*HEADER    MEMBRANE PROTEIN                        29-OCT-20   7ATB              
*TITLE     TRANSMEMBRANE HELIX OF TUMOR NECROSIS FACTOR ALPHA IN TRIFLUORETHANOL,
*TITLE    2 AGALLL MUTANT                                                        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TUMOR NECROSIS FACTOR;                                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: CACHECTIN,TNF-ALPHA,TUMOR NECROSIS FACTOR LIGAND SUPERFAMILY
*COMPND   5 MEMBER 2,TNF-A;                                                      
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   4 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   5 ORGANISM_TAXID: 9606                                                 
*KEYWDS    TRANSMEMBRANE DOMAIN, HELIX, TRIFLUORETHANOL, MEMBRANE PROTEIN        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    N.GUSCHTSCHIN-SCHMIDT,C.MUHLE-GOLL                                    
*REVDAT   1   09-DEC-20 7ATB    0                                                
# Restraints file 1: noe_restraints.xml


  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  
    
    
      
        
        
      
      
        
        
        
        
      
      
    
    
      
      
      
      
      
    
  
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ARG  28           HT1      ARG  28  22.840   7.725   0.456
    2    H2   ARG  28           HT2      ARG  28  23.549   6.551   1.447
    3    H3   ARG  28           HT3      ARG  28  24.045   8.164   1.560
    4    HA   ARG  28           HA       ARG  28  22.629   7.597   3.407
    5    HB2  ARG  28           HB2      ARG  28  22.580   9.890   2.480
    6    HB3  ARG  28           HB1      ARG  28  21.260   9.420   1.417
    7    HG2  ARG  28           HG2      ARG  28  20.349  10.602   3.279
    8    HG3  ARG  28           HG1      ARG  28  19.897   8.903   3.428
    9    HD2  ARG  28           HD2      ARG  28  20.596   9.802   5.579
   10    HD3  ARG  28           HD1      ARG  28  21.720   8.561   5.025
   11    HE   ARG  28           HE       ARG  28  22.692  11.035   4.180
   12   HH11  ARG  28          HH11      ARG  28  22.119   9.314   7.156
   13   HH12  ARG  28          HH12      ARG  28  23.388  10.121   8.016
   14   HH21  ARG  28          HH21      ARG  28  24.362  12.100   5.303
   15   HH22  ARG  28          HH22      ARG  28  24.663  11.704   6.962
   16    H    ARG  29           HN       ARG  29  20.717   7.555   0.396
   17    HA   ARG  29           HA       ARG  29  18.483   6.265   1.514
   18    HB2  ARG  29           HB2      ARG  29  19.432   6.361  -1.353
   19    HB3  ARG  29           HB1      ARG  29  17.846   5.802  -0.844
   20    HG2  ARG  29           HG2      ARG  29  17.349   8.015   0.057
   21    HG3  ARG  29           HG1      ARG  29  18.945   8.578  -0.447
   22    HD2  ARG  29           HD2      ARG  29  18.379   8.128  -2.775
   23    HD3  ARG  29           HD1      ARG  29  16.797   7.523  -2.285
   24    HE   ARG  29           HE       ARG  29  17.090  10.127  -1.304
   25   HH11  ARG  29          HH11      ARG  29  16.783   8.458  -4.345
   26   HH12  ARG  29          HH12      ARG  29  16.023   9.791  -5.148
   27   HH21  ARG  29          HH21      ARG  29  16.094  11.889  -2.350
   28   HH22  ARG  29          HH22      ARG  29  15.631  11.743  -4.013
   29    H    CYS  30           HN       CYS  30  18.170   4.227   2.099
   30    HA   CYS  30           HA       CYS  30  20.184   2.230   1.422
   31    HB2  CYS  30           HB2      CYS  30  17.864   2.125   3.362
   32    HB3  CYS  30           HB1      CYS  30  19.056   0.848   3.143
   33    HG   CYS  30           HG       CYS  30  19.222   3.586   4.996
   34    H    LEU  31           HN       LEU  31  19.881   1.124  -0.389
   35    HA   LEU  31           HA       LEU  31  17.482   0.927  -1.807
   36    HB2  LEU  31           HB2      LEU  31  18.582  -0.688  -3.203
   37    HB3  LEU  31           HB1      LEU  31  19.721   0.578  -2.789
   38    HG   LEU  31           HG       LEU  31  19.651  -2.019  -1.273
   39   HD11  LEU  31          HD11      LEU  31  21.448  -2.813  -2.736
   40   HD12  LEU  31          HD12      LEU  31  21.230  -1.398  -3.766
   41   HD13  LEU  31          HD13      LEU  31  19.938  -2.590  -3.618
   42   HD21  LEU  31          HD21      LEU  31  22.021  -1.413  -0.859
   43   HD22  LEU  31          HD22      LEU  31  20.874  -0.244  -0.205
   44   HD23  LEU  31          HD23      LEU  31  21.741   0.113  -1.698
   45    H    PHE  32           HN       PHE  32  18.738  -0.981   0.808
   46    HA   PHE  32           HA       PHE  32  17.018  -3.232   0.384
   47    HB2  PHE  32           HB2      PHE  32  18.653  -2.373   2.777
   48    HB3  PHE  32           HB1      PHE  32  17.750  -3.882   2.694
   49    HD1  PHE  32           HD1      PHE  32  18.413  -5.633   1.093
   50    HD2  PHE  32           HD2      PHE  32  20.735  -2.113   1.663
   51    HE1  PHE  32           HE1      PHE  32  20.331  -6.727   0.007
   52    HE2  PHE  32           HE2      PHE  32  22.657  -3.199   0.578
   53    HZ   PHE  32           HZ       PHE  32  22.457  -5.510  -0.252
   54    H    LEU  33           HN       LEU  33  17.013  -0.491   2.651
   55    HA   LEU  33           HA       LEU  33  14.601  -1.212   3.941
   56    HB2  LEU  33           HB2      LEU  33  15.932   1.477   3.680
   57    HB3  LEU  33           HB1      LEU  33  14.601   1.120   4.763
   58    HG   LEU  33           HG       LEU  33  17.393  -0.018   4.900
   59   HD11  LEU  33          HD11      LEU  33  17.432   1.122   7.069
   60   HD12  LEU  33          HD12      LEU  33  15.833   1.784   6.734
   61   HD13  LEU  33          HD13      LEU  33  17.205   2.246   5.730
   62   HD21  LEU  33          HD21      LEU  33  16.621  -1.156   6.945
   63   HD22  LEU  33          HD22      LEU  33  15.811  -1.756   5.498
   64   HD23  LEU  33          HD23      LEU  33  14.970  -0.650   6.584
   65    H    SER  34           HN       SER  34  15.319   0.582   1.038
   66    HA   SER  34           HA       SER  34  12.800   1.836   0.721
   67    HB2  SER  34           HB2      SER  34  14.855   1.060  -1.366
   68    HB3  SER  34           HB1      SER  34  13.493   2.147  -1.638
   69    HG   SER  34           HG       SER  34  15.504   3.217  -1.144
   70    H    LEU  35           HN       LEU  35  14.126  -1.245  -0.373
   71    HA   LEU  35           HA       LEU  35  11.997  -2.044  -2.014
   72    HB2  LEU  35           HB2      LEU  35  14.292  -3.092  -1.825
   73    HB3  LEU  35           HB1      LEU  35  13.749  -3.851  -0.345
   74    HG   LEU  35           HG       LEU  35  13.736  -5.265  -2.464
   75   HD11  LEU  35          HD11      LEU  35  11.092  -5.094  -1.046
   76   HD12  LEU  35          HD12      LEU  35  12.543  -5.784  -0.321
   77   HD13  LEU  35          HD13      LEU  35  11.850  -6.512  -1.769
   78   HD21  LEU  35          HD21      LEU  35  11.800  -5.067  -3.914
   79   HD22  LEU  35          HD22      LEU  35  12.753  -3.584  -3.951
   80   HD23  LEU  35          HD23      LEU  35  11.254  -3.647  -3.024
   81    H    PHE  36           HN       PHE  36  12.499  -2.250   1.453
   82    HA   PHE  36           HA       PHE  36  10.226  -3.914   1.948
   83    HB2  PHE  36           HB2      PHE  36  12.213  -3.743   3.466
   84    HB3  PHE  36           HB1      PHE  36  11.686  -2.120   3.896
   85    HD1  PHE  36           HD1      PHE  36  10.776  -5.692   4.040
   86    HD2  PHE  36           HD2      PHE  36   9.982  -1.771   5.488
   87    HE1  PHE  36           HE1      PHE  36   9.335  -6.638   5.796
   88    HE2  PHE  36           HE2      PHE  36   8.540  -2.709   7.247
   89    HZ   PHE  36           HZ       PHE  36   8.215  -5.144   7.402
   90    H    SER  37           HN       SER  37  10.701  -0.576   1.361
   91    HA   SER  37           HA       SER  37   8.391   0.382   2.755
   92    HB2  SER  37           HB2      SER  37  10.017   1.668   0.548
   93    HB3  SER  37           HB1      SER  37   8.800   2.486   1.527
   94    HG   SER  37           HG       SER  37  10.411   2.869   2.817
   95    H    PHE  38           HN       PHE  38   9.080  -0.682  -0.530
   96    HA   PHE  38           HA       PHE  38   6.677   0.190  -1.720
   97    HB2  PHE  38           HB2      PHE  38   8.468  -2.127  -2.450
   98    HB3  PHE  38           HB1      PHE  38   7.178  -1.502  -3.470
   99    HD1  PHE  38           HD1      PHE  38   7.338   1.122  -3.897
  100    HD2  PHE  38           HD2      PHE  38  10.600  -1.410  -2.874
  101    HE1  PHE  38           HE1      PHE  38   8.901   2.740  -4.891
  102    HE2  PHE  38           HE2      PHE  38  12.170   0.205  -3.861
  103    HZ   PHE  38           HZ       PHE  38  11.321   2.284  -4.873
  104    H    LEU  39           HN       LEU  39   7.459  -2.545   0.267
  105    HA   LEU  39           HA       LEU  39   5.147  -4.083  -0.420
  106    HB2  LEU  39           HB2      LEU  39   7.321  -4.959   0.564
  107    HB3  LEU  39           HB1      LEU  39   6.778  -4.321   2.104
  108    HG   LEU  39           HG       LEU  39   4.983  -6.172   0.618
  109   HD11  LEU  39          HD11      LEU  39   7.382  -7.046   2.222
  110   HD12  LEU  39          HD12      LEU  39   7.131  -7.294   0.495
  111   HD13  LEU  39          HD13      LEU  39   6.086  -8.103   1.662
  112   HD21  LEU  39          HD21      LEU  39   4.383  -6.855   2.895
  113   HD22  LEU  39          HD22      LEU  39   4.201  -5.116   2.669
  114   HD23  LEU  39          HD23      LEU  39   5.596  -5.749   3.541
  115    H    ILE  40           HN       ILE  40   5.933  -1.636   1.941
  116    HA   ILE  40           HA       ILE  40   3.548  -2.011   3.498
  117    HB   ILE  40           HB       ILE  40   5.462   0.328   3.448
  118   HG12  ILE  40          HG12      ILE  40   5.300  -1.988   5.389
  119   HG13  ILE  40          HG11      ILE  40   6.479  -1.862   4.087
  120   HG21  ILE  40          HG21      ILE  40   4.497   0.878   5.642
  121   HG22  ILE  40          HG22      ILE  40   3.330  -0.428   5.444
  122   HG23  ILE  40          HG23      ILE  40   3.298   0.956   4.351
  123   HD11  ILE  40          HD11      ILE  40   7.397   0.149   5.105
  124   HD12  ILE  40          HD12      ILE  40   7.430  -1.211   6.228
  125   HD13  ILE  40          HD13      ILE  40   6.203   0.046   6.399
  126    H    VAL  41           HN       VAL  41   4.610   0.159   0.920
  127    HA   VAL  41           HA       VAL  41   2.366   1.878   1.006
  128    HB   VAL  41           HB       VAL  41   4.588   2.343  -0.134
  129   HG11  VAL  41          HG11      VAL  41   3.300   0.731  -2.324
  130   HG12  VAL  41          HG12      VAL  41   4.750   0.301  -1.421
  131   HG13  VAL  41          HG13      VAL  41   4.763   1.704  -2.487
  132   HG21  VAL  41          HG21      VAL  41   2.014   2.877  -1.614
  133   HG22  VAL  41          HG22      VAL  41   3.535   3.726  -1.892
  134   HG23  VAL  41          HG23      VAL  41   2.722   3.862  -0.333
  135    H    LEU  42           HN       LEU  42   2.966  -1.201  -0.522
  136    HA   LEU  42           HA       LEU  42   0.618  -1.066  -2.194
  137    HB2  LEU  42           HB2      LEU  42   2.736  -2.337  -2.747
  138    HB3  LEU  42           HB1      LEU  42   2.260  -3.504  -1.519
  139    HG   LEU  42           HG       LEU  42   0.375  -2.863  -3.758
  140   HD11  LEU  42          HD11      LEU  42   2.675  -4.806  -3.905
  141   HD12  LEU  42          HD12      LEU  42   2.493  -3.331  -4.855
  142   HD13  LEU  42          HD13      LEU  42   1.365  -4.668  -5.078
  143   HD21  LEU  42          HD21      LEU  42  -0.454  -4.217  -1.926
  144   HD22  LEU  42          HD22      LEU  42   0.910  -5.322  -2.094
  145   HD23  LEU  42          HD23      LEU  42  -0.292  -5.204  -3.378
  146    H    LEU  43           HN       LEU  43   1.593  -2.807   0.742
  147    HA   LEU  43           HA       LEU  43  -0.740  -4.280   1.130
  148    HB2  LEU  43           HB2      LEU  43   1.334  -4.648   2.385
  149    HB3  LEU  43           HB1      LEU  43   1.115  -3.115   3.208
  150    HG   LEU  43           HG       LEU  43  -1.007  -4.020   4.185
  151   HD11  LEU  43          HD11      LEU  43  -1.355  -6.435   4.146
  152   HD12  LEU  43          HD12      LEU  43  -0.002  -6.617   3.029
  153   HD13  LEU  43          HD13      LEU  43  -1.451  -5.747   2.525
  154   HD21  LEU  43          HD21      LEU  43   0.117  -5.426   5.845
  155   HD22  LEU  43          HD22      LEU  43   1.058  -3.983   5.468
  156   HD23  LEU  43          HD23      LEU  43   1.525  -5.542   4.788
  157    H    LEU  44           HN       LEU  44  -0.026  -0.926   1.816
  158    HA   LEU  44           HA       LEU  44  -2.351  -0.503   3.443
  159    HB2  LEU  44           HB2      LEU  44  -0.407   1.385   2.129
  160    HB3  LEU  44           HB1      LEU  44  -1.773   1.937   3.080
  161    HG   LEU  44           HG       LEU  44   0.466   0.200   4.125
  162   HD11  LEU  44          HD11      LEU  44   1.175   2.209   5.328
  163   HD12  LEU  44          HD12      LEU  44  -0.073   3.141   4.500
  164   HD13  LEU  44          HD13      LEU  44   1.256   2.433   3.581
  165   HD21  LEU  44          HD21      LEU  44  -1.808   1.581   5.547
  166   HD22  LEU  44          HD22      LEU  44  -0.494   0.693   6.319
  167   HD23  LEU  44          HD23      LEU  44  -1.648  -0.157   5.292
  168    H    THR  45           HN       THR  45  -1.452   0.299   0.095
  169    HA   THR  45           HA       THR  45  -3.810   1.633  -0.599
  170    HB   THR  45           HB       THR  45  -3.232   0.853  -2.980
  171    HG1  THR  45           HG1      THR  45  -0.671   0.301  -2.364
  172   HG21  THR  45          HG21      THR  45  -1.177   2.367  -1.365
  173   HG22  THR  45          HG22      THR  45  -2.634   3.051  -2.090
  174   HG23  THR  45          HG23      THR  45  -1.350   2.415  -3.119
  175    H    THR  46           HN       THR  46  -3.200  -1.729  -0.134
  176    HA   THR  46           HA       THR  46  -5.288  -2.758  -1.756
  177    HB   THR  46           HB       THR  46  -4.054  -4.007   0.707
  178    HG1  THR  46           HG1      THR  46  -3.088  -3.571  -1.806
  179   HG21  THR  46          HG21      THR  46  -4.830  -6.114  -0.195
  180   HG22  THR  46          HG22      THR  46  -5.485  -5.303  -1.617
  181   HG23  THR  46          HG23      THR  46  -6.203  -5.017  -0.031
  182    H    LEU  47           HN       LEU  47  -5.090  -2.190   1.760
  183    HA   LEU  47           HA       LEU  47  -7.886  -2.763   2.127
  184    HB2  LEU  47           HB2      LEU  47  -5.892  -1.567   4.050
  185    HB3  LEU  47           HB1      LEU  47  -7.479  -2.184   4.467
  186    HG   LEU  47           HG       LEU  47  -5.222  -3.855   3.355
  187   HD11  LEU  47          HD11      LEU  47  -5.059  -4.773   5.615
  188   HD12  LEU  47          HD12      LEU  47  -6.267  -3.616   6.173
  189   HD13  LEU  47          HD13      LEU  47  -4.703  -3.046   5.590
  190   HD21  LEU  47          HD21      LEU  47  -6.638  -5.747   4.009
  191   HD22  LEU  47          HD22      LEU  47  -7.415  -4.739   2.789
  192   HD23  LEU  47          HD23      LEU  47  -7.914  -4.624   4.477
  193    H    PHE  48           HN       PHE  48  -5.861   0.150   2.340
  194    HA   PHE  48           HA       PHE  48  -7.764   1.993   3.098
  195    HB2  PHE  48           HB2      PHE  48  -5.378   2.519   2.935
  196    HB3  PHE  48           HB1      PHE  48  -5.461   2.413   1.181
  197    HD1  PHE  48           HD1      PHE  48  -5.992   4.289  -0.091
  198    HD2  PHE  48           HD2      PHE  48  -6.796   4.296   4.087
  199    HE1  PHE  48           HE1      PHE  48  -6.554   6.682  -0.208
  200    HE2  PHE  48           HE2      PHE  48  -7.358   6.688   3.979
  201    HZ   PHE  48           HZ       PHE  48  -7.239   7.885   1.830
  202    H    CYS  49           HN       CYS  49  -7.222   0.592  -0.077
  203    HA   CYS  49           HA       CYS  49  -8.911   2.428  -1.468
  204    HB2  CYS  49           HB2      CYS  49  -7.159   1.174  -2.637
  205    HB3  CYS  49           HB1      CYS  49  -7.981  -0.338  -2.264
  206    HG   CYS  49           HG       CYS  49  -9.008   2.109  -4.414
  207    H    LEU  50           HN       LEU  50  -9.363  -0.686   0.091
  208    HA   LEU  50           HA       LEU  50 -12.009  -1.116  -0.895
  209    HB2  LEU  50           HB2      LEU  50 -10.666  -2.301   1.540
  210    HB3  LEU  50           HB1      LEU  50 -12.112  -2.916   0.746
  211    HG   LEU  50           HG       LEU  50  -9.490  -2.716  -0.715
  212   HD11  LEU  50          HD11      LEU  50 -10.458  -5.163   0.745
  213   HD12  LEU  50          HD12      LEU  50  -9.258  -4.052   1.406
  214   HD13  LEU  50          HD13      LEU  50  -8.919  -4.929  -0.086
  215   HD21  LEU  50          HD21      LEU  50 -11.483  -3.032  -2.069
  216   HD22  LEU  50          HD22      LEU  50 -11.951  -4.420  -1.086
  217   HD23  LEU  50          HD23      LEU  50 -10.494  -4.492  -2.077
  218    H    LEU  51           HN       LEU  51 -10.623   0.604   1.776
  219    HA   LEU  51           HA       LEU  51 -13.080   0.828   3.262
  220    HB2  LEU  51           HB2      LEU  51 -10.464   2.313   3.536
  221    HB3  LEU  51           HB1      LEU  51 -11.796   2.397   4.674
  222    HG   LEU  51           HG       LEU  51 -10.241  -0.113   4.034
  223   HD11  LEU  51          HD11      LEU  51  -8.846   1.519   5.183
  224   HD12  LEU  51          HD12      LEU  51  -9.246   0.171   6.247
  225   HD13  LEU  51          HD13      LEU  51 -10.080   1.714   6.427
  226   HD21  LEU  51          HD21      LEU  51 -12.530  -0.554   4.742
  227   HD22  LEU  51          HD22      LEU  51 -12.302   0.472   6.158
  228   HD23  LEU  51          HD23      LEU  51 -11.383  -1.024   5.996
  229    H    HIS  52           HN       HIS  52 -11.245   2.810   1.007
  230    HA   HIS  52           HA       HIS  52 -12.914   5.124   1.341
  231    HB2  HIS  52           HB2      HIS  52 -10.588   5.407   0.702
  232    HB3  HIS  52           HB1      HIS  52 -10.835   4.440  -0.747
  233    HD1  HIS  52           HD1      HIS  52 -11.532   7.829   0.694
  234    HD2  HIS  52           HD2      HIS  52 -11.999   5.784  -2.893
  235    HE1  HIS  52           HE1      HIS  52 -12.145   9.581  -1.003
  236    HE2  HIS  52           HE2      HIS  52 -12.371   8.329  -3.178
  237    H    PHE  53           HN       PHE  53 -12.439   2.769  -1.291
  238    HA   PHE  53           HA       PHE  53 -14.417   3.772  -2.994
  239    HB2  PHE  53           HB2      PHE  53 -12.610   2.084  -3.552
  240    HB3  PHE  53           HB1      PHE  53 -13.625   0.866  -2.786
  241    HD1  PHE  53           HD1      PHE  53 -15.715   0.165  -3.809
  242    HD2  PHE  53           HD2      PHE  53 -13.190   3.033  -5.681
  243    HE1  PHE  53           HE1      PHE  53 -16.934  -0.148  -5.922
  244    HE2  PHE  53           HE2      PHE  53 -14.405   2.726  -7.798
  245    HZ   PHE  53           HZ       PHE  53 -16.281   1.136  -7.920
  246    H    GLY  54           HN       GLY  54 -14.657   1.806  -0.145
  247    HA2  GLY  54           HA2      GLY  54 -16.505   1.134   1.052
  248    HA3  GLY  54           HA1      GLY  54 -17.477   2.141  -0.009
  249    H    VAL  55           HN       VAL  55 -15.429  -0.374  -1.261
  250    HA   VAL  55           HA       VAL  55 -17.147  -1.588  -2.945
  251    HB   VAL  55           HB       VAL  55 -15.436  -3.442  -1.358
  252   HG11  VAL  55          HG11      VAL  55 -14.886  -4.294  -3.593
  253   HG12  VAL  55          HG12      VAL  55 -15.893  -3.034  -4.309
  254   HG13  VAL  55          HG13      VAL  55 -16.625  -4.279  -3.295
  255   HG21  VAL  55          HG21      VAL  55 -14.054  -1.471  -1.411
  256   HG22  VAL  55          HG22      VAL  55 -14.354  -1.262  -3.138
  257   HG23  VAL  55          HG23      VAL  55 -13.426  -2.648  -2.564
  258    H    ILE  56           HN       ILE  56 -16.457  -3.188   0.134
  259    HA   ILE  56           HA       ILE  56 -19.299  -3.630   0.599
  260    HB   ILE  56           HB       ILE  56 -18.494  -6.106   1.176
  261   HG12  ILE  56          HG12      ILE  56 -17.098  -6.925  -0.748
  262   HG13  ILE  56          HG11      ILE  56 -16.770  -5.243  -1.152
  263   HG21  ILE  56          HG21      ILE  56 -19.491  -6.812  -0.958
  264   HG22  ILE  56          HG22      ILE  56 -19.377  -5.152  -1.544
  265   HG23  ILE  56          HG23      ILE  56 -20.422  -5.534  -0.175
  266   HD11  ILE  56          HD11      ILE  56 -14.939  -6.219   0.100
  267   HD12  ILE  56          HD12      ILE  56 -16.037  -6.620   1.422
  268   HD13  ILE  56          HD13      ILE  56 -15.712  -4.932   1.026
  269    H    GLY  57           HN       GLY  57 -16.552  -2.571   1.776
  270    HA2  GLY  57           HA2      GLY  57 -17.271  -3.262   4.527
  271    HA3  GLY  57           HA1      GLY  57 -15.628  -3.596   3.997
  272    HA   PRO  58           HA       PRO  58 -15.904   1.173   3.919
  273    HB2  PRO  58           HB2      PRO  58 -18.209   2.417   4.515
  274    HB3  PRO  58           HB1      PRO  58 -17.875   1.803   2.891
  275    HG2  PRO  58           HG2      PRO  58 -19.534   0.596   5.070
  276    HG3  PRO  58           HG1      PRO  58 -19.876   0.705   3.335
  277    HD2  PRO  58           HD2      PRO  58 -18.899  -1.542   4.552
  278    HD3  PRO  58           HD1      PRO  58 -18.612  -1.143   2.847
  279    H    GLN  59           HN       GLN  59 -14.803   0.198   5.920
  280    HA   GLN  59           HA       GLN  59 -16.096   0.872   8.437
  281    HB2  GLN  59           HB2      GLN  59 -13.375  -0.325   7.874
  282    HB3  GLN  59           HB1      GLN  59 -14.071  -0.103   9.473
  283    HG2  GLN  59           HG2      GLN  59 -15.921  -1.613   8.827
  284    HG3  GLN  59           HG1      GLN  59 -15.102  -1.899   7.291
  285   HE21  GLN  59          HE21      GLN  59 -14.821  -4.080   7.670
  286   HE22  GLN  59          HE22      GLN  59 -13.705  -4.688   8.841
  287    H    ARG  60           HN       ARG  60 -15.774   3.128   6.965
  288    HA   ARG  60           HA       ARG  60 -13.309   4.469   7.513
  289    HB2  ARG  60           HB2      ARG  60 -14.761   5.038   5.587
  290    HB3  ARG  60           HB1      ARG  60 -15.979   5.637   6.706
  291    HG2  ARG  60           HG2      ARG  60 -14.315   7.296   7.527
  292    HG3  ARG  60           HG1      ARG  60 -13.222   6.755   6.252
  293    HD2  ARG  60           HD2      ARG  60 -15.945   8.000   5.902
  294    HD3  ARG  60           HD1      ARG  60 -14.388   8.734   5.520
  295    HE   ARG  60           HE       ARG  60 -14.680   6.324   4.090
  296   HH11  ARG  60          HH11      ARG  60 -15.899   9.587   4.181
  297   HH12  ARG  60          HH12      ARG  60 -16.277   9.630   2.491
  298   HH21  ARG  60          HH21      ARG  60 -15.176   6.371   1.866
  299   HH22  ARG  60          HH22      ARG  60 -15.867   7.802   1.175
  Start of MODEL    2
    1    H1   ARG  28           HT1      ARG  28  23.832  -3.135  -7.454
    2    H2   ARG  28           HT2      ARG  28  24.447  -3.373  -9.012
    3    H3   ARG  28           HT3      ARG  28  22.836  -2.905  -8.802
    4    HA   ARG  28           HA       ARG  28  25.191  -1.278  -8.047
    5    HB2  ARG  28           HB2      ARG  28  24.904  -1.587 -10.505
    6    HB3  ARG  28           HB1      ARG  28  23.285  -0.918 -10.369
    7    HG2  ARG  28           HG2      ARG  28  25.559   0.692  -9.340
    8    HG3  ARG  28           HG1      ARG  28  25.342   0.561 -11.086
    9    HD2  ARG  28           HD2      ARG  28  23.350   1.587  -9.070
   10    HD3  ARG  28           HD1      ARG  28  24.192   2.519 -10.306
   11    HE   ARG  28           HE       ARG  28  22.713   0.441 -11.512
   12   HH11  ARG  28          HH11      ARG  28  22.285   3.507  -9.912
   13   HH12  ARG  28          HH12      ARG  28  20.804   3.874 -10.731
   14   HH21  ARG  28          HH21      ARG  28  20.763   0.914 -12.593
   15   HH22  ARG  28          HH22      ARG  28  19.938   2.399 -12.254
   16    H    ARG  29           HN       ARG  29  21.697  -1.628  -8.291
   17    HA   ARG  29           HA       ARG  29  21.404   0.726  -6.540
   18    HB2  ARG  29           HB2      ARG  29  20.431   1.062  -8.786
   19    HB3  ARG  29           HB1      ARG  29  19.412  -0.350  -8.545
   20    HG2  ARG  29           HG2      ARG  29  18.329   0.775  -6.648
   21    HG3  ARG  29           HG1      ARG  29  19.324   2.202  -6.949
   22    HD2  ARG  29           HD2      ARG  29  17.136   2.501  -7.935
   23    HD3  ARG  29           HD1      ARG  29  18.353   2.375  -9.204
   24    HE   ARG  29           HE       ARG  29  17.145  -0.142  -8.596
   25   HH11  ARG  29          HH11      ARG  29  16.728   2.825 -10.376
   26   HH12  ARG  29          HH12      ARG  29  15.675   2.119 -11.556
   27   HH21  ARG  29          HH21      ARG  29  15.762  -1.079 -10.147
   28   HH22  ARG  29          HH22      ARG  29  15.127  -0.100 -11.427
   29    H    CYS  30           HN       CYS  30  20.270   0.499  -4.677
   30    HA   CYS  30           HA       CYS  30  19.771  -2.136  -3.709
   31    HB2  CYS  30           HB2      CYS  30  19.028   0.543  -2.513
   32    HB3  CYS  30           HB1      CYS  30  18.976  -1.001  -1.670
   33    HG   CYS  30           HG       CYS  30  21.972  -0.779  -2.845
   34    H    LEU  31           HN       LEU  31  18.207  -3.071  -5.018
   35    HA   LEU  31           HA       LEU  31  15.648  -1.791  -5.400
   36    HB2  LEU  31           HB2      LEU  31  16.685  -3.216  -7.137
   37    HB3  LEU  31           HB1      LEU  31  16.530  -4.599  -6.071
   38    HG   LEU  31           HG       LEU  31  14.043  -4.261  -6.115
   39   HD11  LEU  31          HD11      LEU  31  13.116  -2.895  -7.926
   40   HD12  LEU  31          HD12      LEU  31  14.737  -2.313  -8.308
   41   HD13  LEU  31          HD13      LEU  31  14.002  -1.919  -6.754
   42   HD21  LEU  31          HD21      LEU  31  13.762  -5.215  -8.361
   43   HD22  LEU  31          HD22      LEU  31  15.104  -5.957  -7.489
   44   HD23  LEU  31          HD23      LEU  31  15.422  -4.765  -8.749
   45    H    PHE  32           HN       PHE  32  17.064  -4.070  -3.212
   46    HA   PHE  32           HA       PHE  32  14.544  -5.094  -2.254
   47    HB2  PHE  32           HB2      PHE  32  16.705  -6.405  -2.273
   48    HB3  PHE  32           HB1      PHE  32  17.259  -5.372  -0.958
   49    HD1  PHE  32           HD1      PHE  32  16.195  -5.495   1.249
   50    HD2  PHE  32           HD2      PHE  32  15.099  -8.128  -1.911
   51    HE1  PHE  32           HE1      PHE  32  15.100  -6.984   2.874
   52    HE2  PHE  32           HE2      PHE  32  14.002  -9.620  -0.292
   53    HZ   PHE  32           HZ       PHE  32  14.001  -9.048   2.103
   54    H    LEU  33           HN       LEU  33  17.010  -2.819  -1.124
   55    HA   LEU  33           HA       LEU  33  15.843  -2.297   1.391
   56    HB2  LEU  33           HB2      LEU  33  17.638  -0.560  -0.294
   57    HB3  LEU  33           HB1      LEU  33  17.251  -0.271   1.392
   58    HG   LEU  33           HG       LEU  33  18.863  -2.546   0.247
   59   HD11  LEU  33          HD11      LEU  33  19.509  -0.363   2.213
   60   HD12  LEU  33          HD12      LEU  33  20.051  -0.448   0.538
   61   HD13  LEU  33          HD13      LEU  33  20.603  -1.648   1.707
   62   HD21  LEU  33          HD21      LEU  33  19.082  -3.361   2.555
   63   HD22  LEU  33          HD22      LEU  33  17.418  -3.451   1.979
   64   HD23  LEU  33          HD23      LEU  33  17.900  -2.161   3.081
   65    H    SER  34           HN       SER  34  15.475  -0.765  -1.771
   66    HA   SER  34           HA       SER  34  13.821   1.360  -0.842
   67    HB2  SER  34           HB2      SER  34  14.129   0.219  -3.630
   68    HB3  SER  34           HB1      SER  34  13.351   1.751  -3.232
   69    HG   SER  34           HG       SER  34  15.362   2.463  -2.403
   70    H    LEU  35           HN       LEU  35  13.222  -1.870  -2.083
   71    HA   LEU  35           HA       LEU  35  10.399  -1.565  -2.361
   72    HB2  LEU  35           HB2      LEU  35  11.677  -3.255  -3.595
   73    HB3  LEU  35           HB1      LEU  35  12.068  -4.062  -2.088
   74    HG   LEU  35           HG       LEU  35   9.646  -4.507  -1.743
   75   HD11  LEU  35          HD11      LEU  35   8.122  -4.235  -3.639
   76   HD12  LEU  35          HD12      LEU  35   9.391  -3.399  -4.536
   77   HD13  LEU  35          HD13      LEU  35   8.731  -2.684  -3.064
   78   HD21  LEU  35          HD21      LEU  35  11.098  -6.193  -2.720
   79   HD22  LEU  35          HD22      LEU  35  10.814  -5.524  -4.327
   80   HD23  LEU  35          HD23      LEU  35   9.487  -6.266  -3.433
   81    H    PHE  36           HN       PHE  36  12.477  -2.076   0.299
   82    HA   PHE  36           HA       PHE  36  10.825  -3.568   2.009
   83    HB2  PHE  36           HB2      PHE  36  13.276  -3.037   2.344
   84    HB3  PHE  36           HB1      PHE  36  12.780  -1.432   2.871
   85    HD1  PHE  36           HD1      PHE  36  12.693  -5.018   3.676
   86    HD2  PHE  36           HD2      PHE  36  11.842  -1.075   5.032
   87    HE1  PHE  36           HE1      PHE  36  12.379  -5.875   5.959
   88    HE2  PHE  36           HE2      PHE  36  11.527  -1.925   7.320
   89    HZ   PHE  36           HZ       PHE  36  11.796  -4.329   7.785
   90    H    SER  37           HN       SER  37  10.623  -0.311   0.943
   91    HA   SER  37           HA       SER  37   8.826   0.432   3.132
   92    HB2  SER  37           HB2      SER  37   8.954   2.716   2.152
   93    HB3  SER  37           HB1      SER  37  10.533   2.071   2.603
   94    HG   SER  37           HG       SER  37   9.483   1.878  -0.021
   95    H    PHE  38           HN       PHE  38   8.888   0.339  -0.423
   96    HA   PHE  38           HA       PHE  38   6.302   1.184  -0.930
   97    HB2  PHE  38           HB2      PHE  38   7.939  -0.867  -2.433
   98    HB3  PHE  38           HB1      PHE  38   6.474  -0.110  -3.049
   99    HD1  PHE  38           HD1      PHE  38   6.632   2.625  -2.640
  100    HD2  PHE  38           HD2      PHE  38   9.850  -0.056  -3.389
  101    HE1  PHE  38           HE1      PHE  38   7.968   4.486  -3.538
  102    HE2  PHE  38           HE2      PHE  38  11.193   1.800  -4.287
  103    HZ   PHE  38           HZ       PHE  38  10.255   4.071  -4.367
  104    H    LEU  39           HN       LEU  39   7.461  -2.022  -0.035
  105    HA   LEU  39           HA       LEU  39   5.104  -3.454  -0.535
  106    HB2  LEU  39           HB2      LEU  39   7.419  -4.355  -0.015
  107    HB3  LEU  39           HB1      LEU  39   7.060  -4.059   1.675
  108    HG   LEU  39           HG       LEU  39   5.195  -5.739   0.053
  109   HD11  LEU  39          HD11      LEU  39   7.740  -6.729   1.330
  110   HD12  LEU  39          HD12      LEU  39   7.428  -6.631  -0.403
  111   HD13  LEU  39          HD13      LEU  39   6.482  -7.728   0.603
  112   HD21  LEU  39          HD21      LEU  39   4.518  -5.109   2.292
  113   HD22  LEU  39          HD22      LEU  39   6.035  -5.723   2.949
  114   HD23  LEU  39          HD23      LEU  39   4.869  -6.835   2.231
  115    H    ILE  40           HN       ILE  40   6.249  -1.883   2.446
  116    HA   ILE  40           HA       ILE  40   4.081  -2.622   4.069
  117    HB   ILE  40           HB       ILE  40   5.776  -0.130   4.295
  118   HG12  ILE  40          HG12      ILE  40   6.153  -2.844   5.585
  119   HG13  ILE  40          HG11      ILE  40   7.086  -2.247   4.215
  120   HG21  ILE  40          HG21      ILE  40   3.726  -0.045   5.630
  121   HG22  ILE  40          HG22      ILE  40   5.156  -0.175   6.655
  122   HG23  ILE  40          HG23      ILE  40   4.144  -1.591   6.370
  123   HD11  ILE  40          HD11      ILE  40   7.021  -1.047   6.973
  124   HD12  ILE  40          HD12      ILE  40   7.942  -0.426   5.603
  125   HD13  ILE  40          HD13      ILE  40   8.326  -2.010   6.280
  126    H    VAL  41           HN       VAL  41   4.543   0.090   1.874
  127    HA   VAL  41           HA       VAL  41   2.197   1.504   2.674
  128    HB   VAL  41           HB       VAL  41   3.748   1.718   0.088
  129   HG11  VAL  41          HG11      VAL  41   2.757   3.955  -0.064
  130   HG12  VAL  41          HG12      VAL  41   1.812   3.633   1.390
  131   HG13  VAL  41          HG13      VAL  41   1.522   2.697  -0.076
  132   HG21  VAL  41          HG21      VAL  41   4.009   3.308   2.637
  133   HG22  VAL  41          HG22      VAL  41   4.898   3.588   1.140
  134   HG23  VAL  41          HG23      VAL  41   5.154   2.102   2.052
  135    H    LEU  42           HN       LEU  42   2.922  -0.895   0.204
  136    HA   LEU  42           HA       LEU  42   0.509  -0.626  -1.243
  137    HB2  LEU  42           HB2      LEU  42   2.504  -2.871  -1.015
  138    HB3  LEU  42           HB1      LEU  42   1.087  -2.967  -2.054
  139    HG   LEU  42           HG       LEU  42   3.216  -0.839  -2.297
  140   HD11  LEU  42          HD11      LEU  42   4.143  -3.047  -2.773
  141   HD12  LEU  42          HD12      LEU  42   4.001  -2.081  -4.242
  142   HD13  LEU  42          HD13      LEU  42   2.829  -3.357  -3.908
  143   HD21  LEU  42          HD21      LEU  42   2.178  -0.403  -4.457
  144   HD22  LEU  42          HD22      LEU  42   1.013  -0.195  -3.150
  145   HD23  LEU  42          HD23      LEU  42   0.972  -1.650  -4.143
  146    H    LEU  43           HN       LEU  43   1.514  -2.955   1.258
  147    HA   LEU  43           HA       LEU  43  -0.775  -4.501   1.357
  148    HB2  LEU  43           HB2      LEU  43   1.378  -3.829   3.279
  149    HB3  LEU  43           HB1      LEU  43  -0.077  -4.539   3.948
  150    HG   LEU  43           HG       LEU  43   1.670  -6.212   3.478
  151   HD11  LEU  43          HD11      LEU  43  -0.665  -6.883   3.471
  152   HD12  LEU  43          HD12      LEU  43   0.250  -7.795   2.271
  153   HD13  LEU  43          HD13      LEU  43  -0.793  -6.467   1.761
  154   HD21  LEU  43          HD21      LEU  43   1.247  -5.420   0.599
  155   HD22  LEU  43          HD22      LEU  43   2.193  -6.798   1.158
  156   HD23  LEU  43          HD23      LEU  43   2.710  -5.158   1.548
  157    H    LEU  44           HN       LEU  44  -0.169  -1.361   2.841
  158    HA   LEU  44           HA       LEU  44  -2.603  -1.375   4.360
  159    HB2  LEU  44           HB2      LEU  44  -0.720   0.867   3.636
  160    HB3  LEU  44           HB1      LEU  44  -2.095   1.042   4.710
  161    HG   LEU  44           HG       LEU  44   0.331  -0.690   5.192
  162   HD11  LEU  44          HD11      LEU  44   0.725   0.884   7.045
  163   HD12  LEU  44          HD12      LEU  44  -0.631   1.860   6.478
  164   HD13  LEU  44          HD13      LEU  44   0.799   1.664   5.465
  165   HD21  LEU  44          HD21      LEU  44  -1.637  -1.751   6.122
  166   HD22  LEU  44          HD22      LEU  44  -2.126  -0.237   6.884
  167   HD23  LEU  44          HD23      LEU  44  -0.662  -1.060   7.421
  168    H    THR  45           HN       THR  45  -1.530   0.261   1.392
  169    HA   THR  45           HA       THR  45  -3.890   1.676   0.894
  170    HB   THR  45           HB       THR  45  -3.137   1.724  -1.491
  171    HG1  THR  45           HG1      THR  45  -0.810   0.369  -0.624
  172   HG21  THR  45          HG21      THR  45  -1.064   2.352   0.611
  173   HG22  THR  45          HG22      THR  45  -2.354   3.418   0.058
  174   HG23  THR  45          HG23      THR  45  -1.050   2.970  -1.039
  175    H    THR  46           HN       THR  46  -3.156  -1.678   0.488
  176    HA   THR  46           HA       THR  46  -4.975  -2.365  -1.526
  177    HB   THR  46           HB       THR  46  -4.177  -4.059   0.850
  178    HG1  THR  46           HG1      THR  46  -2.968  -4.529  -1.572
  179   HG21  THR  46          HG21      THR  46  -4.735  -5.954  -0.556
  180   HG22  THR  46          HG22      THR  46  -5.156  -4.879  -1.888
  181   HG23  THR  46          HG23      THR  46  -6.138  -4.892  -0.423
  182    H    LEU  47           HN       LEU  47  -5.417  -2.591   2.010
  183    HA   LEU  47           HA       LEU  47  -8.250  -3.036   1.706
  184    HB2  LEU  47           HB2      LEU  47  -6.516  -2.657   4.144
  185    HB3  LEU  47           HB1      LEU  47  -8.239  -2.963   4.216
  186    HG   LEU  47           HG       LEU  47  -7.111  -5.020   4.645
  187   HD11  LEU  47          HD11      LEU  47  -8.130  -5.040   1.810
  188   HD12  LEU  47          HD12      LEU  47  -9.115  -5.184   3.265
  189   HD13  LEU  47          HD13      LEU  47  -7.950  -6.445   2.860
  190   HD21  LEU  47          HD21      LEU  47  -5.641  -4.637   2.040
  191   HD22  LEU  47          HD22      LEU  47  -5.501  -6.014   3.134
  192   HD23  LEU  47          HD23      LEU  47  -4.947  -4.420   3.646
  193    H    PHE  48           HN       PHE  48  -6.140  -0.363   2.464
  194    HA   PHE  48           HA       PHE  48  -8.104   1.361   3.553
  195    HB2  PHE  48           HB2      PHE  48  -5.717   1.730   3.925
  196    HB3  PHE  48           HB1      PHE  48  -5.471   2.018   2.208
  197    HD1  PHE  48           HD1      PHE  48  -7.183   3.328   5.221
  198    HD2  PHE  48           HD2      PHE  48  -5.758   4.150   1.296
  199    HE1  PHE  48           HE1      PHE  48  -7.624   5.724   5.567
  200    HE2  PHE  48           HE2      PHE  48  -6.195   6.547   1.635
  201    HZ   PHE  48           HZ       PHE  48  -7.135   7.334   3.783
  202    H    CYS  49           HN       CYS  49  -7.178   0.561   0.292
  203    HA   CYS  49           HA       CYS  49  -8.546   2.812  -0.889
  204    HB2  CYS  49           HB2      CYS  49  -6.602   1.916  -2.026
  205    HB3  CYS  49           HB1      CYS  49  -7.345   0.323  -2.115
  206    HG   CYS  49           HG       CYS  49  -7.630   1.063  -4.653
  207    H    LEU  50           HN       LEU  50  -9.132  -0.658  -0.514
  208    HA   LEU  50           HA       LEU  50 -11.465  -0.867  -2.023
  209    HB2  LEU  50           HB2      LEU  50 -10.652  -2.381   0.461
  210    HB3  LEU  50           HB1      LEU  50 -11.964  -2.851  -0.613
  211    HG   LEU  50           HG       LEU  50  -9.126  -2.569  -1.581
  212   HD11  LEU  50          HD11      LEU  50  -9.314  -4.217   0.300
  213   HD12  LEU  50          HD12      LEU  50  -8.778  -4.895  -1.237
  214   HD13  LEU  50          HD13      LEU  50 -10.443  -5.129  -0.703
  215   HD21  LEU  50          HD21      LEU  50  -9.931  -4.061  -3.361
  216   HD22  LEU  50          HD22      LEU  50 -10.834  -2.547  -3.301
  217   HD23  LEU  50          HD23      LEU  50 -11.543  -4.023  -2.646
  218    H    LEU  51           HN       LEU  51 -10.970   0.256   1.262
  219    HA   LEU  51           HA       LEU  51 -13.783   0.353   1.874
  220    HB2  LEU  51           HB2      LEU  51 -11.348   1.406   3.302
  221    HB3  LEU  51           HB1      LEU  51 -12.980   1.586   3.919
  222    HG   LEU  51           HG       LEU  51 -11.635  -1.065   3.388
  223   HD11  LEU  51          HD11      LEU  51 -11.490  -1.242   5.829
  224   HD12  LEU  51          HD12      LEU  51 -12.098   0.408   5.979
  225   HD13  LEU  51          HD13      LEU  51 -10.539   0.108   5.211
  226   HD21  LEU  51          HD21      LEU  51 -13.517  -1.984   4.661
  227   HD22  LEU  51          HD22      LEU  51 -14.061  -1.162   3.198
  228   HD23  LEU  51          HD23      LEU  51 -14.229  -0.372   4.766
  229    H    HIS  52           HN       HIS  52 -11.418   2.502   0.526
  230    HA   HIS  52           HA       HIS  52 -12.833   4.926   1.064
  231    HB2  HIS  52           HB2      HIS  52 -10.382   4.815   0.645
  232    HB3  HIS  52           HB1      HIS  52 -10.720   4.404  -1.033
  233    HD1  HIS  52           HD1      HIS  52 -10.541   7.254   1.314
  234    HD2  HIS  52           HD2      HIS  52 -11.805   6.540  -2.579
  235    HE1  HIS  52           HE1      HIS  52 -10.803   9.524   0.266
  236    HE2  HIS  52           HE2      HIS  52 -11.646   9.070  -2.065
  237    H    PHE  53           HN       PHE  53 -12.243   3.193  -2.007
  238    HA   PHE  53           HA       PHE  53 -14.345   4.688  -3.304
  239    HB2  PHE  53           HB2      PHE  53 -12.611   2.427  -4.315
  240    HB3  PHE  53           HB1      PHE  53 -13.721   3.369  -5.303
  241    HD1  PHE  53           HD1      PHE  53 -13.335   5.924  -5.344
  242    HD2  PHE  53           HD2      PHE  53 -10.412   3.099  -4.090
  243    HE1  PHE  53           HE1      PHE  53 -11.563   7.578  -5.765
  244    HE2  PHE  53           HE2      PHE  53  -8.633   4.748  -4.506
  245    HZ   PHE  53           HZ       PHE  53  -9.206   6.993  -5.334
  246    H    GLY  54           HN       GLY  54 -13.979   1.600  -1.775
  247    HA2  GLY  54           HA2      GLY  54 -15.747   0.243  -1.049
  248    HA3  GLY  54           HA1      GLY  54 -16.826   1.103  -2.135
  249    H    VAL  55           HN       VAL  55 -14.823   0.694  -4.365
  250    HA   VAL  55           HA       VAL  55 -14.979  -2.185  -4.764
  251    HB   VAL  55           HB       VAL  55 -15.761  -1.204  -7.236
  252   HG11  VAL  55          HG11      VAL  55 -16.447  -3.317  -6.237
  253   HG12  VAL  55          HG12      VAL  55 -17.852  -2.402  -6.785
  254   HG13  VAL  55          HG13      VAL  55 -17.447  -2.452  -5.070
  255   HG21  VAL  55          HG21      VAL  55 -17.405   0.110  -5.078
  256   HG22  VAL  55          HG22      VAL  55 -17.807   0.066  -6.793
  257   HG23  VAL  55          HG23      VAL  55 -16.374   0.935  -6.246
  258    H    ILE  56           HN       ILE  56 -14.561   0.306  -7.210
  259    HA   ILE  56           HA       ILE  56 -11.676  -0.176  -7.240
  260    HB   ILE  56           HB       ILE  56 -11.996  -0.127  -9.861
  261   HG12  ILE  56          HG12      ILE  56 -13.975  -1.557 -10.466
  262   HG13  ILE  56          HG11      ILE  56 -14.577  -1.322  -8.830
  263   HG21  ILE  56          HG21      ILE  56 -12.363  -2.579  -8.147
  264   HG22  ILE  56          HG22      ILE  56 -10.830  -1.859  -8.635
  265   HG23  ILE  56          HG23      ILE  56 -11.888  -2.586  -9.845
  266   HD11  ILE  56          HD11      ILE  56 -14.715   1.079  -9.224
  267   HD12  ILE  56          HD12      ILE  56 -15.667   0.172 -10.399
  268   HD13  ILE  56          HD13      ILE  56 -14.104   0.846 -10.862
  269    H    GLY  57           HN       GLY  57 -14.099   2.002  -7.181
  270    HA2  GLY  57           HA2      GLY  57 -13.838   4.332  -7.134
  271    HA3  GLY  57           HA1      GLY  57 -12.314   4.152  -7.992
  272    HA   PRO  58           HA       PRO  58 -15.690   3.917 -11.405
  273    HB2  PRO  58           HB2      PRO  58 -18.268   4.294 -10.729
  274    HB3  PRO  58           HB1      PRO  58 -17.499   2.705 -10.643
  275    HG2  PRO  58           HG2      PRO  58 -18.034   4.674  -8.451
  276    HG3  PRO  58           HG1      PRO  58 -18.259   2.915  -8.453
  277    HD2  PRO  58           HD2      PRO  58 -16.098   4.138  -7.335
  278    HD3  PRO  58           HD1      PRO  58 -16.039   2.505  -8.026
  279    H    GLN  59           HN       GLN  59 -16.411   6.140  -8.770
  280    HA   GLN  59           HA       GLN  59 -16.668   8.394  -8.668
  281    HB2  GLN  59           HB2      GLN  59 -14.459   8.229  -9.918
  282    HB3  GLN  59           HB1      GLN  59 -15.375   8.516 -11.391
  283    HG2  GLN  59           HG2      GLN  59 -16.108  10.669 -10.542
  284    HG3  GLN  59           HG1      GLN  59 -15.251  10.378  -9.029
  285   HE21  GLN  59          HE21      GLN  59 -14.930  12.525 -10.978
  286   HE22  GLN  59          HE22      GLN  59 -13.278  12.474 -11.481
  287    H    ARG  60           HN       ARG  60 -18.481   6.539 -10.437
  288    HA   ARG  60           HA       ARG  60 -20.171   8.742 -11.366
  289    HB2  ARG  60           HB2      ARG  60 -19.498   6.304 -13.025
  290    HB3  ARG  60           HB1      ARG  60 -20.698   7.518 -13.447
  291    HG2  ARG  60           HG2      ARG  60 -18.974   9.210 -13.608
  292    HG3  ARG  60           HG1      ARG  60 -17.753   8.040 -13.105
  293    HD2  ARG  60           HD2      ARG  60 -19.427   7.909 -15.609
  294    HD3  ARG  60           HD1      ARG  60 -17.719   8.339 -15.519
  295    HE   ARG  60           HE       ARG  60 -18.527   5.710 -14.533
  296   HH11  ARG  60          HH11      ARG  60 -16.997   7.636 -17.003
  297   HH12  ARG  60          HH12      ARG  60 -16.182   6.290 -17.727
  298   HH21  ARG  60          HH21      ARG  60 -17.457   3.934 -15.483
  299   HH22  ARG  60          HH22      ARG  60 -16.445   4.187 -16.865
  Start of MODEL    3
    1    H1   ARG  28           HT1      ARG  28  21.254   9.123  -0.470
    2    H2   ARG  28           HT2      ARG  28  20.579   7.697  -1.081
    3    H3   ARG  28           HT3      ARG  28  21.680   7.629   0.201
    4    HA   ARG  28           HA       ARG  28  20.149   8.793   1.636
    5    HB2  ARG  28           HB2      ARG  28  18.319   8.644  -0.768
    6    HB3  ARG  28           HB1      ARG  28  17.816   9.131   0.844
    7    HG2  ARG  28           HG2      ARG  28  19.380  11.029   0.734
    8    HG3  ARG  28           HG1      ARG  28  19.808  10.553  -0.911
    9    HD2  ARG  28           HD2      ARG  28  17.510  10.883  -1.629
   10    HD3  ARG  28           HD1      ARG  28  17.035  11.289   0.020
   11    HE   ARG  28           HE       ARG  28  19.111  12.995  -0.897
   12   HH11  ARG  28          HH11      ARG  28  15.688  12.404  -1.173
   13   HH12  ARG  28          HH12      ARG  28  15.305  14.048  -1.554
   14   HH21  ARG  28          HH21      ARG  28  18.613  15.164  -1.393
   15   HH22  ARG  28          HH22      ARG  28  16.966  15.618  -1.676
   16    H    ARG  29           HN       ARG  29  18.740   6.536  -0.744
   17    HA   ARG  29           HA       ARG  29  18.444   4.575   1.434
   18    HB2  ARG  29           HB2      ARG  29  16.484   5.045  -0.820
   19    HB3  ARG  29           HB1      ARG  29  16.323   3.855   0.464
   20    HG2  ARG  29           HG2      ARG  29  16.184   5.658   2.113
   21    HG3  ARG  29           HG1      ARG  29  16.329   6.846   0.816
   22    HD2  ARG  29           HD2      ARG  29  14.113   4.826   1.158
   23    HD3  ARG  29           HD1      ARG  29  14.001   6.560   1.455
   24    HE   ARG  29           HE       ARG  29  14.837   5.962  -1.211
   25   HH11  ARG  29          HH11      ARG  29  12.061   6.214   0.880
   26   HH12  ARG  29          HH12      ARG  29  10.958   6.550  -0.412
   27   HH21  ARG  29          HH21      ARG  29  13.393   6.401  -2.918
   28   HH22  ARG  29          HH22      ARG  29  11.714   6.655  -2.571
   29    H    CYS  30           HN       CYS  30  18.570   2.372   0.832
   30    HA   CYS  30           HA       CYS  30  20.209   1.940  -1.549
   31    HB2  CYS  30           HB2      CYS  30  21.047   1.104   0.610
   32    HB3  CYS  30           HB1      CYS  30  19.612   0.100   0.778
   33    HG   CYS  30           HG       CYS  30  22.440  -0.664  -0.598
   34    H    LEU  31           HN       LEU  31  19.827   0.019  -2.875
   35    HA   LEU  31           HA       LEU  31  17.227  -0.082  -3.895
   36    HB2  LEU  31           HB2      LEU  31  19.463  -2.090  -4.178
   37    HB3  LEU  31           HB1      LEU  31  18.015  -2.057  -5.165
   38    HG   LEU  31           HG       LEU  31  19.992   0.219  -5.044
   39   HD11  LEU  31          HD11      LEU  31  19.777  -2.013  -7.060
   40   HD12  LEU  31          HD12      LEU  31  21.098  -1.762  -5.918
   41   HD13  LEU  31          HD13      LEU  31  20.810  -0.590  -7.204
   42   HD21  LEU  31          HD21      LEU  31  17.762  -0.434  -6.969
   43   HD22  LEU  31          HD22      LEU  31  18.874   0.929  -7.100
   44   HD23  LEU  31          HD23      LEU  31  17.742   0.842  -5.750
   45    H    PHE  32           HN       PHE  32  18.655  -1.739  -1.244
   46    HA   PHE  32           HA       PHE  32  16.687  -3.869  -1.215
   47    HB2  PHE  32           HB2      PHE  32  19.070  -4.205  -0.494
   48    HB3  PHE  32           HB1      PHE  32  18.738  -3.177   0.896
   49    HD1  PHE  32           HD1      PHE  32  17.502  -3.981   2.765
   50    HD2  PHE  32           HD2      PHE  32  18.002  -6.408  -0.695
   51    HE1  PHE  32           HE1      PHE  32  16.686  -5.931   4.022
   52    HE2  PHE  32           HE2      PHE  32  17.185  -8.364   0.555
   53    HZ   PHE  32           HZ       PHE  32  16.542  -8.138   2.909
   54    H    LEU  33           HN       LEU  33  17.321  -0.832   0.420
   55    HA   LEU  33           HA       LEU  33  15.290  -1.214   2.417
   56    HB2  LEU  33           HB2      LEU  33  16.841   1.226   1.580
   57    HB3  LEU  33           HB1      LEU  33  15.709   1.193   2.917
   58    HG   LEU  33           HG       LEU  33  18.286  -0.368   2.708
   59   HD11  LEU  33          HD11      LEU  33  18.599   1.984   3.200
   60   HD12  LEU  33          HD12      LEU  33  18.941   1.006   4.627
   61   HD13  LEU  33          HD13      LEU  33  17.417   1.886   4.503
   62   HD21  LEU  33          HD21      LEU  33  16.206  -0.346   4.895
   63   HD22  LEU  33          HD22      LEU  33  17.791  -1.109   4.999
   64   HD23  LEU  33          HD23      LEU  33  16.601  -1.705   3.843
   65    H    SER  34           HN       SER  34  15.387  -0.068  -0.818
   66    HA   SER  34           HA       SER  34  13.139   1.662  -0.734
   67    HB2  SER  34           HB2      SER  34  14.340   0.153  -3.066
   68    HB3  SER  34           HB1      SER  34  13.162   1.460  -3.197
   69    HG   SER  34           HG       SER  34  15.435   2.003  -1.705
   70    H    LEU  35           HN       LEU  35  13.532  -1.788  -1.278
   71    HA   LEU  35           HA       LEU  35  10.806  -2.198  -2.076
   72    HB2  LEU  35           HB2      LEU  35  12.722  -3.650  -2.770
   73    HB3  LEU  35           HB1      LEU  35  12.815  -4.237  -1.121
   74    HG   LEU  35           HG       LEU  35  10.198  -4.489  -2.513
   75   HD11  LEU  35          HD11      LEU  35  11.783  -5.191  -4.229
   76   HD12  LEU  35          HD12      LEU  35  10.891  -6.570  -3.585
   77   HD13  LEU  35          HD13      LEU  35  12.555  -6.282  -3.078
   78   HD21  LEU  35          HD21      LEU  35  11.770  -6.270  -0.653
   79   HD22  LEU  35          HD22      LEU  35  10.137  -6.581  -1.240
   80   HD23  LEU  35          HD23      LEU  35  10.449  -5.198  -0.194
   81    H    PHE  36           HN       PHE  36  12.573  -2.167   0.914
   82    HA   PHE  36           HA       PHE  36  10.837  -3.649   2.534
   83    HB2  PHE  36           HB2      PHE  36  13.086  -2.945   3.245
   84    HB3  PHE  36           HB1      PHE  36  12.547  -1.271   3.294
   85    HD1  PHE  36           HD1      PHE  36  11.935  -4.611   4.792
   86    HD2  PHE  36           HD2      PHE  36  11.597  -0.391   5.225
   87    HE1  PHE  36           HE1      PHE  36  11.233  -4.910   7.133
   88    HE2  PHE  36           HE2      PHE  36  10.896  -0.683   7.565
   89    HZ   PHE  36           HZ       PHE  36  10.714  -2.944   8.522
   90    H    SER  37           HN       SER  37  10.918  -0.154   1.868
   91    HA   SER  37           HA       SER  37   8.487   0.295   3.358
   92    HB2  SER  37           HB2      SER  37  10.087   2.153   1.581
   93    HB3  SER  37           HB1      SER  37   8.739   2.639   2.606
   94    HG   SER  37           HG       SER  37  10.960   1.287   3.690
   95    H    PHE  38           HN       PHE  38   9.153  -0.924   0.354
   96    HA   PHE  38           HA       PHE  38   6.918   0.297  -1.042
