.101
  381    HZ1  LYS  48          1HZ       LYS  48  -7.063  -1.418 -10.312
  382    HZ2  LYS  48          2HZ       LYS  48  -8.304  -2.562 -10.405
  383    HZ3  LYS  48          3HZ       LYS  48  -6.698  -3.034 -10.675
  384    H    CYS  49           H        CYS  49  -6.996   0.653  -5.905
  385    HA   CYS  49           HA       CYS  49  -5.970   1.587  -8.311
  386    HB2  CYS  49          1HB       CYS  49  -8.234   2.027  -7.792
  387    HB3  CYS  49          2HB       CYS  49  -7.824   2.886  -6.310
  388    H    VAL  50           H        VAL  50  -5.571   2.932  -5.036
  389    HA   VAL  50           HA       VAL  50  -4.170   5.230  -5.779
  390    HB   VAL  50           HB       VAL  50  -4.243   3.702  -3.183
  391   HG11  VAL  50          1HG1      VAL  50  -3.310   5.703  -2.128
  392   HG12  VAL  50          2HG1      VAL  50  -3.080   6.433  -3.717
  393   HG13  VAL  50          3HG1      VAL  50  -2.173   4.986  -3.270
  394   HG21  VAL  50          1HG2      VAL  50  -6.356   4.628  -3.798
  395   HG22  VAL  50          2HG2      VAL  50  -5.615   6.184  -4.166
  396   HG23  VAL  50          3HG2      VAL  50  -5.672   5.608  -2.500
  397    H    PHE  51           H        PHE  51  -3.033   2.080  -4.639
  398    HA   PHE  51           HA       PHE  51  -0.302   2.690  -4.647
  399    HB2  PHE  51          1HB       PHE  51  -1.936   0.203  -4.557
  400    HB3  PHE  51          2HB       PHE  51  -0.217   0.044  -4.909
  401    HD1  PHE  51           HD1      PHE  51  -1.618   2.637  -2.706
  402    HD2  PHE  51           HD2      PHE  51   0.324  -1.144  -2.914
  403    HE1  PHE  51           HE1      PHE  51  -1.169   2.738  -0.289
  404    HE2  PHE  51           HE2      PHE  51   0.775  -1.046  -0.499
  405    HZ   PHE  51           HZ       PHE  51   0.031   0.894   0.816
  406    H    ASN  52           H        ASN  52  -2.504   1.796  -7.142
  407    HA   ASN  52           HA       ASN  52  -0.542   0.926  -9.050
  408    HB2  ASN  52          1HB       ASN  52  -2.870   0.115  -9.112
  409    HB3  ASN  52          2HB       ASN  52  -3.435   1.758  -9.428
  410   HD21  ASN  52          1HD2      ASN  52  -0.552   0.299 -10.835
  411   HD22  ASN  52          2HD2      ASN  52  -1.149   0.266 -12.459
  412    H    LYS  53           H        LYS  53  -2.323   3.888  -8.382
  413    HA   LYS  53           HA       LYS  53  -1.311   5.296 -10.660
  414    HB2  LYS  53          1HB       LYS  53  -2.885   6.040  -8.225
  415    HB3  LYS  53          2HB       LYS  53  -2.220   7.304  -9.253
  416    HG2  LYS  53          1HG       LYS  53  -3.487   6.426 -11.151
  417    HG3  LYS  53          2HG       LYS  53  -4.102   5.115 -10.143
  418    HD2  LYS  53          1HD       LYS  53  -5.259   6.701  -8.726
  419    HD3  LYS  53          2HD       LYS  53  -4.571   8.053  -9.629
  420    HE2  LYS  53          1HE       LYS  53  -6.871   7.631 -10.316
  421    HE3  LYS  53          2HE       LYS  53  -5.750   7.319 -11.638
  422    HZ1  LYS  53          1HZ       LYS  53  -5.943   4.975 -11.263
  423    HZ2  LYS  53          2HZ       LYS  53  -7.499   5.620 -11.404
  424    HZ3  LYS  53          3HZ       LYS  53  -6.890   5.215  -9.881
  425    H    MET  54           H        MET  54  -0.146   4.629  -7.512
  426    HA   MET  54           HA       MET  54   1.743   6.830  -7.509
  427    HB2  MET  54          1HB       MET  54   1.167   4.594  -5.582
  428    HB3  MET  54          2HB       MET  54   2.525   5.694  -5.368
  429    HG2  MET  54          1HG       MET  54   1.111   7.535  -5.088
  430    HG3  MET  54          2HG       MET  54  -0.292   6.657  -5.688
  431    HE1  MET  54          1HE       MET  54   2.501   5.863  -2.888
  432    HE2  MET  54          2HE       MET  54   1.552   6.398  -1.498
  433    HE3  MET  54          3HE       MET  54   1.971   7.539  -2.769
  434    H    GLN  55           H        GLN  55   1.661   4.201  -9.275
  435    HA   GLN  55           HA       GLN  55   3.110   2.793 -10.268
  436    HB2  GLN  55          1HB       GLN  55   4.804   5.162  -9.629
  437    HB3  GLN  55          2HB       GLN  55   5.584   3.726 -10.286
  438    HG2  GLN  55          1HG       GLN  55   5.122   5.213 -12.077
  439    HG3  GLN  55          2HG       GLN  55   4.007   3.858 -12.209
  440   HE21  GLN  55          1HE2      GLN  55   4.328   7.237 -11.422
  441   HE22  GLN  55          2HE2      GLN  55   2.641   7.618 -11.501
  442    H    LEU  56           H        LEU  56   2.506   2.041  -7.699
  443    HA   LEU  56           HA       LEU  56   5.067   1.091  -6.640
  444    HB2  LEU  56          1HB       LEU  56   2.822   2.464  -5.354
  445    HB3  LEU  56          2HB       LEU  56   3.357   1.023  -4.475
  446    HG   LEU  56           HG       LEU  56   5.076   3.372  -5.277
  447   HD11  LEU  56          1HD1      LEU  56   3.504   3.979  -3.529
  448   HD12  LEU  56          2HD1      LEU  56   5.129   3.845  -2.864
  449   HD13  LEU  56          3HD1      LEU  56   3.961   2.555  -2.597
  450   HD21  LEU  56          1HD2      LEU  56   6.703   2.298  -3.714
  451   HD22  LEU  56          2HD2      LEU  56   6.432   1.410  -5.212
  452   HD23  LEU  56          3HD2      LEU  56   5.668   0.872  -3.715
  453    H    PHE  57           H        PHE  57   1.930   0.328  -7.710
  454    HA   PHE  57           HA       PHE  57   2.403  -2.514  -7.239
  455    HB2  PHE  57          1HB       PHE  57   0.926  -1.904  -5.409
  456    HB3  PHE  57          2HB       PHE  57  -0.131  -1.022  -6.497
  457    HD1  PHE  57           HD1      PHE  57   0.896  -4.346  -5.341
  458    HD2  PHE  57           HD2      PHE  57  -1.759  -2.157  -7.849
  459    HE1  PHE  57           HE1      PHE  57  -0.507  -6.348  -5.605
  460    HE2  PHE  57           HE2      PHE  57  -3.158  -4.160  -8.119
  461    HZ   PHE  57           HZ       PHE  57  -2.535  -6.257  -6.995
  462    H    ASP  58           H        ASP  58   1.897  -3.711  -8.959
  463    HA   ASP  58           HA       ASP  58   0.649  -2.349 -11.243
  464    HB2  ASP  58          1HB       ASP  58   2.870  -3.301 -11.678
  465    HB3  ASP  58          2HB       ASP  58   2.318  -4.880 -11.139
  466    H    ASP  59           H        ASP  59  -1.218  -3.056 -12.082
  467    HA   ASP  59           HA       ASP  59  -3.024  -4.353 -10.371
  468    HB2  ASP  59          1HB       ASP  59  -3.731  -2.722 -12.033
  469    HB3  ASP  59          2HB       ASP  59  -3.241  -3.789 -13.331
  470    H    THR  60           H        THR  60  -0.830  -5.643 -12.666
  471    HA   THR  60           HA       THR  60  -2.231  -8.224 -12.646
  472    HB   THR  60           HB       THR  60  -0.277  -7.012 -14.579
  473    HG1  THR  60           HG1      THR  60  -3.015  -7.611 -14.545
  474   HG21  THR  60          1HG2      THR  60  -0.391  -9.096 -15.857
  475   HG22  THR  60          2HG2      THR  60  -1.339  -9.838 -14.568
  476   HG23  THR  60          3HG2      THR  60   0.330  -9.352 -14.269
  477    H    GLU  61           H        GLU  61   1.065  -6.843 -12.559
  478    HA   GLU  61           HA       GLU  61   2.172  -9.390 -11.719
  479    HB2  GLU  61          1HB       GLU  61   3.653  -6.780 -12.004
  480    HB3  GLU  61          2HB       GLU  61   4.300  -8.416 -12.033
  481    HG2  GLU  61          1HG       GLU  61   3.079  -8.865 -14.103
  482    HG3  GLU  61          2HG       GLU  61   2.499  -7.203 -14.101
  483    H    GLY  62           H        GLY  62   0.721  -6.936 -10.011
  484    HA2  GLY  62          1HA       GLY  62   0.385  -6.990  -7.705
  485    HA3  GLY  62          2HA       GLY  62   1.689  -8.169  -7.575
  486    HA   PRO  63           HA       PRO  63   3.203  -4.307  -5.547
  487    HB2  PRO  63          1HB       PRO  63   4.827  -6.292  -4.085
  488    HB3  PRO  63          2HB       PRO  63   3.779  -5.013  -3.460
  489    HG2  PRO  63          1HG       PRO  63   3.114  -7.621  -3.313
  490    HG3  PRO  63          2HG       PRO  63   1.908  -6.335  -3.504
  491    HD2  PRO  63          1HD       PRO  63   2.995  -8.242  -5.541
  492    HD3  PRO  63          2HD       PRO  63   1.346  -7.584  -5.368
  493    H    LEU  64           H        LEU  64   4.829  -3.218  -6.409
  494    HA   LEU  64           HA       LEU  64   6.936  -4.682  -7.810
  495    HB2  LEU  64          1HB       LEU  64   6.420  -1.705  -7.801
  496    HB3  LEU  64          2HB       LEU  64   7.457  -2.600  -8.895
  497    HG   LEU  64           HG       LEU  64   4.455  -2.892  -8.758
  498   HD11  LEU  64          1HD1      LEU  64   4.451  -1.786 -10.933
  499   HD12  LEU  64          2HD1      LEU  64   6.190  -1.535 -10.814
  500   HD13  LEU  64          3HD1      LEU  64   5.104  -0.734  -9.680
  501   HD21  LEU  64          1HD2      LEU  64   4.696  -4.261 -10.741
  502   HD22  LEU  64          2HD2      LEU  64   5.636  -4.940  -9.410
  503   HD23  LEU  64          3HD2      LEU  64   6.448  -4.050 -10.697
  504    H    VAL  65           H        VAL  65   8.244  -5.391  -6.287
  505    HA   VAL  65           HA       VAL  65   8.800  -4.339  -3.822
  506    HB   VAL  65           HB       VAL  65  10.532  -6.092  -5.546
  507   HG11  VAL  65          1HG1      VAL  65  11.892  -5.065  -3.820
  508   HG12  VAL  65          2HG1      VAL  65  11.630  -6.772  -3.455
  509   HG13  VAL  65          3HG1      VAL  65  10.720  -5.535  -2.588
  510   HG21  VAL  65          1HG2      VAL  65   8.516  -6.685  -3.394
  511   HG22  VAL  65          2HG2      VAL  65   9.589  -7.884  -4.117
  512   HG23  VAL  65          3HG2      VAL  65   8.385  -7.066  -5.110
  513    H    ASP  66           H        ASP  66  10.624  -3.814  -6.821
  514    HA   ASP  66           HA       ASP  66  12.827  -2.506  -5.707
  515    HB2  ASP  66          1HB       ASP  66  11.571  -2.083  -8.423
  516    HB3  ASP  66          2HB       ASP  66  13.194  -1.585  -7.957
  517    H    ASN  67           H        ASN  67   9.921  -1.070  -7.184
  518    HA   ASN  67           HA       ASN  67  10.528   1.592  -6.545
  519    HB2  ASN  67          1HB       ASN  67   7.897   0.217  -7.081
  520    HB3  ASN  67          2HB       ASN  67   8.047   1.953  -6.846
  521   HD21  ASN  67          1HD2      ASN  67   7.262   2.313  -8.918
  522   HD22  ASN  67          2HD2      ASN  67   8.247   2.071 -10.324
  523    H    LEU  68           H        LEU  68   8.908  -0.945  -4.790
  524    HA   LEU  68           HA       LEU  68   7.782   0.556  -2.725
  525    HB2  LEU  68          1HB       LEU  68   8.606  -2.298  -3.039
  526    HB3  LEU  68          2HB       LEU  68   8.115  -1.713  -1.458
  527    HG   LEU  68           HG       LEU  68   6.380  -1.337  -3.883
  528   HD11  LEU  68          1HD1      LEU  68   5.161  -3.347  -3.221
  529   HD12  LEU  68          2HD1      LEU  68   6.360  -3.666  -1.964
  530   HD13  LEU  68          3HD1      LEU  68   6.825  -3.728  -3.664
  531   HD21  LEU  68          1HD2      LEU  68   4.621  -1.164  -2.205
  532   HD22  LEU  68          2HD2      LEU  68   5.891   0.026  -1.924
  533   HD23  LEU  68          3HD2      LEU  68   5.810  -1.427  -0.930
  534    H    VAL  69           H        VAL  69  10.973  -0.963  -2.973
  535    HA   VAL  69           HA       VAL  69  11.854  -0.186  -0.380
  536    HB   VAL  69           HB       VAL  69  13.488  -0.874  -2.815
  537   HG11  VAL  69          1HG1      VAL  69  14.822   0.267  -1.160
  538   HG12  VAL  69          2HG1      VAL  69  15.229  -1.449  -1.160
  539   HG13  VAL  69          3HG1      VAL  69  14.198  -0.785   0.109
  540   HG21  VAL  69          1HG2      VAL  69  12.599  -2.630  -0.538
  541   HG22  VAL  69          2HG2      VAL  69  13.576  -3.112  -1.927
  542   HG23  VAL  69          3HG2      VAL  69  11.895  -2.632  -2.156
  543    H    HIS  70           H        HIS  70  12.170   1.245  -3.611
  544    HA   HIS  70           HA       HIS  70  13.889   3.357  -2.919
  545    HB2  HIS  70          1HB       HIS  70  11.875   3.007  -5.117
  546    HB3  HIS  70          2HB       HIS  70  12.708   4.542  -4.905
  547    HD1  HIS  70           HD1      HIS  70  15.241   4.614  -5.451
  548    HD2  HIS  70           HD2      HIS  70  13.446   0.927  -6.136
  549    HE1  HIS  70           HE1      HIS  70  16.895   3.294  -6.806
  550    HE2  HIS  70           HE2      HIS  70  15.727   1.127  -7.333
  551    H    GLN  71           H        GLN  71  10.467   2.954  -2.494
  552    HA   GLN  71           HA       GLN  71  10.039   5.752  -1.833
  553    HB2  GLN  71          1HB       GLN  71   8.395   4.271  -3.096
  554    HB3  GLN  71          2HB       GLN  71   8.076   3.487  -1.552
  555    HG2  GLN  71          1HG       GLN  71   6.404   5.188  -2.071
  556    HG3  GLN  71          2HG       GLN  71   7.301   5.554  -0.601
  557   HE21  GLN  71          1HE2      GLN  71   8.582   7.340  -0.514
  558   HE22  GLN  71          2HE2      GLN  71   8.607   8.548  -1.746
  559    H    LEU  72           H        LEU  72   9.639   2.636  -0.170
  560    HA   LEU  72           HA       LEU  72   8.971   3.806   2.303
  561    HB2  LEU  72          1HB       LEU  72   9.868   1.020   1.605
  562    HB3  LEU  72          2HB       LEU  72   9.348   1.491   3.209
  563    HG   LEU  72           HG       LEU  72   7.618   1.705   0.744
  564   HD11  LEU  72          1HD1      LEU  72   8.152  -0.633   1.239
  565   HD12  LEU  72          2HD1      LEU  72   6.462  -0.274   1.600
  566   HD13  LEU  72          3HD1      LEU  72   7.639  -0.399   2.910
  567   HD21  LEU  72          1HD2      LEU  72   6.899   3.247   2.427
  568   HD22  LEU  72          2HD2      LEU  72   7.050   2.020   3.687
  569   HD23  LEU  72          3HD2      LEU  72   5.800   1.865   2.451
  570    H    ALA  73           H        ALA  73  12.031   2.376   1.153
  571    HA   ALA  73           HA       ALA  73  13.296   2.537   3.692
  572    HB1  ALA  73          1HB       ALA  73  14.554   2.137   0.998
  573    HB2  ALA  73          2HB       ALA  73  13.848   0.867   1.993
  574    HB3  ALA  73          3HB       ALA  73  15.263   1.750   2.565
  575    H    HIS  74           H        HIS  74  12.352   5.167   2.792
  576    HA   HIS  74           HA       HIS  74  14.686   6.707   2.148
  577    HB2  HIS  74          1HB       HIS  74  11.871   7.351   2.906
  578    HB3  HIS  74          2HB       HIS  74  13.094   8.599   3.125
  579    HD1  HIS  74           HD1      HIS  74  10.919   7.114   0.615
  580    HD2  HIS  74           HD2      HIS  74  14.478   9.263   0.624
  581    HE1  HIS  74           HE1      HIS  74  11.176   8.013  -1.719
  582    HE2  HIS  74           HE2      HIS  74  13.458   9.077  -1.743
  583    H    GLY  75           H        GLY  75  16.328   6.653   3.537
  584    HA2  GLY  75          1HA       GLY  75  17.424   7.467   5.436
  585    HA3  GLY  75          2HA       GLY  75  15.866   7.677   6.222
  586    H    ARG  76           H        ARG  76  16.416   4.640   4.707
  587    HA   ARG  76           HA       ARG  76  17.345   3.414   7.173
  588    HB2  ARG  76          1HB       ARG  76  14.589   3.179   6.142
  589    HB3  ARG  76          2HB       ARG  76  15.343   1.675   6.663
  590    HG2  ARG  76          1HG       ARG  76  15.898   2.872   8.819
  591    HG3  ARG  76          2HG       ARG  76  14.807   4.148   8.280
  592    HD2  ARG  76          1HD       ARG  76  12.981   2.573   8.167
  593    HD3  ARG  76          2HD       ARG  76  14.057   1.249   8.598
  594    HE   ARG  76           HE       ARG  76  13.722   3.490  10.455
  595   HH11  ARG  76          1HH1      ARG  76  13.184   0.120   9.668
  596   HH12  ARG  76          2HH1      ARG  76  12.828  -0.335  11.301
  597   HH21  ARG  76          1HH2      ARG  76  13.227   2.895  12.609
  598   HH22  ARG  76          2HH2      ARG  76  12.851   1.241  12.973
  599    H    ASP  77           H        ASP  77  17.725   1.057   6.909
  600    HA   ASP  77           HA       ASP  77  19.303   0.526   4.652
  601    HB2  ASP  77          1HB       ASP  77  18.227  -1.243   6.834
  602    HB3  ASP  77          2HB       ASP  77  19.221  -1.873   5.525
  603    H    ALA  78           H        ALA  78  18.559   0.371   2.711
  604    HA   ALA  78           HA       ALA  78  16.024  -0.353   1.855
  605    HB1  ALA  78          1HB       ALA  78  18.632  -0.677   0.383
  606    HB2  ALA  78          2HB       ALA  78  17.681   0.805   0.479
  607    HB3  ALA  78          3HB       ALA  78  17.026  -0.611  -0.344
  608    H    GLU  79           H        GLU  79  18.814  -2.331   2.565
  609    HA   GLU  79           HA       GLU  79  18.039  -4.737   1.366
  610    HB2  GLU  79          1HB       GLU  79  19.685  -4.271   3.853
  611    HB3  GLU  79          2HB       GLU  79  19.593  -5.792   2.976
  612    HG2  GLU  79          1HG       GLU  79  20.604  -4.795   1.044
  613    HG3  GLU  79          2HG       GLU  79  20.580  -3.206   1.806
  614    H    GLU  80           H        GLU  80  17.522  -3.561   4.681
  615    HA   GLU  80           HA       GLU  80  16.089  -5.857   5.532
  616    HB2  GLU  80          1HB       GLU  80  16.359  -3.078   6.649
  617    HB3  GLU  80          2HB       GLU  80  15.394  -4.324   7.430
  618    HG2  GLU  80          1HG       GLU  80  18.325  -4.555   6.812
  619    HG3  GLU  80          2HG       GLU  80  17.656  -4.107   8.374
  620    H    VAL  81           H        VAL  81  15.113  -2.621   4.467
  621    HA   VAL  81           HA       VAL  81  12.367  -2.867   4.732
  622    HB   VAL  81           HB       VAL  81  13.974  -1.336   2.695
  623   HG11  VAL  81          1HG1      VAL  81  11.755  -1.647   1.779
  624   HG12  VAL  81          2HG1      VAL  81  11.908   0.011   2.364
  625   HG13  VAL  81          3HG1      VAL  81  11.023  -1.185   3.314
  626   HG21  VAL  81          1HG2      VAL  81  13.411   0.555   4.165
  627   HG22  VAL  81          2HG2      VAL  81  14.372  -0.684   4.967
  628   HG23  VAL  81          3HG2      VAL  81  12.639  -0.573   5.279
  629    H    ARG  82           H        ARG  82  14.382  -3.672   1.890
  630    HA   ARG  82           HA       ARG  82  12.365  -4.626   0.227
  631    HB2  ARG  82          1HB       ARG  82  14.808  -4.207  -0.328
  632    HB3  ARG  82          2HB       ARG  82  15.138  -5.793   0.354
  633    HG2  ARG  82          1HG       ARG  82  13.713  -6.842  -1.266
  634    HG3  ARG  82          2HG       ARG  82  13.246  -5.273  -1.908
  635    HD2  ARG  82          1HD       ARG  82  15.719  -4.903  -2.362
  636    HD3  ARG  82          2HD       ARG  82  15.913  -6.628  -2.063
  637    HE   ARG  82           HE       ARG  82  14.442  -7.043  -3.948
  638   HH11  ARG  82          1HH1      ARG  82  15.768  -3.806  -3.662
  639   HH12  ARG  82          2HH1      ARG  82  15.498  -3.412  -5.327
  640   HH21  ARG  82          1HH2      ARG  82  14.082  -6.521  -6.141
  641   HH22  ARG  82          2HH2      ARG  82  14.522  -4.948  -6.744
  642    H    THR  83           H        THR  83  14.243  -6.260   2.713
  643    HA   THR  83           HA       THR  83  13.333  -8.871   2.253
  644    HB   THR  83           HB       THR  83  14.438  -7.483   4.686
  645    HG1  THR  83           HG1      THR  83  16.056  -7.830   3.299
  646   HG21  THR  83          1HG2      THR  83  12.998  -9.263   5.511
  647   HG22  THR  83          2HG2      THR  83  14.692  -9.704   5.726
  648   HG23  THR  83          3HG2      THR  83  13.758 -10.413   4.411
  649    H    GLU  84           H        GLU  84  12.267  -6.476   4.687
  650    HA   GLU  84           HA       GLU  84  10.124  -7.923   5.710
  651    HB2  GLU  84          1HB       GLU  84  10.392  -4.923   5.493
  652    HB3  GLU  84          2HB       GLU  84   9.311  -5.790   6.576
  653    HG2  GLU  84          1HG       GLU  84  11.271  -6.819   7.650
  654    HG3  GLU  84          2HG       GLU  84  12.316  -5.842   6.624
  655    H    VAL  85           H        VAL  85  10.196  -5.630   2.985
  656    HA   VAL  85           HA       VAL  85   7.487  -5.648   2.345
  657    HB   VAL  85           HB       VAL  85   9.945  -5.342   0.630
  658   HG11  VAL  85          1HG1      VAL  85   8.474  -4.602  -1.196
  659   HG12  VAL  85          2HG1      VAL  85   7.069  -5.093  -0.246
  660   HG13  VAL  85          3HG1      VAL  85   8.230  -6.303  -0.796
  661   HG21  VAL  85          1HG2      VAL  85   7.817  -3.419   1.556
  662   HG22  VAL  85          2HG2      VAL  85   9.183  -3.014   0.513
  663   HG23  VAL  85          3HG2      VAL  85   9.467  -3.540   2.174
  664    H    LEU  86           H        LEU  86  10.082  -7.802   1.200
  665    HA   LEU  86           HA       LEU  86   8.549  -9.358  -0.532
  666    HB2  LEU  86          1HB       LEU  86  11.064  -9.973   1.009
  667    HB3  LEU  86          2HB       LEU  86  10.362 -11.082  -0.167
  668    HG   LEU  86           HG       LEU  86  11.135  -8.265  -0.873
  669   HD11  LEU  86          1HD1      LEU  86  12.786 -10.770  -1.159
  670   HD12  LEU  86          2HD1      LEU  86  13.095  -9.465  -0.013
  671   HD13  LEU  86          3HD1      LEU  86  13.213  -9.163  -1.747
  672   HD21  LEU  86          1HD2      LEU  86   9.586  -9.332  -2.393
  673   HD22  LEU  86          2HD2      LEU  86  10.619 -10.756  -2.487
  674   HD23  LEU  86          3HD2      LEU  86  11.176  -9.218  -3.146
  675    H    LYS  87           H        LYS  87   8.946  -9.540   2.935
  676    HA   LYS  87           HA       LYS  87   7.789 -12.138   3.249
  677    HB2  LYS  87          1HB       LYS  87   8.208  -9.844   5.166
  678    HB3  LYS  87          2HB       LYS  87   7.471 -11.365   5.650
  679    HG2  LYS  87          1HG       LYS  87   9.484 -12.568   5.076
  680    HG3  LYS  87          2HG       LYS  87  10.232 -11.077   4.477
  681    HD2  LYS  87          1HD       LYS  87  10.175 -10.121   6.696
  682    HD3  LYS  87          2HD       LYS  87   9.306 -11.525   7.313
  683    HE2  LYS  87          1HE       LYS  87  12.086 -11.575   6.146
  684    HE3  LYS  87          2HE       LYS  87  11.707 -11.568   7.867
  685    HZ1  LYS  87          1HZ       LYS  87  12.155 -13.802   7.075
  686    HZ2  LYS  87          2HZ       LYS  87  10.918 -13.679   5.933
  687    HZ3  LYS  87          3HZ       LYS  87  10.547 -13.671   7.582
  688    H    CYS  88           H        CYS  88   6.552  -9.083   2.537
  689    HA   CYS  88           HA       CYS  88   3.871  -9.802   3.459
  690    HB2  CYS  88          1HB       CYS  88   5.189  -7.190   2.794
  691    HB3  CYS  88          2HB       CYS  88   3.420  -7.321   2.852
  692    H    VAL  89           H        VAL  89   5.839  -9.586   0.695
  693    HA   VAL  89           HA       VAL  89   3.770  -9.270  -1.250
  694    HB   VAL  89           HB       VAL  89   6.549 -10.422  -1.542
  695   HG11  VAL  89          1HG1      VAL  89   4.520  -9.606  -3.614
  696   HG12  VAL  89          2HG1      VAL  89   5.122 -11.235  -3.309
  697   HG13  VAL  89          3HG1      VAL  89   6.204 -10.003  -3.960
  698   HG21  VAL  89          1HG2      VAL  89   7.082  -8.250  -2.568
  699   HG22  VAL  89          2HG2      VAL  89   6.607  -8.094  -0.878
  700   HG23  VAL  89          3HG2      VAL  89   5.464  -7.678  -2.159
  701    H    ASP  90           H        ASP  90   2.450 -10.746  -2.019
  702    HA   ASP  90           HA       ASP  90   2.992 -13.579  -1.512
  703    HB2  ASP  90          1HB       ASP  90   1.352 -12.516   0.146
  704    HB3  ASP  90          2HB       ASP  90   0.252 -12.359  -1.227
  705    H    LYS  91           H        LYS  91   1.665 -15.001  -2.891
  706    HA   LYS  91           HA       LYS  91   1.557 -14.063  -5.614
  707    HB2  LYS  91          1HB       LYS  91   0.521 -16.699  -4.589
  708    HB3  LYS  91          2HB       LYS  91   1.135 -16.312  -6.191
  709    HG2  LYS  91          1HG       LYS  91   3.368 -16.125  -5.343
  710    HG3  LYS  91          2HG       LYS  91   2.793 -16.372  -3.696
  711    HD2  LYS  91          1HD       LYS  91   2.009 -18.610  -4.307
  712    HD3  LYS  91          2HD       LYS  91   2.597 -18.363  -5.950
  713    HE2  LYS  91          1HE       LYS  91   4.340 -18.265  -3.498
  714    HE3  LYS  91          2HE       LYS  91   4.120 -19.700  -4.495
  715    HZ1  LYS  91          1HZ       LYS  91   5.222 -17.110  -5.439
  716    HZ2  LYS  91          2HZ       LYS  91   5.045 -18.509  -6.372
  717    HZ3  LYS  91          3HZ       LYS  91   6.131 -18.489  -5.075
  718    H    ASN  92           H        ASN  92  -0.372 -14.237  -6.948
  719    HA   ASN  92           HA       ASN  92  -2.655 -13.137  -5.546
  720    HB2  ASN  92          1HB       ASN  92  -1.857 -12.255  -7.761
  721    HB3  ASN  92          2HB       ASN  92  -2.413 -13.755  -8.488
  722   HD21  ASN  92          1HD2      ASN  92  -3.794 -12.437  -9.790
  723   HD22  ASN  92          2HD2      ASN  92  -5.300 -11.857  -9.162
  724    H    THR  93           H        THR  93  -2.520 -15.432  -4.470
  725    HA   THR  93           HA       THR  93  -4.033 -17.480  -5.804
  726    HB   THR  93           HB       THR  93  -4.120 -18.489  -3.492
  727    HG1  THR  93           HG1      THR  93  -2.216 -17.125  -2.308
  728   HG21  THR  93          1HG2      THR  93  -1.706 -18.991  -3.420
  729   HG22  THR  93          2HG2      THR  93  -1.433 -17.709  -4.599
  730   HG23  THR  93          3HG2      THR  93  -2.387 -19.123  -5.040
  731    H    ASP  94           H        ASP  94  -4.732 -14.605  -4.208
  732    HA   ASP  94           HA       ASP  94  -7.340 -15.287  -3.232
  733    HB2  ASP  94          1HB       ASP  94  -5.899 -13.459  -2.287
  734    HB3  ASP  94          2HB       ASP  94  -6.178 -12.542  -3.771
  735    H    ASN  95           H        ASN  95  -5.940 -14.323  -6.178
  736    HA   ASN  95           HA       ASN  95  -6.687 -14.003  -8.271
  737    HB2  ASN  95          1HB       ASN  95  -9.139 -15.367  -7.173
  738    HB3  ASN  95          2HB       ASN  95  -8.902 -14.992  -8.870
  739   HD21  ASN  95          1HD2      ASN  95  -9.243 -17.543  -7.551
  740   HD22  ASN  95          2HD2      ASN  95  -7.843 -18.489  -7.955
  741    H    ASN  96           H        ASN  96  -7.140 -11.941  -6.213
  742    HA   ASN  96           HA       ASN  96  -8.947 -10.299  -7.792
  743    HB2  ASN  96          1HB       ASN  96 -10.463 -11.122  -6.131
  744    HB3  ASN  96          2HB       ASN  96  -9.303 -10.834  -4.837
  745   HD21  ASN  96          1HD2      ASN  96 -11.639  -9.434  -6.969
  746   HD22  ASN  96          2HD2      ASN  96 -11.716  -7.889  -6.195
  747    H    ALA  97           H        ALA  97  -8.018  -8.405  -8.150
  748    HA   ALA  97           HA       ALA  97  -5.435  -7.845  -7.187
  749    HB1  ALA  97          1HB       ALA  97  -7.339  -6.018  -8.643
  750    HB2  ALA  97          2HB       ALA  97  -6.220  -7.155  -9.394
  751    HB3  ALA  97          3HB       ALA  97  -5.599  -5.786  -8.473
  752    H    CYS  98           H        CYS  98  -8.608  -6.650  -6.208
  753    HA   CYS  98           HA       CYS  98  -7.687  -4.433  -4.708
  754    HB2  CYS  98          1HB       CYS  98 -10.204  -6.053  -4.271
  755    HB3  CYS  98          2HB       CYS  98  -9.880  -4.446  -3.632
  756    H    HIS  99           H        HIS  99  -8.428  -7.785  -3.746
  757    HA   HIS  99           HA       HIS  99  -7.740  -7.217  -1.004
  758    HB2  HIS  99          1HB       HIS  99  -9.460  -8.938  -1.786
  759    HB3  HIS  99          2HB       HIS  99  -8.094  -9.949  -2.237
  760    HD1  HIS  99           HD1      HIS  99  -8.517 -11.778  -0.526
  761    HD2  HIS  99           HD2      HIS  99  -8.158  -7.991   1.174
  762    HE1  HIS  99           HE1      HIS  99  -8.394 -12.150   1.962
  763    HE2  HIS  99           HE2      HIS  99  -8.252  -9.846   2.972
  764    H    TRP 100           H        TRP 100  -6.150  -8.382  -3.843
  765    HA   TRP 100           HA       TRP 100  -3.944  -9.649  -2.636
  766    HB2  TRP 100          1HB       TRP 100  -4.543  -9.859  -5.043
  767    HB3  TRP 100          2HB       TRP 100  -3.999  -8.201  -5.297
  768    HD1  TRP 100           HD1      TRP 100  -1.747  -9.987  -2.943
  769    HE1  TRP 100           HE1      TRP 100   0.389 -10.737  -4.151
  770    HE3  TRP 100           HE3      TRP 100  -3.208  -9.174  -7.773
  771    HZ2  TRP 100           HZ2      TRP 100   1.339 -10.964  -6.792
  772    HZ3  TRP 100           HZ3      TRP 100  -1.626  -9.689  -9.578
  773    HH2  TRP 100           HH2      TRP 100   0.598 -10.567  -9.106
  774    H    ALA 101           H        ALA 101  -4.209  -6.369  -4.019
  775    HA   ALA 101           HA       ALA 101  -1.713  -5.448  -3.123
  776    HB1  ALA 101          1HB       ALA 101  -3.002  -4.319  -4.858
  777    HB2  ALA 101          2HB       ALA 101  -2.593  -3.207  -3.548
  778    HB3  ALA 101          3HB       ALA 101  -4.222  -3.871  -3.668
  779    H    PHE 102           H        PHE 102  -4.885  -5.497  -1.644
  780    HA   PHE 102           HA       PHE 102  -4.264  -3.827   0.525
  781    HB2  PHE 102          1HB       PHE 102  -6.555  -4.303  -0.218
  782    HB3  PHE 102          2HB       PHE 102  -6.398  -5.954   0.376
  783    HD1  PHE 102           HD1      PHE 102  -6.877  -6.447   2.626
  784    HD2  PHE 102           HD2      PHE 102  -6.321  -2.400   1.425
  785    HE1  PHE 102           HE1      PHE 102  -7.635  -5.689   4.840
  786    HE2  PHE 102           HE2      PHE 102  -7.079  -1.636   3.637
  787    HZ   PHE 102           HZ       PHE 102  -7.735  -3.279   5.349
  788    H    ARG 103           H        ARG 103  -3.878  -7.279  -0.028
  789    HA   ARG 103           HA       ARG 103  -3.394  -8.001   2.675
  790    HB2  ARG 103          1HB       ARG 103  -2.701  -9.335   0.076
  791    HB3  ARG 103          2HB       ARG 103  -2.165  -9.989   1.613
  792    HG2  ARG 103          1HG       ARG 103  -4.529 -10.075   2.338
  793    HG3  ARG 103          2HG       ARG 103  -5.004  -9.551   0.727
  794    HD2  ARG 103          1HD       ARG 103  -3.496 -12.063   1.403
  795    HD3  ARG 103          2HD       ARG 103  -5.192 -11.966   0.946
  796    HE   ARG 103           HE       ARG 103  -4.208 -10.963  -1.215
  797   HH11  ARG 103          1HH1      ARG 103  -2.753 -13.481   0.716
  798   HH12  ARG 103          2HH1      ARG 103  -1.894 -14.199  -0.618
  799   HH21  ARG 103          1HH2      ARG 103  -3.125 -11.941  -3.000
  800   HH22  ARG 103          2HH2      ARG 103  -2.125 -13.338  -2.732
  801    H    GLY 104           H        GLY 104  -1.312  -7.019   0.013
  802    HA2  GLY 104          1HA       GLY 104   1.163  -7.389   1.340
  803    HA3  GLY 104          2HA       GLY 104   0.876  -6.321  -0.039
  804    H    PHE 105           H        PHE 105  -0.915  -4.543   0.949
  805    HA   PHE 105           HA       PHE 105   0.717  -2.757   2.362
  806    HB2  PHE 105          1HB       PHE 105  -0.941  -1.866   0.910
  807    HB3  PHE 105          2HB       PHE 105  -2.221  -2.756   1.716
  808    HD1  PHE 105           HD1      PHE 105  -3.695  -1.238   2.658
  809    HD2  PHE 105           HD2      PHE 105   0.494  -0.537   2.977
  810    HE1  PHE 105           HE1      PHE 105  -4.134   0.740   4.047
  811    HE2  PHE 105           HE2      PHE 105   0.055   1.445   4.368
  812    HZ   PHE 105           HZ       PHE 105  -2.260   2.084   4.904
  813    H    LYS 106           H        LYS 106  -2.036  -4.732   3.353
  814    HA   LYS 106           HA       LYS 106  -2.307  -3.807   5.968
  815    HB2  LYS 106          1HB       LYS 106  -4.120  -5.029   5.286
  816    HB3  LYS 106          2HB       LYS 106  -3.152  -6.267   4.499
  817    HG2  LYS 106          1HG       LYS 106  -2.506  -7.001   6.851
  818    HG3  LYS 106          2HG       LYS 106  -3.814  -5.951   7.407
  819    HD2  LYS 106          1HD       LYS 106  -5.333  -7.196   5.826
  820    HD3  LYS 106          2HD       LYS 106  -4.015  -8.341   5.582
  821    HE2  LYS 106          1HE       LYS 106  -5.272  -9.362   7.236
  822    HE3  LYS 106          2HE       LYS 106  -4.025  -8.530   8.164
  823    HZ1  LYS 106          1HZ       LYS 106  -6.080  -8.103   9.214
  824    HZ2  LYS 106          2HZ       LYS 106  -6.840  -7.697   7.759
  825    HZ3  LYS 106          3HZ       LYS 106  -5.662  -6.672   8.417
  826    H    CYS 107           H        CYS 107  -0.456  -6.561   4.703
  827    HA   CYS 107           HA       CYS 107   0.493  -7.563   7.115
  828    HB2  CYS 107          1HB       CYS 107   0.743  -8.917   5.205
  829    HB3  CYS 107          2HB       CYS 107   1.557  -7.653   4.295
  830    H    PHE 108           H        PHE 108   1.791  -5.055   4.996
  831    HA   PHE 108           HA       PHE 108   4.256  -4.839   6.415
  832    HB2  PHE 108          1HB       PHE 108   3.857  -4.302   3.967
  833    HB3  PHE 108          2HB       PHE 108   3.116  -2.800   4.521
  834    HD1  PHE 108           HD1      PHE 108   6.234  -4.701   4.235
  835    HD2  PHE 108           HD2      PHE 108   4.468  -1.011   5.414