   97    HB2  PHE  38           HB2      PHE  38   9.129  -0.370  -2.133
   98    HB3  PHE  38           HB1      PHE  38   8.578  -2.033  -1.980
   99    HD1  PHE  38           HD1      PHE  38   7.612  -2.963  -3.829
  100    HD2  PHE  38           HD2      PHE  38   7.245   1.230  -3.207
  101    HE1  PHE  38           HE1      PHE  38   6.391  -2.759  -5.955
  102    HE2  PHE  38           HE2      PHE  38   6.023   1.443  -5.331
  103    HZ   PHE  38           HZ       PHE  38   5.593  -0.554  -6.709
  104    H    LEU  39           HN       LEU  39   7.551  -2.446   0.907
  105    HA   LEU  39           HA       LEU  39   5.362  -4.032  -0.104
  106    HB2  LEU  39           HB2      LEU  39   7.464  -4.979   0.899
  107    HB3  LEU  39           HB1      LEU  39   6.917  -4.398   2.458
  108    HG   LEU  39           HG       LEU  39   5.119  -6.192   0.900
  109   HD11  LEU  39          HD11      LEU  39   6.216  -8.163   1.815
  110   HD12  LEU  39          HD12      LEU  39   7.484  -7.150   2.503
  111   HD13  LEU  39          HD13      LEU  39   7.306  -7.273   0.753
  112   HD21  LEU  39          HD21      LEU  39   4.322  -5.229   2.984
  113   HD22  LEU  39          HD22      LEU  39   5.732  -5.859   3.835
  114   HD23  LEU  39          HD23      LEU  39   4.541  -6.969   3.160
  115    H    ILE  40           HN       ILE  40   5.931  -1.707   2.416
  116    HA   ILE  40           HA       ILE  40   3.472  -2.266   3.820
  117    HB   ILE  40           HB       ILE  40   5.294   0.126   4.105
  118   HG12  ILE  40          HG12      ILE  40   5.284  -2.414   5.747
  119   HG13  ILE  40          HG11      ILE  40   6.428  -2.094   4.448
  120   HG21  ILE  40          HG21      ILE  40   4.285   0.311   6.335
  121   HG22  ILE  40          HG22      ILE  40   3.219  -1.042   5.957
  122   HG23  ILE  40          HG23      ILE  40   3.083   0.467   5.054
  123   HD11  ILE  40          HD11      ILE  40   6.116  -0.475   6.967
  124   HD12  ILE  40          HD12      ILE  40   7.262  -0.149   5.665
  125   HD13  ILE  40          HD13      ILE  40   7.405  -1.628   6.618
  126    H    VAL  41           HN       VAL  41   4.611  -0.022   1.381
  127    HA   VAL  41           HA       VAL  41   2.431   1.785   1.538
  128    HB   VAL  41           HB       VAL  41   4.648   2.297   0.487
  129   HG11  VAL  41          HG11      VAL  41   3.519   0.685  -1.788
  130   HG12  VAL  41          HG12      VAL  41   4.915   0.264  -0.801
  131   HG13  VAL  41          HG13      VAL  41   4.975   1.677  -1.854
  132   HG21  VAL  41          HG21      VAL  41   2.736   3.769   0.188
  133   HG22  VAL  41          HG22      VAL  41   2.187   2.804  -1.183
  134   HG23  VAL  41          HG23      VAL  41   3.700   3.704  -1.287
  135    H    LEU  42           HN       LEU  42   2.994  -1.182  -0.257
  136    HA   LEU  42           HA       LEU  42   0.679  -0.870  -1.930
  137    HB2  LEU  42           HB2      LEU  42   2.377  -3.300  -1.354
  138    HB3  LEU  42           HB1      LEU  42   1.130  -3.208  -2.592
  139    HG   LEU  42           HG       LEU  42   3.642  -1.530  -2.539
  140   HD11  LEU  42          HD11      LEU  42   4.120  -3.891  -2.941
  141   HD12  LEU  42          HD12      LEU  42   4.377  -2.926  -4.395
  142   HD13  LEU  42          HD13      LEU  42   2.924  -3.914  -4.238
  143   HD21  LEU  42          HD21      LEU  42   2.988  -0.931  -4.826
  144   HD22  LEU  42          HD22      LEU  42   1.790  -0.405  -3.644
  145   HD23  LEU  42          HD23      LEU  42   1.487  -1.836  -4.629
  146    H    LEU  43           HN       LEU  43   1.496  -3.095   0.734
  147    HA   LEU  43           HA       LEU  43  -0.969  -4.350   0.953
  148    HB2  LEU  43           HB2      LEU  43   1.082  -5.097   2.081
  149    HB3  LEU  43           HB1      LEU  43   0.986  -3.722   3.164
  150    HG   LEU  43           HG       LEU  43  -1.182  -4.607   4.020
  151   HD11  LEU  43          HD11      LEU  43  -1.829  -5.923   2.077
  152   HD12  LEU  43          HD12      LEU  43  -1.777  -6.925   3.528
  153   HD13  LEU  43          HD13      LEU  43  -0.469  -7.012   2.348
  154   HD21  LEU  43          HD21      LEU  43   0.897  -5.030   5.215
  155   HD22  LEU  43          HD22      LEU  43   1.186  -6.465   4.230
  156   HD23  LEU  43          HD23      LEU  43  -0.186  -6.416   5.339
  157    H    LEU  44           HN       LEU  44  -0.060  -1.154   1.898
  158    HA   LEU  44           HA       LEU  44  -2.242  -0.808   3.750
  159    HB2  LEU  44           HB2      LEU  44  -0.496   0.524   4.388
  160    HB3  LEU  44           HB1      LEU  44   0.016   0.831   2.740
  161    HG   LEU  44           HG       LEU  44  -1.952   2.352   2.488
  162   HD11  LEU  44          HD11      LEU  44  -2.167   1.957   5.470
  163   HD12  LEU  44          HD12      LEU  44  -3.353   1.462   4.263
  164   HD13  LEU  44          HD13      LEU  44  -3.031   3.174   4.533
  165   HD21  LEU  44          HD21      LEU  44   0.029   3.032   4.655
  166   HD22  LEU  44          HD22      LEU  44  -0.937   4.192   3.743
  167   HD23  LEU  44          HD23      LEU  44   0.279   3.215   2.919
  168    H    THR  45           HN       THR  45  -1.398   0.446   0.523
  169    HA   THR  45           HA       THR  45  -3.771   1.911   0.143
  170    HB   THR  45           HB       THR  45  -3.196   1.726  -2.324
  171    HG1  THR  45           HG1      THR  45  -0.660   0.861  -1.820
  172   HG21  THR  45          HG21      THR  45  -1.202   3.153  -2.118
  173   HG22  THR  45          HG22      THR  45  -1.056   2.691  -0.422
  174   HG23  THR  45          HG23      THR  45  -2.458   3.611  -0.967
  175    H    THR  46           HN       THR  46  -3.103  -1.466  -0.105
  176    HA   THR  46           HA       THR  46  -5.077  -2.244  -1.939
  177    HB   THR  46           HB       THR  46  -4.044  -3.813   0.432
  178    HG1  THR  46           HG1      THR  46  -3.146  -3.612  -2.267
  179   HG21  THR  46          HG21      THR  46  -4.739  -5.784  -0.814
  180   HG22  THR  46          HG22      THR  46  -5.344  -4.770  -2.121
  181   HG23  THR  46          HG23      THR  46  -6.123  -4.726  -0.540
  182    H    LEU  47           HN       LEU  47  -5.229  -2.374   1.631
  183    HA   LEU  47           HA       LEU  47  -8.061  -2.846   1.586
  184    HB2  LEU  47           HB2      LEU  47  -6.140  -2.278   3.839
  185    HB3  LEU  47           HB1      LEU  47  -7.848  -2.576   4.084
  186    HG   LEU  47           HG       LEU  47  -6.682  -4.599   4.557
  187   HD11  LEU  47          HD11      LEU  47  -7.937  -4.818   1.826
  188   HD12  LEU  47          HD12      LEU  47  -8.793  -4.860   3.367
  189   HD13  LEU  47          HD13      LEU  47  -7.662  -6.146   2.953
  190   HD21  LEU  47          HD21      LEU  47  -4.616  -4.056   3.323
  191   HD22  LEU  47          HD22      LEU  47  -5.447  -4.429   1.813
  192   HD23  LEU  47          HD23      LEU  47  -5.188  -5.695   3.013
  193    H    PHE  48           HN       PHE  48  -5.972  -0.077   2.225
  194    HA   PHE  48           HA       PHE  48  -7.856   1.668   3.299
  195    HB2  PHE  48           HB2      PHE  48  -5.412   2.097   3.217
  196    HB3  PHE  48           HB1      PHE  48  -5.547   2.395   1.488
  197    HD1  PHE  48           HD1      PHE  48  -6.990   3.553   4.724
  198    HD2  PHE  48           HD2      PHE  48  -5.824   4.560   0.757
  199    HE1  PHE  48           HE1      PHE  48  -7.496   5.919   5.179
  200    HE2  PHE  48           HE2      PHE  48  -6.327   6.926   1.204
  201    HZ   PHE  48           HZ       PHE  48  -7.170   7.607   3.416
  202    H    CYS  49           HN       CYS  49  -6.979   1.141  -0.108
  203    HA   CYS  49           HA       CYS  49  -8.772   3.070  -1.146
  204    HB2  CYS  49           HB2      CYS  49  -6.862   2.232  -2.436
  205    HB3  CYS  49           HB1      CYS  49  -7.586   0.628  -2.480
  206    HG   CYS  49           HG       CYS  49  -9.518   3.084  -3.710
  207    H    LEU  50           HN       LEU  50  -9.083  -0.348  -0.398
  208    HA   LEU  50           HA       LEU  50 -11.565  -0.771  -1.683
  209    HB2  LEU  50           HB2      LEU  50 -10.202  -2.178   0.609
  210    HB3  LEU  50           HB1      LEU  50 -11.736  -2.717  -0.065
  211    HG   LEU  50           HG       LEU  50  -9.217  -2.446  -1.705
  212   HD11  LEU  50          HD11      LEU  50  -9.032  -4.890  -1.519
  213   HD12  LEU  50          HD12      LEU  50 -10.347  -4.888  -0.343
  214   HD13  LEU  50          HD13      LEU  50  -8.823  -4.084   0.036
  215   HD21  LEU  50          HD21      LEU  50 -11.836  -3.858  -2.196
  216   HD22  LEU  50          HD22      LEU  50 -10.430  -3.910  -3.258
  217   HD23  LEU  50          HD23      LEU  50 -11.276  -2.386  -2.990
  218    H    LEU  51           HN       LEU  51 -10.684   0.516   1.444
  219    HA   LEU  51           HA       LEU  51 -13.363   0.403   2.499
  220    HB2  LEU  51           HB2      LEU  51 -10.870   1.789   3.484
  221    HB3  LEU  51           HB1      LEU  51 -12.388   1.750   4.361
  222    HG   LEU  51           HG       LEU  51 -10.793  -0.705   3.623
  223   HD11  LEU  51          HD11      LEU  51 -10.152  -0.773   5.979
  224   HD12  LEU  51          HD12      LEU  51 -10.975   0.762   6.252
  225   HD13  LEU  51          HD13      LEU  51  -9.562   0.694   5.199
  226   HD21  LEU  51          HD21      LEU  51 -13.163  -0.307   5.448
  227   HD22  LEU  51          HD22      LEU  51 -12.262  -1.811   5.251
  228   HD23  LEU  51          HD23      LEU  51 -13.167  -1.142   3.894
  229    H    HIS  52           HN       HIS  52 -11.437   2.669   0.715
  230    HA   HIS  52           HA       HIS  52 -12.992   4.982   1.371
  231    HB2  HIS  52           HB2      HIS  52 -10.623   5.115   0.669
  232    HB3  HIS  52           HB1      HIS  52 -11.082   4.551  -0.934
  233    HD1  HIS  52           HD1      HIS  52 -12.007   6.261  -2.551
  234    HD2  HIS  52           HD2      HIS  52 -11.519   7.758   1.294
  235    HE1  HIS  52           HE1      HIS  52 -12.364   8.742  -2.746
  236    HE2  HIS  52           HE2      HIS  52 -12.029   9.634  -0.414
  237    H    PHE  53           HN       PHE  53 -13.137   2.524  -1.119
  238    HA   PHE  53           HA       PHE  53 -15.376   3.981  -2.362
  239    HB2  PHE  53           HB2      PHE  53 -13.441   1.989  -3.539
  240    HB3  PHE  53           HB1      PHE  53 -14.908   2.511  -4.366
  241    HD1  PHE  53           HD1      PHE  53 -15.190   5.090  -4.625
  242    HD2  PHE  53           HD2      PHE  53 -11.480   3.142  -3.886
  243    HE1  PHE  53           HE1      PHE  53 -13.992   7.039  -5.527
  244    HE2  PHE  53           HE2      PHE  53 -10.273   5.089  -4.785
  245    HZ   PHE  53           HZ       PHE  53 -11.526   7.048  -5.589
  246    H    GLY  54           HN       GLY  54 -14.540   1.258  -0.536
  247    HA2  GLY  54           HA2      GLY  54 -16.155  -0.123   0.503
  248    HA3  GLY  54           HA1      GLY  54 -17.269   0.235  -0.806
  249    H    VAL  55           HN       VAL  55 -15.081  -0.337  -2.800
  250    HA   VAL  55           HA       VAL  55 -14.133  -2.937  -2.544
  251    HB   VAL  55           HB       VAL  55 -16.432  -3.645  -2.482
  252   HG11  VAL  55          HG11      VAL  55 -16.773  -2.311  -5.153
  253   HG12  VAL  55          HG12      VAL  55 -17.452  -1.751  -3.627
  254   HG13  VAL  55          HG13      VAL  55 -17.978  -3.286  -4.318
  255   HG21  VAL  55          HG21      VAL  55 -16.444  -5.199  -4.408
  256   HG22  VAL  55          HG22      VAL  55 -14.897  -5.148  -3.563
  257   HG23  VAL  55          HG23      VAL  55 -15.092  -4.302  -5.097
  258    H    ILE  56           HN       ILE  56 -15.602  -0.753  -4.929
  259    HA   ILE  56           HA       ILE  56 -13.169  -0.505  -6.380
  260    HB   ILE  56           HB       ILE  56 -14.531  -1.316  -8.559
  261   HG12  ILE  56          HG12      ILE  56 -15.363  -3.668  -7.918
  262   HG13  ILE  56          HG11      ILE  56 -15.464  -3.045  -6.277
  263   HG21  ILE  56          HG21      ILE  56 -12.837  -3.129  -6.852
  264   HG22  ILE  56          HG22      ILE  56 -12.222  -1.874  -7.926
  265   HG23  ILE  56          HG23      ILE  56 -13.094  -3.253  -8.592
  266   HD11  ILE  56          HD11      ILE  56 -16.896  -1.881  -8.651
  267   HD12  ILE  56          HD12      ILE  56 -17.056  -1.376  -6.968
  268   HD13  ILE  56          HD13      ILE  56 -17.606  -2.975  -7.464
  269    H    GLY  57           HN       GLY  57 -13.269   1.627  -6.619
  270    HA2  GLY  57           HA2      GLY  57 -15.795   2.944  -7.183
  271    HA3  GLY  57           HA1      GLY  57 -14.254   3.732  -6.880
  272    HA   PRO  58           HA       PRO  58 -13.364   4.328 -11.161
  273    HB2  PRO  58           HB2      PRO  58 -11.195   2.318 -11.270
  274    HB3  PRO  58           HB1      PRO  58 -11.136   4.055 -11.582
  275    HG2  PRO  58           HG2      PRO  58 -10.078   3.017  -9.360
  276    HG3  PRO  58           HG1      PRO  58 -10.903   4.587  -9.343
  277    HD2  PRO  58           HD2      PRO  58 -11.895   1.913  -8.437
  278    HD3  PRO  58           HD1      PRO  58 -12.118   3.510  -7.690
  279    H    GLN  59           HN       GLN  59 -12.905   3.135 -13.342
  280    HA   GLN  59           HA       GLN  59 -14.701   0.808 -13.430
  281    HB2  GLN  59           HB2      GLN  59 -15.043   1.403 -15.812
  282    HB3  GLN  59           HB1      GLN  59 -15.530   2.685 -14.712
  283    HG2  GLN  59           HG2      GLN  59 -13.425   3.854 -15.152
  284    HG3  GLN  59           HG1      GLN  59 -12.958   2.574 -16.271
  285   HE21  GLN  59          HE21      GLN  59 -14.032   2.386 -18.246
  286   HE22  GLN  59          HE22      GLN  59 -14.966   3.682 -18.904
  287    H    ARG  60           HN       ARG  60 -11.874   0.648 -12.778
  288    HA   ARG  60           HA       ARG  60 -10.494  -0.338 -15.096
  289    HB2  ARG  60           HB2      ARG  60  -9.355   0.720 -13.132
  290    HB3  ARG  60           HB1      ARG  60  -9.769  -0.701 -12.184
  291    HG2  ARG  60           HG2      ARG  60  -7.511  -0.922 -12.894
  292    HG3  ARG  60           HG1      ARG  60  -8.479  -2.077 -13.813
  293    HD2  ARG  60           HD2      ARG  60  -6.836  -0.912 -15.223
  294    HD3  ARG  60           HD1      ARG  60  -8.494  -0.589 -15.725
  295    HE   ARG  60           HE       ARG  60  -7.999   1.494 -14.122
  296   HH11  ARG  60          HH11      ARG  60  -6.141   0.086 -16.713
  297   HH12  ARG  60          HH12      ARG  60  -5.385   1.579 -17.155
  298   HH21  ARG  60          HH21      ARG  60  -7.008   3.464 -14.697
  299   HH22  ARG  60          HH22      ARG  60  -5.877   3.500 -16.009
  Start of MODEL    4
    1    H1   ARG  28           HT1      ARG  28  27.280   0.590  -3.943
    2    H2   ARG  28           HT2      ARG  28  25.642   0.253  -4.189
    3    H3   ARG  28           HT3      ARG  28  26.235   0.462  -2.618
    4    HA   ARG  28           HA       ARG  28  26.781   2.766  -3.113
    5    HB2  ARG  28           HB2      ARG  28  27.084   2.474  -5.537
    6    HB3  ARG  28           HB1      ARG  28  25.361   2.173  -5.718
    7    HG2  ARG  28           HG2      ARG  28  24.895   4.445  -4.916
    8    HG3  ARG  28           HG1      ARG  28  26.630   4.742  -4.790
    9    HD2  ARG  28           HD2      ARG  28  25.108   4.074  -7.307
   10    HD3  ARG  28           HD1      ARG  28  25.737   5.660  -6.863
   11    HE   ARG  28           HE       ARG  28  27.730   3.581  -6.979
   12   HH11  ARG  28          HH11      ARG  28  26.011   6.030  -8.765
   13   HH12  ARG  28          HH12      ARG  28  27.230   6.176  -9.987
   14   HH21  ARG  28          HH21      ARG  28  29.338   3.767  -8.586
   15   HH22  ARG  28          HH22      ARG  28  29.119   4.891  -9.886
   16    H    ARG  29           HN       ARG  29  23.767   1.607  -4.626
   17    HA   ARG  29           HA       ARG  29  22.259   3.171  -2.655
   18    HB2  ARG  29           HB2      ARG  29  21.334   1.920  -5.249
   19    HB3  ARG  29           HB1      ARG  29  20.364   2.944  -4.198
   20    HG2  ARG  29           HG2      ARG  29  21.834   4.823  -4.625
   21    HG3  ARG  29           HG1      ARG  29  22.878   3.803  -5.616
   22    HD2  ARG  29           HD2      ARG  29  21.391   5.164  -6.997
   23    HD3  ARG  29           HD1      ARG  29  21.057   3.445  -7.192
   24    HE   ARG  29           HE       ARG  29  19.359   4.427  -5.209
   25   HH11  ARG  29          HH11      ARG  29  19.906   4.821  -8.630
   26   HH12  ARG  29          HH12      ARG  29  18.252   5.196  -8.982
   27   HH21  ARG  29          HH21      ARG  29  17.179   4.921  -5.666
   28   HH22  ARG  29          HH22      ARG  29  16.704   5.255  -7.297
   29    H    CYS  30           HN       CYS  30  20.197   2.215  -1.876
   30    HA   CYS  30           HA       CYS  30  20.603  -0.625  -1.234
   31    HB2  CYS  30           HB2      CYS  30  18.999   1.489   0.219
   32    HB3  CYS  30           HB1      CYS  30  19.126  -0.197   0.711
   33    HG   CYS  30           HG       CYS  30  21.200   2.330   1.272
   34    H    LEU  31           HN       LEU  31  19.623  -1.541  -3.026
   35    HA   LEU  31           HA       LEU  31  16.975  -0.785  -3.846
   36    HB2  LEU  31           HB2      LEU  31  18.777  -3.078  -4.613
   37    HB3  LEU  31           HB1      LEU  31  17.173  -2.863  -5.284
   38    HG   LEU  31           HG       LEU  31  18.768  -2.025  -6.858
   39   HD11  LEU  31          HD11      LEU  31  17.443   0.280  -5.439
   40   HD12  LEU  31          HD12      LEU  31  16.702  -0.751  -6.664
   41   HD13  LEU  31          HD13      LEU  31  18.055   0.296  -7.094
   42   HD21  LEU  31          HD21      LEU  31  20.612  -1.664  -5.258
   43   HD22  LEU  31          HD22      LEU  31  19.801  -0.205  -4.689
   44   HD23  LEU  31          HD23      LEU  31  20.378  -0.303  -6.353
   45    H    PHE  32           HN       PHE  32  18.387  -3.152  -1.726
   46    HA   PHE  32           HA       PHE  32  16.048  -4.799  -1.519
   47    HB2  PHE  32           HB2      PHE  32  18.298  -5.698  -1.085
   48    HB3  PHE  32           HB1      PHE  32  18.472  -4.605   0.287
   49    HD1  PHE  32           HD1      PHE  32  16.617  -7.525  -0.995
   50    HD2  PHE  32           HD2      PHE  32  17.551  -5.128   2.396
   51    HE1  PHE  32           HE1      PHE  32  15.609  -9.220   0.476
   52    HE2  PHE  32           HE2      PHE  32  16.546  -6.819   3.874
   53    HZ   PHE  32           HZ       PHE  32  15.564  -8.862   2.915
   54    H    LEU  33           HN       LEU  33  17.370  -2.057   0.197
   55    HA   LEU  33           HA       LEU  33  15.544  -2.241   2.409
   56    HB2  LEU  33           HB2      LEU  33  17.934  -1.090   2.123
   57    HB3  LEU  33           HB1      LEU  33  16.931   0.302   1.771
   58    HG   LEU  33           HG       LEU  33  16.456  -1.306   4.249
   59   HD11  LEU  33          HD11      LEU  33  18.847  -0.761   4.212
   60   HD12  LEU  33          HD12      LEU  33  17.986   0.132   5.466
   61   HD13  LEU  33          HD13      LEU  33  18.447   0.939   3.967
   62   HD21  LEU  33          HD21      LEU  33  16.034   1.593   3.534
   63   HD22  LEU  33          HD22      LEU  33  15.630   0.845   5.079
   64   HD23  LEU  33          HD23      LEU  33  14.788   0.347   3.612
   65    H    SER  34           HN       SER  34  15.827  -0.261  -0.504
   66    HA   SER  34           HA       SER  34  13.707   1.487  -0.050
   67    HB2  SER  34           HB2      SER  34  13.652   1.796  -2.495
   68    HB3  SER  34           HB1      SER  34  15.309   1.784  -1.891
   69    HG   SER  34           HG       SER  34  14.000  -0.024  -3.529
   70    H    LEU  35           HN       LEU  35  13.742  -1.838  -1.085
   71    HA   LEU  35           HA       LEU  35  11.051  -1.936  -2.015
   72    HB2  LEU  35           HB2      LEU  35  12.790  -3.561  -2.681
   73    HB3  LEU  35           HB1      LEU  35  12.820  -4.179  -1.040
   74    HG   LEU  35           HG       LEU  35  10.183  -4.189  -2.389
   75   HD11  LEU  35          HD11      LEU  35  11.645  -4.884  -4.208
   76   HD12  LEU  35          HD12      LEU  35  10.687  -6.239  -3.612
   77   HD13  LEU  35          HD13      LEU  35  12.386  -6.095  -3.163
   78   HD21  LEU  35          HD21      LEU  35  10.022  -6.350  -1.245
   79   HD22  LEU  35          HD22      LEU  35  10.465  -5.057  -0.130
   80   HD23  LEU  35          HD23      LEU  35  11.693  -6.185  -0.704
   81    H    PHE  36           HN       PHE  36  12.588  -2.210   1.091
   82    HA   PHE  36           HA       PHE  36  10.553  -3.539   2.502
   83    HB2  PHE  36           HB2      PHE  36  12.870  -3.130   3.344
   84    HB3  PHE  36           HB1      PHE  36  12.446  -1.438   3.578
   85    HD1  PHE  36           HD1      PHE  36  11.937  -4.862   4.771
   86    HD2  PHE  36           HD2      PHE  36  11.033  -0.751   5.398
   87    HE1  PHE  36           HE1      PHE  36  11.082  -5.396   7.016
   88    HE2  PHE  36           HE2      PHE  36  10.178  -1.278   7.645
   89    HZ   PHE  36           HZ       PHE  36  10.216  -3.598   8.462
   90    H    SER  37           HN       SER  37  10.778  -0.312   1.306
   91    HA   SER  37           HA       SER  37   8.727   0.737   3.060
   92    HB2  SER  37           HB2      SER  37   9.937   2.018   0.602
   93    HB3  SER  37           HB1      SER  37   9.021   2.824   1.874
   94    HG   SER  37           HG       SER  37  11.657   1.981   1.845
   95    H    PHE  38           HN       PHE  38   9.033  -0.135  -0.369
   96    HA   PHE  38           HA       PHE  38   6.460   0.635  -1.171
   97    HB2  PHE  38           HB2      PHE  38   8.123  -1.632  -2.281
   98    HB3  PHE  38           HB1      PHE  38   6.794  -0.821  -3.099
   99    HD1  PHE  38           HD1      PHE  38   7.257   1.965  -2.748
  100    HD2  PHE  38           HD2      PHE  38  10.099  -1.144  -3.351
  101    HE1  PHE  38           HE1      PHE  38   8.831   3.595  -3.707
  102    HE2  PHE  38           HE2      PHE  38  11.678   0.481  -4.310
  103    HZ   PHE  38           HZ       PHE  38  11.052   2.844  -4.492
  104    H    LEU  39           HN       LEU  39   7.651  -2.293   0.345
  105    HA   LEU  39           HA       LEU  39   5.443  -3.950  -0.091
  106    HB2  LEU  39           HB2      LEU  39   7.678  -4.624   0.825
  107    HB3  LEU  39           HB1      LEU  39   7.199  -3.931   2.362
  108    HG   LEU  39           HG       LEU  39   5.414  -5.967   1.153
  109   HD11  LEU  39          HD11      LEU  39   6.751  -7.791   2.078
  110   HD12  LEU  39          HD12      LEU  39   8.022  -6.646   2.502
  111   HD13  LEU  39          HD13      LEU  39   7.625  -6.934   0.808
  112   HD21  LEU  39          HD21      LEU  39   6.343  -5.396   3.965
  113   HD22  LEU  39          HD22      LEU  39   5.137  -6.597   3.507
  114   HD23  LEU  39          HD23      LEU  39   4.815  -4.883   3.251
  115    H    ILE  40           HN       ILE  40   5.961  -1.344   2.153
  116    HA   ILE  40           HA       ILE  40   3.657  -1.980   3.772
  117    HB   ILE  40           HB       ILE  40   5.320   0.542   3.711
  118   HG12  ILE  40          HG12      ILE  40   5.441  -1.771   5.656
  119   HG13  ILE  40          HG11      ILE  40   6.557  -1.561   4.311
  120   HG21  ILE  40          HG21      ILE  40   3.324  -0.459   5.739
  121   HG22  ILE  40          HG22      ILE  40   3.112   0.917   4.656
  122   HG23  ILE  40          HG23      ILE  40   4.340   0.972   5.921
  123   HD11  ILE  40          HD11      ILE  40   7.310   0.552   5.271
  124   HD12  ILE  40          HD12      ILE  40   7.531  -0.790   6.393
  125   HD13  ILE  40          HD13      ILE  40   6.193   0.337   6.619
  126    H    VAL  41           HN       VAL  41   4.513   0.512   1.381
  127    HA   VAL  41           HA       VAL  41   2.049   1.864   1.445
  128    HB   VAL  41           HB       VAL  41   4.269   2.638   0.406
  129   HG11  VAL  41          HG11      VAL  41   4.519   2.256  -1.977
  130   HG12  VAL  41          HG12      VAL  41   3.103   1.204  -1.970
  131   HG13  VAL  41          HG13      VAL  41   4.555   0.732  -1.093
  132   HG21  VAL  41          HG21      VAL  41   3.089   4.114  -1.174
  133   HG22  VAL  41          HG22      VAL  41   2.253   3.982   0.373
  134   HG23  VAL  41          HG23      VAL  41   1.655   3.097  -1.029
  135    H    LEU  42           HN       LEU  42   2.927  -1.147   0.097
  136    HA   LEU  42           HA       LEU  42   0.838  -1.181  -1.905
  137    HB2  LEU  42           HB2      LEU  42   3.171  -2.418  -1.856
  138    HB3  LEU  42           HB1      LEU  42   2.255  -3.647  -0.995
  139    HG   LEU  42           HG       LEU  42   2.404  -4.184  -3.361
  140   HD11  LEU  42          HD11      LEU  42   0.030  -4.469  -3.860
  141   HD12  LEU  42          HD12      LEU  42  -0.378  -3.329  -2.577
  142   HD13  LEU  42          HD13      LEU  42   0.390  -4.866  -2.180
  143   HD21  LEU  42          HD21      LEU  42   1.368  -2.774  -5.057
  144   HD22  LEU  42          HD22      LEU  42   2.670  -1.919  -4.230
  145   HD23  LEU  42          HD23      LEU  42   0.988  -1.565  -3.832
  146    H    LEU  43           HN       LEU  43   1.534  -3.185   0.970
  147    HA   LEU  43           HA       LEU  43  -0.903  -4.510   1.081
  148    HB2  LEU  43           HB2      LEU  43   0.966  -3.725   3.315
  149    HB3  LEU  43           HB1      LEU  43  -0.389  -4.819   3.517
  150    HG   LEU  43           HG       LEU  43   1.959  -5.299   1.678
  151   HD11  LEU  43          HD11      LEU  43   2.620  -5.382   4.021
  152   HD12  LEU  43          HD12      LEU  43   2.624  -6.995   3.307
  153   HD13  LEU  43          HD13      LEU  43   1.301  -6.501   4.364
  154   HD21  LEU  43          HD21      LEU  43   1.046  -7.567   1.510
  155   HD22  LEU  43          HD22      LEU  43  -0.082  -6.363   0.891
  156   HD23  LEU  43          HD23      LEU  43  -0.342  -7.077   2.482
  157    H    LEU  44           HN       LEU  44  -0.138  -1.255   1.939
  158    HA   LEU  44           HA       LEU  44  -2.463  -0.879   3.606
  159    HB2  LEU  44           HB2      LEU  44  -0.436   1.036   2.467
  160    HB3  LEU  44           HB1      LEU  44  -1.794   1.553   3.445
  161    HG   LEU  44           HG       LEU  44   0.426  -0.283   4.348
  162   HD11  LEU  44          HD11      LEU  44   1.053   1.595   5.792
  163   HD12  LEU  44          HD12      LEU  44  -0.200   2.583   5.040
  164   HD13  LEU  44          HD13      LEU  44   1.167   2.013   4.082
  165   HD21  LEU  44          HD21      LEU  44  -0.584  -0.058   6.569
  166   HD22  LEU  44          HD22      LEU  44  -1.682  -0.838   5.431
  167   HD23  LEU  44          HD23      LEU  44  -1.919   0.856   5.866
  168    H    THR  45           HN       THR  45  -1.442   0.272   0.390
  169    HA   THR  45           HA       THR  45  -3.750   1.693  -0.244
  170    HB   THR  45           HB       THR  45  -3.114   1.158  -2.670
  171    HG1  THR  45           HG1      THR  45  -0.674   0.449  -2.417
  172   HG21  THR  45          HG21      THR  45  -2.464   3.223  -1.545
  173   HG22  THR  45          HG22      THR  45  -1.160   2.641  -2.580
  174   HG23  THR  45          HG23      THR  45  -1.069   2.410  -0.834
  175    H    THR  46           HN       THR  46  -3.229  -1.728  -0.149
  176    HA   THR  46           HA       THR  46  -5.277  -2.515  -1.938
  177    HB   THR  46           HB       THR  46  -4.201  -4.043   0.441
  178    HG1  THR  46           HG1      THR  46  -2.966  -3.303  -1.763
  179   HG21  THR  46          HG21      THR  46  -4.989  -6.027  -0.756
  180   HG22  THR  46          HG22      THR  46  -5.646  -5.003  -2.034
  181   HG23  THR  46          HG23      THR  46  -6.328  -4.932  -0.408
  182    H    LEU  47           HN       LEU  47  -5.265  -2.540   1.634
  183    HA   LEU  47           HA       LEU  47  -8.089  -2.951   1.776
  184    HB2  LEU  47           HB2      LEU  47  -6.064  -2.181   3.873
  185    HB3  LEU  47           HB1      LEU  47  -7.748  -2.530   4.220
  186    HG   LEU  47           HG       LEU  47  -5.815  -4.500   2.992
  187   HD11  LEU  47          HD11      LEU  47  -5.156  -3.986   5.266
  188   HD12  LEU  47          HD12      LEU  47  -5.868  -5.597   5.189
  189   HD13  LEU  47          HD13      LEU  47  -6.807  -4.247   5.829
  190   HD21  LEU  47          HD21      LEU  47  -7.568  -6.138   3.539
  191   HD22  LEU  47          HD22      LEU  47  -8.117  -4.936   2.371
  192   HD23  LEU  47          HD23      LEU  47  -8.618  -4.820   4.059
  193    H    PHE  48           HN       PHE  48  -5.965  -0.162   2.307
  194    HA   PHE  48           HA       PHE  48  -7.831   1.665   3.223
  195    HB2  PHE  48           HB2      PHE  48  -5.422   2.113   3.189
  196    HB3  PHE  48           HB1      PHE  48  -5.450   2.196   1.431
  197    HD1  PHE  48           HD1      PHE  48  -6.061   4.174   0.317
  198    HD2  PHE  48           HD2      PHE  48  -6.645   3.839   4.519
  199    HE1  PHE  48           HE1      PHE  48  -6.544   6.584   0.437
  200    HE2  PHE  48           HE2      PHE  48  -7.131   6.248   4.647
  201    HZ   PHE  48           HZ       PHE  48  -7.094   7.620   2.615
  202    H    CYS  49           HN       CYS  49  -7.184   0.602  -0.066
  203    HA   CYS  49           HA       CYS  49  -8.758   2.610  -1.334
  204    HB2  CYS  49           HB2      CYS  49  -7.028   1.410  -2.570
  205    HB3  CYS  49           HB1      CYS  49  -7.881  -0.111  -2.324
  206    HG   CYS  49           HG       CYS  49 -10.006   0.479  -3.963
  207    H    LEU  50           HN       LEU  50  -9.353  -0.759  -0.417
  208    HA   LEU  50           HA       LEU  50 -11.962  -0.964  -1.431
  209    HB2  LEU  50           HB2      LEU  50 -10.788  -2.383   0.966
  210    HB3  LEU  50           HB1      LEU  50 -12.187  -2.900   0.030
  211    HG   LEU  50           HG       LEU  50  -9.458  -2.626  -1.212
  212   HD11  LEU  50          HD11      LEU  50  -9.061  -4.954  -0.826
  213   HD12  LEU  50          HD12      LEU  50 -10.635  -5.144  -0.051
  214   HD13  LEU  50          HD13      LEU  50  -9.378  -4.182   0.728
  215   HD21  LEU  50          HD21      LEU  50 -10.390  -4.186  -2.849
  216   HD22  LEU  50          HD22      LEU  50 -11.354  -2.713  -2.738
  217   HD23  LEU  50          HD23      LEU  50 -11.917  -4.197  -1.968
  218    H    LEU  51           HN       LEU  51 -10.705   0.370   1.537
  219    HA   LEU  51           HA       LEU  51 -13.279   0.585   2.811
  220    HB2  LEU  51           HB2      LEU  51 -10.595   1.780   3.508
  221    HB3  LEU  51           HB1      LEU  51 -12.028   1.895   4.514
  222    HG   LEU  51           HG       LEU  51 -10.699  -0.706   3.746
  223   HD11  LEU  51          HD11      LEU  51  -9.889  -0.743   6.064
  224   HD12  LEU  51          HD12      LEU  51 -10.514   0.890   6.298
  225   HD13  LEU  51          HD13      LEU  51  -9.212   0.601   5.144
  226   HD21  LEU  51          HD21      LEU  51 -13.063  -0.947   4.236
  227   HD22  LEU  51          HD22      LEU  51 -12.864  -0.053   5.743
  228   HD23  LEU  51          HD23      LEU  51 -12.097  -1.629   5.544
  229    H    HIS  52           HN       HIS  52 -11.371   2.492   0.663
  230    HA   HIS  52           HA       HIS  52 -12.627   5.000   1.303
  231    HB2  HIS  52           HB2      HIS  52 -10.310   4.806   0.380
  232    HB3  HIS  52           HB1      HIS  52 -11.009   4.279  -1.147
  233    HD1  HIS  52           HD1      HIS  52 -12.108   6.071  -2.628
  234    HD2  HIS  52           HD2      HIS  52 -10.612   7.545   0.959
  235    HE1  HIS  52           HE1      HIS  52 -12.131   8.575  -2.866
  236    HE2  HIS  52           HE2      HIS  52 -11.160   9.443  -0.709
  237    H    PHE  53           HN       PHE  53 -12.671   2.948  -1.623
  238    HA   PHE  53           HA       PHE  53 -14.820   4.318  -2.830
  239    HB2  PHE  53           HB2      PHE  53 -13.613   1.599  -3.293
  240    HB3  PHE  53           HB1      PHE  53 -14.985   2.178  -4.232
  241    HD1  PHE  53           HD1      PHE  53 -11.419   2.600  -3.538
  242    HD2  PHE  53           HD2      PHE  53 -14.733   3.953  -5.839
  243    HE1  PHE  53           HE1      PHE  53  -9.881   3.779  -5.054
  244    HE2  PHE  53           HE2      PHE  53 -13.202   5.134  -7.360
  245    HZ   PHE  53           HZ       PHE  53 -10.772   5.048  -6.968
  246    H    GLY  54           HN       GLY  54 -14.700   1.803  -0.447
  247    HA2  GLY  54           HA2      GLY  54 -16.423   1.049   0.908
  248    HA3  GLY  54           HA1      GLY  54 -17.543   2.028  -0.026
  249    H    VAL  55           HN       VAL  55 -15.403  -0.246  -1.566
  250    HA   VAL  55           HA       VAL  55 -17.213  -1.511  -3.143
  251    HB   VAL  55           HB       VAL  55 -14.887  -1.931  -3.458
  252   HG11  VAL  55          HG11      VAL  55 -13.622  -3.390  -1.863
  253   HG12  VAL  55          HG12      VAL  55 -14.958  -3.188  -0.733
  254   HG13  VAL  55          HG13      VAL  55 -14.029  -1.786  -1.255
  255   HG21  VAL  55          HG21      VAL  55 -16.385  -3.701  -4.219
  256   HG22  VAL  55          HG22      VAL  55 -16.241  -4.503  -2.655
  257   HG23  VAL  55          HG23      VAL  55 -14.832  -4.361  -3.706
  258    H    ILE  56           HN       ILE  56 -16.426  -2.343   0.185
  259    HA   ILE  56           HA       ILE  56 -18.981  -3.609   0.527
  260    HB   ILE  56           HB       ILE  56 -17.585  -5.634   1.615
  261   HG12  ILE  56          HG12      ILE  56 -15.989  -6.408  -0.197
  262   HG13  ILE  56          HG11      ILE  56 -16.059  -4.775  -0.846
  263   HG21  ILE  56          HG21      ILE  56 -18.580  -5.499  -1.226
  264   HG22  ILE  56          HG22      ILE  56 -19.555  -5.829   0.206
  265   HG23  ILE  56          HG23      ILE  56 -18.312  -6.973  -0.296
  266   HD11  ILE  56          HD11      ILE  56 -14.082  -5.159   0.540
  267   HD12  ILE  56          HD12      ILE  56 -15.126  -5.500   1.920
  268   HD13  ILE  56          HD13      ILE  56 -15.118  -3.892   1.194
  269    H    GLY  57           HN       GLY  57 -19.156  -1.910   2.011
  270    HA2  GLY  57           HA2      GLY  57 -17.754  -2.437   4.550
  271    HA3  GLY  57           HA1      GLY  57 -17.953  -0.797   3.950
  272    HA   PRO  58           HA       PRO  58 -21.858  -0.482   5.972
  273    HB2  PRO  58           HB2      PRO  58 -23.135   0.724   3.626
  274    HB3  PRO  58           HB1      PRO  58 -22.739   1.457   5.181
  275    HG2  PRO  58           HG2      PRO  58 -21.426   2.101   2.915
  276    HG3  PRO  58           HG1      PRO  58 -20.631   2.087   4.500
  277    HD2  PRO  58           HD2      PRO  58 -20.547   0.034   2.319
  278    HD3  PRO  58           HD1      PRO  58 -19.230   0.638   3.349
  279    H    GLN  59           HN       GLN  59 -24.403  -0.628   5.294
  280    HA   GLN  59           HA       GLN  59 -24.729  -3.097   3.723
  281    HB2  GLN  59           HB2      GLN  59 -26.120  -2.462   6.332
  282    HB3  GLN  59           HB1      GLN  59 -26.383  -3.893   5.347
  283    HG2  GLN  59           HG2      GLN  59 -24.026  -4.533   5.714
  284    HG3  GLN  59           HG1      GLN  59 -23.849  -3.142   6.784
  285   HE21  GLN  59          HE21      GLN  59 -25.273  -6.282   6.369
  286   HE22  GLN  59          HE22      GLN  59 -25.725  -6.522   8.019
  287    H    ARG  60           HN       ARG  60 -25.374  -1.695   1.994
  288    HA   ARG  60           HA       ARG  60 -28.086  -0.600   2.342
  289    HB2  ARG  60           HB2      ARG  60 -27.442   0.879   0.349
  290    HB3  ARG  60           HB1      ARG  60 -26.741   1.270   1.911
  291    HG2  ARG  60           HG2      ARG  60 -24.671   0.126   1.259
  292    HG3  ARG  60           HG1      ARG  60 -25.378  -0.228  -0.318
  293    HD2  ARG  60           HD2      ARG  60 -25.589   2.155  -0.773
  294    HD3  ARG  60           HD1      ARG  60 -24.928   2.530   0.818
  295    HE   ARG  60           HE       ARG  60 -23.084   0.921  -0.522
  296   HH11  ARG  60          HH11      ARG  60 -24.481   4.103  -0.786
  297   HH12  ARG  60          HH12      ARG  60 -23.089   4.791  -1.552
  298   HH21  ARG  60          HH21      ARG  60 -21.247   1.820  -1.536
  299   HH22  ARG  60          HH22      ARG  60 -21.252   3.495  -1.978
  Start of MODEL    5
    1    H1   ARG  28           HT1      ARG  28  26.643  -0.933   0.331
    2    H2   ARG  28           HT2      ARG  28  28.297  -0.602   0.205
    3    H3   ARG  28           HT3      ARG  28  27.238  -0.096  -1.014
    4    HA   ARG  28           HA       ARG  28  27.265   0.878   1.783
    5    HB2  ARG  28           HB2      ARG  28  28.000   3.012   0.783
    6    HB3  ARG  28           HB1      ARG  28  29.162   1.721   0.518
    7    HG2  ARG  28           HG2      ARG  28  28.388   1.451  -1.761
    8    HG3  ARG  28           HG1      ARG  28  27.147   2.679  -1.506
    9    HD2  ARG  28           HD2      ARG  28  29.090   3.584  -2.692
   10    HD3  ARG  28           HD1      ARG  28  28.859   4.361  -1.126
   11    HE   ARG  28           HE       ARG  28  30.646   2.243  -0.787
   12   HH11  ARG  28          HH11      ARG  28  30.489   5.318  -2.420
   13   HH12  ARG  28          HH12      ARG  28  32.194   5.605  -2.317
   14   HH21  ARG  28          HH21      ARG  28  32.891   2.611  -0.651
   15   HH22  ARG  28          HH22      ARG  28  33.560   4.066  -1.313
   16    H    ARG  29           HN       ARG  29  25.157  -0.161  -0.282
   17    HA   ARG  29           HA       ARG  29  23.301   2.079   0.154
   18    HB2  ARG  29           HB2      ARG  29  22.278   1.667  -2.030
   19    HB3  ARG  29           HB1      ARG  29  23.979   2.079  -2.203
   20    HG2  ARG  29           HG2      ARG  29  24.508  -0.312  -2.461
   21    HG3  ARG  29           HG1      ARG  29  22.786  -0.683  -2.356
   22    HD2  ARG  29           HD2      ARG  29  23.478  -0.629  -4.673
   23    HD3  ARG  29           HD1      ARG  29  22.388   0.716  -4.343
   24    HE   ARG  29           HE       ARG  29  25.180   1.375  -4.102
   25   HH11  ARG  29          HH11      ARG  29  22.451   1.148  -6.259
   26   HH12  ARG  29          HH12      ARG  29  23.098   2.279  -7.400
   27   HH21  ARG  29          HH21      ARG  29  26.040   2.859  -5.603
   28   HH22  ARG  29          HH22      ARG  29  25.138   3.249  -7.031
   29    H    CYS  30           HN       CYS  30  21.023   1.439   0.163
   30    HA   CYS  30           HA       CYS  30  20.705  -1.271   1.257
   31    HB2  CYS  30           HB2      CYS  30  18.609  -0.345   2.279
   32    HB3  CYS  30           HB1      CYS  30  20.093   0.404   2.855
   33    HG   CYS  30           HG       CYS  30  17.483   1.780   1.344
   34    H    LEU  31           HN       LEU  31  20.335  -2.462  -0.577
   35    HA   LEU  31           HA       LEU  31  18.373  -1.618  -2.525
   36    HB2  LEU  31           HB2      LEU  31  19.899  -4.210  -2.257
   37    HB3  LEU  31           HB1      LEU  31  18.885  -3.773  -3.618
   38    HG   LEU  31           HG       LEU  31  21.376  -2.284  -2.786
   39   HD11  LEU  31          HD11      LEU  31  20.929  -4.238  -5.038
   40   HD12  LEU  31          HD12      LEU  31  21.920  -4.507  -3.604
   41   HD13  LEU  31          HD13      LEU  31  22.386  -3.280  -4.781
   42   HD21  LEU  31          HD21      LEU  31  19.756  -0.862  -3.910
   43   HD22  LEU  31          HD22      LEU  31  19.611  -2.033  -5.220
   44   HD23  LEU  31          HD23      LEU  31  21.134  -1.180  -4.963
   45    H    PHE  32           HN       PHE  32  18.652  -4.111  -0.025
   46    HA   PHE  32           HA       PHE  32  16.085  -5.247  -0.559
   47    HB2  PHE  32           HB2      PHE  32  17.894  -5.494   1.853
   48    HB3  PHE  32           HB1      PHE  32  16.447  -6.459   1.581
   49    HD1  PHE  32           HD1      PHE  32  16.376  -8.093  -0.257
   50    HD2  PHE  32           HD2      PHE  32  19.930  -5.966   0.722
   51    HE1  PHE  32           HE1      PHE  32  17.701  -9.727  -1.531
   52    HE2  PHE  32           HE2      PHE  32  21.262  -7.596  -0.552
   53    HZ   PHE  32           HZ       PHE  32  20.149  -9.472  -1.690
   54    H    LEU  33           HN       LEU  33  17.351  -3.165   2.032
   55    HA   LEU  33           HA       LEU  33  15.059  -2.841   3.526
   56    HB2  LEU  33           HB2      LEU  33  17.609  -1.603   3.322
   57    HB3  LEU  33           HB1      LEU  33  16.405  -0.331   3.405
   58    HG   LEU  33           HG       LEU  33  15.495  -1.473   5.466
   59   HD11  LEU  33          HD11      LEU  33  18.091  -2.990   5.269
   60   HD12  LEU  33          HD12      LEU  33  16.474  -3.673   5.097
   61   HD13  LEU  33          HD13      LEU  33  16.989  -3.001   6.645
   62   HD21  LEU  33          HD21      LEU  33  17.221  -0.549   6.924
   63   HD22  LEU  33          HD22      LEU  33  16.885   0.534   5.571
   64   HD23  LEU  33          HD23      LEU  33  18.337  -0.468   5.561
   65    H    SER  34           HN       SER  34  16.095  -0.978   0.687
   66    HA   SER  34           HA       SER  34  14.007   0.898   0.723
   67    HB2  SER  34           HB2      SER  34  14.591   1.299  -1.647
   68    HB3  SER  34           HB1      SER  34  16.021   1.234  -0.616
   69    HG   SER  34           HG       SER  34  15.380  -1.218  -1.564
   70    H    LEU  35           HN       LEU  35  14.116  -2.399  -0.323
   71    HA   LEU  35           HA       LEU  35  11.729  -2.233  -1.932
   72    HB2  LEU  35           HB2      LEU  35  13.563  -3.838  -2.398
   73    HB3  LEU  35           HB1      LEU  35  13.189  -4.664  -0.899
   74    HG   LEU  35           HG       LEU  35  10.952  -4.366  -2.818
   75   HD11  LEU  35          HD11      LEU  35  12.793  -4.907  -4.320
   76   HD12  LEU  35          HD12      LEU  35  11.700  -6.280  -4.144
   77   HD13  LEU  35          HD13      LEU  35  13.244  -6.268  -3.293
   78   HD21  LEU  35          HD21      LEU  35  10.691  -5.523  -0.676
   79   HD22  LEU  35          HD22      LEU  35  11.967  -6.652  -1.131
   80   HD23  LEU  35          HD23      LEU  35  10.453  -6.621  -2.036
   81    H    PHE  36           HN       PHE  36  12.471  -2.708   1.385
   82    HA   PHE  36           HA       PHE  36  10.060  -4.123   2.051
   83    HB2  PHE  36           HB2      PHE  36  12.373  -3.017   3.555
   84    HB3  PHE  36           HB1      PHE  36  10.869  -3.250   4.441
   85    HD1  PHE  36           HD1      PHE  36  13.164  -5.067   2.133
   86    HD2  PHE  36           HD2      PHE  36  10.445  -5.299   5.395
   87    HE1  PHE  36           HE1      PHE  36  13.699  -7.453   2.403
   88    HE2  PHE  36           HE2      PHE  36  10.975  -7.685   5.673
   89    HZ   PHE  36           HZ       PHE  36  12.603  -8.766   4.176
   90    H    SER  37           HN       SER  37  10.589  -0.990   1.145
   91    HA   SER  37           HA       SER  37   8.607   0.150   2.969
   92    HB2  SER  37           HB2      SER  37   9.193   2.313   1.919
   93    HB3  SER  37           HB1      SER  37  10.607   1.491   2.579
   94    HG   SER  37           HG       SER  37   9.811   1.364  -0.141
   95    H    PHE  38           HN       PHE  38   9.125  -0.411  -0.490
   96    HA   PHE  38           HA       PHE  38   6.807   0.779  -1.469
   97    HB2  PHE  38           HB2      PHE  38   8.313  -1.633  -2.498
   98    HB3  PHE  38           HB1      PHE  38   7.052  -0.795  -3.398
   99    HD1  PHE  38           HD1      PHE  38   7.415   1.728  -3.817
  100    HD2  PHE  38           HD2      PHE  38  10.516  -0.963  -2.700
  101    HE1  PHE  38           HE1      PHE  38   9.091   3.294  -4.709
  102    HE2  PHE  38           HE2      PHE  38  12.197   0.597  -3.587
  103    HZ   PHE  38           HZ       PHE  38  11.476   2.738  -4.599
  104    H    LEU  39           HN       LEU  39   7.300  -2.366   0.001
  105    HA   LEU  39           HA       LEU  39   4.787  -3.468  -0.715
  106    HB2  LEU  39           HB2      LEU  39   6.863  -4.704   0.073
  107    HB3  LEU  39           HB1      LEU  39   6.425  -4.217   1.699
  108    HG   LEU  39           HG       LEU  39   4.450  -5.697   0.006
  109   HD11  LEU  39          HD11      LEU  39   6.500  -7.003  -0.129
  110   HD12  LEU  39          HD12      LEU  39   5.307  -7.809   0.888
  111   HD13  LEU  39          HD13      LEU  39   6.661  -6.953   1.627
  112   HD21  LEU  39          HD21      LEU  39   3.736  -6.527   2.225
  113   HD22  LEU  39          HD22      LEU  39   3.646  -4.772   2.088
  114   HD23  LEU  39          HD23      LEU  39   4.976  -5.520   2.972
  115    H    ILE  40           HN       ILE  40   5.947  -1.714   2.128
  116    HA   ILE  40           HA       ILE  40   3.614  -1.998   3.683
  117    HB   ILE  40           HB       ILE  40   5.625   0.255   3.758
  118   HG12  ILE  40          HG12      ILE  40   5.548  -2.304   5.373
  119   HG13  ILE  40          HG11      ILE  40   6.613  -2.025   3.999
  120   HG21  ILE  40          HG21      ILE  40   3.660  -0.716   5.829
  121   HG22  ILE  40          HG22      ILE  40   3.571   0.802   4.936
  122   HG23  ILE  40          HG23      ILE  40   4.883   0.529   6.083
  123   HD11  ILE  40          HD11      ILE  40   7.679  -0.188   5.200
  124   HD12  ILE  40          HD12      ILE  40   7.779  -1.701   6.101
  125   HD13  ILE  40          HD13      ILE  40   6.610  -0.468   6.574
  126    H    VAL  41           HN       VAL  41   4.508   0.239   1.147
  127    HA   VAL  41           HA       VAL  41   2.361   2.074   1.665
  128    HB   VAL  41           HB       VAL  41   4.170   1.785  -0.737
  129   HG11  VAL  41          HG11      VAL  41   3.383   4.054  -1.337
  130   HG12  VAL  41          HG12      VAL  41   2.179   3.947  -0.052
  131   HG13  VAL  41          HG13      VAL  41   2.105   2.841  -1.423
  132   HG21  VAL  41          HG21      VAL  41   5.334   2.415   1.307
  133   HG22  VAL  41          HG22      VAL  41   4.197   3.738   1.560
  134   HG23  VAL  41          HG23      VAL  41   5.284   3.762   0.172
  135    H    LEU  42           HN       LEU  42   3.000  -0.325  -0.907
  136    HA   LEU  42           HA       LEU  42   0.535   0.042  -2.210
  137    HB2  LEU  42           HB2      LEU  42   1.012  -2.025  -3.388
  138    HB3  LEU  42           HB1      LEU  42   2.440  -1.002  -3.309
  139    HG   LEU  42           HG       LEU  42   2.976  -2.515  -1.198
  140   HD11  LEU  42          HD11      LEU  42   1.292  -4.322  -2.926
  141   HD12  LEU  42          HD12      LEU  42   0.874  -3.761  -1.308
  142   HD13  LEU  42          HD13      LEU  42   2.268  -4.817  -1.542
  143   HD21  LEU  42          HD21      LEU  42   4.303  -3.951  -2.669
  144   HD22  LEU  42          HD22      LEU  42   4.391  -2.260  -3.164
  145   HD23  LEU  42          HD23      LEU  42   3.371  -3.387  -4.058
  146    H    LEU  43           HN       LEU  43   1.490  -2.007   0.469
  147    HA   LEU  43           HA       LEU  43  -0.892  -3.580   0.473
  148    HB2  LEU  43           HB2      LEU  43   1.188  -4.373   1.498
  149    HB3  LEU  43           HB1      LEU  43   1.113  -3.075   2.674
  150    HG   LEU  43           HG       LEU  43  -0.997  -4.041   3.559
  151   HD11  LEU  43          HD11      LEU  43  -1.605  -6.327   2.916
  152   HD12  LEU  43          HD12      LEU  43  -0.369  -6.296   1.658
  153   HD13  LEU  43          HD13      LEU  43  -1.751  -5.204   1.564
  154   HD21  LEU  43          HD21      LEU  43   1.364  -5.916   3.514
  155   HD22  LEU  43          HD22      LEU  43   0.053  -5.933   4.694
  156   HD23  LEU  43          HD23      LEU  43   1.144  -4.550   4.607
  157    H    LEU  44           HN       LEU  44   0.012  -0.487   1.729
  158    HA   LEU  44           HA       LEU  44  -2.131  -0.294   3.628
  159    HB2  LEU  44           HB2      LEU  44  -0.397   1.073   4.253
  160    HB3  LEU  44           HB1      LEU  44   0.030   1.470   2.601
  161    HG   LEU  44           HG       LEU  44  -1.975   2.941   2.495
  162   HD11  LEU  44          HD11      LEU  44  -2.106   2.399   5.458
  163   HD12  LEU  44          HD12      LEU  44  -3.295   1.895   4.258
  164   HD13  LEU  44          HD13      LEU  44  -3.047   3.609   4.589
  165   HD21  LEU  44          HD21      LEU  44   0.253   3.837   2.944
  166   HD22  LEU  44          HD22      LEU  44   0.009   3.582   4.672
  167   HD23  LEU  44          HD23      LEU  44  -0.990   4.746   3.803
  168    H    THR  45           HN       THR  45  -1.499   0.804   0.333
  169    HA   THR  45           HA       THR  45  -3.907   2.299   0.076
  170    HB   THR  45           HB       THR  45  -3.413   2.037  -2.434
  171    HG1  THR  45           HG1      THR  45  -0.822   1.498  -2.120
  172   HG21  THR  45          HG21      THR  45  -1.324   3.282  -0.642
  173   HG22  THR  45          HG22      THR  45  -2.845   4.033  -1.131
  174   HG23  THR  45          HG23      THR  45  -1.607   3.679  -2.337
  175    H    THR  46           HN       THR  46  -3.095  -1.062  -0.295
  176    HA   THR  46           HA       THR  46  -5.219  -1.849  -1.970
  177    HB   THR  46           HB       THR  46  -3.816  -3.465   0.172
  178    HG1  THR  46           HG1      THR  46  -2.967  -2.527  -2.178
  179   HG21  THR  46          HG21      THR  46  -4.598  -5.423  -1.076
  180   HG22  THR  46          HG22      THR  46  -5.482  -4.370  -2.181
  181   HG23  THR  46          HG23      THR  46  -5.955  -4.464  -0.485
  182    H    LEU  47           HN       LEU  47  -4.928  -1.984   1.582
  183    HA   LEU  47           HA       LEU  47  -7.652  -2.719   1.961
  184    HB2  LEU  47           HB2      LEU  47  -5.334  -2.006   3.673
  185    HB3  LEU  47           HB1      LEU  47  -6.925  -1.842   4.376
  186    HG   LEU  47           HG       LEU  47  -7.377  -4.220   3.881
  187   HD11  LEU  47          HD11      LEU  47  -4.491  -4.293   3.012
  188   HD12  LEU  47          HD12      LEU  47  -5.890  -4.447   1.949
  189   HD13  LEU  47          HD13      LEU  47  -5.571  -5.679   3.169
  190   HD21  LEU  47          HD21      LEU  47  -5.915  -5.143   5.592
  191   HD22  LEU  47          HD22      LEU  47  -6.487  -3.543   6.061
  192   HD23  LEU  47          HD23      LEU  47  -4.846  -3.749   5.451
  193    H    PHE  48           HN       PHE  48  -5.836   0.285   1.996
  194    HA   PHE  48           HA       PHE  48  -7.825   1.942   3.114
  195    HB2  PHE  48           HB2      PHE  48  -5.452   2.590   2.939
  196    HB3  PHE  48           HB1      PHE  48  -5.605   2.658   1.187
  197    HD1  PHE  48           HD1      PHE  48  -6.331   4.603   0.123
  198    HD2  PHE  48           HD2      PHE  48  -6.853   4.183   4.325
  199    HE1  PHE  48           HE1      PHE  48  -7.019   6.960   0.271
  200    HE2  PHE  48           HE2      PHE  48  -7.542   6.538   4.482
  201    HZ   PHE  48           HZ       PHE  48  -7.606   7.938   2.448
  202    H    CYS  49           HN       CYS  49  -7.250   0.764  -0.123
  203    HA   CYS  49           HA       CYS  49  -9.060   2.581  -1.402
  204    HB2  CYS  49           HB2      CYS  49  -7.223   1.592  -2.662
  205    HB3  CYS  49           HB1      CYS  49  -7.854  -0.023  -2.362
  206    HG   CYS  49           HG       CYS  49  -8.481   0.372  -4.957
  207    H    LEU  50           HN       LEU  50  -9.203  -0.807  -0.364
  208    HA   LEU  50           HA       LEU  50 -11.778  -1.379  -1.323
  209    HB2  LEU  50           HB2      LEU  50 -10.327  -2.523   1.070
  210    HB3  LEU  50           HB1      LEU  50 -11.764  -3.220   0.329