  836    HE1  PHE 108           HE1      PHE 108   8.461  -3.670   4.337
  837    HE2  PHE 108           HE2      PHE 108   6.697   0.025   5.512
  838    HZ   PHE 108           HZ       PHE 108   8.695  -1.305   4.970
  839    H    GLN 109           H        GLN 109   1.349  -2.765   6.195
  840    HA   GLN 109           HA       GLN 109   2.296  -0.823   8.014
  841    HB2  GLN 109          1HB       GLN 109   0.009   0.006   8.075
  842    HB3  GLN 109          2HB       GLN 109   0.520  -0.330   6.430
  843    HG2  GLN 109          1HG       GLN 109  -1.356  -1.465   6.173
  844    HG3  GLN 109          2HG       GLN 109  -0.711  -2.674   7.288
  845   HE21  GLN 109          1HE2      GLN 109  -1.514  -2.791   9.347
  846   HE22  GLN 109          2HE2      GLN 109  -2.890  -1.893   9.879
  847    H    LYS 110           H        LYS 110   1.050  -3.958   8.531
  848    HA   LYS 110           HA       LYS 110  -0.007  -3.586  11.138
  849    HB2  LYS 110          1HB       LYS 110  -0.491  -5.523   9.648
  850    HB3  LYS 110          2HB       LYS 110   1.154  -6.077   9.872
  851    HG2  LYS 110          1HG       LYS 110  -0.609  -5.688  12.243
  852    HG3  LYS 110          2HG       LYS 110  -0.776  -7.128  11.245
  853    HD2  LYS 110          1HD       LYS 110   1.564  -7.681  11.617
  854    HD3  LYS 110          2HD       LYS 110   1.778  -6.207  12.562
  855    HE2  LYS 110          1HE       LYS 110  -0.071  -8.483  13.260
  856    HE3  LYS 110          2HE       LYS 110   1.510  -8.195  13.980
  857    HZ1  LYS 110          1HZ       LYS 110   0.675  -6.044  14.777
  858    HZ2  LYS 110          2HZ       LYS 110  -0.205  -7.342  15.406
  859    HZ3  LYS 110          3HZ       LYS 110  -0.855  -6.410  14.156
  860    H    ASN 111           H        ASN 111   3.206  -4.011   9.852
  861    HA   ASN 111           HA       ASN 111   4.255  -4.202  12.602
  862    HB2  ASN 111          1HB       ASN 111   5.507  -5.210  10.043
  863    HB3  ASN 111          2HB       ASN 111   6.269  -5.249  11.632
  864   HD21  ASN 111          1HD2      ASN 111   3.892  -6.678   9.558
  865   HD22  ASN 111          2HD2      ASN 111   3.535  -8.028  10.574
  866    H    ASN 112           H        ASN 112   4.353  -2.456   9.609
  867    HA   ASN 112           HA       ASN 112   6.384  -0.649  10.727
  868    HB2  ASN 112          1HB       ASN 112   6.407  -1.911   7.981
  869    HB3  ASN 112          2HB       ASN 112   7.380  -0.502   8.418
  870   HD21  ASN 112          1HD2      ASN 112   7.922  -3.402   7.677
  871   HD22  ASN 112          2HD2      ASN 112   9.074  -3.917   8.867
  872    H    LEU 113           H        LEU 113   4.171   0.447  11.084
  873    HA   LEU 113           HA       LEU 113   3.083   1.618   8.663
  874    HB2  LEU 113          1HB       LEU 113   1.466   0.918  10.259
  875    HB3  LEU 113          2HB       LEU 113   2.242   1.823  11.542
  876    HG   LEU 113           HG       LEU 113   1.653   3.918  10.327
  877   HD11  LEU 113          1HD1      LEU 113   0.008   3.825   8.546
  878   HD12  LEU 113          2HD1      LEU 113   0.044   2.063   8.589
  879   HD13  LEU 113          3HD1      LEU 113   1.476   2.962   8.090
  880   HD21  LEU 113          1HD2      LEU 113   0.280   3.082  12.164
  881   HD22  LEU 113          2HD2      LEU 113  -0.656   2.115  11.025
  882   HD23  LEU 113          3HD2      LEU 113  -0.707   3.877  10.938
  883    H    SER 114           H        SER 114   5.037   2.575  11.403
  884    HA   SER 114           HA       SER 114   4.806   5.372  11.067
  885    HB2  SER 114          1HB       SER 114   5.685   4.256  13.124
  886    HB3  SER 114          2HB       SER 114   7.148   3.845  12.231
  887    HG   SER 114           HG       SER 114   7.722   5.712  13.098
  888    H    LEU 115           H        LEU 115   6.883   2.939   9.628
  889    HA   LEU 115           HA       LEU 115   8.678   4.665   8.319
  890    HB2  LEU 115          1HB       LEU 115   9.042   2.247   8.568
  891    HB3  LEU 115          2HB       LEU 115   7.708   1.939   7.476
  892    HG   LEU 115           HG       LEU 115   8.964   3.111   5.678
  893   HD11  LEU 115          1HD1      LEU 115  10.369   4.549   6.949
  894   HD12  LEU 115          2HD1      LEU 115  11.413   3.425   6.078
  895   HD13  LEU 115          3HD1      LEU 115  11.092   3.186   7.795
  896   HD21  LEU 115          1HD2      LEU 115   9.017   0.686   5.837
  897   HD22  LEU 115          2HD2      LEU 115  10.366   0.772   6.968
  898   HD23  LEU 115          3HD2      LEU 115  10.579   1.303   5.300
  899    H    ILE 116           H        ILE 116   5.517   3.389   7.464
  900    HA   ILE 116           HA       ILE 116   5.473   4.133   4.767
  901    HB   ILE 116           HB       ILE 116   3.174   3.813   6.713
  902   HG12  ILE 116          1HG1      ILE 116   4.383   1.913   4.685
  903   HG13  ILE 116          2HG1      ILE 116   4.516   1.783   6.445
  904   HG21  ILE 116          1HG2      ILE 116   2.476   5.146   4.801
  905   HG22  ILE 116          2HG2      ILE 116   1.763   3.532   4.724
  906   HG23  ILE 116          3HG2      ILE 116   3.141   3.936   3.703
  907   HD11  ILE 116          1HD1      ILE 116   2.873   0.231   5.632
  908   HD12  ILE 116          2HD1      ILE 116   2.014   1.521   4.795
  909   HD13  ILE 116          3HD1      ILE 116   2.065   1.498   6.557
  910    H    LYS 117           H        LYS 117   4.434   5.850   7.679
  911    HA   LYS 117           HA       LYS 117   3.386   8.137   6.442
  912    HB2  LYS 117          1HB       LYS 117   4.715   7.859   9.138
  913    HB3  LYS 117          2HB       LYS 117   3.755   9.241   8.630
  914    HG2  LYS 117          1HG       LYS 117   1.784   7.844   8.446
  915    HG3  LYS 117          2HG       LYS 117   2.728   6.414   8.861
  916    HD2  LYS 117          1HD       LYS 117   3.200   7.367  11.071
  917    HD3  LYS 117          2HD       LYS 117   2.289   8.814  10.648
  918    HE2  LYS 117          1HE       LYS 117   0.251   7.550  10.492
  919    HE3  LYS 117          2HE       LYS 117   1.120   6.036  10.714
  920    HZ1  LYS 117          1HZ       LYS 117   0.061   6.717  12.754
  921    HZ2  LYS 117          2HZ       LYS 117   0.860   8.203  12.721
  922    HZ3  LYS 117          3HZ       LYS 117   1.741   6.778  12.938
  923    H    ALA 118           H        ALA 118   6.640   7.314   7.503
  924    HA   ALA 118           HA       ALA 118   7.782   9.871   6.915
  925    HB1  ALA 118          1HB       ALA 118   8.698   8.395   8.615
  926    HB2  ALA 118          2HB       ALA 118   9.901   8.762   7.379
  927    HB3  ALA 118          3HB       ALA 118   9.080   7.200   7.378
  928    H    SER 119           H        SER 119   7.307   6.908   5.149
  929    HA   SER 119           HA       SER 119   9.233   7.195   3.152
  930    HB2  SER 119          1HB       SER 119   6.499   5.914   2.949
  931    HB3  SER 119          2HB       SER 119   7.830   5.670   1.819
  932    HG   SER 119           HG       SER 119   8.096   5.153   4.589
  933    H    ILE 120           H        ILE 120   5.970   8.510   3.368
  934    HA   ILE 120           HA       ILE 120   6.199   9.695   0.716
  935    HB   ILE 120           HB       ILE 120   3.872  10.505   1.153
  936   HG12  ILE 120          1HG1      ILE 120   3.991   8.725   3.588
  937   HG13  ILE 120          2HG1      ILE 120   4.143  10.477   3.663
  938   HG21  ILE 120          1HG2      ILE 120   2.842   8.260   0.997
  939   HG22  ILE 120          2HG2      ILE 120   4.406   7.558   1.413
  940   HG23  ILE 120          3HG2      ILE 120   4.222   8.476  -0.081
  941   HD11  ILE 120          1HD1      ILE 120   1.881   9.713   4.178
  942   HD12  ILE 120          2HD1      ILE 120   1.770   8.992   2.571
  943   HD13  ILE 120          3HD1      ILE 120   1.927  10.738   2.745
  944    H    LYS 121           H        LYS 121   7.157  10.513   3.766
  945    HA   LYS 121           HA       LYS 121   6.436  13.326   3.603
  946    HB2  LYS 121          1HB       LYS 121   6.339  11.997   5.746
  947    HB3  LYS 121          2HB       LYS 121   8.095  11.939   5.708
  948    HG2  LYS 121          1HG       LYS 121   8.156  14.402   5.773
  949    HG3  LYS 121          2HG       LYS 121   6.395  14.423   5.870
  950    HD2  LYS 121          1HD       LYS 121   8.267  13.169   7.875
  951    HD3  LYS 121          2HD       LYS 121   7.406  14.693   8.077
  952    HE2  LYS 121          1HE       LYS 121   5.273  13.513   7.960
  953    HE3  LYS 121          2HE       LYS 121   6.120  11.986   7.721
  954    HZ1  LYS 121          1HZ       LYS 121   7.108  12.224   9.905
  955    HZ2  LYS 121          2HZ       LYS 121   5.421  12.283  10.020
  956    HZ3  LYS 121          3HZ       LYS 121   6.325  13.706  10.133
  957    H    LYS 122           H        LYS 122   7.714  14.747   2.638
  958    HA   LYS 122           HA       LYS 122  10.596  14.152   2.443
  959    HB2  LYS 122          1HB       LYS 122   8.826  14.661   0.358
  960    HB3  LYS 122          2HB       LYS 122   9.626  16.192   0.625
  961    HG2  LYS 122          1HG       LYS 122  10.784  14.892  -1.064
  962    HG3  LYS 122          2HG       LYS 122  11.797  15.182   0.348
  963    HD2  LYS 122          1HD       LYS 122  11.235  12.906   1.161
  964    HD3  LYS 122          2HD       LYS 122  10.340  12.630  -0.336
  965    HE2  LYS 122          1HE       LYS 122  12.587  11.679  -0.456
  966    HE3  LYS 122          2HE       LYS 122  12.378  12.978  -1.626
  967    HZ1  LYS 122          1HZ       LYS 122  13.548  14.471  -0.137
  968    HZ2  LYS 122          2HZ       LYS 122  14.512  13.130  -0.493
  969    HZ3  LYS 122          3HZ       LYS 122  13.733  13.236   1.004
  970    H    ASP 123           H        ASP 123  10.824  15.036   4.511
  971    HA   ASP 123           HA       ASP 123  10.242  17.831   4.949
  972    HB2  ASP 123          1HB       ASP 123  10.093  16.161   6.784
  973    HB3  ASP 123          2HB       ASP 123  11.832  15.912   6.668
  974    H21  ACD 201           H21      ACD   1  -4.789   5.214   1.660
  975    H22  ACD 201           H22      ACD   1  -3.591   5.483   2.933
  976    H31  ACD 201           H31      ACD   1  -2.182   6.760   1.342
  977    H32  ACD 201           H32      ACD   1  -3.376   6.515   0.069
  978    H41  ACD 201           H41      ACD   1  -3.033   4.047   0.229
  979    H42  ACD 201           H42      ACD   1  -1.527   4.894  -0.158
  980    H5   ACD 201           H5       ACD   1  -2.193   3.497   2.488
  981    H6   ACD 201           H6       ACD   1   0.115   3.952   2.935
  982    H71  ACD 201           H71      ACD   1   0.643   4.848   0.249
  983    H72  ACD 201           H72      ACD   1  -0.238   6.202   0.955
  984    H8   ACD 201           H8       ACD   1   1.594   6.587   2.614
  985    H9   ACD 201           H9       ACD   1   3.698   5.598   2.086
  986   H101  ACD 201          H101      ACD   1   2.599   4.614  -0.440
  987   H102  ACD 201          H102      ACD   1   2.215   3.386   0.765
  988    H11  ACD 201           H11      ACD   1   5.139   4.352   0.569
  989    H12  ACD 201           H12      ACD   1   5.527   2.032   0.235
  990   H131  ACD 201          H131      ACD   1   2.553   2.002  -0.460
  991   H132  ACD 201          H132      ACD   1   3.680   0.645  -0.582
  992    H14  ACD 201           H14      ACD   1   2.548   1.657   2.130
  993    H15  ACD 201           H15      ACD   1   2.494  -0.685   2.555
  994   H161  ACD 201          H161      ACD   1   2.696  -1.320  -0.268
  995   H162  ACD 201          H162      ACD   1   4.349  -0.927   0.215
  996   H171  ACD 201          H171      ACD   1   4.370  -2.657   1.892
  997   H172  ACD 201          H172      ACD   1   2.633  -2.929   1.726
  998   H181  ACD 201          H181      ACD   1   4.689  -3.412  -0.476
  999   H182  ACD 201          H182      ACD   1   2.959  -3.745  -0.585
 1000   H191  ACD 201          H191      ACD   1   4.936  -5.056   1.328
 1001   H192  ACD 201          H192      ACD   1   3.193  -5.325   1.373
 1002   H201  ACD 201          H201      ACD   1   3.301  -6.161  -0.967
 1003   H202  ACD 201          H202      ACD   1   4.295  -7.095   0.099
 1004   H203  ACD 201          H203      ACD   1   5.017  -5.935  -0.964
  Start of MODEL   28
    1    H1   MET   1          1H        MET   1  15.304   9.633 -15.330
    2    H2   MET   1          2H        MET   1  13.893  10.165 -14.559
    3    H3   MET   1          3H        MET   1  15.202   9.610 -13.643
    4    HA   MET   1           HA       MET   1  16.553  11.443 -14.336
    5    HB2  MET   1          1HB       MET   1  14.076  12.323 -15.834
    6    HB3  MET   1          2HB       MET   1  15.528  13.290 -15.628
    7    HG2  MET   1          1HG       MET   1  16.805  11.590 -16.861
    8    HG3  MET   1          2HG       MET   1  15.315  10.681 -17.113
    9    HE1  MET   1          1HE       MET   1  15.968  12.069 -20.697
   10    HE2  MET   1          2HE       MET   1  15.623  10.638 -19.725
   11    HE3  MET   1          3HE       MET   1  17.162  11.476 -19.543
   12    H    GLU   2           H        GLU   2  16.661  12.047 -12.270
   13    HA   GLU   2           HA       GLU   2  16.188  13.027 -10.282
   14    HB2  GLU   2          1HB       GLU   2  13.980  14.439 -11.776
   15    HB3  GLU   2          2HB       GLU   2  14.600  14.880 -10.195
   16    HG2  GLU   2          1HG       GLU   2  16.768  15.388 -11.190
   17    HG3  GLU   2          2HG       GLU   2  16.135  14.949 -12.776
   18    H    PHE   3           H        PHE   3  15.608  11.041  -9.416
   19    HA   PHE   3           HA       PHE   3  12.987   9.979  -9.583
   20    HB2  PHE   3          1HB       PHE   3  14.913   8.566  -9.078
   21    HB3  PHE   3          2HB       PHE   3  15.162   9.422  -7.553
   22    HD1  PHE   3           HD1      PHE   3  13.865   8.888  -5.626
   23    HD2  PHE   3           HD2      PHE   3  12.965   7.120  -9.390
   24    HE1  PHE   3           HE1      PHE   3  12.378   7.274  -4.509
   25    HE2  PHE   3           HE2      PHE   3  11.472   5.509  -8.280
   26    HZ   PHE   3           HZ       PHE   3  11.176   5.586  -5.837
   27    H    THR   4           H        THR   4  11.232  10.670  -8.640
   28    HA   THR   4           HA       THR   4  11.483  12.257  -6.193
   29    HB   THR   4           HB       THR   4   9.682  12.468  -8.525
   30    HG1  THR   4           HG1      THR   4  10.974  14.160  -8.295
   31   HG21  THR   4          1HG2      THR   4   8.677  12.990  -5.723
   32   HG22  THR   4          2HG2      THR   4   7.992  11.872  -6.903
   33   HG23  THR   4          3HG2      THR   4   7.916  13.609  -7.189
   34    H    VAL   5           H        VAL   5  10.564  11.578  -4.367
   35    HA   VAL   5           HA       VAL   5   9.272   8.950  -4.379
   36    HB   VAL   5           HB       VAL   5   9.901   8.688  -2.200
   37   HG11  VAL   5          1HG1      VAL   5  11.926   9.112  -3.445
   38   HG12  VAL   5          2HG1      VAL   5  12.085   9.612  -1.762
   39   HG13  VAL   5          3HG1      VAL   5  11.842  10.821  -3.022
   40   HG21  VAL   5          1HG2      VAL   5   8.538  10.510  -1.297
   41   HG22  VAL   5          2HG2      VAL   5   9.790  11.669  -1.745
   42   HG23  VAL   5          3HG2      VAL   5  10.119  10.444  -0.520
   43    H    SER   6           H        SER   6   7.240   8.579  -3.603
   44    HA   SER   6           HA       SER   6   5.329  10.614  -4.046
   45    HB2  SER   6          1HB       SER   6   4.847   8.041  -2.535
   46    HB3  SER   6          2HB       SER   6   3.688   8.972  -3.483
   47    HG   SER   6           HG       SER   6   5.784   7.303  -4.349
   48    H    THR   7           H        THR   7   4.654  12.161  -2.710
   49    HA   THR   7           HA       THR   7   5.380  11.937   0.132
   50    HB   THR   7           HB       THR   7   5.363  14.419   0.132
   51    HG1  THR   7           HG1      THR   7   5.391  14.378  -2.686
   52   HG21  THR   7          1HG2      THR   7   7.460  13.224  -0.189
   53   HG22  THR   7          2HG2      THR   7   7.441  14.690  -1.170
   54   HG23  THR   7          3HG2      THR   7   7.152  13.122  -1.923
   55    H    THR   8           H        THR   8   3.900  13.594   1.439
   56    HA   THR   8           HA       THR   8   1.399  12.381   1.583
   57    HB   THR   8           HB       THR   8   2.137  15.105   2.652
   58    HG1  THR   8           HG1      THR   8   3.311  12.869   3.201
   59   HG21  THR   8          1HG2      THR   8   0.415  14.623   4.332
   60   HG22  THR   8          2HG2      THR   8   0.048  13.104   3.512
   61   HG23  THR   8          3HG2      THR   8  -0.260  14.642   2.701
   62    H    GLU   9           H        GLU   9   2.138  15.691   0.456
   63    HA   GLU   9           HA       GLU   9  -0.490  16.322  -0.228
   64    HB2  GLU   9          1HB       GLU   9   2.103  17.479  -1.213
   65    HB3  GLU   9          2HB       GLU   9   0.527  18.148  -1.605
   66    HG2  GLU   9          1HG       GLU   9   0.100  18.420   0.822
   67    HG3  GLU   9          2HG       GLU   9   1.755  17.899   1.126
   68    H    ASP  10           H        ASP  10   2.091  14.895  -2.167
   69    HA   ASP  10           HA       ASP  10   0.592  15.015  -4.589
   70    HB2  ASP  10          1HB       ASP  10   2.620  14.667  -5.418
   71    HB3  ASP  10          2HB       ASP  10   3.248  14.310  -3.817
   72    H    LEU  11           H        LEU  11   1.139  12.584  -2.110
   73    HA   LEU  11           HA       LEU  11  -0.321  10.476  -3.194
   74    HB2  LEU  11          1HB       LEU  11   0.994  10.137  -1.224
   75    HB3  LEU  11          2HB       LEU  11   0.043  11.313  -0.314
   76    HG   LEU  11           HG       LEU  11  -1.915   9.760  -0.563
   77   HD11  LEU  11          1HD1      LEU  11  -1.112   8.531  -2.507
   78   HD12  LEU  11          2HD1      LEU  11  -1.484   7.451  -1.160
   79   HD13  LEU  11          3HD1      LEU  11   0.194   7.852  -1.535
   80   HD21  LEU  11          1HD2      LEU  11  -1.198   8.265   1.196
   81   HD22  LEU  11          2HD2      LEU  11  -0.537   9.877   1.477
   82   HD23  LEU  11          3HD2      LEU  11   0.495   8.602   0.829
   83    H    GLN  12           H        GLN  12  -1.385  13.352  -1.453
   84    HA   GLN  12           HA       GLN  12  -4.016  12.673  -0.900
   85    HB2  GLN  12          1HB       GLN  12  -2.809  15.344  -1.579
   86    HB3  GLN  12          2HB       GLN  12  -4.458  15.147  -1.005
   87    HG2  GLN  12          1HG       GLN  12  -1.973  14.344   0.487
   88    HG3  GLN  12          2HG       GLN  12  -2.928  15.793   0.795
   89   HE21  GLN  12          1HE2      GLN  12  -4.921  15.597   1.801
   90   HE22  GLN  12          2HE2      GLN  12  -5.388  14.158   2.638
   91    H    ARG  13           H        ARG  13  -2.564  13.715  -3.881
   92    HA   ARG  13           HA       ARG  13  -4.959  14.372  -5.242
   93    HB2  ARG  13          1HB       ARG  13  -2.743  15.181  -5.938
   94    HB3  ARG  13          2HB       ARG  13  -2.283  13.539  -6.364
   95    HG2  ARG  13          1HG       ARG  13  -3.922  13.469  -8.115
   96    HG3  ARG  13          2HG       ARG  13  -4.562  15.048  -7.625
   97    HD2  ARG  13          1HD       ARG  13  -2.392  16.064  -8.163
   98    HD3  ARG  13          2HD       ARG  13  -1.799  14.491  -8.691
   99    HE   ARG  13           HE       ARG  13  -3.940  14.751 -10.234
  100   HH11  ARG  13          1HH1      ARG  13  -1.407  17.059  -9.490
  101   HH12  ARG  13          2HH1      ARG  13  -1.562  17.903 -10.997
  102   HH21  ARG  13          1HH2      ARG  13  -4.142  15.843 -12.207
  103   HH22  ARG  13          2HH2      ARG  13  -3.129  17.212 -12.546
  104    H    TYR  14           H        TYR  14  -2.949  11.436  -5.120
  105    HA   TYR  14           HA       TYR  14  -4.491  10.010  -7.033
  106    HB2  TYR  14          1HB       TYR  14  -2.638   8.950  -4.892
  107    HB3  TYR  14          2HB       TYR  14  -3.307   8.004  -6.217
  108    HD1  TYR  14           HD1      TYR  14  -3.005   9.484  -8.571
  109    HD2  TYR  14           HD2      TYR  14  -0.380   9.375  -5.229
  110    HE1  TYR  14           HE1      TYR  14  -1.134  10.122 -10.029
  111    HE2  TYR  14           HE2      TYR  14   1.495  10.025  -6.677
  112    HH   TYR  14           HH       TYR  14   2.149  10.041  -8.951
  113    H    ARG  15           H        ARG  15  -4.597  10.200  -3.514
  114    HA   ARG  15           HA       ARG  15  -6.527   8.215  -3.036
  115    HB2  ARG  15          1HB       ARG  15  -6.539  10.796  -1.480
  116    HB3  ARG  15          2HB       ARG  15  -6.871   9.170  -0.923
  117    HG2  ARG  15          1HG       ARG  15  -4.571   8.566  -0.982
  118    HG3  ARG  15          2HG       ARG  15  -4.141  10.075  -1.790
  119    HD2  ARG  15          1HD       ARG  15  -3.559  10.512   0.418
  120    HD3  ARG  15          2HD       ARG  15  -5.176  11.204   0.308
  121    HE   ARG  15           HE       ARG  15  -4.998   8.459   1.271
  122   HH11  ARG  15          1HH1      ARG  15  -5.258  11.859   2.074
  123   HH12  ARG  15          2HH1      ARG  15  -5.830  11.565   3.685
  124   HH21  ARG  15          1HH2      ARG  15  -5.682   8.060   3.377
  125   HH22  ARG  15          2HH2      ARG  15  -6.059   9.388   4.437
  126    H    THR  16           H        THR  16  -6.851  11.634  -3.792
  127    HA   THR  16           HA       THR  16  -9.616  11.873  -3.658
  128    HB   THR  16           HB       THR  16  -7.523  13.339  -5.246
  129    HG1  THR  16           HG1      THR  16  -7.321  13.882  -3.162
  130   HG21  THR  16          1HG2      THR  16  -9.612  13.563  -6.470
  131   HG22  THR  16          2HG2      THR  16  -9.205  15.085  -5.672
  132   HG23  THR  16          3HG2      THR  16 -10.449  14.037  -4.990
  133    H    GLU  17           H        GLU  17  -7.564  11.247  -6.513
  134    HA   GLU  17           HA       GLU  17  -9.633  11.036  -8.397
  135    HB2  GLU  17          1HB       GLU  17  -7.094   9.410  -8.553
  136    HB3  GLU  17          2HB       GLU  17  -8.069  10.040  -9.866
  137    HG2  GLU  17          1HG       GLU  17  -6.576  11.811  -7.961
  138    HG3  GLU  17          2HG       GLU  17  -5.917  11.240  -9.499
  139    H    CYS  18           H        CYS  18  -8.193   8.586  -6.292
  140    HA   CYS  18           HA       CYS  18  -9.657   6.433  -7.428
  141    HB2  CYS  18          1HB       CYS  18  -8.232   6.696  -4.783
  142    HB3  CYS  18          2HB       CYS  18  -8.962   5.198  -5.379
  143    H    VAL  19           H        VAL  19 -10.289   8.741  -4.902
  144    HA   VAL  19           HA       VAL  19 -12.497   7.448  -3.747
  145    HB   VAL  19           HB       VAL  19 -11.572  10.298  -3.789
  146   HG11  VAL  19          1HG1      VAL  19 -14.148   9.327  -2.551
  147   HG12  VAL  19          2HG1      VAL  19 -14.011  10.412  -3.940
  148   HG13  VAL  19          3HG1      VAL  19 -13.438  10.932  -2.352
  149   HG21  VAL  19          1HG2      VAL  19 -11.998   8.229  -1.637
  150   HG22  VAL  19          2HG2      VAL  19 -11.473   9.890  -1.345
  151   HG23  VAL  19          3HG2      VAL  19 -10.454   8.794  -2.278
  152    H    SER  20           H        SER  20 -12.287   9.969  -6.219
  153    HA   SER  20           HA       SER  20 -15.056  10.067  -6.749
  154    HB2  SER  20          1HB       SER  20 -13.402  11.852  -7.295
  155    HB3  SER  20          2HB       SER  20 -12.770  10.829  -8.583
  156    HG   SER  20           HG       SER  20 -14.503  11.212  -9.773
  157    H    SER  21           H        SER  21 -12.445   8.104  -8.092
  158    HA   SER  21           HA       SER  21 -13.918   7.196 -10.362
  159    HB2  SER  21          1HB       SER  21 -11.448   7.246 -10.285
  160    HB3  SER  21          2HB       SER  21 -11.471   6.004  -9.038
  161    HG   SER  21           HG       SER  21 -12.555   5.693 -11.645
  162    H    LEU  22           H        LEU  22 -13.094   5.699  -7.223
  163    HA   LEU  22           HA       LEU  22 -14.642   3.349  -7.913
  164    HB2  LEU  22          1HB       LEU  22 -12.997   4.088  -5.499
  165    HB3  LEU  22          2HB       LEU  22 -13.860   2.556  -5.655
  166    HG   LEU  22           HG       LEU  22 -11.773   3.485  -7.622
  167   HD11  LEU  22          1HD1      LEU  22 -10.729   3.255  -5.453
  168   HD12  LEU  22          2HD1      LEU  22 -10.270   1.897  -6.481
  169   HD13  LEU  22          3HD1      LEU  22 -11.491   1.683  -5.224
  170   HD21  LEU  22          1HD2      LEU  22 -12.986   0.781  -7.075
  171   HD22  LEU  22          2HD2      LEU  22 -11.763   1.152  -8.291
  172   HD23  LEU  22          3HD2      LEU  22 -13.384   1.832  -8.437
  173    H    ASN  23           H        ASN  23 -15.583   6.242  -7.006
  174    HA   ASN  23           HA       ASN  23 -17.348   7.180  -5.924
  175    HB2  ASN  23          1HB       ASN  23 -18.506   4.401  -6.147
  176    HB3  ASN  23          2HB       ASN  23 -19.409   5.873  -5.839
  177   HD21  ASN  23          1HD2      ASN  23 -19.724   4.008  -8.006
  178   HD22  ASN  23          2HD2      ASN  23 -19.466   4.901  -9.469
  179    H    ILE  24           H        ILE  24 -15.275   6.367  -4.264
  180    HA   ILE  24           HA       ILE  24 -16.036   4.875  -2.016
  181    HB   ILE  24           HB       ILE  24 -14.042   7.143  -2.130
  182   HG12  ILE  24          1HG1      ILE  24 -13.594   5.444  -3.871
  183   HG13  ILE  24          2HG1      ILE  24 -12.355   5.434  -2.618
  184   HG21  ILE  24          1HG2      ILE  24 -14.614   6.480   0.136
  185   HG22  ILE  24          2HG2      ILE  24 -12.968   5.987  -0.258
  186   HG23  ILE  24          3HG2      ILE  24 -14.268   4.795  -0.251
  187   HD11  ILE  24          1HD1      ILE  24 -13.433   3.463  -1.611
  188   HD12  ILE  24          2HD1      ILE  24 -12.928   3.180  -3.280
  189   HD13  ILE  24          3HD1      ILE  24 -14.626   3.477  -2.910
  190    HA   PRO  25           HA       PRO  25 -18.954   7.729  -0.157
  191    HB2  PRO  25          1HB       PRO  25 -18.522   6.057   2.223
  192    HB3  PRO  25          2HB       PRO  25 -20.012   6.398   1.343
  193    HG2  PRO  25          1HG       PRO  25 -18.816   4.001   1.245
  194    HG3  PRO  25          2HG       PRO  25 -19.693   4.682  -0.136
  195    HD2  PRO  25          1HD       PRO  25 -16.746   4.513   0.347
  196    HD3  PRO  25          2HD       PRO  25 -17.662   4.324  -1.170
  197    H    ALA  26           H        ALA  26 -18.771   9.454   1.099
  198    HA   ALA  26           HA       ALA  26 -16.297  10.578   1.600
  199    HB1  ALA  26          1HB       ALA  26 -18.366  11.845   1.349
  200    HB2  ALA  26          2HB       ALA  26 -17.507  12.300   2.821
  201    HB3  ALA  26          3HB       ALA  26 -18.921  11.250   2.914
  202    H    ASP  27           H        ASP  27 -18.354   8.731   3.792
  203    HA   ASP  27           HA       ASP  27 -17.120   9.288   6.209
  204    HB2  ASP  27          1HB       ASP  27 -19.148   7.972   6.094
  205    HB3  ASP  27          2HB       ASP  27 -18.292   6.660   5.291
  206    H    TYR  28           H        TYR  28 -16.323   6.644   3.947
  207    HA   TYR  28           HA       TYR  28 -14.104   5.650   5.275
  208    HB2  TYR  28          1HB       TYR  28 -14.946   5.697   2.404
  209    HB3  TYR  28          2HB       TYR  28 -13.351   5.077   2.821
  210    HD1  TYR  28           HD1      TYR  28 -13.110   2.866   3.597
  211    HD2  TYR  28           HD2      TYR  28 -16.974   4.637   3.488
  212    HE1  TYR  28           HE1      TYR  28 -14.117   0.682   4.093
  213    HE2  TYR  28           HE2      TYR  28 -17.990   2.456   3.985
  214    HH   TYR  28           HH       TYR  28 -15.980  -0.443   4.492
  215    H    VAL  29           H        VAL  29 -14.372   8.305   2.965
  216    HA   VAL  29           HA       VAL  29 -11.664   8.769   2.499
  217    HB   VAL  29           HB       VAL  29 -13.881  10.806   2.533
  218   HG11  VAL  29          1HG1      VAL  29 -11.182  10.799   1.195
  219   HG12  VAL  29          2HG1      VAL  29 -11.704  11.857   2.506
  220   HG13  VAL  29          3HG1      VAL  29 -12.445  11.998   0.912
  221   HG21  VAL  29          1HG2      VAL  29 -12.888   8.971   0.368
  222   HG22  VAL  29          2HG2      VAL  29 -13.967  10.338   0.092
  223   HG23  VAL  29          3HG2      VAL  29 -14.492   8.992   1.103
  224    H    GLU  30           H        GLU  30 -13.820  10.203   4.952
  225    HA   GLU  30           HA       GLU  30 -11.846  11.847   6.154
  226    HB2  GLU  30          1HB       GLU  30 -14.130  10.665   7.705
  227    HB3  GLU  30          2HB       GLU  30 -13.382  12.251   7.852
  228    HG2  GLU  30          1HG       GLU  30 -14.328  12.864   5.670
  229    HG3  GLU  30          2HG       GLU  30 -15.161  11.315   5.627
  230    H    LYS  31           H        LYS  31 -12.785   8.511   6.593
  231    HA   LYS  31           HA       LYS  31 -11.430   8.193   9.068
  232    HB2  LYS  31          1HB       LYS  31 -12.784   6.455   9.194
  233    HB3  LYS  31          2HB       LYS  31 -13.321   6.761   7.546
  234    HG2  LYS  31          1HG       LYS  31 -11.653   5.260   6.683
  235    HG3  LYS  31          2HG       LYS  31 -10.965   5.037   8.291
  236    HD2  LYS  31          1HD       LYS  31 -13.679   4.182   7.308
  237    HD3  LYS  31          2HD       LYS  31 -12.345   3.144   7.831
  238    HE2  LYS  31          1HE       LYS  31 -12.567   4.082  10.117
  239    HE3  LYS  31          2HE       LYS  31 -13.948   5.032   9.571
  240    HZ1  LYS  31          1HZ       LYS  31 -13.761   2.076   9.688
  241    HZ2  LYS  31          2HZ       LYS  31 -15.047   2.916   8.981
  242    HZ3  LYS  31          3HZ       LYS  31 -14.741   3.075  10.634
  243    H    PHE  32           H        PHE  32 -10.482   7.786   5.710
  244    HA   PHE  32           HA       PHE  32  -8.197   6.180   6.221
  245    HB2  PHE  32          1HB       PHE  32  -8.732   8.046   3.900
  246    HB3  PHE  32          2HB       PHE  32  -7.422   6.874   3.984
  247    HD1  PHE  32           HD1      PHE  32 -10.015   7.293   2.111
  248    HD2  PHE  32           HD2      PHE  32  -8.831   4.549   5.140
  249    HE1  PHE  32           HE1      PHE  32 -11.457   5.572   1.111
  250    HE2  PHE  32           HE2      PHE  32 -10.275   2.829   4.148
  251    HZ   PHE  32           HZ       PHE  32 -11.586   3.331   2.128
  252    H    LYS  33           H        LYS  33  -8.880   9.517   6.634
  253    HA   LYS  33           HA       LYS  33  -6.211  10.486   6.554
  254    HB2  LYS  33          1HB       LYS  33  -8.067  12.009   6.302
  255    HB3  LYS  33          2HB       LYS  33  -8.703  11.564   7.875
  256    HG2  LYS  33          1HG       LYS  33  -6.732  12.560   8.948
  257    HG3  LYS  33          2HG       LYS  33  -6.106  13.009   7.353
  258    HD2  LYS  33          1HD       LYS  33  -8.039  14.429   6.972
  259    HD3  LYS  33          2HD       LYS  33  -8.729  13.944   8.522
  260    HE2  LYS  33          1HE       LYS  33  -6.129  15.422   8.127
  261    HE3  LYS  33          2HE       LYS  33  -7.649  16.139   8.656
  262    HZ1  LYS  33          1HZ       LYS  33  -6.235  15.709  10.536
  263    HZ2  LYS  33          2HZ       LYS  33  -6.083  14.082  10.114
  264    HZ3  LYS  33          3HZ       LYS  33  -7.580  14.688  10.609
  265    H    LYS  34           H        LYS  34  -8.142   8.862   8.940
  266    HA   LYS  34           HA       LYS  34  -6.157   9.383  11.020
  267    HB2  LYS  34          1HB       LYS  34  -8.939   8.257  11.056
  268    HB3  LYS  34          2HB       LYS  34  -7.859   8.004  12.421
  269    HG2  LYS  34          1HG       LYS  34  -7.612  10.447  12.633
  270    HG3  LYS  34          2HG       LYS  34  -8.760  10.653  11.309
  271    HD2  LYS  34          1HD       LYS  34 -10.496   9.567  12.592
  272    HD3  LYS  34          2HD       LYS  34  -9.355   9.217  13.892
  273    HE2  LYS  34          1HE       LYS  34  -9.047  11.622  14.251
  274    HE3  LYS  34          2HE       LYS  34 -10.208  11.958  12.969
  275    HZ1  LYS  34          1HZ       LYS  34 -11.271  12.110  15.104
  276    HZ2  LYS  34          2HZ       LYS  34 -10.767  10.552  15.521
  277    HZ3  LYS  34          3HZ       LYS  34 -11.887  10.772  14.276
  278    H    TRP  35           H        TRP  35  -5.702   7.651   8.672
  279    HA   TRP  35           HA       TRP  35  -4.861   5.641   8.071
  280    HB2  TRP  35          1HB       TRP  35  -3.848   5.841  10.908
  281    HB3  TRP  35          2HB       TRP  35  -3.280   4.633   9.747
  282    HD1  TRP  35           HD1      TRP  35  -2.948   8.302  10.663
  283    HE1  TRP  35           HE1      TRP  35  -1.094   9.374   9.236
  284    HE3  TRP  35           HE3      TRP  35  -2.110   4.462   7.386
  285    HZ2  TRP  35           HZ2      TRP  35   0.511   8.686   7.020