  211    HG   LEU  50           HG       LEU  50  -9.197  -2.829  -1.201
  212   HD11  LEU  50          HD11      LEU  50  -8.688  -5.166  -0.758
  213   HD12  LEU  50          HD12      LEU  50 -10.092  -5.286   0.302
  214   HD13  LEU  50          HD13      LEU  50  -8.739  -4.243   0.743
  215   HD21  LEU  50          HD21      LEU  50 -11.594  -4.607  -1.630
  216   HD22  LEU  50          HD22      LEU  50 -10.160  -4.541  -2.654
  217   HD23  LEU  50          HD23      LEU  50 -11.220  -3.136  -2.528
  218    H    LEU  51           HN       LEU  51 -10.654   0.190   1.587
  219    HA   LEU  51           HA       LEU  51 -13.232   0.177   2.872
  220    HB2  LEU  51           HB2      LEU  51 -10.672   1.645   3.502
  221    HB3  LEU  51           HB1      LEU  51 -12.109   1.700   4.504
  222    HG   LEU  51           HG       LEU  51 -10.547  -0.809   3.885
  223   HD11  LEU  51          HD11      LEU  51  -9.761  -0.662   6.190
  224   HD12  LEU  51          HD12      LEU  51 -10.596   0.879   6.383
  225   HD13  LEU  51          HD13      LEU  51  -9.249   0.742   5.253
  226   HD21  LEU  51          HD21      LEU  51 -12.904  -1.230   4.340
  227   HD22  LEU  51          HD22      LEU  51 -12.798  -0.283   5.823
  228   HD23  LEU  51          HD23      LEU  51 -11.898  -1.792   5.675
  229    H    HIS  52           HN       HIS  52 -11.460   2.268   0.745
  230    HA   HIS  52           HA       HIS  52 -12.983   4.630   1.280
  231    HB2  HIS  52           HB2      HIS  52 -10.618   4.464   0.272
  232    HB3  HIS  52           HB1      HIS  52 -11.436   4.118  -1.249
  233    HD1  HIS  52           HD1      HIS  52 -12.544   6.070  -2.461
  234    HD2  HIS  52           HD2      HIS  52 -10.980   7.101   1.247
  235    HE1  HIS  52           HE1      HIS  52 -12.626   8.582  -2.370
  236    HE2  HIS  52           HE2      HIS  52 -11.561   9.184  -0.169
  237    H    PHE  53           HN       PHE  53 -13.214   1.972  -1.006
  238    HA   PHE  53           HA       PHE  53 -15.454   3.274  -2.361
  239    HB2  PHE  53           HB2      PHE  53 -13.844   0.802  -2.976
  240    HB3  PHE  53           HB1      PHE  53 -15.323   1.197  -3.842
  241    HD1  PHE  53           HD1      PHE  53 -15.373   3.722  -4.722
  242    HD2  PHE  53           HD2      PHE  53 -11.867   1.448  -3.925
  243    HE1  PHE  53           HE1      PHE  53 -14.094   5.169  -6.247
  244    HE2  PHE  53           HE2      PHE  53 -10.580   2.891  -5.448
  245    HZ   PHE  53           HZ       PHE  53 -11.693   4.752  -6.612
  246    H    GLY  54           HN       GLY  54 -14.787   0.850  -0.016
  247    HA2  GLY  54           HA2      GLY  54 -16.180  -0.421   1.292
  248    HA3  GLY  54           HA1      GLY  54 -17.506   0.568   0.701
  249    H    VAL  55           HN       VAL  55 -15.471  -1.218  -1.494
  250    HA   VAL  55           HA       VAL  55 -17.549  -2.454  -2.836
  251    HB   VAL  55           HB       VAL  55 -15.704  -4.109  -3.567
  252   HG11  VAL  55          HG11      VAL  55 -14.695  -2.403  -5.028
  253   HG12  VAL  55          HG12      VAL  55 -15.427  -1.144  -4.032
  254   HG13  VAL  55          HG13      VAL  55 -16.451  -2.258  -4.939
  255   HG21  VAL  55          HG21      VAL  55 -13.999  -2.063  -2.153
  256   HG22  VAL  55          HG22      VAL  55 -13.432  -3.424  -3.122
  257   HG23  VAL  55          HG23      VAL  55 -14.264  -3.714  -1.595
  258    H    ILE  56           HN       ILE  56 -15.617  -3.633  -0.137
  259    HA   ILE  56           HA       ILE  56 -17.605  -5.753   0.263
  260    HB   ILE  56           HB       ILE  56 -15.483  -7.053   1.199
  261   HG12  ILE  56          HG12      ILE  56 -13.610  -6.800  -0.453
  262   HG13  ILE  56          HG11      ILE  56 -14.399  -5.344  -1.046
  263   HG21  ILE  56          HG21      ILE  56 -15.441  -8.312  -0.904
  264   HG22  ILE  56          HG22      ILE  56 -16.318  -7.004  -1.699
  265   HG23  ILE  56          HG23      ILE  56 -17.088  -7.925  -0.405
  266   HD11  ILE  56          HD11      ILE  56 -13.395  -5.774   1.756
  267   HD12  ILE  56          HD12      ILE  56 -14.147  -4.304   1.136
  268   HD13  ILE  56          HD13      ILE  56 -12.589  -4.835   0.501
  269    H    GLY  57           HN       GLY  57 -16.222  -3.106   1.473
  270    HA2  GLY  57           HA2      GLY  57 -16.805  -3.925   4.233
  271    HA3  GLY  57           HA1      GLY  57 -15.271  -3.141   3.886
  272    HA   PRO  58           HA       PRO  58 -18.697   0.201   3.051
  273    HB2  PRO  58           HB2      PRO  58 -21.092  -0.958   4.303
  274    HB3  PRO  58           HB1      PRO  58 -20.910  -0.201   2.718
  275    HG2  PRO  58           HG2      PRO  58 -21.297  -2.845   2.985
  276    HG3  PRO  58           HG1      PRO  58 -20.274  -2.172   1.701
  277    HD2  PRO  58           HD2      PRO  58 -19.471  -3.425   4.303
  278    HD3  PRO  58           HD1      PRO  58 -18.761  -3.634   2.687
  279    H    GLN  59           HN       GLN  59 -17.659   1.400   4.574
  280    HA   GLN  59           HA       GLN  59 -17.948   0.929   7.386
  281    HB2  GLN  59           HB2      GLN  59 -16.748   3.234   5.845
  282    HB3  GLN  59           HB1      GLN  59 -16.696   3.090   7.597
  283    HG2  GLN  59           HG2      GLN  59 -15.392   1.067   7.433
  284    HG3  GLN  59           HG1      GLN  59 -15.521   1.094   5.675
  285   HE21  GLN  59          HE21      GLN  59 -15.205   3.994   5.544
  286   HE22  GLN  59          HE22      GLN  59 -13.530   4.305   5.830
  287    H    ARG  60           HN       ARG  60 -19.959   2.299   5.126
  288    HA   ARG  60           HA       ARG  60 -20.994   4.488   6.647
  289    HB2  ARG  60           HB2      ARG  60 -21.170   4.362   4.180
  290    HB3  ARG  60           HB1      ARG  60 -22.259   2.992   4.344
  291    HG2  ARG  60           HG2      ARG  60 -23.857   4.414   5.538
  292    HG3  ARG  60           HG1      ARG  60 -22.768   5.787   5.343
  293    HD2  ARG  60           HD2      ARG  60 -22.939   5.533   2.894
  294    HD3  ARG  60           HD1      ARG  60 -24.090   4.217   3.132
  295    HE   ARG  60           HE       ARG  60 -24.878   6.635   4.447
  296   HH11  ARG  60          HH11      ARG  60 -24.874   4.939   1.404
  297   HH12  ARG  60          HH12      ARG  60 -26.265   5.771   0.792
  298   HH21  ARG  60          HH21      ARG  60 -26.705   7.738   3.647
  299   HH22  ARG  60          HH22      ARG  60 -27.302   7.362   2.065
  Start of MODEL    6
    1    H1   ARG  28           HT1      ARG  28  23.264   5.675   4.170
    2    H2   ARG  28           HT2      ARG  28  23.001   6.442   2.686
    3    H3   ARG  28           HT3      ARG  28  24.534   6.486   3.399
    4    HA   ARG  28           HA       ARG  28  24.444   4.914   1.564
    5    HB2  ARG  28           HB2      ARG  28  24.733   3.606   4.276
    6    HB3  ARG  28           HB1      ARG  28  25.410   3.009   2.767
    7    HG2  ARG  28           HG2      ARG  28  26.122   5.652   4.017
    8    HG3  ARG  28           HG1      ARG  28  27.047   4.163   4.224
    9    HD2  ARG  28           HD2      ARG  28  27.414   4.060   1.806
   10    HD3  ARG  28           HD1      ARG  28  26.487   5.545   1.600
   11    HE   ARG  28           HE       ARG  28  28.348   6.408   3.250
   12   HH11  ARG  28          HH11      ARG  28  28.680   4.310   0.487
   13   HH12  ARG  28          HH12      ARG  28  30.303   4.809   0.142
   14   HH21  ARG  28          HH21      ARG  28  30.483   7.069   2.804
   15   HH22  ARG  28          HH22      ARG  28  31.327   6.376   1.460
   16    H    ARG  29           HN       ARG  29  21.747   5.309   1.727
   17    HA   ARG  29           HA       ARG  29  20.216   3.137   2.616
   18    HB2  ARG  29           HB2      ARG  29  19.628   4.944   0.265
   19    HB3  ARG  29           HB1      ARG  29  18.460   3.980   1.156
   20    HG2  ARG  29           HG2      ARG  29  18.953   5.318   3.175
   21    HG3  ARG  29           HG1      ARG  29  20.028   6.328   2.203
   22    HD2  ARG  29           HD2      ARG  29  18.107   6.857   0.726
   23    HD3  ARG  29           HD1      ARG  29  17.062   5.947   1.815
   24    HE   ARG  29           HE       ARG  29  18.520   7.971   3.191
   25   HH11  ARG  29          HH11      ARG  29  15.753   7.413   1.148
   26   HH12  ARG  29          HH12      ARG  29  14.891   8.804   1.718
   27   HH21  ARG  29          HH21      ARG  29  17.393   9.806   3.944
   28   HH22  ARG  29          HH22      ARG  29  15.824  10.164   3.305
   29    H    CYS  30           HN       CYS  30  19.975   1.129   1.884
   30    HA   CYS  30           HA       CYS  30  21.394   0.303  -0.502
   31    HB2  CYS  30           HB2      CYS  30  19.760  -1.318   1.463
   32    HB3  CYS  30           HB1      CYS  30  20.787  -1.976   0.196
   33    HG   CYS  30           HG       CYS  30  21.581  -1.058   3.256
   34    H    LEU  31           HN       LEU  31  20.453  -0.824  -2.251
   35    HA   LEU  31           HA       LEU  31  18.007   0.269  -3.169
   36    HB2  LEU  31           HB2      LEU  31  19.512  -2.119  -4.241
   37    HB3  LEU  31           HB1      LEU  31  18.289  -1.198  -5.095
   38    HG   LEU  31           HG       LEU  31  20.986  -0.146  -4.233
   39   HD11  LEU  31          HD11      LEU  31  19.943  -0.850  -6.973
   40   HD12  LEU  31          HD12      LEU  31  21.127  -1.778  -6.052
   41   HD13  LEU  31          HD13      LEU  31  21.520  -0.150  -6.604
   42   HD21  LEU  31          HD21      LEU  31  19.309   1.607  -4.234
   43   HD22  LEU  31          HD22      LEU  31  18.786   1.135  -5.851
   44   HD23  LEU  31          HD23      LEU  31  20.399   1.806  -5.606
   45    H    PHE  32           HN       PHE  32  18.760  -2.449  -1.243
   46    HA   PHE  32           HA       PHE  32  16.306  -3.873  -1.844
   47    HB2  PHE  32           HB2      PHE  32  18.473  -4.388   0.202
   48    HB3  PHE  32           HB1      PHE  32  17.088  -5.440  -0.072
   49    HD1  PHE  32           HD1      PHE  32  16.883  -6.689  -2.185
   50    HD2  PHE  32           HD2      PHE  32  20.341  -4.385  -1.267
   51    HE1  PHE  32           HE1      PHE  32  18.134  -7.871  -3.944
   52    HE2  PHE  32           HE2      PHE  32  21.597  -5.562  -3.023
   53    HZ   PHE  32           HZ       PHE  32  20.491  -7.319  -4.358
   54    H    LEU  33           HN       LEU  33  17.696  -1.993   0.811
   55    HA   LEU  33           HA       LEU  33  15.533  -2.337   2.603
   56    HB2  LEU  33           HB2      LEU  33  17.541  -0.097   2.465
   57    HB3  LEU  33           HB1      LEU  33  16.503  -0.458   3.830
   58    HG   LEU  33           HG       LEU  33  18.813  -2.093   2.794
   59   HD11  LEU  33          HD11      LEU  33  19.671  -1.757   5.053
   60   HD12  LEU  33          HD12      LEU  33  18.239  -0.809   5.455
   61   HD13  LEU  33          HD13      LEU  33  19.375  -0.218   4.242
   62   HD21  LEU  33          HD21      LEU  33  16.766  -2.841   4.882
   63   HD22  LEU  33          HD22      LEU  33  18.278  -3.700   4.589
   64   HD23  LEU  33          HD23      LEU  33  17.038  -3.647   3.336
   65    H    SER  34           HN       SER  34  16.055  -0.242  -0.104
   66    HA   SER  34           HA       SER  34  14.021   1.659   0.633
   67    HB2  SER  34           HB2      SER  34  14.402   2.592  -1.625
   68    HB3  SER  34           HB1      SER  34  15.914   2.375  -0.743
   69    HG   SER  34           HG       SER  34  15.876   1.622  -2.989
   70    H    LEU  35           HN       LEU  35  14.233  -1.262  -1.264
   71    HA   LEU  35           HA       LEU  35  11.686  -0.926  -2.552
   72    HB2  LEU  35           HB2      LEU  35  13.901  -2.525  -2.964
   73    HB3  LEU  35           HB1      LEU  35  12.709  -3.658  -2.359
   74    HG   LEU  35           HG       LEU  35  12.689  -3.621  -4.784
   75   HD11  LEU  35          HD11      LEU  35  10.322  -3.175  -5.161
   76   HD12  LEU  35          HD12      LEU  35  10.237  -2.302  -3.631
   77   HD13  LEU  35          HD13      LEU  35  10.579  -4.032  -3.641
   78   HD21  LEU  35          HD21      LEU  35  12.006  -0.695  -4.531
   79   HD22  LEU  35          HD22      LEU  35  12.055  -1.626  -6.028
   80   HD23  LEU  35          HD23      LEU  35  13.536  -1.353  -5.111
   81    H    PHE  36           HN       PHE  36  12.637  -1.764   0.550
   82    HA   PHE  36           HA       PHE  36  10.569  -3.683   1.107
   83    HB2  PHE  36           HB2      PHE  36  12.760  -3.595   2.321
   84    HB3  PHE  36           HB1      PHE  36  12.226  -2.096   3.074
   85    HD1  PHE  36           HD1      PHE  36  11.532  -5.709   2.794
   86    HD2  PHE  36           HD2      PHE  36  10.770  -2.106   4.926
   87    HE1  PHE  36           HE1      PHE  36  10.426  -7.001   4.574
   88    HE2  PHE  36           HE2      PHE  36   9.664  -3.390   6.708
   89    HZ   PHE  36           HZ       PHE  36   9.499  -5.850   6.532
   90    H    SER  37           HN       SER  37  10.818  -0.251   1.055
   91    HA   SER  37           HA       SER  37   8.685   0.290   2.885
   92    HB2  SER  37           HB2      SER  37   9.977   2.019   0.764
   93    HB3  SER  37           HB1      SER  37   8.795   2.597   1.938
   94    HG   SER  37           HG       SER  37  10.885   1.231   3.066
   95    H    PHE  38           HN       PHE  38   8.967   0.027  -0.625
   96    HA   PHE  38           HA       PHE  38   6.420   0.894  -1.344
   97    HB2  PHE  38           HB2      PHE  38   8.178  -1.189  -2.652
   98    HB3  PHE  38           HB1      PHE  38   6.749  -0.482  -3.398
   99    HD1  PHE  38           HD1      PHE  38   6.822   1.647  -4.418
  100    HD2  PHE  38           HD2      PHE  38  10.147   0.252  -2.160
  101    HE1  PHE  38           HE1      PHE  38   8.185   3.499  -5.289
  102    HE2  PHE  38           HE2      PHE  38  11.518   2.102  -3.028
  103    HZ   PHE  38           HZ       PHE  38  10.538   3.730  -4.594
  104    H    LEU  39           HN       LEU  39   7.459  -2.103   0.063
  105    HA   LEU  39           HA       LEU  39   5.110  -3.586  -0.626
  106    HB2  LEU  39           HB2      LEU  39   7.407  -4.525  -0.079
  107    HB3  LEU  39           HB1      LEU  39   7.034  -4.210   1.604
  108    HG   LEU  39           HG       LEU  39   5.144  -5.852  -0.019
  109   HD11  LEU  39          HD11      LEU  39   7.708  -6.861   1.206
  110   HD12  LEU  39          HD12      LEU  39   7.308  -6.831  -0.512
  111   HD13  LEU  39          HD13      LEU  39   6.404  -7.874   0.586
  112   HD21  LEU  39          HD21      LEU  39   6.003  -5.905   2.872
  113   HD22  LEU  39          HD22      LEU  39   4.769  -6.933   2.145
  114   HD23  LEU  39          HD23      LEU  39   4.519  -5.190   2.244
  115    H    ILE  40           HN       ILE  40   6.267  -1.999   2.344
  116    HA   ILE  40           HA       ILE  40   4.125  -2.674   3.999
  117    HB   ILE  40           HB       ILE  40   5.705  -0.100   4.083
  118   HG12  ILE  40          HG12      ILE  40   6.263  -2.713   5.505
  119   HG13  ILE  40          HG11      ILE  40   7.108  -2.178   4.055
  120   HG21  ILE  40          HG21      ILE  40   5.146  -0.113   6.470
  121   HG22  ILE  40          HG22      ILE  40   4.175  -1.565   6.232
  122   HG23  ILE  40          HG23      ILE  40   3.699  -0.051   5.464
  123   HD11  ILE  40          HD11      ILE  40   7.098  -0.763   6.712
  124   HD12  ILE  40          HD12      ILE  40   7.955  -0.239   5.262
  125   HD13  ILE  40          HD13      ILE  40   8.409  -1.744   6.060
  126    H    VAL  41           HN       VAL  41   4.435  -0.187   1.563
  127    HA   VAL  41           HA       VAL  41   1.990   1.156   2.313
  128    HB   VAL  41           HB       VAL  41   3.645   1.469  -0.198
  129   HG11  VAL  41          HG11      VAL  41   1.382   2.321  -0.457
  130   HG12  VAL  41          HG12      VAL  41   2.535   3.652  -0.376
  131   HG13  VAL  41          HG13      VAL  41   1.545   3.256   1.029
  132   HG21  VAL  41          HG21      VAL  41   4.647   3.396   0.899
  133   HG22  VAL  41          HG22      VAL  41   4.948   1.922   1.820
  134   HG23  VAL  41          HG23      VAL  41   3.716   3.063   2.360
  135    H    LEU  42           HN       LEU  42   3.004  -1.325   0.098
  136    HA   LEU  42           HA       LEU  42   0.826  -1.266  -1.677
  137    HB2  LEU  42           HB2      LEU  42   3.110  -2.560  -1.737
  138    HB3  LEU  42           HB1      LEU  42   2.189  -3.824  -0.935
  139    HG   LEU  42           HG       LEU  42   2.359  -4.161  -3.371
  140   HD11  LEU  42          HD11      LEU  42  -0.454  -3.570  -2.472
  141   HD12  LEU  42          HD12      LEU  42   0.443  -5.045  -2.112
  142   HD13  LEU  42          HD13      LEU  42   0.031  -4.648  -3.780
  143   HD21  LEU  42          HD21      LEU  42   2.416  -1.821  -4.062
  144   HD22  LEU  42          HD22      LEU  42   0.735  -1.627  -3.565
  145   HD23  LEU  42          HD23      LEU  42   1.141  -2.705  -4.900
  146    H    LEU  43           HN       LEU  43   1.388  -3.188   1.265
  147    HA   LEU  43           HA       LEU  43  -1.036  -4.605   1.196
  148    HB2  LEU  43           HB2      LEU  43   0.924  -3.941   3.358
  149    HB3  LEU  43           HB1      LEU  43  -0.596  -4.707   3.771
  150    HG   LEU  43           HG       LEU  43   1.173  -6.361   3.569
  151   HD11  LEU  43          HD11      LEU  43  -1.112  -6.992   2.949
  152   HD12  LEU  43          HD12      LEU  43   0.093  -7.888   2.024
  153   HD13  LEU  43          HD13      LEU  43  -0.774  -6.547   1.275
  154   HD21  LEU  43          HD21      LEU  43   2.614  -5.176   1.996
  155   HD22  LEU  43          HD22      LEU  43   1.428  -5.422   0.714
  156   HD23  LEU  43          HD23      LEU  43   2.256  -6.806   1.428
  157    H    LEU  44           HN       LEU  44  -0.187  -1.525   2.743
  158    HA   LEU  44           HA       LEU  44  -2.628  -1.155   4.096
  159    HB2  LEU  44           HB2      LEU  44  -0.537   0.778   3.132
  160    HB3  LEU  44           HB1      LEU  44  -1.970   1.311   3.987
  161    HG   LEU  44           HG       LEU  44   0.147  -0.548   5.075
  162   HD11  LEU  44          HD11      LEU  44   0.947   1.720   4.920
  163   HD12  LEU  44          HD12      LEU  44   0.601   1.338   6.607
  164   HD13  LEU  44          HD13      LEU  44  -0.526   2.326   5.676
  165   HD21  LEU  44          HD21      LEU  44  -1.060  -0.304   7.206
  166   HD22  LEU  44          HD22      LEU  44  -2.032  -1.115   5.977
  167   HD23  LEU  44          HD23      LEU  44  -2.336   0.579   6.367
  168    H    THR  45           HN       THR  45  -1.563  -0.100   0.873
  169    HA   THR  45           HA       THR  45  -3.800   1.468   0.255
  170    HB   THR  45           HB       THR  45  -3.213   0.954  -2.163
  171    HG1  THR  45           HG1      THR  45  -0.811  -0.147  -1.238
  172   HG21  THR  45          HG21      THR  45  -1.094   2.220  -2.059
  173   HG22  THR  45          HG22      THR  45  -1.056   1.973  -0.313
  174   HG23  THR  45          HG23      THR  45  -2.353   2.921  -1.043
  175    H    THR  46           HN       THR  46  -3.444  -1.960   0.401
  176    HA   THR  46           HA       THR  46  -5.513  -2.706  -1.369
  177    HB   THR  46           HB       THR  46  -4.557  -4.185   1.092
  178    HG1  THR  46           HG1      THR  46  -3.179  -5.243  -0.397
  179   HG21  THR  46          HG21      THR  46  -5.413  -6.177  -0.050
  180   HG22  THR  46          HG22      THR  46  -6.009  -5.170  -1.367
  181   HG23  THR  46          HG23      THR  46  -6.703  -5.012   0.246
  182    H    LEU  47           HN       LEU  47  -5.540  -2.545   2.199
  183    HA   LEU  47           HA       LEU  47  -8.388  -2.758   2.311
  184    HB2  LEU  47           HB2      LEU  47  -6.150  -2.520   4.242
  185    HB3  LEU  47           HB1      LEU  47  -7.740  -2.045   4.792
  186    HG   LEU  47           HG       LEU  47  -8.599  -4.285   4.197
  187   HD11  LEU  47          HD11      LEU  47  -7.012  -4.810   2.423
  188   HD12  LEU  47          HD12      LEU  47  -7.032  -6.072   3.656
  189   HD13  LEU  47          HD13      LEU  47  -5.710  -4.905   3.609
  190   HD21  LEU  47          HD21      LEU  47  -7.855  -3.828   6.473
  191   HD22  LEU  47          HD22      LEU  47  -6.211  -4.295   6.039
  192   HD23  LEU  47          HD23      LEU  47  -7.504  -5.495   6.019
  193    H    PHE  48           HN       PHE  48  -6.139  -0.168   2.046
  194    HA   PHE  48           HA       PHE  48  -7.826   1.835   3.224
  195    HB2  PHE  48           HB2      PHE  48  -5.415   2.141   3.251
  196    HB3  PHE  48           HB1      PHE  48  -5.356   2.093   1.495
  197    HD1  PHE  48           HD1      PHE  48  -5.762   4.023   0.210
  198    HD2  PHE  48           HD2      PHE  48  -6.553   4.050   4.391
  199    HE1  PHE  48           HE1      PHE  48  -6.055   6.464   0.135
  200    HE2  PHE  48           HE2      PHE  48  -6.849   6.492   4.323
  201    HZ   PHE  48           HZ       PHE  48  -6.619   7.700   2.200
  202    H    CYS  49           HN       CYS  49  -7.204   0.637  -0.024
  203    HA   CYS  49           HA       CYS  49  -8.692   2.716  -1.320
  204    HB2  CYS  49           HB2      CYS  49  -7.614   0.063  -2.262
  205    HB3  CYS  49           HB1      CYS  49  -8.560   1.117  -3.306
  206    HG   CYS  49           HG       CYS  49  -6.177   1.823  -4.190
  207    H    LEU  50           HN       LEU  50  -9.360  -0.562  -0.228
  208    HA   LEU  50           HA       LEU  50 -11.855  -0.923  -1.442
  209    HB2  LEU  50           HB2      LEU  50 -10.755  -2.009   1.151
  210    HB3  LEU  50           HB1      LEU  50 -12.262  -2.556   0.421
  211    HG   LEU  50           HG       LEU  50  -9.616  -2.713  -1.014
  212   HD11  LEU  50          HD11      LEU  50  -9.495  -5.042  -0.345
  213   HD12  LEU  50          HD12      LEU  50 -10.955  -4.860   0.626
  214   HD13  LEU  50          HD13      LEU  50  -9.484  -3.996   1.073
  215   HD21  LEU  50          HD21      LEU  50 -11.616  -2.814  -2.411
  216   HD22  LEU  50          HD22      LEU  50 -12.247  -4.129  -1.420
  217   HD23  LEU  50          HD23      LEU  50 -10.783  -4.369  -2.374
  218    H    LEU  51           HN       LEU  51 -10.940   0.738   1.515
  219    HA   LEU  51           HA       LEU  51 -13.660   1.120   2.386
  220    HB2  LEU  51           HB2      LEU  51 -11.080   2.370   3.329
  221    HB3  LEU  51           HB1      LEU  51 -12.637   2.585   4.106
  222    HG   LEU  51           HG       LEU  51 -11.236  -0.073   3.806
  223   HD11  LEU  51          HD11      LEU  51  -9.962   1.378   5.266
  224   HD12  LEU  51          HD12      LEU  51 -10.779   0.134   6.211
  225   HD13  LEU  51          HD13      LEU  51 -11.418   1.777   6.178
  226   HD21  LEU  51          HD21      LEU  51 -13.670   0.764   5.379
  227   HD22  LEU  51          HD22      LEU  51 -12.891  -0.816   5.469
  228   HD23  LEU  51          HD23      LEU  51 -13.646  -0.290   3.965
  229    H    HIS  52           HN       HIS  52 -11.361   2.827   0.429
  230    HA   HIS  52           HA       HIS  52 -12.659   5.377   0.604
  231    HB2  HIS  52           HB2      HIS  52 -10.232   5.084   0.084
  232    HB3  HIS  52           HB1      HIS  52 -10.691   4.418  -1.479
  233    HD1  HIS  52           HD1      HIS  52 -10.539   7.630   0.432
  234    HD2  HIS  52           HD2      HIS  52 -11.542   6.294  -3.373
  235    HE1  HIS  52           HE1      HIS  52 -10.735   9.703  -0.979
  236    HE2  HIS  52           HE2      HIS  52 -11.387   8.873  -3.267
  237    H    PHE  53           HN       PHE  53 -12.897   2.580  -1.480
  238    HA   PHE  53           HA       PHE  53 -14.735   4.029  -3.248
  239    HB2  PHE  53           HB2      PHE  53 -13.258   1.421  -3.564
  240    HB3  PHE  53           HB1      PHE  53 -14.553   1.905  -4.652
  241    HD1  PHE  53           HD1      PHE  53 -14.299   4.035  -5.961
  242    HD2  PHE  53           HD2      PHE  53 -11.078   2.247  -3.831
  243    HE1  PHE  53           HE1      PHE  53 -12.697   5.329  -7.307
  244    HE2  PHE  53           HE2      PHE  53  -9.469   3.539  -5.172
  245    HZ   PHE  53           HZ       PHE  53 -10.278   5.082  -6.913
  246    H    GLY  54           HN       GLY  54 -14.688   1.797  -0.680
  247    HA2  GLY  54           HA2      GLY  54 -16.383   0.704   0.422
  248    HA3  GLY  54           HA1      GLY  54 -17.508   1.672  -0.520
  249    H    VAL  55           HN       VAL  55 -15.161  -0.392  -2.059
  250    HA   VAL  55           HA       VAL  55 -17.343  -2.023  -3.098
  251    HB   VAL  55           HB       VAL  55 -15.554  -2.798  -4.711
  252   HG11  VAL  55          HG11      VAL  55 -15.811  -0.791  -6.132
  253   HG12  VAL  55          HG12      VAL  55 -16.443   0.080  -4.734
  254   HG13  VAL  55          HG13      VAL  55 -17.325  -1.302  -5.386
  255   HG21  VAL  55          HG21      VAL  55 -14.136  -0.402  -3.568
  256   HG22  VAL  55          HG22      VAL  55 -13.680  -1.216  -5.064
  257   HG23  VAL  55          HG23      VAL  55 -13.586  -2.076  -3.528
  258    H    ILE  56           HN       ILE  56 -17.392  -3.128  -1.063
  259    HA   ILE  56           HA       ILE  56 -15.322  -4.673  -0.012
  260    HB   ILE  56           HB       ILE  56 -17.330  -6.143   0.839
  261   HG12  ILE  56          HG12      ILE  56 -19.430  -4.912   0.976
  262   HG13  ILE  56          HG11      ILE  56 -18.744  -3.580   0.058
  263   HG21  ILE  56          HG21      ILE  56 -15.958  -4.737   2.245
  264   HG22  ILE  56          HG22      ILE  56 -17.658  -4.535   2.672
  265   HG23  ILE  56          HG23      ILE  56 -16.837  -3.303   1.713
  266   HD11  ILE  56          HD11      ILE  56 -18.565  -5.000  -1.902
  267   HD12  ILE  56          HD12      ILE  56 -20.220  -4.979  -1.294
  268   HD13  ILE  56          HD13      ILE  56 -19.183  -6.371  -0.981
  269    H    GLY  57           HN       GLY  57 -16.704  -5.026  -2.960
  270    HA2  GLY  57           HA2      GLY  57 -15.603  -7.696  -3.251
  271    HA3  GLY  57           HA1      GLY  57 -17.334  -7.568  -3.523
  272    HA   PRO  58           HA       PRO  58 -16.888  -6.282  -7.705
  273    HB2  PRO  58           HB2      PRO  58 -18.087  -3.622  -7.163
  274    HB3  PRO  58           HB1      PRO  58 -18.605  -4.883  -8.288
  275    HG2  PRO  58           HG2      PRO  58 -19.951  -4.432  -6.031
  276    HG3  PRO  58           HG1      PRO  58 -19.716  -6.080  -6.641
  277    HD2  PRO  58           HD2      PRO  58 -18.301  -4.661  -4.419
  278    HD3  PRO  58           HD1      PRO  58 -18.842  -6.350  -4.515
  279    H    GLN  59           HN       GLN  59 -14.613  -6.099  -7.705
  280    HA   GLN  59           HA       GLN  59 -13.497  -3.422  -7.294
  281    HB2  GLN  59           HB2      GLN  59 -11.299  -4.557  -7.431
  282    HB3  GLN  59           HB1      GLN  59 -12.319  -5.203  -6.153
  283    HG2  GLN  59           HG2      GLN  59 -12.902  -7.102  -7.559
  284    HG3  GLN  59           HG1      GLN  59 -11.916  -6.447  -8.865
  285   HE21  GLN  59          HE21      GLN  59 -11.704  -8.992  -7.456
  286   HE22  GLN  59          HE22      GLN  59 -10.110  -9.042  -6.792
  287    H    ARG  60           HN       ARG  60 -15.147  -4.235  -9.624
  288    HA   ARG  60           HA       ARG  60 -13.432  -4.481 -11.886
  289    HB2  ARG  60           HB2      ARG  60 -16.331  -3.650 -11.673
  290    HB3  ARG  60           HB1      ARG  60 -15.495  -3.966 -13.188
  291    HG2  ARG  60           HG2      ARG  60 -15.131  -6.273 -12.536
  292    HG3  ARG  60           HG1      ARG  60 -15.901  -5.969 -10.977
  293    HD2  ARG  60           HD2      ARG  60 -17.230  -5.701 -13.672
  294    HD3  ARG  60           HD1      ARG  60 -17.421  -7.065 -12.571
  295    HE   ARG  60           HE       ARG  60 -18.132  -4.407 -11.592
  296   HH11  ARG  60          HH11      ARG  60 -19.134  -7.543 -12.730
  297   HH12  ARG  60          HH12      ARG  60 -20.756  -7.380 -12.147
  298   HH21  ARG  60          HH21      ARG  60 -20.269  -4.181 -10.823
  299   HH22  ARG  60          HH22      ARG  60 -21.402  -5.468 -11.065
  Start of MODEL    7
    1    H1   ARG  28           HT1      ARG  28  24.255   0.001   5.119
    2    H2   ARG  28           HT2      ARG  28  22.977   0.751   5.932
    3    H3   ARG  28           HT3      ARG  28  24.449   1.562   5.741
    4    HA   ARG  28           HA       ARG  28  22.811   2.422   4.215
    5    HB2  ARG  28           HB2      ARG  28  24.993   0.792   2.901
    6    HB3  ARG  28           HB1      ARG  28  24.098   2.087   2.117
    7    HG2  ARG  28           HG2      ARG  28  24.976   3.690   3.719
    8    HG3  ARG  28           HG1      ARG  28  25.841   2.397   4.552
    9    HD2  ARG  28           HD2      ARG  28  27.164   1.976   2.551
   10    HD3  ARG  28           HD1      ARG  28  26.275   3.229   1.684
   11    HE   ARG  28           HE       ARG  28  27.409   4.327   4.012
   12   HH11  ARG  28          HH11      ARG  28  28.340   3.104   0.884
   13   HH12  ARG  28          HH12      ARG  28  29.755   4.096   0.775
   14   HH21  ARG  28          HH21      ARG  28  29.265   5.637   3.876
   15   HH22  ARG  28          HH22      ARG  28  30.280   5.538   2.477
   16    H    ARG  29           HN       ARG  29  20.952   2.035   3.227
   17    HA   ARG  29           HA       ARG  29  20.102  -0.693   2.785
   18    HB2  ARG  29           HB2      ARG  29  18.722   1.975   2.542
   19    HB3  ARG  29           HB1      ARG  29  17.953   0.477   2.041
   20    HG2  ARG  29           HG2      ARG  29  17.189   0.972   4.228
   21    HG3  ARG  29           HG1      ARG  29  18.306  -0.387   4.359
   22    HD2  ARG  29           HD2      ARG  29  20.066   1.076   5.123
   23    HD3  ARG  29           HD1      ARG  29  19.052   2.493   4.857
   24    HE   ARG  29           HE       ARG  29  17.636   0.946   6.607
   25   HH11  ARG  29          HH11      ARG  29  20.835   2.329   6.574
   26   HH12  ARG  29          HH12      ARG  29  20.908   2.521   8.294
   27   HH21  ARG  29          HH21      ARG  29  17.723   1.202   8.870
   28   HH22  ARG  29          HH22      ARG  29  19.141   1.882   9.598
   29    H    CYS  30           HN       CYS  30  19.761  -1.685   0.863
   30    HA   CYS  30           HA       CYS  30  20.794  -0.315  -1.514
   31    HB2  CYS  30           HB2      CYS  30  20.982  -2.569  -2.488
   32    HB3  CYS  30           HB1      CYS  30  21.850  -2.449  -0.962
   33    HG   CYS  30           HG       CYS  30  18.939  -4.107  -1.593
   34    H    LEU  31           HN       LEU  31  19.655  -1.611  -3.566
   35    HA   LEU  31           HA       LEU  31  17.175  -0.370  -3.873
   36    HB2  LEU  31           HB2      LEU  31  18.581  -1.069  -5.752
   37    HB3  LEU  31           HB1      LEU  31  18.293  -2.752  -5.354
   38    HG   LEU  31           HG       LEU  31  15.874  -2.409  -5.842
   39   HD11  LEU  31          HD11      LEU  31  15.192  -0.407  -7.059
   40   HD12  LEU  31          HD12      LEU  31  16.801   0.282  -6.836
   41   HD13  LEU  31          HD13      LEU  31  15.764  -0.008  -5.439
   42   HD21  LEU  31          HD21      LEU  31  16.131  -2.356  -8.267
   43   HD22  LEU  31          HD22      LEU  31  17.386  -3.344  -7.518
   44   HD23  LEU  31          HD23      LEU  31  17.765  -1.719  -8.088
   45    H    PHE  32           HN       PHE  32  17.978  -3.685  -2.949
   46    HA   PHE  32           HA       PHE  32  15.367  -4.723  -2.974
   47    HB2  PHE  32           HB2      PHE  32  17.750  -5.545  -1.301
   48    HB3  PHE  32           HB1      PHE  32  16.279  -6.492  -1.492
   49    HD1  PHE  32           HD1      PHE  32  15.895  -7.799  -3.433
   50    HD2  PHE  32           HD2      PHE  32  19.259  -5.200  -3.228
   51    HE1  PHE  32           HE1      PHE  32  16.840  -8.869  -5.438
   52    HE2  PHE  32           HE2      PHE  32  20.208  -6.264  -5.233
   53    HZ   PHE  32           HZ       PHE  32  18.998  -8.100  -6.341
   54    H    LEU  33           HN       LEU  33  17.305  -3.502  -0.239
   55    HA   LEU  33           HA       LEU  33  15.332  -3.762   1.717
   56    HB2  LEU  33           HB2      LEU  33  17.635  -1.838   1.513
   57    HB3  LEU  33           HB1      LEU  33  16.633  -2.009   2.944
   58    HG   LEU  33           HG       LEU  33  18.356  -4.169   1.726
   59   HD11  LEU  33          HD11      LEU  33  19.642  -3.930   3.809
   60   HD12  LEU  33          HD12      LEU  33  18.637  -2.546   4.242
   61   HD13  LEU  33          HD13      LEU  33  19.672  -2.472   2.816
   62   HD21  LEU  33          HD21      LEU  33  16.339  -5.098   2.737
   63   HD22  LEU  33          HD22      LEU  33  16.657  -4.198   4.220
   64   HD23  LEU  33          HD23      LEU  33  17.762  -5.474   3.710
   65    H    SER  34           HN       SER  34  15.875  -1.267  -0.670
   66    HA   SER  34           HA       SER  34  14.158   0.682   0.487
   67    HB2  SER  34           HB2      SER  34  15.076   0.334  -2.378
   68    HB3  SER  34           HB1      SER  34  14.256   1.761  -1.745
   69    HG   SER  34           HG       SER  34  16.650   1.786  -1.828
   70    H    LEU  35           HN       LEU  35  13.691  -2.027  -1.674
   71    HA   LEU  35           HA       LEU  35  11.055  -1.333  -2.497
   72    HB2  LEU  35           HB2      LEU  35  12.946  -3.390  -3.040
   73    HB3  LEU  35           HB1      LEU  35  11.438  -4.155  -2.578
   74    HG   LEU  35           HG       LEU  35  11.700  -2.094  -4.769
   75   HD11  LEU  35          HD11      LEU  35  11.426  -3.962  -6.312
   76   HD12  LEU  35          HD12      LEU  35  11.444  -5.093  -4.959
   77   HD13  LEU  35          HD13      LEU  35  12.886  -4.152  -5.341
   78   HD21  LEU  35          HD21      LEU  35   9.442  -2.834  -5.372
   79   HD22  LEU  35          HD22      LEU  35   9.492  -2.146  -3.748
   80   HD23  LEU  35          HD23      LEU  35   9.418  -3.895  -3.964
   81    H    PHE  36           HN       PHE  36  12.392  -2.731   0.330
   82    HA   PHE  36           HA       PHE  36  10.156  -4.225   1.218
   83    HB2  PHE  36           HB2      PHE  36  12.482  -4.461   2.101
   84    HB3  PHE  36           HB1      PHE  36  12.296  -2.904   2.901
   85    HD1  PHE  36           HD1      PHE  36  11.007  -6.366   2.779
   86    HD2  PHE  36           HD2      PHE  36  11.212  -2.729   4.980
   87    HE1  PHE  36           HE1      PHE  36  10.023  -7.496   4.731
   88    HE2  PHE  36           HE2      PHE  36  10.228  -3.851   6.935
   89    HZ   PHE  36           HZ       PHE  36   9.654  -6.239   6.823
   90    H    SER  37           HN       SER  37  10.802  -0.869   1.066
   91    HA   SER  37           HA       SER  37   8.926  -0.150   3.156
   92    HB2  SER  37           HB2      SER  37  10.414   1.575   1.161
   93    HB3  SER  37           HB1      SER  37   9.445   2.178   2.505
   94    HG   SER  37           HG       SER  37  10.892   0.976   3.893
   95    H    PHE  38           HN       PHE  38   9.096  -0.066  -0.380
   96    HA   PHE  38           HA       PHE  38   6.625   1.225  -0.802
   97    HB2  PHE  38           HB2      PHE  38   8.128  -0.695  -2.585
   98    HB3  PHE  38           HB1      PHE  38   6.766   0.294  -3.098
   99    HD1  PHE  38           HD1      PHE  38   7.117   2.897  -2.383
  100    HD2  PHE  38           HD2      PHE  38  10.189   0.072  -3.216
  101    HE1  PHE  38           HE1      PHE  38   8.652   4.736  -2.943
  102    HE2  PHE  38           HE2      PHE  38  11.731   1.907  -3.773
  103    HZ   PHE  38           HZ       PHE  38  10.962   4.243  -3.637
  104    H    LEU  39           HN       LEU  39   7.390  -1.934   0.225
  105    HA   LEU  39           HA       LEU  39   4.982  -3.177  -0.734
  106    HB2  LEU  39           HB2      LEU  39   7.218  -4.313  -0.203
  107    HB3  LEU  39           HB1      LEU  39   6.737  -4.207   1.479
  108    HG   LEU  39           HG       LEU  39   4.870  -5.467  -0.467
  109   HD11  LEU  39          HD11      LEU  39   7.031  -6.483  -0.974
  110   HD12  LEU  39          HD12      LEU  39   5.960  -7.628  -0.167
  111   HD13  LEU  39          HD13      LEU  39   7.263  -6.852   0.735
  112   HD21  LEU  39          HD21      LEU  39   5.543  -5.938   2.434
  113   HD22  LEU  39          HD22      LEU  39   4.359  -6.862   1.511
  114   HD23  LEU  39          HD23      LEU  39   4.103  -5.142   1.798
  115    H    ILE  40           HN       ILE  40   6.084  -1.616   2.188
  116    HA   ILE  40           HA       ILE  40   3.837  -2.361   3.790
  117    HB   ILE  40           HB       ILE  40   5.764  -0.068   4.192
  118   HG12  ILE  40          HG12      ILE  40   5.850  -2.845   5.388
  119   HG13  ILE  40          HG11      ILE  40   6.834  -2.332   4.022
  120   HG21  ILE  40          HG21      ILE  40   3.948  -1.472   6.148
  121   HG22  ILE  40          HG22      ILE  40   3.691   0.139   5.479
  122   HG23  ILE  40          HG23      ILE  40   5.076  -0.170   6.527
  123   HD11  ILE  40          HD11      ILE  40   8.079  -2.275   6.114
  124   HD12  ILE  40          HD12      ILE  40   6.911  -1.134   6.782
  125   HD13  ILE  40          HD13      ILE  40   7.920  -0.664   5.414
  126    H    VAL  41           HN       VAL  41   4.665   0.351   1.717
  127    HA   VAL  41           HA       VAL  41   2.457   1.984   2.496
  128    HB   VAL  41           HB       VAL  41   4.612   2.793   1.408
  129   HG11  VAL  41          HG11      VAL  41   4.602   2.882  -1.049
  130   HG12  VAL  41          HG12      VAL  41   3.182   1.837  -1.060
  131   HG13  VAL  41          HG13      VAL  41   4.712   1.237  -0.427
  132   HG21  VAL  41          HG21      VAL  41   3.460   4.617   0.207
  133   HG22  VAL  41          HG22      VAL  41   2.736   4.274   1.778
  134   HG23  VAL  41          HG23      VAL  41   1.954   3.701   0.303
  135    H    LEU  42           HN       LEU  42   2.957  -0.550   0.176
  136    HA   LEU  42           HA       LEU  42   0.551   0.015  -1.315
  137    HB2  LEU  42           HB2      LEU  42   2.792  -1.206  -2.039
  138    HB3  LEU  42           HB1      LEU  42   1.933  -2.626  -1.455
  139    HG   LEU  42           HG       LEU  42   0.897  -0.764  -3.599
  140   HD11  LEU  42          HD11      LEU  42   1.473  -2.524  -5.171
  141   HD12  LEU  42          HD12      LEU  42   2.172  -3.481  -3.865
  142   HD13  LEU  42          HD13      LEU  42   2.910  -1.947  -4.326
  143   HD21  LEU  42          HD21      LEU  42  -0.887  -1.897  -2.421
  144   HD22  LEU  42          HD22      LEU  42  -0.069  -3.447  -2.617
  145   HD23  LEU  42          HD23      LEU  42  -0.696  -2.595  -4.029
  146    H    LEU  43           HN       LEU  43   1.627  -2.334   1.102
  147    HA   LEU  43           HA       LEU  43  -0.586  -3.990   1.199
  148    HB2  LEU  43           HB2      LEU  43   1.480  -4.430   2.427
  149    HB3  LEU  43           HB1      LEU  43   1.160  -3.068   3.483
  150    HG   LEU  43           HG       LEU  43  -0.907  -4.249   4.268
  151   HD11  LEU  43          HD11      LEU  43  -1.063  -6.661   3.850
  152   HD12  LEU  43          HD12      LEU  43   0.278  -6.543   2.712
  153   HD13  LEU  43          HD13      LEU  43  -1.245  -5.723   2.369
  154   HD21  LEU  43          HD21      LEU  43   1.169  -4.276   5.556
  155   HD22  LEU  43          HD22      LEU  43   1.705  -5.702   4.668
  156   HD23  LEU  43          HD23      LEU  43   0.293  -5.798   5.719
  157    H    LEU  44           HN       LEU  44  -0.157  -0.769   2.475
  158    HA   LEU  44           HA       LEU  44  -2.569  -0.818   4.051
  159    HB2  LEU  44           HB2      LEU  44  -0.794   1.474   3.212
  160    HB3  LEU  44           HB1      LEU  44  -2.137   1.609   4.329
  161    HG   LEU  44           HG       LEU  44   0.367  -0.018   4.776
  162   HD11  LEU  44          HD11      LEU  44  -0.584   2.557   6.017
  163   HD12  LEU  44          HD12      LEU  44   0.765   2.377   4.897
  164   HD13  LEU  44          HD13      LEU  44   0.848   1.649   6.501
  165   HD21  LEU  44          HD21      LEU  44  -1.987   0.497   6.592
  166   HD22  LEU  44          HD22      LEU  44  -0.503  -0.345   7.037
  167   HD23  LEU  44          HD23      LEU  44  -1.583  -1.042   5.830
  168    H    THR  45           HN       THR  45  -1.541   0.750   1.027
  169    HA   THR  45           HA       THR  45  -3.930   2.060   0.448
  170    HB   THR  45           HB       THR  45  -3.187   1.914  -1.967
  171    HG1  THR  45           HG1      THR  45  -0.673   1.083  -1.300
  172   HG21  THR  45          HG21      THR  45  -2.572   3.781  -0.500
  173   HG22  THR  45          HG22      THR  45  -1.279   3.400  -1.638
  174   HG23  THR  45          HG23      THR  45  -1.152   2.885   0.043
  175    H    THR  46           HN       THR  46  -3.148  -1.301   0.243
  176    HA   THR  46           HA       THR  46  -5.023  -2.098  -1.704
  177    HB   THR  46           HB       THR  46  -4.028  -3.693   0.667
  178    HG1  THR  46           HG1      THR  46  -2.783  -4.499  -1.433
  179   HG21  THR  46          HG21      THR  46  -6.037  -4.640  -0.419
  180   HG22  THR  46          HG22      THR  46  -4.609  -5.652  -0.653
  181   HG23  THR  46          HG23      THR  46  -5.186  -4.622  -1.964
  182    H    LEU  47           HN       LEU  47  -5.253  -2.110   1.853
  183    HA   LEU  47           HA       LEU  47  -8.063  -2.737   1.779
  184    HB2  LEU  47           HB2      LEU  47  -6.218  -1.991   4.047
  185    HB3  LEU  47           HB1      LEU  47  -7.908  -2.396   4.264
  186    HG   LEU  47           HG       LEU  47  -6.608  -4.316   4.832
  187   HD11  LEU  47          HD11      LEU  47  -8.680  -4.765   3.633
  188   HD12  LEU  47          HD12      LEU  47  -7.456  -5.981   3.268
  189   HD13  LEU  47          HD13      LEU  47  -7.813  -4.711   2.099
  190   HD21  LEU  47          HD21      LEU  47  -4.567  -3.678   3.603
  191   HD22  LEU  47          HD22      LEU  47  -5.351  -4.159   2.097
  192   HD23  LEU  47          HD23      LEU  47  -5.023  -5.362   3.345
  193    H    PHE  48           HN       PHE  48  -6.100   0.075   2.679
  194    HA   PHE  48           HA       PHE  48  -8.070   1.812   3.503
  195    HB2  PHE  48           HB2      PHE  48  -5.680   2.311   3.671
  196    HB3  PHE  48           HB1      PHE  48  -5.573   2.466   1.922
  197    HD1  PHE  48           HD1      PHE  48  -6.126   4.482   0.841
  198    HD2  PHE  48           HD2      PHE  48  -7.034   3.961   4.965
  199    HE1  PHE  48           HE1      PHE  48  -6.665   6.878   1.022
  200    HE2  PHE  48           HE2      PHE  48  -7.573   6.354   5.154
  201    HZ   PHE  48           HZ       PHE  48  -7.389   7.816   3.180
  202    H    CYS  49           HN       CYS  49  -7.314   0.763   0.272
  203    HA   CYS  49           HA       CYS  49  -8.847   2.839  -1.016
  204    HB2  CYS  49           HB2      CYS  49  -7.030   2.005  -2.287
  205    HB3  CYS  49           HB1      CYS  49  -7.498   0.332  -2.002
  206    HG   CYS  49           HG       CYS  49  -8.383   0.260  -4.430
  207    H    LEU  50           HN       LEU  50  -9.235  -0.642  -0.439
  208    HA   LEU  50           HA       LEU  50 -11.735  -0.926  -1.683
  209    HB2  LEU  50           HB2      LEU  50 -10.572  -2.503   0.618
  210    HB3  LEU  50           HB1      LEU  50 -11.930  -3.006  -0.384
  211    HG   LEU  50           HG       LEU  50  -9.200  -2.478  -1.542
  212   HD11  LEU  50          HD11      LEU  50  -9.019  -4.202   0.206
  213   HD12  LEU  50          HD12      LEU  50  -8.754  -4.852  -1.412
  214   HD13  LEU  50          HD13      LEU  50 -10.293  -5.123  -0.594
  215   HD21  LEU  50          HD21      LEU  50 -10.037  -3.926  -3.337
  216   HD22  LEU  50          HD22      LEU  50 -11.044  -2.494  -3.120
  217   HD23  LEU  50          HD23      LEU  50 -11.584  -4.055  -2.501
  218    H    LEU  51           HN       LEU  51 -10.855   0.342   1.423
  219    HA   LEU  51           HA       LEU  51 -13.496   0.082   2.543
  220    HB2  LEU  51           HB2      LEU  51 -11.099   1.655   3.485
  221    HB3  LEU  51           HB1      LEU  51 -12.581   1.438   4.397
  222    HG   LEU  51           HG       LEU  51 -10.741  -0.804   3.555
  223   HD11  LEU  51          HD11      LEU  51 -10.081  -0.899   5.898
  224   HD12  LEU  51          HD12      LEU  51 -11.082   0.510   6.248
  225   HD13  LEU  51          HD13      LEU  51  -9.677   0.666   5.192
  226   HD21  LEU  51          HD21      LEU  51 -13.040  -1.532   3.799
  227   HD22  LEU  51          HD22      LEU  51 -13.144  -0.753   5.377
  228   HD23  LEU  51          HD23      LEU  51 -12.070  -2.132   5.144
  229    H    HIS  52           HN       HIS  52 -11.793   2.373   0.615
  230    HA   HIS  52           HA       HIS  52 -13.523   4.592   1.259
  231    HB2  HIS  52           HB2      HIS  52 -11.091   4.798   0.568
  232    HB3  HIS  52           HB1      HIS  52 -11.608   4.394  -1.065
  233    HD1  HIS  52           HD1      HIS  52 -14.156   6.416   0.474
  234    HD2  HIS  52           HD2      HIS  52 -10.530   7.148  -1.417
  235    HE1  HIS  52           HE1      HIS  52 -14.214   8.845  -0.173
  236    HE2  HIS  52           HE2      HIS  52 -12.047   9.243  -1.395
  237    H    PHE  53           HN       PHE  53 -12.879   2.777  -1.755
  238    HA   PHE  53           HA       PHE  53 -15.655   3.357  -2.571
  239    HB2  PHE  53           HB2      PHE  53 -13.115   3.223  -4.172
  240    HB3  PHE  53           HB1      PHE  53 -14.676   2.955  -4.935
  241    HD1  PHE  53           HD1      PHE  53 -16.067   4.758  -5.522
  242    HD2  PHE  53           HD2      PHE  53 -12.687   5.413  -3.021
  243    HE1  PHE  53           HE1      PHE  53 -16.371   7.190  -5.753
  244    HE2  PHE  53           HE2      PHE  53 -12.985   7.845  -3.248
  245    HZ   PHE  53           HZ       PHE  53 -14.830   8.733  -4.644
  246    H    GLY  54           HN       GLY  54 -13.195   0.952  -2.157
  247    HA2  GLY  54           HA2      GLY  54 -13.600  -1.347  -1.897
  248    HA3  GLY  54           HA1      GLY  54 -15.177  -1.130  -2.639
  249    H    VAL  55           HN       VAL  55 -12.967   0.490  -4.494
  250    HA   VAL  55           HA       VAL  55 -12.026  -1.778  -6.004
  251    HB   VAL  55           HB       VAL  55 -14.217  -1.624  -6.948
  252   HG11  VAL  55          HG11      VAL  55 -13.633   1.299  -7.316
  253   HG12  VAL  55          HG12      VAL  55 -14.873   0.574  -6.298
  254   HG13  VAL  55          HG13      VAL  55 -14.995   0.462  -8.054
  255   HG21  VAL  55          HG21      VAL  55 -13.693  -1.142  -9.299
  256   HG22  VAL  55          HG22      VAL  55 -12.429  -2.093  -8.521
  257   HG23  VAL  55          HG23      VAL  55 -12.192  -0.368  -8.795
  258    H    ILE  56           HN       ILE  56 -12.375   1.737  -5.870
  259    HA   ILE  56           HA       ILE  56  -9.572   2.073  -6.363
  260    HB   ILE  56           HB       ILE  56 -10.334   3.827  -8.279
  261   HG12  ILE  56          HG12      ILE  56 -11.721   2.416  -9.893
  262   HG13  ILE  56          HG11      ILE  56 -12.151   1.427  -8.502
  263   HG21  ILE  56          HG21      ILE  56  -8.440   2.301  -8.360
  264   HG22  ILE  56          HG22      ILE  56  -9.344   2.274  -9.874
  265   HG23  ILE  56          HG23      ILE  56  -9.527   0.957  -8.715
  266   HD11  ILE  56          HD11      ILE  56 -13.182   3.329  -7.431
  267   HD12  ILE  56          HD12      ILE  56 -13.861   3.089  -9.041
  268   HD13  ILE  56          HD13      ILE  56 -12.686   4.376  -8.762
  269    H    GLY  57           HN       GLY  57  -9.204   3.366  -4.698
  270    HA2  GLY  57           HA2      GLY  57 -11.009   5.631  -4.210
  271    HA3  GLY  57           HA1      GLY  57  -9.859   4.974  -3.056
  272    HA   PRO  58           HA       PRO  58  -6.802   7.947  -4.157
  273    HB2  PRO  58           HB2      PRO  58  -4.780   5.902  -4.794
  274    HB3  PRO  58           HB1      PRO  58  -4.790   7.105  -3.503
  275    HG2  PRO  58           HG2      PRO  58  -5.149   4.494  -2.999
  276    HG3  PRO  58           HG1      PRO  58  -5.985   5.752  -2.067
  277    HD2  PRO  58           HD2      PRO  58  -7.021   4.035  -4.292
  278    HD3  PRO  58           HD1      PRO  58  -7.817   4.519  -2.778
  279    H    GLN  59           HN       GLN  59  -5.096   8.544  -5.854
  280    HA   GLN  59           HA       GLN  59  -6.073   7.699  -8.501
  281    HB2  GLN  59           HB2      GLN  59  -6.552  10.050  -7.994
  282    HB3  GLN  59           HB1      GLN  59  -4.846  10.340  -7.682
  283    HG2  GLN  59           HG2      GLN  59  -5.485  11.151  -9.876
  284    HG3  GLN  59           HG1      GLN  59  -4.323   9.832 -10.004
  285   HE21  GLN  59          HE21      GLN  59  -4.927   9.319 -12.092
  286   HE22  GLN  59          HE22      GLN  59  -6.433   8.556 -12.465
  287    H    ARG  60           HN       ARG  60  -4.667   6.124  -9.078
  288    HA   ARG  60           HA       ARG  60  -1.810   6.844  -9.133
  289    HB2  ARG  60           HB2      ARG  60  -2.313   5.031  -7.521
  290    HB3  ARG  60           HB1      ARG  60  -2.986   4.076  -8.835
  291    HG2  ARG  60           HG2      ARG  60  -0.794   4.060  -9.934
  292    HG3  ARG  60           HG1      ARG  60  -0.126   4.984  -8.587
  293    HD2  ARG  60           HD2      ARG  60  -0.739   3.159  -7.057
  294    HD3  ARG  60           HD1      ARG  60  -1.358   2.236  -8.425
  295    HE   ARG  60           HE       ARG  60   1.362   3.021  -8.792
  296   HH11  ARG  60          HH11      ARG  60  -0.704   0.683  -7.240
  297   HH12  ARG  60          HH12      ARG  60   0.516  -0.543  -7.176
  298   HH21  ARG  60          HH21      ARG  60   2.974   1.413  -8.710
  299   HH22  ARG  60          HH22      ARG  60   2.609  -0.128  -8.011
  Start of MODEL    8
    1    H1   ARG  28           HT1      ARG  28  25.676  -3.467  -8.183
    2    H2   ARG  28           HT2      ARG  28  24.253  -2.648  -8.589
    3    H3   ARG  28           HT3      ARG  28  24.416  -3.350  -7.060
    4    HA   ARG  28           HA       ARG  28  26.192  -1.832  -6.506
    5    HB2  ARG  28           HB2      ARG  28  25.553  -0.557  -9.173
    6    HB3  ARG  28           HB1      ARG  28  26.719   0.028  -7.995
    7    HG2  ARG  28           HG2      ARG  28  28.056  -1.995  -8.319
    8    HG3  ARG  28           HG1      ARG  28  26.889  -2.566  -9.514
    9    HD2  ARG  28           HD2      ARG  28  28.552  -0.057  -9.699
   10    HD3  ARG  28           HD1      ARG  28  28.808  -1.546 -10.607
   11    HE   ARG  28           HE       ARG  28  26.250  -0.816 -11.208
   12   HH11  ARG  28          HH11      ARG  28  29.359   0.744 -11.416
   13   HH12  ARG  28          HH12      ARG  28  28.920   1.722 -12.775
   14   HH21  ARG  28          HH21      ARG  28  25.665   0.470 -12.997
   15   HH22  ARG  28          HH22      ARG  28  26.820   1.569 -13.672
   16    H    ARG  29           HN       ARG  29  22.993  -1.941  -7.362
   17    HA   ARG  29           HA       ARG  29  22.418   0.578  -5.945
   18    HB2  ARG  29           HB2      ARG  29  20.878  -0.771  -8.165
   19    HB3  ARG  29           HB1      ARG  29  20.230   0.549  -7.200
   20    HG2  ARG  29           HG2      ARG  29  21.882   2.058  -8.012
   21    HG3  ARG  29           HG1      ARG  29  22.774   0.751  -8.792
   22    HD2  ARG  29           HD2      ARG  29  19.961   1.559  -9.517
   23    HD3  ARG  29           HD1      ARG  29  21.403   2.133 -10.353
   24    HE   ARG  29           HE       ARG  29  21.436  -0.672 -10.299
   25   HH11  ARG  29          HH11      ARG  29  19.670   1.952 -11.760
   26   HH12  ARG  29          HH12      ARG  29  19.251   1.052 -13.178
   27   HH21  ARG  29          HH21      ARG  29  20.892  -1.865 -12.166
   28   HH22  ARG  29          HH22      ARG  29  19.946  -1.117 -13.410
   29    H    CYS  30           HN       CYS  30  20.498   0.602  -4.617
   30    HA   CYS  30           HA       CYS  30  20.066  -1.988  -3.327
   31    HB2  CYS  30           HB2      CYS  30  19.043  -0.603  -1.504
   32    HB3  CYS  30           HB1      CYS  30  20.739  -0.251  -1.816
   33    HG   CYS  30           HG       CYS  30  19.908   1.988  -3.536
   34    H    LEU  31           HN       LEU  31  18.595  -2.942  -4.737
   35    HA   LEU  31           HA       LEU  31  16.122  -1.578  -5.378
   36    HB2  LEU  31           HB2      LEU  31  17.090  -4.371  -5.985
   37    HB3  LEU  31           HB1      LEU  31  15.566  -3.710  -6.546
   38    HG   LEU  31           HG       LEU  31  18.280  -2.594  -7.257
   39   HD11  LEU  31          HD11      LEU  31  17.873  -3.558  -9.470
   40   HD12  LEU  31          HD12      LEU  31  16.402  -4.319  -8.865
   41   HD13  LEU  31          HD13      LEU  31  17.972  -4.802  -8.224
   42   HD21  LEU  31          HD21      LEU  31  17.042  -1.303  -8.924
   43   HD22  LEU  31          HD22      LEU  31  16.498  -0.926  -7.290
   44   HD23  LEU  31          HD23      LEU  31  15.526  -1.973  -8.322
   45    H    PHE  32           HN       PHE  32  17.225  -4.200  -3.304
   46    HA   PHE  32           HA       PHE  32  14.614  -4.971  -2.444
   47    HB2  PHE  32           HB2      PHE  32  16.585  -6.486  -2.383
   48    HB3  PHE  32           HB1      PHE  32  17.280  -5.488  -1.112
   49    HD1  PHE  32           HD1      PHE  32  14.616  -7.866  -1.950
   50    HD2  PHE  32           HD2      PHE  32  16.473  -5.599   1.137
   51    HE1  PHE  32           HE1      PHE  32  13.414  -9.190  -0.260
   52    HE2  PHE  32           HE2      PHE  32  15.275  -6.920   2.833
   53    HZ   PHE  32           HZ       PHE  32  13.746  -8.725   2.132
   54    H    LEU  33           HN       LEU  33  17.151  -2.881  -1.148
   55    HA   LEU  33           HA       LEU  33  16.061  -2.351   1.354
   56    HB2  LEU  33           HB2      LEU  33  18.225  -1.456  -0.175
   57    HB3  LEU  33           HB1      LEU  33  17.306  -0.011   0.202
   58    HG   LEU  33           HG       LEU  33  17.374  -0.837   2.634
   59   HD11  LEU  33          HD11      LEU  33  19.309  -2.233   3.185
   60   HD12  LEU  33          HD12      LEU  33  19.615  -2.476   1.466
   61   HD13  LEU  33          HD13      LEU  33  18.134  -3.098   2.195
   62   HD21  LEU  33          HD21      LEU  33  18.588   1.114   1.843
   63   HD22  LEU  33          HD22      LEU  33  19.889   0.083   1.249
   64   HD23  LEU  33          HD23      LEU  33  19.574   0.195   2.980
   65    H    SER  34           HN       SER  34  15.390  -0.907  -1.788
   66    HA   SER  34           HA       SER  34  13.714   1.169  -0.759
   67    HB2  SER  34           HB2      SER  34  13.118   1.552  -3.121
   68    HB3  SER  34           HB1      SER  34  14.863   1.419  -2.912
   69    HG   SER  34           HG       SER  34  14.843  -0.540  -3.855
   70    H    LEU  35           HN       LEU  35  13.192  -2.065  -2.054
   71    HA   LEU  35           HA       LEU  35  10.341  -1.861  -2.105
   72    HB2  LEU  35           HB2      LEU  35  12.363  -3.904  -2.670
   73    HB3  LEU  35           HB1      LEU  35  10.887  -4.551  -1.983
   74    HG   LEU  35           HG       LEU  35  10.834  -4.621  -4.422
   75   HD11  LEU  35          HD11      LEU  35   8.918  -2.574  -3.319
   76   HD12  LEU  35          HD12      LEU  35   8.741  -4.322  -3.182
   77   HD13  LEU  35          HD13      LEU  35   8.687  -3.552  -4.769
   78   HD21  LEU  35          HD21      LEU  35  12.284  -2.759  -4.936
   79   HD22  LEU  35          HD22      LEU  35  11.119  -1.624  -4.249
   80   HD23  LEU  35          HD23      LEU  35  10.717  -2.524  -5.713
   81    H    PHE  36           HN       PHE  36  12.534  -2.098   0.392
   82    HA   PHE  36           HA       PHE  36  11.129  -3.855   2.144
   83    HB2  PHE  36           HB2      PHE  36  13.534  -3.382   2.396
   84    HB3  PHE  36           HB1      PHE  36  13.162  -1.706   2.782
   85    HD1  PHE  36           HD1      PHE  36  12.318  -5.153   3.924
   86    HD2  PHE  36           HD2      PHE  36  13.041  -1.097   4.994
   87    HE1  PHE  36           HE1      PHE  36  12.132  -5.751   6.303
   88    HE2  PHE  36           HE2      PHE  36  12.855  -1.689   7.376
   89    HZ   PHE  36           HZ       PHE  36  12.394  -4.012   8.033
   90    H    SER  37           HN       SER  37  10.740  -0.567   1.235
   91    HA   SER  37           HA       SER  37   8.921  -0.109   3.505
   92    HB2  SER  37           HB2      SER  37  10.307   1.908   1.723
   93    HB3  SER  37           HB1      SER  37   9.199   2.303   3.036
   94    HG   SER  37           HG       SER  37  11.023   2.352   4.117
   95    H    PHE  38           HN       PHE  38   9.192  -0.258   0.047
   96    HA   PHE  38           HA       PHE  38   6.736   1.029  -0.580
   97    HB2  PHE  38           HB2      PHE  38   8.663   0.618  -2.170
   98    HB3  PHE  38           HB1      PHE  38   8.144  -1.062  -2.236
   99    HD1  PHE  38           HD1      PHE  38   7.204   2.400  -3.063
  100    HD2  PHE  38           HD2      PHE  38   6.269  -1.725  -3.529
  101    HE1  PHE  38           HE1      PHE  38   5.612   2.967  -4.851
  102    HE2  PHE  38           HE2      PHE  38   4.675  -1.166  -5.318
  103    HZ   PHE  38           HZ       PHE  38   4.345   1.184  -5.981
  104    H    LEU  39           HN       LEU  39   7.503  -2.025   0.711
  105    HA   LEU  39           HA       LEU  39   5.203  -3.429  -0.278
  106    HB2  LEU  39           HB2      LEU  39   7.394  -4.461   0.471
  107    HB3  LEU  39           HB1      LEU  39   6.883  -4.146   2.118
  108    HG   LEU  39           HG       LEU  39   5.078  -5.707   0.333
  109   HD11  LEU  39          HD11      LEU  39   7.287  -6.703  -0.006
  110   HD12  LEU  39          HD12      LEU  39   6.223  -7.773   0.908
  111   HD13  LEU  39          HD13      LEU  39   7.481  -6.859   1.739
  112   HD21  LEU  39          HD21      LEU  39   5.732  -5.794   3.277
  113   HD22  LEU  39          HD22      LEU  39   4.564  -6.836   2.464
  114   HD23  LEU  39          HD23      LEU  39   4.289  -5.097   2.541
  115    H    ILE  40           HN       ILE  40   6.003  -1.520   2.534
  116    HA   ILE  40           HA       ILE  40   3.656  -2.245   4.021
  117    HB   ILE  40           HB       ILE  40   5.463   0.139   4.440
  118   HG12  ILE  40          HG12      ILE  40   5.631  -2.598   5.719
  119   HG13  ILE  40          HG11      ILE  40   6.683  -2.043   4.421
  120   HG21  ILE  40          HG21      ILE  40   4.642   0.055   6.741
  121   HG22  ILE  40          HG22      ILE  40   3.594  -1.299   6.320
  122   HG23  ILE  40          HG23      ILE  40   3.320   0.286   5.598
  123   HD11  ILE  40          HD11      ILE  40   6.479  -0.852   7.177
  124   HD12  ILE  40          HD12      ILE  40   7.511  -0.257   5.878
  125   HD13  ILE  40          HD13      ILE  40   7.789  -1.859   6.561
  126    H    VAL  41           HN       VAL  41   4.556   0.274   1.764
  127    HA   VAL  41           HA       VAL  41   2.275   1.929   2.298
  128    HB   VAL  41           HB       VAL  41   4.486   2.729   1.336
  129   HG11  VAL  41          HG11      VAL  41   4.687   2.643  -1.114
  130   HG12  VAL  41          HG12      VAL  41   3.302   1.553  -1.167
  131   HG13  VAL  41          HG13      VAL  41   4.788   1.052  -0.362
  132   HG21  VAL  41          HG21      VAL  41   1.926   3.476  -0.074
  133   HG22  VAL  41          HG22      VAL  41   3.405   4.435  -0.075
  134   HG23  VAL  41          HG23      VAL  41   2.530   4.162   1.433
  135    H    LEU  42           HN       LEU  42   2.968  -0.770   0.255
  136    HA   LEU  42           HA       LEU  42   0.706  -0.338  -1.496
  137    HB2  LEU  42           HB2      LEU  42   3.036  -1.574  -1.900
  138    HB3  LEU  42           HB1      LEU  42   2.107  -2.962  -1.349
  139    HG   LEU  42           HG       LEU  42   2.135  -2.838  -3.783
  140   HD11  LEU  42          HD11      LEU  42  -0.251  -2.983  -4.199
  141   HD12  LEU  42          HD12      LEU  42  -0.585  -2.169  -2.671
  142   HD13  LEU  42          HD13      LEU  42   0.160  -3.767  -2.674
  143   HD21  LEU  42          HD21      LEU  42   0.776  -0.167  -3.442
  144   HD22  LEU  42          HD22      LEU  42   1.050  -1.004  -4.970
  145   HD23  LEU  42          HD23      LEU  42   2.421  -0.426  -4.022
  146    H    LEU  43           HN       LEU  43   1.600  -2.556   1.119
  147    HA   LEU  43           HA       LEU  43  -0.653  -4.191   1.098
  148    HB2  LEU  43           HB2      LEU  43   1.580  -4.192   2.529
  149    HB3  LEU  43           HB1      LEU  43   0.562  -3.382   3.701
  150    HG   LEU  43           HG       LEU  43   0.696  -5.780   4.140
  151   HD11  LEU  43          HD11      LEU  43  -1.349  -4.569   4.735
  152   HD12  LEU  43          HD12      LEU  43  -1.670  -6.254   4.328
  153   HD13  LEU  43          HD13      LEU  43  -2.039  -4.981   3.166
  154   HD21  LEU  43          HD21      LEU  43  -0.278  -7.399   2.599
  155   HD22  LEU  43          HD22      LEU  43   1.072  -6.546   1.851
  156   HD23  LEU  43          HD23      LEU  43  -0.585  -6.114   1.431
  157    H    LEU  44           HN       LEU  44  -0.116  -1.057   2.628
  158    HA   LEU  44           HA       LEU  44  -2.567  -0.979   4.047
  159    HB2  LEU  44           HB2      LEU  44  -0.655   1.175   3.174
  160    HB3  LEU  44           HB1      LEU  44  -2.099   1.517   4.106
  161    HG   LEU  44           HG       LEU  44   0.164  -0.267   5.011
  162   HD11  LEU  44          HD11      LEU  44  -0.577   2.548   5.794
  163   HD12  LEU  44          HD12      LEU  44   0.866   2.048   4.913
  164   HD13  LEU  44          HD13      LEU  44   0.644   1.556   6.592
  165   HD21  LEU  44          HD21      LEU  44  -1.999  -0.917   5.945
  166   HD22  LEU  44          HD22      LEU  44  -2.273   0.741   6.477
  167   HD23  LEU  44          HD23      LEU  44  -0.959  -0.204   7.180
  168    H    THR  45           HN       THR  45  -1.552   0.506   0.974
  169    HA   THR  45           HA       THR  45  -3.933   1.817   0.375
  170    HB   THR  45           HB       THR  45  -3.203   1.596  -2.040
  171    HG1  THR  45           HG1      THR  45  -0.705   0.714  -1.234
  172   HG21  THR  45          HG21      THR  45  -2.575   3.514  -0.676
  173   HG22  THR  45          HG22      THR  45  -1.247   3.058  -1.743
  174   HG23  THR  45          HG23      THR  45  -1.195   2.626  -0.034
  175    H    THR  46           HN       THR  46  -3.189  -1.552   0.250
  176    HA   THR  46           HA       THR  46  -5.029  -2.408  -1.685
  177    HB   THR  46           HB       THR  46  -4.165  -3.905   0.798
  178    HG1  THR  46           HG1      THR  46  -2.400  -4.477  -0.324
  179   HG21  THR  46          HG21      THR  46  -6.122  -4.884  -0.329
  180   HG22  THR  46          HG22      THR  46  -4.697  -5.910  -0.487
  181   HG23  THR  46          HG23      THR  46  -5.222  -4.917  -1.845
  182    H    LEU  47           HN       LEU  47  -5.400  -2.376   1.866
  183    HA   LEU  47           HA       LEU  47  -8.250  -2.806   1.629
  184    HB2  LEU  47           HB2      LEU  47  -6.410  -2.426   3.984
  185    HB3  LEU  47           HB1      LEU  47  -8.147  -2.564   4.160
  186    HG   LEU  47           HG       LEU  47  -7.112  -4.692   4.635
  187   HD11  LEU  47          HD11      LEU  47  -9.286  -4.737   3.539
  188   HD12  LEU  47          HD12      LEU  47  -8.301  -6.116   3.051
  189   HD13  LEU  47          HD13      LEU  47  -8.500  -4.744   1.960
  190   HD21  LEU  47          HD21      LEU  47  -5.820  -5.916   2.986
  191   HD22  LEU  47          HD22      LEU  47  -5.054  -4.368   3.339
  192   HD23  LEU  47          HD23      LEU  47  -5.970  -4.579   1.847
  193    H    PHE  48           HN       PHE  48  -6.086  -0.148   1.996
  194    HA   PHE  48           HA       PHE  48  -7.870   1.709   3.173
  195    HB2  PHE  48           HB2      PHE  48  -5.536   2.188   3.277
  196    HB3  PHE  48           HB1      PHE  48  -5.359   2.054   1.532
  197    HD1  PHE  48           HD1      PHE  48  -5.617   3.923   0.150
  198    HD2  PHE  48           HD2      PHE  48  -6.876   4.113   4.211
  199    HE1  PHE  48           HE1      PHE  48  -5.953   6.350  -0.071
  200    HE2  PHE  48           HE2      PHE  48  -7.214   6.540   3.997
  201    HZ   PHE  48           HZ       PHE  48  -6.739   7.664   1.860
  202    H    CYS  49           HN       CYS  49  -7.231   0.742  -0.140
  203    HA   CYS  49           HA       CYS  49  -8.851   2.846  -1.261
  204    HB2  CYS  49           HB2      CYS  49  -6.930   1.980  -2.508
  205    HB3  CYS  49           HB1      CYS  49  -7.658   0.379  -2.544
  206    HG   CYS  49           HG       CYS  49  -8.383   3.104  -4.395
  207    H    LEU  50           HN       LEU  50  -9.140  -0.692  -0.964
  208    HA   LEU  50           HA       LEU  50 -11.625  -1.024  -2.138
  209    HB2  LEU  50           HB2      LEU  50 -10.400  -2.507   0.191
  210    HB3  LEU  50           HB1      LEU  50 -11.841  -3.039  -0.669
  211    HG   LEU  50           HG       LEU  50  -9.178  -2.643  -2.032
  212   HD11  LEU  50          HD11      LEU  50  -8.987  -5.119  -1.917
  213   HD12  LEU  50          HD12      LEU  50 -10.336  -5.128  -0.780
  214   HD13  LEU  50          HD13      LEU  50  -8.828  -4.318  -0.354
  215   HD21  LEU  50          HD21      LEU  50 -11.665  -4.162  -2.812
  216   HD22  LEU  50          HD22      LEU  50 -10.174  -4.068  -3.747
  217   HD23  LEU  50          HD23      LEU  50 -11.142  -2.618  -3.484
  218    H    LEU  51           HN       LEU  51 -10.816   0.025   1.115
  219    HA   LEU  51           HA       LEU  51 -13.546  -0.021   2.031
  220    HB2  LEU  51           HB2      LEU  51 -11.008   1.094   3.214
  221    HB3  LEU  51           HB1      LEU  51 -12.566   1.188   4.016
  222    HG   LEU  51           HG       LEU  51 -11.150  -1.374   3.268
  223   HD11  LEU  51          HD11      LEU  51 -10.807  -1.628   5.680
  224   HD12  LEU  51          HD12      LEU  51 -11.502  -0.029   5.943
  225   HD13  LEU  51          HD13      LEU  51  -9.991  -0.198   5.050
  226   HD21  LEU  51          HD21      LEU  51 -13.674  -0.883   4.846
  227   HD22  LEU  51          HD22      LEU  51 -12.872  -2.443   4.655
  228   HD23  LEU  51          HD23      LEU  51 -13.564  -1.629   3.252
  229    H    HIS  52           HN       HIS  52 -11.320   2.351   0.723
  230    HA   HIS  52           HA       HIS  52 -12.741   4.677   1.418
  231    HB2  HIS  52           HB2      HIS  52 -10.380   4.573   0.547
  232    HB3  HIS  52           HB1      HIS  52 -11.050   4.295  -1.057
  233    HD1  HIS  52           HD1      HIS  52 -12.491   6.301  -2.067
  234    HD2  HIS  52           HD2      HIS  52 -10.287   7.194   1.340
  235    HE1  HIS  52           HE1      HIS  52 -12.405   8.812  -1.961
  236    HE2  HIS  52           HE2      HIS  52 -11.147   9.328   0.160
  237    H    PHE  53           HN       PHE  53 -12.705   2.884  -1.669
  238    HA   PHE  53           HA       PHE  53 -14.918   4.390  -2.706
  239    HB2  PHE  53           HB2      PHE  53 -13.484   1.931  -3.716
  240    HB3  PHE  53           HB1      PHE  53 -14.806   2.707  -4.582
  241    HD1  PHE  53           HD1      PHE  53 -11.360   3.169  -3.346
  242    HD2  PHE  53           HD2      PHE  53 -14.453   4.659  -5.864
  243    HE1  PHE  53           HE1      PHE  53  -9.758   4.714  -4.396
  244    HE2  PHE  53           HE2      PHE  53 -12.856   6.205  -6.917
  245    HZ   PHE  53           HZ       PHE  53 -10.505   6.233  -6.187
  246    H    GLY  54           HN       GLY  54 -14.515   1.462  -0.915
  247    HA2  GLY  54           HA2      GLY  54 -16.044   0.039   0.036
  248    HA3  GLY  54           HA1      GLY  54 -17.264   1.255  -0.310
  249    H    VAL  55           HN       VAL  55 -15.348  -0.080  -2.882
  250    HA   VAL  55           HA       VAL  55 -17.507  -0.802  -4.459
  251    HB   VAL  55           HB       VAL  55 -15.336  -0.514  -5.443
  252   HG11  VAL  55          HG11      VAL  55 -14.485  -2.963  -3.917
  253   HG12  VAL  55          HG12      VAL  55 -13.961  -1.310  -3.608
  254   HG13  VAL  55          HG13      VAL  55 -13.516  -2.110  -5.116
  255   HG21  VAL  55          HG21      VAL  55 -16.293  -3.355  -5.746
  256   HG22  VAL  55          HG22      VAL  55 -15.194  -2.530  -6.850
  257   HG23  VAL  55          HG23      VAL  55 -16.849  -1.953  -6.660
  258    H    ILE  56           HN       ILE  56 -15.579  -2.820  -2.290
  259    HA   ILE  56           HA       ILE  56 -17.786  -4.561  -1.787
  260    HB   ILE  56           HB       ILE  56 -16.146  -6.586  -2.463
  261   HG12  ILE  56          HG12      ILE  56 -15.472  -6.071  -4.884
  262   HG13  ILE  56          HG11      ILE  56 -15.641  -4.376  -4.451
  263   HG21  ILE  56          HG21      ILE  56 -18.144  -5.306  -4.320
  264   HG22  ILE  56          HG22      ILE  56 -18.535  -6.365  -2.967
  265   HG23  ILE  56          HG23      ILE  56 -17.623  -6.990  -4.341
  266   HD11  ILE  56          HD11      ILE  56 -13.777  -6.340  -3.140
  267   HD12  ILE  56          HD12      ILE  56 -13.929  -4.626  -2.749
  268   HD13  ILE  56          HD13      ILE  56 -13.329  -5.119  -4.332
  269    H    GLY  57           HN       GLY  57 -17.371  -3.982   0.337
  270    HA2  GLY  57           HA2      GLY  57 -15.162  -5.463   1.555
  271    HA3  GLY  57           HA1      GLY  57 -15.253  -3.739   1.870
  272    HA   PRO  58           HA       PRO  58 -17.967  -4.470   5.256
  273    HB2  PRO  58           HB2      PRO  58 -19.776  -2.448   5.088
  274    HB3  PRO  58           HB1      PRO  58 -18.103  -2.207   5.601
  275    HG2  PRO  58           HG2      PRO  58 -19.349  -1.733   2.921
  276    HG3  PRO  58           HG1      PRO  58 -18.195  -0.725   3.813
  277    HD2  PRO  58           HD2      PRO  58 -17.439  -2.351   1.787
  278    HD3  PRO  58           HD1      PRO  58 -16.388  -2.010   3.176
  279    H    GLN  59           HN       GLN  59 -19.046  -4.811   2.108
  280    HA   GLN  59           HA       GLN  59 -20.787  -5.890   1.127
  281    HB2  GLN  59           HB2      GLN  59 -21.041  -7.034   3.909
  282    HB3  GLN  59           HB1      GLN  59 -21.981  -7.599   2.536
  283    HG2  GLN  59           HG2      GLN  59 -18.976  -7.630   2.693
  284    HG3  GLN  59           HG1      GLN  59 -20.024  -9.007   3.024
  285   HE21  GLN  59          HE21      GLN  59 -17.949  -8.671   1.001
  286   HE22  GLN  59          HE22      GLN  59 -18.717  -8.940  -0.523
  287    H    ARG  60           HN       ARG  60 -21.186  -3.289   2.670
  288    HA   ARG  60           HA       ARG  60 -23.978  -3.397   3.420
  289    HB2  ARG  60           HB2      ARG  60 -22.400  -1.961   4.657
  290    HB3  ARG  60           HB1      ARG  60 -22.109  -1.028   3.196
  291    HG2  ARG  60           HG2      ARG  60 -23.631   0.172   4.602
  292    HG3  ARG  60           HG1      ARG  60 -24.500  -0.392   3.174
  293    HD2  ARG  60           HD2      ARG  60 -25.359  -2.296   4.482
  294    HD3  ARG  60           HD1      ARG  60 -24.535  -1.667   5.908
  295    HE   ARG  60           HE       ARG  60 -26.105   0.398   5.052
  296   HH11  ARG  60          HH11      ARG  60 -26.671  -2.922   5.950
  297   HH12  ARG  60          HH12      ARG  60 -28.272  -2.624   6.538
  298   HH21  ARG  60          HH21      ARG  60 -28.216   0.796   5.825
  299   HH22  ARG  60          HH22      ARG  60 -29.150  -0.514   6.468
  Start of MODEL    9
    1    H1   ARG  28           HT1      ARG  28  18.105  11.758   0.055
    2    H2   ARG  28           HT2      ARG  28  19.562  10.901   0.128
    3    H3   ARG  28           HT3      ARG  28  19.480  12.480   0.727
    4    HA   ARG  28           HA       ARG  28  19.487  10.910   2.533
    5    HB2  ARG  28           HB2      ARG  28  17.439  11.673   3.665
    6    HB3  ARG  28           HB1      ARG  28  18.247  12.991   2.826
    7    HG2  ARG  28           HG2      ARG  28  16.646  12.778   0.978
    8    HG3  ARG  28           HG1      ARG  28  15.824  11.488   1.856
    9    HD2  ARG  28           HD2      ARG  28  15.344  13.047   3.685
   10    HD3  ARG  28           HD1      ARG  28  16.159  14.335   2.798
   11    HE   ARG  28           HE       ARG  28  14.080  13.166   1.251
   12   HH11  ARG  28          HH11      ARG  28  14.675  15.380   3.875
   13   HH12  ARG  28          HH12      ARG  28  13.228  16.291   3.603
   14   HH21  ARG  28          HH21      ARG  28  12.173  14.360   0.887
   15   HH22  ARG  28          HH22      ARG  28  11.806  15.712   1.906
   16    H    ARG  29           HN       ARG  29  17.202  10.216   0.012
   17    HA   ARG  29           HA       ARG  29  15.948   8.018   1.378
   18    HB2  ARG  29           HB2      ARG  29  14.771   9.337  -0.348
   19    HB3  ARG  29           HB1      ARG  29  15.909   8.756  -1.554
   20    HG2  ARG  29           HG2      ARG  29  13.996   7.440  -1.825
   21    HG3  ARG  29           HG1      ARG  29  15.134   6.417  -0.947
   22    HD2  ARG  29           HD2      ARG  29  12.998   8.055   0.403
   23    HD3  ARG  29           HD1      ARG  29  12.754   6.388  -0.112
   24    HE   ARG  29           HE       ARG  29  15.066   6.558   1.490
   25   HH11  ARG  29          HH11      ARG  29  11.594   6.733   1.717
   26   HH12  ARG  29          HH12      ARG  29  11.543   6.169   3.355
   27   HH21  ARG  29          HH21      ARG  29  15.010   5.814   3.645
   28   HH22  ARG  29          HH22      ARG  29  13.486   5.648   4.450
   29    H    CYS  30           HN       CYS  30  16.322   5.850   1.132
   30    HA   CYS  30           HA       CYS  30  18.856   5.134  -0.174
   31    HB2  CYS  30           HB2      CYS  30  17.294   3.691   1.977
   32    HB3  CYS  30           HB1      CYS  30  18.812   3.132   1.283
   33    HG   CYS  30           HG       CYS  30  19.889   5.840   2.144
   34    H    LEU  31           HN       LEU  31  18.933   3.693  -1.798
   35    HA   LEU  31           HA       LEU  31  16.571   3.022  -3.203
   36    HB2  LEU  31           HB2      LEU  31  19.441   2.168  -3.477
   37    HB3  LEU  31           HB1      LEU  31  18.187   1.513  -4.510
   38    HG   LEU  31           HG       LEU  31  19.356   3.302  -5.647
   39   HD11  LEU  31          HD11      LEU  31  16.586   4.151  -4.819
   40   HD12  LEU  31          HD12      LEU  31  16.984   3.025  -6.116
   41   HD13  LEU  31          HD13      LEU  31  17.463   4.718  -6.239
   42   HD21  LEU  31          HD21      LEU  31  19.322   5.592  -4.837
   43   HD22  LEU  31          HD22      LEU  31  20.118   4.536  -3.672
   44   HD23  LEU  31          HD23      LEU  31  18.467   5.083  -3.381
   45    H    PHE  32           HN       PHE  32  18.466   1.367  -0.801
   46    HA   PHE  32           HA       PHE  32  17.301  -1.215  -1.295
   47    HB2  PHE  32           HB2      PHE  32  19.018  -0.128   0.937
   48    HB3  PHE  32           HB1      PHE  32  18.415  -1.782   0.915
   49    HD1  PHE  32           HD1      PHE  32  19.274  -3.401  -0.654
   50    HD2  PHE  32           HD2      PHE  32  20.726   0.599  -0.615
   51    HE1  PHE  32           HE1      PHE  32  21.192  -4.088  -2.033
   52    HE2  PHE  32           HE2      PHE  32  22.647  -0.080  -1.995
   53    HZ   PHE  32           HZ       PHE  32  22.882  -2.427  -2.707
   54    H    LEU  33           HN       LEU  33  16.807   1.424   0.994
   55    HA   LEU  33           HA       LEU  33  14.862   0.055   2.562
   56    HB2  LEU  33           HB2      LEU  33  15.436   3.000   2.276
   57    HB3  LEU  33           HB1      LEU  33  14.356   2.306   3.470
   58    HG   LEU  33           HG       LEU  33  17.345   1.935   3.289
   59   HD11  LEU  33          HD11      LEU  33  17.311   2.998   5.490
   60   HD12  LEU  33          HD12      LEU  33  15.562   3.184   5.368
   61   HD13  LEU  33          HD13      LEU  33  16.619   4.044   4.249
   62   HD21  LEU  33          HD21      LEU  33  16.372  -0.181   3.939
   63   HD22  LEU  33          HD22      LEU  33  15.354   0.619   5.137
   64   HD23  LEU  33          HD23      LEU  33  17.105   0.586   5.348
   65    H    SER  34           HN       SER  34  14.778   1.829  -0.400
   66    HA   SER  34           HA       SER  34  12.090   2.629  -0.443
   67    HB2  SER  34           HB2      SER  34  13.716   3.466  -2.064
   68    HB3  SER  34           HB1      SER  34  13.893   1.850  -2.748
   69    HG   SER  34           HG       SER  34  12.095   2.107  -3.818
   70    H    LEU  35           HN       LEU  35  13.646  -0.402  -1.332
   71    HA   LEU  35           HA       LEU  35  11.277  -1.601  -2.391
   72    HB2  LEU  35           HB2      LEU  35  13.601  -2.262  -3.011
   73    HB3  LEU  35           HB1      LEU  35  13.802  -2.932  -1.405
   74    HG   LEU  35           HG       LEU  35  11.537  -3.927  -3.074
   75   HD11  LEU  35          HD11      LEU  35  13.003  -5.582  -4.121
   76   HD12  LEU  35          HD12      LEU  35  14.409  -4.778  -3.422
   77   HD13  LEU  35          HD13      LEU  35  13.419  -3.942  -4.619
   78   HD21  LEU  35          HD21      LEU  35  11.741  -4.707  -0.792
   79   HD22  LEU  35          HD22      LEU  35  13.414  -5.185  -1.075
   80   HD23  LEU  35          HD23      LEU  35  12.105  -6.025  -1.906
   81    H    PHE  36           HN       PHE  36  12.832  -1.453   0.736
   82    HA   PHE  36           HA       PHE  36  11.374  -3.528   1.994
   83    HB2  PHE  36           HB2      PHE  36  13.501  -2.507   2.850
   84    HB3  PHE  36           HB1      PHE  36  12.579  -1.077   3.298
   85    HD1  PHE  36           HD1      PHE  36  13.156  -4.633   4.023
   86    HD2  PHE  36           HD2      PHE  36  11.174  -1.063   5.226
   87    HE1  PHE  36           HE1      PHE  36  12.610  -5.670   6.186
   88    HE2  PHE  36           HE2      PHE  36  10.626  -2.094   7.392
   89    HZ   PHE  36           HZ       PHE  36  11.365  -4.397   7.881
   90    H    SER  37           HN       SER  37  10.797  -0.075   1.583
   91    HA   SER  37           HA       SER  37   8.418  -0.108   3.217
   92    HB2  SER  37           HB2      SER  37   9.546   2.028   1.387
   93    HB3  SER  37           HB1      SER  37   8.164   2.246   2.460
   94    HG   SER  37           HG       SER  37   9.511   1.930   4.217
   95    H    PHE  38           HN       PHE  38   9.223  -0.854   0.009
   96    HA   PHE  38           HA       PHE  38   6.844  -0.128  -1.326
   97    HB2  PHE  38           HB2      PHE  38   9.130  -0.900  -2.291
   98    HB3  PHE  38           HB1      PHE  38   8.484  -2.523  -2.083
   99    HD1  PHE  38           HD1      PHE  38   8.074   0.661  -3.866
  100    HD2  PHE  38           HD2      PHE  38   6.800  -3.384  -3.528
  101    HE1  PHE  38           HE1      PHE  38   6.913   0.851  -6.027
  102    HE2  PHE  38           HE2      PHE  38   5.636  -3.204  -5.688
  103    HZ   PHE  38           HZ       PHE  38   5.692  -1.085  -6.940
  104    H    LEU  39           HN       LEU  39   7.556  -2.580   0.934
  105    HA   LEU  39           HA       LEU  39   5.423  -4.356   0.120
  106    HB2  LEU  39           HB2      LEU  39   7.583  -5.091   1.221
  107    HB3  LEU  39           HB1      LEU  39   6.978  -4.387   2.708
  108    HG   LEU  39           HG       LEU  39   5.352  -6.456   1.281
  109   HD11  LEU  39          HD11      LEU  39   7.583  -7.416   1.438
  110   HD12  LEU  39          HD12      LEU  39   6.478  -8.203   2.564
  111   HD13  LEU  39          HD13      LEU  39   7.643  -7.021   3.155
  112   HD21  LEU  39          HD21      LEU  39   5.693  -5.666   4.171
  113   HD22  LEU  39          HD22      LEU  39   4.656  -6.969   3.595
  114   HD23  LEU  39          HD23      LEU  39   4.313  -5.301   3.136
  115    H    ILE  40           HN       ILE  40   6.047  -1.972   2.643
  116    HA   ILE  40           HA       ILE  40   3.594  -2.371   4.029
  117    HB   ILE  40           HB       ILE  40   5.358   0.083   4.029
  118   HG12  ILE  40          HG12      ILE  40   5.386  -2.256   5.949
  119   HG13  ILE  40          HG11      ILE  40   6.528  -2.062   4.623
  120   HG21  ILE  40          HG21      ILE  40   3.146   0.503   4.943
  121   HG22  ILE  40          HG22      ILE  40   4.352   0.507   6.230
  122   HG23  ILE  40          HG23      ILE  40   3.301  -0.892   6.010
  123   HD11  ILE  40          HD11      ILE  40   6.181  -0.174   6.943
  124   HD12  ILE  40          HD12      ILE  40   7.331   0.014   5.618
  125   HD13  ILE  40          HD13      ILE  40   7.486  -1.342   6.735
  126    H    VAL  41           HN       VAL  41   4.580  -0.405   1.315
  127    HA   VAL  41           HA       VAL  41   2.320   1.333   1.361
  128    HB   VAL  41           HB       VAL  41   4.517   1.861   0.261
  129   HG11  VAL  41          HG11      VAL  41   4.828  -0.272  -0.868
  130   HG12  VAL  41          HG12      VAL  41   4.890   1.076  -2.002
  131   HG13  VAL  41          HG13      VAL  41   3.445   0.070  -1.904
  132   HG21  VAL  41          HG21      VAL  41   3.502   3.102  -1.590
  133   HG22  VAL  41          HG22      VAL  41   2.524   3.214  -0.127
  134   HG23  VAL  41          HG23      VAL  41   2.034   2.136  -1.433
  135    H    LEU  42           HN       LEU  42   2.995  -1.782  -0.073
  136    HA   LEU  42           HA       LEU  42   0.712  -1.719  -1.827
  137    HB2  LEU  42           HB2      LEU  42   2.934  -3.542  -1.264
  138    HB3  LEU  42           HB1      LEU  42   1.418  -4.367  -1.607
  139    HG   LEU  42           HG       LEU  42   2.764  -4.114  -3.626
  140   HD11  LEU  42          HD11      LEU  42   1.076  -3.103  -5.060
  141   HD12  LEU  42          HD12      LEU  42   0.312  -2.362  -3.655
  142   HD13  LEU  42          HD13      LEU  42   0.330  -4.117  -3.825
  143   HD21  LEU  42          HD21      LEU  42   3.166  -1.892  -4.585
  144   HD22  LEU  42          HD22      LEU  42   3.993  -2.104  -3.043
  145   HD23  LEU  42          HD23      LEU  42   2.512  -1.151  -3.125
  146    H    LEU  43           HN       LEU  43   1.533  -3.633   1.071
  147    HA   LEU  43           HA       LEU  43  -0.898  -4.943   1.351
  148    HB2  LEU  43           HB2      LEU  43   1.278  -4.190   3.248
  149    HB3  LEU  43           HB1      LEU  43  -0.216  -4.836   3.896
  150    HG   LEU  43           HG       LEU  43   1.458  -6.588   3.648
  151   HD11  LEU  43          HD11      LEU  43   0.140  -8.184   2.349
  152   HD12  LEU  43          HD12      LEU  43  -0.793  -6.854   1.663
  153   HD13  LEU  43          HD13      LEU  43  -0.882  -7.194   3.390
  154   HD21  LEU  43          HD21      LEU  43   2.785  -5.706   1.848
  155   HD22  LEU  43          HD22      LEU  43   1.427  -5.832   0.730
  156   HD23  LEU  43          HD23      LEU  43   2.173  -7.291   1.381
  157    H    LEU  44           HN       LEU  44  -0.102  -1.645   2.038
  158    HA   LEU  44           HA       LEU  44  -2.384  -1.222   3.761
  159    HB2  LEU  44           HB2      LEU  44  -0.258   0.561   2.626
  160    HB3  LEU  44           HB1      LEU  44  -1.671   1.238   3.411
  161    HG   LEU  44           HG       LEU  44   0.298  -0.648   4.709
  162   HD11  LEU  44          HD11      LEU  44   1.301   1.517   4.280
  163   HD12  LEU  44          HD12      LEU  44   0.976   1.326   6.003
  164   HD13  LEU  44          HD13      LEU  44  -0.086   2.326   5.010
  165   HD21  LEU  44          HD21      LEU  44  -0.875  -0.061   6.783
  166   HD22  LEU  44          HD22      LEU  44  -1.939  -0.874   5.635
  167   HD23  LEU  44          HD23      LEU  44  -2.045   0.873   5.850
  168    H    THR  45           HN       THR  45  -1.444  -0.254   0.467
  169    HA   THR  45           HA       THR  45  -3.691   1.264  -0.156
  170    HB   THR  45           HB       THR  45  -3.206   0.606  -2.560
  171    HG1  THR  45           HG1      THR  45  -0.888  -0.608  -1.460
  172   HG21  THR  45          HG21      THR  45  -2.266   2.619  -1.624
  173   HG22  THR  45          HG22      THR  45  -1.031   1.811  -2.590
  174   HG23  THR  45          HG23      THR  45  -0.988   1.699  -0.831
  175    H    THR  46           HN       THR  46  -3.390  -2.168   0.146
  176    HA   THR  46           HA       THR  46  -5.464  -3.020  -1.529
  177    HB   THR  46           HB       THR  46  -4.629  -4.254   1.104
  178    HG1  THR  46           HG1      THR  46  -2.864  -4.707   0.037
  179   HG21  THR  46          HG21      THR  46  -6.803  -5.053   0.190
  180   HG22  THR  46          HG22      THR  46  -5.563  -6.307   0.243
  181   HG23  THR  46          HG23      THR  46  -5.964  -5.528  -1.288
  182    H    LEU  47           HN       LEU  47  -5.607  -2.520   2.007
  183    HA   LEU  47           HA       LEU  47  -8.464  -2.618   2.024
  184    HB2  LEU  47           HB2      LEU  47  -6.294  -2.243   4.024
  185    HB3  LEU  47           HB1      LEU  47  -7.906  -1.723   4.452
  186    HG   LEU  47           HG       LEU  47  -8.754  -3.998   4.056
  187   HD11  LEU  47          HD11      LEU  47  -5.860  -4.689   3.571
  188   HD12  LEU  47          HD12      LEU  47  -7.141  -4.685   2.359
  189   HD13  LEU  47          HD13      LEU  47  -7.194  -5.837   3.694
  190   HD21  LEU  47          HD21      LEU  47  -8.033  -3.351   6.295
  191   HD22  LEU  47          HD22      LEU  47  -6.390  -3.877   5.926
  192   HD23  LEU  47          HD23      LEU  47  -7.700  -5.056   5.989
  193    H    PHE  48           HN       PHE  48  -6.004  -0.102   2.283
  194    HA   PHE  48           HA       PHE  48  -7.593   2.049   3.013
  195    HB2  PHE  48           HB2      PHE  48  -5.141   2.133   2.957
  196    HB3  PHE  48           HB1      PHE  48  -5.171   2.060   1.199
  197    HD1  PHE  48           HD1      PHE  48  -5.497   3.999  -0.098
  198    HD2  PHE  48           HD2      PHE  48  -6.081   4.135   4.116
  199    HE1  PHE  48           HE1      PHE  48  -5.621   6.455  -0.198
  200    HE2  PHE  48           HE2      PHE  48  -6.207   6.591   4.023
  201    HZ   PHE  48           HZ       PHE  48  -5.976   7.753   1.869
  202    H    CYS  49           HN       CYS  49  -7.237   0.510  -0.109
  203    HA   CYS  49           HA       CYS  49  -8.567   2.640  -1.530
  204    HB2  CYS  49           HB2      CYS  49  -6.884   1.310  -2.685
  205    HB3  CYS  49           HB1      CYS  49  -7.815  -0.156  -2.401
  206    HG   CYS  49           HG       CYS  49  -8.995   2.447  -4.277
  207    H    LEU  50           HN       LEU  50  -9.415  -0.540  -0.269
  208    HA   LEU  50           HA       LEU  50 -12.009  -0.649  -1.429
  209    HB2  LEU  50           HB2      LEU  50 -10.947  -2.074   1.015
  210    HB3  LEU  50           HB1      LEU  50 -12.393  -2.509   0.111
  211    HG   LEU  50           HG       LEU  50  -9.670  -2.492  -1.174
  212   HD11  LEU  50          HD11      LEU  50  -9.522  -4.878  -0.739
  213   HD12  LEU  50          HD12      LEU  50 -11.017  -4.816   0.195
  214   HD13  LEU  50          HD13      LEU  50  -9.579  -3.973   0.775
  215   HD21  LEU  50          HD21      LEU  50 -11.560  -2.504  -2.688
  216   HD22  LEU  50          HD22      LEU  50 -12.270  -3.872  -1.829
  217   HD23  LEU  50          HD23      LEU  50 -10.757  -4.074  -2.713
  218    H    LEU  51           HN       LEU  51 -10.720   0.869   1.397
  219    HA   LEU  51           HA       LEU  51 -13.254   1.148   2.735
  220    HB2  LEU  51           HB2      LEU  51 -10.575   2.443   3.227
  221    HB3  LEU  51           HB1      LEU  51 -11.978   2.649   4.258
  222    HG   LEU  51           HG       LEU  51 -10.667  -0.015   3.713
  223   HD11  LEU  51          HD11      LEU  51  -9.707   0.180   5.940
  224   HD12  LEU  51          HD12      LEU  51 -10.386   1.799   6.105
  225   HD13  LEU  51          HD13      LEU  51  -9.140   1.483   4.898
  226   HD21  LEU  51          HD21      LEU  51 -12.712   0.843   5.758
  227   HD22  LEU  51          HD22      LEU  51 -11.989  -0.760   5.628
  228   HD23  LEU  51          HD23      LEU  51 -13.024  -0.151   4.336
  229    H    HIS  52           HN       HIS  52 -11.106   3.256   0.866
  230    HA   HIS  52           HA       HIS  52 -12.844   5.524   1.114
  231    HB2  HIS  52           HB2      HIS  52 -10.349   4.956  -0.457
  232    HB3  HIS  52           HB1      HIS  52 -11.284   6.417  -0.752
  233    HD1  HIS  52           HD1      HIS  52 -10.954   8.331   0.841
  234    HD2  HIS  52           HD2      HIS  52  -9.250   4.799   2.215
  235    HE1  HIS  52           HE1      HIS  52  -9.619   8.974   2.872
  236    HE2  HIS  52           HE2      HIS  52  -8.548   6.831   3.651
  237    H    PHE  53           HN       PHE  53 -12.527   2.867  -1.099
  238    HA   PHE  53           HA       PHE  53 -14.014   4.149  -3.211
  239    HB2  PHE  53           HB2      PHE  53 -12.289   2.344  -3.585
  240    HB3  PHE  53           HB1      PHE  53 -13.437   1.199  -2.902
  241    HD1  PHE  53           HD1      PHE  53 -15.337   0.456  -4.138
  242    HD2  PHE  53           HD2      PHE  53 -12.739   3.423  -5.737
  243    HE1  PHE  53           HE1      PHE  53 -16.376   0.166  -6.349
  244    HE2  PHE  53           HE2      PHE  53 -13.772   3.138  -7.953
  245    HZ   PHE  53           HZ       PHE  53 -15.587   1.518  -8.266
  246    H    GLY  54           HN       GLY  54 -14.694   2.206  -0.428
  247    HA2  GLY  54           HA2      GLY  54 -16.692   1.703   0.591
  248    HA3  GLY  54           HA1      GLY  54 -17.475   2.782  -0.551
  249    H    VAL  55           HN       VAL  55 -15.566   0.076  -1.650
  250    HA   VAL  55           HA       VAL  55 -17.468  -0.964  -3.348
  251    HB   VAL  55           HB       VAL  55 -15.231  -1.690  -3.611
  252   HG11  VAL  55          HG11      VAL  55 -15.422  -2.717  -0.802
  253   HG12  VAL  55          HG12      VAL  55 -14.350  -1.470  -1.430
  254   HG13  VAL  55          HG13      VAL  55 -14.121  -3.153  -1.907
  255   HG21  VAL  55          HG21      VAL  55 -15.426  -4.110  -3.711
  256   HG22  VAL  55          HG22      VAL  55 -16.930  -3.349  -4.227
  257   HG23  VAL  55          HG23      VAL  55 -16.807  -4.059  -2.617
  258    H    ILE  56           HN       ILE  56 -16.883  -1.750   0.025
  259    HA   ILE  56           HA       ILE  56 -19.564  -2.891   0.195
  260    HB   ILE  56           HB       ILE  56 -18.249  -4.587   1.868
  261   HG12  ILE  56          HG12      ILE  56 -16.432  -5.604   0.448
  262   HG13  ILE  56          HG11      ILE  56 -16.510  -4.169  -0.567
  263   HG21  ILE  56          HG21      ILE  56 -18.953  -5.052  -1.024
  264   HG22  ILE  56          HG22      ILE  56 -20.048  -5.173   0.351
  265   HG23  ILE  56          HG23      ILE  56 -18.711  -6.311   0.186
  266   HD11  ILE  56          HD11      ILE  56 -15.788  -4.239   2.354
  267   HD12  ILE  56          HD12      ILE  56 -15.890  -2.789   1.355
  268   HD13  ILE  56          HD13      ILE  56 -14.678  -4.018   1.000
  269    H    GLY  57           HN       GLY  57 -17.549  -0.673   1.249
  270    HA2  GLY  57           HA2      GLY  57 -18.896  -0.434   3.815
  271    HA3  GLY  57           HA1      GLY  57 -17.148  -0.601   3.884
  272    HA   PRO  58           HA       PRO  58 -18.194   3.600   1.589
  273    HB2  PRO  58           HB2      PRO  58 -20.834   4.174   2.783
  274    HB3  PRO  58           HB1      PRO  58 -20.286   4.371   1.116
  275    HG2  PRO  58           HG2      PRO  58 -21.990   2.423   1.799
  276    HG3  PRO  58           HG1      PRO  58 -20.741   2.172   0.564
  277    HD2  PRO  58           HD2      PRO  58 -20.780   1.293   3.427
  278    HD3  PRO  58           HD1      PRO  58 -20.225   0.415   1.986
  279    H    GLN  59           HN       GLN  59 -16.584   4.241   3.023
  280    HA   GLN  59           HA       GLN  59 -17.489   5.347   5.594
  281    HB2  GLN  59           HB2      GLN  59 -14.694   4.586   4.723
  282    HB3  GLN  59           HB1      GLN  59 -15.141   5.207   6.305
  283    HG2  GLN  59           HG2      GLN  59 -16.028   2.597   5.100
  284    HG3  GLN  59           HG1      GLN  59 -14.831   2.810   6.375
  285   HE21  GLN  59          HE21      GLN  59 -17.317   1.296   6.392
  286   HE22  GLN  59          HE22      GLN  59 -18.260   1.933   7.691
  287    H    ARG  60           HN       ARG  60 -17.431   6.506   2.742
  288    HA   ARG  60           HA       ARG  60 -15.536   8.603   2.713
  289    HB2  ARG  60           HB2      ARG  60 -18.212   8.430   1.314
  290    HB3  ARG  60           HB1      ARG  60 -16.933   9.573   0.932
  291    HG2  ARG  60           HG2      ARG  60 -15.467   7.730   0.293
  292    HG3  ARG  60           HG1      ARG  60 -16.745   6.578   0.683
  293    HD2  ARG  60           HD2      ARG  60 -16.646   7.004  -1.718
  294    HD3  ARG  60           HD1      ARG  60 -18.170   7.566  -1.033
  295    HE   ARG  60           HE       ARG  60 -16.591   9.773  -0.987
  296   HH11  ARG  60          HH11      ARG  60 -17.501   7.508  -3.473
  297   HH12  ARG  60          HH12      ARG  60 -17.415   8.676  -4.749
  298   HH21  ARG  60          HH21      ARG  60 -16.472  11.318  -2.662
  299   HH22  ARG  60          HH22      ARG  60 -16.829  10.841  -4.289
  Start of MODEL   10
    1    H1   ARG  28           HT1      ARG  28  26.377   5.620  -3.922
    2    H2   ARG  28           HT2      ARG  28  25.805   5.206  -5.458
    3    H3   ARG  28           HT3      ARG  28  27.312   4.641  -4.938
    4    HA   ARG  28           HA       ARG  28  25.687   2.887  -4.828
    5    HB2  ARG  28           HB2      ARG  28  27.482   2.891  -3.177
    6    HB3  ARG  28           HB1      ARG  28  26.548   3.949  -2.129
    7    HG2  ARG  28           HG2      ARG  28  26.453   1.691  -1.305
    8    HG3  ARG  28           HG1      ARG  28  24.858   2.177  -1.882
    9    HD2  ARG  28           HD2      ARG  28  25.307  -0.069  -2.615
   10    HD3  ARG  28           HD1      ARG  28  25.322   1.004  -4.013
   11    HE   ARG  28           HE       ARG  28  27.936   0.675  -2.972
   12   HH11  ARG  28          HH11      ARG  28  25.485  -0.960  -4.833
   13   HH12  ARG  28          HH12      ARG  28  26.617  -1.947  -5.697
   14   HH21  ARG  28          HH21      ARG  28  29.434  -0.623  -4.102
   15   HH22  ARG  28          HH22      ARG  28  28.861  -1.757  -5.280
   16    H    ARG  29           HN       ARG  29  23.572   3.064  -5.321
   17    HA   ARG  29           HA       ARG  29  21.795   4.663  -3.671
   18    HB2  ARG  29           HB2      ARG  29  21.371   3.044  -6.181
   19    HB3  ARG  29           HB1      ARG  29  20.050   3.812  -5.315
   20    HG2  ARG  29           HG2      ARG  29  20.615   5.277  -7.060
   21    HG3  ARG  29           HG1      ARG  29  21.300   5.990  -5.598
   22    HD2  ARG  29           HD2      ARG  29  22.849   6.077  -7.514
   23    HD3  ARG  29           HD1      ARG  29  23.490   5.142  -6.164
   24    HE   ARG  29           HE       ARG  29  22.175   3.412  -7.946
   25   HH11  ARG  29          HH11      ARG  29  25.040   5.383  -7.737
   26   HH12  ARG  29          HH12      ARG  29  25.961   4.385  -8.811
   27   HH21  ARG  29          HH21      ARG  29  23.380   2.091  -9.361
   28   HH22  ARG  29          HH22      ARG  29  25.018   2.514  -9.735
   29    H    CYS  30           HN       CYS  30  19.908   3.802  -2.652
   30    HA   CYS  30           HA       CYS  30  20.349   1.093  -1.632
   31    HB2  CYS  30           HB2      CYS  30  18.565   3.306  -0.598
   32    HB3  CYS  30           HB1      CYS  30  18.786   1.737   0.167
   33    HG   CYS  30           HG       CYS  30  21.669   2.292   0.372
   34    H    LEU  31           HN       LEU  31  19.484  -0.182  -3.244
   35    HA   LEU  31           HA       LEU  31  16.831   0.308  -4.266
   36    HB2  LEU  31           HB2      LEU  31  18.555  -0.648  -5.709
   37    HB3  LEU  31           HB1      LEU  31  18.707  -2.028  -4.640
   38    HG   LEU  31           HG       LEU  31  16.342  -2.633  -5.174
   39   HD11  LEU  31          HD11      LEU  31  15.296  -1.610  -7.130
   40   HD12  LEU  31          HD12      LEU  31  16.625  -0.456  -7.241
   41   HD13  LEU  31          HD13      LEU  31  15.548  -0.430  -5.844
   42   HD21  LEU  31          HD21      LEU  31  16.842  -3.519  -7.394
   43   HD22  LEU  31          HD22      LEU  31  18.217  -3.707  -6.307
   44   HD23  LEU  31          HD23      LEU  31  18.224  -2.430  -7.523
   45    H    PHE  32           HN       PHE  32  18.382  -2.105  -2.179
   46    HA   PHE  32           HA       PHE  32  16.125  -3.687  -1.691
   47    HB2  PHE  32           HB2      PHE  32  18.320  -4.497  -1.118
   48    HB3  PHE  32           HB1      PHE  32  18.574  -3.166   0.003
   49    HD1  PHE  32           HD1      PHE  32  16.572  -6.222  -0.583
   50    HD2  PHE  32           HD2      PHE  32  17.884  -3.317   2.238
   51    HE1  PHE  32           HE1      PHE  32  15.671  -7.598   1.249
   52    HE2  PHE  32           HE2      PHE  32  16.987  -4.687   4.073
   53    HZ   PHE  32           HZ       PHE  32  15.878  -6.830   3.579
   54    H    LEU  33           HN       LEU  33  17.439  -0.942   0.148
   55    HA   LEU  33           HA       LEU  33  15.547  -0.956   2.210
   56    HB2  LEU  33           HB2      LEU  33  17.082   1.357   1.042
   57    HB3  LEU  33           HB1      LEU  33  16.188   1.411   2.550
   58    HG   LEU  33           HG       LEU  33  18.651  -0.224   1.953
   59   HD11  LEU  33          HD11      LEU  33  18.095   2.009   3.893
   60   HD12  LEU  33          HD12      LEU  33  19.073   2.113   2.429
   61   HD13  LEU  33          HD13      LEU  33  19.604   1.106   3.776
   62   HD21  LEU  33          HD21      LEU  33  16.895  -0.232   4.406
   63   HD22  LEU  33          HD22      LEU  33  18.492  -0.974   4.301
   64   HD23  LEU  33          HD23      LEU  33  17.171  -1.578   3.301
   65    H    SER  34           HN       SER  34  15.449   0.419  -1.013
   66    HA   SER  34           HA       SER  34  13.105   1.989  -0.598
   67    HB2  SER  34           HB2      SER  34  14.682   2.498  -2.408
   68    HB3  SER  34           HB1      SER  34  14.322   0.948  -3.169
   69    HG   SER  34           HG       SER  34  12.056   2.337  -2.676
   70    H    LEU  35           HN       LEU  35  13.732  -1.314  -1.533
   71    HA   LEU  35           HA       LEU  35  11.041  -1.838  -2.409
   72    HB2  LEU  35           HB2      LEU  35  12.995  -3.055  -3.305
   73    HB3  LEU  35           HB1      LEU  35  13.265  -3.758  -1.722
   74    HG   LEU  35           HG       LEU  35  11.097  -4.913  -1.863
   75   HD11  LEU  35          HD11      LEU  35   9.904  -3.349  -3.286
   76   HD12  LEU  35          HD12      LEU  35   9.891  -4.962  -4.000
   77   HD13  LEU  35          HD13      LEU  35  10.979  -3.726  -4.633
   78   HD21  LEU  35          HD21      LEU  35  11.732  -6.528  -3.583
   79   HD22  LEU  35          HD22      LEU  35  13.123  -6.040  -2.614
   80   HD23  LEU  35          HD23      LEU  35  12.900  -5.378  -4.233
   81    H    PHE  36           HN       PHE  36  12.703  -1.762   0.579
   82    HA   PHE  36           HA       PHE  36  11.039  -3.609   1.994
   83    HB2  PHE  36           HB2      PHE  36  13.360  -3.001   2.691
   84    HB3  PHE  36           HB1      PHE  36  12.773  -1.396   3.112
   85    HD1  PHE  36           HD1      PHE  36  12.700  -4.954   4.001
   86    HD2  PHE  36           HD2      PHE  36  11.505  -1.022   5.107
   87    HE1  PHE  36           HE1      PHE  36  12.112  -5.769   6.247
   88    HE2  PHE  36           HE2      PHE  36  10.915  -1.829   7.355
   89    HZ   PHE  36           HZ       PHE  36  11.218  -4.205   7.927
   90    H    SER  37           HN       SER  37  10.938  -0.192   1.287
   91    HA   SER  37           HA       SER  37   8.712   0.235   3.124
   92    HB2  SER  37           HB2      SER  37  10.160   2.171   1.299
   93    HB3  SER  37           HB1      SER  37   8.907   2.608   2.461
   94    HG   SER  37           HG       SER  37  10.362   1.604   4.066
   95    H    PHE  38           HN       PHE  38   8.956  -1.117   0.224
   96    HA   PHE  38           HA       PHE  38   6.684   0.251  -1.015
   97    HB2  PHE  38           HB2      PHE  38   8.820  -0.435  -2.281
   98    HB3  PHE  38           HB1      PHE  38   8.192  -2.074  -2.176
   99    HD1  PHE  38           HD1      PHE  38   7.568   1.286  -3.550
  100    HD2  PHE  38           HD2      PHE  38   6.436  -2.817  -3.575
  101    HE1  PHE  38           HE1      PHE  38   6.202   1.679  -5.559
  102    HE2  PHE  38           HE2      PHE  38   5.069  -2.431  -5.585
  103    HZ   PHE  38           HZ       PHE  38   4.968  -0.180  -6.590
  104    H    LEU  39           HN       LEU  39   7.452  -2.522   0.830
  105    HA   LEU  39           HA       LEU  39   5.204  -4.101  -0.047
  106    HB2  LEU  39           HB2      LEU  39   7.351  -5.076   0.783
  107    HB3  LEU  39           HB1      LEU  39   6.952  -4.486   2.385
  108    HG   LEU  39           HG       LEU  39   5.008  -6.263   0.992
  109   HD11  LEU  39          HD11      LEU  39   7.513  -7.217   2.370
  110   HD12  LEU  39          HD12      LEU  39   7.121  -7.405   0.661
  111   HD13  LEU  39          HD13      LEU  39   6.160  -8.239   1.882
  112   HD21  LEU  39          HD21      LEU  39   5.853  -5.889   3.863
  113   HD22  LEU  39          HD22      LEU  39   4.627  -7.031   3.309
  114   HD23  LEU  39          HD23      LEU  39   4.369  -5.297   3.115
  115    H    ILE  40           HN       ILE  40   5.999  -1.975   2.635
  116    HA   ILE  40           HA       ILE  40   3.610  -2.522   4.116
  117    HB   ILE  40           HB       ILE  40   5.484  -0.162   4.338
  118   HG12  ILE  40          HG12      ILE  40   5.445  -2.723   5.949
  119   HG13  ILE  40          HG11      ILE  40   6.575  -2.393   4.641
  120   HG21  ILE  40          HG21      ILE  40   3.330   0.262   5.377
  121   HG22  ILE  40          HG22      ILE  40   4.573   0.053   6.609
  122   HG23  ILE  40          HG23      ILE  40   3.440  -1.256   6.269
  123   HD11  ILE  40          HD11      ILE  40   7.581  -2.005   6.821
  124   HD12  ILE  40          HD12      ILE  40   6.333  -0.817   7.193
  125   HD13  ILE  40          HD13      ILE  40   7.480  -0.511   5.889
  126    H    VAL  41           HN       VAL  41   4.567  -0.254   1.641
  127    HA   VAL  41           HA       VAL  41   2.333   1.503   1.985
  128    HB   VAL  41           HB       VAL  41   4.561   2.128   0.947
  129   HG11  VAL  41          HG11      VAL  41   3.349   0.765  -1.446
  130   HG12  VAL  41          HG12      VAL  41   4.763   0.225  -0.544
  131   HG13  VAL  41          HG13      VAL  41   4.818   1.741  -1.441
  132   HG21  VAL  41          HG21      VAL  41   2.021   2.784  -0.545
  133   HG22  VAL  41          HG22      VAL  41   3.530   3.688  -0.662
  134   HG23  VAL  41          HG23      VAL  41   2.657   3.626   0.869
  135    H    LEU  42           HN       LEU  42   2.901  -1.454   0.308
  136    HA   LEU  42           HA       LEU  42   0.715  -1.141  -1.547
  137    HB2  LEU  42           HB2      LEU  42   2.911  -2.574  -1.747
  138    HB3  LEU  42           HB1      LEU  42   1.962  -3.783  -0.895
  139    HG   LEU  42           HG       LEU  42   1.934  -4.141  -3.320