  286    HZ3  TRP  35           HZ3      TRP  35  -0.403   4.753   5.643
  287    HH2  TRP  35           HH2      TRP  35   0.884   6.812   5.463
  288    H    GLU  36           H        GLU  36  -7.538   5.417   8.773
  289    HA   GLU  36           HA       GLU  36  -7.644   2.781  10.072
  290    HB2  GLU  36          1HB       GLU  36  -9.729   4.910   9.689
  291    HB3  GLU  36          2HB       GLU  36 -10.160   3.255  10.085
  292    HG2  GLU  36          1HG       GLU  36  -8.831   3.430  12.135
  293    HG3  GLU  36          2HG       GLU  36  -8.450   5.098  11.722
  294    H    PHE  37           H        PHE  37  -7.587   1.173   8.679
  295    HA   PHE  37           HA       PHE  37  -8.984   1.518   6.111
  296    HB2  PHE  37          1HB       PHE  37  -6.548  -0.198   6.664
  297    HB3  PHE  37          2HB       PHE  37  -7.326   0.016   5.099
  298    HD1  PHE  37           HD1      PHE  37  -5.231   1.572   7.656
  299    HD2  PHE  37           HD2      PHE  37  -7.018   2.050   3.822
  300    HE1  PHE  37           HE1      PHE  37  -3.794   3.520   7.229
  301    HE2  PHE  37           HE2      PHE  37  -5.592   4.004   3.397
  302    HZ   PHE  37           HZ       PHE  37  -3.975   4.742   5.099
  303    HA   PRO  38           HA       PRO  38 -11.380  -1.791   8.255
  304    HB2  PRO  38          1HB       PRO  38 -13.191  -0.972   6.044
  305    HB3  PRO  38          2HB       PRO  38 -13.545  -1.257   7.759
  306    HG2  PRO  38          1HG       PRO  38 -13.444   1.220   6.831
  307    HG3  PRO  38          2HG       PRO  38 -12.729   0.821   8.404
  308    HD2  PRO  38          1HD       PRO  38 -11.356   1.232   5.762
  309    HD3  PRO  38          2HD       PRO  38 -10.879   1.803   7.389
  310    H    GLU  39           H        GLU  39 -11.662  -3.864   7.674
  311    HA   GLU  39           HA       GLU  39 -10.417  -4.680   5.200
  312    HB2  GLU  39          1HB       GLU  39  -9.839  -5.727   7.362
  313    HB3  GLU  39          2HB       GLU  39 -11.476  -6.353   7.479
  314    HG2  GLU  39          1HG       GLU  39 -11.148  -7.867   5.745
  315    HG3  GLU  39          2HG       GLU  39  -9.733  -7.006   5.137
  316    H    ASP  40           H        ASP  40 -12.104  -3.825   3.866
  317    HA   ASP  40           HA       ASP  40 -14.048  -5.850   3.202
  318    HB2  ASP  40          1HB       ASP  40 -16.022  -4.637   3.498
  319    HB3  ASP  40          2HB       ASP  40 -15.103  -4.198   4.925
  320    H    ASP  41           H        ASP  41 -15.253  -5.185   1.143
  321    HA   ASP  41           HA       ASP  41 -13.455  -4.976  -0.901
  322    HB2  ASP  41          1HB       ASP  41 -16.376  -4.209  -0.910
  323    HB3  ASP  41          2HB       ASP  41 -15.395  -4.307  -2.365
  324    H    THR  42           H        THR  42 -15.198  -2.269   0.578
  325    HA   THR  42           HA       THR  42 -14.757  -0.313  -1.336
  326    HB   THR  42           HB       THR  42 -14.675   0.237   1.616
  327    HG1  THR  42           HG1      THR  42 -16.445  -0.994   1.561
  328   HG21  THR  42          1HG2      THR  42 -14.360   2.143   0.135
  329   HG22  THR  42          2HG2      THR  42 -15.922   2.245   0.949
  330   HG23  THR  42          3HG2      THR  42 -15.836   1.727  -0.736
  331    H    THR  43           H        THR  43 -12.905  -0.710   1.662
  332    HA   THR  43           HA       THR  43 -10.866   1.091   1.039
  333    HB   THR  43           HB       THR  43 -10.587  -1.323   2.822
  334    HG1  THR  43           HG1      THR  43 -11.494   0.054   4.452
  335   HG21  THR  43          1HG2      THR  43  -8.527  -0.099   2.502
  336   HG22  THR  43          2HG2      THR  43  -9.143   0.227   4.122
  337   HG23  THR  43          3HG2      THR  43  -9.338   1.427   2.846
  338    H    MET  44           H        MET  44 -11.258  -2.310   0.280
  339    HA   MET  44           HA       MET  44  -8.542  -2.903  -0.170
  340    HB2  MET  44          1HB       MET  44 -11.023  -4.251  -1.230
  341    HB3  MET  44          2HB       MET  44  -9.397  -4.911  -1.364
  342    HG2  MET  44          1HG       MET  44  -9.216  -4.992   1.058
  343    HG3  MET  44          2HG       MET  44 -10.826  -4.294   1.210
  344    HE1  MET  44          1HE       MET  44 -11.559  -6.245   2.805
  345    HE2  MET  44          2HE       MET  44  -9.934  -6.925   2.680
  346    HE3  MET  44          3HE       MET  44 -11.343  -7.956   2.426
  347    H    CYS  45           H        CYS  45 -11.146  -2.260  -2.533
  348    HA   CYS  45           HA       CYS  45  -9.359  -2.232  -4.737
  349    HB2  CYS  45          1HB       CYS  45 -12.163  -1.145  -4.453
  350    HB3  CYS  45          2HB       CYS  45 -11.256  -1.106  -5.960
  351    H    TYR  46           H        TYR  46 -10.411   0.189  -2.466
  352    HA   TYR  46           HA       TYR  46  -9.588   2.483  -3.817
  353    HB2  TYR  46          1HB       TYR  46 -10.875   2.798  -1.877
  354    HB3  TYR  46          2HB       TYR  46  -9.817   1.780  -0.900
  355    HD1  TYR  46           HD1      TYR  46  -8.243   2.786   0.473
  356    HD2  TYR  46           HD2      TYR  46  -9.816   4.994  -2.809
  357    HE1  TYR  46           HE1      TYR  46  -7.050   4.787   1.255
  358    HE2  TYR  46           HE2      TYR  46  -8.627   7.001  -2.030
  359    HH   TYR  46           HH       TYR  46  -6.313   6.873   0.582
  360    H    ILE  47           H        ILE  47  -7.830   0.463  -1.486
  361    HA   ILE  47           HA       ILE  47  -5.374   1.756  -1.591
  362    HB   ILE  47           HB       ILE  47  -6.034  -1.136  -1.068
  363   HG12  ILE  47          1HG1      ILE  47  -6.942   0.401   0.580
  364   HG13  ILE  47          2HG1      ILE  47  -5.606  -0.497   1.297
  365   HG21  ILE  47          1HG2      ILE  47  -3.741  -1.058  -1.827
  366   HG22  ILE  47          2HG2      ILE  47  -3.778  -1.341  -0.086
  367   HG23  ILE  47          3HG2      ILE  47  -3.386   0.261  -0.710
  368   HD11  ILE  47          1HD1      ILE  47  -5.423   1.753   2.009
  369   HD12  ILE  47          2HD1      ILE  47  -5.621   2.364   0.369
  370   HD13  ILE  47          3HD1      ILE  47  -4.151   1.495   0.814
  371    H    LYS  48           H        LYS  48  -6.672  -0.826  -3.624
  372    HA   LYS  48           HA       LYS  48  -4.324  -1.413  -5.027
  373    HB2  LYS  48          1HB       LYS  48  -6.501  -2.727  -5.002
  374    HB3  LYS  48          2HB       LYS  48  -7.106  -1.572  -6.180
  375    HG2  LYS  48          1HG       LYS  48  -5.095  -2.179  -7.598
  376    HG3  LYS  48          2HG       LYS  48  -4.841  -3.518  -6.478
  377    HD2  LYS  48          1HD       LYS  48  -6.082  -4.451  -8.215
  378    HD3  LYS  48          2HD       LYS  48  -7.273  -4.136  -6.955
  379    HE2  LYS  48          1HE       LYS  48  -8.201  -3.436  -9.032
  380    HE3  LYS  48          2HE       LYS  48  -7.803  -1.990  -8.108
  381    HZ1  LYS  48          1HZ       LYS  48  -5.811  -1.717  -9.410
  382    HZ2  LYS  48          2HZ       LYS  48  -7.140  -1.829 -10.447
  383    HZ3  LYS  48          3HZ       LYS  48  -6.105  -3.159 -10.252
  384    H    CYS  49           H        CYS  49  -6.992   0.799  -5.748
  385    HA   CYS  49           HA       CYS  49  -6.144   1.682  -8.235
  386    HB2  CYS  49          1HB       CYS  49  -8.333   2.206  -7.588
  387    HB3  CYS  49          2HB       CYS  49  -7.813   2.996  -6.102
  388    H    VAL  50           H        VAL  50  -5.416   3.128  -5.022
  389    HA   VAL  50           HA       VAL  50  -3.947   5.260  -6.217
  390    HB   VAL  50           HB       VAL  50  -3.752   6.207  -4.196
  391   HG11  VAL  50          1HG1      VAL  50  -5.471   5.697  -2.649
  392   HG12  VAL  50          2HG1      VAL  50  -5.612   4.053  -3.260
  393   HG13  VAL  50          3HG1      VAL  50  -6.080   5.413  -4.279
  394   HG21  VAL  50          1HG2      VAL  50  -1.981   4.648  -3.463
  395   HG22  VAL  50          2HG2      VAL  50  -3.231   3.575  -2.828
  396   HG23  VAL  50          3HG2      VAL  50  -3.028   5.189  -2.153
  397    H    PHE  51           H        PHE  51  -3.125   2.060  -5.116
  398    HA   PHE  51           HA       PHE  51  -0.318   2.506  -5.066
  399    HB2  PHE  51          1HB       PHE  51  -2.119   0.196  -4.783
  400    HB3  PHE  51          2HB       PHE  51  -0.549  -0.176  -5.469
  401    HD1  PHE  51           HD1      PHE  51  -2.203   1.391  -2.545
  402    HD2  PHE  51           HD2      PHE  51   1.352  -0.325  -4.136
  403    HE1  PHE  51           HE1      PHE  51  -1.203   1.392  -0.300
  404    HE2  PHE  51           HE2      PHE  51   2.357  -0.324  -1.896
  405    HZ   PHE  51           HZ       PHE  51   1.080   0.534   0.029
  406    H    ASN  52           H        ASN  52  -2.630   1.611  -7.501
  407    HA   ASN  52           HA       ASN  52  -0.738   0.915  -9.523
  408    HB2  ASN  52          1HB       ASN  52  -3.670   1.642  -9.561
  409    HB3  ASN  52          2HB       ASN  52  -2.761   1.407 -11.058
  410   HD21  ASN  52          1HD2      ASN  52  -4.074  -0.353 -11.602
  411   HD22  ASN  52          2HD2      ASN  52  -3.868  -1.892 -10.842
  412    H    LYS  53           H        LYS  53  -2.454   3.836  -8.591
  413    HA   LYS  53           HA       LYS  53  -1.556   5.416 -10.776
  414    HB2  LYS  53          1HB       LYS  53  -2.838   6.027  -8.133
  415    HB3  LYS  53          2HB       LYS  53  -2.293   7.326  -9.185
  416    HG2  LYS  53          1HG       LYS  53  -3.790   6.516 -10.946
  417    HG3  LYS  53          2HG       LYS  53  -4.311   5.195  -9.898
  418    HD2  LYS  53          1HD       LYS  53  -5.154   6.855  -8.277
  419    HD3  LYS  53          2HD       LYS  53  -4.690   8.147  -9.388
  420    HE2  LYS  53          1HE       LYS  53  -6.675   5.948  -9.967
  421    HE3  LYS  53          2HE       LYS  53  -7.079   7.612  -9.552
  422    HZ1  LYS  53          1HZ       LYS  53  -5.887   8.320 -11.567
  423    HZ2  LYS  53          2HZ       LYS  53  -7.199   7.313 -11.912
  424    HZ3  LYS  53          3HZ       LYS  53  -5.627   6.699 -11.975
  425    H    MET  54           H        MET  54  -0.285   4.674  -7.620
  426    HA   MET  54           HA       MET  54   1.707   6.768  -7.703
  427    HB2  MET  54          1HB       MET  54   1.145   4.521  -5.784
  428    HB3  MET  54          2HB       MET  54   2.547   5.572  -5.618
  429    HG2  MET  54          1HG       MET  54   1.212   7.448  -5.202
  430    HG3  MET  54          2HG       MET  54  -0.247   6.646  -5.779
  431    HE1  MET  54          1HE       MET  54   1.816   5.928  -1.730
  432    HE2  MET  54          2HE       MET  54   2.139   7.282  -2.805
  433    HE3  MET  54          3HE       MET  54   2.647   5.657  -3.260
  434    H    GLN  55           H        GLN  55   1.404   3.984  -9.324
  435    HA   GLN  55           HA       GLN  55   2.753   2.567 -10.416
  436    HB2  GLN  55          1HB       GLN  55   4.551   4.921 -10.014
  437    HB3  GLN  55          2HB       GLN  55   5.136   3.480 -10.858
  438    HG2  GLN  55          1HG       GLN  55   3.437   3.725 -12.527
  439    HG3  GLN  55          2HG       GLN  55   2.674   5.024 -11.620
  440   HE21  GLN  55          1HE2      GLN  55   2.845   6.504 -13.278
  441   HE22  GLN  55          2HE2      GLN  55   4.356   7.186 -13.771
  442    H    LEU  56           H        LEU  56   2.401   1.841  -7.852
  443    HA   LEU  56           HA       LEU  56   5.050   0.998  -6.918
  444    HB2  LEU  56          1HB       LEU  56   2.804   2.262  -5.542
  445    HB3  LEU  56          2HB       LEU  56   3.395   0.817  -4.707
  446    HG   LEU  56           HG       LEU  56   5.049   3.217  -5.490
  447   HD11  LEU  56          1HD1      LEU  56   5.100   3.690  -3.095
  448   HD12  LEU  56          2HD1      LEU  56   4.030   2.326  -2.795
  449   HD13  LEU  56          3HD1      LEU  56   3.449   3.715  -3.707
  450   HD21  LEU  56          1HD2      LEU  56   6.420   1.247  -5.475
  451   HD22  LEU  56          2HD2      LEU  56   5.711   0.717  -3.951
  452   HD23  LEU  56          3HD2      LEU  56   6.730   2.154  -3.994
  453    H    PHE  57           H        PHE  57   1.892   0.076  -7.843
  454    HA   PHE  57           HA       PHE  57   2.506  -2.737  -7.278
  455    HB2  PHE  57          1HB       PHE  57   0.916  -2.014  -5.546
  456    HB3  PHE  57          2HB       PHE  57  -0.152  -1.354  -6.778
  457    HD1  PHE  57           HD1      PHE  57   1.096  -4.430  -5.212
  458    HD2  PHE  57           HD2      PHE  57  -1.607  -2.761  -8.043
  459    HE1  PHE  57           HE1      PHE  57  -0.132  -6.556  -5.294
  460    HE2  PHE  57           HE2      PHE  57  -2.834  -4.890  -8.135
  461    HZ   PHE  57           HZ       PHE  57  -2.097  -6.790  -6.756
  462    H    ASP  58           H        ASP  58   2.167  -4.005  -9.007
  463    HA   ASP  58           HA       ASP  58   0.830  -2.785 -11.319
  464    HB2  ASP  58          1HB       ASP  58   3.119  -3.577 -11.749
  465    HB3  ASP  58          2HB       ASP  58   2.675  -5.190 -11.202
  466    H    ASP  59           H        ASP  59  -0.987  -3.655 -12.135
  467    HA   ASP  59           HA       ASP  59  -2.605  -5.068 -10.293
  468    HB2  ASP  59          1HB       ASP  59  -3.380  -3.376 -11.983
  469    HB3  ASP  59          2HB       ASP  59  -3.176  -4.598 -13.219
  470    H    THR  60           H        THR  60  -0.449  -6.109 -12.697
  471    HA   THR  60           HA       THR  60  -1.633  -8.782 -12.794
  472    HB   THR  60           HB       THR  60   0.434  -7.408 -14.485
  473    HG1  THR  60           HG1      THR  60  -2.185  -7.568 -14.595
  474   HG21  THR  60          1HG2      THR  60   0.590  -9.430 -15.822
  475   HG22  THR  60          2HG2      THR  60  -0.494 -10.269 -14.714
  476   HG23  THR  60          3HG2      THR  60   1.099  -9.750 -14.166
  477    H    GLU  61           H        GLU  61   1.656  -7.351 -12.515
  478    HA   GLU  61           HA       GLU  61   2.740  -9.835 -11.548
  479    HB2  GLU  61          1HB       GLU  61   4.193  -7.208 -11.523
  480    HB3  GLU  61          2HB       GLU  61   4.837  -8.832 -11.701
  481    HG2  GLU  61          1HG       GLU  61   3.728  -9.009 -13.885
  482    HG3  GLU  61          2HG       GLU  61   3.201  -7.338 -13.722
  483    H    GLY  62           H        GLY  62   1.171  -7.298  -9.955
  484    HA2  GLY  62          1HA       GLY  62   0.672  -7.299  -7.668
  485    HA3  GLY  62          2HA       GLY  62   1.969  -8.467  -7.416
  486    HA   PRO  63           HA       PRO  63   3.392  -4.528  -5.483
  487    HB2  PRO  63          1HB       PRO  63   5.039  -6.466  -3.972
  488    HB3  PRO  63          2HB       PRO  63   3.985  -5.177  -3.377
  489    HG2  PRO  63          1HG       PRO  63   3.323  -7.780  -3.169
  490    HG3  PRO  63          2HG       PRO  63   2.111  -6.505  -3.413
  491    HD2  PRO  63          1HD       PRO  63   3.232  -8.468  -5.374
  492    HD3  PRO  63          2HD       PRO  63   1.583  -7.805  -5.248
  493    H    LEU  64           H        LEU  64   4.926  -3.436  -6.491
  494    HA   LEU  64           HA       LEU  64   7.103  -4.849  -7.813
  495    HB2  LEU  64          1HB       LEU  64   6.511  -1.886  -7.806
  496    HB3  LEU  64          2HB       LEU  64   7.593  -2.747  -8.885
  497    HG   LEU  64           HG       LEU  64   4.602  -3.137  -8.801
  498   HD11  LEU  64          1HD1      LEU  64   6.327  -1.686 -10.807
  499   HD12  LEU  64          2HD1      LEU  64   5.188  -0.941  -9.684
  500   HD13  LEU  64          3HD1      LEU  64   4.599  -1.999 -10.965
  501   HD21  LEU  64          1HD2      LEU  64   5.871  -5.129  -9.455
  502   HD22  LEU  64          2HD2      LEU  64   6.680  -4.191 -10.711
  503   HD23  LEU  64          3HD2      LEU  64   4.939  -4.466 -10.799
  504    H    VAL  65           H        VAL  65   8.414  -5.521  -6.252
  505    HA   VAL  65           HA       VAL  65   8.989  -4.347  -3.844
  506    HB   VAL  65           HB       VAL  65  10.711  -6.185  -5.486
  507   HG11  VAL  65          1HG1      VAL  65  10.937  -5.485  -2.561
  508   HG12  VAL  65          2HG1      VAL  65  12.076  -5.027  -3.829
  509   HG13  VAL  65          3HG1      VAL  65  11.869  -6.727  -3.399
  510   HG21  VAL  65          1HG2      VAL  65   8.750  -6.673  -3.257
  511   HG22  VAL  65          2HG2      VAL  65   9.801  -7.902  -3.962
  512   HG23  VAL  65          3HG2      VAL  65   8.561  -7.129  -4.948
  513    H    ASP  66           H        ASP  66  10.765  -3.939  -6.902
  514    HA   ASP  66           HA       ASP  66  12.954  -2.549  -5.849
  515    HB2  ASP  66          1HB       ASP  66  12.960  -3.450  -8.105
  516    HB3  ASP  66          2HB       ASP  66  11.717  -2.302  -8.590
  517    H    ASN  67           H        ASN  67   9.950  -1.257  -7.278
  518    HA   ASN  67           HA       ASN  67  10.579   1.452  -6.779
  519    HB2  ASN  67          1HB       ASN  67   7.940   0.067  -7.240
  520    HB3  ASN  67          2HB       ASN  67   8.085   1.804  -7.023
  521   HD21  ASN  67          1HD2      ASN  67   7.330   2.284  -9.040
  522   HD22  ASN  67          2HD2      ASN  67   8.254   1.999 -10.475
  523    H    LEU  68           H        LEU  68   8.950  -1.030  -4.939
  524    HA   LEU  68           HA       LEU  68   7.876   0.538  -2.895
  525    HB2  LEU  68          1HB       LEU  68   8.689  -2.330  -3.121
  526    HB3  LEU  68          2HB       LEU  68   8.208  -1.683  -1.560
  527    HG   LEU  68           HG       LEU  68   6.456  -1.411  -3.986
  528   HD11  LEU  68          1HD1      LEU  68   5.256  -3.399  -3.242
  529   HD12  LEU  68          2HD1      LEU  68   6.454  -3.654  -1.971
  530   HD13  LEU  68          3HD1      LEU  68   6.922  -3.791  -3.664
  531   HD21  LEU  68          1HD2      LEU  68   4.708  -1.170  -2.306
  532   HD22  LEU  68          2HD2      LEU  68   5.981   0.028  -2.075
  533   HD23  LEU  68          3HD2      LEU  68   5.904  -1.387  -1.027
  534    H    VAL  69           H        VAL  69  11.012  -1.083  -3.123
  535    HA   VAL  69           HA       VAL  69  11.967  -0.218  -0.598
  536    HB   VAL  69           HB       VAL  69  13.505  -1.100  -3.032
  537   HG11  VAL  69          1HG1      VAL  69  14.959   0.104  -1.555
  538   HG12  VAL  69          2HG1      VAL  69  15.280  -1.620  -1.371
  539   HG13  VAL  69          3HG1      VAL  69  14.325  -0.766  -0.159
  540   HG21  VAL  69          1HG2      VAL  69  13.569  -3.269  -1.972
  541   HG22  VAL  69          2HG2      VAL  69  11.894  -2.756  -2.178
  542   HG23  VAL  69          3HG2      VAL  69  12.662  -2.649  -0.593
  543    H    HIS  70           H        HIS  70  12.410   1.050  -3.901
  544    HA   HIS  70           HA       HIS  70  14.152   3.145  -3.187
  545    HB2  HIS  70          1HB       HIS  70  12.331   2.667  -5.517
  546    HB3  HIS  70          2HB       HIS  70  13.111   4.235  -5.326
  547    HD1  HIS  70           HD1      HIS  70  13.686   0.895  -6.654
  548    HD2  HIS  70           HD2      HIS  70  16.033   4.028  -5.251
  549    HE1  HIS  70           HE1      HIS  70  16.005   0.444  -7.515
  550    HE2  HIS  70           HE2      HIS  70  17.394   2.386  -6.709
  551    H    GLN  71           H        GLN  71  10.737   2.802  -2.925
  552    HA   GLN  71           HA       GLN  71  10.195   5.604  -2.509
  553    HB2  GLN  71          1HB       GLN  71   8.553   4.094  -3.541
  554    HB3  GLN  71          2HB       GLN  71   8.487   3.147  -2.065
  555    HG2  GLN  71          1HG       GLN  71   6.564   4.637  -2.290
  556    HG3  GLN  71          2HG       GLN  71   7.532   4.995  -0.864
  557   HE21  GLN  71          1HE2      GLN  71   8.400   6.956  -0.624
  558   HE22  GLN  71          2HE2      GLN  71   8.216   8.246  -1.751
  559    H    LEU  72           H        LEU  72   9.825   2.720  -0.472
  560    HA   LEU  72           HA       LEU  72   9.365   4.163   1.896
  561    HB2  LEU  72          1HB       LEU  72  10.222   1.310   1.452
  562    HB3  LEU  72          2HB       LEU  72   9.788   1.955   3.020
  563    HG   LEU  72           HG       LEU  72   7.924   1.892   0.645
  564   HD11  LEU  72          1HD1      LEU  72   6.835   0.009   1.792
  565   HD12  LEU  72          2HD1      LEU  72   8.123   0.009   2.999
  566   HD13  LEU  72          3HD1      LEU  72   8.490  -0.380   1.318
  567   HD21  LEU  72          1HD2      LEU  72   7.499   2.491   3.570
  568   HD22  LEU  72          2HD2      LEU  72   6.199   2.222   2.410
  569   HD23  LEU  72          3HD2      LEU  72   7.289   3.593   2.206
  570    H    ALA  73           H        ALA  73  12.273   2.503   0.696
  571    HA   ALA  73           HA       ALA  73  13.819   3.224   3.006
  572    HB1  ALA  73          1HB       ALA  73  15.560   1.947   2.047
  573    HB2  ALA  73          2HB       ALA  73  14.826   2.032   0.447
  574    HB3  ALA  73          3HB       ALA  73  14.053   1.091   1.717
  575    H    HIS  74           H        HIS  74  12.847   5.534   1.494
  576    HA   HIS  74           HA       HIS  74  15.032   6.509  -0.085
  577    HB2  HIS  74          1HB       HIS  74  13.801   8.564  -0.341
  578    HB3  HIS  74          2HB       HIS  74  12.678   7.223  -0.500
  579    HD1  HIS  74           HD1      HIS  74  12.576  10.433   0.673
  580    HD2  HIS  74           HD2      HIS  74  11.612   6.811   2.477
  581    HE1  HIS  74           HE1      HIS  74  11.018  11.010   2.554
  582    HE2  HIS  74           HE2      HIS  74  10.554   8.827   3.715
  583    H    GLY  75           H        GLY  75  16.800   6.290   1.260
  584    HA2  GLY  75          1HA       GLY  75  18.388   7.559   2.519
  585    HA3  GLY  75          2HA       GLY  75  17.050   8.371   3.325
  586    H    ARG  76           H        ARG  76  17.030   4.943   2.820
  587    HA   ARG  76           HA       ARG  76  17.867   4.424   5.568
  588    HB2  ARG  76          1HB       ARG  76  15.139   3.985   4.462
  589    HB3  ARG  76          2HB       ARG  76  15.771   2.776   5.576
  590    HG2  ARG  76          1HG       ARG  76  16.207   4.667   7.175
  591    HG3  ARG  76          2HG       ARG  76  15.286   5.701   6.081
  592    HD2  ARG  76          1HD       ARG  76  13.401   4.060   6.281
  593    HD3  ARG  76          2HD       ARG  76  14.320   3.265   7.556
  594    HE   ARG  76           HE       ARG  76  13.862   6.103   7.925
  595   HH11  ARG  76          1HH1      ARG  76  12.822   2.840   8.648
  596   HH12  ARG  76          2HH1      ARG  76  11.809   3.321   9.968
  597   HH21  ARG  76          1HH2      ARG  76  12.543   6.735   9.677
  598   HH22  ARG  76          2HH2      ARG  76  11.663   5.531  10.566
  599    H    ASP  77           H        ASP  77  17.973   1.969   5.928
  600    HA   ASP  77           HA       ASP  77  19.556   0.801   3.919
  601    HB2  ASP  77          1HB       ASP  77  18.341  -0.264   6.444
  602    HB3  ASP  77          2HB       ASP  77  19.155  -1.340   5.314
  603    H    ALA  78           H        ALA  78  18.776   0.402   2.035
  604    HA   ALA  78           HA       ALA  78  16.198  -0.334   1.318
  605    HB1  ALA  78          1HB       ALA  78  18.788  -0.956  -0.088
  606    HB2  ALA  78          2HB       ALA  78  17.866   0.541  -0.234
  607    HB3  ALA  78          3HB       ALA  78  17.184  -0.976  -0.817
  608    H    GLU  79           H        GLU  79  18.911  -2.248   2.378
  609    HA   GLU  79           HA       GLU  79  18.033  -4.784   1.513
  610    HB2  GLU  79          1HB       GLU  79  19.841  -3.991   3.794
  611    HB3  GLU  79          2HB       GLU  79  19.604  -5.648   3.255
  612    HG2  GLU  79          1HG       GLU  79  20.528  -5.132   1.101
  613    HG3  GLU  79          2HG       GLU  79  20.649  -3.425   1.516
  614    H    GLU  80           H        GLU  80  17.573  -3.029   4.556
  615    HA   GLU  80           HA       GLU  80  16.153  -5.127   5.852
  616    HB2  GLU  80          1HB       GLU  80  16.226  -2.162   6.432
  617    HB3  GLU  80          2HB       GLU  80  15.568  -3.392   7.508
  618    HG2  GLU  80          1HG       GLU  80  17.851  -4.433   7.513
  619    HG3  GLU  80          2HG       GLU  80  18.420  -3.002   6.670
  620    H    VAL  81           H        VAL  81  15.214  -2.152   4.204
  621    HA   VAL  81           HA       VAL  81  12.457  -2.323   4.575
  622    HB   VAL  81           HB       VAL  81  14.074  -1.024   2.395
  623   HG11  VAL  81          1HG1      VAL  81  11.138  -0.752   3.024
  624   HG12  VAL  81          2HG1      VAL  81  11.848  -1.357   1.526
  625   HG13  VAL  81          3HG1      VAL  81  12.044   0.339   1.975
  626   HG21  VAL  81          1HG2      VAL  81  12.825  -0.038   4.944
  627   HG22  VAL  81          2HG2      VAL  81  13.511   1.019   3.709
  628   HG23  VAL  81          3HG2      VAL  81  14.543  -0.138   4.553
  629    H    ARG  82           H        ARG  82  14.447  -3.462   1.839
  630    HA   ARG  82           HA       ARG  82  12.439  -4.549   0.247
  631    HB2  ARG  82          1HB       ARG  82  14.866  -4.271  -0.345
  632    HB3  ARG  82          2HB       ARG  82  15.199  -5.699   0.624
  633    HG2  ARG  82          1HG       ARG  82  13.642  -6.970  -0.832
  634    HG3  ARG  82          2HG       ARG  82  13.520  -5.543  -1.854
  635    HD2  ARG  82          1HD       ARG  82  16.006  -7.122  -1.241
  636    HD3  ARG  82          2HD       ARG  82  15.159  -7.035  -2.785
  637    HE   ARG  82           HE       ARG  82  15.789  -4.642  -2.832
  638   HH11  ARG  82          1HH1      ARG  82  17.631  -6.856  -0.826
  639   HH12  ARG  82          2HH1      ARG  82  19.075  -5.896  -0.879
  640   HH21  ARG  82          1HH2      ARG  82  17.676  -3.355  -2.857
  641   HH22  ARG  82          2HH2      ARG  82  19.099  -3.902  -2.024
  642    H    THR  83           H        THR  83  14.286  -5.965   2.885
  643    HA   THR  83           HA       THR  83  13.372  -8.592   2.691
  644    HB   THR  83           HB       THR  83  14.468  -6.942   4.952
  645    HG1  THR  83           HG1      THR  83  16.154  -7.493   3.803
  646   HG21  THR  83          1HG2      THR  83  14.700  -9.002   6.275
  647   HG22  THR  83          2HG2      THR  83  13.765  -9.878   5.062
  648   HG23  THR  83          3HG2      THR  83  13.009  -8.585   5.996
  649    H    GLU  84           H        GLU  84  12.222  -5.917   4.733
  650    HA   GLU  84           HA       GLU  84  10.081  -7.238   5.939
  651    HB2  GLU  84          1HB       GLU  84  10.443  -4.319   5.285
  652    HB3  GLU  84          2HB       GLU  84   9.109  -4.939   6.243
  653    HG2  GLU  84          1HG       GLU  84  12.035  -5.038   6.916
  654    HG3  GLU  84          2HG       GLU  84  10.781  -4.098   7.716
  655    H    VAL  85           H        VAL  85  10.150  -5.309   2.951
  656    HA   VAL  85           HA       VAL  85   7.464  -5.474   2.268
  657    HB   VAL  85           HB       VAL  85   9.943  -5.318   0.558
  658   HG11  VAL  85          1HG1      VAL  85   8.472  -4.769  -1.339
  659   HG12  VAL  85          2HG1      VAL  85   7.070  -5.178  -0.349
  660   HG13  VAL  85          3HG1      VAL  85   8.243  -6.425  -0.773
  661   HG21  VAL  85          1HG2      VAL  85   7.808  -3.318   1.282
  662   HG22  VAL  85          2HG2      VAL  85   9.171  -3.013   0.204
  663   HG23  VAL  85          3HG2      VAL  85   9.457  -3.369   1.907
  664    H    LEU  86           H        LEU  86  10.118  -7.682   1.410
  665    HA   LEU  86           HA       LEU  86   8.660  -9.428  -0.198
  666    HB2  LEU  86          1HB       LEU  86  11.117  -9.889   1.492
  667    HB3  LEU  86          2HB       LEU  86  10.476 -11.075   0.359
  668    HG   LEU  86           HG       LEU  86  11.314  -8.305  -0.465
  669   HD11  LEU  86          1HD1      LEU  86  12.911 -10.859  -0.556
  670   HD12  LEU  86          2HD1      LEU  86  13.219  -9.486   0.509
  671   HD13  LEU  86          3HD1      LEU  86  13.395  -9.306  -1.238
  672   HD21  LEU  86          1HD2      LEU  86  10.772 -10.849  -1.981
  673   HD22  LEU  86          2HD2      LEU  86  11.424  -9.372  -2.690
  674   HD23  LEU  86          3HD2      LEU  86   9.801  -9.377  -2.002
  675    H    LYS  87           H        LYS  87   8.974  -9.267   3.285
  676    HA   LYS  87           HA       LYS  87   7.942 -11.842   3.887
  677    HB2  LYS  87          1HB       LYS  87   8.004  -9.280   5.484
  678    HB3  LYS  87          2HB       LYS  87   7.405 -10.800   6.130
  679    HG2  LYS  87          1HG       LYS  87   9.574 -11.820   5.856
  680    HG3  LYS  87          2HG       LYS  87  10.195 -10.348   5.088
  681    HD2  LYS  87          1HD       LYS  87   9.704  -9.114   7.182
  682    HD3  LYS  87          2HD       LYS  87   9.220 -10.636   7.929
  683    HE2  LYS  87          1HE       LYS  87  11.422 -11.524   7.715
  684    HE3  LYS  87          2HE       LYS  87  11.934 -10.164   6.717
  685    HZ1  LYS  87          1HZ       LYS  87  11.644  -8.696   8.608
  686    HZ2  LYS  87          2HZ       LYS  87  12.718  -9.949   8.995
  687    HZ3  LYS  87          3HZ       LYS  87  11.129  -9.993   9.569
  688    H    CYS  88           H        CYS  88   6.510  -8.951   2.787
  689    HA   CYS  88           HA       CYS  88   3.860  -9.792   3.697
  690    HB2  CYS  88          1HB       CYS  88   5.052  -7.145   2.974
  691    HB3  CYS  88          2HB       CYS  88   3.290  -7.366   2.914
  692    H    VAL  89           H        VAL  89   5.838  -9.649   0.940
  693    HA   VAL  89           HA       VAL  89   3.822  -9.418  -1.054
  694    HB   VAL  89           HB       VAL  89   6.572 -10.662  -1.205
  695   HG11  VAL  89          1HG1      VAL  89   6.321 -10.428  -3.642
  696   HG12  VAL  89          2HG1      VAL  89   4.654  -9.897  -3.404
  697   HG13  VAL  89          3HG1      VAL  89   5.131 -11.536  -2.958
  698   HG21  VAL  89          1HG2      VAL  89   6.689  -8.311  -0.685
  699   HG22  VAL  89          2HG2      VAL  89   5.561  -7.932  -1.988
  700   HG23  VAL  89          3HG2      VAL  89   7.167  -8.559  -2.364
  701    H    ASP  90           H        ASP  90   2.234 -10.812  -1.296
  702    HA   ASP  90           HA       ASP  90   2.768 -13.669  -0.873
  703    HB2  ASP  90          1HB       ASP  90   1.317 -12.671   0.896
  704    HB3  ASP  90          2HB       ASP  90   0.162 -12.226  -0.362
  705    H    LYS  91           H        LYS  91   1.132 -15.058  -2.035
  706    HA   LYS  91           HA       LYS  91   1.131 -14.284  -4.831
  707    HB2  LYS  91          1HB       LYS  91   0.061 -16.849  -3.675
  708    HB3  LYS  91          2HB       LYS  91   0.686 -16.549  -5.292
  709    HG2  LYS  91          1HG       LYS  91   2.920 -16.261  -4.387
  710    HG3  LYS  91          2HG       LYS  91   2.304 -16.560  -2.765
  711    HD2  LYS  91          1HD       LYS  91   2.142 -18.520  -5.050
  712    HD3  LYS  91          2HD       LYS  91   3.379 -18.544  -3.793
  713    HE2  LYS  91          1HE       LYS  91   1.600 -18.802  -2.100
  714    HE3  LYS  91          2HE       LYS  91   0.407 -18.869  -3.395
  715    HZ1  LYS  91          1HZ       LYS  91   1.025 -21.075  -2.636
  716    HZ2  LYS  91          2HZ       LYS  91   2.645 -20.783  -3.015
  717    HZ3  LYS  91          3HZ       LYS  91   1.488 -20.849  -4.245
  718    H    ASN  92           H        ASN  92  -0.703 -14.398  -6.181
  719    HA   ASN  92           HA       ASN  92  -3.072 -13.271  -4.976
  720    HB2  ASN  92          1HB       ASN  92  -2.120 -12.474  -7.150
  721    HB3  ASN  92          2HB       ASN  92  -2.563 -14.020  -7.857
  722   HD21  ASN  92          1HD2      ASN  92  -3.786 -12.759  -9.358
  723   HD22  ASN  92          2HD2      ASN  92  -5.372 -12.205  -8.937
  724    H    THR  93           H        THR  93  -3.475 -15.240  -3.687
  725    HA   THR  93           HA       THR  93  -4.509 -17.544  -5.113
  726    HB   THR  93           HB       THR  93  -4.948 -18.389  -2.775
  727    HG1  THR  93           HG1      THR  93  -4.890 -16.887  -1.276
  728   HG21  THR  93          1HG2      THR  93  -2.574 -18.745  -2.270
  729   HG22  THR  93          2HG2      THR  93  -2.150 -17.490  -3.435
  730   HG23  THR  93          3HG2      THR  93  -2.923 -18.977  -3.983
  731    H    ASP  94           H        ASP  94  -5.743 -14.598  -4.091
  732    HA   ASP  94           HA       ASP  94  -8.435 -15.564  -3.568
  733    HB2  ASP  94          1HB       ASP  94  -7.169 -12.833  -3.567
  734    HB3  ASP  94          2HB       ASP  94  -8.924 -13.031  -3.498
  735    H    ASN  95           H        ASN  95  -6.555 -14.534  -6.181
  736    HA   ASN  95           HA       ASN  95  -6.932 -14.120  -8.358
  737    HB2  ASN  95          1HB       ASN  95  -9.597 -15.363  -7.727
  738    HB3  ASN  95          2HB       ASN  95  -9.113 -14.886  -9.346
  739   HD21  ASN  95          1HD2      ASN  95  -7.496 -16.032 -10.396