  140   HD11  LEU  42          HD11      LEU  42   0.001  -4.830  -1.984
  141   HD12  LEU  42          HD12      LEU  42  -0.461  -4.359  -3.619
  142   HD13  LEU  42          HD13      LEU  42  -0.750  -3.261  -2.271
  143   HD21  LEU  42          HD21      LEU  42   2.200  -1.819  -4.030
  144   HD22  LEU  42          HD22      LEU  42   0.569  -1.456  -3.463
  145   HD23  LEU  42          HD23      LEU  42   0.808  -2.574  -4.805
  146    H    LEU  43           HN       LEU  43   1.352  -3.210   1.289
  147    HA   LEU  43           HA       LEU  43  -1.096  -4.501   1.413
  148    HB2  LEU  43           HB2      LEU  43   0.699  -3.638   3.681
  149    HB3  LEU  43           HB1      LEU  43  -0.638  -4.760   3.848
  150    HG   LEU  43           HG       LEU  43   1.819  -5.210   2.149
  151   HD11  LEU  43          HD11      LEU  43   0.982  -6.405   4.787
  152   HD12  LEU  43          HD12      LEU  43   2.329  -5.299   4.519
  153   HD13  LEU  43          HD13      LEU  43   2.366  -6.918   3.821
  154   HD21  LEU  43          HD21      LEU  43  -0.517  -7.015   2.772
  155   HD22  LEU  43          HD22      LEU  43   0.950  -7.496   1.921
  156   HD23  LEU  43          HD23      LEU  43  -0.133  -6.303   1.205
  157    H    LEU  44           HN       LEU  44  -0.222  -1.281   2.509
  158    HA   LEU  44           HA       LEU  44  -2.650  -0.843   3.959
  159    HB2  LEU  44           HB2      LEU  44  -0.485   1.004   2.980
  160    HB3  LEU  44           HB1      LEU  44  -1.904   1.589   3.826
  161    HG   LEU  44           HG       LEU  44   0.131  -0.341   4.951
  162   HD11  LEU  44          HD11      LEU  44   0.728   1.540   6.419
  163   HD12  LEU  44          HD12      LEU  44  -0.369   2.579   5.508
  164   HD13  LEU  44          HD13      LEU  44   1.048   1.887   4.719
  165   HD21  LEU  44          HD21      LEU  44  -2.090  -0.741   5.858
  166   HD22  LEU  44          HD22      LEU  44  -2.266   0.975   6.227
  167   HD23  LEU  44          HD23      LEU  44  -1.054   0.012   7.071
  168    H    THR  45           HN       THR  45  -1.433   0.275   0.802
  169    HA   THR  45           HA       THR  45  -3.695   1.750   0.071
  170    HB   THR  45           HB       THR  45  -2.915   1.273  -2.321
  171    HG1  THR  45           HG1      THR  45  -0.547   0.524  -2.075
  172   HG21  THR  45          HG21      THR  45  -0.973   2.465  -0.339
  173   HG22  THR  45          HG22      THR  45  -2.319   3.305  -1.109
  174   HG23  THR  45          HG23      THR  45  -0.961   2.739  -2.081
  175    H    THR  46           HN       THR  46  -3.189  -1.664   0.159
  176    HA   THR  46           HA       THR  46  -5.081  -2.460  -1.777
  177    HB   THR  46           HB       THR  46  -4.222  -3.952   0.711
  178    HG1  THR  46           HG1      THR  46  -3.250  -4.393  -1.909
  179   HG21  THR  46          HG21      THR  46  -6.285  -4.844  -0.294
  180   HG22  THR  46          HG22      THR  46  -4.930  -5.956  -0.494
  181   HG23  THR  46          HG23      THR  46  -5.466  -4.966  -1.851
  182    H    LEU  47           HN       LEU  47  -5.399  -2.396   1.785
  183    HA   LEU  47           HA       LEU  47  -8.226  -2.785   1.663
  184    HB2  LEU  47           HB2      LEU  47  -6.180  -2.402   3.783
  185    HB3  LEU  47           HB1      LEU  47  -7.848  -2.076   4.191
  186    HG   LEU  47           HG       LEU  47  -8.458  -4.369   3.522
  187   HD11  LEU  47          HD11      LEU  47  -6.687  -6.008   3.098
  188   HD12  LEU  47          HD12      LEU  47  -5.491  -4.712   3.113
  189   HD13  LEU  47          HD13      LEU  47  -6.732  -4.753   1.861
  190   HD21  LEU  47          HD21      LEU  47  -7.375  -5.520   5.398
  191   HD22  LEU  47          HD22      LEU  47  -7.931  -3.908   5.848
  192   HD23  LEU  47          HD23      LEU  47  -6.220  -4.195   5.536
  193    H    PHE  48           HN       PHE  48  -6.093  -0.045   2.349
  194    HA   PHE  48           HA       PHE  48  -7.995   1.812   3.156
  195    HB2  PHE  48           HB2      PHE  48  -5.636   2.267   3.392
  196    HB3  PHE  48           HB1      PHE  48  -5.407   2.226   1.648
  197    HD1  PHE  48           HD1      PHE  48  -5.634   4.168   0.372
  198    HD2  PHE  48           HD2      PHE  48  -7.098   4.094   4.367
  199    HE1  PHE  48           HE1      PHE  48  -6.032   6.594   0.266
  200    HE2  PHE  48           HE2      PHE  48  -7.501   6.519   4.268
  201    HZ   PHE  48           HZ       PHE  48  -6.960   7.774   2.212
  202    H    CYS  49           HN       CYS  49  -7.202   0.674  -0.051
  203    HA   CYS  49           HA       CYS  49  -8.624   2.787  -1.395
  204    HB2  CYS  49           HB2      CYS  49  -6.742   1.720  -2.511
  205    HB3  CYS  49           HB1      CYS  49  -7.544   0.155  -2.421
  206    HG   CYS  49           HG       CYS  49  -9.475   0.678  -4.266
  207    H    LEU  50           HN       LEU  50  -9.226  -0.608  -0.606
  208    HA   LEU  50           HA       LEU  50 -11.716  -0.807  -1.933
  209    HB2  LEU  50           HB2      LEU  50 -10.686  -2.383   0.430
  210    HB3  LEU  50           HB1      LEU  50 -12.033  -2.842  -0.607
  211    HG   LEU  50           HG       LEU  50  -9.227  -2.483  -1.651
  212   HD11  LEU  50          HD11      LEU  50  -8.976  -4.897  -1.525
  213   HD12  LEU  50          HD12      LEU  50 -10.550  -5.034  -0.739
  214   HD13  LEU  50          HD13      LEU  50  -9.223  -4.212   0.082
  215   HD21  LEU  50          HD21      LEU  50 -10.053  -3.838  -3.504
  216   HD22  LEU  50          HD22      LEU  50 -11.019  -2.376  -3.306
  217   HD23  LEU  50          HD23      LEU  50 -11.641  -3.927  -2.741
  218    H    LEU  51           HN       LEU  51 -10.773   0.425   1.174
  219    HA   LEU  51           HA       LEU  51 -13.437   0.422   2.268
  220    HB2  LEU  51           HB2      LEU  51 -10.878   1.720   3.201
  221    HB3  LEU  51           HB1      LEU  51 -12.386   1.768   4.095
  222    HG   LEU  51           HG       LEU  51 -10.890  -0.760   3.394
  223   HD11  LEU  51          HD11      LEU  51 -10.302  -0.829   5.768
  224   HD12  LEU  51          HD12      LEU  51 -11.049   0.752   5.997
  225   HD13  LEU  51          HD13      LEU  51  -9.625   0.590   4.970
  226   HD21  LEU  51          HD21      LEU  51 -13.273  -0.264   5.175
  227   HD22  LEU  51          HD22      LEU  51 -12.417  -1.798   5.016
  228   HD23  LEU  51          HD23      LEU  51 -13.278  -1.120   3.633
  229    H    HIS  52           HN       HIS  52 -11.228   2.829   0.902
  230    HA   HIS  52           HA       HIS  52 -12.804   5.098   1.367
  231    HB2  HIS  52           HB2      HIS  52 -10.437   5.204   0.703
  232    HB3  HIS  52           HB1      HIS  52 -10.857   4.593  -0.893
  233    HD1  HIS  52           HD1      HIS  52 -12.015   6.232  -2.525
  234    HD2  HIS  52           HD2      HIS  52 -11.019   7.907   1.145
  235    HE1  HIS  52           HE1      HIS  52 -12.266   8.715  -2.829
  236    HE2  HIS  52           HE2      HIS  52 -11.696   9.708  -0.584
  237    H    PHE  53           HN       PHE  53 -12.694   2.894  -1.414
  238    HA   PHE  53           HA       PHE  53 -14.765   4.358  -2.798
  239    HB2  PHE  53           HB2      PHE  53 -13.274   1.811  -3.406
  240    HB3  PHE  53           HB1      PHE  53 -14.610   2.375  -4.404
  241    HD1  PHE  53           HD1      PHE  53 -14.178   3.793  -6.172
  242    HD2  PHE  53           HD2      PHE  53 -11.363   3.527  -2.994
  243    HE1  PHE  53           HE1      PHE  53 -12.630   5.233  -7.430
  244    HE2  PHE  53           HE2      PHE  53  -9.809   4.967  -4.245
  245    HZ   PHE  53           HZ       PHE  53 -10.448   5.825  -6.471
  246    H    GLY  54           HN       GLY  54 -14.568   1.685  -0.613
  247    HA2  GLY  54           HA2      GLY  54 -16.225   0.482   0.436
  248    HA3  GLY  54           HA1      GLY  54 -17.382   1.619  -0.240
  249    H    VAL  55           HN       VAL  55 -15.220  -0.183  -2.282
  250    HA   VAL  55           HA       VAL  55 -17.126  -1.125  -4.019
  251    HB   VAL  55           HB       VAL  55 -14.853  -1.202  -4.683
  252   HG11  VAL  55          HG11      VAL  55 -13.199  -2.692  -3.646
  253   HG12  VAL  55          HG12      VAL  55 -14.388  -3.119  -2.419
  254   HG13  VAL  55          HG13      VAL  55 -13.800  -1.463  -2.533
  255   HG21  VAL  55          HG21      VAL  55 -15.799  -4.045  -4.367
  256   HG22  VAL  55          HG22      VAL  55 -14.598  -3.471  -5.523
  257   HG23  VAL  55          HG23      VAL  55 -16.275  -2.942  -5.656
  258    H    ILE  56           HN       ILE  56 -15.839  -2.753  -1.158
  259    HA   ILE  56           HA       ILE  56 -18.229  -4.378  -1.028
  260    HB   ILE  56           HB       ILE  56 -16.612  -6.440  -0.600
  261   HG12  ILE  56          HG12      ILE  56 -14.771  -6.478  -2.213
  262   HG13  ILE  56          HG11      ILE  56 -15.147  -4.835  -2.712
  263   HG21  ILE  56          HG21      ILE  56 -17.462  -5.508  -3.328
  264   HG22  ILE  56          HG22      ILE  56 -18.475  -6.355  -2.160
  265   HG23  ILE  56          HG23      ILE  56 -17.078  -7.166  -2.866
  266   HD11  ILE  56          HD11      ILE  56 -14.022  -5.742  -0.078
  267   HD12  ILE  56          HD12      ILE  56 -14.598  -4.103  -0.386
  268   HD13  ILE  56          HD13      ILE  56 -13.244  -4.749  -1.311
  269    H    GLY  57           HN       GLY  57 -15.874  -5.906   0.764
  270    HA2  GLY  57           HA2      GLY  57 -15.011  -5.394   2.927
  271    HA3  GLY  57           HA1      GLY  57 -16.232  -4.139   3.076
  272    HA   PRO  58           HA       PRO  58 -18.526  -8.385   3.748
  273    HB2  PRO  58           HB2      PRO  58 -16.886 -10.481   4.364
  274    HB3  PRO  58           HB1      PRO  58 -17.487 -10.150   2.736
  275    HG2  PRO  58           HG2      PRO  58 -14.836  -9.480   3.952
  276    HG3  PRO  58           HG1      PRO  58 -15.201 -10.102   2.331
  277    HD2  PRO  58           HD2      PRO  58 -14.653  -7.502   2.770
  278    HD3  PRO  58           HD1      PRO  58 -15.817  -8.022   1.533
  279    H    GLN  59           HN       GLN  59 -15.551  -9.077   5.532
  280    HA   GLN  59           HA       GLN  59 -16.391  -7.757   7.916
  281    HB2  GLN  59           HB2      GLN  59 -16.691  -9.791   9.296
  282    HB3  GLN  59           HB1      GLN  59 -17.931  -9.621   8.061
  283    HG2  GLN  59           HG2      GLN  59 -16.663 -11.221   6.649
  284    HG3  GLN  59           HG1      GLN  59 -15.553 -11.462   7.997
  285   HE21  GLN  59          HE21      GLN  59 -16.253 -12.567   9.822
  286   HE22  GLN  59          HE22      GLN  59 -17.688 -13.529   9.823
  287    H    ARG  60           HN       ARG  60 -14.050  -7.974   6.199
  288    HA   ARG  60           HA       ARG  60 -12.108  -9.035   8.147
  289    HB2  ARG  60           HB2      ARG  60 -12.162 -10.208   5.935
  290    HB3  ARG  60           HB1      ARG  60 -11.691  -8.696   5.172
  291    HG2  ARG  60           HG2      ARG  60  -9.756 -10.084   5.429
  292    HG3  ARG  60           HG1      ARG  60  -9.619  -8.707   6.524
  293    HD2  ARG  60           HD2      ARG  60  -8.944 -10.808   7.599
  294    HD3  ARG  60           HD1      ARG  60 -10.344 -10.082   8.387
  295    HE   ARG  60           HE       ARG  60 -11.119 -11.979   6.412
  296   HH11  ARG  60          HH11      ARG  60  -9.917 -11.684   9.670
  297   HH12  ARG  60          HH12      ARG  60 -10.590 -13.191  10.192
  298   HH21  ARG  60          HH21      ARG  60 -12.011 -13.963   7.092
  299   HH22  ARG  60          HH22      ARG  60 -11.780 -14.487   8.727
  Start of MODEL   11
    1    H1   ARG  28           HT1      ARG  28  20.880   9.798  -4.730
    2    H2   ARG  28           HT2      ARG  28  19.550   8.930  -4.149
    3    H3   ARG  28           HT3      ARG  28  20.900   8.106  -4.748
    4    HA   ARG  28           HA       ARG  28  22.261   8.968  -2.958
    5    HB2  ARG  28           HB2      ARG  28  19.653  10.120  -1.948
    6    HB3  ARG  28           HB1      ARG  28  21.191  10.156  -1.097
    7    HG2  ARG  28           HG2      ARG  28  22.135  11.529  -2.906
    8    HG3  ARG  28           HG1      ARG  28  20.558  11.532  -3.700
    9    HD2  ARG  28           HD2      ARG  28  19.585  12.601  -1.709
   10    HD3  ARG  28           HD1      ARG  28  21.183  12.641  -0.967
   11    HE   ARG  28           HE       ARG  28  21.135  13.918  -3.522
   12   HH11  ARG  28          HH11      ARG  28  20.409  14.351  -0.142
   13   HH12  ARG  28          HH12      ARG  28  20.582  16.073  -0.193
   14   HH21  ARG  28          HH21      ARG  28  21.366  16.185  -3.599
   15   HH22  ARG  28          HH22      ARG  28  21.127  17.116  -2.159
   16    H    ARG  29           HN       ARG  29  18.975   7.708  -2.904
   17    HA   ARG  29           HA       ARG  29  19.681   5.852  -0.755
   18    HB2  ARG  29           HB2      ARG  29  17.059   6.607  -2.037
   19    HB3  ARG  29           HB1      ARG  29  17.206   5.243  -0.938
   20    HG2  ARG  29           HG2      ARG  29  16.428   7.051   0.351
   21    HG3  ARG  29           HG1      ARG  29  18.134   6.860   0.759
   22    HD2  ARG  29           HD2      ARG  29  17.558   9.211   0.472
   23    HD3  ARG  29           HD1      ARG  29  18.705   8.687  -0.758
   24    HE   ARG  29           HE       ARG  29  16.156   8.389  -1.824
   25   HH11  ARG  29          HH11      ARG  29  18.222  10.960  -0.700
   26   HH12  ARG  29          HH12      ARG  29  17.546  12.144  -1.767
   27   HH21  ARG  29          HH21      ARG  29  15.259   9.939  -3.232
   28   HH22  ARG  29          HH22      ARG  29  15.861  11.563  -3.210
   29    H    CYS  30           HN       CYS  30  19.133   3.574  -0.970
   30    HA   CYS  30           HA       CYS  30  19.887   2.578  -3.594
   31    HB2  CYS  30           HB2      CYS  30  19.469   1.117  -0.977
   32    HB3  CYS  30           HB1      CYS  30  20.100   0.398  -2.455
   33    HG   CYS  30           HG       CYS  30  22.125   2.735  -2.192
   34    H    LEU  31           HN       LEU  31  18.622   1.415  -4.941
   35    HA   LEU  31           HA       LEU  31  15.806   1.634  -4.702
   36    HB2  LEU  31           HB2      LEU  31  17.097   1.592  -6.844
   37    HB3  LEU  31           HB1      LEU  31  17.375  -0.120  -6.591
   38    HG   LEU  31           HG       LEU  31  14.864  -0.422  -6.598
   39   HD11  LEU  31          HD11      LEU  31  13.530   1.333  -7.636
   40   HD12  LEU  31          HD12      LEU  31  14.942   2.391  -7.682
   41   HD13  LEU  31          HD13      LEU  31  14.258   1.899  -6.132
   42   HD21  LEU  31          HD21      LEU  31  14.708  -0.328  -9.039
   43   HD22  LEU  31          HD22      LEU  31  16.249  -1.006  -8.513
   44   HD23  LEU  31          HD23      LEU  31  16.169   0.658  -9.094
   45    H    PHE  32           HN       PHE  32  18.034  -0.660  -3.528
   46    HA   PHE  32           HA       PHE  32  16.180  -2.877  -3.471
   47    HB2  PHE  32           HB2      PHE  32  18.888  -2.559  -2.158
   48    HB3  PHE  32           HB1      PHE  32  17.970  -4.057  -2.262
   49    HD1  PHE  32           HD1      PHE  32  17.557  -5.080  -4.504
   50    HD2  PHE  32           HD2      PHE  32  20.243  -1.829  -3.936
   51    HE1  PHE  32           HE1      PHE  32  18.613  -5.581  -6.668
   52    HE2  PHE  32           HE2      PHE  32  21.304  -2.324  -6.101
   53    HZ   PHE  32           HZ       PHE  32  20.493  -4.195  -7.470
   54    H    LEU  33           HN       LEU  33  17.070  -0.245  -1.436
   55    HA   LEU  33           HA       LEU  33  15.967  -1.444   0.965
   56    HB2  LEU  33           HB2      LEU  33  17.389   1.075   0.320
   57    HB3  LEU  33           HB1      LEU  33  16.408   1.011   1.772
   58    HG   LEU  33           HG       LEU  33  18.708   0.502   2.287
   59   HD11  LEU  33          HD11      LEU  33  16.984  -1.949   2.470
   60   HD12  LEU  33          HD12      LEU  33  16.986  -0.597   3.602
   61   HD13  LEU  33          HD13      LEU  33  18.417  -1.615   3.441
   62   HD21  LEU  33          HD21      LEU  33  18.440  -1.809   0.382
   63   HD22  LEU  33          HD22      LEU  33  19.833  -1.468   1.408
   64   HD23  LEU  33          HD23      LEU  33  19.402  -0.356   0.109
   65    H    SER  34           HN       SER  34  15.284   1.396  -1.066
   66    HA   SER  34           HA       SER  34  12.957   2.238   0.196
   67    HB2  SER  34           HB2      SER  34  13.646   2.419  -2.748
   68    HB3  SER  34           HB1      SER  34  12.409   3.370  -1.928
   69    HG   SER  34           HG       SER  34  14.833   4.090  -2.225
   70    H    LEU  35           HN       LEU  35  13.493  -0.441  -1.937
   71    HA   LEU  35           HA       LEU  35  10.815  -0.858  -2.759
   72    HB2  LEU  35           HB2      LEU  35  13.094  -1.881  -3.599
   73    HB3  LEU  35           HB1      LEU  35  12.744  -3.120  -2.412
   74    HG   LEU  35           HG       LEU  35  12.043  -3.745  -4.696
   75   HD11  LEU  35          HD11      LEU  35  10.903  -4.648  -2.687
   76   HD12  LEU  35          HD12      LEU  35   9.885  -4.603  -4.126
   77   HD13  LEU  35          HD13      LEU  35   9.682  -3.388  -2.865
   78   HD21  LEU  35          HD21      LEU  35  11.457  -1.516  -5.510
   79   HD22  LEU  35          HD22      LEU  35  10.072  -1.481  -4.419
   80   HD23  LEU  35          HD23      LEU  35  10.130  -2.656  -5.733
   81    H    PHE  36           HN       PHE  36  12.691  -1.865   0.038
   82    HA   PHE  36           HA       PHE  36  10.957  -3.800   1.074
   83    HB2  PHE  36           HB2      PHE  36  13.222  -3.462   1.939
   84    HB3  PHE  36           HB1      PHE  36  12.763  -1.880   2.562
   85    HD1  PHE  36           HD1      PHE  36  12.098  -5.507   2.900
   86    HD2  PHE  36           HD2      PHE  36  11.801  -1.653   4.679
   87    HE1  PHE  36           HE1      PHE  36  11.420  -6.546   5.026
   88    HE2  PHE  36           HE2      PHE  36  11.123  -2.683   6.808
   89    HZ   PHE  36           HZ       PHE  36  10.927  -5.134   6.981
   90    H    SER  37           HN       SER  37  10.825  -0.316   1.151
   91    HA   SER  37           HA       SER  37   8.698  -0.249   3.113
   92    HB2  SER  37           HB2      SER  37   9.874   1.957   1.405
   93    HB3  SER  37           HB1      SER  37   8.724   2.190   2.720
   94    HG   SER  37           HG       SER  37  10.920   0.722   3.438
   95    H    PHE  38           HN       PHE  38   8.992  -0.566  -0.273
   96    HA   PHE  38           HA       PHE  38   6.479   0.588  -0.997
   97    HB2  PHE  38           HB2      PHE  38   8.589   0.059  -2.471
   98    HB3  PHE  38           HB1      PHE  38   7.820  -1.514  -2.647
   99    HD1  PHE  38           HD1      PHE  38   7.621   2.036  -3.460
  100    HD2  PHE  38           HD2      PHE  38   5.741  -1.759  -3.864
  101    HE1  PHE  38           HE1      PHE  38   6.199   2.937  -5.254
  102    HE2  PHE  38           HE2      PHE  38   4.315  -0.866  -5.659
  103    HZ   PHE  38           HZ       PHE  38   4.544   1.484  -6.357
  104    H    LEU  39           HN       LEU  39   7.419  -2.356   0.438
  105    HA   LEU  39           HA       LEU  39   5.124  -3.853  -0.494
  106    HB2  LEU  39           HB2      LEU  39   7.333  -4.912   0.036
  107    HB3  LEU  39           HB1      LEU  39   7.046  -4.554   1.728
  108    HG   LEU  39           HG       LEU  39   5.003  -6.128   0.236
  109   HD11  LEU  39          HD11      LEU  39   7.563  -7.287   1.327
  110   HD12  LEU  39          HD12      LEU  39   7.128  -7.172  -0.378
  111   HD13  LEU  39          HD13      LEU  39   6.189  -8.201   0.704
  112   HD21  LEU  39          HD21      LEU  39   4.746  -7.200   2.431
  113   HD22  LEU  39          HD22      LEU  39   4.541  -5.451   2.523
  114   HD23  LEU  39          HD23      LEU  39   6.047  -6.192   3.065
  115    H    ILE  40           HN       ILE  40   6.174  -2.188   2.427
  116    HA   ILE  40           HA       ILE  40   3.999  -2.918   4.070
  117    HB   ILE  40           HB       ILE  40   5.645  -0.387   4.219
  118   HG12  ILE  40          HG12      ILE  40   6.108  -3.031   5.617
  119   HG13  ILE  40          HG11      ILE  40   6.997  -2.493   4.195
  120   HG21  ILE  40          HG21      ILE  40   3.626  -0.283   5.563
  121   HG22  ILE  40          HG22      ILE  40   5.044  -0.429   6.602
  122   HG23  ILE  40          HG23      ILE  40   4.019  -1.833   6.308
  123   HD11  ILE  40          HD11      ILE  40   8.261  -2.122   6.239
  124   HD12  ILE  40          HD12      ILE  40   6.960  -1.112   6.869
  125   HD13  ILE  40          HD13      ILE  40   7.867  -0.597   5.448
  126    H    VAL  41           HN       VAL  41   4.493  -0.338   1.738
  127    HA   VAL  41           HA       VAL  41   2.141   1.122   2.414
  128    HB   VAL  41           HB       VAL  41   4.158   2.034   1.168
  129   HG11  VAL  41          HG11      VAL  41   4.371   0.272  -0.476
  130   HG12  VAL  41          HG12      VAL  41   4.127   1.829  -1.265
  131   HG13  VAL  41          HG13      VAL  41   2.795   0.681  -1.147
  132   HG21  VAL  41          HG21      VAL  41   1.400   2.512   0.040
  133   HG22  VAL  41          HG22      VAL  41   2.789   3.575  -0.185
  134   HG23  VAL  41          HG23      VAL  41   2.124   3.324   1.429
  135    H    LEU  42           HN       LEU  42   2.821  -1.633   0.444
  136    HA   LEU  42           HA       LEU  42   0.516  -1.509  -1.215
  137    HB2  LEU  42           HB2      LEU  42   2.503  -3.633  -0.507
  138    HB3  LEU  42           HB1      LEU  42   1.032  -4.075  -1.367
  139    HG   LEU  42           HG       LEU  42   3.019  -2.020  -2.346
  140   HD11  LEU  42          HD11      LEU  42   2.665  -4.908  -3.138
  141   HD12  LEU  42          HD12      LEU  42   4.057  -4.209  -2.307
  142   HD13  LEU  42          HD13      LEU  42   3.692  -3.738  -3.967
  143   HD21  LEU  42          HD21      LEU  42   1.810  -2.295  -4.474
  144   HD22  LEU  42          HD22      LEU  42   0.781  -1.655  -3.193
  145   HD23  LEU  42          HD23      LEU  42   0.654  -3.350  -3.662
  146    H    LEU  43           HN       LEU  43   1.271  -3.496   1.651
  147    HA   LEU  43           HA       LEU  43  -1.175  -4.767   1.912
  148    HB2  LEU  43           HB2      LEU  43   0.943  -3.978   3.872
  149    HB3  LEU  43           HB1      LEU  43  -0.559  -4.666   4.458
  150    HG   LEU  43           HG       LEU  43   1.179  -6.368   4.261
  151   HD11  LEU  43          HD11      LEU  43  -0.059  -7.999   2.945
  152   HD12  LEU  43          HD12      LEU  43  -0.994  -6.704   2.201
  153   HD13  LEU  43          HD13      LEU  43  -1.148  -7.022   3.929
  154   HD21  LEU  43          HD21      LEU  43   2.494  -5.383   2.472
  155   HD22  LEU  43          HD22      LEU  43   1.183  -5.668   1.328
  156   HD23  LEU  43          HD23      LEU  43   2.028  -7.033   2.060
  157    H    LEU  44           HN       LEU  44  -0.243  -1.523   2.843
  158    HA   LEU  44           HA       LEU  44  -2.595  -1.003   4.393
  159    HB2  LEU  44           HB2      LEU  44  -0.486   0.799   3.217
  160    HB3  LEU  44           HB1      LEU  44  -1.840   1.403   4.152
  161    HG   LEU  44           HG       LEU  44   0.300  -0.476   5.163
  162   HD11  LEU  44          HD11      LEU  44   0.951   1.443   6.556
  163   HD12  LEU  44          HD12      LEU  44  -0.239   2.438   5.715
  164   HD13  LEU  44          HD13      LEU  44   1.136   1.773   4.833
  165   HD21  LEU  44          HD21      LEU  44  -1.841  -0.916   6.231
  166   HD22  LEU  44          HD22      LEU  44  -2.034   0.800   6.587
  167   HD23  LEU  44          HD23      LEU  44  -0.742  -0.120   7.357
  168    H    THR  45           HN       THR  45  -1.488   0.095   1.191
  169    HA   THR  45           HA       THR  45  -3.762   1.531   0.480
  170    HB   THR  45           HB       THR  45  -3.057   1.089  -1.900
  171    HG1  THR  45           HG1      THR  45  -1.123  -0.487  -0.536
  172   HG21  THR  45          HG21      THR  45  -0.918   2.321  -1.687
  173   HG22  THR  45          HG22      THR  45  -0.964   2.044   0.055
  174   HG23  THR  45          HG23      THR  45  -2.212   3.022  -0.717
  175    H    THR  46           HN       THR  46  -3.274  -1.888   0.625
  176    HA   THR  46           HA       THR  46  -5.185  -2.745  -1.240
  177    HB   THR  46           HB       THR  46  -4.376  -4.109   1.336
  178    HG1  THR  46           HG1      THR  46  -3.369  -5.061  -1.032
  179   HG21  THR  46          HG21      THR  46  -5.123  -6.164   0.232
  180   HG22  THR  46          HG22      THR  46  -5.653  -5.227  -1.164
  181   HG23  THR  46          HG23      THR  46  -6.453  -5.015   0.394
  182    H    LEU  47           HN       LEU  47  -5.543  -2.501   2.306
  183    HA   LEU  47           HA       LEU  47  -8.408  -2.757   2.099
  184    HB2  LEU  47           HB2      LEU  47  -6.574  -2.270   4.443
  185    HB3  LEU  47           HB1      LEU  47  -8.315  -2.400   4.592
  186    HG   LEU  47           HG       LEU  47  -7.337  -4.499   5.214
  187   HD11  LEU  47          HD11      LEU  47  -8.433  -6.016   3.676
  188   HD12  LEU  47          HD12      LEU  47  -8.518  -4.748   2.453
  189   HD13  LEU  47          HD13      LEU  47  -9.434  -4.590   3.951
  190   HD21  LEU  47          HD21      LEU  47  -5.935  -5.805   3.722
  191   HD22  LEU  47          HD22      LEU  47  -5.197  -4.237   4.048
  192   HD23  LEU  47          HD23      LEU  47  -6.006  -4.528   2.509
  193    H    PHE  48           HN       PHE  48  -6.107  -0.173   2.368
  194    HA   PHE  48           HA       PHE  48  -7.906   1.803   3.346
  195    HB2  PHE  48           HB2      PHE  48  -5.474   2.035   3.573
  196    HB3  PHE  48           HB1      PHE  48  -5.310   2.139   1.824
  197    HD1  PHE  48           HD1      PHE  48  -5.312   4.212   0.801
  198    HD2  PHE  48           HD2      PHE  48  -6.992   3.814   4.691
  199    HE1  PHE  48           HE1      PHE  48  -5.602   6.653   0.920
  200    HE2  PHE  48           HE2      PHE  48  -7.286   6.254   4.818
  201    HZ   PHE  48           HZ       PHE  48  -6.577   7.679   2.934
  202    H    CYS  49           HN       CYS  49  -7.135   0.577   0.169
  203    HA   CYS  49           HA       CYS  49  -8.440   2.746  -1.219
  204    HB2  CYS  49           HB2      CYS  49  -7.244   0.127  -2.097
  205    HB3  CYS  49           HB1      CYS  49  -8.165   1.132  -3.210
  206    HG   CYS  49           HG       CYS  49  -5.903   2.133  -3.984
  207    H    LEU  50           HN       LEU  50  -9.155  -0.667  -0.552
  208    HA   LEU  50           HA       LEU  50 -11.585  -0.852  -1.893
  209    HB2  LEU  50           HB2      LEU  50 -10.766  -2.224   0.674
  210    HB3  LEU  50           HB1      LEU  50 -12.091  -2.722  -0.374
  211    HG   LEU  50           HG       LEU  50  -9.237  -2.607  -1.333
  212   HD11  LEU  50          HD11      LEU  50  -9.055  -4.969  -0.889
  213   HD12  LEU  50          HD12      LEU  50 -10.689  -5.004  -0.224
  214   HD13  LEU  50          HD13      LEU  50  -9.415  -4.116   0.613
  215   HD21  LEU  50          HD21      LEU  50 -10.060  -4.135  -3.045
  216   HD22  LEU  50          HD22      LEU  50 -10.975  -2.627  -3.052
  217   HD23  LEU  50          HD23      LEU  50 -11.671  -4.079  -2.331
  218    H    LEU  51           HN       LEU  51 -10.828   0.471   1.268
  219    HA   LEU  51           HA       LEU  51 -13.591   0.795   2.020
  220    HB2  LEU  51           HB2      LEU  51 -11.032   1.835   3.234
  221    HB3  LEU  51           HB1      LEU  51 -12.621   2.108   3.922
  222    HG   LEU  51           HG       LEU  51 -11.368  -0.609   3.514
  223   HD11  LEU  51          HD11      LEU  51 -11.676   1.057   6.007
  224   HD12  LEU  51          HD12      LEU  51 -10.163   0.640   5.204
  225   HD13  LEU  51          HD13      LEU  51 -11.135  -0.621   5.960
  226   HD21  LEU  51          HD21      LEU  51 -13.882   0.234   4.952
  227   HD22  LEU  51          HD22      LEU  51 -13.212  -1.397   4.917
  228   HD23  LEU  51          HD23      LEU  51 -13.803  -0.656   3.431
  229    H    HIS  52           HN       HIS  52 -11.185   2.642   0.356
  230    HA   HIS  52           HA       HIS  52 -12.426   5.197   0.722
  231    HB2  HIS  52           HB2      HIS  52 -10.042   5.048   0.252
  232    HB3  HIS  52           HB1      HIS  52 -10.368   4.259  -1.287
  233    HD1  HIS  52           HD1      HIS  52 -10.453   5.762  -3.253
  234    HD2  HIS  52           HD2      HIS  52 -11.139   7.810   0.298
  235    HE1  HIS  52           HE1      HIS  52 -10.609   8.188  -3.894
  236    HE2  HIS  52           HE2      HIS  52 -11.001   9.411  -1.727
  237    H    PHE  53           HN       PHE  53 -12.069   3.125  -2.166
  238    HA   PHE  53           HA       PHE  53 -13.941   4.578  -3.706
  239    HB2  PHE  53           HB2      PHE  53 -12.866   1.770  -4.009
  240    HB3  PHE  53           HB1      PHE  53 -13.898   2.556  -5.200
  241    HD1  PHE  53           HD1      PHE  53 -10.565   2.391  -3.750
  242    HD2  PHE  53           HD2      PHE  53 -13.071   4.431  -6.519
  243    HE1  PHE  53           HE1      PHE  53  -8.580   3.408  -4.791
  244    HE2  PHE  53           HE2      PHE  53 -11.092   5.452  -7.565
  245    HZ   PHE  53           HZ       PHE  53  -8.844   4.941  -6.701
  246    H    GLY  54           HN       GLY  54 -14.257   2.078  -1.346
  247    HA2  GLY  54           HA2      GLY  54 -16.144   1.268  -0.303
  248    HA3  GLY  54           HA1      GLY  54 -17.099   2.379  -1.272
  249    H    VAL  55           HN       VAL  55 -14.947   0.146  -2.836
  250    HA   VAL  55           HA       VAL  55 -16.901  -0.933  -4.495
  251    HB   VAL  55           HB       VAL  55 -14.597  -1.097  -5.131
  252   HG11  VAL  55          HG11      VAL  55 -14.228  -2.858  -2.718
  253   HG12  VAL  55          HG12      VAL  55 -13.564  -1.243  -2.956
  254   HG13  VAL  55          HG13      VAL  55 -13.016  -2.581  -3.966
  255   HG21  VAL  55          HG21      VAL  55 -14.430  -3.471  -5.744
  256   HG22  VAL  55          HG22      VAL  55 -16.048  -2.826  -6.022
  257   HG23  VAL  55          HG23      VAL  55 -15.733  -3.842  -4.617
  258    H    ILE  56           HN       ILE  56 -15.567  -2.188  -1.478
  259    HA   ILE  56           HA       ILE  56 -17.985  -3.594  -0.883
  260    HB   ILE  56           HB       ILE  56 -16.421  -5.757  -0.495
  261   HG12  ILE  56          HG12      ILE  56 -15.282  -6.131  -2.755
  262   HG13  ILE  56          HG11      ILE  56 -15.398  -4.391  -2.983
  263   HG21  ILE  56          HG21      ILE  56 -17.957  -5.156  -3.015
  264   HG22  ILE  56          HG22      ILE  56 -18.652  -5.704  -1.490
  265   HG23  ILE  56          HG23      ILE  56 -17.561  -6.758  -2.391
  266   HD11  ILE  56          HD11      ILE  56 -13.954  -5.770  -0.735
  267   HD12  ILE  56          HD12      ILE  56 -14.044  -4.030  -1.002
  268   HD13  ILE  56          HD13      ILE  56 -13.209  -5.057  -2.166
  269    H    GLY  57           HN       GLY  57 -17.947  -2.358   0.977
  270    HA2  GLY  57           HA2      GLY  57 -16.089  -3.327   3.025
  271    HA3  GLY  57           HA1      GLY  57 -16.181  -1.595   2.749
  272    HA   PRO  58           HA       PRO  58 -19.548  -1.168   5.551
  273    HB2  PRO  58           HB2      PRO  58 -21.127   0.286   3.515
  274    HB3  PRO  58           HB1      PRO  58 -20.556   0.830   5.095
  275    HG2  PRO  58           HG2      PRO  58 -19.446   1.732   2.836
  276    HG3  PRO  58           HG1      PRO  58 -18.472   1.425   4.284
  277    HD2  PRO  58           HD2      PRO  58 -18.772  -0.239   1.814
  278    HD3  PRO  58           HD1      PRO  58 -17.317   0.103   2.774
  279    H    GLN  59           HN       GLN  59 -22.115  -1.222   5.552
  280    HA   GLN  59           HA       GLN  59 -22.968  -3.494   3.882
  281    HB2  GLN  59           HB2      GLN  59 -22.491  -4.028   6.333
  282    HB3  GLN  59           HB1      GLN  59 -23.889  -3.034   6.719
  283    HG2  GLN  59           HG2      GLN  59 -25.313  -4.511   5.400
  284    HG3  GLN  59           HG1      GLN  59 -23.913  -5.500   4.991
  285   HE21  GLN  59          HE21      GLN  59 -24.795  -7.335   5.926
  286   HE22  GLN  59          HE22      GLN  59 -24.920  -7.531   7.638
  287    H    ARG  60           HN       ARG  60 -23.310  -0.632   3.463
  288    HA   ARG  60           HA       ARG  60 -26.223  -0.619   3.235
  289    HB2  ARG  60           HB2      ARG  60 -25.651   0.630   5.301
  290    HB3  ARG  60           HB1      ARG  60 -24.658   1.719   4.343
  291    HG2  ARG  60           HG2      ARG  60 -26.793   2.735   4.819
  292    HG3  ARG  60           HG1      ARG  60 -26.651   2.412   3.090
  293    HD2  ARG  60           HD2      ARG  60 -28.874   1.831   3.998
  294    HD3  ARG  60           HD1      ARG  60 -28.033   0.447   3.301
  295    HE   ARG  60           HE       ARG  60 -27.479   0.547   6.047
  296   HH11  ARG  60          HH11      ARG  60 -30.142  -0.066   3.883
  297   HH12  ARG  60          HH12      ARG  60 -30.952  -1.138   4.976
  298   HH21  ARG  60          HH21      ARG  60 -28.535  -0.862   7.492
  299   HH22  ARG  60          HH22      ARG  60 -30.039  -1.587   7.032
  Start of MODEL   12
    1    H1   ARG  28           HT1      ARG  28  24.062   5.390  -3.383
    2    H2   ARG  28           HT2      ARG  28  24.377   6.765  -4.317
    3    H3   ARG  28           HT3      ARG  28  23.000   5.833  -4.623
    4    HA   ARG  28           HA       ARG  28  23.524   7.356  -2.140
    5    HB2  ARG  28           HB2      ARG  28  23.083   8.855  -4.002
    6    HB3  ARG  28           HB1      ARG  28  21.670   7.915  -4.463
    7    HG2  ARG  28           HG2      ARG  28  20.647   8.499  -2.272
    8    HG3  ARG  28           HG1      ARG  28  22.021   9.564  -1.970
    9    HD2  ARG  28           HD2      ARG  28  21.468  10.898  -3.900
   10    HD3  ARG  28           HD1      ARG  28  20.182   9.778  -4.349
   11    HE   ARG  28           HE       ARG  28  19.841  10.878  -1.726
   12   HH11  ARG  28          HH11      ARG  28  19.335  11.446  -5.127
   13   HH12  ARG  28          HH12      ARG  28  18.008  12.530  -4.879
   14   HH21  ARG  28          HH21      ARG  28  18.094  12.300  -1.391
   15   HH22  ARG  28          HH22      ARG  28  17.304  13.017  -2.754
   16    H    ARG  29           HN       ARG  29  20.714   6.208  -4.006
   17    HA   ARG  29           HA       ARG  29  19.434   5.366  -1.535
   18    HB2  ARG  29           HB2      ARG  29  18.398   5.311  -4.375
   19    HB3  ARG  29           HB1      ARG  29  17.449   5.012  -2.925
   20    HG2  ARG  29           HG2      ARG  29  17.880   7.311  -2.184
   21    HG3  ARG  29           HG1      ARG  29  18.787   7.604  -3.670
   22    HD2  ARG  29           HD2      ARG  29  16.774   7.111  -4.983
   23    HD3  ARG  29           HD1      ARG  29  15.874   6.840  -3.491
   24    HE   ARG  29           HE       ARG  29  17.055   9.407  -3.463
   25   HH11  ARG  29          HH11      ARG  29  14.460   7.611  -4.945
   26   HH12  ARG  29          HH12      ARG  29  13.468   9.007  -5.198
   27   HH21  ARG  29          HH21      ARG  29  15.751  11.247  -3.790
   28   HH22  ARG  29          HH22      ARG  29  14.201  11.072  -4.544
   29    H    CYS  30           HN       CYS  30  18.827   3.283  -1.035
   30    HA   CYS  30           HA       CYS  30  20.306   1.193  -2.445
   31    HB2  CYS  30           HB2      CYS  30  20.558   1.362   0.006
   32    HB3  CYS  30           HB1      CYS  30  18.830   1.087   0.196
   33    HG   CYS  30           HG       CYS  30  20.154  -1.254   0.908
   34    H    LEU  31           HN       LEU  31  19.299   0.059  -3.956
   35    HA   LEU  31           HA       LEU  31  16.498   0.143  -4.349
   36    HB2  LEU  31           HB2      LEU  31  16.834  -1.294  -6.208
   37    HB3  LEU  31           HB1      LEU  31  18.178  -0.178  -6.158
   38    HG   LEU  31           HG       LEU  31  19.173  -2.189  -6.737
   39   HD11  LEU  31          HD11      LEU  31  19.403  -2.148  -3.737
   40   HD12  LEU  31          HD12      LEU  31  20.349  -1.171  -4.858
   41   HD13  LEU  31          HD13      LEU  31  20.516  -2.927  -4.862
   42   HD21  LEU  31          HD21      LEU  31  17.615  -3.655  -4.621
   43   HD22  LEU  31          HD22      LEU  31  18.654  -4.348  -5.865
   44   HD23  LEU  31          HD23      LEU  31  17.143  -3.558  -6.317
   45    H    PHE  32           HN       PHE  32  18.439  -1.750  -2.313
   46    HA   PHE  32           HA       PHE  32  16.603  -3.994  -2.208
   47    HB2  PHE  32           HB2      PHE  32  19.021  -4.385  -1.976
   48    HB3  PHE  32           HB1      PHE  32  19.048  -3.379  -0.533
   49    HD1  PHE  32           HD1      PHE  32  17.470  -6.448  -1.919
   50    HD2  PHE  32           HD2      PHE  32  18.750  -4.340   1.550
   51    HE1  PHE  32           HE1      PHE  32  16.970  -8.424  -0.540
   52    HE2  PHE  32           HE2      PHE  32  18.252  -6.312   2.935
   53    HZ   PHE  32           HZ       PHE  32  17.358  -8.355   1.891
   54    H    LEU  33           HN       LEU  33  17.368  -1.118  -0.359
   55    HA   LEU  33           HA       LEU  33  15.671  -1.900   1.857
   56    HB2  LEU  33           HB2      LEU  33  17.198   0.629   1.285
   57    HB3  LEU  33           HB1      LEU  33  16.239   0.370   2.730
   58    HG   LEU  33           HG       LEU  33  18.708  -1.161   1.910
   59   HD11  LEU  33          HD11      LEU  33  19.165   1.044   2.806
   60   HD12  LEU  33          HD12      LEU  33  19.638  -0.202   3.961
   61   HD13  LEU  33          HD13      LEU  33  18.145   0.704   4.203
   62   HD21  LEU  33          HD21      LEU  33  18.462  -2.320   4.071
   63   HD22  LEU  33          HD22      LEU  33  17.145  -2.686   2.957
   64   HD23  LEU  33          HD23      LEU  33  16.888  -1.552   4.283
   65    H    SER  34           HN       SER  34  15.472   0.045  -1.018
   66    HA   SER  34           HA       SER  34  13.204   1.582  -0.270
   67    HB2  SER  34           HB2      SER  34  14.255   0.858  -3.014
   68    HB3  SER  34           HB1      SER  34  13.025   2.079  -2.692
   69    HG   SER  34           HG       SER  34  14.512   3.395  -1.907
   70    H    LEU  35           HN       LEU  35  13.644  -1.595  -1.625
   71    HA   LEU  35           HA       LEU  35  10.961  -1.948  -2.526
   72    HB2  LEU  35           HB2      LEU  35  12.820  -3.246  -3.439
   73    HB3  LEU  35           HB1      LEU  35  13.101  -3.973  -1.868
   74    HG   LEU  35           HG       LEU  35  10.383  -4.337  -2.970
   75   HD11  LEU  35          HD11      LEU  35  12.774  -5.730  -4.169
   76   HD12  LEU  35          HD12      LEU  35  11.718  -4.582  -4.993
   77   HD13  LEU  35          HD13      LEU  35  11.084  -6.140  -4.462
   78   HD21  LEU  35          HD21      LEU  35  11.075  -5.348  -0.863
   79   HD22  LEU  35          HD22      LEU  35  12.396  -6.179  -1.683
   80   HD23  LEU  35          HD23      LEU  35  10.724  -6.589  -2.067
   81    H    PHE  36           HN       PHE  36  12.543  -2.204   0.528
   82    HA   PHE  36           HA       PHE  36  10.603  -3.938   1.745
   83    HB2  PHE  36           HB2      PHE  36  12.963  -3.760   2.532
   84    HB3  PHE  36           HB1      PHE  36  12.623  -2.121   3.077
   85    HD1  PHE  36           HD1      PHE  36  11.947  -5.683   3.661
   86    HD2  PHE  36           HD2      PHE  36  11.394  -1.711   5.083
   87    HE1  PHE  36           HE1      PHE  36  11.170  -6.569   5.821
   88    HE2  PHE  36           HE2      PHE  36  10.617  -2.590   7.247
   89    HZ   PHE  36           HZ       PHE  36  10.510  -5.021   7.619
   90    H    SER  37           HN       SER  37  10.992  -0.512   1.296
   91    HA   SER  37           HA       SER  37   8.999   0.204   3.258
   92    HB2  SER  37           HB2      SER  37  10.357   1.870   1.125
   93    HB3  SER  37           HB1      SER  37   9.325   2.502   2.407
   94    HG   SER  37           HG       SER  37  11.780   2.393   2.658
   95    H    PHE  38           HN       PHE  38   9.095  -0.568  -0.112
   96    HA   PHE  38           HA       PHE  38   6.610   0.684  -0.801
   97    HB2  PHE  38           HB2      PHE  38   8.507   0.086  -2.400
   98    HB3  PHE  38           HB1      PHE  38   7.936  -1.576  -2.285
   99    HD1  PHE  38           HD1      PHE  38   6.815   1.854  -3.155
  100    HD2  PHE  38           HD2      PHE  38   6.239  -2.330  -3.675
  101    HE1  PHE  38           HE1      PHE  38   5.161   2.306  -4.919
  102    HE2  PHE  38           HE2      PHE  38   4.584  -1.886  -5.441
  103    HZ   PHE  38           HZ       PHE  38   4.042   0.435  -6.064
  104    H    LEU  39           HN       LEU  39   7.560  -2.324   0.596
  105    HA   LEU  39           HA       LEU  39   5.245  -3.826  -0.079
  106    HB2  LEU  39           HB2      LEU  39   7.453  -4.758   0.671
  107    HB3  LEU  39           HB1      LEU  39   7.072  -4.214   2.293
  108    HG   LEU  39           HG       LEU  39   5.131  -5.999   0.914
  109   HD11  LEU  39          HD11      LEU  39   7.271  -7.059   0.456
  110   HD12  LEU  39          HD12      LEU  39   6.363  -7.977   1.659
  111   HD13  LEU  39          HD13      LEU  39   7.704  -6.948   2.162
  112   HD21  LEU  39          HD21      LEU  39   4.634  -5.065   3.128
  113   HD22  LEU  39          HD22      LEU  39   6.105  -5.800   3.763
  114   HD23  LEU  39          HD23      LEU  39   4.789  -6.820   3.183
  115    H    ILE  40           HN       ILE  40   6.013  -1.509   2.380
  116    HA   ILE  40           HA       ILE  40   3.759  -2.161   4.061
  117    HB   ILE  40           HB       ILE  40   5.498   0.307   4.142
  118   HG12  ILE  40          HG12      ILE  40   5.816  -2.254   5.724
  119   HG13  ILE  40          HG11      ILE  40   6.790  -1.834   4.317
  120   HG21  ILE  40          HG21      ILE  40   3.387   0.503   5.358
  121   HG22  ILE  40          HG22      ILE  40   4.762   0.464   6.462
  122   HG23  ILE  40          HG23      ILE  40   3.761  -0.972   6.250
  123   HD11  ILE  40          HD11      ILE  40   7.982  -1.349   6.363
  124   HD12  ILE  40          HD12      ILE  40   6.665  -0.312   6.910
  125   HD13  ILE  40          HD13      ILE  40   7.618   0.144   5.498
  126    H    VAL  41           HN       VAL  41   4.539   0.188   1.564
  127    HA   VAL  41           HA       VAL  41   2.201   1.786   1.996
  128    HB   VAL  41           HB       VAL  41   4.371   2.591   0.958
  129   HG11  VAL  41          HG11      VAL  41   3.208   1.238  -1.464
  130   HG12  VAL  41          HG12      VAL  41   4.690   0.788  -0.625
  131   HG13  VAL  41          HG13      VAL  41   4.587   2.336  -1.463
  132   HG21  VAL  41          HG21      VAL  41   1.790   3.149  -0.503
  133   HG22  VAL  41          HG22      VAL  41   3.228   4.171  -0.525
  134   HG23  VAL  41          HG23      VAL  41   2.335   3.936   0.978
  135    H    LEU  42           HN       LEU  42   2.905  -1.082   0.227
  136    HA   LEU  42           HA       LEU  42   0.683  -0.810  -1.599
  137    HB2  LEU  42           HB2      LEU  42   2.770  -1.996  -2.217
  138    HB3  LEU  42           HB1      LEU  42   2.410  -3.214  -0.999
  139    HG   LEU  42           HG       LEU  42   0.348  -2.721  -3.086
  140   HD11  LEU  42          HD11      LEU  42   1.479  -4.244  -4.638
  141   HD12  LEU  42          HD12      LEU  42   2.905  -4.233  -3.600
  142   HD13  LEU  42          HD13      LEU  42   2.388  -2.751  -4.403
  143   HD21  LEU  42          HD21      LEU  42   0.074  -5.148  -2.859
  144   HD22  LEU  42          HD22      LEU  42  -0.056  -4.327  -1.305
  145   HD23  LEU  42          HD23      LEU  42   1.424  -5.189  -1.724
  146    H    LEU  43           HN       LEU  43   1.480  -2.995   1.102
  147    HA   LEU  43           HA       LEU  43  -0.962  -4.352   1.180
  148    HB2  LEU  43           HB2      LEU  43   1.024  -5.142   2.345
  149    HB3  LEU  43           HB1      LEU  43   0.975  -3.755   3.416
  150    HG   LEU  43           HG       LEU  43  -1.224  -4.578   4.281
  151   HD11  LEU  43          HD11      LEU  43  -0.534  -7.027   2.667
  152   HD12  LEU  43          HD12      LEU  43  -1.886  -5.933   2.373
  153   HD13  LEU  43          HD13      LEU  43  -1.840  -6.903   3.845
  154   HD21  LEU  43          HD21      LEU  43   1.112  -6.465   4.548
  155   HD22  LEU  43          HD22      LEU  43  -0.258  -6.354   5.653
  156   HD23  LEU  43          HD23      LEU  43   0.853  -4.995   5.486
  157    H    LEU  44           HN       LEU  44  -0.117  -1.182   2.276
  158    HA   LEU  44           HA       LEU  44  -2.357  -0.931   4.068
  159    HB2  LEU  44           HB2      LEU  44  -0.636   0.379   4.809
  160    HB3  LEU  44           HB1      LEU  44  -0.086   0.766   3.191
  161    HG   LEU  44           HG       LEU  44  -2.044   2.291   2.958
  162   HD11  LEU  44          HD11      LEU  44  -3.500   1.295   4.634
  163   HD12  LEU  44          HD12      LEU  44  -3.210   2.996   4.996
  164   HD13  LEU  44          HD13      LEU  44  -2.365   1.744   5.907
  165   HD21  LEU  44          HD21      LEU  44  -0.142   2.856   5.228
  166   HD22  LEU  44          HD22      LEU  44  -1.088   4.063   4.358
  167   HD23  LEU  44          HD23      LEU  44   0.160   3.146   3.515
  168    H    THR  45           HN       THR  45  -1.456   0.324   0.866
  169    HA   THR  45           HA       THR  45  -3.808   1.847   0.482
  170    HB   THR  45           HB       THR  45  -3.183   1.626  -1.998
  171    HG1  THR  45           HG1      THR  45  -0.717   1.001  -1.858
  172   HG21  THR  45          HG21      THR  45  -1.281   3.166  -1.741
  173   HG22  THR  45          HG22      THR  45  -1.186   2.747  -0.030
  174   HG23  THR  45          HG23      THR  45  -2.611   3.574  -0.658
  175    H    THR  46           HN       THR  46  -3.152  -1.528   0.179
  176    HA   THR  46           HA       THR  46  -5.088  -2.270  -1.701
  177    HB   THR  46           HB       THR  46  -4.172  -3.873   0.696
  178    HG1  THR  46           HG1      THR  46  -2.433  -4.356  -0.457
  179   HG21  THR  46          HG21      THR  46  -5.380  -4.751  -1.932
  180   HG22  THR  46          HG22      THR  46  -6.189  -4.777  -0.365
  181   HG23  THR  46          HG23      THR  46  -4.797  -5.820  -0.654
  182    H    LEU  47           HN       LEU  47  -5.340  -2.362   1.864
  183    HA   LEU  47           HA       LEU  47  -8.183  -2.786   1.739
  184    HB2  LEU  47           HB2      LEU  47  -6.348  -2.223   4.068
  185    HB3  LEU  47           HB1      LEU  47  -8.058  -2.571   4.224
  186    HG   LEU  47           HG       LEU  47  -6.892  -4.570   4.739
  187   HD11  LEU  47          HD11      LEU  47  -8.886  -4.878   3.373
  188   HD12  LEU  47          HD12      LEU  47  -7.682  -6.124   3.041
  189   HD13  LEU  47          HD13      LEU  47  -7.905  -4.791   1.910
  190   HD21  LEU  47          HD21      LEU  47  -5.242  -5.597   3.306
  191   HD22  LEU  47          HD22      LEU  47  -4.748  -3.950   3.697
  192   HD23  LEU  47          HD23      LEU  47  -5.434  -4.312   2.114
  193    H    PHE  48           HN       PHE  48  -6.070  -0.061   1.973
  194    HA   PHE  48           HA       PHE  48  -7.909   1.758   3.151
  195    HB2  PHE  48           HB2      PHE  48  -5.429   2.077   3.087
  196    HB3  PHE  48           HB1      PHE  48  -5.559   2.402   1.361
  197    HD1  PHE  48           HD1      PHE  48  -6.282   4.511   0.556
  198    HD2  PHE  48           HD2      PHE  48  -6.446   3.633   4.717
  199    HE1  PHE  48           HE1      PHE  48  -6.706   6.886   1.038
  200    HE2  PHE  48           HE2      PHE  48  -6.872   6.005   5.205
  201    HZ   PHE  48           HZ       PHE  48  -7.002   7.636   3.365
  202    H    CYS  49           HN       CYS  49  -7.258   0.740  -0.138
  203    HA   CYS  49           HA       CYS  49  -8.877   2.818  -1.310
  204    HB2  CYS  49           HB2      CYS  49  -7.558   0.359  -2.462
  205    HB3  CYS  49           HB1      CYS  49  -8.523   1.473  -3.423
  206    HG   CYS  49           HG       CYS  49  -6.499   3.440  -1.977
  207    H    LEU  50           HN       LEU  50  -9.208  -0.650  -0.670
  208    HA   LEU  50           HA       LEU  50 -11.692  -1.020  -1.924
  209    HB2  LEU  50           HB2      LEU  50 -10.533  -2.461   0.467
  210    HB3  LEU  50           HB1      LEU  50 -11.896  -3.022  -0.496
  211    HG   LEU  50           HG       LEU  50  -9.122  -2.600  -1.611
  212   HD11  LEU  50          HD11      LEU  50 -10.433  -5.141  -0.658
  213   HD12  LEU  50          HD12      LEU  50  -9.051  -4.335   0.085
  214   HD13  LEU  50          HD13      LEU  50  -8.901  -5.038  -1.526
  215   HD21  LEU  50          HD21      LEU  50  -9.933  -3.904  -3.483
  216   HD22  LEU  50          HD22      LEU  50 -10.968  -2.498  -3.235
  217   HD23  LEU  50          HD23      LEU  50 -11.504  -4.092  -2.703
  218    H    LEU  51           HN       LEU  51 -10.829   0.206   1.239
  219    HA   LEU  51           HA       LEU  51 -13.532   0.168   2.234
  220    HB2  LEU  51           HB2      LEU  51 -10.977   1.377   3.274
  221    HB3  LEU  51           HB1      LEU  51 -12.515   1.541   4.102
  222    HG   LEU  51           HG       LEU  51 -11.174  -1.097   3.501
  223   HD11  LEU  51          HD11      LEU  51 -11.297   0.490   6.062
  224   HD12  LEU  51          HD12      LEU  51  -9.858   0.175   5.092
  225   HD13  LEU  51          HD13      LEU  51 -10.682  -1.155   5.906
  226   HD21  LEU  51          HD21      LEU  51 -12.822  -2.003   5.066
  227   HD22  LEU  51          HD22      LEU  51 -13.600  -1.254   3.672
  228   HD23  LEU  51          HD23      LEU  51 -13.557  -0.407   5.219
  229    H    HIS  52           HN       HIS  52 -11.317   2.558   0.886
  230    HA   HIS  52           HA       HIS  52 -12.867   4.847   1.385
  231    HB2  HIS  52           HB2      HIS  52 -10.503   4.952   0.726
  232    HB3  HIS  52           HB1      HIS  52 -10.916   4.337  -0.870
  233    HD1  HIS  52           HD1      HIS  52 -12.229   5.964  -2.455
  234    HD2  HIS  52           HD2      HIS  52 -10.918   7.665   1.103
  235    HE1  HIS  52           HE1      HIS  52 -12.441   8.449  -2.780
  236    HE2  HIS  52           HE2      HIS  52 -11.630   9.459  -0.619
  237    H    PHE  53           HN       PHE  53 -12.538   3.005  -1.657
  238    HA   PHE  53           HA       PHE  53 -14.715   4.370  -2.900
  239    HB2  PHE  53           HB2      PHE  53 -12.760   3.300  -4.095
  240    HB3  PHE  53           HB1      PHE  53 -13.500   1.740  -3.755
  241    HD1  PHE  53           HD1      PHE  53 -15.470   1.016  -4.937
  242    HD2  PHE  53           HD2      PHE  53 -13.770   4.848  -5.669
  243    HE1  PHE  53           HE1      PHE  53 -16.828   1.225  -6.977
  244    HE2  PHE  53           HE2      PHE  53 -15.129   5.065  -7.710
  245    HZ   PHE  53           HZ       PHE  53 -16.659   3.252  -8.366
  246    H    GLY  54           HN       GLY  54 -14.405   1.555  -0.917
  247    HA2  GLY  54           HA2      GLY  54 -15.990   0.201   0.046
  248    HA3  GLY  54           HA1      GLY  54 -17.197   1.354  -0.498
  249    H    VAL  55           HN       VAL  55 -15.056  -0.210  -2.765
  250    HA   VAL  55           HA       VAL  55 -17.085  -1.099  -4.434
  251    HB   VAL  55           HB       VAL  55 -14.852  -0.897  -5.282
  252   HG11  VAL  55          HG11      VAL  55 -13.057  -2.448  -4.640
  253   HG12  VAL  55          HG12      VAL  55 -14.109  -3.123  -3.399
  254   HG13  VAL  55          HG13      VAL  55 -13.593  -1.442  -3.295
  255   HG21  VAL  55          HG21      VAL  55 -15.737  -3.778  -5.332
  256   HG22  VAL  55          HG22      VAL  55 -14.587  -3.042  -6.449
  257   HG23  VAL  55          HG23      VAL  55 -16.265  -2.501  -6.426
  258    H    ILE  56           HN       ILE  56 -15.356  -2.865  -1.905
  259    HA   ILE  56           HA       ILE  56 -17.605  -4.568  -1.436
  260    HB   ILE  56           HB       ILE  56 -15.877  -6.628  -1.708
  261   HG12  ILE  56          HG12      ILE  56 -14.990  -6.384  -4.094
  262   HG13  ILE  56          HG11      ILE  56 -15.234  -4.654  -3.897
  263   HG21  ILE  56          HG21      ILE  56 -17.711  -5.624  -3.875
  264   HG22  ILE  56          HG22      ILE  56 -18.218  -6.514  -2.440
  265   HG23  ILE  56          HG23      ILE  56 -17.175  -7.287  -3.634
  266   HD11  ILE  56          HD11      ILE  56 -13.451  -6.385  -2.202
  267   HD12  ILE  56          HD12      ILE  56 -13.691  -4.648  -2.015
  268   HD13  ILE  56          HD13      ILE  56 -12.931  -5.281  -3.475
  269    H    GLY  57           HN       GLY  57 -17.483  -3.873   0.670
  270    HA2  GLY  57           HA2      GLY  57 -16.243  -5.308   2.582
  271    HA3  GLY  57           HA1      GLY  57 -15.009  -4.132   2.157
  272    HA   PRO  58           HA       PRO  58 -18.716  -1.621   4.039
  273    HB2  PRO  58           HB2      PRO  58 -20.542  -3.060   5.441
  274    HB3  PRO  58           HB1      PRO  58 -20.719  -2.709   3.717
  275    HG2  PRO  58           HG2      PRO  58 -19.685  -5.191   5.047
  276    HG3  PRO  58           HG1      PRO  58 -20.836  -5.041   3.704
  277    HD2  PRO  58           HD2      PRO  58 -18.244  -5.626   3.286
  278    HD3  PRO  58           HD1      PRO  58 -19.170  -4.613   2.160
  279    H    GLN  59           HN       GLN  59 -19.824  -1.936   6.572
  280    HA   GLN  59           HA       GLN  59 -17.785  -2.948   8.357
  281    HB2  GLN  59           HB2      GLN  59 -17.643  -0.678   9.520
  282    HB3  GLN  59           HB1      GLN  59 -16.766  -0.861   8.007
  283    HG2  GLN  59           HG2      GLN  59 -17.805   1.260   7.961
  284    HG3  GLN  59           HG1      GLN  59 -18.699   0.222   6.851
  285   HE21  GLN  59          HE21      GLN  59 -20.791  -0.387   7.351
  286   HE22  GLN  59          HE22      GLN  59 -21.708   0.378   8.599
  287    H    ARG  60           HN       ARG  60 -20.616  -3.428   7.811
  288    HA   ARG  60           HA       ARG  60 -21.817  -2.574  10.355
  289    HB2  ARG  60           HB2      ARG  60 -23.062  -1.948   8.326
  290    HB3  ARG  60           HB1      ARG  60 -23.155  -3.641   7.863
  291    HG2  ARG  60           HG2      ARG  60 -24.487  -4.125   9.842
  292    HG3  ARG  60           HG1      ARG  60 -24.373  -2.436  10.339
  293    HD2  ARG  60           HD2      ARG  60 -25.531  -1.761   8.289
  294    HD3  ARG  60           HD1      ARG  60 -25.650  -3.452   7.803
  295    HE   ARG  60           HE       ARG  60 -26.801  -3.236  10.321
  296   HH11  ARG  60          HH11      ARG  60 -27.366  -2.038   7.097
  297   HH12  ARG  60          HH12      ARG  60 -29.082  -1.920   7.305
  298   HH21  ARG  60          HH21      ARG  60 -29.055  -3.085  10.601
  299   HH22  ARG  60          HH22      ARG  60 -30.042  -2.514   9.297
  Start of MODEL   13
    1    H1   ARG  28           HT1      ARG  28  24.380   0.953  -6.971
    2    H2   ARG  28           HT2      ARG  28  26.039   0.662  -7.131
    3    H3   ARG  28           HT3      ARG  28  25.487   1.843  -6.052
    4    HA   ARG  28           HA       ARG  28  24.937  -1.058  -5.830
    5    HB2  ARG  28           HB2      ARG  28  26.486  -0.996  -3.910
    6    HB3  ARG  28           HB1      ARG  28  27.290  -0.603  -5.422
    7    HG2  ARG  28           HG2      ARG  28  27.231   1.758  -4.868
    8    HG3  ARG  28           HG1      ARG  28  26.360   1.401  -3.375
    9    HD2  ARG  28           HD2      ARG  28  29.144   0.474  -4.082
   10    HD3  ARG  28           HD1      ARG  28  28.733   1.756  -2.941
   11    HE   ARG  28           HE       ARG  28  27.401  -0.485  -2.058
   12   HH11  ARG  28          HH11      ARG  28  30.719   0.410  -2.650
   13   HH12  ARG  28          HH12      ARG  28  31.354  -0.646  -1.433
   14   HH21  ARG  28          HH21      ARG  28  28.232  -1.874  -0.453
   15   HH22  ARG  28          HH22      ARG  28  29.942  -1.944  -0.186
   16    H    ARG  29           HN       ARG  29  23.077   1.199  -5.757
   17    HA   ARG  29           HA       ARG  29  22.465   1.886  -3.080
   18    HB2  ARG  29           HB2      ARG  29  21.672   3.218  -4.962
   19    HB3  ARG  29           HB1      ARG  29  20.710   1.866  -5.541
   20    HG2  ARG  29           HG2      ARG  29  19.311   1.978  -3.564
   21    HG3  ARG  29           HG1      ARG  29  20.302   3.288  -2.919
   22    HD2  ARG  29           HD2      ARG  29  19.680   4.709  -4.786
   23    HD3  ARG  29           HD1      ARG  29  18.749   3.394  -5.501
   24    HE   ARG  29           HE       ARG  29  17.719   3.777  -2.970
   25   HH11  ARG  29          HH11      ARG  29  18.107   5.664  -5.872
   26   HH12  ARG  29          HH12      ARG  29  16.700   6.633  -5.587
   27   HH21  ARG  29          HH21      ARG  29  15.863   5.047  -2.585
   28   HH22  ARG  29          HH22      ARG  29  15.425   6.282  -3.717
   29    H    CYS  30           HN       CYS  30  21.139   0.972  -1.595
   30    HA   CYS  30           HA       CYS  30  20.665  -1.802  -1.703
   31    HB2  CYS  30           HB2      CYS  30  19.484   0.284   0.143
   32    HB3  CYS  30           HB1      CYS  30  19.408  -1.456   0.401
   33    HG   CYS  30           HG       CYS  30  21.428  -1.235   1.998
   34    H    LEU  31           HN       LEU  31  19.383  -2.483  -3.353
   35    HA   LEU  31           HA       LEU  31  16.850  -1.196  -3.904
   36    HB2  LEU  31           HB2      LEU  31  18.244  -2.047  -5.733
   37    HB3  LEU  31           HB1      LEU  31  18.105  -3.671  -5.091
   38    HG   LEU  31           HG       LEU  31  15.640  -3.556  -5.486
   39   HD11  LEU  31          HD11      LEU  31  15.387  -1.134  -5.465
   40   HD12  LEU  31          HD12      LEU  31  14.786  -1.817  -6.976
   41   HD13  LEU  31          HD13      LEU  31  16.353  -1.010  -6.935
   42   HD21  LEU  31          HD21      LEU  31  17.407  -3.141  -7.895
   43   HD22  LEU  31          HD22      LEU  31  15.797  -3.863  -7.909
   44   HD23  LEU  31          HD23      LEU  31  17.119  -4.671  -7.066
   45    H    PHE  32           HN       PHE  32  17.921  -4.416  -2.822
   46    HA   PHE  32           HA       PHE  32  15.363  -5.503  -2.438
   47    HB2  PHE  32           HB2      PHE  32  17.981  -6.176  -1.085
   48    HB3  PHE  32           HB1      PHE  32  16.520  -7.151  -0.964
   49    HD1  PHE  32           HD1      PHE  32  15.734  -8.453  -2.843
   50    HD2  PHE  32           HD2      PHE  32  19.273  -6.105  -3.123
   51    HE1  PHE  32           HE1      PHE  32  16.364  -9.655  -4.895
   52    HE2  PHE  32           HE2      PHE  32  19.910  -7.302  -5.176
   53    HZ   PHE  32           HZ       PHE  32  18.454  -9.080  -6.065
   54    H    LEU  33           HN       LEU  33  17.234  -3.323  -0.504
   55    HA   LEU  33           HA       LEU  33  15.661  -3.771   1.890
   56    HB2  LEU  33           HB2      LEU  33  17.841  -1.816   1.222
   57    HB3  LEU  33           HB1      LEU  33  17.017  -1.828   2.762
   58    HG   LEU  33           HG       LEU  33  17.778  -4.281   2.866
   59   HD11  LEU  33          HD11      LEU  33  19.716  -3.210   0.836
   60   HD12  LEU  33          HD12      LEU  33  18.535  -4.494   0.577
   61   HD13  LEU  33          HD13      LEU  33  19.875  -4.742   1.696
   62   HD21  LEU  33          HD21      LEU  33  19.734  -2.015   3.134
   63   HD22  LEU  33          HD22      LEU  33  19.917  -3.610   3.863
   64   HD23  LEU  33          HD23      LEU  33  18.589  -2.559   4.360
   65    H    SER  34           HN       SER  34  16.078  -1.216  -0.531
   66    HA   SER  34           HA       SER  34  14.216   0.580   0.611
   67    HB2  SER  34           HB2      SER  34  15.885   1.341  -0.999
   68    HB3  SER  34           HB1      SER  34  15.166   0.331  -2.253
   69    HG   SER  34           HG       SER  34  13.690   1.795  -2.564
   70    H    LEU  35           HN       LEU  35  13.870  -2.254  -1.312
   71    HA   LEU  35           HA       LEU  35  11.302  -1.718  -2.401
   72    HB2  LEU  35           HB2      LEU  35  12.834  -3.420  -3.304
   73    HB3  LEU  35           HB1      LEU  35  12.638  -4.363  -1.840
   74    HG   LEU  35           HG       LEU  35  10.234  -4.635  -2.362
   75   HD11  LEU  35          HD11      LEU  35   9.913  -2.612  -3.682
   76   HD12  LEU  35          HD12      LEU  35   9.417  -4.043  -4.586
   77   HD13  LEU  35          HD13      LEU  35  10.956  -3.261  -4.947
   78   HD21  LEU  35          HD21      LEU  35  12.101  -5.494  -4.564
   79   HD22  LEU  35          HD22      LEU  35  10.538  -6.217  -4.184
   80   HD23  LEU  35          HD23      LEU  35  11.866  -6.327  -3.029
   81    H    PHE  36           HN       PHE  36  12.385  -2.534   0.720
   82    HA   PHE  36           HA       PHE  36  10.102  -3.957   1.643
   83    HB2  PHE  36           HB2      PHE  36  12.335  -4.027   2.742
   84    HB3  PHE  36           HB1      PHE  36  12.099  -2.360   3.258
   85    HD1  PHE  36           HD1      PHE  36  10.715  -5.782   3.567
   86    HD2  PHE  36           HD2      PHE  36  10.923  -1.865   5.216
   87    HE1  PHE  36           HE1      PHE  36   9.567  -6.577   5.591
   88    HE2  PHE  36           HE2      PHE  36   9.775  -2.654   7.244
   89    HZ   PHE  36           HZ       PHE  36   9.099  -5.014   7.435
   90    H    SER  37           HN       SER  37  10.881  -0.573   1.317
   91    HA   SER  37           HA       SER  37   8.862   0.408   3.076
   92    HB2  SER  37           HB2      SER  37  10.143   1.868   0.756
   93    HB3  SER  37           HB1      SER  37   9.359   2.585   2.164
   94    HG   SER  37           HG       SER  37  11.645   2.567   2.352
   95    H    PHE  38           HN       PHE  38   9.061   0.071  -0.460
   96    HA   PHE  38           HA       PHE  38   6.511   1.100  -1.030
   97    HB2  PHE  38           HB2      PHE  38   8.041  -0.979  -2.600
   98    HB3  PHE  38           HB1      PHE  38   6.751   0.050  -3.211
   99    HD1  PHE  38           HD1      PHE  38   7.138   2.549  -3.265
  100    HD2  PHE  38           HD2      PHE  38  10.265  -0.268  -2.644
  101    HE1  PHE  38           HE1      PHE  38   8.792   4.252  -3.911
  102    HE2  PHE  38           HE2      PHE  38  11.926   1.429  -3.288
  103    HZ   PHE  38           HZ       PHE  38  11.195   3.688  -3.923
  104    H    LEU  39           HN       LEU  39   7.498  -1.900   0.302
  105    HA   LEU  39           HA       LEU  39   5.200  -3.411  -0.494
  106    HB2  LEU  39           HB2      LEU  39   7.473  -4.329   0.178
  107    HB3  LEU  39           HB1      LEU  39   7.016  -3.997   1.838
  108    HG   LEU  39           HG       LEU  39   5.188  -5.651   0.174
  109   HD11  LEU  39          HD11      LEU  39   7.384  -6.595  -0.298
  110   HD12  LEU  39          HD12      LEU  39   6.437  -7.674   0.727
  111   HD13  LEU  39          HD13      LEU  39   7.721  -6.691   1.430
  112   HD21  LEU  39          HD21      LEU  39   6.022  -5.724   3.071
  113   HD22  LEU  39          HD22      LEU  39   4.799  -6.754   2.325
  114   HD23  LEU  39          HD23      LEU  39   4.539  -5.013   2.435
  115    H    ILE  40           HN       ILE  40   6.073  -1.380   2.209
  116    HA   ILE  40           HA       ILE  40   3.811  -2.126   3.822
  117    HB   ILE  40           HB       ILE  40   5.611   0.283   4.102
  118   HG12  ILE  40          HG12      ILE  40   5.820  -2.386   5.511
  119   HG13  ILE  40          HG11      ILE  40   6.807  -1.928   4.126
  120   HG21  ILE  40          HG21      ILE  40   4.866   0.263   6.441
  121   HG22  ILE  40          HG22      ILE  40   3.780  -1.078   6.076
  122   HG23  ILE  40          HG23      ILE  40   3.521   0.496   5.325
  123   HD11  ILE  40          HD11      ILE  40   6.743  -0.477   6.761
  124   HD12  ILE  40          HD12      ILE  40   7.789  -0.119   5.388
  125   HD13  ILE  40          HD13      ILE  40   7.972  -1.639   6.262
  126    H    VAL  41           HN       VAL  41   4.629   0.452   1.576
  127    HA   VAL  41           HA       VAL  41   2.334   2.052   2.136
  128    HB   VAL  41           HB       VAL  41   4.529   2.822   1.068
  129   HG11  VAL  41          HG11      VAL  41   3.157   1.790  -1.403
  130   HG12  VAL  41          HG12      VAL  41   4.614   1.120  -0.675
  131   HG13  VAL  41          HG13      VAL  41   4.637   2.746  -1.356
  132   HG21  VAL  41          HG21      VAL  41   1.899   3.636  -0.168
  133   HG22  VAL  41          HG22      VAL  41   3.393   4.573  -0.227
  134   HG23  VAL  41          HG23      VAL  41   2.597   4.277   1.320
  135    H    LEU  42           HN       LEU  42   2.974  -0.667   0.093
  136    HA   LEU  42           HA       LEU  42   0.639  -0.263  -1.566
  137    HB2  LEU  42           HB2      LEU  42   2.946  -1.486  -2.073
  138    HB3  LEU  42           HB1      LEU  42   2.068  -2.877  -1.448
  139    HG   LEU  42           HG       LEU  42   1.955  -2.809  -3.874
  140   HD11  LEU  42          HD11      LEU  42   0.035  -3.702  -2.644
  141   HD12  LEU  42          HD12      LEU  42  -0.446  -2.958  -4.169
  142   HD13  LEU  42          HD13      LEU  42  -0.705  -2.101  -2.650
  143   HD21  LEU  42          HD21      LEU  42   0.627  -0.125  -3.529
  144   HD22  LEU  42          HD22      LEU  42   0.813  -1.002  -5.049
  145   HD23  LEU  42          HD23      LEU  42   2.236  -0.410  -4.192
  146    H    LEU  43           HN       LEU  43   1.661  -2.541   0.964
  147    HA   LEU  43           HA       LEU  43  -0.602  -4.140   1.052
  148    HB2  LEU  43           HB2      LEU  43   1.736  -3.984   2.463
  149    HB3  LEU  43           HB1      LEU  43   0.563  -3.515   3.677
  150    HG   LEU  43           HG       LEU  43   1.009  -5.895   3.812
  151   HD11  LEU  43          HD11      LEU  43  -1.270  -6.750   3.641
  152   HD12  LEU  43          HD12      LEU  43  -1.728  -5.348   2.673
  153   HD13  LEU  43          HD13      LEU  43  -1.243  -5.137   4.355
  154   HD21  LEU  43          HD21      LEU  43   0.028  -6.039   0.964
  155   HD22  LEU  43          HD22      LEU  43   0.464  -7.409   1.985
  156   HD23  LEU  43          HD23      LEU  43   1.698  -6.251   1.490
  157    H    LEU  44           HN       LEU  44  -0.114  -0.909   2.255
  158    HA   LEU  44           HA       LEU  44  -2.503  -0.927   3.880
  159    HB2  LEU  44           HB2      LEU  44  -0.542   1.222   3.117
  160    HB3  LEU  44           HB1      LEU  44  -2.003   1.573   4.017
  161    HG   LEU  44           HG       LEU  44   0.215  -0.262   4.931
  162   HD11  LEU  44          HD11      LEU  44   0.625   1.498   6.600
  163   HD12  LEU  44          HD12      LEU  44  -0.574   2.513   5.800
  164   HD13  LEU  44          HD13      LEU  44   0.903   2.058   4.951
  165   HD21  LEU  44          HD21      LEU  44  -2.298   0.657   6.323
  166   HD22  LEU  44          HD22      LEU  44  -0.989  -0.255   7.073
  167   HD23  LEU  44          HD23      LEU  44  -1.944  -0.984   5.781
  168    H    THR  45           HN       THR  45  -1.471   0.626   0.850
  169    HA   THR  45           HA       THR  45  -3.805   2.034   0.305
  170    HB   THR  45           HB       THR  45  -3.118   1.767  -2.141
  171    HG1  THR  45           HG1      THR  45  -0.613   0.922  -1.378
  172   HG21  THR  45          HG21      THR  45  -1.169   3.237  -1.870
  173   HG22  THR  45          HG22      THR  45  -1.100   2.824  -0.158
  174   HG23  THR  45          HG23      THR  45  -2.489   3.703  -0.796
  175    H    THR  46           HN       THR  46  -3.102  -1.366  -0.113
  176    HA   THR  46           HA       THR  46  -5.104  -2.042  -1.942
  177    HB   THR  46           HB       THR  46  -4.073  -3.745   0.335
  178    HG1  THR  46           HG1      THR  46  -2.956  -2.905  -2.039
  179   HG21  THR  46          HG21      THR  46  -4.733  -5.636  -1.066
  180   HG22  THR  46          HG22      THR  46  -5.366  -4.526  -2.282
  181   HG23  THR  46          HG23      THR  46  -6.127  -4.621  -0.694
  182    H    LEU  47           HN       LEU  47  -5.235  -2.383   1.615
  183    HA   LEU  47           HA       LEU  47  -8.035  -2.893   1.615
  184    HB2  LEU  47           HB2      LEU  47  -5.892  -2.553   3.641
  185    HB3  LEU  47           HB1      LEU  47  -7.544  -2.341   4.169
  186    HG   LEU  47           HG       LEU  47  -8.089  -4.611   3.380
  187   HD11  LEU  47          HD11      LEU  47  -6.455  -4.782   1.585
  188   HD12  LEU  47          HD12      LEU  47  -6.290  -6.126   2.716
  189   HD13  LEU  47          HD13      LEU  47  -5.143  -4.786   2.765
  190   HD21  LEU  47          HD21      LEU  47  -6.854  -5.829   5.099
  191   HD22  LEU  47          HD22      LEU  47  -7.406  -4.264   5.696
  192   HD23  LEU  47          HD23      LEU  47  -5.718  -4.487   5.239
  193    H    PHE  48           HN       PHE  48  -6.030  -0.093   2.443
  194    HA   PHE  48           HA       PHE  48  -7.981   1.579   3.480
  195    HB2  PHE  48           HB2      PHE  48  -5.602   2.105   3.586
  196    HB3  PHE  48           HB1      PHE  48  -5.551   2.326   1.842
  197    HD1  PHE  48           HD1      PHE  48  -5.825   4.439   0.957
  198    HD2  PHE  48           HD2      PHE  48  -7.254   3.634   4.884
  199    HE1  PHE  48           HE1      PHE  48  -6.369   6.822   1.244
  200    HE2  PHE  48           HE2      PHE  48  -7.801   6.015   5.178
  201    HZ   PHE  48           HZ       PHE  48  -7.358   7.613   3.356
  202    H    CYS  49           HN       CYS  49  -7.072   1.068   0.088
  203    HA   CYS  49           HA       CYS  49  -8.791   3.086  -0.939
  204    HB2  CYS  49           HB2      CYS  49  -7.430   0.718  -2.212
  205    HB3  CYS  49           HB1      CYS  49  -8.463   1.812  -3.126
  206    HG   CYS  49           HG       CYS  49  -6.874   4.069  -2.629
  207    H    LEU  50           HN       LEU  50  -9.186  -0.335  -0.258
  208    HA   LEU  50           HA       LEU  50 -11.611  -0.741  -1.639
  209    HB2  LEU  50           HB2      LEU  50 -10.406  -2.119   0.759
  210    HB3  LEU  50           HB1      LEU  50 -11.878  -2.670  -0.033
  211    HG   LEU  50           HG       LEU  50  -9.271  -2.380  -1.515
  212   HD11  LEU  50          HD11      LEU  50  -8.914  -4.755  -1.203
  213   HD12  LEU  50          HD12      LEU  50 -10.359  -4.864  -0.197
  214   HD13  LEU  50          HD13      LEU  50  -8.964  -3.939   0.360
  215   HD21  LEU  50          HD21      LEU  50 -11.771  -3.968  -2.075
  216   HD22  LEU  50          HD22      LEU  50 -10.330  -3.904  -3.089
  217   HD23  LEU  50          HD23      LEU  50 -11.313  -2.458  -2.861
  218    H    LEU  51           HN       LEU  51 -10.958   0.159   1.729
  219    HA   LEU  51           HA       LEU  51 -13.567   0.141   2.682
  220    HB2  LEU  51           HB2      LEU  51 -11.339   2.029   3.448
  221    HB3  LEU  51           HB1      LEU  51 -12.776   1.703   4.399
  222    HG   LEU  51           HG       LEU  51 -10.716  -0.389   3.693
  223   HD11  LEU  51          HD11      LEU  51 -11.058   1.164   6.257
  224   HD12  LEU  51          HD12      LEU  51  -9.736   1.353   5.106
  225   HD13  LEU  51          HD13      LEU  51  -9.928  -0.162   5.987
  226   HD21  LEU  51          HD21      LEU  51 -11.815  -1.698   5.425
  227   HD22  LEU  51          HD22      LEU  51 -12.963  -1.251   4.163
  228   HD23  LEU  51          HD23      LEU  51 -12.967  -0.392   5.702
  229    H    HIS  52           HN       HIS  52 -11.783   2.720   1.036
  230    HA   HIS  52           HA       HIS  52 -14.027   4.530   1.150
  231    HB2  HIS  52           HB2      HIS  52 -11.343   4.703  -0.226
  232    HB3  HIS  52           HB1      HIS  52 -12.557   5.976  -0.299
  233    HD1  HIS  52           HD1      HIS  52 -13.251   6.978   2.141
  234    HD2  HIS  52           HD2      HIS  52  -9.672   4.878   1.910
  235    HE1  HIS  52           HE1      HIS  52 -11.949   7.640   4.189
  236    HE2  HIS  52           HE2      HIS  52  -9.821   6.295   4.068
  237    H    PHE  53           HN       PHE  53 -12.885   2.082  -0.977
  238    HA   PHE  53           HA       PHE  53 -14.149   3.094  -3.350
  239    HB2  PHE  53           HB2      PHE  53 -12.229   1.638  -3.581
  240    HB3  PHE  53           HB1      PHE  53 -13.035   0.363  -2.674
  241    HD1  PHE  53           HD1      PHE  53 -14.416  -1.192  -3.747
  242    HD2  PHE  53           HD2      PHE  53 -13.159   2.301  -5.826
  243    HE1  PHE  53           HE1      PHE  53 -15.307  -2.123  -5.842
  244    HE2  PHE  53           HE2      PHE  53 -14.049   1.377  -7.925
  245    HZ   PHE  53           HZ       PHE  53 -15.126  -0.838  -7.935
  246    H    GLY  54           HN       GLY  54 -15.088   1.121  -0.657
  247    HA2  GLY  54           HA2      GLY  54 -17.248   0.563  -0.005
  248    HA3  GLY  54           HA1      GLY  54 -17.844   1.218  -1.521
  249    H    VAL  55           HN       VAL  55 -15.296  -1.152  -1.461
  250    HA   VAL  55           HA       VAL  55 -16.381  -2.877  -3.289
  251    HB   VAL  55           HB       VAL  55 -14.096  -3.114  -2.699
  252   HG11  VAL  55          HG11      VAL  55 -13.516  -4.128  -0.417
  253   HG12  VAL  55          HG12      VAL  55 -15.110  -3.555   0.068
  254   HG13  VAL  55          HG13      VAL  55 -13.902  -2.411  -0.506
  255   HG21  VAL  55          HG21      VAL  55 -15.536  -5.581  -1.741
  256   HG22  VAL  55          HG22      VAL  55 -13.873  -5.505  -2.324
  257   HG23  VAL  55          HG23      VAL  55 -15.210  -5.175  -3.426
  258    H    ILE  56           HN       ILE  56 -16.903  -2.820   0.178
  259    HA   ILE  56           HA       ILE  56 -19.162  -4.649  -0.182
  260    HB   ILE  56           HB       ILE  56 -18.307  -5.356   2.323
  261   HG12  ILE  56          HG12      ILE  56 -15.929  -6.096   1.960
  262   HG13  ILE  56          HG11      ILE  56 -15.894  -5.077   0.526
  263   HG21  ILE  56          HG21      ILE  56 -19.241  -6.849   0.662
  264   HG22  ILE  56          HG22      ILE  56 -17.732  -7.510   1.292
  265   HG23  ILE  56          HG23      ILE  56 -17.764  -6.744  -0.296
  266   HD11  ILE  56          HD11      ILE  56 -16.143  -4.240   3.394
  267   HD12  ILE  56          HD12      ILE  56 -16.496  -3.153   2.053
  268   HD13  ILE  56          HD13      ILE  56 -14.879  -3.832   2.232
  269    H    GLY  57           HN       GLY  57 -18.280  -1.705   0.673
  270    HA2  GLY  57           HA2      GLY  57 -20.637  -1.302   2.295
  271    HA3  GLY  57           HA1      GLY  57 -19.130  -1.020   3.153
  272    HA   PRO  58           HA       PRO  58 -19.225   2.341  -0.296
  273    HB2  PRO  58           HB2      PRO  58 -21.466   2.568  -1.802
  274    HB3  PRO  58           HB1      PRO  58 -20.105   1.537  -2.257
  275    HG2  PRO  58           HG2      PRO  58 -22.696   0.794  -0.961
  276    HG3  PRO  58           HG1      PRO  58 -21.807  -0.043  -2.247
  277    HD2  PRO  58           HD2      PRO  58 -21.733  -0.828   0.354
  278    HD3  PRO  58           HD1      PRO  58 -20.376  -1.066  -0.765
  279    H    GLN  59           HN       GLN  59 -22.694   1.925   0.328
  280    HA   GLN  59           HA       GLN  59 -24.242   3.260   1.327
  281    HB2  GLN  59           HB2      GLN  59 -21.901   3.885   3.135
  282    HB3  GLN  59           HB1      GLN  59 -23.582   4.253   3.496
  283    HG2  GLN  59           HG2      GLN  59 -22.423   1.503   3.102
  284    HG3  GLN  59           HG1      GLN  59 -22.837   2.244   4.647
  285   HE21  GLN  59          HE21      GLN  59 -25.240   3.508   3.571
  286   HE22  GLN  59          HE22      GLN  59 -26.408   2.247   3.400
  287    H    ARG  60           HN       ARG  60 -24.469   4.659  -0.464
  288    HA   ARG  60           HA       ARG  60 -22.965   7.169  -0.375
  289    HB2  ARG  60           HB2      ARG  60 -24.895   6.164  -2.474
  290    HB3  ARG  60           HB1      ARG  60 -23.874   7.591  -2.598
  291    HG2  ARG  60           HG2      ARG  60 -21.883   6.161  -2.496
  292    HG3  ARG  60           HG1      ARG  60 -22.926   4.738  -2.420
  293    HD2  ARG  60           HD2      ARG  60 -23.894   5.379  -4.601
  294    HD3  ARG  60           HD1      ARG  60 -22.767   6.733  -4.678
  295    HE   ARG  60           HE       ARG  60 -21.600   4.089  -4.365
  296   HH11  ARG  60          HH11      ARG  60 -22.450   6.708  -6.502
  297   HH12  ARG  60          HH12      ARG  60 -21.378   6.198  -7.762
  298   HH21  ARG  60          HH21      ARG  60 -20.186   3.411  -6.018
  299   HH22  ARG  60          HH22      ARG  60 -20.089   4.324  -7.487
  Start of MODEL   14
    1    H1   ARG  28           HT1      ARG  28  22.668   4.043   4.071
    2    H2   ARG  28           HT2      ARG  28  24.354   3.999   3.944
    3    H3   ARG  28           HT3      ARG  28  23.489   2.571   4.214
    4    HA   ARG  28           HA       ARG  28  23.370   4.249   1.778
    5    HB2  ARG  28           HB2      ARG  28  25.461   2.920   2.077
    6    HB3  ARG  28           HB1      ARG  28  24.482   1.463   2.169
    7    HG2  ARG  28           HG2      ARG  28  25.262   1.515  -0.028
    8    HG3  ARG  28           HG1      ARG  28  23.603   2.107  -0.135
    9    HD2  ARG  28           HD2      ARG  28  26.011   3.906   0.059
   10    HD3  ARG  28           HD1      ARG  28  25.296   3.398  -1.470
   11    HE   ARG  28           HE       ARG  28  23.279   4.506   0.121
   12   HH11  ARG  28          HH11      ARG  28  26.171   5.483  -1.560
   13   HH12  ARG  28          HH12      ARG  28  25.622   7.104  -1.827
   14   HH21  ARG  28          HH21      ARG  28  22.548   6.637  -0.230
   15   HH22  ARG  28          HH22      ARG  28  23.563   7.760  -1.071
   16    H    ARG  29           HN       ARG  29  21.745   3.833   0.386
   17    HA   ARG  29           HA       ARG  29  19.850   1.704   1.137
   18    HB2  ARG  29           HB2      ARG  29  18.124   3.130  -0.008
   19    HB3  ARG  29           HB1      ARG  29  18.797   3.821   1.461
   20    HG2  ARG  29           HG2      ARG  29  20.306   5.202   0.077
   21    HG3  ARG  29           HG1      ARG  29  19.519   4.559  -1.366
   22    HD2  ARG  29           HD2      ARG  29  18.127   6.066   0.842
   23    HD3  ARG  29           HD1      ARG  29  18.643   6.768  -0.692
   24    HE   ARG  29           HE       ARG  29  17.055   4.601  -1.329
   25   HH11  ARG  29          HH11      ARG  29  16.694   7.605   0.399
   26   HH12  ARG  29          HH12      ARG  29  15.014   7.773   0.016
   27   HH21  ARG  29          HH21      ARG  29  14.842   4.814  -1.839
   28   HH22  ARG  29          HH22      ARG  29  13.960   6.186  -1.255
   29    H    CYS  30           HN       CYS  30  19.533   0.121  -0.282
   30    HA   CYS  30           HA       CYS  30  20.606   0.451  -2.991
   31    HB2  CYS  30           HB2      CYS  30  19.862  -2.062  -1.482
   32    HB3  CYS  30           HB1      CYS  30  20.542  -2.017  -3.105
   33    HG   CYS  30           HG       CYS  30  22.242  -0.619  -0.506
   34    H    LEU  31           HN       LEU  31  19.332  -1.224  -4.542
   35    HA   LEU  31           HA       LEU  31  16.861   0.015  -5.074
   36    HB2  LEU  31           HB2      LEU  31  18.211  -1.041  -6.814
   37    HB3  LEU  31           HB1      LEU  31  17.956  -2.613  -6.079
   38    HG   LEU  31           HG       LEU  31  15.511  -2.365  -6.542
   39   HD11  LEU  31          HD11      LEU  31  15.422   0.067  -6.680
   40   HD12  LEU  31          HD12      LEU  31  14.800  -0.676  -8.153
   41   HD13  LEU  31          HD13      LEU  31  16.417   0.027  -8.137
   42   HD21  LEU  31          HD21      LEU  31  16.949  -3.672  -8.010
   43   HD22  LEU  31          HD22      LEU  31  17.350  -2.221  -8.927
   44   HD23  LEU  31          HD23      LEU  31  15.699  -2.840  -8.935
   45    H    PHE  32           HN       PHE  32  17.524  -3.318  -3.986
   46    HA   PHE  32           HA       PHE  32  14.808  -3.931  -3.464
   47    HB2  PHE  32           HB2      PHE  32  17.373  -5.213  -2.509
   48    HB3  PHE  32           HB1      PHE  32  15.774  -5.876  -2.189
   49    HD1  PHE  32           HD1      PHE  32  14.585  -7.077  -3.849
   50    HD2  PHE  32           HD2      PHE  32  18.209  -5.076  -4.832
   51    HE1  PHE  32           HE1      PHE  32  14.641  -8.250  -6.011
   52    HE2  PHE  32           HE2      PHE  32  18.272  -6.245  -6.996
   53    HZ   PHE  32           HZ       PHE  32  16.478  -7.842  -7.584
   54    H    LEU  33           HN       LEU  33  17.380  -2.538  -1.544
   55    HA   LEU  33           HA       LEU  33  16.296  -2.858   1.008
   56    HB2  LEU  33           HB2      LEU  33  18.469  -1.479  -0.186
   57    HB3  LEU  33           HB1      LEU  33  17.615  -0.330   0.824
   58    HG   LEU  33           HG       LEU  33  17.779  -2.066   2.680
   59   HD11  LEU  33          HD11      LEU  33  19.823  -3.216   0.791
   60   HD12  LEU  33          HD12      LEU  33  18.318  -3.987   1.291
   61   HD13  LEU  33          HD13      LEU  33  19.592  -3.691   2.474
   62   HD21  LEU  33          HD21      LEU  33  20.053  -1.393   3.261
   63   HD22  LEU  33          HD22      LEU  33  19.125  -0.033   2.627
   64   HD23  LEU  33          HD23      LEU  33  20.316  -0.841   1.606
   65    H    SER  34           HN       SER  34  15.886  -0.235  -1.344
   66    HA   SER  34           HA       SER  34  14.075   1.228   0.338
   67    HB2  SER  34           HB2      SER  34  15.493   2.403  -1.275
   68    HB3  SER  34           HB1      SER  34  14.723   1.536  -2.604
   69    HG   SER  34           HG       SER  34  13.818   3.608  -2.317
   70    H    LEU  35           HN       LEU  35  13.826  -1.334  -1.918
   71    HA   LEU  35           HA       LEU  35  11.158  -0.946  -2.784
   72    HB2  LEU  35           HB2      LEU  35  12.839  -2.411  -3.890
   73    HB3  LEU  35           HB1      LEU  35  12.688  -3.534  -2.553
   74    HG   LEU  35           HG       LEU  35  10.329  -3.911  -3.125
   75   HD11  LEU  35          HD11      LEU  35   9.436  -3.038  -5.240
   76   HD12  LEU  35          HD12      LEU  35  10.890  -2.059  -5.438
   77   HD13  LEU  35          HD13      LEU  35   9.796  -1.751  -4.089
   78   HD21  LEU  35          HD21      LEU  35  10.706  -5.133  -5.209
   79   HD22  LEU  35          HD22      LEU  35  12.041  -5.360  -4.079
   80   HD23  LEU  35          HD23      LEU  35  12.219  -4.260  -5.448
   81    H    PHE  36           HN       PHE  36  12.471  -1.947   0.188
   82    HA   PHE  36           HA       PHE  36  10.359  -3.656   1.044
   83    HB2  PHE  36           HB2      PHE  36  12.629  -3.699   2.038
   84    HB3  PHE  36           HB1      PHE  36  12.340  -2.101   2.720
   85    HD1  PHE  36           HD1      PHE  36  11.109  -5.597   2.759
   86    HD2  PHE  36           HD2      PHE  36  11.285  -1.859   4.786
   87    HE1  PHE  36           HE1      PHE  36  10.106  -6.636   4.751
   88    HE2  PHE  36           HE2      PHE  36  10.283  -2.891   6.782
   89    HZ   PHE  36           HZ       PHE  36   9.692  -5.282   6.767
   90    H    SER  37           HN       SER  37  10.805  -0.227   0.938
   91    HA   SER  37           HA       SER  37   8.872   0.431   2.935
   92    HB2  SER  37           HB2      SER  37  10.004   2.109   0.684
   93    HB3  SER  37           HB1      SER  37   9.047   2.725   2.029
   94    HG   SER  37           HG       SER  37  11.691   1.954   1.945
   95    H    PHE  38           HN       PHE  38   8.789  -0.050  -0.547
   96    HA   PHE  38           HA       PHE  38   6.167   0.957  -0.954
   97    HB2  PHE  38           HB2      PHE  38   7.742  -1.041  -2.582
   98    HB3  PHE  38           HB1      PHE  38   6.273  -0.231  -3.114
   99    HD1  PHE  38           HD1      PHE  38   6.316   1.994  -3.936
  100    HD2  PHE  38           HD2      PHE  38   9.816   0.258  -2.251
  101    HE1  PHE  38           HE1      PHE  38   7.660   3.860  -4.814
  102    HE2  PHE  38           HE2      PHE  38  11.166   2.119  -3.125
  103    HZ   PHE  38           HZ       PHE  38  10.075   3.931  -4.412
  104    H    LEU  39           HN       LEU  39   7.436  -2.080   0.139
  105    HA   LEU  39           HA       LEU  39   5.144  -3.660  -0.398
  106    HB2  LEU  39           HB2      LEU  39   7.488  -4.476   0.111
  107    HB3  LEU  39           HB1      LEU  39   7.155  -4.129   1.797
  108    HG   LEU  39           HG       LEU  39   5.262  -5.879   0.319
  109   HD11  LEU  39          HD11      LEU  39   6.637  -7.845   0.803
  110   HD12  LEU  39          HD12      LEU  39   7.938  -6.795   1.366
  111   HD13  LEU  39          HD13      LEU  39   7.441  -6.756  -0.327
  112   HD21  LEU  39          HD21      LEU  39   4.778  -5.228   2.613
  113   HD22  LEU  39          HD22      LEU  39   6.338  -5.863   3.136
  114   HD23  LEU  39          HD23      LEU  39   5.104  -6.958   2.514
  115    H    ILE  40           HN       ILE  40   6.186  -1.722   2.350
  116    HA   ILE  40           HA       ILE  40   4.085  -2.521   4.095
  117    HB   ILE  40           HB       ILE  40   5.693   0.035   4.167
  118   HG12  ILE  40          HG12      ILE  40   6.226  -2.553   5.636
  119   HG13  ILE  40          HG11      ILE  40   7.051  -2.087   4.152
  120   HG21  ILE  40          HG21      ILE  40   4.131  -1.397   6.313
  121   HG22  ILE  40          HG22      ILE  40   3.699   0.132   5.548
  122   HG23  ILE  40          HG23      ILE  40   5.140   0.028   6.560
  123   HD11  ILE  40          HD11      ILE  40   7.118  -0.557   6.742
  124   HD12  ILE  40          HD12      ILE  40   7.977  -0.137   5.260
  125   HD13  ILE  40          HD13      ILE  40   8.391  -1.614   6.131
  126    H    VAL  41           HN       VAL  41   4.544   0.195   1.871
  127    HA   VAL  41           HA       VAL  41   2.122   1.515   2.550
  128    HB   VAL  41           HB       VAL  41   4.188   2.487   1.348
  129   HG11  VAL  41          HG11      VAL  41   2.688   1.365  -1.006
  130   HG12  VAL  41          HG12      VAL  41   4.309   0.922  -0.477
  131   HG13  VAL  41          HG13      VAL  41   3.999   2.540  -1.103
  132   HG21  VAL  41          HG21      VAL  41   2.798   4.183   0.223
  133   HG22  VAL  41          HG22      VAL  41   2.204   3.787   1.838
  134   HG23  VAL  41          HG23      VAL  41   1.394   3.132   0.414
  135    H    LEU  42           HN       LEU  42   2.883  -1.172   0.557
  136    HA   LEU  42           HA       LEU  42   0.551  -0.986  -1.119
  137    HB2  LEU  42           HB2      LEU  42   2.748  -2.084  -1.743
  138    HB3  LEU  42           HB1      LEU  42   2.301  -3.399  -0.665
  139    HG   LEU  42           HG       LEU  42   0.470  -2.598  -2.904
  140   HD11  LEU  42          HD11      LEU  42   1.571  -4.248  -4.337
  141   HD12  LEU  42          HD12      LEU  42   2.832  -4.460  -3.121
  142   HD13  LEU  42          HD13      LEU  42   2.648  -2.909  -3.940
  143   HD21  LEU  42          HD21      LEU  42   0.999  -5.172  -1.422
  144   HD22  LEU  42          HD22      LEU  42  -0.114  -5.002  -2.779
  145   HD23  LEU  42          HD23      LEU  42  -0.421  -4.136  -1.273
  146    H    LEU  43           HN       LEU  43   1.572  -3.098   1.561
  147    HA   LEU  43           HA       LEU  43  -0.659  -4.707   1.752
  148    HB2  LEU  43           HB2      LEU  43   1.084  -3.629   3.965
  149    HB3  LEU  43           HB1      LEU  43  -0.083  -4.920   4.174
  150    HG   LEU  43           HG       LEU  43   2.289  -5.049   2.311
  151   HD11  LEU  43          HD11      LEU  43   3.253  -6.575   3.961
  152   HD12  LEU  43          HD12      LEU  43   1.892  -6.267   5.041
  153   HD13  LEU  43          HD13      LEU  43   3.009  -4.964   4.635
  154   HD21  LEU  43          HD21      LEU  43   0.319  -7.150   3.207
  155   HD22  LEU  43          HD22      LEU  43   1.751  -7.443   2.222
  156   HD23  LEU  43          HD23      LEU  43   0.437  -6.449   1.593
  157    H    LEU  44           HN       LEU  44  -0.237  -1.415   2.924
  158    HA   LEU  44           HA       LEU  44  -2.732  -1.437   4.376
  159    HB2  LEU  44           HB2      LEU  44  -0.870   0.833   3.683
  160    HB3  LEU  44           HB1      LEU  44  -2.273   0.972   4.723
  161    HG   LEU  44           HG       LEU  44   0.183  -0.697   5.277
  162   HD11  LEU  44          HD11      LEU  44   0.536   0.910   7.102
  163   HD12  LEU  44          HD12      LEU  44  -0.837   1.851   6.521
  164   HD13  LEU  44          HD13      LEU  44   0.600   1.677   5.516
  165   HD21  LEU  44          HD21      LEU  44  -2.284  -0.236   6.953
  166   HD22  LEU  44          HD22      LEU  44  -0.829  -1.086   7.472
  167   HD23  LEU  44          HD23      LEU  44  -1.823  -1.750   6.176
  168    H    THR  45           HN       THR  45  -1.524   0.088   1.393
  169    HA   THR  45           HA       THR  45  -3.818   1.517   0.731
  170    HB   THR  45           HB       THR  45  -3.034   1.239  -1.679
  171    HG1  THR  45           HG1      THR  45  -0.624   0.485  -1.411
  172   HG21  THR  45          HG21      THR  45  -2.429   3.185  -0.379
  173   HG22  THR  45          HG22      THR  45  -1.028   2.652  -1.309
  174   HG23  THR  45          HG23      THR  45  -1.132   2.294   0.415
  175    H    THR  46           HN       THR  46  -3.240  -1.887   0.592
  176    HA   THR  46           HA       THR  46  -5.045  -2.647  -1.403
  177    HB   THR  46           HB       THR  46  -4.412  -4.174   1.131
  178    HG1  THR  46           HG1      THR  46  -3.085  -5.142  -0.919
  179   HG21  THR  46          HG21      THR  46  -6.378  -5.018  -0.107
  180   HG22  THR  46          HG22      THR  46  -5.025  -6.150  -0.149
  181   HG23  THR  46          HG23      THR  46  -5.383  -5.152  -1.558
  182    H    LEU  47           HN       LEU  47  -5.609  -2.625   2.127
  183    HA   LEU  47           HA       LEU  47  -8.449  -2.910   1.761
  184    HB2  LEU  47           HB2      LEU  47  -6.696  -2.531   4.173
  185    HB3  LEU  47           HB1      LEU  47  -8.443  -2.526   4.294
  186    HG   LEU  47           HG       LEU  47  -7.589  -4.702   4.894
  187   HD11  LEU  47          HD11      LEU  47  -9.729  -4.634   3.739
  188   HD12  LEU  47          HD12      LEU  47  -8.840  -6.101   3.330
  189   HD13  LEU  47          HD13      LEU  47  -8.907  -4.762   2.184
  190   HD21  LEU  47          HD21      LEU  47  -5.478  -4.597   3.655
  191   HD22  LEU  47          HD22      LEU  47  -6.361  -4.794   2.142
  192   HD23  LEU  47          HD23      LEU  47  -6.354  -6.094   3.333
  193    H    PHE  48           HN       PHE  48  -6.266  -0.320   2.789
  194    HA   PHE  48           HA       PHE  48  -8.128   1.579   3.561
  195    HB2  PHE  48           HB2      PHE  48  -5.679   1.792   3.862
  196    HB3  PHE  48           HB1      PHE  48  -5.507   2.087   2.136
  197    HD1  PHE  48           HD1      PHE  48  -6.023   4.213   1.186
  198    HD2  PHE  48           HD2      PHE  48  -6.763   3.453   5.307
  199    HE1  PHE  48           HE1      PHE  48  -6.368   6.620   1.565
  200    HE2  PHE  48           HE2      PHE  48  -7.110   5.858   5.693
  201    HZ   PHE  48           HZ       PHE  48  -6.890   7.448   3.823
  202    H    CYS  49           HN       CYS  49  -7.234   0.546   0.349
  203    HA   CYS  49           HA       CYS  49  -8.488   2.795  -0.957
  204    HB2  CYS  49           HB2      CYS  49  -6.577   1.704  -2.011
  205    HB3  CYS  49           HB1      CYS  49  -7.456   0.181  -2.074
  206    HG   CYS  49           HG       CYS  49  -7.549   0.967  -4.645
  207    H    LEU  50           HN       LEU  50  -9.222  -0.662  -0.576
  208    HA   LEU  50           HA       LEU  50 -11.601  -0.721  -2.026
  209    HB2  LEU  50           HB2      LEU  50 -10.915  -2.358   0.420
  210    HB3  LEU  50           HB1      LEU  50 -12.112  -2.766  -0.808
  211    HG   LEU  50           HG       LEU  50  -9.186  -2.456  -1.456
  212   HD11  LEU  50          HD11      LEU  50  -8.942  -4.847  -1.278
  213   HD12  LEU  50          HD12      LEU  50 -10.628  -5.015  -0.786
  214   HD13  LEU  50          HD13      LEU  50  -9.479  -4.196   0.272
  215   HD21  LEU  50          HD21      LEU  50 -10.745  -2.319  -3.328
  216   HD22  LEU  50          HD22      LEU  50 -11.448  -3.867  -2.859
  217   HD23  LEU  50          HD23      LEU  50  -9.774  -3.789  -3.407
  218    H    LEU  51           HN       LEU  51 -10.947   0.446   1.187
  219    HA   LEU  51           HA       LEU  51 -13.710   0.511   1.998
  220    HB2  LEU  51           HB2      LEU  51 -11.262   1.787   3.219
  221    HB3  LEU  51           HB1      LEU  51 -12.850   1.748   3.960
  222    HG   LEU  51           HG       LEU  51 -11.240  -0.714   3.286
  223   HD11  LEU  51          HD11      LEU  51 -11.592   0.694   5.929
  224   HD12  LEU  51          HD12      LEU  51 -10.103   0.609   4.985
  225   HD13  LEU  51          HD13      LEU  51 -10.790  -0.859   5.683
  226   HD21  LEU  51          HD21      LEU  51 -12.849  -1.838   4.752
  227   HD22  LEU  51          HD22      LEU  51 -13.643  -1.097   3.362
  228   HD23  LEU  51          HD23      LEU  51 -13.730  -0.322   4.944
  229    H    HIS  52           HN       HIS  52 -11.487   2.668   0.423
  230    HA   HIS  52           HA       HIS  52 -13.067   5.030   0.904
  231    HB2  HIS  52           HB2      HIS  52 -10.605   5.127   0.650
  232    HB3  HIS  52           HB1      HIS  52 -10.774   4.610  -1.023
  233    HD1  HIS  52           HD1      HIS  52 -10.861   6.451  -2.671
  234    HD2  HIS  52           HD2      HIS  52 -12.060   7.701   1.106
  235    HE1  HIS  52           HE1      HIS  52 -11.271   8.924  -2.879
  236    HE2  HIS  52           HE2      HIS  52 -12.054   9.647  -0.597
  237    H    PHE  53           HN       PHE  53 -12.295   3.078  -1.984
  238    HA   PHE  53           HA       PHE  53 -14.070   4.500  -3.679
  239    HB2  PHE  53           HB2      PHE  53 -12.556   1.927  -3.902
  240    HB3  PHE  53           HB1      PHE  53 -13.784   2.321  -5.101
  241    HD1  PHE  53           HD1      PHE  53 -13.481   4.159  -6.638
  242    HD2  PHE  53           HD2      PHE  53 -10.500   3.191  -3.759
  243    HE1  PHE  53           HE1      PHE  53 -11.859   5.548  -7.857
  244    HE2  PHE  53           HE2      PHE  53  -8.872   4.580  -4.973
  245    HZ   PHE  53           HZ       PHE  53  -9.551   5.762  -7.024
  246    H    GLY  54           HN       GLY  54 -14.510   1.870  -1.463
  247    HA2  GLY  54           HA2      GLY  54 -16.447   0.853  -0.739
  248    HA3  GLY  54           HA1      GLY  54 -17.346   2.017  -1.701
  249    H    VAL  55           HN       VAL  55 -14.907  -0.023  -3.101
  250    HA   VAL  55           HA       VAL  55 -16.122  -0.909  -5.293
  251    HB   VAL  55           HB       VAL  55 -13.886  -1.568  -4.908
  252   HG11  VAL  55          HG11      VAL  55 -14.827  -3.334  -2.666
  253   HG12  VAL  55          HG12      VAL  55 -14.086  -1.752  -2.450
  254   HG13  VAL  55          HG13      VAL  55 -13.164  -3.067  -3.181
  255   HG21  VAL  55          HG21      VAL  55 -15.143  -3.085  -6.348
  256   HG22  VAL  55          HG22      VAL  55 -15.585  -4.061  -4.946
  257   HG23  VAL  55          HG23      VAL  55 -13.898  -3.953  -5.448
  258    H    ILE  56           HN       ILE  56 -16.579  -2.448  -2.132
  259    HA   ILE  56           HA       ILE  56 -19.147  -3.450  -3.063
  260    HB   ILE  56           HB       ILE  56 -18.378  -5.660  -1.706
  261   HG12  ILE  56          HG12      ILE  56 -16.173  -6.346  -2.681
  262   HG13  ILE  56          HG11      ILE  56 -15.950  -4.691  -3.231
  263   HG21  ILE  56          HG21      ILE  56 -19.564  -5.611  -3.819
  264   HG22  ILE  56          HG22      ILE  56 -18.213  -6.741  -3.902
  265   HG23  ILE  56          HG23      ILE  56 -18.083  -5.156  -4.663
  266   HD11  ILE  56          HD11      ILE  56 -16.236  -5.557  -0.364
  267   HD12  ILE  56          HD12      ILE  56 -15.959  -3.910  -0.936
  268   HD13  ILE  56          HD13      ILE  56 -14.725  -5.147  -1.178
  269    H    GLY  57           HN       GLY  57 -20.173  -2.098  -1.644
  270    HA2  GLY  57           HA2      GLY  57 -20.973  -2.952   0.793
  271    HA3  GLY  57           HA1      GLY  57 -19.487  -2.091   1.164
  272    HA   PRO  58           HA       PRO  58 -22.393   1.343  -0.413
  273    HB2  PRO  58           HB2      PRO  58 -24.771   0.777  -1.502
  274    HB3  PRO  58           HB1      PRO  58 -23.277   0.646  -2.439
  275    HG2  PRO  58           HG2      PRO  58 -24.886  -1.509  -1.127
  276    HG3  PRO  58           HG1      PRO  58 -24.115  -1.502  -2.723
  277    HD2  PRO  58           HD2      PRO  58 -23.039  -2.692  -0.488
  278    HD3  PRO  58           HD1      PRO  58 -22.089  -2.126  -1.874
  279    H    GLN  59           HN       GLN  59 -22.386   1.150   2.044
  280    HA   GLN  59           HA       GLN  59 -24.650   0.241   3.442
  281    HB2  GLN  59           HB2      GLN  59 -22.393   0.726   4.435
  282    HB3  GLN  59           HB1      GLN  59 -22.770   2.438   4.306
  283    HG2  GLN  59           HG2      GLN  59 -24.565   0.567   5.802
  284    HG3  GLN  59           HG1      GLN  59 -23.130   1.262   6.554
  285   HE21  GLN  59          HE21      GLN  59 -25.990   1.617   7.143
  286   HE22  GLN  59          HE22      GLN  59 -26.274   3.319   7.064
  287    H    ARG  60           HN       ARG  60 -24.004   3.143   1.716
  288    HA   ARG  60           HA       ARG  60 -26.179   4.631   2.898
  289    HB2  ARG  60           HB2      ARG  60 -24.293   5.191   0.614
  290    HB3  ARG  60           HB1      ARG  60 -25.638   6.256   0.993
  291    HG2  ARG  60           HG2      ARG  60 -23.748   7.190   2.034
  292    HG3  ARG  60           HG1      ARG  60 -24.688   6.436   3.321
  293    HD2  ARG  60           HD2      ARG  60 -22.325   5.956   3.600
  294    HD3  ARG  60           HD1      ARG  60 -23.213   4.478   3.237
  295    HE   ARG  60           HE       ARG  60 -22.239   5.562   0.841
  296   HH11  ARG  60          HH11      ARG  60 -21.077   4.040   3.752
  297   HH12  ARG  60          HH12      ARG  60 -19.676   3.363   2.991
  298   HH21  ARG  60          HH21      ARG  60 -20.397   4.674  -0.167
  299   HH22  ARG  60          HH22      ARG  60 -19.291   3.721   0.765
  Start of MODEL   15
    1    H1   ARG  28           HT1      ARG  28  20.183   9.269  -3.350
    2    H2   ARG  28           HT2      ARG  28  19.196   7.896  -3.312
    3    H3   ARG  28           HT3      ARG  28  20.719   7.862  -2.578
    4    HA   ARG  28           HA       ARG  28  20.032   9.489  -0.959
    5    HB2  ARG  28           HB2      ARG  28  18.399  10.624  -2.448
    6    HB3  ARG  28           HB1      ARG  28  17.319   9.247  -2.279
    7    HG2  ARG  28           HG2      ARG  28  16.607  11.037  -0.831
    8    HG3  ARG  28           HG1      ARG  28  17.180   9.678   0.139
    9    HD2  ARG  28           HD2      ARG  28  19.269  10.785   0.558
   10    HD3  ARG  28           HD1      ARG  28  18.857  12.083  -0.562
   11    HE   ARG  28           HE       ARG  28  16.980  12.563   1.068
   12   HH11  ARG  28          HH11      ARG  28  20.000  11.120   2.047
   13   HH12  ARG  28          HH12      ARG  28  19.920  11.743   3.661
   14   HH21  ARG  28          HH21      ARG  28  16.873  13.391   3.190
   15   HH22  ARG  28          HH22      ARG  28  18.145  13.034   4.310
   16    H    ARG  29           HN       ARG  29  17.845   6.959  -2.180
   17    HA   ARG  29           HA       ARG  29  17.788   5.795   0.521
   18    HB2  ARG  29           HB2      ARG  29  15.912   5.325  -1.805
   19    HB3  ARG  29           HB1      ARG  29  15.756   4.623  -0.200
   20    HG2  ARG  29           HG2      ARG  29  15.431   6.838   0.754
   21    HG3  ARG  29           HG1      ARG  29  15.618   7.561  -0.845
   22    HD2  ARG  29           HD2      ARG  29  13.656   6.296  -1.622
   23    HD3  ARG  29           HD1      ARG  29  13.458   5.634   0.001
   24    HE   ARG  29           HE       ARG  29  13.464   8.358   0.327
   25   HH11  ARG  29          HH11      ARG  29  11.570   6.062  -1.485
   26   HH12  ARG  29          HH12      ARG  29  10.125   7.013  -1.426
   27   HH21  ARG  29          HH21      ARG  29  11.568   9.619   0.407
   28   HH22  ARG  29          HH22      ARG  29  10.123   9.035  -0.351
   29    H    CYS  30           HN       CYS  30  18.236   3.619   0.839
   30    HA   CYS  30           HA       CYS  30  20.049   2.463  -1.074
   31    HB2  CYS  30           HB2      CYS  30  20.438   2.356   1.383
   32    HB3  CYS  30           HB1      CYS  30  19.037   1.299   1.526
   33    HG   CYS  30           HG       CYS  30  21.600   0.402  -0.522
   34    H    LEU  31           HN       LEU  31  19.857   0.097  -1.630
   35    HA   LEU  31           HA       LEU  31  17.625  -0.380  -3.193
   36    HB2  LEU  31           HB2      LEU  31  19.507  -2.391  -1.957
   37    HB3  LEU  31           HB1      LEU  31  18.385  -2.742  -3.256
   38    HG   LEU  31           HG       LEU  31  20.638  -0.742  -3.453
   39   HD11  LEU  31          HD11      LEU  31  21.533  -2.978  -3.186
   40   HD12  LEU  31          HD12      LEU  31  21.745  -2.430  -4.849
   41   HD13  LEU  31          HD13      LEU  31  20.467  -3.580  -4.454
   42   HD21  LEU  31          HD21      LEU  31  20.170  -0.835  -5.851
   43   HD22  LEU  31          HD22      LEU  31  18.763  -0.277  -4.946
   44   HD23  LEU  31          HD23      LEU  31  18.823  -1.933  -5.549
   45    H    PHE  32           HN       PHE  32  18.384  -1.933  -0.070
   46    HA   PHE  32           HA       PHE  32  15.850  -3.184   0.165
   47    HB2  PHE  32           HB2      PHE  32  17.866  -2.556   2.332
   48    HB3  PHE  32           HB1      PHE  32  16.537  -3.705   2.457
   49    HD1  PHE  32           HD1      PHE  32  16.625  -5.841   1.313
   50    HD2  PHE  32           HD2      PHE  32  19.851  -3.076   1.070
   51    HE1  PHE  32           HE1      PHE  32  18.082  -7.623   0.444
   52    HE2  PHE  32           HE2      PHE  32  21.314  -4.852   0.200
   53    HZ   PHE  32           HZ       PHE  32  20.428  -7.128  -0.118
   54    H    LEU  33           HN       LEU  33  17.054  -0.043   0.985
   55    HA   LEU  33           HA       LEU  33  15.176   0.691   2.942
   56    HB2  LEU  33           HB2      LEU  33  17.256   1.942   1.416
   57    HB3  LEU  33           HB1      LEU  33  15.847   2.983   1.434
   58    HG   LEU  33           HG       LEU  33  15.836   2.773   3.941
   59   HD11  LEU  33          HD11      LEU  33  17.133   0.725   4.133
   60   HD12  LEU  33          HD12      LEU  33  17.903   2.040   5.021
   61   HD13  LEU  33          HD13      LEU  33  18.543   1.541   3.456
   62   HD21  LEU  33          HD21      LEU  33  18.296   3.966   2.671
   63   HD22  LEU  33          HD22      LEU  33  17.650   4.375   4.260
   64   HD23  LEU  33          HD23      LEU  33  16.719   4.744   2.808
   65    H    SER  34           HN       SER  34  15.159   1.149  -0.585
   66    HA   SER  34           HA       SER  34  12.615   2.437  -0.617
   67    HB2  SER  34           HB2      SER  34  12.750   2.148  -3.070
   68    HB3  SER  34           HB1      SER  34  14.239   2.819  -2.405