  740   HD22  ASN  95          2HD2      ASN  95  -6.998 -17.612  -9.865
  741    H    ASN  96           H        ASN  96  -7.669 -12.217  -6.182
  742    HA   ASN  96           HA       ASN  96  -9.259 -10.385  -7.825
  743    HB2  ASN  96          1HB       ASN  96 -10.799 -11.164  -6.151
  744    HB3  ASN  96          2HB       ASN  96  -9.615 -10.927  -4.865
  745   HD21  ASN  96          1HD2      ASN  96 -11.843  -9.410  -7.044
  746   HD22  ASN  96          2HD2      ASN  96 -11.868  -7.863  -6.271
  747    H    ALA  97           H        ALA  97  -8.167  -8.591  -8.204
  748    HA   ALA  97           HA       ALA  97  -5.554  -8.271  -7.180
  749    HB1  ALA  97          1HB       ALA  97  -7.172  -6.306  -8.789
  750    HB2  ALA  97          2HB       ALA  97  -6.237  -7.640  -9.461
  751    HB3  ALA  97          3HB       ALA  97  -5.419  -6.333  -8.605
  752    H    CYS  98           H        CYS  98  -8.628  -6.701  -6.400
  753    HA   CYS  98           HA       CYS  98  -7.568  -4.551  -4.910
  754    HB2  CYS  98          1HB       CYS  98 -10.205  -5.980  -4.484
  755    HB3  CYS  98          2HB       CYS  98  -9.764  -4.414  -3.812
  756    H    HIS  99           H        HIS  99  -8.479  -7.845  -3.902
  757    HA   HIS  99           HA       HIS  99  -7.867  -7.284  -1.145
  758    HB2  HIS  99          1HB       HIS  99  -9.540  -9.028  -2.040
  759    HB3  HIS  99          2HB       HIS  99  -8.133 -10.041  -2.338
  760    HD1  HIS  99           HD1      HIS  99  -8.896 -11.789  -0.574
  761    HD2  HIS  99           HD2      HIS  99  -8.275  -7.969   0.969
  762    HE1  HIS  99           HE1      HIS  99  -8.929 -12.043   1.925
  763    HE2  HIS  99           HE2      HIS  99  -8.701  -9.710   2.831
  764    H    TRP 100           H        TRP 100  -6.158  -8.415  -3.909
  765    HA   TRP 100           HA       TRP 100  -4.003  -9.684  -2.576
  766    HB2  TRP 100          1HB       TRP 100  -4.548 -10.049  -4.965
  767    HB3  TRP 100          2HB       TRP 100  -4.032  -8.401  -5.322
  768    HD1  TRP 100           HD1      TRP 100  -1.775 -10.032  -2.842
  769    HE1  TRP 100           HE1      TRP 100   0.397 -10.791  -3.989
  770    HE3  TRP 100           HE3      TRP 100  -3.192  -9.466  -7.723
  771    HZ2  TRP 100           HZ2      TRP 100   1.376 -11.124  -6.613
  772    HZ3  TRP 100           HZ3      TRP 100  -1.581 -10.034  -9.487
  773    HH2  TRP 100           HH2      TRP 100   0.653 -10.846  -8.950
  774    H    ALA 101           H        ALA 101  -4.250  -6.466  -4.105
  775    HA   ALA 101           HA       ALA 101  -1.768  -5.493  -3.213
  776    HB1  ALA 101          1HB       ALA 101  -4.285  -3.979  -3.889
  777    HB2  ALA 101          2HB       ALA 101  -2.999  -4.425  -5.010
  778    HB3  ALA 101          3HB       ALA 101  -2.682  -3.265  -3.717
  779    H    PHE 102           H        PHE 102  -4.957  -5.523  -1.790
  780    HA   PHE 102           HA       PHE 102  -4.433  -3.796   0.355
  781    HB2  PHE 102          1HB       PHE 102  -6.691  -4.370  -0.381
  782    HB3  PHE 102          2HB       PHE 102  -6.464  -6.025   0.172
  783    HD1  PHE 102           HD1      PHE 102  -7.137  -6.595   2.326
  784    HD2  PHE 102           HD2      PHE 102  -6.399  -2.506   1.385
  785    HE1  PHE 102           HE1      PHE 102  -7.984  -5.935   4.537
  786    HE2  PHE 102           HE2      PHE 102  -7.238  -1.844   3.600
  787    HZ   PHE 102           HZ       PHE 102  -8.034  -3.555   5.179
  788    H    ARG 103           H        ARG 103  -3.852  -7.206  -0.156
  789    HA   ARG 103           HA       ARG 103  -3.361  -7.944   2.536
  790    HB2  ARG 103          1HB       ARG 103  -3.768  -9.618   0.791
  791    HB3  ARG 103          2HB       ARG 103  -2.281  -9.138  -0.016
  792    HG2  ARG 103          1HG       ARG 103  -0.935  -9.985   1.717
  793    HG3  ARG 103          2HG       ARG 103  -2.318 -10.165   2.794
  794    HD2  ARG 103          1HD       ARG 103  -1.865 -11.724   0.245
  795    HD3  ARG 103          2HD       ARG 103  -1.602 -12.326   1.883
  796    HE   ARG 103           HE       ARG 103  -4.117 -11.622   2.081
  797   HH11  ARG 103          1HH1      ARG 103  -2.506 -13.402  -0.474
  798   HH12  ARG 103          2HH1      ARG 103  -3.976 -14.119  -1.059
  799   HH21  ARG 103          1HH2      ARG 103  -6.015 -12.579   1.351
  800   HH22  ARG 103          2HH2      ARG 103  -5.992 -13.640  -0.029
  801    H    GLY 104           H        GLY 104  -1.243  -6.890  -0.096
  802    HA2  GLY 104          1HA       GLY 104   1.192  -7.135   1.293
  803    HA3  GLY 104          2HA       GLY 104   0.900  -6.064  -0.083
  804    H    PHE 105           H        PHE 105  -0.985  -4.368   0.911
  805    HA   PHE 105           HA       PHE 105   0.590  -2.558   2.383
  806    HB2  PHE 105          1HB       PHE 105  -1.010  -1.666   0.882
  807    HB3  PHE 105          2HB       PHE 105  -2.316  -2.580   1.621
  808    HD1  PHE 105           HD1      PHE 105   0.327  -0.257   2.853
  809    HD2  PHE 105           HD2      PHE 105  -3.822  -1.214   2.716
  810    HE1  PHE 105           HE1      PHE 105  -0.174   1.696   4.264
  811    HE2  PHE 105           HE2      PHE 105  -4.319   0.728   4.134
  812    HZ   PHE 105           HZ       PHE 105  -2.495   2.187   4.909
  813    H    LYS 106           H        LYS 106  -2.180  -4.567   3.266
  814    HA   LYS 106           HA       LYS 106  -2.546  -3.607   5.868
  815    HB2  LYS 106          1HB       LYS 106  -4.358  -4.803   5.148
  816    HB3  LYS 106          2HB       LYS 106  -3.387  -6.044   4.363
  817    HG2  LYS 106          1HG       LYS 106  -2.787  -6.784   6.737
  818    HG3  LYS 106          2HG       LYS 106  -4.140  -5.769   7.248
  819    HD2  LYS 106          1HD       LYS 106  -5.603  -7.024   5.683
  820    HD3  LYS 106          2HD       LYS 106  -4.245  -8.093   5.328
  821    HE2  LYS 106          1HE       LYS 106  -5.566  -9.194   6.959
  822    HE3  LYS 106          2HE       LYS 106  -4.139  -8.587   7.797
  823    HZ1  LYS 106          1HZ       LYS 106  -6.045  -8.116   9.115
  824    HZ2  LYS 106          2HZ       LYS 106  -6.864  -7.416   7.812
  825    HZ3  LYS 106          3HZ       LYS 106  -5.504  -6.647   8.477
  826    H    CYS 107           H        CYS 107  -0.678  -6.360   4.661
  827    HA   CYS 107           HA       CYS 107   0.169  -7.367   7.122
  828    HB2  CYS 107          1HB       CYS 107   0.419  -8.755   5.237
  829    HB3  CYS 107          2HB       CYS 107   1.284  -7.525   4.323
  830    H    PHE 108           H        PHE 108   1.578  -4.937   4.986
  831    HA   PHE 108           HA       PHE 108   4.040  -4.777   6.406
  832    HB2  PHE 108          1HB       PHE 108   3.564  -4.235   3.944
  833    HB3  PHE 108          2HB       PHE 108   2.985  -2.679   4.532
  834    HD1  PHE 108           HD1      PHE 108   5.873  -4.794   3.925
  835    HD2  PHE 108           HD2      PHE 108   4.561  -1.081   5.539
  836    HE1  PHE 108           HE1      PHE 108   8.182  -3.970   3.900
  837    HE2  PHE 108           HE2      PHE 108   6.877  -0.252   5.514
  838    HZ   PHE 108           HZ       PHE 108   8.689  -1.698   4.688
  839    H    GLN 109           H        GLN 109   1.151  -2.706   6.235
  840    HA   GLN 109           HA       GLN 109   2.161  -0.699   7.954
  841    HB2  GLN 109          1HB       GLN 109  -0.079   0.191   7.974
  842    HB3  GLN 109          2HB       GLN 109   0.329  -0.322   6.346
  843    HG2  GLN 109          1HG       GLN 109  -1.671  -1.299   6.364
  844    HG3  GLN 109          2HG       GLN 109  -0.900  -2.543   7.352
  845   HE21  GLN 109          1HE2      GLN 109  -2.802  -3.048   8.413
  846   HE22  GLN 109          2HE2      GLN 109  -3.534  -1.999   9.579
  847    H    LYS 110           H        LYS 110   0.878  -3.797   8.575
  848    HA   LYS 110           HA       LYS 110  -0.173  -3.340  11.173
  849    HB2  LYS 110          1HB       LYS 110  -0.774  -5.277   9.799
  850    HB3  LYS 110          2HB       LYS 110   0.877  -5.863   9.884
  851    HG2  LYS 110          1HG       LYS 110  -0.424  -7.112  11.415
  852    HG3  LYS 110          2HG       LYS 110   0.609  -6.030  12.345
  853    HD2  LYS 110          1HD       LYS 110  -1.247  -4.487  12.656
  854    HD3  LYS 110          2HD       LYS 110  -2.291  -5.523  11.684
  855    HE2  LYS 110          1HE       LYS 110  -2.030  -7.319  13.335
  856    HE3  LYS 110          2HE       LYS 110  -0.996  -6.273  14.307
  857    HZ1  LYS 110          1HZ       LYS 110  -3.245  -6.284  15.147
  858    HZ2  LYS 110          2HZ       LYS 110  -3.846  -5.775  13.652
  859    HZ3  LYS 110          3HZ       LYS 110  -2.859  -4.746  14.559
  860    H    ASN 111           H        ASN 111   3.031  -3.766   9.923
  861    HA   ASN 111           HA       ASN 111   4.043  -4.017  12.681
  862    HB2  ASN 111          1HB       ASN 111   5.251  -5.247  10.198
  863    HB3  ASN 111          2HB       ASN 111   5.899  -5.355  11.832
  864   HD21  ASN 111          1HD2      ASN 111   3.454  -6.469   9.640
  865   HD22  ASN 111          2HD2      ASN 111   2.862  -7.748  10.638
  866    H    ASN 112           H        ASN 112   4.354  -2.471   9.577
  867    HA   ASN 112           HA       ASN 112   6.504  -0.794  10.673
  868    HB2  ASN 112          1HB       ASN 112   6.472  -2.127   7.959
  869    HB3  ASN 112          2HB       ASN 112   7.584  -0.826   8.411
  870   HD21  ASN 112          1HD2      ASN 112   7.809  -3.818   7.771
  871   HD22  ASN 112          2HD2      ASN 112   8.833  -4.418   9.030
  872    H    LEU 113           H        LEU 113   4.325   0.386  10.965
  873    HA   LEU 113           HA       LEU 113   3.302   1.602   8.551
  874    HB2  LEU 113          1HB       LEU 113   1.711   1.001  10.242
  875    HB3  LEU 113          2HB       LEU 113   2.561   1.941  11.450
  876    HG   LEU 113           HG       LEU 113   1.952   4.001  10.178
  877   HD11  LEU 113          1HD1      LEU 113   0.289   3.872   8.433
  878   HD12  LEU 113          2HD1      LEU 113   0.240   2.116   8.574
  879   HD13  LEU 113          3HD1      LEU 113   1.699   2.910   7.984
  880   HD21  LEU 113          1HD2      LEU 113   0.615   3.230  12.080
  881   HD22  LEU 113          2HD2      LEU 113  -0.356   2.240  10.992
  882   HD23  LEU 113          3HD2      LEU 113  -0.396   3.998  10.855
  883    H    SER 114           H        SER 114   5.521   2.327  11.083
  884    HA   SER 114           HA       SER 114   5.574   5.142  10.871
  885    HB2  SER 114          1HB       SER 114   7.859   3.318  11.662
  886    HB3  SER 114          2HB       SER 114   7.672   5.021  12.078
  887    HG   SER 114           HG       SER 114   7.028   3.644  13.787
  888    H    LEU 115           H        LEU 115   7.327   2.577   9.179
  889    HA   LEU 115           HA       LEU 115   9.058   4.266   7.724
  890    HB2  LEU 115          1HB       LEU 115   9.432   1.861   8.001
  891    HB3  LEU 115          2HB       LEU 115   8.008   1.524   7.035
  892    HG   LEU 115           HG       LEU 115   9.104   2.566   5.083
  893   HD11  LEU 115          1HD1      LEU 115  10.560   4.122   6.209
  894   HD12  LEU 115          2HD1      LEU 115  11.520   3.033   5.207
  895   HD13  LEU 115          3HD1      LEU 115  11.448   2.795   6.955
  896   HD21  LEU 115          1HD2      LEU 115  10.735   0.398   6.396
  897   HD22  LEU 115          2HD2      LEU 115  10.710   0.787   4.677
  898   HD23  LEU 115          3HD2      LEU 115   9.261   0.155   5.460
  899    H    ILE 116           H        ILE 116   5.789   3.160   7.218
  900    HA   ILE 116           HA       ILE 116   5.521   4.002   4.530
  901    HB   ILE 116           HB       ILE 116   3.417   3.602   6.668
  902   HG12  ILE 116          1HG1      ILE 116   4.378   1.805   4.426
  903   HG13  ILE 116          2HG1      ILE 116   4.684   1.574   6.152
  904   HG21  ILE 116          1HG2      ILE 116   1.816   3.464   4.807
  905   HG22  ILE 116          2HG2      ILE 116   3.098   3.930   3.688
  906   HG23  ILE 116          3HG2      ILE 116   2.558   5.059   4.932
  907   HD11  ILE 116          1HD1      ILE 116   2.027   1.443   4.756
  908   HD12  ILE 116          2HD1      ILE 116   2.254   1.320   6.497
  909   HD13  ILE 116          3HD1      ILE 116   2.937   0.094   5.429
  910    H    LYS 117           H        LYS 117   4.739   5.496   7.641
  911    HA   LYS 117           HA       LYS 117   3.752   7.930   6.649
  912    HB2  LYS 117          1HB       LYS 117   5.040   7.192   9.267
  913    HB3  LYS 117          2HB       LYS 117   4.420   8.803   8.941
  914    HG2  LYS 117          1HG       LYS 117   2.188   7.889   8.602
  915    HG3  LYS 117          2HG       LYS 117   2.793   6.260   8.890
  916    HD2  LYS 117          1HD       LYS 117   3.381   6.835  11.164
  917    HD3  LYS 117          2HD       LYS 117   2.937   8.519  10.892
  918    HE2  LYS 117          1HE       LYS 117   0.615   7.864  10.552
  919    HE3  LYS 117          2HE       LYS 117   1.052   6.169  10.761
  920    HZ1  LYS 117          1HZ       LYS 117   1.398   8.266  12.834
  921    HZ2  LYS 117          2HZ       LYS 117   1.663   6.605  13.024
  922    HZ3  LYS 117          3HZ       LYS 117   0.098   7.186  12.769
  923    H    ALA 118           H        ALA 118   6.995   6.878   7.567
  924    HA   ALA 118           HA       ALA 118   8.286   9.368   7.228
  925    HB1  ALA 118          1HB       ALA 118   9.439   6.599   7.039
  926    HB2  ALA 118          2HB       ALA 118   9.205   7.513   8.529
  927    HB3  ALA 118          3HB       ALA 118  10.339   8.092   7.307
  928    H    SER 119           H        SER 119   7.498   6.775   5.022
  929    HA   SER 119           HA       SER 119   9.242   7.456   2.936
  930    HB2  SER 119          1HB       SER 119   8.011   5.294   3.139
  931    HB3  SER 119          2HB       SER 119   6.533   6.137   2.679
  932    HG   SER 119           HG       SER 119   8.892   5.830   1.126
  933    H    ILE 120           H        ILE 120   5.967   8.556   3.693
  934    HA   ILE 120           HA       ILE 120   5.966  10.237   1.293
  935    HB   ILE 120           HB       ILE 120   3.597  10.666   1.815
  936   HG12  ILE 120          1HG1      ILE 120   3.889   8.609   4.001
  937   HG13  ILE 120          2HG1      ILE 120   3.916  10.344   4.309
  938   HG21  ILE 120          1HG2      ILE 120   4.357   7.755   1.744
  939   HG22  ILE 120          2HG2      ILE 120   4.186   8.823   0.353
  940   HG23  ILE 120          3HG2      ILE 120   2.774   8.408   1.324
  941   HD11  ILE 120          1HD1      ILE 120   1.673  10.544   3.386
  942   HD12  ILE 120          2HD1      ILE 120   1.720   9.406   4.733
  943   HD13  ILE 120          3HD1      ILE 120   1.644   8.811   3.074
  944    H    LYS 121           H        LYS 121   7.204  10.587   4.214
  945    HA   LYS 121           HA       LYS 121   5.964  12.984   5.144
  946    HB2  LYS 121          1HB       LYS 121   7.059  11.418   6.666
  947    HB3  LYS 121          2HB       LYS 121   8.608  11.736   5.901
  948    HG2  LYS 121          1HG       LYS 121   8.452  14.085   6.625
  949    HG3  LYS 121          2HG       LYS 121   6.928  13.712   7.432
  950    HD2  LYS 121          1HD       LYS 121   8.088  12.074   8.844
  951    HD3  LYS 121          2HD       LYS 121   9.611  12.480   8.051
  952    HE2  LYS 121          1HE       LYS 121   9.429  13.634  10.179
  953    HE3  LYS 121          2HE       LYS 121   9.402  14.787   8.847
  954    HZ1  LYS 121          1HZ       LYS 121   7.741  15.254  10.581
  955    HZ2  LYS 121          2HZ       LYS 121   6.984  13.782  10.243
  956    HZ3  LYS 121          3HZ       LYS 121   7.039  14.996   9.066
  957    H    LYS 122           H        LYS 122   6.349  14.997   4.602
  958    HA   LYS 122           HA       LYS 122   8.899  15.688   3.297
  959    HB2  LYS 122          1HB       LYS 122   6.362  15.808   2.103
  960    HB3  LYS 122          2HB       LYS 122   6.734  17.455   2.553
  961    HG2  LYS 122          1HG       LYS 122   8.821  17.362   1.312
  962    HG3  LYS 122          2HG       LYS 122   8.495  15.682   0.874
  963    HD2  LYS 122          1HD       LYS 122   6.458  16.396  -0.290
  964    HD3  LYS 122          2HD       LYS 122   6.807  18.070   0.134
  965    HE2  LYS 122          1HE       LYS 122   8.614  16.306  -1.514
  966    HE3  LYS 122          2HE       LYS 122   7.460  17.457  -2.186
  967    HZ1  LYS 122          1HZ       LYS 122   9.751  18.128  -0.421
  968    HZ2  LYS 122          2HZ       LYS 122   8.642  19.235  -1.054
  969    HZ3  LYS 122          3HZ       LYS 122   9.675  18.388  -2.088
  970    H    ASP 123           H        ASP 123   9.895  17.439   4.077
  971    HA   ASP 123           HA       ASP 123   8.601  18.787   6.330
  972    HB2  ASP 123          1HB       ASP 123  11.510  18.649   5.517
  973    HB3  ASP 123          2HB       ASP 123  10.905  19.623   6.850
  974    H21  ACD 201           H21      ACD   1  -4.310   4.375   1.818
  975    H22  ACD 201           H22      ACD   1  -3.057   4.830   2.978
  976    H31  ACD 201           H31      ACD   1  -2.037   6.341   1.292
  977    H32  ACD 201           H32      ACD   1  -3.304   5.933   0.136
  978    H41  ACD 201           H41      ACD   1  -2.573   3.590   0.081
  979    H42  ACD 201           H42      ACD   1  -1.181   4.640  -0.240
  980    H5   ACD 201           H5       ACD   1  -1.655   2.968   2.279
  981    H6   ACD 201           H6       ACD   1   0.555   3.699   2.802
  982    H71  ACD 201           H71      ACD   1   0.890   4.904   0.185
  983    H72  ACD 201           H72      ACD   1  -0.062   6.078   1.093
  984    H8   ACD 201           H8       ACD   1   1.818   6.470   2.657
  985    H9   ACD 201           H9       ACD   1   3.949   5.592   2.048
  986   H101  ACD 201          H101      ACD   1   2.910   4.721  -0.523
  987   H102  ACD 201          H102      ACD   1   2.471   3.430   0.600
  988    H11  ACD 201           H11      ACD   1   5.409   4.386   0.478
  989    H12  ACD 201           H12      ACD   1   5.800   2.059   0.192
  990   H131  ACD 201          H131      ACD   1   2.833   2.002  -0.523
  991   H132  ACD 201          H132      ACD   1   3.966   0.654  -0.611
  992    H14  ACD 201           H14      ACD   1   2.871   1.706   2.098
  993    H15  ACD 201           H15      ACD   1   2.646  -0.629   2.511
  994   H161  ACD 201          H161      ACD   1   2.717  -1.333  -0.276
  995   H162  ACD 201          H162      ACD   1   4.407  -0.976   0.089
  996   H171  ACD 201          H171      ACD   1   4.446  -2.640   1.869
  997   H172  ACD 201          H172      ACD   1   2.711  -2.910   1.709
  998   H181  ACD 201          H181      ACD   1   4.759  -3.461  -0.480
  999   H182  ACD 201          H182      ACD   1   3.025  -3.789  -0.578
 1000   H191  ACD 201          H191      ACD   1   5.000  -5.056   1.371
 1001   H192  ACD 201          H192      ACD   1   3.258  -5.314   1.426
 1002   H201  ACD 201          H201      ACD   1   5.061  -5.998  -0.910
 1003   H202  ACD 201          H202      ACD   1   3.350  -6.245  -0.870
 1004   H203  ACD 201          H203      ACD   1   4.376  -7.128   0.208
  Start of MODEL   29
    1    H1   MET   1          1H        MET   1  13.484  10.306 -16.000
    2    H2   MET   1          2H        MET   1  12.518   9.000 -15.532
    3    H3   MET   1          3H        MET   1  13.241   9.008 -17.057
    4    HA   MET   1           HA       MET   1  14.419   7.521 -15.623
    5    HB2  MET   1          1HB       MET   1  16.657   8.403 -15.894
    6    HB3  MET   1          2HB       MET   1  15.692   8.830 -17.299
    7    HG2  MET   1          1HG       MET   1  15.400  11.082 -16.436
    8    HG3  MET   1          2HG       MET   1  16.318  10.658 -14.993
    9    HE1  MET   1          1HE       MET   1  17.002  13.185 -16.756
   10    HE2  MET   1          2HE       MET   1  18.759  13.065 -16.833
   11    HE3  MET   1          3HE       MET   1  17.917  12.707 -15.326
   12    H    GLU   2           H        GLU   2  13.809  10.650 -14.214
   13    HA   GLU   2           HA       GLU   2  15.201  10.010 -11.759
   14    HB2  GLU   2          1HB       GLU   2  13.427  12.347 -12.466
   15    HB3  GLU   2          2HB       GLU   2  14.372  12.193 -10.995
   16    HG2  GLU   2          1HG       GLU   2  15.613  12.162 -13.716
   17    HG3  GLU   2          2HG       GLU   2  15.328  13.649 -12.817
   18    H    PHE   3           H        PHE   3  14.252   8.441 -10.624
   19    HA   PHE   3           HA       PHE   3  11.493   7.894 -10.612
   20    HB2  PHE   3          1HB       PHE   3  13.094   6.184  -9.965
   21    HB3  PHE   3          2HB       PHE   3  13.601   7.148  -8.573
   22    HD1  PHE   3           HD1      PHE   3  10.893   5.118 -10.000
   23    HD2  PHE   3           HD2      PHE   3  12.319   7.188  -6.574
   24    HE1  PHE   3           HE1      PHE   3   9.157   4.037  -8.632
   25    HE2  PHE   3           HE2      PHE   3  10.587   6.116  -5.192
   26    HZ   PHE   3           HZ       PHE   3   9.001   4.535  -6.223
   27    H    THR   4           H        THR   4   9.932   9.021  -9.785
   28    HA   THR   4           HA       THR   4  10.529  11.008  -7.718
   29    HB   THR   4           HB       THR   4   7.827  10.976  -8.873
   30    HG1  THR   4           HG1      THR   4  10.176  11.219 -10.456
   31   HG21  THR   4          1HG2      THR   4   8.757  12.730  -7.409
   32   HG22  THR   4          2HG2      THR   4   8.222  13.351  -8.972
   33   HG23  THR   4          3HG2      THR   4   9.941  13.111  -8.660
   34    H    VAL   5           H        VAL   5   9.962  10.714  -5.727
   35    HA   VAL   5           HA       VAL   5   8.420   8.327  -5.037
   36    HB   VAL   5           HB       VAL   5   9.417   8.332  -2.993
   37   HG11  VAL   5          1HG1      VAL   5  11.230   8.298  -4.552
   38   HG12  VAL   5          2HG1      VAL   5  11.719   9.115  -3.070
   39   HG13  VAL   5          3HG1      VAL   5  11.344  10.056  -4.511
   40   HG21  VAL   5          1HG2      VAL   5   9.583  11.344  -3.042
   41   HG22  VAL   5          2HG2      VAL   5  10.108  10.311  -1.712
   42   HG23  VAL   5          3HG2      VAL   5   8.405  10.371  -2.160
   43    H    SER   6           H        SER   6   6.548   8.336  -3.868
   44    HA   SER   6           HA       SER   6   4.886  10.634  -4.331
   45    HB2  SER   6          1HB       SER   6   3.133   9.112  -3.286
   46    HB3  SER   6          2HB       SER   6   3.887   8.530  -4.772
   47    HG   SER   6           HG       SER   6   4.642   7.790  -2.130
   48    H    THR   7           H        THR   7   5.304  12.293  -2.958
   49    HA   THR   7           HA       THR   7   5.609  11.841  -0.118
   50    HB   THR   7           HB       THR   7   5.714  14.285   0.066
   51    HG1  THR   7           HG1      THR   7   5.058  14.201  -2.720
   52   HG21  THR   7          1HG2      THR   7   7.757  13.084  -0.506
   53   HG22  THR   7          2HG2      THR   7   7.724  14.656  -1.304
   54   HG23  THR   7          3HG2      THR   7   7.359  13.194  -2.219
   55    H    THR   8           H        THR   8   4.142  13.516   1.259
   56    HA   THR   8           HA       THR   8   1.550  12.492   1.289
   57    HB   THR   8           HB       THR   8   2.358  15.210   2.337
   58    HG1  THR   8           HG1      THR   8   3.458  12.918   2.943
   59   HG21  THR   8          1HG2      THR   8   0.244  13.234   3.197
   60   HG22  THR   8          2HG2      THR   8  -0.037  14.786   2.407
   61   HG23  THR   8          3HG2      THR   8   0.635  14.735   4.037
   62    H    GLU   9           H        GLU   9   2.853  15.404  -0.206
   63    HA   GLU   9           HA       GLU   9   0.518  16.612  -1.104
   64    HB2  GLU   9          1HB       GLU   9   2.785  17.624  -1.141
   65    HB3  GLU   9          2HB       GLU   9   3.202  16.577  -2.488
   66    HG2  GLU   9          1HG       GLU   9   2.680  18.741  -3.333
   67    HG3  GLU   9          2HG       GLU   9   1.392  17.633  -3.803
   68    H    ASP  10           H        ASP  10   2.509  14.110  -2.601
   69    HA   ASP  10           HA       ASP  10   1.007  14.057  -5.045
   70    HB2  ASP  10          1HB       ASP  10   2.912  11.946  -4.006
   71    HB3  ASP  10          2HB       ASP  10   2.371  12.169  -5.666
   72    H    LEU  11           H        LEU  11   1.096  12.222  -2.071
   73    HA   LEU  11           HA       LEU  11  -0.379  10.010  -2.917
   74    HB2  LEU  11          1HB       LEU  11   0.936   9.894  -0.928
   75    HB3  LEU  11          2HB       LEU  11   0.005  11.186  -0.165
   76    HG   LEU  11           HG       LEU  11  -1.961   9.686  -0.143
   77   HD11  LEU  11          1HD1      LEU  11  -1.698   7.338  -0.638
   78   HD12  LEU  11          2HD1      LEU  11  -0.020   7.604  -1.112
   79   HD13  LEU  11          3HD1      LEU  11  -1.329   8.306  -2.061
   80   HD21  LEU  11          1HD2      LEU  11   0.470   8.463   1.152
   81   HD22  LEU  11          2HD2      LEU  11  -1.206   8.304   1.678
   82   HD23  LEU  11          3HD2      LEU  11  -0.396   9.867   1.774
   83    H    GLN  12           H        GLN  12  -1.452  13.059  -1.426
   84    HA   GLN  12           HA       GLN  12  -4.150  12.203  -1.157
   85    HB2  GLN  12          1HB       GLN  12  -4.653  14.521  -0.629
   86    HB3  GLN  12          2HB       GLN  12  -3.207  13.993   0.219
   87    HG2  GLN  12          1HG       GLN  12  -1.848  15.100  -1.530
   88    HG3  GLN  12          2HG       GLN  12  -3.338  15.744  -2.217
   89   HE21  GLN  12          1HE2      GLN  12  -4.568  16.093   0.412
   90   HE22  GLN  12          2HE2      GLN  12  -3.804  17.471   1.121
   91    H    ARG  13           H        ARG  13  -2.297  13.494  -3.744
   92    HA   ARG  13           HA       ARG  13  -4.414  14.466  -5.361
   93    HB2  ARG  13          1HB       ARG  13  -2.062  15.071  -5.729
   94    HB3  ARG  13          2HB       ARG  13  -1.703  13.407  -6.162
   95    HG2  ARG  13          1HG       ARG  13  -3.377  13.655  -8.031
   96    HG3  ARG  13          2HG       ARG  13  -3.389  15.389  -7.665
   97    HD2  ARG  13          1HD       ARG  13  -1.019  15.530  -8.094
   98    HD3  ARG  13          2HD       ARG  13  -0.929  13.787  -8.341
   99    HE   ARG  13           HE       ARG  13  -2.789  14.778 -10.152
  100   HH11  ARG  13          1HH1      ARG  13   0.642  15.054  -9.504
  101   HH12  ARG  13          2HH1      ARG  13   1.052  15.386 -11.158
  102   HH21  ARG  13          1HH2      ARG  13  -2.246  15.197 -12.333
  103   HH22  ARG  13          2HH2      ARG  13  -0.586  15.474 -12.763
  104    H    TYR  14           H        TYR  14  -2.591  11.398  -5.396
  105    HA   TYR  14           HA       TYR  14  -4.159  10.202  -7.436
  106    HB2  TYR  14          1HB       TYR  14  -2.426   8.918  -5.313
  107    HB3  TYR  14          2HB       TYR  14  -3.092   8.095  -6.719
  108    HD1  TYR  14           HD1      TYR  14  -2.609   9.478  -9.002
  109    HD2  TYR  14           HD2      TYR  14  -0.177   9.505  -5.507
  110    HE1  TYR  14           HE1      TYR  14  -0.667  10.114 -10.365
  111    HE2  TYR  14           HE2      TYR  14   1.770  10.146  -6.864
  112    HH   TYR  14           HH       TYR  14   1.516  11.240 -10.063
  113    H    ARG  15           H        ARG  15  -4.319  10.185  -3.944
  114    HA   ARG  15           HA       ARG  15  -6.266   8.189  -3.650
  115    HB2  ARG  15          1HB       ARG  15  -5.539   8.499  -1.568
  116    HB3  ARG  15          2HB       ARG  15  -4.822  10.041  -2.001
  117    HG2  ARG  15          1HG       ARG  15  -6.937  11.167  -1.537
  118    HG3  ARG  15          2HG       ARG  15  -7.682   9.610  -1.151
  119    HD2  ARG  15          1HD       ARG  15  -5.987   9.301   0.641
  120    HD3  ARG  15          2HD       ARG  15  -5.388  10.924   0.311
  121    HE   ARG  15           HE       ARG  15  -7.732  11.654   0.900
  122   HH11  ARG  15          1HH1      ARG  15  -6.247   8.769   2.233
  123   HH12  ARG  15          2HH1      ARG  15  -7.176   8.822   3.695
  124   HH21  ARG  15          1HH2      ARG  15  -8.964  11.721   2.821
  125   HH22  ARG  15          2HH2      ARG  15  -8.761  10.478   4.011
  126    H    THR  16           H        THR  16  -6.472  11.625  -4.259
  127    HA   THR  16           HA       THR  16  -9.200  12.026  -3.836
  128    HB   THR  16           HB       THR  16  -7.172  13.356  -5.607
  129    HG1  THR  16           HG1      THR  16  -6.931  13.925  -3.508
  130   HG21  THR  16          1HG2      THR  16  -8.802  15.120  -6.099
  131   HG22  THR  16          2HG2      THR  16 -10.062  14.181  -5.298
  132   HG23  THR  16          3HG2      THR  16  -9.308  13.570  -6.773
  133    H    GLU  17           H        GLU  17  -7.440  11.161  -6.805
  134    HA   GLU  17           HA       GLU  17  -9.733  11.092  -8.455
  135    HB2  GLU  17          1HB       GLU  17  -7.358   9.399  -9.104
  136    HB3  GLU  17          2HB       GLU  17  -8.351  10.370 -10.165
  137    HG2  GLU  17          1HG       GLU  17  -7.359  12.406  -9.164
  138    HG3  GLU  17          2HG       GLU  17  -6.253  11.367  -8.257
  139    H    CYS  18           H        CYS  18  -8.053   8.598  -6.600
  140    HA   CYS  18           HA       CYS  18  -9.528   6.414  -7.617
  141    HB2  CYS  18          1HB       CYS  18  -8.064   6.741  -4.995
  142    HB3  CYS  18          2HB       CYS  18  -8.758   5.219  -5.574
  143    H    VAL  19           H        VAL  19 -10.128   8.699  -5.040
  144    HA   VAL  19           HA       VAL  19 -12.298   7.318  -3.879
  145    HB   VAL  19           HB       VAL  19 -11.329  10.143  -3.742
  146   HG11  VAL  19          1HG1      VAL  19 -13.906   9.179  -2.509
  147   HG12  VAL  19          2HG1      VAL  19 -13.779  10.301  -3.865
  148   HG13  VAL  19          3HG1      VAL  19 -13.157  10.759  -2.278
  149   HG21  VAL  19          1HG2      VAL  19 -11.229   9.574  -1.329
  150   HG22  VAL  19          2HG2      VAL  19 -10.239   8.525  -2.343
  151   HG23  VAL  19          3HG2      VAL  19 -11.791   7.949  -1.731
  152    H    SER  20           H        SER  20 -12.113   9.978  -6.180
  153    HA   SER  20           HA       SER  20 -14.855  10.233  -6.660
  154    HB2  SER  20          1HB       SER  20 -12.566  10.822  -8.552
  155    HB3  SER  20          2HB       SER  20 -14.185  11.521  -8.616
  156    HG   SER  20           HG       SER  20 -12.043  12.213  -7.069
  157    H    SER  21           H        SER  21 -12.389   8.276  -8.317
  158    HA   SER  21           HA       SER  21 -14.100   7.448 -10.431
  159    HB2  SER  21          1HB       SER  21 -11.680   7.451 -10.697
  160    HB3  SER  21          2HB       SER  21 -11.513   6.261  -9.407
  161    HG   SER  21           HG       SER  21 -11.443   5.343 -11.531
  162    H    LEU  22           H        LEU  22 -13.013   5.826  -7.434
  163    HA   LEU  22           HA       LEU  22 -14.534   3.469  -8.110
  164    HB2  LEU  22          1HB       LEU  22 -12.900   4.208  -5.687
  165    HB3  LEU  22          2HB       LEU  22 -13.722   2.656  -5.874
  166    HG   LEU  22           HG       LEU  22 -11.636   3.684  -7.794
  167   HD11  LEU  22          1HD1      LEU  22 -10.640   3.371  -5.598
  168   HD12  LEU  22          2HD1      LEU  22 -10.120   2.091  -6.697
  169   HD13  LEU  22          3HD1      LEU  22 -11.362   1.767  -5.485
  170   HD21  LEU  22          1HD2      LEU  22 -13.240   2.032  -8.670
  171   HD22  LEU  22          2HD2      LEU  22 -12.776   0.929  -7.370
  172   HD23  LEU  22          3HD2      LEU  22 -11.592   1.410  -8.586
  173    H    ASN  23           H        ASN  23 -15.597   6.294  -7.215
  174    HA   ASN  23           HA       ASN  23 -17.386   7.164  -6.121
  175    HB2  ASN  23          1HB       ASN  23 -18.354   4.325  -6.453
  176    HB3  ASN  23          2HB       ASN  23 -19.359   5.638  -5.870
  177   HD21  ASN  23          1HD2      ASN  23 -20.775   5.485  -7.587
  178   HD22  ASN  23          2HD2      ASN  23 -20.354   5.998  -9.188
  179    H    ILE  24           H        ILE  24 -15.238   6.390  -4.472
  180    HA   ILE  24           HA       ILE  24 -16.058   4.979  -2.170
  181    HB   ILE  24           HB       ILE  24 -13.938   7.123  -2.321
  182   HG12  ILE  24          1HG1      ILE  24 -13.588   5.416  -4.083
  183   HG13  ILE  24          2HG1      ILE  24 -12.339   5.349  -2.842
  184   HG21  ILE  24          1HG2      ILE  24 -14.280   4.770  -0.468
  185   HG22  ILE  24          2HG2      ILE  24 -14.543   6.466  -0.063
  186   HG23  ILE  24          3HG2      ILE  24 -12.923   5.899  -0.465
  187   HD11  ILE  24          1HD1      ILE  24 -13.040   3.129  -3.544
  188   HD12  ILE  24          2HD1      ILE  24 -14.699   3.495  -3.071
  189   HD13  ILE  24          3HD1      ILE  24 -13.430   3.411  -1.847
  190    HA   PRO  25           HA       PRO  25 -18.736   8.138  -0.414
  191    HB2  PRO  25          1HB       PRO  25 -18.552   6.448   1.979
  192    HB3  PRO  25          2HB       PRO  25 -19.971   6.922   1.043
  193    HG2  PRO  25          1HG       PRO  25 -18.989   4.416   1.021
  194    HG3  PRO  25          2HG       PRO  25 -19.792   5.147  -0.379
  195    HD2  PRO  25          1HD       PRO  25 -16.880   4.704   0.123
  196    HD3  PRO  25          2HD       PRO  25 -17.797   4.607  -1.399
  197    H    ALA  26           H        ALA  26 -18.405   9.836   0.887
  198    HA   ALA  26           HA       ALA  26 -15.837  10.635   1.607
  199    HB1  ALA  26          1HB       ALA  26 -16.895  12.469   2.762
  200    HB2  ALA  26          2HB       ALA  26 -18.425  11.594   2.811
  201    HB3  ALA  26          3HB       ALA  26 -17.769  12.135   1.268
  202    H    ASP  27           H        ASP  27 -18.275   8.930   3.422
  203    HA   ASP  27           HA       ASP  27 -17.365   9.014   6.006
  204    HB2  ASP  27          1HB       ASP  27 -19.388   7.860   5.438
  205    HB3  ASP  27          2HB       ASP  27 -18.515   6.689   4.457
  206    H    TYR  28           H        TYR  28 -16.369   6.617   3.553
  207    HA   TYR  28           HA       TYR  28 -14.390   5.425   5.128
  208    HB2  TYR  28          1HB       TYR  28 -14.980   5.480   2.198
  209    HB3  TYR  28          2HB       TYR  28 -13.496   4.721   2.774
  210    HD1  TYR  28           HD1      TYR  28 -13.561   2.618   3.936
  211    HD2  TYR  28           HD2      TYR  28 -17.174   4.583   2.851
  212    HE1  TYR  28           HE1      TYR  28 -14.819   0.576   4.457
  213    HE2  TYR  28           HE2      TYR  28 -18.443   2.540   3.358
  214    HH   TYR  28           HH       TYR  28 -18.028   0.100   3.507
  215    H    VAL  29           H        VAL  29 -14.288   8.154   2.916
  216    HA   VAL  29           HA       VAL  29 -11.550   8.418   2.561
  217    HB   VAL  29           HB       VAL  29 -13.598  10.618   2.744
  218   HG11  VAL  29          1HG1      VAL  29 -11.356  11.507   2.927
  219   HG12  VAL  29          2HG1      VAL  29 -12.014  11.879   1.334
  220   HG13  VAL  29          3HG1      VAL  29 -10.844  10.571   1.525
  221   HG21  VAL  29          1HG2      VAL  29 -14.212   8.968   1.098
  222   HG22  VAL  29          2HG2      VAL  29 -12.588   9.008   0.413
  223   HG23  VAL  29          3HG2      VAL  29 -13.634  10.422   0.285
  224    H    GLU  30           H        GLU  30 -13.598   9.745   5.162
  225    HA   GLU  30           HA       GLU  30 -11.535  11.161   6.489
  226    HB2  GLU  30          1HB       GLU  30 -13.849   9.953   7.968
  227    HB3  GLU  30          2HB       GLU  30 -13.021  11.482   8.239
  228    HG2  GLU  30          1HG       GLU  30 -13.950  12.225   6.019
  229    HG3  GLU  30          2HG       GLU  30 -14.993  10.805   6.095
  230    H    LYS  31           H        LYS  31 -12.661   7.855   6.678
  231    HA   LYS  31           HA       LYS  31 -11.281   7.112   9.027
  232    HB2  LYS  31          1HB       LYS  31 -12.158   5.370   6.714
  233    HB3  LYS  31          2HB       LYS  31 -11.658   4.798   8.310
  234    HG2  LYS  31          1HG       LYS  31 -13.535   6.137   9.279
  235    HG3  LYS  31          2HG       LYS  31 -14.082   6.446   7.632
  236    HD2  LYS  31          1HD       LYS  31 -14.262   4.001   7.274
  237    HD3  LYS  31          2HD       LYS  31 -13.819   3.748   8.974
  238    HE2  LYS  31          1HE       LYS  31 -15.797   5.114   9.633
  239    HE3  LYS  31          2HE       LYS  31 -16.257   5.213   7.935
  240    HZ1  LYS  31          1HZ       LYS  31 -16.039   2.725   9.540
  241    HZ2  LYS  31          2HZ       LYS  31 -16.446   2.794   7.901
  242    HZ3  LYS  31          3HZ       LYS  31 -17.474   3.478   9.057
  243    H    PHE  32           H        PHE  32 -10.440   6.789   5.594
  244    HA   PHE  32           HA       PHE  32  -7.987   5.507   5.898
  245    HB2  PHE  32          1HB       PHE  32  -8.657   7.548   3.776
  246    HB3  PHE  32          2HB       PHE  32  -7.444   6.281   3.672
  247    HD1  PHE  32           HD1      PHE  32  -9.123   4.052   4.859
  248    HD2  PHE  32           HD2      PHE  32  -9.953   6.992   1.900
  249    HE1  PHE  32           HE1      PHE  32 -10.771   2.550   3.828
  250    HE2  PHE  32           HE2      PHE  32 -11.603   5.490   0.869
  251    HZ   PHE  32           HZ       PHE  32 -12.012   3.264   1.831
  252    H    LYS  33           H        LYS  33  -8.811   8.925   5.970
  253    HA   LYS  33           HA       LYS  33  -6.203   9.983   5.953
  254    HB2  LYS  33          1HB       LYS  33  -8.492  11.178   5.671
  255    HB3  LYS  33          2HB       LYS  33  -8.482  11.267   7.431
  256    HG2  LYS  33          1HG       LYS  33  -6.415  12.508   7.409
  257    HG3  LYS  33          2HG       LYS  33  -6.313  12.355   5.648
  258    HD2  LYS  33          1HD       LYS  33  -8.407  13.621   5.436
  259    HD3  LYS  33          2HD       LYS  33  -8.476  13.793   7.190
  260    HE2  LYS  33          1HE       LYS  33  -6.377  15.031   7.164
  261    HE3  LYS  33          2HE       LYS  33  -6.266  14.829   5.416
  262    HZ1  LYS  33          1HZ       LYS  33  -8.304  16.110   5.181
  263    HZ2  LYS  33          2HZ       LYS  33  -7.123  17.004   5.991
  264    HZ3  LYS  33          3HZ       LYS  33  -8.398  16.312   6.857
  265    H    LYS  34           H        LYS  34  -8.218   8.725   8.531
  266    HA   LYS  34           HA       LYS  34  -6.328   9.561  10.565
  267    HB2  LYS  34          1HB       LYS  34  -8.964   8.101  10.679
  268    HB3  LYS  34          2HB       LYS  34  -7.958   8.336  12.105
  269    HG2  LYS  34          1HG       LYS  34  -8.132  10.743  11.848
  270    HG3  LYS  34          2HG       LYS  34  -9.072  10.532  10.371
  271    HD2  LYS  34          1HD       LYS  34 -10.826   9.403  11.646
  272    HD3  LYS  34          2HD       LYS  34  -9.880   9.599  13.124
  273    HE2  LYS  34          1HE       LYS  34 -10.015  12.022  12.898
  274    HE3  LYS  34          2HE       LYS  34 -10.929  11.841  11.403
  275    HZ1  LYS  34          1HZ       LYS  34 -12.682  10.748  12.657
  276    HZ2  LYS  34          2HZ       LYS  34 -12.384  12.292  13.269
  277    HZ3  LYS  34          3HZ       LYS  34 -11.808  10.933  14.089
  278    H    TRP  35           H        TRP  35  -5.790   7.492   8.417
  279    HA   TRP  35           HA       TRP  35  -4.790   5.499   8.112
  280    HB2  TRP  35          1HB       TRP  35  -3.840   6.100  10.916
  281    HB3  TRP  35          2HB       TRP  35  -3.191   4.794   9.913
  282    HD1  TRP  35           HD1      TRP  35  -3.088   8.567  10.364
  283    HE1  TRP  35           HE1      TRP  35  -1.258   9.558   8.848
  284    HE3  TRP  35           HE3      TRP  35  -1.950   4.395   7.627
  285    HZ2  TRP  35           HZ2      TRP  35   0.437   8.685   6.775
  286    HZ3  TRP  35           HZ3      TRP  35  -0.216   4.563   5.895
  287    HH2  TRP  35           HH2      TRP  35   0.958   6.661   5.476
  288    H    GLU  36           H        GLU  36  -7.387   5.146   8.589
  289    HA   GLU  36           HA       GLU  36  -7.425   2.642  10.124
  290    HB2  GLU  36          1HB       GLU  36  -9.651   4.670   9.863
  291    HB3  GLU  36          2HB       GLU  36  -9.815   3.091  10.619
  292    HG2  GLU  36          1HG       GLU  36  -8.169   3.741  12.301
  293    HG3  GLU  36          2HG       GLU  36  -8.031   5.321  11.539
  294    H    PHE  37           H        PHE  37  -7.491   1.060   8.685
  295    HA   PHE  37           HA       PHE  37  -9.024   1.487   6.200
  296    HB2  PHE  37          1HB       PHE  37  -6.622  -0.318   6.588
  297    HB3  PHE  37          2HB       PHE  37  -7.444   0.012   5.068
  298    HD1  PHE  37           HD1      PHE  37  -5.260   1.403   7.667
  299    HD2  PHE  37           HD2      PHE  37  -7.027   2.040   3.845
  300    HE1  PHE  37           HE1      PHE  37  -3.755   3.310   7.292
  301    HE2  PHE  37           HE2      PHE  37  -5.530   3.955   3.470
  302    HZ   PHE  37           HZ       PHE  37  -3.890   4.593   5.194
  303    HA   PRO  38           HA       PRO  38 -11.432  -1.863   8.181
  304    HB2  PRO  38          1HB       PRO  38 -13.244  -1.082   5.978
  305    HB3  PRO  38          2HB       PRO  38 -13.574  -1.274   7.708
  306    HG2  PRO  38          1HG       PRO  38 -13.462   1.150   6.631
  307    HG3  PRO  38          2HG       PRO  38 -12.763   0.832   8.230
  308    HD2  PRO  38          1HD       PRO  38 -11.366   1.054   5.580
  309    HD3  PRO  38          2HD       PRO  38 -10.910   1.755   7.162
  310    H    GLU  39           H        GLU  39 -11.797  -3.917   7.582
  311    HA   GLU  39           HA       GLU  39 -10.568  -4.852   5.150
  312    HB2  GLU  39          1HB       GLU  39 -10.321  -5.992   7.367
  313    HB3  GLU  39          2HB       GLU  39 -12.018  -6.438   7.272
  314    HG2  GLU  39          1HG       GLU  39 -11.486  -7.613   5.125
  315    HG3  GLU  39          2HG       GLU  39  -9.782  -7.318   5.473
  316    H    ASP  40           H        ASP  40 -12.049  -3.854   3.664
  317    HA   ASP  40           HA       ASP  40 -14.303  -5.563   3.056
  318    HB2  ASP  40          1HB       ASP  40 -16.035  -4.122   3.421
  319    HB3  ASP  40          2HB       ASP  40 -14.943  -3.491   4.644
  320    H    ASP  41           H        ASP  41 -15.276  -5.026   0.927
  321    HA   ASP  41           HA       ASP  41 -13.351  -4.971  -1.044
  322    HB2  ASP  41          1HB       ASP  41 -16.246  -4.136  -1.331
  323    HB3  ASP  41          2HB       ASP  41 -15.169  -4.557  -2.656
  324    H    THR  42           H        THR  42 -15.276  -2.240   0.140
  325    HA   THR  42           HA       THR  42 -14.675  -0.336  -1.782
  326    HB   THR  42           HB       THR  42 -14.915   0.266   1.156
  327    HG1  THR  42           HG1      THR  42 -16.677  -0.931   0.933
  328   HG21  THR  42          1HG2      THR  42 -14.433   2.177  -0.244
  329   HG22  THR  42          2HG2      THR  42 -16.100   2.264   0.322
  330   HG23  THR  42          3HG2      THR  42 -15.755   1.748  -1.329
  331    H    THR  43           H        THR  43 -13.103  -0.672   1.384
  332    HA   THR  43           HA       THR  43 -11.022   1.130   0.957
  333    HB   THR  43           HB       THR  43 -10.998  -1.311   2.741
  334    HG1  THR  43           HG1      THR  43 -12.750  -0.134   3.411
  335   HG21  THR  43          1HG2      THR  43  -9.447   0.063   4.113
  336   HG22  THR  43          2HG2      THR  43  -9.439   1.275   2.831
  337   HG23  THR  43          3HG2      THR  43  -8.798  -0.336   2.522
  338    H    MET  44           H        MET  44 -11.319  -2.274   0.159
  339    HA   MET  44           HA       MET  44  -8.572  -2.803  -0.194
  340    HB2  MET  44          1HB       MET  44 -10.992  -4.197  -1.327
  341    HB3  MET  44          2HB       MET  44  -9.351  -4.816  -1.447
  342    HG2  MET  44          1HG       MET  44  -9.217  -4.954   0.977
  343    HG3  MET  44          2HG       MET  44 -10.844  -4.296   1.111
  344    HE1  MET  44          1HE       MET  44  -9.925  -6.957   2.527
  345    HE2  MET  44          2HE       MET  44 -11.308  -8.007   2.213
  346    HE3  MET  44          3HE       MET  44 -11.565  -6.311   2.638
  347    H    CYS  45           H        CYS  45 -11.135  -2.171  -2.600
  348    HA   CYS  45           HA       CYS  45  -9.319  -2.184  -4.786
  349    HB2  CYS  45          1HB       CYS  45 -12.120  -1.067  -4.571
  350    HB3  CYS  45          2HB       CYS  45 -11.201  -1.142  -6.067
  351    H    TYR  46           H        TYR  46 -10.403   0.270  -2.563
  352    HA   TYR  46           HA       TYR  46  -9.528   2.537  -3.934
  353    HB2  TYR  46          1HB       TYR  46 -10.833   2.925  -2.025
  354    HB3  TYR  46          2HB       TYR  46  -9.836   1.881  -1.014
  355    HD1  TYR  46           HD1      TYR  46  -9.623   5.048  -2.991
  356    HD2  TYR  46           HD2      TYR  46  -8.305   2.867   0.419
  357    HE1  TYR  46           HE1      TYR  46  -8.380   7.019  -2.210
  358    HE2  TYR  46           HE2      TYR  46  -7.064   4.837   1.204
  359    HH   TYR  46           HH       TYR  46  -6.169   6.894   0.446
  360    H    ILE  47           H        ILE  47  -7.837   0.468  -1.597
  361    HA   ILE  47           HA       ILE  47  -5.358   1.750  -1.692
  362    HB   ILE  47           HB       ILE  47  -6.029  -1.130  -1.108
  363   HG12  ILE  47          1HG1      ILE  47  -6.988   0.447   0.486
  364   HG13  ILE  47          2HG1      ILE  47  -5.678  -0.445   1.252
  365   HG21  ILE  47          1HG2      ILE  47  -3.409   0.312  -0.729
  366   HG22  ILE  47          2HG2      ILE  47  -3.724  -1.040  -1.816
  367   HG23  ILE  47          3HG2      ILE  47  -3.788  -1.279  -0.069
  368   HD11  ILE  47          1HD1      ILE  47  -5.510   1.820   1.933
  369   HD12  ILE  47          2HD1      ILE  47  -5.643   2.399   0.274
  370   HD13  ILE  47          3HD1      ILE  47  -4.198   1.528   0.791
  371    H    LYS  48           H        LYS  48  -6.758  -0.756  -3.735
  372    HA   LYS  48           HA       LYS  48  -4.435  -1.473  -5.124
  373    HB2  LYS  48          1HB       LYS  48  -6.752  -2.601  -5.111
  374    HB3  LYS  48          2HB       LYS  48  -7.186  -1.455  -6.365
  375    HG2  LYS  48          1HG       LYS  48  -4.903  -3.418  -6.537
  376    HG3  LYS  48          2HG       LYS  48  -6.505  -3.679  -7.220
  377    HD2  LYS  48          1HD       LYS  48  -4.714  -1.372  -7.971
  378    HD3  LYS  48          2HD       LYS  48  -4.763  -2.899  -8.849
  379    HE2  LYS  48          1HE       LYS  48  -7.132  -1.085  -8.413
  380    HE3  LYS  48          2HE       LYS  48  -6.150  -1.121  -9.876
  381    HZ1  LYS  48          1HZ       LYS  48  -8.092  -2.451 -10.201
  382    HZ2  LYS  48          2HZ       LYS  48  -7.801  -3.337  -8.795
  383    HZ3  LYS  48          3HZ       LYS  48  -6.752  -3.489 -10.118
  384    H    CYS  49           H        CYS  49  -7.034   0.788  -6.027
  385    HA   CYS  49           HA       CYS  49  -5.944   1.754  -8.377
  386    HB2  CYS  49          1HB       CYS  49  -8.185   2.286  -7.877
  387    HB3  CYS  49          2HB       CYS  49  -7.762   3.065  -6.355
  388    H    VAL  50           H        VAL  50  -5.537   3.057  -5.078
  389    HA   VAL  50           HA       VAL  50  -4.012   5.284  -5.767
  390    HB   VAL  50           HB       VAL  50  -4.108   3.698  -3.204
  391   HG11  VAL  50          1HG1      VAL  50  -3.095   5.651  -2.125
  392   HG12  VAL  50          2HG1      VAL  50  -2.877   6.409  -3.706
  393   HG13  VAL  50          3HG1      VAL  50  -2.006   4.926  -3.309
  394   HG21  VAL  50          1HG2      VAL  50  -5.438   6.233  -4.106
  395   HG22  VAL  50          2HG2      VAL  50  -5.464   5.634  -2.450
  396   HG23  VAL  50          3HG2      VAL  50  -6.208   4.691  -3.741
  397    H    PHE  51           H        PHE  51  -3.054   2.044  -4.757
  398    HA   PHE  51           HA       PHE  51  -0.288   2.536  -4.749
  399    HB2  PHE  51          1HB       PHE  51  -2.047   0.148  -4.579
  400    HB3  PHE  51          2HB       PHE  51  -0.357  -0.125  -4.993
  401    HD1  PHE  51           HD1      PHE  51   0.229  -1.294  -3.005
  402    HD2  PHE  51           HD2      PHE  51  -1.546   2.568  -2.776
  403    HE1  PHE  51           HE1      PHE  51   0.787  -1.181  -0.613
  404    HE2  PHE  51           HE2      PHE  51  -0.981   2.689  -0.386
  405    HZ   PHE  51           HZ       PHE  51   0.186   0.814   0.699
  406    H    ASN  52           H        ASN  52  -2.541   1.744  -7.245
  407    HA   ASN  52           HA       ASN  52  -0.567   0.779  -9.111
  408    HB2  ASN  52          1HB       ASN  52  -2.935   0.021  -9.187
  409    HB3  ASN  52          2HB       ASN  52  -3.422   1.663  -9.628
  410   HD21  ASN  52          1HD2      ASN  52  -0.546  -0.037 -10.750
  411   HD22  ASN  52          2HD2      ASN  52  -1.019  -0.112 -12.410
  412    H    LYS  53           H        LYS  53  -2.328   3.762  -8.516
  413    HA   LYS  53           HA       LYS  53  -1.380   5.182 -10.775
  414    HB2  LYS  53          1HB       LYS  53  -2.614   5.964  -8.161
  415    HB3  LYS  53          2HB       LYS  53  -1.985   7.201  -9.241
  416    HG2  LYS  53          1HG       LYS  53  -3.541   6.523 -10.964
  417    HG3  LYS  53          2HG       LYS  53  -4.091   5.169  -9.976
  418    HD2  LYS  53          1HD       LYS  53  -5.011   6.668  -8.337
  419    HD3  LYS  53          2HD       LYS  53  -4.326   8.067  -9.169
  420    HE2  LYS  53          1HE       LYS  53  -6.295   6.201 -10.467
  421    HE3  LYS  53          2HE       LYS  53  -6.791   7.621  -9.551
  422    HZ1  LYS  53          1HZ       LYS  53  -6.652   8.085 -11.919
  423    HZ2  LYS  53          2HZ       LYS  53  -5.023   7.643 -11.936
  424    HZ3  LYS  53          3HZ       LYS  53  -5.518   9.008 -11.061
  425    H    MET  54           H        MET  54  -0.186   4.662  -7.546
  426    HA   MET  54           HA       MET  54   1.922   6.616  -7.796
  427    HB2  MET  54          1HB       MET  54   1.065   4.678  -5.671
  428    HB3  MET  54          2HB       MET  54   2.596   5.546  -5.548
  429    HG2  MET  54          1HG       MET  54   1.559   7.594  -5.343
  430    HG3  MET  54          2HG       MET  54   0.067   7.029  -6.083
  431    HE1  MET  54          1HE       MET  54   1.375   6.085  -1.776
  432    HE2  MET  54          2HE       MET  54   2.407   6.764  -3.036
  433    HE3  MET  54          3HE       MET  54   1.942   5.064  -3.098
  434    H    GLN  55           H        GLN  55   1.560   3.880  -9.314
  435    HA   GLN  55           HA       GLN  55   2.867   2.357 -10.311
  436    HB2  GLN  55          1HB       GLN  55   4.843   4.540  -9.743
  437    HB3  GLN  55          2HB       GLN  55   5.285   3.100 -10.670
  438    HG2  GLN  55          1HG       GLN  55   3.648   3.626 -12.335
  439    HG3  GLN  55          2HG       GLN  55   3.029   4.952 -11.360
  440   HE21  GLN  55          1HE2      GLN  55   4.102   4.978 -14.070
  441   HE22  GLN  55          2HE2      GLN  55   5.424   6.098 -14.052
  442    H    LEU  56           H        LEU  56   2.318   1.656  -7.763
  443    HA   LEU  56           HA       LEU  56   4.852   0.630  -6.738
  444    HB2  LEU  56          1HB       LEU  56   2.697   2.129  -5.430
  445    HB3  LEU  56          2HB       LEU  56   3.259   0.727  -4.506
  446    HG   LEU  56           HG       LEU  56   4.956   3.007  -5.526
  447   HD11  LEU  56          1HD1      LEU  56   3.985   2.352  -2.748
  448   HD12  LEU  56          2HD1      LEU  56   3.506   3.734  -3.728
  449   HD13  LEU  56          3HD1      LEU  56   5.162   3.600  -3.142
  450   HD21  LEU  56          1HD2      LEU  56   5.625   0.599  -3.855
  451   HD22  LEU  56          2HD2      LEU  56   6.675   2.001  -4.033
  452   HD23  LEU  56          3HD2      LEU  56   6.281   1.015  -5.439
  453    H    PHE  57           H        PHE  57   1.687  -0.067  -7.768
  454    HA   PHE  57           HA       PHE  57   2.103  -2.899  -7.211
  455    HB2  PHE  57          1HB       PHE  57   0.686  -2.222  -5.354
  456    HB3  PHE  57          2HB       PHE  57  -0.406  -1.380  -6.443
  457    HD1  PHE  57           HD1      PHE  57  -2.088  -2.550  -7.669
  458    HD2  PHE  57           HD2      PHE  57   0.717  -4.675  -5.273
  459    HE1  PHE  57           HE1      PHE  57  -3.468  -4.576  -7.855
  460    HE2  PHE  57           HE2      PHE  57  -0.657  -6.704  -5.461
  461    HZ   PHE  57           HZ       PHE  57  -2.752  -6.654  -6.751
  462    H    ASP  58           H        ASP  58   1.355  -4.209  -8.781
  463    HA   ASP  58           HA       ASP  58  -0.157  -2.999 -11.005
  464    HB2  ASP  58          1HB       ASP  58   2.193  -3.359 -11.641
  465    HB3  ASP  58          2HB       ASP  58   2.084  -5.040 -11.138
  466    H    ASP  59           H        ASP  59  -1.791  -4.279 -11.887
  467    HA   ASP  59           HA       ASP  59  -3.050  -6.056 -10.073
  468    HB2  ASP  59          1HB       ASP  59  -3.651  -5.436 -12.962
  469    HB3  ASP  59          2HB       ASP  59  -4.664  -6.445 -11.952
  470    H    THR  60           H        THR  60  -0.730  -6.583 -12.502
  471    HA   THR  60           HA       THR  60  -1.408  -9.419 -12.745
  472    HB   THR  60           HB       THR  60   0.488  -7.649 -14.279
  473    HG1  THR  60           HG1      THR  60  -2.109  -8.578 -14.636
  474   HG21  THR  60          1HG2      THR  60  -0.079 -10.581 -14.704
  475   HG22  THR  60          2HG2      THR  60   1.425  -9.902 -14.077
  476   HG23  THR  60          3HG2      THR  60   0.921  -9.553 -15.730
  477    H    GLU  61           H        GLU  61   1.577  -7.481 -12.358
  478    HA   GLU  61           HA       GLU  61   3.054  -9.737 -11.388
  479    HB2  GLU  61          1HB       GLU  61   3.976  -6.885 -11.256
  480    HB3  GLU  61          2HB       GLU  61   4.927  -8.349 -11.446
  481    HG2  GLU  61          1HG       GLU  61   3.967  -8.668 -13.676
  482    HG3  GLU  61          2HG       GLU  61   3.089  -7.155 -13.494
  483    H    GLY  62           H        GLY  62   1.068  -7.423  -9.873
  484    HA2  GLY  62          1HA       GLY  62   0.526  -7.300  -7.611
  485    HA3  GLY  62          2HA       GLY  62   1.862  -8.403  -7.269
  486    HA   PRO  63           HA       PRO  63   3.223  -4.358  -5.554
  487    HB2  PRO  63          1HB       PRO  63   4.845  -6.173  -3.895
  488    HB3  PRO  63          2HB       PRO  63   3.735  -4.888  -3.401
  489    HG2  PRO  63          1HG       PRO  63   3.156  -7.507  -3.076
  490    HG3  PRO  63          2HG       PRO  63   1.916  -6.278  -3.387
  491    HD2  PRO  63          1HD       PRO  63   3.118  -8.287  -5.248
  492    HD3  PRO  63          2HD       PRO  63   1.445  -7.677  -5.163
  493    H    LEU  64           H        LEU  64   4.795  -3.345  -6.653
  494    HA   LEU  64           HA       LEU  64   6.972  -4.877  -7.828
  495    HB2  LEU  64          1HB       LEU  64   6.530  -1.883  -7.911
  496    HB3  LEU  64          2HB       LEU  64   7.730  -2.778  -8.814
  497    HG   LEU  64           HG       LEU  64   6.079  -2.313 -10.377
  498   HD11  LEU  64          1HD1      LEU  64   5.507  -5.081  -9.360
  499   HD12  LEU  64          2HD1      LEU  64   6.819  -4.613 -10.440
  500   HD13  LEU  64          3HD1      LEU  64   5.143  -4.469 -10.974
  501   HD21  LEU  64          1HD2      LEU  64   4.015  -3.207  -8.379
  502   HD22  LEU  64          2HD2      LEU  64   3.692  -2.721 -10.044
  503   HD23  LEU  64          3HD2      LEU  64   4.331  -1.549  -8.891
  504    H    VAL  65           H        VAL  65   8.242  -5.587  -6.288
  505    HA   VAL  65           HA       VAL  65   8.831  -4.522  -3.846
  506    HB   VAL  65           HB       VAL  65  10.563  -6.270  -5.575
  507   HG11  VAL  65          1HG1      VAL  65  11.917  -5.208  -3.851
  508   HG12  VAL  65          2HG1      VAL  65  11.702  -6.925  -3.508
  509   HG13  VAL  65          3HG1      VAL  65  10.769  -5.723  -2.615
  510   HG21  VAL  65          1HG2      VAL  65   8.436  -7.267  -5.125
  511   HG22  VAL  65          2HG2      VAL  65   8.561  -6.863  -3.415
  512   HG23  VAL  65          3HG2      VAL  65   9.647  -8.060  -4.120
  513    H    ASP  66           H        ASP  66  10.673  -4.034  -6.855
  514    HA   ASP  66           HA       ASP  66  12.814  -2.653  -5.677
  515    HB2  ASP  66          1HB       ASP  66  12.938  -3.579  -7.918
  516    HB3  ASP  66          2HB       ASP  66  11.726  -2.435  -8.483
  517    H    ASN  67           H        ASN  67   9.945  -1.364  -7.350
  518    HA   ASN  67           HA       ASN  67  10.396   1.344  -6.893
  519    HB2  ASN  67          1HB       ASN  67   7.794  -0.171  -7.130
  520    HB3  ASN  67          2HB       ASN  67   7.917   1.579  -7.147
  521   HD21  ASN  67          1HD2      ASN  67   6.944   1.544  -9.201
  522   HD22  ASN  67          2HD2      ASN  67   7.862   1.147 -10.616
  523    H    LEU  68           H        LEU  68   8.922  -1.126  -4.913
  524    HA   LEU  68           HA       LEU  68   7.806   0.488  -2.919
  525    HB2  LEU  68          1HB       LEU  68   8.617  -2.379  -3.107
  526    HB3  LEU  68          2HB       LEU  68   8.163  -1.713  -1.545
  527    HG   LEU  68           HG       LEU  68   6.374  -1.414  -3.935
  528   HD11  LEU  68          1HD1      LEU  68   6.361  -3.702  -1.973
  529   HD12  LEU  68          2HD1      LEU  68   6.861  -3.804  -3.661
  530   HD13  LEU  68          3HD1      LEU  68   5.191  -3.412  -3.261
  531   HD21  LEU  68          1HD2      LEU  68   5.956  -0.027  -1.963
  532   HD22  LEU  68          2HD2      LEU  68   5.845  -1.482  -0.972
  533   HD23  LEU  68          3HD2      LEU  68   4.656  -1.186  -2.242
  534    H    VAL  69           H        VAL  69  11.001  -0.976  -3.206
  535    HA   VAL  69           HA       VAL  69  11.940  -0.058  -0.677
  536    HB   VAL  69           HB       VAL  69  13.514  -0.845  -3.121
  537   HG11  VAL  69          1HG1      VAL  69  14.305  -0.602  -0.227
  538   HG12  VAL  69          2HG1      VAL  69  14.869   0.402  -1.562
  539   HG13  VAL  69          3HG1      VAL  69  15.312  -1.303  -1.493
  540   HG21  VAL  69          1HG2      VAL  69  13.666  -3.038  -2.138
  541   HG22  VAL  69          2HG2      VAL  69  11.969  -2.594  -2.325
  542   HG23  VAL  69          3HG2      VAL  69  12.734  -2.508  -0.738
  543    H    HIS  70           H        HIS  70  12.134   1.190  -3.993
  544    HA   HIS  70           HA       HIS  70  13.839   3.350  -3.470
  545    HB2  HIS  70          1HB       HIS  70  11.777   2.845  -5.581
  546    HB3  HIS  70          2HB       HIS  70  12.572   4.410  -5.477
  547    HD1  HIS  70           HD1      HIS  70  15.177   4.441  -5.909
  548    HD2  HIS  70           HD2      HIS  70  13.293   0.822  -6.701
  549    HE1  HIS  70           HE1      HIS  70  16.797   3.128  -7.309
  550    HE2  HIS  70           HE2      HIS  70  15.666   0.917  -7.722
  551    H    GLN  71           H        GLN  71  10.431   2.967  -2.868
  552    HA   GLN  71           HA       GLN  71  10.100   5.805  -2.304
  553    HB2  GLN  71          1HB       GLN  71   8.394   3.968  -3.334
  554    HB3  GLN  71          2HB       GLN  71   7.924   3.914  -1.644
  555    HG2  GLN  71          1HG       GLN  71   8.066   6.451  -3.255
  556    HG3  GLN  71          2HG       GLN  71   6.606   5.482  -3.086
  557   HE21  GLN  71          1HE2      GLN  71   8.824   7.633  -1.523
  558   HE22  GLN  71          2HE2      GLN  71   7.858   7.950  -0.130
  559    H    LEU  72           H        LEU  72   9.523   2.761  -0.541
  560    HA   LEU  72           HA       LEU  72   8.976   3.966   1.916
  561    HB2  LEU  72          1HB       LEU  72   9.843   1.169   1.238
  562    HB3  LEU  72          2HB       LEU  72   9.454   1.665   2.871
  563    HG   LEU  72           HG       LEU  72   7.537   1.824   0.546
  564   HD11  LEU  72          1HD1      LEU  72   7.744  -0.220   2.761
  565   HD12  LEU  72          2HD1      LEU  72   8.096  -0.497   1.056
  566   HD13  LEU  72          3HD1      LEU  72   6.448  -0.125   1.566
  567   HD21  LEU  72          1HD2      LEU  72   7.180   2.204   3.516
  568   HD22  LEU  72          2HD2      LEU  72   5.854   2.056   2.363
  569   HD23  LEU  72          3HD2      LEU  72   6.968   3.418   2.253
  570    H    ALA  73           H        ALA  73  12.037   2.675   0.656
  571    HA   ALA  73           HA       ALA  73  13.456   3.070   3.103
  572    HB1  ALA  73          1HB       ALA  73  15.429   2.487   1.854
  573    HB2  ALA  73          2HB       ALA  73  14.568   2.716   0.332
  574    HB3  ALA  73          3HB       ALA  73  14.106   1.403   1.415
  575    H    HIS  74           H        HIS  74  12.043   5.383   2.227
  576    HA   HIS  74           HA       HIS  74  13.827   7.360   1.210
  577    HB2  HIS  74          1HB       HIS  74  11.357   7.541   1.041
  578    HB3  HIS  74          2HB       HIS  74  11.251   7.660   2.794
  579    HD1  HIS  74           HD1      HIS  74  11.154   9.953   3.687
  580    HD2  HIS  74           HD2      HIS  74  12.825   9.851  -0.119
  581    HE1  HIS  74           HE1      HIS  74  11.514  12.354   3.044
  582    HE2  HIS  74           HE2      HIS  74  12.374  12.272   0.681
  583    H    GLY  75           H        GLY  75  15.666   6.888   2.591
  584    HA2  GLY  75          1HA       GLY  75  16.984   8.104   4.163
  585    HA3  GLY  75          2HA       GLY  75  15.525   8.444   5.079
  586    H    ARG  76           H        ARG  76  16.318   5.248   3.864
  587    HA   ARG  76           HA       ARG  76  17.388   4.374   6.398
  588    HB2  ARG  76          1HB       ARG  76  14.584   3.881   5.632
  589    HB3  ARG  76          2HB       ARG  76  15.457   2.479   6.238
  590    HG2  ARG  76          1HG       ARG  76  16.076   3.804   8.241
  591    HG3  ARG  76          2HG       ARG  76  15.053   5.112   7.648
  592    HD2  ARG  76          1HD       ARG  76  13.866   3.791   9.291
  593    HD3  ARG  76          2HD       ARG  76  13.121   3.612   7.706
  594    HE   ARG  76           HE       ARG  76  15.010   1.550   8.179
  595   HH11  ARG  76          1HH1      ARG  76  11.790   2.599   9.056
  596   HH12  ARG  76          2HH1      ARG  76  11.227   0.996   9.414
  597   HH21  ARG  76          1HH2      ARG  76  14.270  -0.575   8.660
  598   HH22  ARG  76          2HH2      ARG  76  12.621  -0.797   9.174
  599    H    ASP  77           H        ASP  77  17.753   1.940   6.369
  600    HA   ASP  77           HA       ASP  77  19.367   1.317   4.143
  601    HB2  ASP  77          1HB       ASP  77  18.338  -0.564   6.275
  602    HB3  ASP  77          2HB       ASP  77  19.727  -0.832   5.229
  603    H    ALA  78           H        ALA  78  18.661   0.852   2.238
  604    HA   ALA  78           HA       ALA  78  16.086   0.145   1.500
  605    HB1  ALA  78          1HB       ALA  78  18.639  -0.366  -0.009
  606    HB2  ALA  78          2HB       ALA  78  17.750   1.156   0.021
  607    HB3  ALA  78          3HB       ALA  78  17.016  -0.278  -0.693
  608    H    GLU  79           H        GLU  79  18.875  -1.943   2.139
  609    HA   GLU  79           HA       GLU  79  17.800  -4.321   1.094
  610    HB2  GLU  79          1HB       GLU  79  19.819  -3.884   3.284
  611    HB3  GLU  79          2HB       GLU  79  19.416  -5.468   2.637
  612    HG2  GLU  79          1HG       GLU  79  20.097  -4.630   0.389
  613    HG3  GLU  79          2HG       GLU  79  20.683  -3.165   1.177
  614    H    GLU  80           H        GLU  80  17.666  -2.963   4.359
  615    HA   GLU  80           HA       GLU  80  16.227  -5.078   5.547
  616    HB2  GLU  80          1HB       GLU  80  17.374  -3.462   6.915
  617    HB3  GLU  80          2HB       GLU  80  16.417  -2.151   6.245
  618    HG2  GLU  80          1HG       GLU  80  14.449  -2.949   7.319
  619    HG3  GLU  80          2HG       GLU  80  15.265  -4.415   7.837
  620    H    VAL  81           H        VAL  81  15.237  -2.034   4.062
  621    HA   VAL  81           HA       VAL  81  12.490  -2.220   4.426
  622    HB   VAL  81           HB       VAL  81  14.044  -0.943   2.178
  623   HG11  VAL  81          1HG1      VAL  81  12.030   0.431   1.823
  624   HG12  VAL  81          2HG1      VAL  81  11.158  -0.584   2.976
  625   HG13  VAL  81          3HG1      VAL  81  11.751  -1.273   1.464
  626   HG21  VAL  81          1HG2      VAL  81  12.955   0.083   4.781
  627   HG22  VAL  81          2HG2      VAL  81  13.597   1.107   3.497
  628   HG23  VAL  81          3HG2      VAL  81  14.647  -0.056   4.299
  629    H    ARG  82           H        ARG  82  14.447  -3.316   1.636
  630    HA   ARG  82           HA       ARG  82  12.419  -4.426   0.099
  631    HB2  ARG  82          1HB       ARG  82  14.819  -4.149  -0.576
  632    HB3  ARG  82          2HB       ARG  82  15.195  -5.566   0.395
  633    HG2  ARG  82          1HG       ARG  82  13.469  -6.795  -0.976
  634    HG3  ARG  82          2HG       ARG  82  13.496  -5.408  -2.058
  635    HD2  ARG  82          1HD       ARG  82  15.901  -5.718  -2.376
  636    HD3  ARG  82          2HD       ARG  82  15.852  -7.126  -1.316
  637    HE   ARG  82           HE       ARG  82  14.158  -7.120  -3.701
  638   HH11  ARG  82          1HH1      ARG  82  16.979  -8.346  -2.034
  639   HH12  ARG  82          2HH1      ARG  82  17.149  -9.722  -3.071
  640   HH21  ARG  82          1HH2      ARG  82  14.368  -8.942  -5.057
  641   HH22  ARG  82          2HH2      ARG  82  15.655 -10.071  -4.779
  642    H    THR  83           H        THR  83  14.306  -5.833   2.716
  643    HA   THR  83           HA       THR  83  13.420  -8.474   2.478
  644    HB   THR  83           HB       THR  83  14.525  -6.886   4.780