   69    HG   SER  34           HG       SER  34  14.593   0.255  -2.337
   70    H    LEU  35           HN       LEU  35  13.708  -0.881  -0.942
   71    HA   LEU  35           HA       LEU  35  11.230  -1.926  -1.880
   72    HB2  LEU  35           HB2      LEU  35  13.429  -3.040  -2.181
   73    HB3  LEU  35           HB1      LEU  35  13.459  -3.372  -0.459
   74    HG   LEU  35           HG       LEU  35  11.419  -4.751  -0.709
   75   HD11  LEU  35          HD11      LEU  35  10.454  -3.680  -2.661
   76   HD12  LEU  35          HD12      LEU  35  10.695  -5.401  -2.962
   77   HD13  LEU  35          HD13      LEU  35  11.809  -4.220  -3.652
   78   HD21  LEU  35          HD21      LEU  35  13.718  -5.513  -2.502
   79   HD22  LEU  35          HD22      LEU  35  12.504  -6.620  -1.861
   80   HD23  LEU  35          HD23      LEU  35  13.612  -5.794  -0.765
   81    H    PHE  36           HN       PHE  36  12.345  -0.911   1.173
   82    HA   PHE  36           HA       PHE  36  10.658  -2.620   2.750
   83    HB2  PHE  36           HB2      PHE  36  12.766  -1.679   3.636
   84    HB3  PHE  36           HB1      PHE  36  12.081  -0.062   3.519
   85    HD1  PHE  36           HD1      PHE  36  11.713  -3.332   5.205
   86    HD2  PHE  36           HD2      PHE  36  10.731   0.808   5.226
   87    HE1  PHE  36           HE1      PHE  36  10.786  -3.568   7.473
   88    HE2  PHE  36           HE2      PHE  36   9.805   0.581   7.494
   89    HZ   PHE  36           HZ       PHE  36   9.821  -1.610   8.616
   90    H    SER  37           HN       SER  37  10.243   0.296   1.004
   91    HA   SER  37           HA       SER  37   7.928   1.137   2.554
   92    HB2  SER  37           HB2      SER  37   9.377   2.901   1.767
   93    HB3  SER  37           HB1      SER  37   9.249   2.324   0.107
   94    HG   SER  37           HG       SER  37   7.427   3.757   1.649
   95    H    PHE  38           HN       PHE  38   8.679  -0.383  -0.514
   96    HA   PHE  38           HA       PHE  38   6.165  -0.115  -1.745
   97    HB2  PHE  38           HB2      PHE  38   8.126  -2.382  -2.060
   98    HB3  PHE  38           HB1      PHE  38   6.854  -1.939  -3.193
   99    HD1  PHE  38           HD1      PHE  38   7.272   1.080  -2.990
  100    HD2  PHE  38           HD2      PHE  38   9.973  -2.160  -3.555
  101    HE1  PHE  38           HE1      PHE  38   8.824   2.583  -4.163
  102    HE2  PHE  38           HE2      PHE  38  11.529  -0.662  -4.731
  103    HZ   PHE  38           HZ       PHE  38  10.965   1.693  -5.049
  104    H    LEU  39           HN       LEU  39   7.522  -3.069  -0.335
  105    HA   LEU  39           HA       LEU  39   5.318  -4.658  -0.346
  106    HB2  LEU  39           HB2      LEU  39   7.678  -5.206   0.377
  107    HB3  LEU  39           HB1      LEU  39   7.239  -4.587   1.959
  108    HG   LEU  39           HG       LEU  39   5.334  -6.270   1.920
  109   HD11  LEU  39          HD11      LEU  39   5.381  -6.778  -0.456
  110   HD12  LEU  39          HD12      LEU  39   5.674  -8.232   0.499
  111   HD13  LEU  39          HD13      LEU  39   7.017  -7.416  -0.300
  112   HD21  LEU  39          HD21      LEU  39   7.273  -6.530   3.337
  113   HD22  LEU  39          HD22      LEU  39   8.195  -7.207   1.996
  114   HD23  LEU  39          HD23      LEU  39   6.822  -8.094   2.658
  115    H    ILE  40           HN       ILE  40   6.069  -2.147   2.021
  116    HA   ILE  40           HA       ILE  40   3.851  -2.861   3.720
  117    HB   ILE  40           HB       ILE  40   5.597  -0.396   3.758
  118   HG12  ILE  40          HG12      ILE  40   5.700  -2.925   5.424
  119   HG13  ILE  40          HG11      ILE  40   6.832  -2.500   4.144
  120   HG21  ILE  40          HG21      ILE  40   3.652  -1.456   5.808
  121   HG22  ILE  40          HG22      ILE  40   3.459   0.006   4.841
  122   HG23  ILE  40          HG23      ILE  40   4.744  -0.091   6.044
  123   HD11  ILE  40          HD11      ILE  40   7.558  -0.558   5.437
  124   HD12  ILE  40          HD12      ILE  40   7.780  -2.063   6.329
  125   HD13  ILE  40          HD13      ILE  40   6.431  -0.997   6.721
  126    H    VAL  41           HN       VAL  41   4.543  -0.345   1.332
  127    HA   VAL  41           HA       VAL  41   2.122   1.088   1.761
  128    HB   VAL  41           HB       VAL  41   4.289   1.943   0.667
  129   HG11  VAL  41          HG11      VAL  41   2.950   0.786  -1.765
  130   HG12  VAL  41          HG12      VAL  41   4.443   0.206  -1.034
  131   HG13  VAL  41          HG13      VAL  41   4.383   1.815  -1.747
  132   HG21  VAL  41          HG21      VAL  41   3.048   3.600  -0.643
  133   HG22  VAL  41          HG22      VAL  41   2.274   3.289   0.911
  134   HG23  VAL  41          HG23      VAL  41   1.610   2.584  -0.563
  135    H    LEU  42           HN       LEU  42   2.881  -1.784   0.083
  136    HA   LEU  42           HA       LEU  42   0.668  -1.613  -1.772
  137    HB2  LEU  42           HB2      LEU  42   2.625  -3.812  -1.112
  138    HB3  LEU  42           HB1      LEU  42   1.314  -4.010  -2.271
  139    HG   LEU  42           HG       LEU  42   3.537  -1.974  -2.509
  140   HD11  LEU  42          HD11      LEU  42   3.129  -4.595  -3.942
  141   HD12  LEU  42          HD12      LEU  42   4.385  -4.241  -2.756
  142   HD13  LEU  42          HD13      LEU  42   4.376  -3.401  -4.307
  143   HD21  LEU  42          HD21      LEU  42   2.687  -1.694  -4.794
  144   HD22  LEU  42          HD22      LEU  42   1.483  -1.248  -3.586
  145   HD23  LEU  42          HD23      LEU  42   1.357  -2.793  -4.426
  146    H    LEU  43           HN       LEU  43   1.490  -3.506   1.125
  147    HA   LEU  43           HA       LEU  43  -0.865  -5.014   1.248
  148    HB2  LEU  43           HB2      LEU  43   1.303  -5.269   2.591
  149    HB3  LEU  43           HB1      LEU  43   0.660  -4.039   3.657
  150    HG   LEU  43           HG       LEU  43   0.373  -6.418   4.430
  151   HD11  LEU  43          HD11      LEU  43  -1.787  -6.060   5.358
  152   HD12  LEU  43          HD12      LEU  43  -2.224  -4.946   4.065
  153   HD13  LEU  43          HD13      LEU  43  -0.991  -4.491   5.241
  154   HD21  LEU  43          HD21      LEU  43  -0.166  -7.407   2.259
  155   HD22  LEU  43          HD22      LEU  43  -1.678  -6.501   2.221
  156   HD23  LEU  43          HD23      LEU  43  -1.421  -7.737   3.453
  157    H    LEU  44           HN       LEU  44  -0.093  -1.805   2.486
  158    HA   LEU  44           HA       LEU  44  -2.503  -1.448   3.941
  159    HB2  LEU  44           HB2      LEU  44  -0.526   0.542   2.836
  160    HB3  LEU  44           HB1      LEU  44  -1.869   0.974   3.876
  161    HG   LEU  44           HG       LEU  44   0.382  -0.882   4.652
  162   HD11  LEU  44          HD11      LEU  44   1.177   1.394   4.372
  163   HD12  LEU  44          HD12      LEU  44   1.118   0.968   6.082
  164   HD13  LEU  44          HD13      LEU  44  -0.135   1.996   5.385
  165   HD21  LEU  44          HD21      LEU  44  -1.691  -1.388   5.817
  166   HD22  LEU  44          HD22      LEU  44  -1.875   0.309   6.263
  167   HD23  LEU  44          HD23      LEU  44  -0.535  -0.635   6.915
  168    H    THR  45           HN       THR  45  -1.466  -0.341   0.718
  169    HA   THR  45           HA       THR  45  -3.718   1.133   0.044
  170    HB   THR  45           HB       THR  45  -3.136   0.454  -2.371
  171    HG1  THR  45           HG1      THR  45  -0.739  -0.307  -2.164
  172   HG21  THR  45          HG21      THR  45  -1.076   1.764  -0.594
  173   HG22  THR  45          HG22      THR  45  -2.427   2.560  -1.401
  174   HG23  THR  45          HG23      THR  45  -1.112   1.871  -2.355
  175    H    THR  46           HN       THR  46  -3.385  -2.297   0.306
  176    HA   THR  46           HA       THR  46  -5.398  -3.135  -1.462
  177    HB   THR  46           HB       THR  46  -4.597  -4.432   1.151
  178    HG1  THR  46           HG1      THR  46  -3.515  -4.475  -1.456
  179   HG21  THR  46          HG21      THR  46  -5.890  -5.652  -1.290
  180   HG22  THR  46          HG22      THR  46  -6.752  -5.227   0.188
  181   HG23  THR  46          HG23      THR  46  -5.500  -6.470   0.224
  182    H    LEU  47           HN       LEU  47  -5.633  -2.737   2.084
  183    HA   LEU  47           HA       LEU  47  -8.514  -2.830   1.969
  184    HB2  LEU  47           HB2      LEU  47  -6.560  -2.392   4.221
  185    HB3  LEU  47           HB1      LEU  47  -8.295  -2.334   4.451
  186    HG   LEU  47           HG       LEU  47  -7.487  -4.489   5.141
  187   HD11  LEU  47          HD11      LEU  47  -9.661  -4.415   4.010
  188   HD12  LEU  47          HD12      LEU  47  -8.834  -5.953   3.762
  189   HD13  LEU  47          HD13      LEU  47  -8.864  -4.750   2.473
  190   HD21  LEU  47          HD21      LEU  47  -6.330  -6.009   3.641
  191   HD22  LEU  47          HD22      LEU  47  -5.412  -4.515   3.837
  192   HD23  LEU  47          HD23      LEU  47  -6.346  -4.790   2.366
  193    H    PHE  48           HN       PHE  48  -6.030  -0.402   2.213
  194    HA   PHE  48           HA       PHE  48  -7.563   1.753   3.141
  195    HB2  PHE  48           HB2      PHE  48  -5.142   1.861   3.100
  196    HB3  PHE  48           HB1      PHE  48  -5.127   1.719   1.346
  197    HD1  PHE  48           HD1      PHE  48  -5.398   3.611  -0.034
  198    HD2  PHE  48           HD2      PHE  48  -6.052   3.924   4.159
  199    HE1  PHE  48           HE1      PHE  48  -5.467   6.064  -0.231
  200    HE2  PHE  48           HE2      PHE  48  -6.125   6.376   3.970
  201    HZ   PHE  48           HZ       PHE  48  -5.832   7.448   1.772
  202    H    CYS  49           HN       CYS  49  -7.062   0.482  -0.110
  203    HA   CYS  49           HA       CYS  49  -8.428   2.632  -1.409
  204    HB2  CYS  49           HB2      CYS  49  -6.740   1.293  -2.586
  205    HB3  CYS  49           HB1      CYS  49  -7.753  -0.138  -2.423
  206    HG   CYS  49           HG       CYS  49  -7.806   2.212  -4.739
  207    H    LEU  50           HN       LEU  50  -9.333  -0.553  -0.227
  208    HA   LEU  50           HA       LEU  50 -11.898  -0.655  -1.415
  209    HB2  LEU  50           HB2      LEU  50 -10.928  -1.963   1.133
  210    HB3  LEU  50           HB1      LEU  50 -12.375  -2.409   0.236
  211    HG   LEU  50           HG       LEU  50  -9.640  -2.546  -1.012
  212   HD11  LEU  50          HD11      LEU  50  -9.401  -4.799  -0.352
  213   HD12  LEU  50          HD12      LEU  50 -11.038  -4.859   0.305
  214   HD13  LEU  50          HD13      LEU  50  -9.795  -3.904   1.116
  215   HD21  LEU  50          HD21      LEU  50 -12.248  -3.933  -1.611
  216   HD22  LEU  50          HD22      LEU  50 -10.735  -4.149  -2.491
  217   HD23  LEU  50          HD23      LEU  50 -11.557  -2.589  -2.518
  218    H    LEU  51           HN       LEU  51 -10.671   0.739   1.548
  219    HA   LEU  51           HA       LEU  51 -13.277   1.362   2.604
  220    HB2  LEU  51           HB2      LEU  51 -10.515   2.278   3.410
  221    HB3  LEU  51           HB1      LEU  51 -11.982   2.646   4.299
  222    HG   LEU  51           HG       LEU  51 -10.919  -0.141   3.829
  223   HD11  LEU  51          HD11      LEU  51 -10.791   1.601   6.286
  224   HD12  LEU  51          HD12      LEU  51  -9.427   1.128   5.272
  225   HD13  LEU  51          HD13      LEU  51 -10.304  -0.092   6.196
  226   HD21  LEU  51          HD21      LEU  51 -13.142   0.873   5.598
  227   HD22  LEU  51          HD22      LEU  51 -12.567  -0.792   5.510
  228   HD23  LEU  51          HD23      LEU  51 -13.342  -0.052   4.109
  229    H    HIS  52           HN       HIS  52 -10.770   2.996   0.781
  230    HA   HIS  52           HA       HIS  52 -11.950   5.599   0.995
  231    HB2  HIS  52           HB2      HIS  52  -9.547   5.356   0.652
  232    HB3  HIS  52           HB1      HIS  52  -9.826   4.528  -0.875
  233    HD1  HIS  52           HD1      HIS  52  -9.824   7.921   0.687
  234    HD2  HIS  52           HD2      HIS  52 -10.493   6.191  -3.033
  235    HE1  HIS  52           HE1      HIS  52  -9.853   9.831  -0.948
  236    HE2  HIS  52           HE2      HIS  52 -10.140   8.747  -3.204
  237    H    PHE  53           HN       PHE  53 -12.274   2.883  -1.149
  238    HA   PHE  53           HA       PHE  53 -13.651   4.447  -3.176
  239    HB2  PHE  53           HB2      PHE  53 -12.120   2.584  -3.805
  240    HB3  PHE  53           HB1      PHE  53 -13.228   1.455  -3.035
  241    HD1  PHE  53           HD1      PHE  53 -15.234   0.763  -4.112
  242    HD2  PHE  53           HD2      PHE  53 -12.794   3.790  -5.845
  243    HE1  PHE  53           HE1      PHE  53 -16.501   0.577  -6.212
  244    HE2  PHE  53           HE2      PHE  53 -14.058   3.610  -7.948
  245    HZ   PHE  53           HZ       PHE  53 -15.914   2.002  -8.134
  246    H    GLY  54           HN       GLY  54 -14.369   2.399  -0.471
  247    HA2  GLY  54           HA2      GLY  54 -16.384   2.124   0.634
  248    HA3  GLY  54           HA1      GLY  54 -17.142   3.152  -0.572
  249    H    VAL  55           HN       VAL  55 -15.303   0.339  -1.489
  250    HA   VAL  55           HA       VAL  55 -17.169  -0.757  -3.163
  251    HB   VAL  55           HB       VAL  55 -14.944  -1.575  -3.250
  252   HG11  VAL  55          HG11      VAL  55 -15.356  -2.416  -0.406
  253   HG12  VAL  55          HG12      VAL  55 -14.160  -1.298  -1.050
  254   HG13  VAL  55          HG13      VAL  55 -14.035  -3.021  -1.400
  255   HG21  VAL  55          HG21      VAL  55 -16.698  -3.813  -2.249
  256   HG22  VAL  55          HG22      VAL  55 -15.246  -3.990  -3.236
  257   HG23  VAL  55          HG23      VAL  55 -16.671  -3.187  -3.897
  258    H    ILE  56           HN       ILE  56 -16.801  -1.331   0.288
  259    HA   ILE  56           HA       ILE  56 -19.537  -2.315   0.394
  260    HB   ILE  56           HB       ILE  56 -18.461  -4.113   2.087
  261   HG12  ILE  56          HG12      ILE  56 -16.598  -5.243   0.861
  262   HG13  ILE  56          HG11      ILE  56 -16.514  -3.851  -0.212
  263   HG21  ILE  56          HG21      ILE  56 -18.909  -5.787   0.357
  264   HG22  ILE  56          HG22      ILE  56 -18.943  -4.513  -0.862
  265   HG23  ILE  56          HG23      ILE  56 -20.166  -4.550   0.409
  266   HD11  ILE  56          HD11      ILE  56 -16.051  -3.790   2.761
  267   HD12  ILE  56          HD12      ILE  56 -15.911  -2.426   1.652
  268   HD13  ILE  56          HD13      ILE  56 -14.798  -3.786   1.518
  269    H    GLY  57           HN       GLY  57 -17.420  -0.231   1.516
  270    HA2  GLY  57           HA2      GLY  57 -18.877   0.412   3.841
  271    HA3  GLY  57           HA1      GLY  57 -17.412  -0.442   4.303
  272    HA   PRO  58           HA       PRO  58 -16.143   3.758   2.098
  273    HB2  PRO  58           HB2      PRO  58 -18.526   5.367   2.795
  274    HB3  PRO  58           HB1      PRO  58 -17.601   5.321   1.291
  275    HG2  PRO  58           HG2      PRO  58 -20.038   4.232   1.455
  276    HG3  PRO  58           HG1      PRO  58 -18.758   3.492   0.478
  277    HD2  PRO  58           HD2      PRO  58 -19.770   2.712   3.185
  278    HD3  PRO  58           HD1      PRO  58 -19.292   1.681   1.819
  279    H    GLN  59           HN       GLN  59 -14.809   3.556   3.952
  280    HA   GLN  59           HA       GLN  59 -15.658   4.534   6.509
  281    HB2  GLN  59           HB2      GLN  59 -13.921   2.739   6.117
  282    HB3  GLN  59           HB1      GLN  59 -12.828   4.015   5.600
  283    HG2  GLN  59           HG2      GLN  59 -12.405   3.418   7.901
  284    HG3  GLN  59           HG1      GLN  59 -13.019   5.068   7.798
  285   HE21  GLN  59          HE21      GLN  59 -13.708   1.800   8.769
  286   HE22  GLN  59          HE22      GLN  59 -15.098   2.163   9.729
  287    H    ARG  60           HN       ARG  60 -14.708   6.042   3.686
  288    HA   ARG  60           HA       ARG  60 -13.882   8.457   5.160
  289    HB2  ARG  60           HB2      ARG  60 -12.059   7.480   3.792
  290    HB3  ARG  60           HB1      ARG  60 -13.063   7.660   2.361
  291    HG2  ARG  60           HG2      ARG  60 -13.056  10.074   2.634
  292    HG3  ARG  60           HG1      ARG  60 -12.095   9.915   4.107
  293    HD2  ARG  60           HD2      ARG  60 -10.312   8.838   2.775
  294    HD3  ARG  60           HD1      ARG  60 -11.264   9.116   1.319
  295    HE   ARG  60           HE       ARG  60 -11.043  11.590   2.367
  296   HH11  ARG  60          HH11      ARG  60  -8.712   9.096   1.670
  297   HH12  ARG  60          HH12      ARG  60  -7.428  10.209   1.339
  298   HH21  ARG  60          HH21      ARG  60  -9.356  13.064   1.935
  299   HH22  ARG  60          HH22      ARG  60  -7.792  12.464   1.491
  Start of MODEL   16
    1    H1   ARG  28           HT1      ARG  28  26.045   4.354  -7.836
    2    H2   ARG  28           HT2      ARG  28  24.618   5.113  -8.333
    3    H3   ARG  28           HT3      ARG  28  24.799   3.443  -8.530
    4    HA   ARG  28           HA       ARG  28  24.806   3.091  -6.178
    5    HB2  ARG  28           HB2      ARG  28  24.364   6.075  -5.950
    6    HB3  ARG  28           HB1      ARG  28  24.471   4.926  -4.622
    7    HG2  ARG  28           HG2      ARG  28  26.706   5.577  -6.534
    8    HG3  ARG  28           HG1      ARG  28  26.522   6.245  -4.911
    9    HD2  ARG  28           HD2      ARG  28  26.854   3.323  -5.587
   10    HD3  ARG  28           HD1      ARG  28  28.116   4.382  -4.958
   11    HE   ARG  28           HE       ARG  28  25.992   4.500  -3.177
   12   HH11  ARG  28          HH11      ARG  28  28.224   2.114  -4.386
   13   HH12  ARG  28          HH12      ARG  28  28.214   1.178  -2.928
   14   HH21  ARG  28          HH21      ARG  28  25.974   3.275  -1.252
   15   HH22  ARG  28          HH22      ARG  28  26.936   1.839  -1.147
   16    H    ARG  29           HN       ARG  29  23.000   1.950  -6.837
   17    HA   ARG  29           HA       ARG  29  20.460   3.415  -6.601
   18    HB2  ARG  29           HB2      ARG  29  20.863   2.951  -8.970
   19    HB3  ARG  29           HB1      ARG  29  21.092   1.245  -8.611
   20    HG2  ARG  29           HG2      ARG  29  18.778   1.059  -7.903
   21    HG3  ARG  29           HG1      ARG  29  18.537   2.783  -8.187
   22    HD2  ARG  29           HD2      ARG  29  19.312   0.761 -10.287
   23    HD3  ARG  29           HD1      ARG  29  17.684   1.386 -10.030
   24    HE   ARG  29           HE       ARG  29  19.230   3.609 -10.398
   25   HH11  ARG  29          HH11      ARG  29  18.604   0.709 -12.227
   26   HH12  ARG  29          HH12      ARG  29  18.814   1.480 -13.764
   27   HH21  ARG  29          HH21      ARG  29  19.506   4.632 -12.416
   28   HH22  ARG  29          HH22      ARG  29  19.328   3.710 -13.871
   29    H    CYS  30           HN       CYS  30  19.195   2.626  -5.073
   30    HA   CYS  30           HA       CYS  30  19.638  -0.142  -4.162
   31    HB2  CYS  30           HB2      CYS  30  18.509   2.193  -2.605
   32    HB3  CYS  30           HB1      CYS  30  18.806   0.575  -1.977
   33    HG   CYS  30           HG       CYS  30  20.720   2.868  -1.412
   34    H    LEU  31           HN       LEU  31  18.182  -1.157  -5.519
   35    HA   LEU  31           HA       LEU  31  15.462  -0.231  -5.747
   36    HB2  LEU  31           HB2      LEU  31  16.573  -1.293  -7.644
   37    HB3  LEU  31           HB1      LEU  31  16.794  -2.762  -6.713
   38    HG   LEU  31           HG       LEU  31  14.003  -1.814  -7.038
   39   HD11  LEU  31          HD11      LEU  31  14.890  -1.416  -9.265
   40   HD12  LEU  31          HD12      LEU  31  13.829  -2.825  -9.264
   41   HD13  LEU  31          HD13      LEU  31  15.578  -3.040  -9.298
   42   HD21  LEU  31          HD21      LEU  31  15.342  -4.512  -7.214
   43   HD22  LEU  31          HD22      LEU  31  13.604  -4.219  -7.258
   44   HD23  LEU  31          HD23      LEU  31  14.523  -3.850  -5.800
   45    H    PHE  32           HN       PHE  32  17.234  -2.516  -3.822
   46    HA   PHE  32           HA       PHE  32  14.915  -3.957  -2.918
   47    HB2  PHE  32           HB2      PHE  32  17.154  -5.009  -3.029
   48    HB3  PHE  32           HB1      PHE  32  17.716  -3.907  -1.778
   49    HD1  PHE  32           HD1      PHE  32  17.129  -4.231   0.521
   50    HD2  PHE  32           HD2      PHE  32  15.568  -6.790  -2.502
   51    HE1  PHE  32           HE1      PHE  32  16.380  -5.812   2.251
   52    HE2  PHE  32           HE2      PHE  32  14.816  -8.376  -0.776
   53    HZ   PHE  32           HZ       PHE  32  15.222  -7.887   1.603
   54    H    LEU  33           HN       LEU  33  17.104  -1.540  -1.505
   55    HA   LEU  33           HA       LEU  33  15.859  -1.374   1.004
   56    HB2  LEU  33           HB2      LEU  33  17.245   0.904  -0.396
   57    HB3  LEU  33           HB1      LEU  33  17.081   0.651   1.329
   58    HG   LEU  33           HG       LEU  33  18.792  -0.949  -0.574
   59   HD11  LEU  33          HD11      LEU  33  20.640  -0.075   0.720
   60   HD12  LEU  33          HD12      LEU  33  19.524   0.804   1.765
   61   HD13  LEU  33          HD13      LEU  33  19.677   1.250   0.065
   62   HD21  LEU  33          HD21      LEU  33  19.539  -2.177   1.419
   63   HD22  LEU  33          HD22      LEU  33  17.831  -2.442   1.075
   64   HD23  LEU  33          HD23      LEU  33  18.309  -1.352   2.376
   65    H    SER  34           HN       SER  34  15.048   0.015  -2.077
   66    HA   SER  34           HA       SER  34  13.182   1.929  -0.991
   67    HB2  SER  34           HB2      SER  34  14.349   2.432  -3.086
   68    HB3  SER  34           HB1      SER  34  13.636   1.008  -3.842
   69    HG   SER  34           HG       SER  34  12.116   3.142  -2.759
   70    H    LEU  35           HN       LEU  35  13.127  -1.349  -2.092
   71    HA   LEU  35           HA       LEU  35  10.258  -1.450  -2.417
   72    HB2  LEU  35           HB2      LEU  35  11.835  -2.829  -3.768
   73    HB3  LEU  35           HB1      LEU  35  12.231  -3.725  -2.314
   74    HG   LEU  35           HG       LEU  35   9.788  -4.346  -2.152
   75   HD11  LEU  35          HD11      LEU  35   8.894  -2.576  -3.569
   76   HD12  LEU  35          HD12      LEU  35   8.459  -4.168  -4.194
   77   HD13  LEU  35          HD13      LEU  35   9.751  -3.244  -4.959
   78   HD21  LEU  35          HD21      LEU  35   9.962  -6.093  -3.851
   79   HD22  LEU  35          HD22      LEU  35  11.476  -5.896  -2.968
   80   HD23  LEU  35          HD23      LEU  35  11.311  -5.235  -4.595
   81    H    PHE  36           HN       PHE  36  12.523  -1.855   0.123
   82    HA   PHE  36           HA       PHE  36  11.112  -3.657   1.770
   83    HB2  PHE  36           HB2      PHE  36  13.510  -2.997   2.055
   84    HB3  PHE  36           HB1      PHE  36  12.961  -1.440   2.668
   85    HD1  PHE  36           HD1      PHE  36  12.418  -1.174   4.921
   86    HD2  PHE  36           HD2      PHE  36  12.794  -5.089   3.296
   87    HE1  PHE  36           HE1      PHE  36  12.266  -2.124   7.185
   88    HE2  PHE  36           HE2      PHE  36  12.640  -6.048   5.557
   89    HZ   PHE  36           HZ       PHE  36  12.375  -4.565   7.506
   90    H    SER  37           HN       SER  37  10.675  -0.297   1.087
   91    HA   SER  37           HA       SER  37   8.833   0.014   3.347
   92    HB2  SER  37           HB2      SER  37   8.839   2.430   2.702
   93    HB3  SER  37           HB1      SER  37  10.437   1.814   3.128
   94    HG   SER  37           HG       SER  37  10.591   1.441   0.728
   95    H    PHE  38           HN       PHE  38   8.958  -0.099  -0.143
   96    HA   PHE  38           HA       PHE  38   6.389   0.905  -0.701
   97    HB2  PHE  38           HB2      PHE  38   8.252   0.525  -2.364
   98    HB3  PHE  38           HB1      PHE  38   7.862  -1.191  -2.303
   99    HD1  PHE  38           HD1      PHE  38   5.850  -2.045  -3.315
  100    HD2  PHE  38           HD2      PHE  38   6.751   2.112  -3.417
  101    HE1  PHE  38           HE1      PHE  38   4.134  -1.720  -5.048
  102    HE2  PHE  38           HE2      PHE  38   5.035   2.447  -5.151
  103    HZ   PHE  38           HZ       PHE  38   3.727   0.537  -5.969
  104    H    LEU  39           HN       LEU  39   7.480  -2.161   0.473
  105    HA   LEU  39           HA       LEU  39   5.226  -3.710  -0.265
  106    HB2  LEU  39           HB2      LEU  39   7.489  -4.561   0.446
  107    HB3  LEU  39           HB1      LEU  39   7.041  -4.174   2.096
  108    HG   LEU  39           HG       LEU  39   5.246  -5.948   0.515
  109   HD11  LEU  39          HD11      LEU  39   7.477  -6.841   0.084
  110   HD12  LEU  39          HD12      LEU  39   6.561  -7.903   1.154
  111   HD13  LEU  39          HD13      LEU  39   7.811  -6.851   1.816
  112   HD21  LEU  39          HD21      LEU  39   4.918  -6.971   2.727
  113   HD22  LEU  39          HD22      LEU  39   4.567  -5.243   2.737
  114   HD23  LEU  39          HD23      LEU  39   6.084  -5.838   3.411
  115    H    ILE  40           HN       ILE  40   6.104  -2.078   2.776
  116    HA   ILE  40           HA       ILE  40   3.825  -2.801   4.232
  117    HB   ILE  40           HB       ILE  40   5.446  -0.267   4.519
  118   HG12  ILE  40          HG12      ILE  40   5.769  -2.932   5.916
  119   HG13  ILE  40          HG11      ILE  40   6.800  -2.355   4.611
  120   HG21  ILE  40          HG21      ILE  40   3.672  -1.703   6.491
  121   HG22  ILE  40          HG22      ILE  40   3.296  -0.184   5.678
  122   HG23  ILE  40          HG23      ILE  40   4.635  -0.263   6.823
  123   HD11  ILE  40          HD11      ILE  40   7.475  -0.457   6.022
  124   HD12  ILE  40          HD12      ILE  40   7.881  -2.019   6.734
  125   HD13  ILE  40          HD13      ILE  40   6.492  -1.111   7.333
  126    H    VAL  41           HN       VAL  41   4.468   0.054   2.223
  127    HA   VAL  41           HA       VAL  41   2.019   1.360   2.719
  128    HB   VAL  41           HB       VAL  41   3.770   1.556   0.264
  129   HG11  VAL  41          HG11      VAL  41   1.545   2.470  -0.113
  130   HG12  VAL  41          HG12      VAL  41   2.740   3.763  -0.023
  131   HG13  VAL  41          HG13      VAL  41   1.683   3.444   1.351
  132   HG21  VAL  41          HG21      VAL  41   4.773   3.487   1.367
  133   HG22  VAL  41          HG22      VAL  41   5.003   2.019   2.318
  134   HG23  VAL  41          HG23      VAL  41   3.777   3.195   2.793
  135    H    LEU  42           HN       LEU  42   2.983  -1.087   0.395
  136    HA   LEU  42           HA       LEU  42   0.716  -0.905  -1.276
  137    HB2  LEU  42           HB2      LEU  42   2.985  -2.108  -1.647
  138    HB3  LEU  42           HB1      LEU  42   2.229  -3.458  -0.812
  139    HG   LEU  42           HG       LEU  42   2.156  -3.649  -3.283
  140   HD11  LEU  42          HD11      LEU  42   0.482  -4.762  -1.860
  141   HD12  LEU  42          HD12      LEU  42  -0.149  -4.330  -3.449
  142   HD13  LEU  42          HD13      LEU  42  -0.573  -3.360  -2.040
  143   HD21  LEU  42          HD21      LEU  42   1.938  -1.281  -3.825
  144   HD22  LEU  42          HD22      LEU  42   0.324  -1.260  -3.117
  145   HD23  LEU  42          HD23      LEU  42   0.641  -2.224  -4.559
  146    H    LEU  43           HN       LEU  43   1.492  -3.136   1.391
  147    HA   LEU  43           HA       LEU  43  -0.871  -4.599   1.378
  148    HB2  LEU  43           HB2      LEU  43   0.869  -3.847   3.727
  149    HB3  LEU  43           HB1      LEU  43  -0.369  -5.088   3.758
  150    HG   LEU  43           HG       LEU  43   2.123  -5.141   2.053
  151   HD11  LEU  43          HD11      LEU  43   2.588  -5.463   4.424
  152   HD12  LEU  43          HD12      LEU  43   2.816  -6.962   3.523
  153   HD13  LEU  43          HD13      LEU  43   1.365  -6.732   4.500
  154   HD21  LEU  43          HD21      LEU  43  -0.061  -7.189   2.420
  155   HD22  LEU  43          HD22      LEU  43   1.445  -7.443   1.538
  156   HD23  LEU  43          HD23      LEU  43   0.269  -6.266   0.954
  157    H    LEU  44           HN       LEU  44  -0.272  -1.372   2.491
  158    HA   LEU  44           HA       LEU  44  -2.656  -1.224   4.109
  159    HB2  LEU  44           HB2      LEU  44  -0.723   0.884   3.155
  160    HB3  LEU  44           HB1      LEU  44  -2.106   1.227   4.176
  161    HG   LEU  44           HG       LEU  44   0.220  -0.554   4.913
  162   HD11  LEU  44          HD11      LEU  44  -0.541   2.219   5.814
  163   HD12  LEU  44          HD12      LEU  44   0.866   1.774   4.848
  164   HD13  LEU  44          HD13      LEU  44   0.740   1.235   6.521
  165   HD21  LEU  44          HD21      LEU  44  -0.786  -0.536   7.157
  166   HD22  LEU  44          HD22      LEU  44  -1.834  -1.308   5.966
  167   HD23  LEU  44          HD23      LEU  44  -2.179   0.332   6.512
  168    H    THR  45           HN       THR  45  -1.616   0.109   0.980
  169    HA   THR  45           HA       THR  45  -3.933   1.522   0.363
  170    HB   THR  45           HB       THR  45  -3.257   1.229  -2.036
  171    HG1  THR  45           HG1      THR  45  -0.843   0.093  -1.286
  172   HG21  THR  45          HG21      THR  45  -1.161   2.488  -1.815
  173   HG22  THR  45          HG22      THR  45  -1.081   2.047  -0.109
  174   HG23  THR  45          HG23      THR  45  -2.391   3.075  -0.694
  175    H    THR  46           HN       THR  46  -3.369  -1.881   0.375
  176    HA   THR  46           HA       THR  46  -5.276  -2.724  -1.498
  177    HB   THR  46           HB       THR  46  -4.468  -4.154   1.041
  178    HG1  THR  46           HG1      THR  46  -2.628  -3.773  -0.167
  179   HG21  THR  46          HG21      THR  46  -6.464  -5.102  -0.000
  180   HG22  THR  46          HG22      THR  46  -5.084  -6.183  -0.197
  181   HG23  THR  46          HG23      THR  46  -5.624  -5.189  -1.549
  182    H    LEU  47           HN       LEU  47  -5.617  -2.586   2.056
  183    HA   LEU  47           HA       LEU  47  -8.477  -2.874   1.874
  184    HB2  LEU  47           HB2      LEU  47  -6.583  -2.432   4.171
  185    HB3  LEU  47           HB1      LEU  47  -8.321  -2.447   4.391
  186    HG   LEU  47           HG       LEU  47  -7.438  -4.597   4.998
  187   HD11  LEU  47          HD11      LEU  47  -8.702  -6.056   3.511
  188   HD12  LEU  47          HD12      LEU  47  -8.807  -4.760   2.318
  189   HD13  LEU  47          HD13      LEU  47  -9.603  -4.586   3.881
  190   HD21  LEU  47          HD21      LEU  47  -6.213  -6.008   3.449
  191   HD22  LEU  47          HD22      LEU  47  -5.355  -4.490   3.709
  192   HD23  LEU  47          HD23      LEU  47  -6.269  -4.742   2.222
  193    H    PHE  48           HN       PHE  48  -6.185  -0.275   2.364
  194    HA   PHE  48           HA       PHE  48  -7.916   1.703   3.318
  195    HB2  PHE  48           HB2      PHE  48  -5.537   2.052   3.394
  196    HB3  PHE  48           HB1      PHE  48  -5.405   1.914   1.645
  197    HD1  PHE  48           HD1      PHE  48  -5.650   3.795   0.267
  198    HD2  PHE  48           HD2      PHE  48  -6.768   4.020   4.368
  199    HE1  PHE  48           HE1      PHE  48  -5.909   6.234   0.059
  200    HE2  PHE  48           HE2      PHE  48  -7.028   6.457   4.169
  201    HZ   PHE  48           HZ       PHE  48  -6.593   7.568   2.006
  202    H    CYS  49           HN       CYS  49  -7.037   0.830  -0.006
  203    HA   CYS  49           HA       CYS  49  -8.733   2.819  -1.178
  204    HB2  CYS  49           HB2      CYS  49  -6.687   1.877  -2.284
  205    HB3  CYS  49           HB1      CYS  49  -7.555   0.360  -2.487
  206    HG   CYS  49           HG       CYS  49  -9.053   1.051  -4.513
  207    H    LEU  50           HN       LEU  50  -9.091  -0.431  -0.084
  208    HA   LEU  50           HA       LEU  50 -11.379  -1.168  -1.579
  209    HB2  LEU  50           HB2      LEU  50  -9.816  -2.189   0.681
  210    HB3  LEU  50           HB1      LEU  50 -11.523  -2.601   0.758
  211    HG   LEU  50           HG       LEU  50  -9.722  -3.189  -1.592
  212   HD11  LEU  50          HD11      LEU  50 -10.671  -5.000   0.623
  213   HD12  LEU  50          HD12      LEU  50  -9.014  -4.461   0.348
  214   HD13  LEU  50          HD13      LEU  50  -9.804  -5.517  -0.824
  215   HD21  LEU  50          HD21      LEU  50 -12.517  -4.116  -0.935
  216   HD22  LEU  50          HD22      LEU  50 -11.553  -4.649  -2.312
  217   HD23  LEU  50          HD23      LEU  50 -12.073  -2.967  -2.198
  218    H    LEU  51           HN       LEU  51 -10.882   0.535   1.423
  219    HA   LEU  51           HA       LEU  51 -13.647   0.437   2.208
  220    HB2  LEU  51           HB2      LEU  51 -11.328   2.019   3.301
  221    HB3  LEU  51           HB1      LEU  51 -12.916   1.922   4.040
  222    HG   LEU  51           HG       LEU  51 -11.299  -0.558   3.528
  223   HD11  LEU  51          HD11      LEU  51 -11.176   1.212   5.969
  224   HD12  LEU  51          HD12      LEU  51  -9.869   0.927   4.820
  225   HD13  LEU  51          HD13      LEU  51 -10.463  -0.393   5.827
  226   HD21  LEU  51          HD21      LEU  51 -13.655  -0.844   4.055
  227   HD22  LEU  51          HD22      LEU  51 -13.467   0.141   5.506
  228   HD23  LEU  51          HD23      LEU  51 -12.648  -1.418   5.385
  229    H    HIS  52           HN       HIS  52 -11.466   3.099   1.217
  230    HA   HIS  52           HA       HIS  52 -13.582   5.006   1.136
  231    HB2  HIS  52           HB2      HIS  52 -11.163   5.551   1.513
  232    HB3  HIS  52           HB1      HIS  52 -10.881   5.227  -0.196
  233    HD1  HIS  52           HD1      HIS  52 -13.061   7.502   1.933
  234    HD2  HIS  52           HD2      HIS  52 -11.175   7.415  -1.767
  235    HE1  HIS  52           HE1      HIS  52 -13.441   9.777   0.934
  236    HE2  HIS  52           HE2      HIS  52 -12.170   9.744  -1.242
  237    H    PHE  53           HN       PHE  53 -11.606   3.656  -1.527
  238    HA   PHE  53           HA       PHE  53 -13.381   4.671  -3.521
  239    HB2  PHE  53           HB2      PHE  53 -11.120   2.675  -3.679
  240    HB3  PHE  53           HB1      PHE  53 -11.995   3.281  -5.080
  241    HD1  PHE  53           HD1      PHE  53  -9.879   4.330  -2.225
  242    HD2  PHE  53           HD2      PHE  53 -11.400   5.310  -6.076
  243    HE1  PHE  53           HE1      PHE  53  -8.349   6.255  -2.336
  244    HE2  PHE  53           HE2      PHE  53  -9.874   7.236  -6.194
  245    HZ   PHE  53           HZ       PHE  53  -8.361   7.723  -4.308
  246    H    GLY  54           HN       GLY  54 -13.453   1.950  -1.518
  247    HA2  GLY  54           HA2      GLY  54 -15.146   0.372  -1.336
  248    HA3  GLY  54           HA1      GLY  54 -15.817   0.957  -2.850
  249    H    VAL  55           HN       VAL  55 -13.121   0.647  -4.144
  250    HA   VAL  55           HA       VAL  55 -12.243  -1.987  -4.024
  251    HB   VAL  55           HB       VAL  55 -14.417  -2.632  -4.811
  252   HG11  VAL  55          HG11      VAL  55 -15.452  -1.866  -6.782
  253   HG12  VAL  55          HG12      VAL  55 -14.006  -1.001  -7.289
  254   HG13  VAL  55          HG13      VAL  55 -14.931  -0.430  -5.902
  255   HG21  VAL  55          HG21      VAL  55 -13.799  -3.835  -6.874
  256   HG22  VAL  55          HG22      VAL  55 -12.568  -3.953  -5.615
  257   HG23  VAL  55          HG23      VAL  55 -12.335  -2.855  -6.975
  258    H    ILE  56           HN       ILE  56 -12.962   0.488  -6.474
  259    HA   ILE  56           HA       ILE  56 -10.165   0.948  -6.929
  260    HB   ILE  56           HB       ILE  56 -10.667   0.570  -9.513
  261   HG12  ILE  56          HG12      ILE  56 -11.802  -1.670  -9.749
  262   HG13  ILE  56          HG11      ILE  56 -12.353  -1.489  -8.088
  263   HG21  ILE  56          HG21      ILE  56  -9.386  -1.475  -9.380
  264   HG22  ILE  56          HG22      ILE  56  -9.782  -1.641  -7.671
  265   HG23  ILE  56          HG23      ILE  56  -8.769  -0.304  -8.215
  266   HD11  ILE  56          HD11      ILE  56 -13.007   0.375 -10.356
  267   HD12  ILE  56          HD12      ILE  56 -13.586   0.508  -8.695
  268   HD13  ILE  56          HD13      ILE  56 -14.072  -0.862  -9.691
  269    H    GLY  57           HN       GLY  57 -13.157   2.126  -6.711
  270    HA2  GLY  57           HA2      GLY  57 -13.799   4.355  -6.983
  271    HA3  GLY  57           HA1      GLY  57 -12.421   4.593  -8.050
  272    HA   PRO  58           HA       PRO  58 -15.835   2.169 -10.703
  273    HB2  PRO  58           HB2      PRO  58 -18.334   2.796  -9.564
  274    HB3  PRO  58           HB1      PRO  58 -17.555   1.213  -9.593
  275    HG2  PRO  58           HG2      PRO  58 -17.626   3.255  -7.430
  276    HG3  PRO  58           HG1      PRO  58 -17.605   1.486  -7.310
  277    HD2  PRO  58           HD2      PRO  58 -15.422   2.927  -6.776
  278    HD3  PRO  58           HD1      PRO  58 -15.305   1.371  -7.628
  279    H    GLN  59           HN       GLN  59 -15.605   3.591 -12.298
  280    HA   GLN  59           HA       GLN  59 -17.023   6.165 -12.086
  281    HB2  GLN  59           HB2      GLN  59 -14.586   6.440 -12.231
  282    HB3  GLN  59           HB1      GLN  59 -14.565   5.507 -13.721
  283    HG2  GLN  59           HG2      GLN  59 -15.865   7.208 -14.845
  284    HG3  GLN  59           HG1      GLN  59 -15.998   8.127 -13.347
  285   HE21  GLN  59          HE21      GLN  59 -15.019   9.928 -14.242
  286   HE22  GLN  59          HE22      GLN  59 -13.326   9.989 -14.582
  287    H    ARG  60           HN       ARG  60 -18.957   5.218 -12.869
  288    HA   ARG  60           HA       ARG  60 -18.963   4.026 -15.513
  289    HB2  ARG  60           HB2      ARG  60 -20.433   3.169 -13.708
  290    HB3  ARG  60           HB1      ARG  60 -21.281   4.709 -13.694
  291    HG2  ARG  60           HG2      ARG  60 -22.685   3.533 -15.028
  292    HG3  ARG  60           HG1      ARG  60 -21.584   4.145 -16.262
  293    HD2  ARG  60           HD2      ARG  60 -21.468   1.434 -14.947
  294    HD3  ARG  60           HD1      ARG  60 -22.013   1.773 -16.589
  295    HE   ARG  60           HE       ARG  60 -19.480   2.770 -16.508
  296   HH11  ARG  60          HH11      ARG  60 -20.906  -0.326 -15.791
  297   HH12  ARG  60          HH12      ARG  60 -19.502  -1.227 -16.255
  298   HH21  ARG  60          HH21      ARG  60 -17.625   1.592 -17.126
  299   HH22  ARG  60          HH22      ARG  60 -17.637  -0.136 -17.013
  Start of MODEL   17
    1    H1   ARG  28           HT1      ARG  28  25.723   3.738  -1.214
    2    H2   ARG  28           HT2      ARG  28  24.696   3.949  -2.541
    3    H3   ARG  28           HT3      ARG  28  26.288   3.431  -2.779
    4    HA   ARG  28           HA       ARG  28  24.714   1.613  -3.012
    5    HB2  ARG  28           HB2      ARG  28  26.978   1.124  -2.260
    6    HB3  ARG  28           HB1      ARG  28  26.529   1.469  -0.596
    7    HG2  ARG  28           HG2      ARG  28  26.621  -0.889  -0.842
    8    HG3  ARG  28           HG1      ARG  28  24.920  -0.440  -0.718
    9    HD2  ARG  28           HD2      ARG  28  26.317  -0.849  -3.352
   10    HD3  ARG  28           HD1      ARG  28  25.509  -2.155  -2.488
   11    HE   ARG  28           HE       ARG  28  23.703  -0.043  -2.738
   12   HH11  ARG  28          HH11      ARG  28  25.392  -2.317  -4.767
   13   HH12  ARG  28          HH12      ARG  28  24.163  -2.336  -5.987
   14   HH21  ARG  28          HH21      ARG  28  22.080  -0.065  -4.339
   15   HH22  ARG  28          HH22      ARG  28  22.281  -1.056  -5.745
   16    H    ARG  29           HN       ARG  29  22.576   1.679  -2.627
   17    HA   ARG  29           HA       ARG  29  21.609   2.012   0.110
   18    HB2  ARG  29           HB2      ARG  29  20.567   3.318  -1.729
   19    HB3  ARG  29           HB1      ARG  29  20.047   1.813  -2.472
   20    HG2  ARG  29           HG2      ARG  29  18.198   2.760  -1.294
   21    HG3  ARG  29           HG1      ARG  29  18.730   1.320  -0.426
   22    HD2  ARG  29           HD2      ARG  29  19.986   2.746   1.135
   23    HD3  ARG  29           HD1      ARG  29  19.403   4.174   0.281
   24    HE   ARG  29           HE       ARG  29  17.272   2.498   1.179
   25   HH11  ARG  29          HH11      ARG  29  19.524   4.963   2.175
   26   HH12  ARG  29          HH12      ARG  29  18.523   5.537   3.465
   27   HH21  ARG  29          HH21      ARG  29  15.946   3.250   2.877
   28   HH22  ARG  29          HH22      ARG  29  16.491   4.565   3.864
   29    H    CYS  30           HN       CYS  30  20.790   0.399   1.304
   30    HA   CYS  30           HA       CYS  30  21.238  -2.281   0.648
   31    HB2  CYS  30           HB2      CYS  30  19.346  -1.116   2.703
   32    HB3  CYS  30           HB1      CYS  30  19.856  -2.800   2.638
   33    HG   CYS  30           HG       CYS  30  21.804  -0.084   3.358
   34    H    LEU  31           HN       LEU  31  20.227  -3.552  -0.734
   35    HA   LEU  31           HA       LEU  31  17.877  -2.859  -2.100
   36    HB2  LEU  31           HB2      LEU  31  17.943  -5.074  -3.054
   37    HB3  LEU  31           HB1      LEU  31  19.564  -4.411  -2.989
   38    HG   LEU  31           HG       LEU  31  18.571  -6.270  -0.847
   39   HD11  LEU  31          HD11      LEU  31  18.219  -7.411  -2.972
   40   HD12  LEU  31          HD12      LEU  31  19.571  -8.122  -2.090
   41   HD13  LEU  31          HD13      LEU  31  19.876  -7.045  -3.452
   42   HD21  LEU  31          HD21      LEU  31  21.306  -5.560  -1.901
   43   HD22  LEU  31          HD22      LEU  31  20.980  -6.757  -0.649
   44   HD23  LEU  31          HD23      LEU  31  20.608  -5.058  -0.362
   45    H    PHE  32           HN       PHE  32  18.350  -4.365   0.955
   46    HA   PHE  32           HA       PHE  32  15.732  -5.590   1.041
   47    HB2  PHE  32           HB2      PHE  32  17.793  -5.195   3.222
   48    HB3  PHE  32           HB1      PHE  32  16.327  -6.161   3.368
   49    HD1  PHE  32           HD1      PHE  32  16.071  -8.208   1.961
   50    HD2  PHE  32           HD2      PHE  32  19.738  -6.067   2.232
   51    HE1  PHE  32           HE1      PHE  32  17.277 -10.171   1.095
   52    HE2  PHE  32           HE2      PHE  32  20.951  -8.026   1.366
   53    HZ   PHE  32           HZ       PHE  32  19.721 -10.080   0.795
   54    H    LEU  33           HN       LEU  33  17.255  -2.629   2.097
   55    HA   LEU  33           HA       LEU  33  15.051  -1.829   3.771
   56    HB2  LEU  33           HB2      LEU  33  17.469  -0.338   2.778
   57    HB3  LEU  33           HB1      LEU  33  16.274   0.346   3.863
   58    HG   LEU  33           HG       LEU  33  18.075  -2.006   4.446
   59   HD11  LEU  33          HD11      LEU  33  17.978   0.801   5.523
   60   HD12  LEU  33          HD12      LEU  33  19.240   0.103   4.509
   61   HD13  LEU  33          HD13      LEU  33  18.999  -0.491   6.152
   62   HD21  LEU  33          HD21      LEU  33  15.946  -0.704   6.143
   63   HD22  LEU  33          HD22      LEU  33  17.121  -1.886   6.720
   64   HD23  LEU  33          HD23      LEU  33  15.926  -2.349   5.509
   65    H    SER  34           HN       SER  34  15.912  -1.554   0.450
   66    HA   SER  34           HA       SER  34  14.381   0.759  -0.177
   67    HB2  SER  34           HB2      SER  34  15.308  -1.508  -1.960
   68    HB3  SER  34           HB1      SER  34  14.655   0.031  -2.526
   69    HG   SER  34           HG       SER  34  16.485   0.995  -2.052
   70    H    LEU  35           HN       LEU  35  13.749  -2.723  -0.447
   71    HA   LEU  35           HA       LEU  35  11.154  -2.469  -1.542
   72    HB2  LEU  35           HB2      LEU  35  12.484  -4.516  -1.711
   73    HB3  LEU  35           HB1      LEU  35  12.388  -4.736   0.025
   74    HG   LEU  35           HG       LEU  35   9.792  -4.554  -1.370
   75   HD11  LEU  35          HD11      LEU  35   9.904  -6.879  -2.142
   76   HD12  LEU  35          HD12      LEU  35  11.619  -6.924  -1.735
   77   HD13  LEU  35          HD13      LEU  35  11.042  -5.842  -3.003
   78   HD21  LEU  35          HD21      LEU  35   9.227  -6.333   0.181
   79   HD22  LEU  35          HD22      LEU  35  10.015  -5.008   1.038
   80   HD23  LEU  35          HD23      LEU  35  10.916  -6.478   0.664
   81    H    PHE  36           HN       PHE  36  12.351  -1.950   1.593
   82    HA   PHE  36           HA       PHE  36  10.142  -2.713   3.163
   83    HB2  PHE  36           HB2      PHE  36  12.319  -2.251   4.151
   84    HB3  PHE  36           HB1      PHE  36  12.224  -0.570   3.640
   85    HD1  PHE  36           HD1      PHE  36  10.585  -3.088   5.817
   86    HD2  PHE  36           HD2      PHE  36  11.261   1.036   5.019
   87    HE1  PHE  36           HE1      PHE  36   9.515  -2.502   7.955
   88    HE2  PHE  36           HE2      PHE  36  10.194   1.630   7.154
   89    HZ   PHE  36           HZ       PHE  36   9.318  -0.140   8.625
   90    H    SER  37           HN       SER  37  10.644  -0.014   1.068
   91    HA   SER  37           HA       SER  37   8.546   1.584   2.276
   92    HB2  SER  37           HB2      SER  37   9.026   3.176   0.445
   93    HB3  SER  37           HB1      SER  37  10.483   2.727   1.328
   94    HG   SER  37           HG       SER  37   9.630   1.629  -1.148
   95    H    PHE  38           HN       PHE  38   9.075   0.009  -0.876
   96    HA   PHE  38           HA       PHE  38   6.628   0.530  -2.057
   97    HB2  PHE  38           HB2      PHE  38   8.236  -2.020  -2.302
   98    HB3  PHE  38           HB1      PHE  38   7.033  -1.437  -3.449
   99    HD1  PHE  38           HD1      PHE  38   7.529   0.300  -5.011
  100    HD2  PHE  38           HD2      PHE  38  10.415  -0.901  -2.124
  101    HE1  PHE  38           HE1      PHE  38   9.266   1.529  -6.243
  102    HE2  PHE  38           HE2      PHE  38  12.158   0.328  -3.350
  103    HZ   PHE  38           HZ       PHE  38  11.585   1.546  -5.413
  104    H    LEU  39           HN       LEU  39   7.540  -2.472  -0.433
  105    HA   LEU  39           HA       LEU  39   5.232  -3.870  -0.473
  106    HB2  LEU  39           HB2      LEU  39   7.541  -4.385   0.561
  107    HB3  LEU  39           HB1      LEU  39   6.847  -3.749   2.041
  108    HG   LEU  39           HG       LEU  39   5.012  -5.445   1.797
  109   HD11  LEU  39          HD11      LEU  39   6.864  -6.571  -0.294
  110   HD12  LEU  39          HD12      LEU  39   5.260  -5.896  -0.582
  111   HD13  LEU  39          HD13      LEU  39   5.439  -7.375   0.364
  112   HD21  LEU  39          HD21      LEU  39   6.870  -5.738   3.347
  113   HD22  LEU  39          HD22      LEU  39   7.829  -6.477   2.066
  114   HD23  LEU  39          HD23      LEU  39   6.375  -7.282   2.655
  115    H    ILE  40           HN       ILE  40   6.077  -1.552   2.119
  116    HA   ILE  40           HA       ILE  40   3.731  -1.862   3.602
  117    HB   ILE  40           HB       ILE  40   5.494   0.576   3.358
  118   HG12  ILE  40          HG12      ILE  40   5.408  -1.624   5.436
  119   HG13  ILE  40          HG11      ILE  40   6.615  -1.482   4.163
  120   HG21  ILE  40          HG21      ILE  40   3.404  -0.088   5.431
  121   HG22  ILE  40          HG22      ILE  40   3.295   1.186   4.216
  122   HG23  ILE  40          HG23      ILE  40   4.512   1.284   5.489
  123   HD11  ILE  40          HD11      ILE  40   7.330   0.668   5.122
  124   HD12  ILE  40          HD12      ILE  40   7.512  -0.679   6.245
  125   HD13  ILE  40          HD13      ILE  40   6.166   0.445   6.428
  126    H    VAL  41           HN       VAL  41   4.498   0.674   1.209
  127    HA   VAL  41           HA       VAL  41   2.055   2.007   1.298
  128    HB   VAL  41           HB       VAL  41   3.878   1.698  -1.091
  129   HG11  VAL  41          HG11      VAL  41   1.725   3.718  -0.473
  130   HG12  VAL  41          HG12      VAL  41   1.734   2.539  -1.786
  131   HG13  VAL  41          HG13      VAL  41   2.892   3.870  -1.787
  132   HG21  VAL  41          HG21      VAL  41   5.058   2.558   0.857
  133   HG22  VAL  41          HG22      VAL  41   3.820   3.794   1.076
  134   HG23  VAL  41          HG23      VAL  41   4.851   3.821  -0.356
  135    H    LEU  42           HN       LEU  42   2.995  -0.846  -0.545
  136    HA   LEU  42           HA       LEU  42   0.686  -0.867  -2.206
  137    HB2  LEU  42           HB2      LEU  42   3.037  -2.084  -2.397
  138    HB3  LEU  42           HB1      LEU  42   2.164  -3.382  -1.592
  139    HG   LEU  42           HG       LEU  42   2.191  -3.686  -4.019
  140   HD11  LEU  42          HD11      LEU  42  -0.194  -4.020  -4.368
  141   HD12  LEU  42          HD12      LEU  42  -0.552  -2.993  -2.980
  142   HD13  LEU  42          HD13      LEU  42   0.284  -4.528  -2.748
  143   HD21  LEU  42          HD21      LEU  42   0.675  -1.081  -4.126
  144   HD22  LEU  42          HD22      LEU  42   0.992  -2.154  -5.489
  145   HD23  LEU  42          HD23      LEU  42   2.330  -1.338  -4.678
  146    H    LEU  43           HN       LEU  43   1.625  -3.090   0.424
  147    HA   LEU  43           HA       LEU  43  -0.795  -4.424   0.643
  148    HB2  LEU  43           HB2      LEU  43   1.457  -3.920   2.541
  149    HB3  LEU  43           HB1      LEU  43   0.000  -4.697   3.128
  150    HG   LEU  43           HG       LEU  43   1.717  -6.337   2.547
  151   HD11  LEU  43          HD11      LEU  43   0.361  -7.762   1.092
  152   HD12  LEU  43          HD12      LEU  43  -0.646  -6.375   0.675
  153   HD13  LEU  43          HD13      LEU  43  -0.616  -6.978   2.332
  154   HD21  LEU  43          HD21      LEU  43   1.470  -5.236  -0.250
  155   HD22  LEU  43          HD22      LEU  43   2.380  -6.672   0.215
  156   HD23  LEU  43          HD23      LEU  43   2.874  -5.087   0.807
  157    H    LEU  44           HN       LEU  44   0.019  -1.234   1.685
  158    HA   LEU  44           HA       LEU  44  -2.104  -1.039   3.618
  159    HB2  LEU  44           HB2      LEU  44  -0.397   0.359   4.213
  160    HB3  LEU  44           HB1      LEU  44   0.020   0.738   2.554
  161    HG   LEU  44           HG       LEU  44  -2.017   2.169   2.434
  162   HD11  LEU  44          HD11      LEU  44  -2.105   1.672   5.406
  163   HD12  LEU  44          HD12      LEU  44  -3.302   1.140   4.226
  164   HD13  LEU  44          HD13      LEU  44  -3.072   2.861   4.532
  165   HD21  LEU  44          HD21      LEU  44   0.179   3.134   2.820
  166   HD22  LEU  44          HD22      LEU  44   0.007   2.867   4.555
  167   HD23  LEU  44          HD23      LEU  44  -1.052   4.012   3.730
  168    H    THR  45           HN       THR  45  -1.500   0.191   0.338
  169    HA   THR  45           HA       THR  45  -3.876   1.663   0.079
  170    HB   THR  45           HB       THR  45  -3.514   1.365  -2.412
  171    HG1  THR  45           HG1      THR  45  -0.983   0.322  -1.833
  172   HG21  THR  45          HG21      THR  45  -2.622   3.287  -1.233
  173   HG22  THR  45          HG22      THR  45  -1.450   2.726  -2.426
  174   HG23  THR  45          HG23      THR  45  -1.218   2.353  -0.719
  175    H    THR  46           HN       THR  46  -3.304  -1.741  -0.072
  176    HA   THR  46           HA       THR  46  -5.482  -2.502  -1.693
  177    HB   THR  46           HB       THR  46  -4.200  -4.073   0.551
  178    HG1  THR  46           HG1      THR  46  -3.593  -4.630  -2.098
  179   HG21  THR  46          HG21      THR  46  -5.046  -6.041  -0.621
  180   HG22  THR  46          HG22      THR  46  -5.807  -5.009  -1.831
  181   HG23  THR  46          HG23      THR  46  -6.375  -4.976  -0.161
  182    H    LEU  47           HN       LEU  47  -5.203  -2.612   1.867