  645    HG1  THR  83           HG1      THR  83  16.104  -7.312   3.357
  646   HG21  THR  83          1HG2      THR  83  13.138  -8.627   5.763
  647   HG22  THR  83          2HG2      THR  83  14.845  -9.017   5.978
  648   HG23  THR  83          3HG2      THR  83  13.901  -9.842   4.737
  649    H    GLU  84           H        GLU  84  12.321  -5.914   4.702
  650    HA   GLU  84           HA       GLU  84  10.204  -7.274   5.882
  651    HB2  GLU  84          1HB       GLU  84  10.453  -4.324   5.271
  652    HB3  GLU  84          2HB       GLU  84   9.275  -5.027   6.366
  653    HG2  GLU  84          1HG       GLU  84  12.258  -5.155   6.695
  654    HG3  GLU  84          2HG       GLU  84  11.182  -4.048   7.539
  655    H    VAL  85           H        VAL  85  10.246  -5.330   2.905
  656    HA   VAL  85           HA       VAL  85   7.517  -5.477   2.299
  657    HB   VAL  85           HB       VAL  85   9.946  -5.192   0.536
  658   HG11  VAL  85          1HG1      VAL  85   7.043  -5.080  -0.272
  659   HG12  VAL  85          2HG1      VAL  85   8.241  -6.258  -0.808
  660   HG13  VAL  85          3HG1      VAL  85   8.396  -4.564  -1.281
  661   HG21  VAL  85          1HG2      VAL  85   7.799  -3.267   1.409
  662   HG22  VAL  85          2HG2      VAL  85   9.125  -2.892   0.307
  663   HG23  VAL  85          3HG2      VAL  85   9.467  -3.317   1.985
  664    H    LEU  86           H        LEU  86  10.198  -7.578   1.276
  665    HA   LEU  86           HA       LEU  86   8.812  -9.239  -0.445
  666    HB2  LEU  86          1HB       LEU  86  11.226  -9.747   1.278
  667    HB3  LEU  86          2HB       LEU  86  10.610 -10.930   0.128
  668    HG   LEU  86           HG       LEU  86  11.435  -8.148  -0.663
  669   HD11  LEU  86          1HD1      LEU  86  13.047 -10.694  -0.745
  670   HD12  LEU  86          2HD1      LEU  86  13.339  -9.317   0.316
  671   HD13  LEU  86          3HD1      LEU  86  13.529  -9.141  -1.429
  672   HD21  LEU  86          1HD2      LEU  86  10.933 -10.683  -2.207
  673   HD22  LEU  86          2HD2      LEU  86  11.575  -9.191  -2.895
  674   HD23  LEU  86          3HD2      LEU  86   9.944  -9.223  -2.223
  675    H    LYS  87           H        LYS  87   9.007  -9.339   3.052
  676    HA   LYS  87           HA       LYS  87   7.860 -11.973   3.255
  677    HB2  LYS  87          1HB       LYS  87   8.450  -9.818   5.276
  678    HB3  LYS  87          2HB       LYS  87   7.656 -11.327   5.713
  679    HG2  LYS  87          1HG       LYS  87   9.578 -12.593   4.934
  680    HG3  LYS  87          2HG       LYS  87  10.377 -11.090   4.436
  681    HD2  LYS  87          1HD       LYS  87   9.554 -11.773   7.260
  682    HD3  LYS  87          2HD       LYS  87  11.186 -11.937   6.613
  683    HE2  LYS  87          1HE       LYS  87  11.242  -9.533   6.161
  684    HE3  LYS  87          2HE       LYS  87   9.614  -9.372   6.813
  685    HZ1  LYS  87          1HZ       LYS  87  11.971 -10.319   8.343
  686    HZ2  LYS  87          2HZ       LYS  87  10.416 -10.075   8.956
  687    HZ3  LYS  87          3HZ       LYS  87  11.328  -8.755   8.413
  688    H    CYS  88           H        CYS  88   6.613  -9.032   2.461
  689    HA   CYS  88           HA       CYS  88   3.938  -9.798   3.399
  690    HB2  CYS  88          1HB       CYS  88   5.184  -7.127   2.847
  691    HB3  CYS  88          2HB       CYS  88   3.420  -7.318   2.770
  692    H    VAL  89           H        VAL  89   5.953  -9.730   0.744
  693    HA   VAL  89           HA       VAL  89   3.861  -9.417  -1.243
  694    HB   VAL  89           HB       VAL  89   6.765 -10.188  -1.562
  695   HG11  VAL  89          1HG1      VAL  89   4.669  -9.476  -3.602
  696   HG12  VAL  89          2HG1      VAL  89   5.456 -11.040  -3.398
  697   HG13  VAL  89          3HG1      VAL  89   6.390  -9.649  -3.949
  698   HG21  VAL  89          1HG2      VAL  89   7.074  -7.917  -2.400
  699   HG22  VAL  89          2HG2      VAL  89   6.500  -7.916  -0.733
  700   HG23  VAL  89          3HG2      VAL  89   5.384  -7.557  -2.051
  701    H    ASP  90           H        ASP  90   2.472 -11.096  -1.194
  702    HA   ASP  90           HA       ASP  90   3.636 -13.770  -1.519
  703    HB2  ASP  90          1HB       ASP  90   2.024 -14.758  -0.128
  704    HB3  ASP  90          2HB       ASP  90   2.437 -13.267   0.718
  705    H    LYS  91           H        LYS  91   1.658 -15.269  -2.298
  706    HA   LYS  91           HA       LYS  91   1.189 -14.339  -4.977
  707    HB2  LYS  91          1HB       LYS  91   0.138 -16.879  -3.749
  708    HB3  LYS  91          2HB       LYS  91   0.464 -16.535  -5.444
  709    HG2  LYS  91          1HG       LYS  91   2.828 -16.479  -5.023
  710    HG3  LYS  91          2HG       LYS  91   2.550 -16.738  -3.301
  711    HD2  LYS  91          1HD       LYS  91   1.649 -18.918  -3.712
  712    HD3  LYS  91          2HD       LYS  91   1.685 -18.656  -5.456
  713    HE2  LYS  91          1HE       LYS  91   4.110 -18.722  -3.667
  714    HE3  LYS  91          2HE       LYS  91   3.539 -20.079  -4.635
  715    HZ1  LYS  91          1HZ       LYS  91   4.454 -17.451  -5.679
  716    HZ2  LYS  91          2HZ       LYS  91   3.857 -18.715  -6.626
  717    HZ3  LYS  91          3HZ       LYS  91   5.302 -18.911  -5.771
  718    H    ASN  92           H        ASN  92  -0.776 -14.231  -6.043
  719    HA   ASN  92           HA       ASN  92  -2.939 -13.077  -4.520
  720    HB2  ASN  92          1HB       ASN  92  -2.214 -12.242  -6.762
  721    HB3  ASN  92          2HB       ASN  92  -2.776 -13.750  -7.461
  722   HD21  ASN  92          1HD2      ASN  92  -4.043 -12.295  -8.789
  723   HD22  ASN  92          2HD2      ASN  92  -5.579 -11.748  -8.208
  724    H    THR  93           H        THR  93  -3.363 -15.004  -3.242
  725    HA   THR  93           HA       THR  93  -4.359 -17.368  -4.572
  726    HB   THR  93           HB       THR  93  -4.675 -18.251  -2.293
  727    HG1  THR  93           HG1      THR  93  -3.382 -16.282  -0.952
  728   HG21  THR  93          1HG2      THR  93  -2.322 -18.256  -1.635
  729   HG22  THR  93          2HG2      THR  93  -2.014 -16.912  -2.732
  730   HG23  THR  93          3HG2      THR  93  -2.506 -18.478  -3.372
  731    H    ASP  94           H        ASP  94  -5.681 -14.488  -3.248
  732    HA   ASP  94           HA       ASP  94  -8.339 -15.607  -2.902
  733    HB2  ASP  94          1HB       ASP  94  -8.971 -13.301  -2.268
  734    HB3  ASP  94          2HB       ASP  94  -7.585 -13.888  -1.339
  735    H    ASN  95           H        ASN  95  -6.466 -14.253  -5.354
  736    HA   ASN  95           HA       ASN  95  -6.816 -13.935  -7.550
  737    HB2  ASN  95          1HB       ASN  95  -9.441 -15.267  -6.941
  738    HB3  ASN  95          2HB       ASN  95  -8.927 -14.831  -8.562
  739   HD21  ASN  95          1HD2      ASN  95  -8.388 -16.909  -5.845
  740   HD22  ASN  95          2HD2      ASN  95  -7.372 -18.051  -6.665
  741    H    ASN  96           H        ASN  96  -7.636 -11.908  -5.526
  742    HA   ASN  96           HA       ASN  96  -9.202 -10.263  -7.389
  743    HB2  ASN  96          1HB       ASN  96 -10.807 -10.834  -5.738
  744    HB3  ASN  96          2HB       ASN  96  -9.658 -10.618  -4.425
  745   HD21  ASN  96          1HD2      ASN  96 -11.006  -9.214  -3.345
  746   HD22  ASN  96          2HD2      ASN  96 -11.331  -7.603  -3.895
  747    H    ALA  97           H        ALA  97  -7.931  -8.688  -8.025
  748    HA   ALA  97           HA       ALA  97  -5.438  -8.088  -6.970
  749    HB1  ALA  97          1HB       ALA  97  -7.168  -6.300  -8.665
  750    HB2  ALA  97          2HB       ALA  97  -6.122  -7.585  -9.265
  751    HB3  ALA  97          3HB       ALA  97  -5.422  -6.179  -8.463
  752    H    CYS  98           H        CYS  98  -8.564  -6.728  -6.147
  753    HA   CYS  98           HA       CYS  98  -7.595  -4.428  -4.788
  754    HB2  CYS  98          1HB       CYS  98 -10.166  -5.947  -4.312
  755    HB3  CYS  98          2HB       CYS  98  -9.799  -4.328  -3.730
  756    H    HIS  99           H        HIS  99  -8.163  -7.761  -3.786
  757    HA   HIS  99           HA       HIS  99  -7.716  -7.091  -0.997
  758    HB2  HIS  99          1HB       HIS  99  -9.361  -8.855  -1.874
  759    HB3  HIS  99          2HB       HIS  99  -7.950  -9.866  -2.155
  760    HD1  HIS  99           HD1      HIS  99 -10.041 -10.875  -0.252
  761    HD2  HIS  99           HD2      HIS  99  -6.839  -8.527   0.990
  762    HE1  HIS  99           HE1      HIS  99  -9.756 -11.354   2.199
  763    HE2  HIS  99           HE2      HIS  99  -7.683 -10.089   2.865
  764    H    TRP 100           H        TRP 100  -5.999  -8.412  -3.712
  765    HA   TRP 100           HA       TRP 100  -3.794  -9.514  -2.365
  766    HB2  TRP 100          1HB       TRP 100  -4.341  -9.861  -4.784
  767    HB3  TRP 100          2HB       TRP 100  -3.789  -8.217  -5.106
  768    HD1  TRP 100           HD1      TRP 100  -1.568  -9.784  -2.598
  769    HE1  TRP 100           HE1      TRP 100   0.589 -10.641  -3.703
  770    HE3  TRP 100           HE3      TRP 100  -2.973  -9.454  -7.506
  771    HZ2  TRP 100           HZ2      TRP 100   1.568 -11.118  -6.302
  772    HZ3  TRP 100           HZ3      TRP 100  -1.368 -10.134  -9.235
  773    HH2  TRP 100           HH2      TRP 100   0.853 -10.955  -8.654
  774    H    ALA 101           H        ALA 101  -4.205  -6.317  -3.884
  775    HA   ALA 101           HA       ALA 101  -1.781  -5.202  -2.995
  776    HB1  ALA 101          1HB       ALA 101  -2.810  -3.039  -3.516
  777    HB2  ALA 101          2HB       ALA 101  -4.383  -3.826  -3.655
  778    HB3  ALA 101          3HB       ALA 101  -3.096  -4.220  -4.793
  779    H    PHE 102           H        PHE 102  -4.973  -5.383  -1.580
  780    HA   PHE 102           HA       PHE 102  -4.505  -3.633   0.573
  781    HB2  PHE 102          1HB       PHE 102  -6.739  -4.201  -0.205
  782    HB3  PHE 102          2HB       PHE 102  -6.517  -5.868   0.311
  783    HD1  PHE 102           HD1      PHE 102  -6.493  -2.385   1.627
  784    HD2  PHE 102           HD2      PHE 102  -7.253  -6.499   2.420
  785    HE1  PHE 102           HE1      PHE 102  -7.391  -1.792   3.840
  786    HE2  PHE 102           HE2      PHE 102  -8.158  -5.911   4.627
  787    HZ   PHE 102           HZ       PHE 102  -8.225  -3.553   5.343
  788    H    ARG 103           H        ARG 103  -3.961  -7.066   0.098
  789    HA   ARG 103           HA       ARG 103  -3.509  -7.669   2.858
  790    HB2  ARG 103          1HB       ARG 103  -4.228  -9.371   1.199
  791    HB3  ARG 103          2HB       ARG 103  -2.662  -9.226   0.418
  792    HG2  ARG 103          1HG       ARG 103  -1.537 -10.063   2.343
  793    HG3  ARG 103          2HG       ARG 103  -3.023 -10.032   3.280
  794    HD2  ARG 103          1HD       ARG 103  -2.411 -12.297   2.503
  795    HD3  ARG 103          2HD       ARG 103  -3.976 -11.760   1.911
  796    HE   ARG 103           HE       ARG 103  -1.503 -11.946   0.310
  797   HH11  ARG 103          1HH1      ARG 103  -4.998 -11.660   0.512
  798   HH12  ARG 103          2HH1      ARG 103  -5.248 -11.995  -1.179
  799   HH21  ARG 103          1HH2      ARG 103  -1.855 -12.411  -1.906
  800   HH22  ARG 103          2HH2      ARG 103  -3.475 -12.415  -2.533
  801    H    GLY 104           H        GLY 104  -1.462  -6.920   0.074
  802    HA2  GLY 104          1HA       GLY 104   1.035  -7.291   1.354
  803    HA3  GLY 104          2HA       GLY 104   0.737  -6.247  -0.041
  804    H    PHE 105           H        PHE 105  -1.031  -4.448   0.997
  805    HA   PHE 105           HA       PHE 105   0.680  -2.632   2.294
  806    HB2  PHE 105          1HB       PHE 105  -0.978  -1.742   0.865
  807    HB3  PHE 105          2HB       PHE 105  -2.259  -2.633   1.666
  808    HD1  PHE 105           HD1      PHE 105  -3.745  -1.148   2.627
  809    HD2  PHE 105           HD2      PHE 105   0.433  -0.372   2.904
  810    HE1  PHE 105           HE1      PHE 105  -4.209   0.823   4.015
  811    HE2  PHE 105           HE2      PHE 105  -0.032   1.608   4.289
  812    HZ   PHE 105           HZ       PHE 105  -2.350   2.205   4.850
  813    H    LYS 106           H        LYS 106  -2.060  -4.560   3.436
  814    HA   LYS 106           HA       LYS 106  -2.124  -3.389   6.003
  815    HB2  LYS 106          1HB       LYS 106  -4.151  -4.265   5.405
  816    HB3  LYS 106          2HB       LYS 106  -3.464  -5.743   4.735
  817    HG2  LYS 106          1HG       LYS 106  -3.083  -6.581   6.977
  818    HG3  LYS 106          2HG       LYS 106  -3.630  -5.048   7.662
  819    HD2  LYS 106          1HD       LYS 106  -5.852  -5.407   6.754
  820    HD3  LYS 106          2HD       LYS 106  -5.316  -6.897   5.977
  821    HE2  LYS 106          1HE       LYS 106  -5.263  -6.420   8.954
  822    HE3  LYS 106          2HE       LYS 106  -6.574  -7.239   8.109
  823    HZ1  LYS 106          1HZ       LYS 106  -3.741  -8.125   8.225
  824    HZ2  LYS 106          2HZ       LYS 106  -4.962  -8.896   7.349
  825    HZ3  LYS 106          3HZ       LYS 106  -5.044  -8.833   9.036
  826    H    CYS 107           H        CYS 107  -0.568  -6.244   4.677
  827    HA   CYS 107           HA       CYS 107   0.341  -7.405   7.051
  828    HB2  CYS 107          1HB       CYS 107   0.482  -8.694   5.074
  829    HB3  CYS 107          2HB       CYS 107   1.376  -7.448   4.215
  830    H    PHE 108           H        PHE 108   1.705  -4.897   4.988
  831    HA   PHE 108           HA       PHE 108   4.225  -4.832   6.309
  832    HB2  PHE 108          1HB       PHE 108   3.681  -4.163   3.910
  833    HB3  PHE 108          2HB       PHE 108   3.092  -2.644   4.587
  834    HD1  PHE 108           HD1      PHE 108   6.022  -4.761   4.015
  835    HD2  PHE 108           HD2      PHE 108   4.637  -0.989   5.412
  836    HE1  PHE 108           HE1      PHE 108   8.319  -3.903   3.969
  837    HE2  PHE 108           HE2      PHE 108   6.940  -0.125   5.366
  838    HZ   PHE 108           HZ       PHE 108   8.782  -1.585   4.638
  839    H    GLN 109           H        GLN 109   1.425  -2.629   6.286
  840    HA   GLN 109           HA       GLN 109   2.462  -0.789   8.136
  841    HB2  GLN 109          1HB       GLN 109   0.183   0.051   8.336
  842    HB3  GLN 109          2HB       GLN 109   0.600  -0.249   6.656
  843    HG2  GLN 109          1HG       GLN 109  -1.419  -1.210   6.605
  844    HG3  GLN 109          2HG       GLN 109  -0.560  -2.593   7.285
  845   HE21  GLN 109          1HE2      GLN 109  -2.789  -0.015   7.909
  846   HE22  GLN 109          2HE2      GLN 109  -3.335  -0.595   9.445
  847    H    LYS 110           H        LYS 110   1.159  -3.918   8.613
  848    HA   LYS 110           HA       LYS 110   0.155  -3.601  11.241
  849    HB2  LYS 110          1HB       LYS 110  -0.377  -5.492   9.712
  850    HB3  LYS 110          2HB       LYS 110   1.257  -6.095   9.938
  851    HG2  LYS 110          1HG       LYS 110   0.741  -6.207  12.394
  852    HG3  LYS 110          2HG       LYS 110  -0.935  -5.872  11.972
  853    HD2  LYS 110          1HD       LYS 110  -0.906  -7.855  10.480
  854    HD3  LYS 110          2HD       LYS 110   0.712  -8.229  11.075
  855    HE2  LYS 110          1HE       LYS 110  -0.943  -9.551  12.252
  856    HE3  LYS 110          2HE       LYS 110  -0.186  -8.406  13.356
  857    HZ1  LYS 110          1HZ       LYS 110  -2.101  -7.000  13.217
  858    HZ2  LYS 110          2HZ       LYS 110  -2.612  -8.561  13.614
  859    HZ3  LYS 110          3HZ       LYS 110  -2.810  -7.982  12.038
  860    H    ASN 111           H        ASN 111   3.331  -4.092   9.910
  861    HA   ASN 111           HA       ASN 111   4.403  -4.400  12.639
  862    HB2  ASN 111          1HB       ASN 111   5.628  -5.374  10.053
  863    HB3  ASN 111          2HB       ASN 111   6.310  -5.569  11.664
  864   HD21  ASN 111          1HD2      ASN 111   3.927  -6.674   9.409
  865   HD22  ASN 111          2HD2      ASN 111   3.437  -8.068  10.300
  866    H    ASN 112           H        ASN 112   4.546  -2.637   9.648
  867    HA   ASN 112           HA       ASN 112   6.658  -0.926  10.757
  868    HB2  ASN 112          1HB       ASN 112   6.637  -2.215   8.024
  869    HB3  ASN 112          2HB       ASN 112   7.674  -0.847   8.450
  870   HD21  ASN 112          1HD2      ASN 112   8.045  -3.828   7.800
  871   HD22  ASN 112          2HD2      ASN 112   9.168  -4.350   9.013
  872    H    LEU 113           H        LEU 113   4.533   0.264  11.129
  873    HA   LEU 113           HA       LEU 113   3.397   1.504   8.773
  874    HB2  LEU 113          1HB       LEU 113   1.871   0.941  10.524
  875    HB3  LEU 113          2HB       LEU 113   2.808   1.829  11.709
  876    HG   LEU 113           HG       LEU 113   2.234   3.930  10.476
  877   HD11  LEU 113          1HD1      LEU 113   1.803   2.924   8.297
  878   HD12  LEU 113          2HD1      LEU 113   0.415   3.858   8.856
  879   HD13  LEU 113          3HD1      LEU 113   0.391   2.097   8.953
  880   HD21  LEU 113          1HD2      LEU 113   0.991   3.244  12.456
  881   HD22  LEU 113          2HD2      LEU 113  -0.079   2.263  11.456
  882   HD23  LEU 113          3HD2      LEU 113  -0.079   4.019  11.285
  883    H    SER 114           H        SER 114   5.625   2.299  11.337
  884    HA   SER 114           HA       SER 114   5.633   5.098  11.059
  885    HB2  SER 114          1HB       SER 114   7.989   3.388  11.874
  886    HB3  SER 114          2HB       SER 114   7.664   5.060  12.332
  887    HG   SER 114           HG       SER 114   5.634   4.111  13.262
  888    H    LEU 115           H        LEU 115   7.375   2.555   9.365
  889    HA   LEU 115           HA       LEU 115   9.122   4.227   7.911
  890    HB2  LEU 115          1HB       LEU 115   9.447   1.808   8.150
  891    HB3  LEU 115          2HB       LEU 115   8.009   1.521   7.191
  892    HG   LEU 115           HG       LEU 115   9.100   2.533   5.237
  893   HD11  LEU 115          1HD1      LEU 115  11.512   3.025   5.348
  894   HD12  LEU 115          2HD1      LEU 115  11.448   2.787   7.094
  895   HD13  LEU 115          3HD1      LEU 115  10.548   4.107   6.353
  896   HD21  LEU 115          1HD2      LEU 115  10.642   0.752   4.788
  897   HD22  LEU 115          2HD2      LEU 115   9.297   0.105   5.728
  898   HD23  LEU 115          3HD2      LEU 115  10.844   0.430   6.510
  899    H    ILE 116           H        ILE 116   5.837   3.130   7.382
  900    HA   ILE 116           HA       ILE 116   5.585   3.990   4.702
  901    HB   ILE 116           HB       ILE 116   3.437   3.637   6.809
  902   HG12  ILE 116          1HG1      ILE 116   4.476   1.745   4.682
  903   HG13  ILE 116          2HG1      ILE 116   4.706   1.584   6.429
  904   HG21  ILE 116          1HG2      ILE 116   3.217   3.829   3.807
  905   HG22  ILE 116          2HG2      ILE 116   2.632   5.011   4.979
  906   HG23  ILE 116          3HG2      ILE 116   1.899   3.408   4.898
  907   HD11  ILE 116          1HD1      ILE 116   2.221   1.422   6.639
  908   HD12  ILE 116          2HD1      ILE 116   2.987   0.088   5.777
  909   HD13  ILE 116          3HD1      ILE 116   2.146   1.348   4.878
  910    H    LYS 117           H        LYS 117   4.952   5.503   7.813
  911    HA   LYS 117           HA       LYS 117   3.845   7.906   6.861
  912    HB2  LYS 117          1HB       LYS 117   5.308   7.219   9.400
  913    HB3  LYS 117          2HB       LYS 117   4.628   8.813   9.100
  914    HG2  LYS 117          1HG       LYS 117   2.406   7.852   8.909
  915    HG3  LYS 117          2HG       LYS 117   3.061   6.233   9.135
  916    HD2  LYS 117          1HD       LYS 117   3.743   6.760  11.377
  917    HD3  LYS 117          2HD       LYS 117   3.323   8.457  11.158
  918    HE2  LYS 117          1HE       LYS 117   1.323   6.215  10.967
  919    HE3  LYS 117          2HE       LYS 117   1.663   7.084  12.463
  920    HZ1  LYS 117          1HZ       LYS 117   0.711   8.348   9.951
  921    HZ2  LYS 117          2HZ       LYS 117   0.960   9.122  11.431
  922    HZ3  LYS 117          3HZ       LYS 117  -0.269   7.969  11.278
  923    H    ALA 118           H        ALA 118   7.169   7.019   7.736
  924    HA   ALA 118           HA       ALA 118   8.333   9.536   7.160
  925    HB1  ALA 118          1HB       ALA 118   9.592   6.806   7.203
  926    HB2  ALA 118          2HB       ALA 118   9.372   7.862   8.597
  927    HB3  ALA 118          3HB       ALA 118  10.447   8.346   7.286
  928    H    SER 119           H        SER 119   7.565   6.764   5.220
  929    HA   SER 119           HA       SER 119   9.170   7.193   2.995
  930    HB2  SER 119          1HB       SER 119   7.797   5.155   3.484
  931    HB3  SER 119          2HB       SER 119   6.365   6.058   3.001
  932    HG   SER 119           HG       SER 119   6.943   5.923   0.958
  933    H    ILE 120           H        ILE 120   5.924   8.453   3.726
  934    HA   ILE 120           HA       ILE 120   5.975  10.031   1.264
  935    HB   ILE 120           HB       ILE 120   3.647  10.620   1.801
  936   HG12  ILE 120          1HG1      ILE 120   3.876   8.702   4.121
  937   HG13  ILE 120          2HG1      ILE 120   3.972  10.454   4.301
  938   HG21  ILE 120          1HG2      ILE 120   4.242   7.673   1.907
  939   HG22  ILE 120          2HG2      ILE 120   4.078   8.658   0.453
  940   HG23  ILE 120          3HG2      ILE 120   2.683   8.382   1.496
  941   HD11  ILE 120          1HD1      ILE 120   1.718  10.630   3.302
  942   HD12  ILE 120          2HD1      ILE 120   1.753   9.725   4.818
  943   HD13  ILE 120          3HD1      ILE 120   1.631   8.868   3.282
  944    H    LYS 121           H        LYS 121   7.091  10.385   4.307
  945    HA   LYS 121           HA       LYS 121   6.271  13.142   4.723
  946    HB2  LYS 121          1HB       LYS 121   6.413  11.542   6.611
  947    HB3  LYS 121          2HB       LYS 121   8.138  11.391   6.323
  948    HG2  LYS 121          1HG       LYS 121   8.368  13.826   6.769
  949    HG3  LYS 121          2HG       LYS 121   6.660  13.852   7.214
  950    HD2  LYS 121          1HD       LYS 121   7.060  12.258   8.989
  951    HD3  LYS 121          2HD       LYS 121   8.751  12.112   8.510
  952    HE2  LYS 121          1HE       LYS 121   9.012  14.551   8.983
  953    HE3  LYS 121          2HE       LYS 121   7.374  14.542   9.634
  954    HZ1  LYS 121          1HZ       LYS 121   9.698  13.008  10.656
  955    HZ2  LYS 121          2HZ       LYS 121   8.118  12.838  11.235
  956    HZ3  LYS 121          3HZ       LYS 121   8.930  14.309  11.416
  957    H    LYS 122           H        LYS 122   7.369  14.756   3.843
  958    HA   LYS 122           HA       LYS 122  10.074  14.322   2.863
  959    HB2  LYS 122          1HB       LYS 122   9.039  17.043   2.663
  960    HB3  LYS 122          2HB       LYS 122   9.697  16.003   1.428
  961    HG2  LYS 122          1HG       LYS 122   7.517  14.815   1.323
  962    HG3  LYS 122          2HG       LYS 122   6.865  16.019   2.433
  963    HD2  LYS 122          1HD       LYS 122   8.079  16.615  -0.263
  964    HD3  LYS 122          2HD       LYS 122   6.351  16.520   0.074
  965    HE2  LYS 122          1HE       LYS 122   6.607  18.361   1.698
  966    HE3  LYS 122          2HE       LYS 122   8.309  18.478   1.260
  967    HZ1  LYS 122          1HZ       LYS 122   6.046  18.848  -0.626
  968    HZ2  LYS 122          2HZ       LYS 122   7.689  19.049  -0.979
  969    HZ3  LYS 122          3HZ       LYS 122   6.921  20.103   0.095
  970    H    ASP 123           H        ASP 123  11.250  14.121   4.698
  971    HA   ASP 123           HA       ASP 123  11.150  16.126   6.769
  972    HB2  ASP 123          1HB       ASP 123  11.585  13.806   7.385
  973    HB3  ASP 123          2HB       ASP 123  13.030  13.789   6.378
  974    H21  ACD 201           H21      ACD   1  -4.826   4.958   1.457
  975    H22  ACD 201           H22      ACD   1  -3.801   5.008   2.898
  976    H31  ACD 201           H31      ACD   1  -2.214   6.518   1.690
  977    H32  ACD 201           H32      ACD   1  -3.218   6.402   0.246
  978    H41  ACD 201           H41      ACD   1  -2.866   3.884   0.292
  979    H42  ACD 201           H42      ACD   1  -1.396   4.821  -0.008
  980    H5   ACD 201           H5       ACD   1  -2.058   3.264   2.551
  981    H6   ACD 201           H6       ACD   1   0.224   3.782   3.069
  982    H71  ACD 201           H71      ACD   1   0.720   4.841   0.417
  983    H72  ACD 201           H72      ACD   1  -0.156   6.133   1.237
  984    H8   ACD 201           H8       ACD   1   1.702   6.366   2.925
  985    H9   ACD 201           H9       ACD   1   3.816   5.531   2.191
  986   H101  ACD 201          H101      ACD   1   2.707   4.857  -0.409
  987   H102  ACD 201          H102      ACD   1   2.289   3.491   0.624
  988    H11  ACD 201           H11      ACD   1   5.234   4.440   0.430
  989    H12  ACD 201           H12      ACD   1   5.581   2.115   0.070
  990   H131  ACD 201          H131      ACD   1   2.595   2.092  -0.527
  991   H132  ACD 201          H132      ACD   1   3.702   0.722  -0.630
  992    H14  ACD 201           H14      ACD   1   2.627   1.810   2.074
  993    H15  ACD 201           H15      ACD   1   2.550  -0.529   2.545
  994   H161  ACD 201          H161      ACD   1   2.712  -1.201  -0.280
  995   H162  ACD 201          H162      ACD   1   4.377  -0.845   0.194
  996   H171  ACD 201          H171      ACD   1   4.351  -2.551   1.902
  997   H172  ACD 201          H172      ACD   1   2.609  -2.785   1.729
  998   H181  ACD 201          H181      ACD   1   4.659  -3.340  -0.457
  999   H182  ACD 201          H182      ACD   1   2.925  -3.643  -0.563
 1000   H191  ACD 201          H191      ACD   1   4.884  -4.969   1.363
 1001   H192  ACD 201          H192      ACD   1   3.136  -5.208   1.419
 1002   H201  ACD 201          H201      ACD   1   4.222  -7.007   0.157
 1003   H202  ACD 201          H202      ACD   1   4.930  -5.858  -0.928
 1004   H203  ACD 201          H203      ACD   1   3.214  -6.077  -0.900
  Start of MODEL   30
    1    H1   MET   1          1H        MET   1  21.196  13.050 -11.623
    2    H2   MET   1          2H        MET   1  20.722  12.587 -10.067
    3    H3   MET   1          3H        MET   1  20.644  14.211 -10.523
    4    HA   MET   1           HA       MET   1  18.942  13.730 -12.134
    5    HB2  MET   1          1HB       MET   1  19.615  11.452 -12.698
    6    HB3  MET   1          2HB       MET   1  19.207  10.906 -11.077
    7    HG2  MET   1          1HG       MET   1  16.853  11.513 -11.504
    8    HG3  MET   1          2HG       MET   1  17.295  11.945 -13.154
    9    HE1  MET   1          1HE       MET   1  14.971   9.885 -12.416
   10    HE2  MET   1          2HE       MET   1  15.265   8.633 -13.623
   11    HE3  MET   1          3HE       MET   1  15.404  10.333 -14.066
   12    H    GLU   2           H        GLU   2  17.240  14.719 -11.275
   13    HA   GLU   2           HA       GLU   2  16.596  14.276  -8.474
   14    HB2  GLU   2          1HB       GLU   2  15.575  16.278 -10.476
   15    HB3  GLU   2          2HB       GLU   2  14.910  16.103  -8.864
   16    HG2  GLU   2          1HG       GLU   2  16.418  17.932  -8.843
   17    HG3  GLU   2          2HG       GLU   2  17.169  16.614  -7.949
   18    H    PHE   3           H        PHE   3  15.368  12.643  -8.031
   19    HA   PHE   3           HA       PHE   3  13.286  11.793  -9.899
   20    HB2  PHE   3          1HB       PHE   3  14.794  10.063  -9.086
   21    HB3  PHE   3          2HB       PHE   3  14.401  10.470  -7.414
   22    HD1  PHE   3           HD1      PHE   3  12.329   9.770  -6.429
   23    HD2  PHE   3           HD2      PHE   3  13.236   8.847 -10.475
   24    HE1  PHE   3           HE1      PHE   3  10.503   8.125  -6.449
   25    HE2  PHE   3           HE2      PHE   3  11.407   7.198 -10.512
   26    HZ   PHE   3           HZ       PHE   3  10.037   6.834  -8.498
   27    H    THR   4           H        THR   4  11.159  11.906  -9.430
   28    HA   THR   4           HA       THR   4  10.442  13.522  -7.091
   29    HB   THR   4           HB       THR   4   8.285  12.922  -8.961
   30    HG1  THR   4           HG1      THR   4   9.596  13.072 -10.669
   31   HG21  THR   4          1HG2      THR   4   8.196  14.674  -7.270
   32   HG22  THR   4          2HG2      THR   4   8.029  15.351  -8.888
   33   HG23  THR   4          3HG2      THR   4   9.563  15.489  -8.028
   34    H    VAL   5           H        VAL   5   9.964  12.377  -5.370
   35    HA   VAL   5           HA       VAL   5   8.600   9.794  -5.623
   36    HB   VAL   5           HB       VAL   5   9.269   9.276  -3.492
   37   HG11  VAL   5          1HG1      VAL   5  11.257   9.572  -4.752
   38   HG12  VAL   5          2HG1      VAL   5  11.544  10.062  -3.083
   39   HG13  VAL   5          3HG1      VAL   5  11.324  11.284  -4.336
   40   HG21  VAL   5          1HG2      VAL   5   9.774  10.900  -1.704
   41   HG22  VAL   5          2HG2      VAL   5   8.127  11.053  -2.313
   42   HG23  VAL   5          3HG2      VAL   5   9.361  12.213  -2.807
   43    H    SER   6           H        SER   6   6.640   9.353  -4.724
   44    HA   SER   6           HA       SER   6   4.740  11.474  -4.738
   45    HB2  SER   6          1HB       SER   6   4.299   8.663  -3.712
   46    HB3  SER   6          2HB       SER   6   3.103   9.764  -4.398
   47    HG   SER   6           HG       SER   6   5.071   8.227  -5.676
   48    H    THR   7           H        THR   7   5.102  12.930  -3.088
   49    HA   THR   7           HA       THR   7   5.582  12.046  -0.386
   50    HB   THR   7           HB       THR   7   5.463  14.455   0.192
   51    HG1  THR   7           HG1      THR   7   4.805  14.672  -2.580
   52   HG21  THR   7          1HG2      THR   7   7.587  13.472  -0.490
   53   HG22  THR   7          2HG2      THR   7   7.460  15.137  -1.060
   54   HG23  THR   7          3HG2      THR   7   7.207  13.799  -2.181
   55    H    THR   8           H        THR   8   4.201  13.338   1.350
   56    HA   THR   8           HA       THR   8   1.686  12.212   1.512
   57    HB   THR   8           HB       THR   8   2.406  14.842   2.793
   58    HG1  THR   8           HG1      THR   8   3.244  13.269   4.484
   59   HG21  THR   8          1HG2      THR   8   1.098  13.913   4.669
   60   HG22  THR   8          2HG2      THR   8   0.749  12.486   3.692
   61   HG23  THR   8          3HG2      THR   8   0.143  14.066   3.194
   62    H    GLU   9           H        GLU   9   2.644  15.371   0.302
   63    HA   GLU   9           HA       GLU   9   0.079  16.439  -0.060
   64    HB2  GLU   9          1HB       GLU   9   2.663  17.082  -1.478
   65    HB3  GLU   9          2HB       GLU   9   1.210  18.071  -1.520
   66    HG2  GLU   9          1HG       GLU   9   1.363  18.543   0.799
   67    HG3  GLU   9          2HG       GLU   9   2.644  17.354   1.016
   68    H    ASP  10           H        ASP  10   2.244  14.710  -2.281
   69    HA   ASP  10           HA       ASP  10   0.536  14.847  -4.537
   70    HB2  ASP  10          1HB       ASP  10   2.579  12.688  -3.965
   71    HB3  ASP  10          2HB       ASP  10   1.921  13.148  -5.533
   72    H    LEU  11           H        LEU  11   0.942  12.552  -1.921
   73    HA   LEU  11           HA       LEU  11  -0.665  10.493  -2.860
   74    HB2  LEU  11          1HB       LEU  11   0.769  10.177  -0.964
   75    HB3  LEU  11          2HB       LEU  11  -0.115  11.385  -0.027
   76    HG   LEU  11           HG       LEU  11  -2.100   9.878  -0.115
   77   HD11  LEU  11          1HD1      LEU  11  -1.466   8.660  -2.140
   78   HD12  LEU  11          2HD1      LEU  11  -1.815   7.579  -0.792
   79   HD13  LEU  11          3HD1      LEU  11  -0.141   7.901  -1.255
   80   HD21  LEU  11          1HD2      LEU  11  -1.327   8.396   1.599
   81   HD22  LEU  11          2HD2      LEU  11  -0.485   9.935   1.788
   82   HD23  LEU  11          3HD2      LEU  11   0.342   8.558   1.057
   83    H    GLN  12           H        GLN  12  -1.496  13.473  -1.200
   84    HA   GLN  12           HA       GLN  12  -4.132  12.821  -0.480
   85    HB2  GLN  12          1HB       GLN  12  -2.791  15.464  -0.977
   86    HB3  GLN  12          2HB       GLN  12  -4.457  15.329  -0.429
   87    HG2  GLN  12          1HG       GLN  12  -2.041  14.272   1.024
   88    HG3  GLN  12          2HG       GLN  12  -2.924  15.743   1.427
   89   HE21  GLN  12          1HE2      GLN  12  -2.438  13.355   3.030
   90   HE22  GLN  12          2HE2      GLN  12  -3.993  12.756   3.481
   91    H    ARG  13           H        ARG  13  -2.755  13.830  -3.489
   92    HA   ARG  13           HA       ARG  13  -5.253  14.609  -4.663
   93    HB2  ARG  13          1HB       ARG  13  -3.209  15.620  -5.457
   94    HB3  ARG  13          2HB       ARG  13  -2.552  14.048  -5.888
   95    HG2  ARG  13          1HG       ARG  13  -3.814  13.873  -7.776
   96    HG3  ARG  13          2HG       ARG  13  -5.122  14.876  -7.125
   97    HD2  ARG  13          1HD       ARG  13  -2.409  15.882  -7.966
   98    HD3  ARG  13          2HD       ARG  13  -3.873  15.977  -8.945
   99    HE   ARG  13           HE       ARG  13  -4.602  17.196  -6.644
  100   HH11  ARG  13          1HH1      ARG  13  -1.892  17.619  -8.808
  101   HH12  ARG  13          2HH1      ARG  13  -1.737  19.317  -8.494
  102   HH21  ARG  13          1HH2      ARG  13  -4.409  19.436  -6.220
  103   HH22  ARG  13          2HH2      ARG  13  -3.161  20.349  -7.007
  104    H    TYR  14           H        TYR  14  -3.193  11.724  -4.739
  105    HA   TYR  14           HA       TYR  14  -4.732  10.367  -6.702
  106    HB2  TYR  14          1HB       TYR  14  -2.853   9.223  -4.625
  107    HB3  TYR  14          2HB       TYR  14  -3.525   8.338  -5.991
  108    HD1  TYR  14           HD1      TYR  14  -3.275  10.009  -8.255
  109    HD2  TYR  14           HD2      TYR  14  -0.583   9.610  -4.983
  110    HE1  TYR  14           HE1      TYR  14  -1.429  10.747  -9.696
  111    HE2  TYR  14           HE2      TYR  14   1.270  10.359  -6.416
  112    HH   TYR  14           HH       TYR  14   1.840  10.454  -8.801
  113    H    ARG  15           H        ARG  15  -5.025  10.663  -3.235
  114    HA   ARG  15           HA       ARG  15  -6.757   8.515  -2.754
  115    HB2  ARG  15          1HB       ARG  15  -7.210  11.131  -1.355
  116    HB3  ARG  15          2HB       ARG  15  -7.351   9.502  -0.731
  117    HG2  ARG  15          1HG       ARG  15  -4.927   9.249  -0.766
  118    HG3  ARG  15          2HG       ARG  15  -4.768  10.894  -1.389
  119    HD2  ARG  15          1HD       ARG  15  -4.456  11.281   0.855
  120    HD3  ARG  15          2HD       ARG  15  -6.207  11.476   0.751
  121    HE   ARG  15           HE       ARG  15  -5.492   8.781   1.319
  122   HH11  ARG  15          1HH1      ARG  15  -5.937  11.940   2.772
  123   HH12  ARG  15          2HH1      ARG  15  -6.028  11.315   4.387
  124   HH21  ARG  15          1HH2      ARG  15  -5.603   7.960   3.415
  125   HH22  ARG  15          2HH2      ARG  15  -5.849   9.046   4.760
  126    H    THR  16           H        THR  16  -7.532  11.891  -3.507
  127    HA   THR  16           HA       THR  16 -10.286  11.666  -3.659
  128    HB   THR  16           HB       THR  16  -8.336  13.508  -5.016
  129    HG1  THR  16           HG1      THR  16  -8.935  14.891  -3.411
  130   HG21  THR  16          1HG2      THR  16 -10.327  13.341  -6.447
  131   HG22  THR  16          2HG2      THR  16 -10.205  14.926  -5.682
  132   HG23  THR  16          3HG2      THR  16 -11.349  13.734  -5.063
  133    H    GLU  17           H        GLU  17  -7.873  11.392  -6.248
  134    HA   GLU  17           HA       GLU  17  -9.618  11.070  -8.369
  135    HB2  GLU  17          1HB       GLU  17  -6.776  10.518  -7.867
  136    HB3  GLU  17          2HB       GLU  17  -7.478   9.594  -9.180
  137    HG2  GLU  17          1HG       GLU  17  -7.521  12.596  -8.904
  138    HG3  GLU  17          2HG       GLU  17  -6.454  11.671  -9.965
  139    H    CYS  18           H        CYS  18  -8.144   8.572  -6.314
  140    HA   CYS  18           HA       CYS  18  -9.427   6.410  -7.651
  141    HB2  CYS  18          1HB       CYS  18  -8.071   6.592  -4.961
  142    HB3  CYS  18          2HB       CYS  18  -8.730   5.092  -5.634
  143    H    VAL  19           H        VAL  19 -10.249   8.443  -4.931
  144    HA   VAL  19           HA       VAL  19 -12.389   6.926  -3.943
  145    HB   VAL  19           HB       VAL  19 -11.607   9.801  -3.703
  146   HG11  VAL  19          1HG1      VAL  19 -14.189   8.667  -2.640
  147   HG12  VAL  19          2HG1      VAL  19 -14.044   9.842  -3.951
  148   HG13  VAL  19          3HG1      VAL  19 -13.539  10.276  -2.316
  149   HG21  VAL  19          1HG2      VAL  19 -10.503   8.210  -2.276
  150   HG22  VAL  19          2HG2      VAL  19 -12.051   7.550  -1.749
  151   HG23  VAL  19          3HG2      VAL  19 -11.593   9.194  -1.301
  152    H    SER  20           H        SER  20 -12.326   9.679  -6.161
  153    HA   SER  20           HA       SER  20 -15.083   9.681  -6.704
  154    HB2  SER  20          1HB       SER  20 -13.522  11.575  -7.117
  155    HB3  SER  20          2HB       SER  20 -12.839  10.679  -8.472
  156    HG   SER  20           HG       SER  20 -15.598  10.948  -8.478
  157    H    SER  21           H        SER  21 -12.398   7.952  -8.231
  158    HA   SER  21           HA       SER  21 -13.908   7.149 -10.520
  159    HB2  SER  21          1HB       SER  21 -11.327   6.076  -9.364
  160    HB3  SER  21          2HB       SER  21 -11.986   5.632 -10.937
  161    HG   SER  21           HG       SER  21 -10.999   8.142 -10.071
  162    H    LEU  22           H        LEU  22 -12.971   5.537  -7.476
  163    HA   LEU  22           HA       LEU  22 -14.369   3.131  -8.280
  164    HB2  LEU  22          1HB       LEU  22 -12.858   3.869  -5.779
  165    HB3  LEU  22          2HB       LEU  22 -13.609   2.293  -6.043
  166    HG   LEU  22           HG       LEU  22 -11.498   3.454  -7.853
  167   HD11  LEU  22          1HD1      LEU  22 -10.541   3.148  -5.658
  168   HD12  LEU  22          2HD1      LEU  22  -9.970   1.870  -6.731
  169   HD13  LEU  22          3HD1      LEU  22 -11.236   1.531  -5.549
  170   HD21  LEU  22          1HD2      LEU  22 -12.978   1.765  -8.835
  171   HD22  LEU  22          2HD2      LEU  22 -12.556   0.654  -7.528
  172   HD23  LEU  22          3HD2      LEU  22 -11.321   1.188  -8.672
  173    H    ASN  23           H        ASN  23 -15.517   5.934  -7.312
  174    HA   ASN  23           HA       ASN  23 -17.388   6.712  -6.281
  175    HB2  ASN  23          1HB       ASN  23 -18.239   3.846  -6.676
  176    HB3  ASN  23          2HB       ASN  23 -19.311   5.127  -6.148
  177   HD21  ASN  23          1HD2      ASN  23 -19.408   3.473  -8.541
  178   HD22  ASN  23          2HD2      ASN  23 -19.400   4.577  -9.879
  179    H    ILE  24           H        ILE  24 -15.242   5.882  -4.585
  180    HA   ILE  24           HA       ILE  24 -16.101   4.414  -2.344
  181    HB   ILE  24           HB       ILE  24 -14.029   6.609  -2.369
  182   HG12  ILE  24          1HG1      ILE  24 -13.597   4.970  -4.178
  183   HG13  ILE  24          2HG1      ILE  24 -12.377   4.893  -2.911
  184   HG21  ILE  24          1HG2      ILE  24 -13.024   5.309  -0.533
  185   HG22  ILE  24          2HG2      ILE  24 -14.391   4.196  -0.598
  186   HG23  ILE  24          3HG2      ILE  24 -14.646   5.881  -0.147
  187   HD11  ILE  24          1HD1      ILE  24 -13.010   2.680  -3.703
  188   HD12  ILE  24          2HD1      ILE  24 -14.686   2.991  -3.251
  189   HD13  ILE  24          3HD1      ILE  24 -13.440   2.896  -2.005
  190    HA   PRO  25           HA       PRO  25 -18.969   7.404  -0.620
  191    HB2  PRO  25          1HB       PRO  25 -18.709   5.714   1.772
  192    HB3  PRO  25          2HB       PRO  25 -20.146   6.132   0.837
  193    HG2  PRO  25          1HG       PRO  25 -19.060   3.678   0.778
  194    HG3  PRO  25          2HG       PRO  25 -19.868   4.402  -0.623
  195    HD2  PRO  25          1HD       PRO  25 -16.950   4.064  -0.082
  196    HD3  PRO  25          2HD       PRO  25 -17.839   3.968  -1.622
  197    H    ALA  26           H        ALA  26 -18.789   9.120   0.666
  198    HA   ALA  26           HA       ALA  26 -16.324  10.123   1.437
  199    HB1  ALA  26          1HB       ALA  26 -19.037  10.856   2.518
  200    HB2  ALA  26          2HB       ALA  26 -18.316  11.478   1.033
  201    HB3  ALA  26          3HB       ALA  26 -17.584  11.852   2.592
  202    H    ASP  27           H        ASP  27 -18.600   8.182   3.244
  203    HA   ASP  27           HA       ASP  27 -17.781   8.493   5.849
  204    HB2  ASP  27          1HB       ASP  27 -19.644   7.079   5.277
  205    HB3  ASP  27          2HB       ASP  27 -18.589   5.953   4.428
  206    H    TYR  28           H        TYR  28 -16.458   6.120   3.530
  207    HA   TYR  28           HA       TYR  28 -14.412   5.194   5.178
  208    HB2  TYR  28          1HB       TYR  28 -14.833   5.197   2.208
  209    HB3  TYR  28          2HB       TYR  28 -13.346   4.545   2.898
  210    HD1  TYR  28           HD1      TYR  28 -13.353   2.425   4.041
  211    HD2  TYR  28           HD2      TYR  28 -17.003   4.145   2.697
  212    HE1  TYR  28           HE1      TYR  28 -14.503   0.292   4.452
  213    HE2  TYR  28           HE2      TYR  28 -18.162   2.016   3.100
  214    HH   TYR  28           HH       TYR  28 -17.645  -0.358   3.297
  215    H    VAL  29           H        VAL  29 -14.539   7.910   2.959
  216    HA   VAL  29           HA       VAL  29 -11.826   8.510   2.748
  217    HB   VAL  29           HB       VAL  29 -14.146  10.425   2.719
  218   HG11  VAL  29          1HG1      VAL  29 -11.330  10.687   1.684
  219   HG12  VAL  29          2HG1      VAL  29 -12.067  11.616   2.990
  220   HG13  VAL  29          3HG1      VAL  29 -12.638  11.819   1.334
  221   HG21  VAL  29          1HG2      VAL  29 -12.803   8.880   0.515
  222   HG22  VAL  29          2HG2      VAL  29 -14.007  10.147   0.271
  223   HG23  VAL  29          3HG2      VAL  29 -14.450   8.659   1.106
  224    H    GLU  30           H        GLU  30 -14.224   9.618   5.138
  225    HA   GLU  30           HA       GLU  30 -12.564  11.360   6.592
  226    HB2  GLU  30          1HB       GLU  30 -14.615   9.667   7.974
  227    HB3  GLU  30          2HB       GLU  30 -14.171  11.345   8.258
  228    HG2  GLU  30          1HG       GLU  30 -15.222  11.980   6.162
  229    HG3  GLU  30          2HG       GLU  30 -15.694  10.305   5.894
  230    H    LYS  31           H        LYS  31 -12.993   7.891   6.734
  231    HA   LYS  31           HA       LYS  31 -11.531   7.438   9.119
  232    HB2  LYS  31          1HB       LYS  31 -12.063   5.556   6.820
  233    HB3  LYS  31          2HB       LYS  31 -11.460   5.097   8.406
  234    HG2  LYS  31          1HG       LYS  31 -13.554   6.027   9.389
  235    HG3  LYS  31          2HG       LYS  31 -14.152   6.253   7.744
  236    HD2  LYS  31          1HD       LYS  31 -13.901   3.847   7.331
  237    HD3  LYS  31          2HD       LYS  31 -13.330   3.631   8.998
  238    HE2  LYS  31          1HE       LYS  31 -16.041   4.702   8.191
  239    HE3  LYS  31          2HE       LYS  31 -15.718   3.071   8.782
  240    HZ1  LYS  31          1HZ       LYS  31 -15.310   5.590  10.296
  241    HZ2  LYS  31          2HZ       LYS  31 -14.945   4.046  10.868
  242    HZ3  LYS  31          3HZ       LYS  31 -16.549   4.468  10.544
  243    H    PHE  32           H        PHE  32 -10.649   7.248   5.687
  244    HA   PHE  32           HA       PHE  32  -8.023   6.378   6.009
  245    HB2  PHE  32          1HB       PHE  32  -9.051   8.209   3.838
  246    HB3  PHE  32          2HB       PHE  32  -7.614   7.197   3.761
  247    HD1  PHE  32           HD1      PHE  32 -10.195   7.325   1.968
  248    HD2  PHE  32           HD2      PHE  32  -8.848   4.742   5.068
  249    HE1  PHE  32           HE1      PHE  32 -11.540   5.494   1.023
  250    HE2  PHE  32           HE2      PHE  32 -10.186   2.911   4.129
  251    HZ   PHE  32           HZ       PHE  32 -11.532   3.279   2.101
  252    H    LYS  33           H        LYS  33  -9.394   9.597   6.200
  253    HA   LYS  33           HA       LYS  33  -7.013  11.096   6.232
  254    HB2  LYS  33          1HB       LYS  33  -9.456  11.908   6.082
  255    HB3  LYS  33          2HB       LYS  33  -9.460  11.787   7.840
  256    HG2  LYS  33          1HG       LYS  33  -7.618  13.350   7.987
  257    HG3  LYS  33          2HG       LYS  33  -7.555  13.460   6.221
  258    HD2  LYS  33          1HD       LYS  33  -9.820  14.380   6.196
  259    HD3  LYS  33          2HD       LYS  33  -9.908  14.238   7.953
  260    HE2  LYS  33          1HE       LYS  33  -8.029  15.795   8.164
  261    HE3  LYS  33          2HE       LYS  33  -7.960  15.944   6.409
  262    HZ1  LYS  33          1HZ       LYS  33 -10.246  16.728   8.130
  263    HZ2  LYS  33          2HZ       LYS  33 -10.205  16.853   6.447
  264    HZ3  LYS  33          3HZ       LYS  33  -9.157  17.786   7.389
  265    H    LYS  34           H        LYS  34  -8.486   9.056   8.590
  266    HA   LYS  34           HA       LYS  34  -6.663  10.021  10.679
  267    HB2  LYS  34          1HB       LYS  34  -9.233   8.442  10.791
  268    HB3  LYS  34          2HB       LYS  34  -8.160   8.574  12.182
  269    HG2  LYS  34          1HG       LYS  34  -8.509  10.898  12.344
  270    HG3  LYS  34          2HG       LYS  34  -9.251  10.975  10.745
  271    HD2  LYS  34          1HD       LYS  34 -10.935  11.142  12.502
  272    HD3  LYS  34          2HD       LYS  34 -11.148   9.667  11.561
  273    HE2  LYS  34          1HE       LYS  34 -10.041   8.379  13.310
  274    HE3  LYS  34          2HE       LYS  34  -9.785   9.853  14.245
  275    HZ1  LYS  34          1HZ       LYS  34 -11.713   8.583  15.007
  276    HZ2  LYS  34          2HZ       LYS  34 -12.438   8.756  13.491
  277    HZ3  LYS  34          3HZ       LYS  34 -12.157  10.115  14.452
  278    H    TRP  35           H        TRP  35  -6.212   8.186   8.320
  279    HA   TRP  35           HA       TRP  35  -5.206   6.250   7.744
  280    HB2  TRP  35          1HB       TRP  35  -3.981   6.796  10.433
  281    HB3  TRP  35          2HB       TRP  35  -3.458   5.442   9.425
  282    HD1  TRP  35           HD1      TRP  35  -3.595   9.297   9.395
  283    HE1  TRP  35           HE1      TRP  35  -1.751  10.166   7.815
  284    HE3  TRP  35           HE3      TRP  35  -1.955   4.825   7.508
  285    HZ2  TRP  35           HZ2      TRP  35   0.136   9.098   6.018
  286    HZ3  TRP  35           HZ3      TRP  35  -0.131   4.843   5.866
  287    HH2  TRP  35           HH2      TRP  35   0.898   6.925   5.135
  288    H    GLU  36           H        GLU  36  -7.788   5.843   8.721
  289    HA   GLU  36           HA       GLU  36  -7.516   3.214  10.009
  290    HB2  GLU  36          1HB       GLU  36  -9.933   5.015   9.826
  291    HB3  GLU  36          2HB       GLU  36  -9.931   3.405  10.531
  292    HG2  GLU  36          1HG       GLU  36  -8.273   4.203  12.189
  293    HG3  GLU  36          2HG       GLU  36  -8.455   5.820  11.519
  294    H    PHE  37           H        PHE  37  -7.533   1.624   8.612
  295    HA   PHE  37           HA       PHE  37  -9.107   1.931   6.137
  296    HB2  PHE  37          1HB       PHE  37  -6.665   0.184   6.561
  297    HB3  PHE  37          2HB       PHE  37  -7.495   0.471   5.036
  298    HD1  PHE  37           HD1      PHE  37  -7.009   2.393   3.719
  299    HD2  PHE  37           HD2      PHE  37  -5.403   2.023   7.646
  300    HE1  PHE  37           HE1      PHE  37  -5.525   4.307   3.292
  301    HE2  PHE  37           HE2      PHE  37  -3.916   3.935   7.221
  302    HZ   PHE  37           HZ       PHE  37  -3.973   5.077   5.044
  303    HA   PRO  38           HA       PRO  38 -11.375  -1.376   8.406
  304    HB2  PRO  38          1HB       PRO  38 -13.222  -0.744   6.164
  305    HB3  PRO  38          2HB       PRO  38 -13.561  -0.950   7.895
  306    HG2  PRO  38          1HG       PRO  38 -13.560   1.477   6.835
  307    HG3  PRO  38          2HG       PRO  38 -12.819   1.192   8.423
  308    HD2  PRO  38          1HD       PRO  38 -11.480   1.500   5.747
  309    HD3  PRO  38          2HD       PRO  38 -11.016   2.185   7.335
  310    H    GLU  39           H        GLU  39 -11.570  -3.488   7.936
  311    HA   GLU  39           HA       GLU  39 -10.332  -4.437   5.527
  312    HB2  GLU  39          1HB       GLU  39  -9.965  -5.485   7.748
  313    HB3  GLU  39          2HB       GLU  39 -11.639  -6.016   7.747
  314    HG2  GLU  39          1HG       GLU  39 -11.265  -7.632   6.164
  315    HG3  GLU  39          2HG       GLU  39  -9.886  -6.784   5.468
  316    H    ASP  40           H        ASP  40 -11.778  -3.564   4.052
  317    HA   ASP  40           HA       ASP  40 -14.175  -5.162   3.552
  318    HB2  ASP  40          1HB       ASP  40 -14.868  -3.134   4.865
  319    HB3  ASP  40          2HB       ASP  40 -14.205  -2.129   3.582
  320    H    ASP  41           H        ASP  41 -14.750  -5.207   1.370
  321    HA   ASP  41           HA       ASP  41 -12.595  -5.184  -0.409
  322    HB2  ASP  41          1HB       ASP  41 -14.656  -6.568  -0.654
  323    HB3  ASP  41          2HB       ASP  41 -15.523  -5.121  -1.163
  324    H    THR  42           H        THR  42 -14.959  -2.729   0.336
  325    HA   THR  42           HA       THR  42 -14.614  -0.998  -1.837
  326    HB   THR  42           HB       THR  42 -15.017  -0.137   1.023
  327    HG1  THR  42           HG1      THR  42 -16.597  -1.608   0.812
  328   HG21  THR  42          1HG2      THR  42 -16.394   1.618  -0.045
  329   HG22  THR  42          2HG2      THR  42 -15.907   0.998  -1.624
  330   HG23  THR  42          3HG2      THR  42 -14.700   1.681  -0.533
  331    H    THR  43           H        THR  43 -13.047  -0.860   1.353
  332    HA   THR  43           HA       THR  43 -11.150   1.102   0.806
  333    HB   THR  43           HB       THR  43 -10.840  -1.236   2.693
  334    HG1  THR  43           HG1      THR  43 -11.718   0.536   4.169
  335   HG21  THR  43          1HG2      THR  43  -9.530   0.445   4.023
  336   HG22  THR  43          2HG2      THR  43  -9.618   1.523   2.628
  337   HG23  THR  43          3HG2      THR  43  -8.780  -0.021   2.495
  338    H    MET  44           H        MET  44 -11.150  -2.335   0.165
  339    HA   MET  44           HA       MET  44  -8.363  -2.629  -0.130
  340    HB2  MET  44          1HB       MET  44 -10.595  -4.336  -1.214
  341    HB3  MET  44          2HB       MET  44  -8.903  -4.808  -1.143
  342    HG2  MET  44          1HG       MET  44  -8.961  -4.636   1.291
  343    HG3  MET  44          2HG       MET  44 -10.650  -4.149   1.216
  344    HE1  MET  44          1HE       MET  44 -10.858  -7.705   2.764
  345    HE2  MET  44          2HE       MET  44 -11.260  -5.997   2.946
  346    HE3  MET  44          3HE       MET  44  -9.578  -6.522   3.028
  347    H    CYS  45           H        CYS  45 -10.956  -2.256  -2.550
  348    HA   CYS  45           HA       CYS  45  -9.195  -2.224  -4.769
  349    HB2  CYS  45          1HB       CYS  45 -11.966  -1.032  -4.498
  350    HB3  CYS  45          2HB       CYS  45 -11.086  -1.197  -6.011
  351    H    TYR  46           H        TYR  46 -10.329   0.236  -2.554
  352    HA   TYR  46           HA       TYR  46  -9.467   2.521  -3.896
  353    HB2  TYR  46          1HB       TYR  46 -10.802   2.885  -2.007
  354    HB3  TYR  46          2HB       TYR  46  -9.822   1.825  -0.994
  355    HD1  TYR  46           HD1      TYR  46  -9.593   5.046  -2.882
  356    HD2  TYR  46           HD2      TYR  46  -8.313   2.773   0.483
  357    HE1  TYR  46           HE1      TYR  46  -8.377   6.998  -2.023
  358    HE2  TYR  46           HE2      TYR  46  -7.091   4.724   1.343
  359    HH   TYR  46           HH       TYR  46  -6.293   6.785   0.808
  360    H    ILE  47           H        ILE  47  -7.772   0.478  -1.543
  361    HA   ILE  47           HA       ILE  47  -5.317   1.802  -1.612
  362    HB   ILE  47           HB       ILE  47  -5.975  -1.071  -1.002
  363   HG12  ILE  47          1HG1      ILE  47  -6.915   0.535   0.571
  364   HG13  ILE  47          2HG1      ILE  47  -5.601  -0.346   1.345
  365   HG21  ILE  47          1HG2      ILE  47  -3.340   0.357  -0.678
  366   HG22  ILE  47          2HG2      ILE  47  -3.676  -1.026  -1.719
  367   HG23  ILE  47          3HG2      ILE  47  -3.727  -1.208   0.035
  368   HD11  ILE  47          1HD1      ILE  47  -4.124   1.624   0.801
  369   HD12  ILE  47          2HD1      ILE  47  -5.392   1.911   1.991
  370   HD13  ILE  47          3HD1      ILE  47  -5.594   2.484   0.335
  371    H    LYS  48           H        LYS  48  -6.612  -0.792  -3.634
  372    HA   LYS  48           HA       LYS  48  -4.248  -1.432  -4.988
  373    HB2  LYS  48          1HB       LYS  48  -6.389  -2.749  -5.049
  374    HB3  LYS  48          2HB       LYS  48  -7.036  -1.536  -6.144
  375    HG2  LYS  48          1HG       LYS  48  -5.260  -2.038  -7.751
  376    HG3  LYS  48          2HG       LYS  48  -4.615  -3.256  -6.651
  377    HD2  LYS  48          1HD       LYS  48  -5.904  -4.413  -8.265
  378    HD3  LYS  48          2HD       LYS  48  -6.857  -4.397  -6.783
  379    HE2  LYS  48          1HE       LYS  48  -8.285  -3.919  -8.665
  380    HE3  LYS  48          2HE       LYS  48  -8.133  -2.477  -7.665
  381    HZ1  LYS  48          1HZ       LYS  48  -6.593  -1.548  -9.216
  382    HZ2  LYS  48          2HZ       LYS  48  -7.955  -2.053 -10.076
  383    HZ3  LYS  48          3HZ       LYS  48  -6.534  -2.980 -10.119
  384    H    CYS  49           H        CYS  49  -6.886   0.791  -5.868
  385    HA   CYS  49           HA       CYS  49  -5.788   1.722  -8.247
  386    HB2  CYS  49          1HB       CYS  49  -8.051   2.210  -7.818
  387    HB3  CYS  49          2HB       CYS  49  -7.684   3.035  -6.304
  388    H    VAL  50           H        VAL  50  -5.457   3.052  -4.947
  389    HA   VAL  50           HA       VAL  50  -3.991   5.320  -5.639
  390    HB   VAL  50           HB       VAL  50  -4.111   3.762  -3.062
  391   HG11  VAL  50          1HG1      VAL  50  -2.840   6.447  -3.589
  392   HG12  VAL  50          2HG1      VAL  50  -2.004   4.966  -3.118
  393   HG13  VAL  50          3HG1      VAL  50  -3.120   5.744  -1.995
  394   HG21  VAL  50          1HG2      VAL  50  -6.190   4.789  -3.721
  395   HG22  VAL  50          2HG2      VAL  50  -5.374   6.334  -3.970
  396   HG23  VAL  50          3HG2      VAL  50  -5.504   5.657  -2.347
  397    H    PHE  51           H        PHE  51  -2.936   2.118  -4.576
  398    HA   PHE  51           HA       PHE  51  -0.182   2.624  -4.596
  399    HB2  PHE  51          1HB       PHE  51  -1.922   0.214  -4.571
  400    HB3  PHE  51          2HB       PHE  51  -0.235  -0.021  -5.015
  401    HD1  PHE  51           HD1      PHE  51   0.271  -1.366  -3.107
  402    HD2  PHE  51           HD2      PHE  51  -1.319   2.554  -2.623
  403    HE1  PHE  51           HE1      PHE  51   0.855  -1.425  -0.720
  404    HE2  PHE  51           HE2      PHE  51  -0.733   2.499  -0.236
  405    HZ   PHE  51           HZ       PHE  51   0.357   0.511   0.718
  406    H    ASN  52           H        ASN  52  -2.445   1.863  -7.095
  407    HA   ASN  52           HA       ASN  52  -0.478   1.137  -9.074
  408    HB2  ASN  52          1HB       ASN  52  -2.771   0.235  -9.138
  409    HB3  ASN  52          2HB       ASN  52  -3.408   1.866  -9.360
  410   HD21  ASN  52          1HD2      ASN  52  -0.502   0.611 -10.909
  411   HD22  ASN  52          2HD2      ASN  52  -1.141   0.633 -12.514
  412    H    LYS  53           H        LYS  53  -2.365   3.968  -8.204
  413    HA   LYS  53           HA       LYS  53  -1.630   5.566 -10.426
  414    HB2  LYS  53          1HB       LYS  53  -2.774   6.181  -7.716
  415    HB3  LYS  53          2HB       LYS  53  -2.383   7.467  -8.848
  416    HG2  LYS  53          1HG       LYS  53  -4.349   5.217  -9.283
  417    HG3  LYS  53          2HG       LYS  53  -4.744   6.900  -8.943
  418    HD2  LYS  53          1HD       LYS  53  -3.692   7.566 -11.057
  419    HD3  LYS  53          2HD       LYS  53  -3.297   5.878 -11.389
  420    HE2  LYS  53          1HE       LYS  53  -6.072   7.011 -11.061
  421    HE3  LYS  53          2HE       LYS  53  -5.310   6.587 -12.593
  422    HZ1  LYS  53          1HZ       LYS  53  -5.977   4.710 -10.388
  423    HZ2  LYS  53          2HZ       LYS  53  -5.185   4.286 -11.820
  424    HZ3  LYS  53          3HZ       LYS  53  -6.779   4.839 -11.872
  425    H    MET  54           H        MET  54  -0.173   4.830  -7.389
  426    HA   MET  54           HA       MET  54   1.765   6.983  -7.598
  427    HB2  MET  54          1HB       MET  54   1.191   4.885  -5.520
  428    HB3  MET  54          2HB       MET  54   2.601   5.939  -5.429
  429    HG2  MET  54          1HG       MET  54   1.275   7.853  -5.189
  430    HG3  MET  54          2HG       MET  54  -0.184   7.007  -5.697
  431    HE1  MET  54          1HE       MET  54   1.837   6.711  -1.580
  432    HE2  MET  54          2HE       MET  54   2.376   7.701  -2.937
  433    HE3  MET  54          3HE       MET  54   2.616   5.954  -2.972
  434    H    GLN  55           H        GLN  55   1.499   4.262  -9.198
  435    HA   GLN  55           HA       GLN  55   2.849   2.773 -10.213
  436    HB2  GLN  55          1HB       GLN  55   4.464   5.211  -9.922
  437    HB3  GLN  55          2HB       GLN  55   5.369   3.749 -10.292
  438    HG2  GLN  55          1HG       GLN  55   4.044   3.390 -12.275
  439    HG3  GLN  55          2HG       GLN  55   3.031   4.770 -11.873
  440   HE21  GLN  55          1HE2      GLN  55   3.766   6.820 -12.251
  441   HE22  GLN  55          2HE2      GLN  55   5.200   7.163 -13.151
  442    H    LEU  56           H        LEU  56   2.385   1.982  -7.726
  443    HA   LEU  56           HA       LEU  56   4.980   1.026  -6.776
  444    HB2  LEU  56          1HB       LEU  56   2.816   2.410  -5.367
  445    HB3  LEU  56          2HB       LEU  56   3.396   0.968  -4.520
  446    HG   LEU  56           HG       LEU  56   5.095   3.288  -5.441
  447   HD11  LEU  56          1HD1      LEU  56   3.619   3.992  -3.658
  448   HD12  LEU  56          2HD1      LEU  56   5.263   3.827  -3.042
  449   HD13  LEU  56          3HD1      LEU  56   4.065   2.582  -2.697
  450   HD21  LEU  56          1HD2      LEU  56   6.381   1.252  -5.366
  451   HD22  LEU  56          2HD2      LEU  56   5.730   0.864  -3.775
  452   HD23  LEU  56          3HD2      LEU  56   6.798   2.252  -3.975
  453    H    PHE  57           H        PHE  57   1.829   0.269  -7.785
  454    HA   PHE  57           HA       PHE  57   2.313  -2.574  -7.290
  455    HB2  PHE  57          1HB       PHE  57   0.799  -1.947  -5.491
  456    HB3  PHE  57          2HB       PHE  57  -0.254  -1.104  -6.615
  457    HD1  PHE  57           HD1      PHE  57  -1.854  -2.281  -7.949
  458    HD2  PHE  57           HD2      PHE  57   0.832  -4.404  -5.413
  459    HE1  PHE  57           HE1      PHE  57  -3.213  -4.315  -8.213
  460    HE2  PHE  57           HE2      PHE  57  -0.523  -6.439  -5.681
  461    HZ   PHE  57           HZ       PHE  57  -2.547  -6.395  -7.080
  462    H    ASP  58           H        ASP  58   1.534  -3.904  -8.883
  463    HA   ASP  58           HA       ASP  58   0.236  -2.601 -11.192
  464    HB2  ASP  58          1HB       ASP  58   2.593  -3.102 -11.688
  465    HB3  ASP  58          2HB       ASP  58   2.351  -4.776 -11.209
  466    H    ASP  59           H        ASP  59  -1.460  -3.720 -12.119
  467    HA   ASP  59           HA       ASP  59  -2.847  -5.491 -10.377
  468    HB2  ASP  59          1HB       ASP  59  -3.418  -4.565 -13.183
  469    HB3  ASP  59          2HB       ASP  59  -4.457  -5.689 -12.339
  470    H    THR  60           H        THR  60  -0.503  -6.061 -12.741
  471    HA   THR  60           HA       THR  60  -1.313  -8.863 -13.048
  472    HB   THR  60           HB       THR  60   0.692  -7.168 -14.523
  473    HG1  THR  60           HG1      THR  60  -1.915  -7.886 -14.919
  474   HG21  THR  60          1HG2      THR  60   1.161  -9.093 -15.931
  475   HG22  THR  60          2HG2      THR  60   0.094 -10.093 -14.945
  476   HG23  THR  60          3HG2      THR  60   1.579  -9.437 -14.253
  477    H    GLU  61           H        GLU  61   1.746  -7.058 -12.569
  478    HA   GLU  61           HA       GLU  61   3.093  -9.391 -11.591
  479    HB2  GLU  61          1HB       GLU  61   4.154  -6.594 -11.392
  480    HB3  GLU  61          2HB       GLU  61   5.031  -8.102 -11.587
  481    HG2  GLU  61          1HG       GLU  61   4.056  -8.328 -13.844
  482    HG3  GLU  61          2HG       GLU  61   3.333  -6.737 -13.648
  483    H    GLY  62           H        GLY  62   1.088  -7.166 -10.057
  484    HA2  GLY  62          1HA       GLY  62   0.492  -7.098  -7.817
  485    HA3  GLY  62          2HA       GLY  62   1.786  -8.247  -7.474
  486    HA   PRO  63           HA       PRO  63   3.195  -4.337  -5.584
  487    HB2  PRO  63          1HB       PRO  63   4.793  -5.507  -3.718
  488    HB3  PRO  63          2HB       PRO  63   3.045  -5.321  -3.509
  489    HG2  PRO  63          1HG       PRO  63   4.613  -7.708  -4.384
  490    HG3  PRO  63          2HG       PRO  63   3.256  -7.625  -3.253
  491    HD2  PRO  63          1HD       PRO  63   2.995  -8.423  -5.823
  492    HD3  PRO  63          2HD       PRO  63   1.690  -7.575  -4.956
  493    H    LEU  64           H        LEU  64   4.747  -3.224  -6.531
  494    HA   LEU  64           HA       LEU  64   6.885  -4.595  -7.931
  495    HB2  LEU  64          1HB       LEU  64   6.419  -1.617  -7.720
  496    HB3  LEU  64          2HB       LEU  64   7.401  -2.461  -8.902
  497    HG   LEU  64           HG       LEU  64   4.404  -2.719  -8.694
  498   HD11  LEU  64          1HD1      LEU  64   4.341  -1.417 -10.761
  499   HD12  LEU  64          2HD1      LEU  64   6.089  -1.192 -10.675
  500   HD13  LEU  64          3HD1      LEU  64   5.045  -0.487  -9.440
  501   HD21  LEU  64          1HD2      LEU  64   5.569  -4.702  -9.563
  502   HD22  LEU  64          2HD2      LEU  64   6.317  -3.697 -10.804
  503   HD23  LEU  64          3HD2      LEU  64   4.565  -3.913 -10.782
  504    H    VAL  65           H        VAL  65   8.189  -5.408  -6.421
  505    HA   VAL  65           HA       VAL  65   8.895  -4.426  -3.972
  506    HB   VAL  65           HB       VAL  65  10.513  -6.150  -5.828
  507   HG11  VAL  65          1HG1      VAL  65  11.991  -5.144  -4.168
  508   HG12  VAL  65          2HG1      VAL  65  11.767  -6.864  -3.852
  509   HG13  VAL  65          3HG1      VAL  65  10.912  -5.671  -2.874
  510   HG21  VAL  65          1HG2      VAL  65   8.659  -6.771  -3.543
  511   HG22  VAL  65          2HG2      VAL  65   9.663  -7.961  -4.372
  512   HG23  VAL  65          3HG2      VAL  65   8.392  -7.115  -5.250
  513    H    ASP  66           H        ASP  66  10.563  -3.806  -7.052
  514    HA   ASP  66           HA       ASP  66  12.804  -2.546  -5.926
  515    HB2  ASP  66          1HB       ASP  66  12.704  -3.403  -8.228
  516    HB3  ASP  66          2HB       ASP  66  11.625  -2.081  -8.661
  517    H    ASN  67           H        ASN  67   9.852  -1.088  -7.326
  518    HA   ASN  67           HA       ASN  67  10.540   1.570  -6.659
  519    HB2  ASN  67          1HB       ASN  67   7.888   0.269  -7.247
  520    HB3  ASN  67          2HB       ASN  67   8.039   1.977  -6.870
  521   HD21  ASN  67          1HD2      ASN  67   7.279   2.594  -8.855
  522   HD22  ASN  67          2HD2      ASN  67   8.216   2.447 -10.303
  523    H    LEU  68           H        LEU  68   8.877  -0.991  -4.968
  524    HA   LEU  68           HA       LEU  68   7.797   0.450  -2.844
  525    HB2  LEU  68          1HB       LEU  68   8.632  -2.390  -3.223
  526    HB3  LEU  68          2HB       LEU  68   8.170  -1.834  -1.622
  527    HG   LEU  68           HG       LEU  68   6.386  -1.457  -4.015
  528   HD11  LEU  68          1HD1      LEU  68   5.194  -3.465  -3.342
  529   HD12  LEU  68          2HD1      LEU  68   6.376  -3.759  -2.065
  530   HD13  LEU  68          3HD1      LEU  68   6.864  -3.851  -3.757
  531   HD21  LEU  68          1HD2      LEU  68   4.658  -1.251  -2.326
  532   HD22  LEU  68          2HD2      LEU  68   5.947  -0.082  -2.039
  533   HD23  LEU  68          3HD2      LEU  68   5.846  -1.541  -1.055
  534    H    VAL  69           H        VAL  69  10.938  -1.192  -3.069
  535    HA   VAL  69           HA       VAL  69  11.874  -0.309  -0.536
  536    HB   VAL  69           HB       VAL  69  13.408  -1.247  -2.950
  537   HG11  VAL  69          1HG1      VAL  69  14.250  -0.888  -0.081
  538   HG12  VAL  69          2HG1      VAL  69  14.876  -0.025  -1.486
  539   HG13  VAL  69          3HG1      VAL  69  15.192  -1.749  -1.298
  540   HG21  VAL  69          1HG2      VAL  69  12.497  -2.719  -0.487
  541   HG22  VAL  69          2HG2      VAL  69  13.461  -3.393  -1.802
  542   HG23  VAL  69          3HG2      VAL  69  11.801  -2.878  -2.101
  543    H    HIS  70           H        HIS  70  12.173   0.937  -3.829
  544    HA   HIS  70           HA       HIS  70  14.005   2.983  -3.364
  545    HB2  HIS  70          1HB       HIS  70  13.171   2.245  -5.599
  546    HB3  HIS  70          2HB       HIS  70  11.648   3.051  -5.262
  547    HD1  HIS  70           HD1      HIS  70  14.772   3.579  -6.910
  548    HD2  HIS  70           HD2      HIS  70  12.125   5.990  -4.801
  549    HE1  HIS  70           HE1      HIS  70  15.336   5.939  -7.565
  550    HE2  HIS  70           HE2      HIS  70  13.861   7.377  -6.118
  551    H    GLN  71           H        GLN  71  10.565   2.819  -2.709
  552    HA   GLN  71           HA       GLN  71  10.437   5.649  -2.053
  553    HB2  GLN  71          1HB       GLN  71   8.590   4.507  -3.283
  554    HB3  GLN  71          2HB       GLN  71   8.282   3.540  -1.846
  555    HG2  GLN  71          1HG       GLN  71   6.699   5.320  -1.903
  556    HG3  GLN  71          2HG       GLN  71   7.829   5.611  -0.584
  557   HE21  GLN  71          1HE2      GLN  71   6.155   7.539  -1.805
  558   HE22  GLN  71          2HE2      GLN  71   7.173   8.733  -2.523
  559    H    LEU  72           H        LEU  72   9.720   2.591  -0.377
  560    HA   LEU  72           HA       LEU  72   9.201   3.775   2.102
  561    HB2  LEU  72          1HB       LEU  72  10.006   0.961   1.404
  562    HB3  LEU  72          2HB       LEU  72   9.564   1.457   3.025
  563    HG   LEU  72           HG       LEU  72   7.744   1.690   0.629
  564   HD11  LEU  72          1HD1      LEU  72   6.570  -0.250   1.575
  565   HD12  LEU  72          2HD1      LEU  72   7.823  -0.400   2.811
  566   HD13  LEU  72          3HD1      LEU  72   8.224  -0.653   1.112
  567   HD21  LEU  72          1HD2      LEU  72   7.141   3.267   2.331
  568   HD22  LEU  72          2HD2      LEU  72   7.285   2.038   3.589
  569   HD23  LEU  72          3HD2      LEU  72   5.996   1.925   2.390
  570    H    ALA  73           H        ALA  73  12.198   2.360   0.827
  571    HA   ALA  73           HA       ALA  73  13.627   2.653   3.283
  572    HB1  ALA  73          1HB       ALA  73  15.546   1.899   2.052
  573    HB2  ALA  73          2HB       ALA  73  14.717   2.187   0.522
  574    HB3  ALA  73          3HB       ALA  73  14.141   0.926   1.613
  575    H    HIS  74           H        HIS  74  12.448   5.130   2.369
  576    HA   HIS  74           HA       HIS  74  14.541   6.833   1.395
  577    HB2  HIS  74          1HB       HIS  74  12.084   7.327   1.128
  578    HB3  HIS  74          2HB       HIS  74  12.009   7.639   2.860
  579    HD1  HIS  74           HD1      HIS  74  11.983   9.485  -0.052
  580    HD2  HIS  74           HD2      HIS  74  14.325   9.723   3.368
  581    HE1  HIS  74           HE1      HIS  74  12.851  11.843   0.010
  582    HE2  HIS  74           HE2      HIS  74  14.094  12.021   2.198
  583    H    GLY  75           H        GLY  75  16.277   6.358   2.794
  584    HA2  GLY  75          1HA       GLY  75  17.600   7.442   4.442
  585    HA3  GLY  75          2HA       GLY  75  16.128   7.876   5.298
  586    H    ARG  76           H        ARG  76  16.720   4.653   4.085
  587    HA   ARG  76           HA       ARG  76  17.682   3.686   6.631
  588    HB2  ARG  76          1HB       ARG  76  14.878   3.337   5.776
  589    HB3  ARG  76          2HB       ARG  76  15.675   1.879   6.357
  590    HG2  ARG  76          1HG       ARG  76  16.339   3.254   8.389
  591    HG3  ARG  76          2HG       ARG  76  15.165   4.444   7.828
  592    HD2  ARG  76          1HD       ARG  76  13.407   2.776   7.925
  593    HD3  ARG  76          2HD       ARG  76  14.571   1.554   8.428
  594    HE   ARG  76           HE       ARG  76  14.177   3.947  10.077
  595   HH11  ARG  76          1HH1      ARG  76  13.909   0.483   9.668
  596   HH12  ARG  76          2HH1      ARG  76  13.616   0.179  11.349
  597   HH21  ARG  76          1HH2      ARG  76  13.771   3.559  12.285
  598   HH22  ARG  76          2HH2      ARG  76  13.530   1.933  12.843
  599    H    ASP  77           H        ASP  77  18.040   1.289   6.549
  600    HA   ASP  77           HA       ASP  77  19.516   0.554   4.290
  601    HB2  ASP  77          1HB       ASP  77  18.454  -1.039   6.610
  602    HB3  ASP  77          2HB       ASP  77  19.398  -1.778   5.323
  603    H    ALA  78           H        ALA  78  18.705   0.308   2.385
  604    HA   ALA  78           HA       ALA  78  16.125  -0.419   1.661
  605    HB1  ALA  78          1HB       ALA  78  18.668  -0.849   0.108
  606    HB2  ALA  78          2HB       ALA  78  17.749   0.654   0.175
  607    HB3  ALA  78          3HB       ALA  78  17.035  -0.784  -0.556
  608    H    GLU  79           H        GLU  79  18.917  -2.392   2.393
  609    HA   GLU  79           HA       GLU  79  18.124  -4.868   1.396
  610    HB2  GLU  79          1HB       GLU  79  19.741  -4.151   3.835
  611    HB3  GLU  79          2HB       GLU  79  19.520  -5.806   3.285
  612    HG2  GLU  79          1HG       GLU  79  20.622  -5.312   1.214
  613    HG3  GLU  79          2HG       GLU  79  20.740  -3.607   1.639
  614    H    GLU  80           H        GLU  80  17.587  -3.504   4.633
  615    HA   GLU  80           HA       GLU  80  16.076  -5.688   5.595
  616    HB2  GLU  80          1HB       GLU  80  17.229  -4.166   7.086
  617    HB3  GLU  80          2HB       GLU  80  16.249  -2.820   6.524
  618    HG2  GLU  80          1HG       GLU  80  14.298  -3.739   7.525
  619    HG3  GLU  80          2HG       GLU  80  15.129  -5.242   7.899
  620    H    VAL  81           H        VAL  81  15.215  -2.545   4.231
  621    HA   VAL  81           HA       VAL  81  12.452  -2.675   4.474
  622    HB   VAL  81           HB       VAL  81  14.095  -1.377   2.308
  623   HG11  VAL  81          1HG1      VAL  81  12.120   0.076   1.984
  624   HG12  VAL  81          2HG1      VAL  81  11.208  -0.971   3.074
  625   HG13  VAL  81          3HG1      VAL  81  11.813  -1.604   1.544
  626   HG21  VAL  81          1HG2      VAL  81  14.717  -0.535   4.418
  627   HG22  VAL  81          2HG2      VAL  81  13.039  -0.433   4.950
  628   HG23  VAL  81          3HG2      VAL  81  13.636   0.653   3.696
  629    H    ARG  82           H        ARG  82  14.493  -3.728   1.736
  630    HA   ARG  82           HA       ARG  82  12.525  -4.754   0.070
  631    HB2  ARG  82          1HB       ARG  82  14.947  -4.476  -0.476
  632    HB3  ARG  82          2HB       ARG  82  15.283  -5.914   0.478
  633    HG2  ARG  82          1HG       ARG  82  13.811  -7.205  -1.008
  634    HG3  ARG  82          2HG       ARG  82  13.588  -5.763  -1.993
  635    HD2  ARG  82          1HD       ARG  82  15.275  -7.114  -3.013
  636    HD3  ARG  82          2HD       ARG  82  16.041  -5.684  -2.326
  637    HE   ARG  82           HE       ARG  82  16.051  -8.029  -0.626
  638   HH11  ARG  82          1HH1      ARG  82  17.757  -6.171  -3.047
  639   HH12  ARG  82          2HH1      ARG  82  19.313  -6.827  -2.647
  640   HH21  ARG  82          1HH2      ARG  82  18.101  -8.896  -0.082
  641   HH22  ARG  82          2HH2      ARG  82  19.509  -8.376  -0.955
  642    H    THR  83           H        THR  83  14.293  -6.313   2.691
  643    HA   THR  83           HA       THR  83  13.248  -8.893   2.359
  644    HB   THR  83           HB       THR  83  14.485  -7.445   4.683
  645    HG1  THR  83           HG1      THR  83  15.998  -8.006   3.207
  646   HG21  THR  83          1HG2      THR  83  13.600 -10.333   4.625
  647   HG22  THR  83          2HG2      THR  83  12.954  -9.060   5.661
  648   HG23  THR  83          3HG2      THR  83  14.620  -9.602   5.865
  649    H    GLU  84           H        GLU  84  12.282  -6.268   4.571
  650    HA   GLU  84           HA       GLU  84  10.120  -7.563   5.768
  651    HB2  GLU  84          1HB       GLU  84  10.647  -4.639   5.308
  652    HB3  GLU  84          2HB       GLU  84   9.244  -5.221   6.188
  653    HG2  GLU  84          1HG       GLU  84  12.129  -5.610   6.920
  654    HG3  GLU  84          2HG       GLU  84  10.944  -4.606   7.748
  655    H    VAL  85           H        VAL  85  10.172  -5.505   2.866
  656    HA   VAL  85           HA       VAL  85   7.458  -5.559   2.259
  657    HB   VAL  85           HB       VAL  85   9.898  -5.433   0.494
  658   HG11  VAL  85          1HG1      VAL  85   8.413  -4.831  -1.368
  659   HG12  VAL  85          2HG1      VAL  85   7.015  -5.206  -0.358
  660   HG13  VAL  85          3HG1      VAL  85   8.141  -6.485  -0.814
  661   HG21  VAL  85          1HG2      VAL  85   9.170  -3.108   0.193
  662   HG22  VAL  85          2HG2      VAL  85   9.472  -3.500   1.886
  663   HG23  VAL  85          3HG2      VAL  85   7.815  -3.401   1.285
  664    H    LEU  86           H        LEU  86  10.019  -7.827   1.296
  665    HA   LEU  86           HA       LEU  86   8.447  -9.484  -0.308
  666    HB2  LEU  86          1HB       LEU  86  10.976 -10.037   1.233
  667    HB3  LEU  86          2HB       LEU  86  10.249 -11.182   0.107
  668    HG   LEU  86           HG       LEU  86  11.076  -8.405  -0.698
  669   HD11  LEU  86          1HD1      LEU  86  13.103  -9.404  -1.596
  670   HD12  LEU  86          2HD1      LEU  86  12.639 -10.971  -0.930
  671   HD13  LEU  86          3HD1      LEU  86  13.015  -9.630   0.153
  672   HD21  LEU  86          1HD2      LEU  86  11.054  -9.424  -2.945
  673   HD22  LEU  86          2HD2      LEU  86   9.471  -9.439  -2.168
  674   HD23  LEU  86          3HD2      LEU  86  10.435 -10.914  -2.232
  675    H    LYS  87           H        LYS  87   8.838  -9.375   3.156
  676    HA   LYS  87           HA       LYS  87   7.745 -11.952   3.722
  677    HB2  LYS  87          1HB       LYS  87   7.988  -9.445   5.388
  678    HB3  LYS  87          2HB       LYS  87   7.315 -10.945   6.010
  679    HG2  LYS  87          1HG       LYS  87   9.413 -12.084   5.639
  680    HG3  LYS  87          2HG       LYS  87  10.102 -10.623   4.909
  681    HD2  LYS  87          1HD       LYS  87   9.751  -9.443   7.055
  682    HD3  LYS  87          2HD       LYS  87   9.170 -10.950   7.762
  683    HE2  LYS  87          1HE       LYS  87  11.302 -11.988   7.467
  684    HE3  LYS  87          2HE       LYS  87  11.895 -10.621   6.525
  685    HZ1  LYS  87          1HZ       LYS  87  12.733 -10.524   8.766
  686    HZ2  LYS  87          2HZ       LYS  87  11.169 -10.577   9.402
  687    HZ3  LYS  87          3HZ       LYS  87  11.671  -9.227   8.507
  688    H    CYS  88           H        CYS  88   6.407  -9.107   2.558
  689    HA   CYS  88           HA       CYS  88   3.726  -9.826   3.501
  690    HB2  CYS  88          1HB       CYS  88   4.989  -7.223   2.715
  691    HB3  CYS  88          2HB       CYS  88   3.221  -7.401   2.714
  692    H    VAL  89           H        VAL  89   5.764  -9.856   0.816
  693    HA   VAL  89           HA       VAL  89   3.711  -9.652  -1.202
  694    HB   VAL  89           HB       VAL  89   6.560 -10.624  -1.458
  695   HG11  VAL  89          1HG1      VAL  89   6.242 -10.170  -3.852
  696   HG12  VAL  89          2HG1      VAL  89   4.552  -9.766  -3.535
  697   HG13  VAL  89          3HG1      VAL  89   5.134 -11.408  -3.257
  698   HG21  VAL  89          1HG2      VAL  89   6.995  -8.382  -2.421
  699   HG22  VAL  89          2HG2      VAL  89   6.564  -8.334  -0.714
  700   HG23  VAL  89          3HG2      VAL  89   5.370  -7.893  -1.936
  701    H    ASP  90           H        ASP  90   2.609 -11.283  -2.077
  702    HA   ASP  90           HA       ASP  90   3.464 -14.014  -1.917
  703    HB2  ASP  90          1HB       ASP  90   2.441 -13.652   0.341
  704    HB3  ASP  90          2HB       ASP  90   0.936 -13.206  -0.465
  705    H    LYS  91           H        LYS  91   1.853 -15.441  -3.001
  706    HA   LYS  91           HA       LYS  91   1.156 -14.275  -5.510
  707    HB2  LYS  91          1HB       LYS  91   0.267 -16.984  -4.537
  708    HB3  LYS  91          2HB       LYS  91   0.564 -16.451  -6.189
  709    HG2  LYS  91          1HG       LYS  91   2.936 -16.275  -5.724
  710    HG3  LYS  91          2HG       LYS  91   2.651 -16.814  -4.070
  711    HD2  LYS  91          1HD       LYS  91   1.785 -18.938  -4.912
  712    HD3  LYS  91          2HD       LYS  91   2.062 -18.395  -6.568
  713    HE2  LYS  91          1HE       LYS  91   3.858 -19.863  -5.809
  714    HE3  LYS  91          2HE       LYS  91   4.453 -18.236  -6.127
  715    HZ1  LYS  91          1HZ       LYS  91   3.781 -19.303  -3.437
  716    HZ2  LYS  91          2HZ       LYS  91   4.433 -17.778  -3.776
  717    HZ3  LYS  91          3HZ       LYS  91   5.345 -19.169  -4.071
  718    H    ASN  92           H        ASN  92  -0.875 -14.251  -6.515
  719    HA   ASN  92           HA       ASN  92  -2.962 -13.196  -4.861
  720    HB2  ASN  92          1HB       ASN  92  -2.463 -12.365  -7.158
  721    HB3  ASN  92          2HB       ASN  92  -3.016 -13.905  -7.797
  722   HD21  ASN  92          1HD2      ASN  92  -4.503 -12.664  -9.019
  723   HD22  ASN  92          2HD2      ASN  92  -5.990 -12.123  -8.316
  724    H    THR  93           H        THR  93  -3.135 -15.155  -3.544
  725    HA   THR  93           HA       THR  93  -4.414 -17.478  -4.660
  726    HB   THR  93           HB       THR  93  -4.567 -18.186  -2.267
  727    HG1  THR  93           HG1      THR  93  -4.485 -16.590  -0.867
  728   HG21  THR  93          1HG2      THR  93  -2.605 -18.744  -3.587
  729   HG22  THR  93          2HG2      THR  93  -2.149 -18.398  -1.920
  730   HG23  THR  93          3HG2      THR  93  -1.870 -17.194  -3.178
  731    H    ASP  94           H        ASP  94  -5.420 -14.482  -3.313
  732    HA   ASP  94           HA       ASP  94  -8.012 -15.358  -2.446
  733    HB2  ASP  94          1HB       ASP  94  -6.780 -13.406  -1.458
  734    HB3  ASP  94          2HB       ASP  94  -7.068 -12.528  -2.965
  735    H    ASN  95           H        ASN  95  -6.597 -14.396  -5.381
  736    HA   ASN  95           HA       ASN  95  -7.334 -14.245  -7.500
  737    HB2  ASN  95          1HB       ASN  95  -9.824 -15.482  -6.339
  738    HB3  ASN  95          2HB       ASN  95  -9.566 -15.219  -8.055
  739   HD21  ASN  95          1HD2      ASN  95  -9.940 -17.679  -6.531
  740   HD22  ASN  95          2HD2      ASN  95  -8.551 -18.662  -6.881
  741    H    ASN  96           H        ASN  96  -7.844 -12.128  -5.442
  742    HA   ASN  96           HA       ASN  96  -9.471 -10.459  -7.200
  743    HB2  ASN  96          1HB       ASN  96 -11.052 -10.958  -5.492
  744    HB3  ASN  96          2HB       ASN  96  -9.852 -10.767  -4.216
  745   HD21  ASN  96          1HD2      ASN  96 -11.232  -9.314  -3.158
  746   HD22  ASN  96          2HD2      ASN  96 -11.462  -7.689  -3.713
  747    H    ALA  97           H        ALA  97  -8.218  -8.874  -7.842
  748    HA   ALA  97           HA       ALA  97  -5.640  -8.451  -6.835
  749    HB1  ALA  97          1HB       ALA  97  -7.243  -6.595  -8.583
  750    HB2  ALA  97          2HB       ALA  97  -6.325  -7.989  -9.152
  751    HB3  ALA  97          3HB       ALA  97  -5.489  -6.628  -8.405
  752    H    CYS  98           H        CYS  98  -8.686  -6.861  -6.086
  753    HA   CYS  98           HA       CYS  98  -7.612  -4.586  -4.791
  754    HB2  CYS  98          1HB       CYS  98 -10.213  -6.017  -4.203
  755    HB3  CYS  98          2HB       CYS  98  -9.778  -4.403  -3.655
  756    H    HIS  99           H        HIS  99  -8.351  -7.851  -3.600
  757    HA   HIS  99           HA       HIS  99  -7.638  -7.093  -0.898
  758    HB2  HIS  99          1HB       HIS  99  -9.406  -8.826  -1.451
  759    HB3  HIS  99          2HB       HIS  99  -8.095  -9.893  -1.940
  760    HD1  HIS  99           HD1      HIS  99  -8.794 -11.555  -0.033
  761    HD2  HIS  99           HD2      HIS  99  -7.530  -7.819   1.301
  762    HE1  HIS  99           HE1      HIS  99  -8.379 -11.814   2.431
  763    HE2  HIS  99           HE2      HIS  99  -7.784  -9.508   3.244
  764    H    TRP 100           H        TRP 100  -6.147  -8.455  -3.677
  765    HA   TRP 100           HA       TRP 100  -3.905  -9.678  -2.512
  766    HB2  TRP 100          1HB       TRP 100  -4.592  -9.943  -4.886
  767    HB3  TRP 100          2HB       TRP 100  -4.087  -8.285  -5.202
  768    HD1  TRP 100           HD1      TRP 100  -1.669 -10.017  -2.957
  769    HE1  TRP 100           HE1      TRP 100   0.401 -10.756  -4.293
  770    HE3  TRP 100           HE3      TRP 100  -3.445  -9.275  -7.695
  771    HZ2  TRP 100           HZ2      TRP 100   1.178 -11.005  -6.993
  772    HZ3  TRP 100           HZ3      TRP 100  -1.979  -9.792  -9.596
  773    HH2  TRP 100           HH2      TRP 100   0.284 -10.640  -9.259
  774    H    ALA 101           H        ALA 101  -4.248  -6.423  -3.923
  775    HA   ALA 101           HA       ALA 101  -1.732  -5.460  -3.089
  776    HB1  ALA 101          1HB       ALA 101  -2.649  -3.235  -3.595
  777    HB2  ALA 101          2HB       ALA 101  -4.258  -3.943  -3.730
  778    HB3  ALA 101          3HB       ALA 101  -2.997  -4.401  -4.873
  779    H    PHE 102           H        PHE 102  -4.927  -5.386  -1.633
  780    HA   PHE 102           HA       PHE 102  -4.319  -3.631   0.464
  781    HB2  PHE 102          1HB       PHE 102  -6.600  -4.131  -0.246
  782    HB3  PHE 102          2HB       PHE 102  -6.442  -5.771   0.369
  783    HD1  PHE 102           HD1      PHE 102  -7.010  -6.236   2.602
  784    HD2  PHE 102           HD2      PHE 102  -6.318  -2.214   1.401
  785    HE1  PHE 102           HE1      PHE 102  -7.789  -5.450   4.797
  786    HE2  PHE 102           HE2      PHE 102  -7.094  -1.420   3.595
  787    HZ   PHE 102           HZ       PHE 102  -7.830  -3.038   5.298
  788    H    ARG 103           H        ARG 103  -3.965  -7.093   0.085
  789    HA   ARG 103           HA       ARG 103  -3.515  -7.713   2.820
  790    HB2  ARG 103          1HB       ARG 103  -4.131  -9.368   1.025
  791    HB3  ARG 103          2HB       ARG 103  -2.489  -9.219   0.419
  792    HG2  ARG 103          1HG       ARG 103  -1.599 -10.048   2.504
  793    HG3  ARG 103          2HG       ARG 103  -3.221 -10.128   3.182
  794    HD2  ARG 103          1HD       ARG 103  -2.497 -12.334   2.469
  795    HD3  ARG 103          2HD       ARG 103  -3.832 -11.778   1.469
  796    HE   ARG 103           HE       ARG 103  -1.339 -11.135   0.283
  797   HH11  ARG 103          1HH1      ARG 103  -3.562 -13.769   0.853
  798   HH12  ARG 103          2HH1      ARG 103  -3.024 -14.693  -0.512
  799   HH21  ARG 103          1HH2      ARG 103  -0.640 -12.321  -1.530
  800   HH22  ARG 103          2HH2      ARG 103  -1.352 -13.867  -1.878
  801    H    GLY 104           H        GLY 104  -1.467  -6.787   0.128
  802    HA2  GLY 104          1HA       GLY 104   1.031  -7.164   1.425
  803    HA3  GLY 104          2HA       GLY 104   0.729  -6.118   0.033
  804    H    PHE 105           H        PHE 105  -1.105  -4.361   1.085
  805    HA   PHE 105           HA       PHE 105   0.583  -2.540   2.410
  806    HB2  PHE 105          1HB       PHE 105  -1.092  -1.667   0.971
  807    HB3  PHE 105          2HB       PHE 105  -2.366  -2.516   1.832
  808    HD1  PHE 105           HD1      PHE 105  -3.784  -0.932   2.770
  809    HD2  PHE 105           HD2      PHE 105   0.430  -0.344   2.988
  810    HE1  PHE 105           HE1      PHE 105  -4.138   1.074   4.142
  811    HE2  PHE 105           HE2      PHE 105   0.075   1.668   4.359
  812    HZ   PHE 105           HZ       PHE 105  -2.209   2.378   4.939
  813    H    LYS 106           H        LYS 106  -2.216  -4.419   3.510
  814    HA   LYS 106           HA       LYS 106  -2.328  -3.399   6.109
  815    HB2  LYS 106          1HB       LYS 106  -4.249  -4.524   5.577
  816    HB3  LYS 106          2HB       LYS 106  -3.404  -5.846   4.771
  817    HG2  LYS 106          1HG       LYS 106  -2.655  -6.599   7.042
  818    HG3  LYS 106          2HG       LYS 106  -3.730  -5.375   7.724
  819    HD2  LYS 106          1HD       LYS 106  -5.639  -6.426   6.636
  820    HD3  LYS 106          2HD       LYS 106  -4.574  -7.625   5.905
  821    HE2  LYS 106          1HE       LYS 106  -3.931  -8.380   8.173
  822    HE3  LYS 106          2HE       LYS 106  -5.091  -7.239   8.853
  823    HZ1  LYS 106          1HZ       LYS 106  -5.687  -9.573   7.123
  824    HZ2  LYS 106          2HZ       LYS 106  -6.839  -8.417   7.574
  825    HZ3  LYS 106          3HZ       LYS 106  -6.096  -9.380   8.751
  826    H    CYS 107           H        CYS 107  -0.693  -6.260   4.813
  827    HA   CYS 107           HA       CYS 107   0.303  -7.312   7.175
  828    HB2  CYS 107          1HB       CYS 107   0.417  -8.651   5.243
  829    HB3  CYS 107          2HB       CYS 107   1.254  -7.414   4.316
  830    H    PHE 108           H        PHE 108   1.670  -4.859   5.023
  831    HA   PHE 108           HA       PHE 108   4.166  -4.773   6.403
  832    HB2  PHE 108          1HB       PHE 108   3.722  -4.247   3.948
  833    HB3  PHE 108          2HB       PHE 108   3.129  -2.684   4.507
  834    HD1  PHE 108           HD1      PHE 108   6.037  -4.804   3.991
  835    HD2  PHE 108           HD2      PHE 108   4.682  -1.048   5.468
  836    HE1  PHE 108           HE1      PHE 108   8.345  -3.969   3.979
  837    HE2  PHE 108           HE2      PHE 108   6.994  -0.208   5.453
  838    HZ   PHE 108           HZ       PHE 108   8.827  -1.670   4.704
  839    H    GLN 109           H        GLN 109   1.313  -2.642   6.269
  840    HA   GLN 109           HA       GLN 109   2.430  -0.660   7.968
  841    HB2  GLN 109          1HB       GLN 109   0.248   0.342   7.989
  842    HB3  GLN 109          2HB       GLN 109   0.606  -0.209   6.362
  843    HG2  GLN 109          1HG       GLN 109  -1.378  -1.180   6.371
  844    HG3  GLN 109          2HG       GLN 109  -0.735  -2.334   7.545
  845   HE21  GLN 109          1HE2      GLN 109  -2.734  -2.589   8.537
  846   HE22  GLN 109          2HE2      GLN 109  -3.449  -1.365   9.529
  847    H    LYS 110           H        LYS 110   1.168  -3.718   8.621
  848    HA   LYS 110           HA       LYS 110   0.074  -3.261  11.197
  849    HB2  LYS 110          1HB       LYS 110  -0.358  -5.269   9.807
  850    HB3  LYS 110          2HB       LYS 110   1.305  -5.774  10.055
  851    HG2  LYS 110          1HG       LYS 110   0.816  -5.798  12.507
  852    HG3  LYS 110          2HG       LYS 110  -0.874  -5.533  12.099
  853    HD2  LYS 110          1HD       LYS 110  -0.776  -7.581  10.669
  854    HD3  LYS 110          2HD       LYS 110   0.834  -7.886  11.323
  855    HE2  LYS 110          1HE       LYS 110  -0.794  -9.188  12.539
  856    HE3  LYS 110          2HE       LYS 110  -0.129  -7.942  13.592
  857    HZ1  LYS 110          1HZ       LYS 110  -2.742  -7.807  12.189
  858    HZ2  LYS 110          2HZ       LYS 110  -2.107  -6.608  13.197
  859    HZ3  LYS 110          3HZ       LYS 110  -2.518  -8.116  13.837
  860    H    ASN 111           H        ASN 111   3.296  -3.951   9.973
  861    HA   ASN 111           HA       ASN 111   4.297  -3.965  12.747
  862    HB2  ASN 111          1HB       ASN 111   5.596  -5.216  10.325
  863    HB3  ASN 111          2HB       ASN 111   6.120  -5.352  11.998
  864   HD21  ASN 111          1HD2      ASN 111   4.913  -6.623  13.441
  865   HD22  ASN 111          2HD2      ASN 111   3.808  -7.828  12.871
  866    H    ASN 112           H        ASN 112   4.539  -2.482   9.632
  867    HA   ASN 112           HA       ASN 112   6.723  -0.782  10.625
  868    HB2  ASN 112          1HB       ASN 112   6.565  -2.154   7.933
  869    HB3  ASN 112          2HB       ASN 112   7.678  -0.829   8.297
  870   HD21  ASN 112          1HD2      ASN 112   7.790  -3.907   7.780
  871   HD22  ASN 112          2HD2      ASN 112   8.940  -4.437   8.957
  872    H    LEU 113           H        LEU 113   4.480   0.356  10.981
  873    HA   LEU 113           HA       LEU 113   3.386   1.573   8.602
  874    HB2  LEU 113          1HB       LEU 113   1.826   1.001  10.312
  875    HB3  LEU 113          2HB       LEU 113   2.724   1.893  11.521
  876    HG   LEU 113           HG       LEU 113   2.148   3.995  10.294
  877   HD11  LEU 113          1HD1      LEU 113   0.266   2.224   8.754
  878   HD12  LEU 113          2HD1      LEU 113   1.765   2.885   8.102
  879   HD13  LEU 113          3HD1      LEU 113   0.460   3.968   8.598
  880   HD21  LEU 113          1HD2      LEU 113  -0.185   4.038  11.054
  881   HD22  LEU 113          2HD2      LEU 113   0.876   3.276  12.241
  882   HD23  LEU 113          3HD2      LEU 113  -0.157   2.281  11.214
  883    H    SER 114           H        SER 114   5.576   2.426  11.161
  884    HA   SER 114           HA       SER 114   5.515   5.234  10.831
  885    HB2  SER 114          1HB       SER 114   6.473   4.014  12.812
  886    HB3  SER 114          2HB       SER 114   7.846   3.562  11.803
  887    HG   SER 114           HG       SER 114   8.654   5.459  12.134
  888    H    LEU 115           H        LEU 115   7.321   2.659   9.270
  889    HA   LEU 115           HA       LEU 115   9.120   4.285   7.824
  890    HB2  LEU 115          1HB       LEU 115   9.378   1.852   8.203
  891    HB3  LEU 115          2HB       LEU 115   8.042   1.566   7.107
  892    HG   LEU 115           HG       LEU 115   9.355   2.582   5.274
  893   HD11  LEU 115          1HD1      LEU 115  10.768   4.075   6.469
  894   HD12  LEU 115          2HD1      LEU 115  11.805   2.876   5.692
  895   HD13  LEU 115          3HD1      LEU 115  11.450   2.757   7.415
  896   HD21  LEU 115          1HD2      LEU 115   9.371   0.153   5.657
  897   HD22  LEU 115          2HD2      LEU 115  10.782   0.338   6.698
  898   HD23  LEU 115          3HD2      LEU 115  10.894   0.731   4.983
  899    H    ILE 116           H        ILE 116   5.848   3.207   7.258
  900    HA   ILE 116           HA       ILE 116   5.665   3.981   4.543
  901    HB   ILE 116           HB       ILE 116   3.551   3.553   6.660
  902   HG12  ILE 116          1HG1      ILE 116   4.340   1.928   4.229
  903   HG13  ILE 116          2HG1      ILE 116   4.859   1.590   5.886
  904   HG21  ILE 116          1HG2      ILE 116   3.159   4.088   3.719
  905   HG22  ILE 116          2HG2      ILE 116   2.677   5.150   5.042
  906   HG23  ILE 116          3HG2      ILE 116   1.900   3.577   4.841
  907   HD11  ILE 116          1HD1      ILE 116   2.497   1.269   6.514
  908   HD12  ILE 116          2HD1      ILE 116   3.039   0.139   5.272
  909   HD13  ILE 116          3HD1      ILE 116   2.041   1.523   4.831
  910    H    LYS 117           H        LYS 117   4.965   5.581   7.594
  911    HA   LYS 117           HA       LYS 117   3.918   7.971   6.518
  912    HB2  LYS 117          1HB       LYS 117   5.182   7.331   9.176
  913    HB3  LYS 117          2HB       LYS 117   4.499   8.908   8.797
  914    HG2  LYS 117          1HG       LYS 117   2.317   7.887   8.426
  915    HG3  LYS 117          2HG       LYS 117   2.985   6.294   8.764
  916    HD2  LYS 117          1HD       LYS 117   3.432   6.898  11.045
  917    HD3  LYS 117          2HD       LYS 117   3.002   8.582  10.736
  918    HE2  LYS 117          1HE       LYS 117   1.104   6.252  10.478
  919    HE3  LYS 117          2HE       LYS 117   1.223   7.286  11.900
  920    HZ1  LYS 117          1HZ       LYS 117   0.598   9.176  10.547
  921    HZ2  LYS 117          2HZ       LYS 117  -0.580   7.969  10.439
  922    HZ3  LYS 117          3HZ       LYS 117   0.510   8.206   9.166
  923    H    ALA 118           H        ALA 118   7.177   6.980   7.478
  924    HA   ALA 118           HA       ALA 118   8.389   9.503   6.906
  925    HB1  ALA 118          1HB       ALA 118  10.491   8.306   7.186
  926    HB2  ALA 118          2HB       ALA 118   9.619   6.771   7.182
  927    HB3  ALA 118          3HB       ALA 118   9.359   7.930   8.484
  928    H    SER 119           H        SER 119   7.541   6.733   5.037
  929    HA   SER 119           HA       SER 119   9.333   6.983   2.900
  930    HB2  SER 119          1HB       SER 119   7.927   4.990   3.344
  931    HB3  SER 119          2HB       SER 119   6.505   5.906   2.853
  932    HG   SER 119           HG       SER 119   8.755   5.543   1.177
  933    H    ILE 120           H        ILE 120   6.093   8.337   3.380
  934    HA   ILE 120           HA       ILE 120   6.206   9.732   0.833
  935    HB   ILE 120           HB       ILE 120   3.951  10.602   1.542
  936   HG12  ILE 120          1HG1      ILE 120   4.255   8.595   3.777
  937   HG13  ILE 120          2HG1      ILE 120   4.398  10.336   3.994
  938   HG21  ILE 120          1HG2      ILE 120   4.341   7.621   1.490
  939   HG22  ILE 120          2HG2      ILE 120   4.175   8.679   0.088
  940   HG23  ILE 120          3HG2      ILE 120   2.819   8.459   1.193
  941   HD11  ILE 120          1HD1      ILE 120   2.105  10.636   3.305
  942   HD12  ILE 120          2HD1      ILE 120   2.200   9.487   4.637
  943   HD13  ILE 120          3HD1      ILE 120   1.950   8.911   2.990
  944    H    LYS 121           H        LYS 121   7.501  10.292   3.758
  945    HA   LYS 121           HA       LYS 121   6.801  13.086   4.033
  946    HB2  LYS 121          1HB       LYS 121   7.022  11.614   5.993
  947    HB3  LYS 121          2HB       LYS 121   8.717  11.360   5.606
  948    HG2  LYS 121          1HG       LYS 121   9.171  13.722   5.976
  949    HG3  LYS 121          2HG       LYS 121   7.462  14.002   6.312
  950    HD2  LYS 121          1HD       LYS 121   9.266  12.176   7.893
  951    HD3  LYS 121          2HD       LYS 121   8.806  13.810   8.368
  952    HE2  LYS 121          1HE       LYS 121   6.442  13.113   8.384
  953    HE3  LYS 121          2HE       LYS 121   6.940  11.473   7.973
  954    HZ1  LYS 121          1HZ       LYS 121   7.797  12.916  10.420
  955    HZ2  LYS 121          2HZ       LYS 121   8.105  11.299  10.037
  956    HZ3  LYS 121          3HZ       LYS 121   6.529  11.801  10.362
  957    H    LYS 122           H        LYS 122   7.860  14.637   3.007
  958    HA   LYS 122           HA       LYS 122  10.388  14.159   1.730
  959    HB2  LYS 122          1HB       LYS 122  10.211  16.523   1.038
  960    HB3  LYS 122          2HB       LYS 122   8.815  15.582   0.607
  961    HG2  LYS 122          1HG       LYS 122   7.564  16.524   2.468
  962    HG3  LYS 122          2HG       LYS 122   8.992  17.421   2.987
  963    HD2  LYS 122          1HD       LYS 122   8.980  18.626   0.834
  964    HD3  LYS 122          2HD       LYS 122   7.509  17.763   0.383
  965    HE2  LYS 122          1HE       LYS 122   7.800  19.569   2.779
  966    HE3  LYS 122          2HE       LYS 122   7.063  20.028   1.247
  967    HZ1  LYS 122          1HZ       LYS 122   5.316  18.490   1.572
  968    HZ2  LYS 122          2HZ       LYS 122   5.477  19.345   3.025
  969    HZ3  LYS 122          3HZ       LYS 122   6.085  17.774   2.902
  970    H    ASP 123           H        ASP 123  12.286  15.428   2.115
  971    HA   ASP 123           HA       ASP 123  12.695  15.931   4.961
  972    HB2  ASP 123          1HB       ASP 123  14.695  15.864   2.688
  973    HB3  ASP 123          2HB       ASP 123  15.092  16.064   4.389
  974    H21  ACD 201           H21      ACD   1  -4.456   4.713   1.433
  975    H22  ACD 201           H22      ACD   1  -3.272   4.722   2.747
  976    H31  ACD 201           H31      ACD   1  -1.922   6.400   1.436
  977    H32  ACD 201           H32      ACD   1  -3.063   6.232   0.103
  978    H41  ACD 201           H41      ACD   1  -2.540   3.784  -0.014
  979    H42  ACD 201           H42      ACD   1  -1.110   4.794  -0.292
  980    H5   ACD 201           H5       ACD   1  -1.636   3.028   2.147
  981    H6   ACD 201           H6       ACD   1   0.580   3.711   2.735
  982    H71  ACD 201           H71      ACD   1   0.931   5.052   0.172
  983    H72  ACD 201           H72      ACD   1   0.008   6.187   1.159
  984    H8   ACD 201           H8       ACD   1   1.920   6.500   2.686
  985    H9   ACD 201           H9       ACD   1   4.015   5.531   2.079
  986   H101  ACD 201          H101      ACD   1   2.916   4.726  -0.496
  987   H102  ACD 201          H102      ACD   1   2.463   3.441   0.625
  988    H11  ACD 201           H11      ACD   1   5.425   4.311   0.472
  989    H12  ACD 201           H12      ACD   1   5.730   1.978   0.134
  990   H131  ACD 201          H131      ACD   1   2.756   2.040  -0.551
  991   H132  ACD 201          H132      ACD   1   3.837   0.650  -0.663
  992    H14  ACD 201           H14      ACD   1   2.732   1.710   2.041
  993    H15  ACD 201           H15      ACD   1   2.599  -0.628   2.479
  994   H161  ACD 201          H161      ACD   1   2.780  -1.301  -0.332
  995   H162  ACD 201          H162      ACD   1   4.444  -0.939   0.136
  996   H171  ACD 201          H171      ACD   1   4.449  -2.648   1.831
  997   H172  ACD 201          H172      ACD   1   2.705  -2.877   1.696
  998   H181  ACD 201          H181      ACD   1   4.713  -3.460  -0.521
  999   H182  ACD 201          H182      ACD   1   2.971  -3.736  -0.608
 1000   H191  ACD 201          H191      ACD   1   4.926  -5.080   1.306
 1001   H192  ACD 201          H192      ACD   1   3.175  -5.284   1.384
 1002   H201  ACD 201          H201      ACD   1   4.202  -7.119   0.123
 1003   H202  ACD 201          H202      ACD   1   4.925  -5.998  -0.978
 1004   H203  ACD 201          H203      ACD   1   3.205  -6.174  -0.929