  183    HA   LEU  47           HA       LEU  47  -8.013  -3.063   2.194
  184    HB2  LEU  47           HB2      LEU  47  -5.855  -2.389   4.192
  185    HB3  LEU  47           HB1      LEU  47  -7.507  -2.777   4.624
  186    HG   LEU  47           HG       LEU  47  -6.202  -4.727   4.994
  187   HD11  LEU  47          HD11      LEU  47  -7.233  -6.350   3.516
  188   HD12  LEU  47          HD12      LEU  47  -7.659  -5.071   2.379
  189   HD13  LEU  47          HD13      LEU  47  -8.396  -5.108   3.981
  190   HD21  LEU  47          HD21      LEU  47  -4.801  -5.761   3.309
  191   HD22  LEU  47          HD22      LEU  47  -4.280  -4.101   3.598
  192   HD23  LEU  47          HD23      LEU  47  -5.215  -4.493   2.155
  193    H    PHE  48           HN       PHE  48  -6.022  -0.280   1.920
  194    HA   PHE  48           HA       PHE  48  -7.769   1.497   3.350
  195    HB2  PHE  48           HB2      PHE  48  -5.343   1.921   3.150
  196    HB3  PHE  48           HB1      PHE  48  -5.537   2.137   1.413
  197    HD1  PHE  48           HD1      PHE  48  -6.245   4.193   0.512
  198    HD2  PHE  48           HD2      PHE  48  -6.436   3.531   4.711
  199    HE1  PHE  48           HE1      PHE  48  -6.717   6.582   0.862
  200    HE2  PHE  48           HE2      PHE  48  -6.909   5.919   5.071
  201    HZ   PHE  48           HZ       PHE  48  -7.050   7.447   3.144
  202    H    CYS  49           HN       CYS  49  -7.192   0.706  -0.050
  203    HA   CYS  49           HA       CYS  49  -8.933   2.703  -1.078
  204    HB2  CYS  49           HB2      CYS  49  -7.738   0.212  -2.279
  205    HB3  CYS  49           HB1      CYS  49  -8.817   1.267  -3.187
  206    HG   CYS  49           HG       CYS  49  -7.088   3.534  -2.742
  207    H    LEU  50           HN       LEU  50  -9.325  -0.801  -0.587
  208    HA   LEU  50           HA       LEU  50 -11.874  -1.128  -1.583
  209    HB2  LEU  50           HB2      LEU  50 -10.651  -2.446   0.846
  210    HB3  LEU  50           HB1      LEU  50 -12.088  -3.018   0.006
  211    HG   LEU  50           HG       LEU  50  -9.391  -2.773  -1.324
  212   HD11  LEU  50          HD11      LEU  50 -10.656  -5.194  -0.049
  213   HD12  LEU  50          HD12      LEU  50  -9.218  -4.346   0.524
  214   HD13  LEU  50          HD13      LEU  50  -9.187  -5.192  -1.024
  215   HD21  LEU  50          HD21      LEU  50 -11.914  -4.245  -2.074
  216   HD22  LEU  50          HD22      LEU  50 -10.392  -4.294  -2.964
  217   HD23  LEU  50          HD23      LEU  50 -11.292  -2.783  -2.841
  218    H    LEU  51           HN       LEU  51 -10.879   0.115   1.556
  219    HA   LEU  51           HA       LEU  51 -13.575   0.311   2.551
  220    HB2  LEU  51           HB2      LEU  51 -10.968   1.411   3.597
  221    HB3  LEU  51           HB1      LEU  51 -12.500   1.510   4.447
  222    HG   LEU  51           HG       LEU  51 -11.102  -1.065   3.713
  223   HD11  LEU  51          HD11      LEU  51  -9.860   0.194   5.393
  224   HD12  LEU  51          HD12      LEU  51 -10.602  -1.244   6.092
  225   HD13  LEU  51          HD13      LEU  51 -11.321   0.342   6.370
  226   HD21  LEU  51          HD21      LEU  51 -13.519  -1.309   3.836
  227   HD22  LEU  51          HD22      LEU  51 -13.532  -0.525   5.417
  228   HD23  LEU  51          HD23      LEU  51 -12.747  -2.092   5.216
  229    H    HIS  52           HN       HIS  52 -11.232   2.436   1.039
  230    HA   HIS  52           HA       HIS  52 -12.459   4.894   1.614
  231    HB2  HIS  52           HB2      HIS  52 -10.169   4.733   0.771
  232    HB3  HIS  52           HB1      HIS  52 -10.763   4.117  -0.767
  233    HD1  HIS  52           HD1      HIS  52 -11.071   5.829  -2.528
  234    HD2  HIS  52           HD2      HIS  52 -11.196   7.488   1.279
  235    HE1  HIS  52           HE1      HIS  52 -11.256   8.311  -2.882
  236    HE2  HIS  52           HE2      HIS  52 -11.287   9.299  -0.565
  237    H    PHE  53           HN       PHE  53 -12.597   3.037  -1.441
  238    HA   PHE  53           HA       PHE  53 -14.741   4.659  -2.438
  239    HB2  PHE  53           HB2      PHE  53 -13.579   2.067  -3.476
  240    HB3  PHE  53           HB1      PHE  53 -14.743   3.067  -4.338
  241    HD1  PHE  53           HD1      PHE  53 -11.282   2.839  -3.138
  242    HD2  PHE  53           HD2      PHE  53 -14.078   5.086  -5.426
  243    HE1  PHE  53           HE1      PHE  53  -9.434   4.148  -4.105
  244    HE2  PHE  53           HE2      PHE  53 -12.237   6.398  -6.398
  245    HZ   PHE  53           HZ       PHE  53  -9.912   5.929  -5.737
  246    H    GLY  54           HN       GLY  54 -14.497   1.668  -0.681
  247    HA2  GLY  54           HA2      GLY  54 -16.106   0.329   0.261
  248    HA3  GLY  54           HA1      GLY  54 -17.228   1.658   0.014
  249    H    VAL  55           HN       VAL  55 -15.778   0.744  -2.879
  250    HA   VAL  55           HA       VAL  55 -18.142  -0.023  -4.114
  251    HB   VAL  55           HB       VAL  55 -16.335   0.726  -5.466
  252   HG11  VAL  55          HG11      VAL  55 -14.452   0.083  -4.148
  253   HG12  VAL  55          HG12      VAL  55 -14.267  -0.619  -5.755
  254   HG13  VAL  55          HG13      VAL  55 -14.792  -1.625  -4.409
  255   HG21  VAL  55          HG21      VAL  55 -16.193  -1.014  -7.175
  256   HG22  VAL  55          HG22      VAL  55 -17.831  -0.876  -6.536
  257   HG23  VAL  55          HG23      VAL  55 -16.791  -2.202  -6.018
  258    H    ILE  56           HN       ILE  56 -15.610  -2.042  -2.705
  259    HA   ILE  56           HA       ILE  56 -17.500  -4.173  -2.291
  260    HB   ILE  56           HB       ILE  56 -15.597  -5.746  -3.399
  261   HG12  ILE  56          HG12      ILE  56 -15.234  -4.777  -5.720
  262   HG13  ILE  56          HG11      ILE  56 -15.733  -3.226  -5.058
  263   HG21  ILE  56          HG21      ILE  56 -17.972  -4.593  -4.850
  264   HG22  ILE  56          HG22      ILE  56 -18.027  -5.907  -3.675
  265   HG23  ILE  56          HG23      ILE  56 -17.172  -6.124  -5.203
  266   HD11  ILE  56          HD11      ILE  56 -13.317  -3.419  -5.161
  267   HD12  ILE  56          HD12      ILE  56 -13.378  -4.854  -4.136
  268   HD13  ILE  56          HD13      ILE  56 -13.874  -3.286  -3.493
  269    H    GLY  57           HN       GLY  57 -17.059  -4.003  -0.133
  270    HA2  GLY  57           HA2      GLY  57 -15.421  -5.571   1.209
  271    HA3  GLY  57           HA1      GLY  57 -14.297  -4.292   0.777
  272    HA   PRO  58           HA       PRO  58 -17.553  -2.234   3.705
  273    HB2  PRO  58           HB2      PRO  58 -19.236  -3.890   5.037
  274    HB3  PRO  58           HB1      PRO  58 -19.634  -3.182   3.467
  275    HG2  PRO  58           HG2      PRO  58 -18.594  -5.917   4.104
  276    HG3  PRO  58           HG1      PRO  58 -19.871  -5.442   2.969
  277    HD2  PRO  58           HD2      PRO  58 -17.354  -6.025   2.164
  278    HD3  PRO  58           HD1      PRO  58 -18.365  -4.824   1.336
  279    H    GLN  59           HN       GLN  59 -16.792  -5.530   4.769
  280    HA   GLN  59           HA       GLN  59 -15.796  -6.347   6.649
  281    HB2  GLN  59           HB2      GLN  59 -14.210  -3.782   6.456
  282    HB3  GLN  59           HB1      GLN  59 -13.727  -5.238   7.315
  283    HG2  GLN  59           HG2      GLN  59 -14.090  -4.951   4.341
  284    HG3  GLN  59           HG1      GLN  59 -12.560  -5.071   5.209
  285   HE21  GLN  59          HE21      GLN  59 -11.918  -7.050   6.049
  286   HE22  GLN  59          HE22      GLN  59 -12.645  -8.538   5.559
  287    H    ARG  60           HN       ARG  60 -18.147  -5.377   7.350
  288    HA   ARG  60           HA       ARG  60 -17.871  -3.424   9.480
  289    HB2  ARG  60           HB2      ARG  60 -19.839  -3.359   8.002
  290    HB3  ARG  60           HB1      ARG  60 -20.293  -4.971   8.538
  291    HG2  ARG  60           HG2      ARG  60 -20.673  -4.167  10.779
  292    HG3  ARG  60           HG1      ARG  60 -20.097  -2.560  10.330
  293    HD2  ARG  60           HD2      ARG  60 -22.523  -3.952   9.202
  294    HD3  ARG  60           HD1      ARG  60 -22.539  -2.649  10.389
  295    HE   ARG  60           HE       ARG  60 -21.129  -1.744   8.167
  296   HH11  ARG  60          HH11      ARG  60 -24.372  -2.735   8.974
  297   HH12  ARG  60          HH12      ARG  60 -25.114  -1.711   7.791
  298   HH21  ARG  60          HH21      ARG  60 -22.100  -0.394   6.611
  299   HH22  ARG  60          HH22      ARG  60 -23.824  -0.382   6.448
  Start of MODEL   18
    1    H1   ARG  28           HT1      ARG  28  20.508   8.578   6.053
    2    H2   ARG  28           HT2      ARG  28  19.518   7.313   6.580
    3    H3   ARG  28           HT3      ARG  28  19.485   7.793   4.958
    4    HA   ARG  28           HA       ARG  28  21.816   7.119   4.725
    5    HB2  ARG  28           HB2      ARG  28  21.337   6.270   7.572
    6    HB3  ARG  28           HB1      ARG  28  22.538   5.458   6.579
    7    HG2  ARG  28           HG2      ARG  28  23.664   7.101   7.863
    8    HG3  ARG  28           HG1      ARG  28  23.613   7.680   6.197
    9    HD2  ARG  28           HD2      ARG  28  23.115   9.450   7.838
   10    HD3  ARG  28           HD1      ARG  28  21.780   9.159   6.726
   11    HE   ARG  28           HE       ARG  28  21.606   7.713   9.215
   12   HH11  ARG  28          HH11      ARG  28  20.818  10.643   7.506
   13   HH12  ARG  28          HH12      ARG  28  19.507  11.058   8.557
   14   HH21  ARG  28          HH21      ARG  28  19.875   8.247  10.604
   15   HH22  ARG  28          HH22      ARG  28  18.969   9.696  10.318
   16    H    ARG  29           HN       ARG  29  18.793   6.245   4.736
   17    HA   ARG  29           HA       ARG  29  18.687   3.455   4.811
   18    HB2  ARG  29           HB2      ARG  29  16.672   3.685   3.380
   19    HB3  ARG  29           HB1      ARG  29  16.663   4.768   4.765
   20    HG2  ARG  29           HG2      ARG  29  17.320   6.624   3.355
   21    HG3  ARG  29           HG1      ARG  29  17.427   5.550   1.959
   22    HD2  ARG  29           HD2      ARG  29  15.036   5.056   2.165
   23    HD3  ARG  29           HD1      ARG  29  14.934   6.139   3.552
   24    HE   ARG  29           HE       ARG  29  15.929   7.730   1.608
   25   HH11  ARG  29          HH11      ARG  29  13.176   5.599   1.761
   26   HH12  ARG  29          HH12      ARG  29  12.224   6.540   0.663
   27   HH21  ARG  29          HH21      ARG  29  14.680   8.978   0.163
   28   HH22  ARG  29          HH22      ARG  29  13.079   8.460  -0.247
   29    H    CYS  30           HN       CYS  30  19.028   1.856   3.326
   30    HA   CYS  30           HA       CYS  30  20.552   2.640   0.942
   31    HB2  CYS  30           HB2      CYS  30  21.398   0.332   0.941
   32    HB3  CYS  30           HB1      CYS  30  21.714   1.131   2.476
   33    HG   CYS  30           HG       CYS  30  21.090  -1.342   3.307
   34    H    LEU  31           HN       LEU  31  20.337   0.601  -0.730
   35    HA   LEU  31           HA       LEU  31  17.866   0.967  -1.989
   36    HB2  LEU  31           HB2      LEU  31  19.867  -1.267  -2.336
   37    HB3  LEU  31           HB1      LEU  31  18.547  -0.924  -3.436
   38    HG   LEU  31           HG       LEU  31  20.793   1.002  -2.840
   39   HD11  LEU  31          HD11      LEU  31  21.640   0.401  -5.059
   40   HD12  LEU  31          HD12      LEU  31  20.403  -0.849  -5.188
   41   HD13  LEU  31          HD13      LEU  31  21.658  -0.974  -3.955
   42   HD21  LEU  31          HD21      LEU  31  19.962   2.188  -4.802
   43   HD22  LEU  31          HD22      LEU  31  18.712   2.065  -3.563
   44   HD23  LEU  31          HD23      LEU  31  18.661   1.009  -4.974
   45    H    PHE  32           HN       PHE  32  19.069  -1.763  -0.063
   46    HA   PHE  32           HA       PHE  32  16.861  -3.443  -0.327
   47    HB2  PHE  32           HB2      PHE  32  18.619  -3.181   2.119
   48    HB3  PHE  32           HB1      PHE  32  17.676  -4.589   1.642
   49    HD1  PHE  32           HD1      PHE  32  18.268  -5.664  -0.625
   50    HD2  PHE  32           HD2      PHE  32  20.834  -2.996   1.474
   51    HE1  PHE  32           HE1      PHE  32  20.194  -6.527  -1.891
   52    HE2  PHE  32           HE2      PHE  32  22.765  -3.853   0.211
   53    HZ   PHE  32           HZ       PHE  32  22.445  -5.620  -1.474
   54    H    LEU  33           HN       LEU  33  17.503  -0.896   2.054
   55    HA   LEU  33           HA       LEU  33  15.183  -1.332   3.603
   56    HB2  LEU  33           HB2      LEU  33  16.889   1.122   3.250
   57    HB3  LEU  33           HB1      LEU  33  15.598   0.988   4.428
   58    HG   LEU  33           HG       LEU  33  18.126  -0.658   4.351
   59   HD11  LEU  33          HD11      LEU  33  17.123   1.432   6.268
   60   HD12  LEU  33          HD12      LEU  33  18.469   1.602   5.143
   61   HD13  LEU  33          HD13      LEU  33  18.580   0.464   6.484
   62   HD21  LEU  33          HD21      LEU  33  17.319  -1.603   6.483
   63   HD22  LEU  33          HD22      LEU  33  16.291  -2.039   5.118
   64   HD23  LEU  33          HD23      LEU  33  15.777  -0.782   6.241
   65    H    SER  34           HN       SER  34  15.789   0.462   0.675
   66    HA   SER  34           HA       SER  34  13.401   2.015   0.732
   67    HB2  SER  34           HB2      SER  34  15.169   1.243  -1.602
   68    HB3  SER  34           HB1      SER  34  13.906   2.473  -1.644
   69    HG   SER  34           HG       SER  34  15.103   3.773  -0.399
   70    H    LEU  35           HN       LEU  35  14.289  -1.106  -0.637
   71    HA   LEU  35           HA       LEU  35  11.899  -1.512  -2.108
   72    HB2  LEU  35           HB2      LEU  35  13.981  -2.740  -2.551
   73    HB3  LEU  35           HB1      LEU  35  13.848  -3.531  -0.991
   74    HG   LEU  35           HG       LEU  35  11.535  -3.854  -2.810
   75   HD11  LEU  35          HD11      LEU  35  13.385  -4.048  -4.379
   76   HD12  LEU  35          HD12      LEU  35  12.641  -5.620  -4.085
   77   HD13  LEU  35          HD13      LEU  35  14.177  -5.214  -3.319
   78   HD21  LEU  35          HD21      LEU  35  11.606  -4.923  -0.622
   79   HD22  LEU  35          HD22      LEU  35  13.110  -5.736  -1.055
   80   HD23  LEU  35          HD23      LEU  35  11.617  -6.129  -1.909
   81    H    PHE  36           HN       PHE  36  12.731  -1.841   1.221
   82    HA   PHE  36           HA       PHE  36  10.644  -3.660   1.937
   83    HB2  PHE  36           HB2      PHE  36  12.904  -2.697   3.183
   84    HB3  PHE  36           HB1      PHE  36  11.612  -1.882   4.056
   85    HD1  PHE  36           HD1      PHE  36  13.509  -4.847   3.761
   86    HD2  PHE  36           HD2      PHE  36   9.686  -3.379   4.920
   87    HE1  PHE  36           HE1      PHE  36  13.132  -6.885   5.089
   88    HE2  PHE  36           HE2      PHE  36   9.304  -5.413   6.250
   89    HZ   PHE  36           HZ       PHE  36  11.028  -7.169   6.336
   90    H    SER  37           HN       SER  37  10.643  -0.433   1.036
   91    HA   SER  37           HA       SER  37   8.418   0.354   2.732
   92    HB2  SER  37           HB2      SER  37   9.824   1.867   0.519
   93    HB3  SER  37           HB1      SER  37   8.613   2.536   1.613
   94    HG   SER  37           HG       SER  37  10.299   1.553   3.235
   95    H    PHE  38           HN       PHE  38   9.019  -0.646  -0.569
   96    HA   PHE  38           HA       PHE  38   6.556   0.171  -1.681
   97    HB2  PHE  38           HB2      PHE  38   8.447  -2.042  -2.469
   98    HB3  PHE  38           HB1      PHE  38   7.049  -1.572  -3.424
   99    HD1  PHE  38           HD1      PHE  38   7.046   0.442  -4.721
  100    HD2  PHE  38           HD2      PHE  38  10.364  -0.540  -2.243
  101    HE1  PHE  38           HE1      PHE  38   8.389   2.174  -5.838
  102    HE2  PHE  38           HE2      PHE  38  11.713   1.192  -3.355
  103    HZ   PHE  38           HZ       PHE  38  10.715   2.550  -5.169
  104    H    LEU  39           HN       LEU  39   7.490  -2.591   0.222
  105    HA   LEU  39           HA       LEU  39   5.186  -4.164  -0.386
  106    HB2  LEU  39           HB2      LEU  39   7.431  -4.964   0.542
  107    HB3  LEU  39           HB1      LEU  39   6.865  -4.394   2.101
  108    HG   LEU  39           HG       LEU  39   5.138  -6.266   0.569
  109   HD11  LEU  39          HD11      LEU  39   7.542  -7.136   2.168
  110   HD12  LEU  39          HD12      LEU  39   7.375  -7.259   0.417
  111   HD13  LEU  39          HD13      LEU  39   6.315  -8.194   1.471
  112   HD21  LEU  39          HD21      LEU  39   4.557  -7.035   2.809
  113   HD22  LEU  39          HD22      LEU  39   4.357  -5.288   2.673
  114   HD23  LEU  39          HD23      LEU  39   5.763  -5.952   3.503
  115    H    ILE  40           HN       ILE  40   5.994  -1.719   1.956
  116    HA   ILE  40           HA       ILE  40   3.693  -2.158   3.617
  117    HB   ILE  40           HB       ILE  40   5.440   0.301   3.494
  118   HG12  ILE  40          HG12      ILE  40   5.752  -2.110   5.296
  119   HG13  ILE  40          HG11      ILE  40   6.728  -1.822   3.858
  120   HG21  ILE  40          HG21      ILE  40   3.672  -0.800   5.676
  121   HG22  ILE  40          HG22      ILE  40   3.339   0.618   4.681
  122   HG23  ILE  40          HG23      ILE  40   4.696   0.629   5.806
  123   HD11  ILE  40          HD11      ILE  40   7.581   0.236   4.848
  124   HD12  ILE  40          HD12      ILE  40   7.903  -1.162   5.876
  125   HD13  ILE  40          HD13      ILE  40   6.599  -0.048   6.285
  126    H    VAL  41           HN       VAL  41   4.537  -0.039   0.936
  127    HA   VAL  41           HA       VAL  41   2.247   1.636   1.178
  128    HB   VAL  41           HB       VAL  41   4.417   2.218  -0.015
  129   HG11  VAL  41          HG11      VAL  41   4.626   0.244  -1.383
  130   HG12  VAL  41          HG12      VAL  41   4.508   1.675  -2.406
  131   HG13  VAL  41          HG13      VAL  41   3.111   0.617  -2.201
  132   HG21  VAL  41          HG21      VAL  41   3.271   3.646  -1.651
  133   HG22  VAL  41          HG22      VAL  41   2.454   3.650  -0.087
  134   HG23  VAL  41          HG23      VAL  41   1.795   2.707  -1.424
  135    H    LEU  42           HN       LEU  42   2.934  -1.355  -0.513
  136    HA   LEU  42           HA       LEU  42   0.539  -1.253  -2.107
  137    HB2  LEU  42           HB2      LEU  42   2.503  -3.477  -1.558
  138    HB3  LEU  42           HB1      LEU  42   1.127  -3.633  -2.642
  139    HG   LEU  42           HG       LEU  42   3.385  -1.657  -3.004
  140   HD11  LEU  42          HD11      LEU  42   4.171  -3.941  -3.280
  141   HD12  LEU  42          HD12      LEU  42   4.097  -3.116  -4.836
  142   HD13  LEU  42          HD13      LEU  42   2.846  -4.278  -4.394
  143   HD21  LEU  42          HD21      LEU  42   2.426  -1.371  -5.247
  144   HD22  LEU  42          HD22      LEU  42   1.297  -0.890  -3.980
  145   HD23  LEU  42          HD23      LEU  42   1.092  -2.437  -4.804
  146    H    LEU  43           HN       LEU  43   1.599  -3.033   0.777
  147    HA   LEU  43           HA       LEU  43  -0.671  -4.605   1.145
  148    HB2  LEU  43           HB2      LEU  43   1.610  -4.583   2.386
  149    HB3  LEU  43           HB1      LEU  43   0.852  -3.413   3.445
  150    HG   LEU  43           HG       LEU  43   0.840  -5.748   4.314
  151   HD11  LEU  43          HD11      LEU  43  -1.919  -4.653   3.816
  152   HD12  LEU  43          HD12      LEU  43  -0.804  -4.047   5.040
  153   HD13  LEU  43          HD13      LEU  43  -1.408  -5.700   5.139
  154   HD21  LEU  43          HD21      LEU  43  -1.119  -6.249   2.078
  155   HD22  LEU  43          HD22      LEU  43  -0.690  -7.374   3.366
  156   HD23  LEU  43          HD23      LEU  43   0.518  -6.898   2.174
  157    H    LEU  44           HN       LEU  44   0.002  -1.297   2.197
  158    HA   LEU  44           HA       LEU  44  -2.363  -0.990   3.732
  159    HB2  LEU  44           HB2      LEU  44  -0.509   1.027   2.481
  160    HB3  LEU  44           HB1      LEU  44  -1.859   1.467   3.507
  161    HG   LEU  44           HG       LEU  44   0.490  -0.227   4.361
  162   HD11  LEU  44          HD11      LEU  44   1.125   2.091   3.961
  163   HD12  LEU  44          HD12      LEU  44   1.133   1.723   5.685
  164   HD13  LEU  44          HD13      LEU  44  -0.200   2.640   4.986
  165   HD21  LEU  44          HD21      LEU  44  -1.818   0.904   5.939
  166   HD22  LEU  44          HD22      LEU  44  -0.425   0.061   6.615
  167   HD23  LEU  44          HD23      LEU  44  -1.550  -0.797   5.562
  168    H    THR  45           HN       THR  45  -1.513   0.145   0.457
  169    HA   THR  45           HA       THR  45  -3.846   1.466  -0.175
  170    HB   THR  45           HB       THR  45  -3.360   0.807  -2.578
  171    HG1  THR  45           HG1      THR  45  -0.855  -0.052  -2.077
  172   HG21  THR  45          HG21      THR  45  -1.149   2.012  -0.911
  173   HG22  THR  45          HG22      THR  45  -2.511   2.873  -1.630
  174   HG23  THR  45          HG23      THR  45  -1.283   2.142  -2.665
  175    H    THR  46           HN       THR  46  -3.361  -1.960   0.106
  176    HA   THR  46           HA       THR  46  -5.478  -2.864  -1.505
  177    HB   THR  46           HB       THR  46  -4.415  -4.148   1.019
  178    HG1  THR  46           HG1      THR  46  -2.753  -3.889  -0.485
  179   HG21  THR  46          HG21      THR  46  -5.290  -6.221   0.118
  180   HG22  THR  46          HG22      THR  46  -5.867  -5.384  -1.324
  181   HG23  THR  46          HG23      THR  46  -6.596  -5.040   0.246
  182    H    LEU  47           HN       LEU  47  -5.412  -2.496   2.045
  183    HA   LEU  47           HA       LEU  47  -8.279  -2.705   2.208
  184    HB2  LEU  47           HB2      LEU  47  -6.183  -2.079   4.287
  185    HB3  LEU  47           HB1      LEU  47  -7.891  -2.246   4.641
  186    HG   LEU  47           HG       LEU  47  -6.827  -4.284   5.257
  187   HD11  LEU  47          HD11      LEU  47  -7.955  -5.915   3.843
  188   HD12  LEU  47          HD12      LEU  47  -8.209  -4.682   2.609
  189   HD13  LEU  47          HD13      LEU  47  -8.998  -4.533   4.179
  190   HD21  LEU  47          HD21      LEU  47  -5.465  -5.608   3.769
  191   HD22  LEU  47          HD22      LEU  47  -4.788  -3.985   3.901
  192   HD23  LEU  47          HD23      LEU  47  -5.702  -4.447   2.465
  193    H    PHE  48           HN       PHE  48  -5.999  -0.182   1.830
  194    HA   PHE  48           HA       PHE  48  -7.545   1.916   3.004
  195    HB2  PHE  48           HB2      PHE  48  -5.113   2.097   2.793
  196    HB3  PHE  48           HB1      PHE  48  -5.245   2.036   1.040
  197    HD1  PHE  48           HD1      PHE  48  -5.941   3.952  -0.221
  198    HD2  PHE  48           HD2      PHE  48  -5.813   4.077   4.030
  199    HE1  PHE  48           HE1      PHE  48  -6.147   6.403  -0.290
  200    HE2  PHE  48           HE2      PHE  48  -6.020   6.527   3.969
  201    HZ   PHE  48           HZ       PHE  48  -6.193   7.693   1.812
  202    H    CYS  49           HN       CYS  49  -7.308   0.488  -0.185
  203    HA   CYS  49           HA       CYS  49  -8.817   2.583  -1.464
  204    HB2  CYS  49           HB2      CYS  49  -7.139   1.318  -2.724
  205    HB3  CYS  49           HB1      CYS  49  -8.044  -0.167  -2.456
  206    HG   CYS  49           HG       CYS  49  -9.217   2.505  -4.246
  207    H    LEU  50           HN       LEU  50  -9.458  -0.590  -0.114
  208    HA   LEU  50           HA       LEU  50 -12.065  -0.914  -1.159
  209    HB2  LEU  50           HB2      LEU  50 -10.874  -2.051   1.376
  210    HB3  LEU  50           HB1      LEU  50 -12.332  -2.628   0.574
  211    HG   LEU  50           HG       LEU  50  -9.633  -2.634  -0.768
  212   HD11  LEU  50          HD11      LEU  50  -9.673  -3.988   1.353
  213   HD12  LEU  50          HD12      LEU  50  -9.309  -4.886  -0.120
  214   HD13  LEU  50          HD13      LEU  50 -10.919  -4.984   0.599
  215   HD21  LEU  50          HD21      LEU  50 -11.509  -2.765  -2.280
  216   HD22  LEU  50          HD22      LEU  50 -12.227  -4.063  -1.326
  217   HD23  LEU  50          HD23      LEU  50 -10.714  -4.337  -2.189
  218    H    LEU  51           HN       LEU  51 -10.796   0.742   1.647
  219    HA   LEU  51           HA       LEU  51 -13.382   1.174   2.842
  220    HB2  LEU  51           HB2      LEU  51 -10.655   2.320   3.434
  221    HB3  LEU  51           HB1      LEU  51 -12.094   2.708   4.360
  222    HG   LEU  51           HG       LEU  51 -10.949  -0.072   4.072
  223   HD11  LEU  51          HD11      LEU  51 -10.201   0.212   6.386
  224   HD12  LEU  51          HD12      LEU  51 -10.737   1.892   6.351
  225   HD13  LEU  51          HD13      LEU  51  -9.420   1.364   5.303
  226   HD21  LEU  51          HD21      LEU  51 -13.355  -0.028   4.494
  227   HD22  LEU  51          HD22      LEU  51 -13.097   1.029   5.882
  228   HD23  LEU  51          HD23      LEU  51 -12.472  -0.620   5.901
  229    H    HIS  52           HN       HIS  52 -11.263   2.861   0.653
  230    HA   HIS  52           HA       HIS  52 -12.495   5.421   0.904
  231    HB2  HIS  52           HB2      HIS  52 -10.196   5.139   0.064
  232    HB3  HIS  52           HB1      HIS  52 -10.820   4.301  -1.353
  233    HD1  HIS  52           HD1      HIS  52 -11.950   5.739  -3.180
  234    HD2  HIS  52           HD2      HIS  52 -10.484   7.924   0.037
  235    HE1  HIS  52           HE1      HIS  52 -11.992   8.142  -3.923
  236    HE2  HIS  52           HE2      HIS  52 -11.018   9.435  -1.993
  237    H    PHE  53           HN       PHE  53 -12.952   2.656  -1.239
  238    HA   PHE  53           HA       PHE  53 -15.030   4.082  -2.711
  239    HB2  PHE  53           HB2      PHE  53 -13.664   1.427  -3.118
  240    HB3  PHE  53           HB1      PHE  53 -15.093   1.891  -4.038
  241    HD1  PHE  53           HD1      PHE  53 -14.843   3.054  -6.012
  242    HD2  PHE  53           HD2      PHE  53 -11.683   3.110  -3.164
  243    HE1  PHE  53           HE1      PHE  53 -13.423   4.258  -7.618
  244    HE2  PHE  53           HE2      PHE  53 -10.256   4.317  -4.764
  245    HZ   PHE  53           HZ       PHE  53 -11.125   4.892  -6.995
  246    H    GLY  54           HN       GLY  54 -14.675   1.791  -0.176
  247    HA2  GLY  54           HA2      GLY  54 -16.245   0.855   1.220
  248    HA3  GLY  54           HA1      GLY  54 -17.460   1.827   0.407
  249    H    VAL  55           HN       VAL  55 -15.610  -0.104  -1.693
  250    HA   VAL  55           HA       VAL  55 -17.830  -1.572  -2.585
  251    HB   VAL  55           HB       VAL  55 -15.753  -3.101  -3.466
  252   HG11  VAL  55          HG11      VAL  55 -15.885  -1.757  -5.518
  253   HG12  VAL  55          HG12      VAL  55 -16.749  -0.502  -4.629
  254   HG13  VAL  55          HG13      VAL  55 -17.479  -2.092  -4.843
  255   HG21  VAL  55          HG21      VAL  55 -13.890  -1.658  -4.011
  256   HG22  VAL  55          HG22      VAL  55 -14.123  -1.676  -2.264
  257   HG23  VAL  55          HG23      VAL  55 -14.671  -0.296  -3.212
  258    H    ILE  56           HN       ILE  56 -14.914  -3.168  -1.377
  259    HA   ILE  56           HA       ILE  56 -16.523  -4.763   0.461
  260    HB   ILE  56           HB       ILE  56 -15.242  -6.832  -0.410
  261   HG12  ILE  56          HG12      ILE  56 -15.345  -6.064  -3.140
  262   HG13  ILE  56          HG11      ILE  56 -14.395  -4.846  -2.295
  263   HG21  ILE  56          HG21      ILE  56 -17.037  -7.313  -2.014
  264   HG22  ILE  56          HG22      ILE  56 -17.494  -5.610  -1.997
  265   HG23  ILE  56          HG23      ILE  56 -17.651  -6.580  -0.532
  266   HD11  ILE  56          HD11      ILE  56 -12.913  -6.560  -1.443
  267   HD12  ILE  56          HD12      ILE  56 -13.013  -6.646  -3.201
  268   HD13  ILE  56          HD13      ILE  56 -13.890  -7.811  -2.209
  269    H    GLY  57           HN       GLY  57 -15.454  -3.894   2.206
  270    HA2  GLY  57           HA2      GLY  57 -12.642  -4.734   2.478
  271    HA3  GLY  57           HA1      GLY  57 -13.125  -3.103   2.919
  272    HA   PRO  58           HA       PRO  58 -14.188  -4.213   7.037
  273    HB2  PRO  58           HB2      PRO  58 -17.011  -3.405   6.588
  274    HB3  PRO  58           HB1      PRO  58 -15.860  -2.843   7.804
  275    HG2  PRO  58           HG2      PRO  58 -16.500  -1.307   5.723
  276    HG3  PRO  58           HG1      PRO  58 -14.839  -1.359   6.345
  277    HD2  PRO  58           HD2      PRO  58 -15.995  -2.654   3.912
  278    HD3  PRO  58           HD1      PRO  58 -14.400  -1.909   4.145
  279    H    GLN  59           HN       GLN  59 -16.419  -5.294   4.552
  280    HA   GLN  59           HA       GLN  59 -17.694  -7.168   4.316
  281    HB2  GLN  59           HB2      GLN  59 -15.554  -8.314   6.120
  282    HB3  GLN  59           HB1      GLN  59 -16.719  -9.267   5.212
  283    HG2  GLN  59           HG2      GLN  59 -14.615  -7.456   4.050
  284    HG3  GLN  59           HG1      GLN  59 -14.571  -9.217   4.096
  285   HE21  GLN  59          HE21      GLN  59 -14.457  -7.447   1.807
  286   HE22  GLN  59          HE22      GLN  59 -15.793  -7.868   0.795
  287    H    ARG  60           HN       ARG  60 -19.458  -6.193   5.460
  288    HA   ARG  60           HA       ARG  60 -19.790  -6.680   8.274
  289    HB2  ARG  60           HB2      ARG  60 -20.727  -4.681   7.133
  290    HB3  ARG  60           HB1      ARG  60 -21.822  -5.731   6.245
  291    HG2  ARG  60           HG2      ARG  60 -23.053  -4.804   8.036
  292    HG3  ARG  60           HG1      ARG  60 -22.736  -6.489   8.453
  293    HD2  ARG  60           HD2      ARG  60 -20.850  -5.772   9.855
  294    HD3  ARG  60           HD1      ARG  60 -21.203  -4.092   9.456
  295    HE   ARG  60           HE       ARG  60 -23.415  -5.530  10.620
  296   HH11  ARG  60          HH11      ARG  60 -20.592  -3.583  11.242
  297   HH12  ARG  60          HH12      ARG  60 -21.145  -3.047  12.793
  298   HH21  ARG  60          HH21      ARG  60 -24.152  -4.829  12.657
  299   HH22  ARG  60          HH22      ARG  60 -23.170  -3.757  13.599
  Start of MODEL   19
    1    H1   ARG  28           HT1      ARG  28  20.127   1.106 -10.662
    2    H2   ARG  28           HT2      ARG  28  19.619   2.149 -11.893
    3    H3   ARG  28           HT3      ARG  28  18.543   1.703 -10.667
    4    HA   ARG  28           HA       ARG  28  21.015   3.288 -10.282
    5    HB2  ARG  28           HB2      ARG  28  19.271   4.524 -11.506
    6    HB3  ARG  28           HB1      ARG  28  18.114   4.147 -10.237
    7    HG2  ARG  28           HG2      ARG  28  18.889   6.396  -9.956
    8    HG3  ARG  28           HG1      ARG  28  19.512   5.405  -8.637
    9    HD2  ARG  28           HD2      ARG  28  21.663   5.224  -9.784
   10    HD3  ARG  28           HD1      ARG  28  21.039   6.199 -11.115
   11    HE   ARG  28           HE       ARG  28  20.670   7.787  -8.955
   12   HH11  ARG  28          HH11      ARG  28  23.427   6.059 -10.207
   13   HH12  ARG  28          HH12      ARG  28  24.577   7.212  -9.619
   14   HH21  ARG  28          HH21      ARG  28  22.176   9.310  -8.182
   15   HH22  ARG  28          HH22      ARG  28  23.866   9.064  -8.470
   16    H    ARG  29           HN       ARG  29  17.846   2.587  -8.800
   17    HA   ARG  29           HA       ARG  29  19.178   2.531  -6.179
   18    HB2  ARG  29           HB2      ARG  29  17.327   4.170  -6.496
   19    HB3  ARG  29           HB1      ARG  29  16.232   2.828  -6.792
   20    HG2  ARG  29           HG2      ARG  29  15.881   3.419  -4.559
   21    HG3  ARG  29           HG1      ARG  29  16.896   1.979  -4.491
   22    HD2  ARG  29           HD2      ARG  29  17.983   4.785  -4.366
   23    HD3  ARG  29           HD1      ARG  29  17.546   3.852  -2.935
   24    HE   ARG  29           HE       ARG  29  19.234   2.178  -4.111
   25   HH11  ARG  29          HH11      ARG  29  19.478   5.622  -3.628
   26   HH12  ARG  29          HH12      ARG  29  21.207   5.613  -3.518
   27   HH21  ARG  29          HH21      ARG  29  21.510   2.158  -3.961
   28   HH22  ARG  29          HH22      ARG  29  22.361   3.644  -3.705
   29    H    CYS  30           HN       CYS  30  18.906   0.802  -4.791
   30    HA   CYS  30           HA       CYS  30  18.639  -1.745  -5.912
   31    HB2  CYS  30           HB2      CYS  30  18.392  -0.902  -3.018
   32    HB3  CYS  30           HB1      CYS  30  18.611  -2.559  -3.573
   33    HG   CYS  30           HG       CYS  30  21.073  -1.416  -4.982
   34    H    LEU  31           HN       LEU  31  16.948  -2.987  -6.364
   35    HA   LEU  31           HA       LEU  31  14.289  -1.986  -5.994
   36    HB2  LEU  31           HB2      LEU  31  15.063  -3.233  -8.008
   37    HB3  LEU  31           HB1      LEU  31  15.184  -4.677  -7.024
   38    HG   LEU  31           HG       LEU  31  12.553  -3.296  -7.073
   39   HD11  LEU  31          HD11      LEU  31  11.929  -4.385  -9.165
   40   HD12  LEU  31          HD12      LEU  31  13.587  -4.948  -9.374
   41   HD13  LEU  31          HD13      LEU  31  13.230  -3.222  -9.418
   42   HD21  LEU  31          HD21      LEU  31  12.877  -5.291  -5.723
   43   HD22  LEU  31          HD22      LEU  31  13.427  -6.183  -7.140
   44   HD23  LEU  31          HD23      LEU  31  11.759  -5.621  -7.045
   45    H    PHE  32           HN       PHE  32  16.349  -4.239  -4.349
   46    HA   PHE  32           HA       PHE  32  14.202  -5.515  -2.903
   47    HB2  PHE  32           HB2      PHE  32  16.310  -6.702  -3.489
   48    HB3  PHE  32           HB1      PHE  32  17.181  -5.635  -2.394
   49    HD1  PHE  32           HD1      PHE  32  14.754  -8.378  -2.623
   50    HD2  PHE  32           HD2      PHE  32  17.058  -5.921  -0.022
   51    HE1  PHE  32           HE1      PHE  32  14.273  -9.908  -0.758
   52    HE2  PHE  32           HE2      PHE  32  16.582  -7.446   1.848
   53    HZ   PHE  32           HZ       PHE  32  15.185  -9.448   1.477
   54    H    LEU  33           HN       LEU  33  16.450  -2.884  -2.399
   55    HA   LEU  33           HA       LEU  33  15.868  -2.646   0.415
   56    HB2  LEU  33           HB2      LEU  33  17.399  -0.905  -1.499
   57    HB3  LEU  33           HB1      LEU  33  17.184  -0.514   0.196
   58    HG   LEU  33           HG       LEU  33  18.636  -2.914  -0.919
   59   HD11  LEU  33          HD11      LEU  33  19.877  -0.848  -1.118
   60   HD12  LEU  33          HD12      LEU  33  20.581  -1.863   0.142
   61   HD13  LEU  33          HD13      LEU  33  19.576  -0.483   0.580
   62   HD21  LEU  33          HD21      LEU  33  17.476  -3.533   1.126
   63   HD22  LEU  33          HD22      LEU  33  18.127  -2.114   1.947
   64   HD23  LEU  33          HD23      LEU  33  19.210  -3.403   1.422
   65    H    SER  34           HN       SER  34  15.022  -0.889  -2.544
   66    HA   SER  34           HA       SER  34  13.542   1.153  -1.276
   67    HB2  SER  34           HB2      SER  34  12.612   1.599  -3.507
   68    HB3  SER  34           HB1      SER  34  14.355   1.348  -3.592
   69    HG   SER  34           HG       SER  34  12.964  -0.972  -3.874
   70    H    LEU  35           HN       LEU  35  12.731  -2.079  -2.345
   71    HA   LEU  35           HA       LEU  35   9.921  -1.854  -2.212
   72    HB2  LEU  35           HB2      LEU  35  11.126  -3.684  -3.355
   73    HB3  LEU  35           HB1      LEU  35  11.638  -4.299  -1.795
   74    HG   LEU  35           HG       LEU  35   9.278  -4.714  -1.198
   75   HD11  LEU  35          HD11      LEU  35   7.559  -4.590  -2.936
   76   HD12  LEU  35          HD12      LEU  35   8.726  -3.856  -4.035
   77   HD13  LEU  35          HD13      LEU  35   8.233  -3.001  -2.574
   78   HD21  LEU  35          HD21      LEU  35   8.938  -6.611  -2.709
   79   HD22  LEU  35          HD22      LEU  35  10.615  -6.496  -2.172
   80   HD23  LEU  35          HD23      LEU  35  10.169  -5.962  -3.792
   81    H    PHE  36           HN       PHE  36  12.313  -1.986   0.220
   82    HA   PHE  36           HA       PHE  36  10.981  -3.267   2.310
   83    HB2  PHE  36           HB2      PHE  36  13.382  -2.554   2.320
   84    HB3  PHE  36           HB1      PHE  36  12.842  -0.896   2.562
   85    HD1  PHE  36           HD1      PHE  36  13.181  -4.202   4.093
   86    HD2  PHE  36           HD2      PHE  36  11.972  -0.165   4.685
   87    HE1  PHE  36           HE1      PHE  36  13.146  -4.573   6.526
   88    HE2  PHE  36           HE2      PHE  36  11.935  -0.528   7.118
   89    HZ   PHE  36           HZ       PHE  36  12.524  -2.734   8.041
   90    H    SER  37           HN       SER  37  10.558  -0.089   0.955
   91    HA   SER  37           HA       SER  37   8.753   0.663   3.141
   92    HB2  SER  37           HB2      SER  37   9.868   2.330   0.873
   93    HB3  SER  37           HB1      SER  37   8.840   2.931   2.174
   94    HG   SER  37           HG       SER  37  11.310   3.041   2.305
   95    H    PHE  38           HN       PHE  38   8.838   0.207  -0.364
   96    HA   PHE  38           HA       PHE  38   6.216   1.050  -0.913
   97    HB2  PHE  38           HB2      PHE  38   7.947  -0.961  -2.349
   98    HB3  PHE  38           HB1      PHE  38   6.436  -0.323  -2.986
   99    HD1  PHE  38           HD1      PHE  38   6.440   2.443  -2.637
  100    HD2  PHE  38           HD2      PHE  38   9.783  -0.077  -3.402
  101    HE1  PHE  38           HE1      PHE  38   7.650   4.350  -3.615
  102    HE2  PHE  38           HE2      PHE  38  10.998   1.825  -4.383
  103    HZ   PHE  38           HZ       PHE  38   9.938   4.034  -4.496
  104    H    LEU  39           HN       LEU  39   7.423  -1.829   0.540
  105    HA   LEU  39           HA       LEU  39   5.177  -3.494  -0.057
  106    HB2  LEU  39           HB2      LEU  39   7.550  -4.201   0.619
  107    HB3  LEU  39           HB1      LEU  39   7.051  -3.863   2.264
  108    HG   LEU  39           HG       LEU  39   5.415  -5.717   0.590
  109   HD11  LEU  39          HD11      LEU  39   7.911  -6.501   2.087
  110   HD12  LEU  39          HD12      LEU  39   7.735  -6.469   0.332
  111   HD13  LEU  39          HD13      LEU  39   6.779  -7.598   1.294
  112   HD21  LEU  39          HD21      LEU  39   6.042  -5.544   3.536
  113   HD22  LEU  39          HD22      LEU  39   5.001  -6.754   2.785
  114   HD23  LEU  39          HD23      LEU  39   4.541  -5.052   2.751
  115    H    ILE  40           HN       ILE  40   6.120  -1.433   2.645
  116    HA   ILE  40           HA       ILE  40   3.933  -2.162   4.322
  117    HB   ILE  40           HB       ILE  40   5.594   0.359   4.415
  118   HG12  ILE  40          HG12      ILE  40   6.009  -2.245   5.903
  119   HG13  ILE  40          HG11      ILE  40   6.945  -1.744   4.498
  120   HG21  ILE  40          HG21      ILE  40   3.486   0.430   5.694
  121   HG22  ILE  40          HG22      ILE  40   4.910   0.490   6.733
  122   HG23  ILE  40          HG23      ILE  40   3.996  -1.009   6.577
  123   HD11  ILE  40          HD11      ILE  40   6.840  -0.351   7.164
  124   HD12  ILE  40          HD12      ILE  40   7.736   0.213   5.754
  125   HD13  ILE  40          HD13      ILE  40   8.174  -1.312   6.526
  126    H    VAL  41           HN       VAL  41   4.493   0.328   1.911
  127    HA   VAL  41           HA       VAL  41   2.113   1.802   2.505
  128    HB   VAL  41           HB       VAL  41   4.241   2.671   1.354
  129   HG11  VAL  41          HG11      VAL  41   4.212   2.581  -1.087
  130   HG12  VAL  41          HG12      VAL  41   2.829   1.491  -1.025
  131   HG13  VAL  41          HG13      VAL  41   4.381   0.981  -0.369
  132   HG21  VAL  41          HG21      VAL  41   2.238   4.019   1.673
  133   HG22  VAL  41          HG22      VAL  41   1.529   3.333   0.211
  134   HG23  VAL  41          HG23      VAL  41   2.968   4.348   0.101
  135    H    LEU  42           HN       LEU  42   2.870  -0.958   0.578
  136    HA   LEU  42           HA       LEU  42   0.555  -0.741  -1.131
  137    HB2  LEU  42           HB2      LEU  42   2.899  -1.965  -1.474
  138    HB3  LEU  42           HB1      LEU  42   2.008  -3.317  -0.788
  139    HG   LEU  42           HG       LEU  42   1.982  -3.410  -3.218
  140   HD11  LEU  42          HD11      LEU  42  -0.715  -2.673  -2.094
  141   HD12  LEU  42          HD12      LEU  42   0.039  -4.266  -2.027
  142   HD13  LEU  42          HD13      LEU  42  -0.424  -3.575  -3.583
  143   HD21  LEU  42          HD21      LEU  42   0.842  -1.692  -4.537
  144   HD22  LEU  42          HD22      LEU  42   2.251  -1.043  -3.700
  145   HD23  LEU  42          HD23      LEU  42   0.631  -0.717  -3.083
  146    H    LEU  43           HN       LEU  43   1.576  -2.997   1.437
  147    HA   LEU  43           HA       LEU  43  -0.671  -4.559   1.613
  148    HB2  LEU  43           HB2      LEU  43   1.415  -4.920   2.878
  149    HB3  LEU  43           HB1      LEU  43   1.001  -3.576   3.925
  150    HG   LEU  43           HG       LEU  43  -1.039  -4.826   4.638
  151   HD11  LEU  43          HD11      LEU  43  -1.167  -7.216   4.162
  152   HD12  LEU  43          HD12      LEU  43   0.230  -7.084   3.095
  153   HD13  LEU  43          HD13      LEU  43  -1.275  -6.262   2.683
  154   HD21  LEU  43          HD21      LEU  43   0.977  -4.846   5.999
  155   HD22  LEU  43          HD22      LEU  43   1.602  -6.214   5.079
  156   HD23  LEU  43          HD23      LEU  43   0.160  -6.406   6.075
  157    H    LEU  44           HN       LEU  44  -0.215  -1.304   2.864
  158    HA   LEU  44           HA       LEU  44  -2.677  -1.340   4.365
  159    HB2  LEU  44           HB2      LEU  44  -0.860   0.951   3.625
  160    HB3  LEU  44           HB1      LEU  44  -2.221   1.060   4.725
  161    HG   LEU  44           HG       LEU  44   0.281  -0.577   5.154
  162   HD11  LEU  44          HD11      LEU  44   0.680   1.794   5.411
  163   HD12  LEU  44          HD12      LEU  44   0.672   1.012   6.993
  164   HD13  LEU  44          HD13      LEU  44  -0.729   1.943   6.462
  165   HD21  LEU  44          HD21      LEU  44  -1.648  -1.688   6.129
  166   HD22  LEU  44          HD22      LEU  44  -2.134  -0.189   6.921
  167   HD23  LEU  44          HD23      LEU  44  -0.638  -0.993   7.396
  168    H    THR  45           HN       THR  45  -1.551   0.336   1.425
  169    HA   THR  45           HA       THR  45  -3.936   1.660   0.839
  170    HB   THR  45           HB       THR  45  -3.106   1.667  -1.549
  171    HG1  THR  45           HG1      THR  45  -0.683   0.967  -1.381
  172   HG21  THR  45          HG21      THR  45  -2.564   3.478  -0.033
  173   HG22  THR  45          HG22      THR  45  -1.162   3.107  -1.036
  174   HG23  THR  45          HG23      THR  45  -1.222   2.552   0.637
  175    H    THR  46           HN       THR  46  -3.126  -1.682   0.455
  176    HA   THR  46           HA       THR  46  -4.854  -2.372  -1.643
  177    HB   THR  46           HB       THR  46  -4.090  -4.085   0.729
  178    HG1  THR  46           HG1      THR  46  -2.407  -4.786  -0.659
  179   HG21  THR  46          HG21      THR  46  -5.001  -4.884  -2.039
  180   HG22  THR  46          HG22      THR  46  -6.002  -4.946  -0.589
  181   HG23  THR  46          HG23      THR  46  -4.573  -5.972  -0.719
  182    H    LEU  47           HN       LEU  47  -5.432  -2.764   1.866
  183    HA   LEU  47           HA       LEU  47  -8.225  -3.235   1.446
  184    HB2  LEU  47           HB2      LEU  47  -6.354  -3.175   3.746
  185    HB3  LEU  47           HB1      LEU  47  -8.053  -2.938   4.083
  186    HG   LEU  47           HG       LEU  47  -8.558  -5.095   2.992
  187   HD11  LEU  47          HD11      LEU  47  -6.735  -6.624   2.447
  188   HD12  LEU  47          HD12      LEU  47  -5.562  -5.354   2.801
  189   HD13  LEU  47          HD13      LEU  47  -6.678  -5.171   1.448
  190   HD21  LEU  47          HD21      LEU  47  -6.499  -5.228   5.190
  191   HD22  LEU  47          HD22      LEU  47  -7.612  -6.522   4.746
  192   HD23  LEU  47          HD23      LEU  47  -8.235  -5.006   5.398
  193    H    PHE  48           HN       PHE  48  -6.221  -0.525   2.399
  194    HA   PHE  48           HA       PHE  48  -8.279   1.090   3.471
  195    HB2  PHE  48           HB2      PHE  48  -5.948   1.546   3.970
  196    HB3  PHE  48           HB1      PHE  48  -5.609   1.860   2.272
  197    HD1  PHE  48           HD1      PHE  48  -5.823   4.010   1.405
  198    HD2  PHE  48           HD2      PHE  48  -7.606   3.078   5.155
  199    HE1  PHE  48           HE1      PHE  48  -6.348   6.390   1.742
  200    HE2  PHE  48           HE2      PHE  48  -8.136   5.456   5.499
  201    HZ   PHE  48           HZ       PHE  48  -7.506   7.115   3.791
  202    H    CYS  49           HN       CYS  49  -7.200   0.493   0.201
  203    HA   CYS  49           HA       CYS  49  -8.617   2.760  -0.888
  204    HB2  CYS  49           HB2      CYS  49  -6.581   1.957  -1.985
  205    HB3  CYS  49           HB1      CYS  49  -7.339   0.395  -2.274
  206    HG   CYS  49           HG       CYS  49  -7.754   3.315  -3.908
  207    H    LEU  50           HN       LEU  50  -9.060  -0.763  -0.868
  208    HA   LEU  50           HA       LEU  50 -11.368  -0.895  -2.418
  209    HB2  LEU  50           HB2      LEU  50 -10.601  -2.625  -0.060
  210    HB3  LEU  50           HB1      LEU  50 -11.811  -3.032  -1.274
  211    HG   LEU  50           HG       LEU  50  -8.922  -2.540  -1.977
  212   HD11  LEU  50          HD11      LEU  50 -10.220  -5.206  -1.440
  213   HD12  LEU  50          HD12      LEU  50  -9.121  -4.386  -0.331
  214   HD13  LEU  50          HD13      LEU  50  -8.546  -4.910  -1.914
  215   HD21  LEU  50          HD21      LEU  50  -9.505  -3.808  -3.981
  216   HD22  LEU  50          HD22      LEU  50 -10.523  -2.378  -3.805
  217   HD23  LEU  50          HD23      LEU  50 -11.162  -3.970  -3.399
  218    H    LEU  51           HN       LEU  51 -10.943  -0.121   0.973
  219    HA   LEU  51           HA       LEU  51 -13.766  -0.127   1.549
  220    HB2  LEU  51           HB2      LEU  51 -11.395   0.841   3.143
  221    HB3  LEU  51           HB1      LEU  51 -13.041   0.793   3.745
  222    HG   LEU  51           HG       LEU  51 -11.461  -1.626   2.868
  223   HD11  LEU  51          HD11      LEU  51 -12.122  -0.632   5.637
  224   HD12  LEU  51          HD12      LEU  51 -10.524  -0.635   4.888
  225   HD13  LEU  51          HD13      LEU  51 -11.332  -2.160   5.248
  226   HD21  LEU  51          HD21      LEU  51 -13.275  -2.889   3.926
  227   HD22  LEU  51          HD22      LEU  51 -13.860  -1.909   2.581
  228   HD23  LEU  51          HD23      LEU  51 -14.135  -1.382   4.241
  229    H    HIS  52           HN       HIS  52 -11.262   2.333   1.043
  230    HA   HIS  52           HA       HIS  52 -12.956   4.548   1.585
  231    HB2  HIS  52           HB2      HIS  52 -10.541   4.744   1.774
  232    HB3  HIS  52           HB1      HIS  52 -10.351   4.391   0.061
  233    HD1  HIS  52           HD1      HIS  52 -10.182   6.374  -1.415
  234    HD2  HIS  52           HD2      HIS  52 -12.049   7.274   2.187
  235    HE1  HIS  52           HE1      HIS  52 -10.560   8.860  -1.457
  236    HE2  HIS  52           HE2      HIS  52 -11.731   9.376   0.713
  237    H    PHE  53           HN       PHE  53 -11.596   3.429  -1.530
  238    HA   PHE  53           HA       PHE  53 -13.160   5.150  -3.107
  239    HB2  PHE  53           HB2      PHE  53 -11.034   3.707  -3.676
  240    HB3  PHE  53           HB1      PHE  53 -12.229   2.517  -4.178
  241    HD1  PHE  53           HD1      PHE  53 -13.565   2.847  -6.143
  242    HD2  PHE  53           HD2      PHE  53 -10.826   5.834  -4.844
  243    HE1  PHE  53           HE1      PHE  53 -13.780   3.985  -8.315
  244    HE2  PHE  53           HE2      PHE  53 -11.037   6.978  -7.012
  245    HZ   PHE  53           HZ       PHE  53 -12.516   6.052  -8.751
  246    H    GLY  54           HN       GLY  54 -13.854   2.069  -1.672
  247    HA2  GLY  54           HA2      GLY  54 -15.798   0.856  -1.549
  248    HA3  GLY  54           HA1      GLY  54 -16.626   2.298  -2.115
  249    H    VAL  55           HN       VAL  55 -14.116   0.935  -4.078
  250    HA   VAL  55           HA       VAL  55 -15.713   0.714  -6.341
  251    HB   VAL  55           HB       VAL  55 -13.325   0.841  -6.560
  252   HG11  VAL  55          HG11      VAL  55 -12.670  -0.355  -4.554
  253   HG12  VAL  55          HG12      VAL  55 -11.848  -1.015  -5.968
  254   HG13  VAL  55          HG13      VAL  55 -13.214  -1.872  -5.264
  255   HG21  VAL  55          HG21      VAL  55 -14.472  -0.207  -8.400
  256   HG22  VAL  55          HG22      VAL  55 -14.400  -1.775  -7.597
  257   HG23  VAL  55          HG23      VAL  55 -12.917  -1.003  -8.156
  258    H    ILE  56           HN       ILE  56 -14.752  -1.809  -4.049
  259    HA   ILE  56           HA       ILE  56 -17.155  -3.278  -4.529
  260    HB   ILE  56           HB       ILE  56 -15.547  -5.403  -5.011
  261   HG12  ILE  56          HG12      ILE  56 -14.170  -4.633  -7.047
  262   HG13  ILE  56          HG11      ILE  56 -14.301  -3.019  -6.364
  263   HG21  ILE  56          HG21      ILE  56 -16.423  -5.365  -7.274
  264   HG22  ILE  56          HG22      ILE  56 -16.821  -3.655  -7.107
  265   HG23  ILE  56          HG23      ILE  56 -17.654  -4.855  -6.119
  266   HD11  ILE  56          HD11      ILE  56 -13.110  -5.394  -4.956
  267   HD12  ILE  56          HD12      ILE  56 -13.162  -3.733  -4.364
  268   HD13  ILE  56          HD13      ILE  56 -12.199  -4.131  -5.786
  269    H    GLY  57           HN       GLY  57 -17.589  -3.421  -2.401
  270    HA2  GLY  57           HA2      GLY  57 -15.496  -4.453  -0.611
  271    HA3  GLY  57           HA1      GLY  57 -16.958  -3.620  -0.103
  272    HA   PRO  58           HA       PRO  58 -19.098  -7.406   0.600
  273    HB2  PRO  58           HB2      PRO  58 -21.299  -6.628  -1.213
  274    HB3  PRO  58           HB1      PRO  58 -21.334  -6.948   0.524
  275    HG2  PRO  58           HG2      PRO  58 -21.574  -4.463  -0.431
  276    HG3  PRO  58           HG1      PRO  58 -20.686  -4.793   1.068
  277    HD2  PRO  58           HD2      PRO  58 -19.630  -4.258  -1.685
  278    HD3  PRO  58           HD1      PRO  58 -19.041  -3.666  -0.117
  279    H    GLN  59           HN       GLN  59 -20.448  -9.187  -0.627
  280    HA   GLN  59           HA       GLN  59 -18.881  -9.889  -3.000
  281    HB2  GLN  59           HB2      GLN  59 -20.654 -11.606  -1.253
  282    HB3  GLN  59           HB1      GLN  59 -19.693 -12.183  -2.607
  283    HG2  GLN  59           HG2      GLN  59 -18.590 -10.906  -0.116
  284    HG3  GLN  59           HG1      GLN  59 -18.645 -12.639  -0.441
  285   HE21  GLN  59          HE21      GLN  59 -17.160  -9.608  -1.277
  286   HE22  GLN  59          HE22      GLN  59 -15.824 -10.273  -2.148
  287    H    ARG  60           HN       ARG  60 -20.070  -8.477  -4.410
  288    HA   ARG  60           HA       ARG  60 -22.714  -9.553  -5.144
  289    HB2  ARG  60           HB2      ARG  60 -22.859  -7.287  -4.162
  290    HB3  ARG  60           HB1      ARG  60 -21.770  -6.692  -5.406
  291    HG2  ARG  60           HG2      ARG  60 -24.013  -6.115  -5.998
  292    HG3  ARG  60           HG1      ARG  60 -23.433  -7.350  -7.117
  293    HD2  ARG  60           HD2      ARG  60 -24.654  -9.060  -5.932
  294    HD3  ARG  60           HD1      ARG  60 -25.137  -7.905  -4.691
  295    HE   ARG  60           HE       ARG  60 -25.987  -7.046  -7.257
  296   HH11  ARG  60          HH11      ARG  60 -26.721  -9.342  -4.738
  297   HH12  ARG  60          HH12      ARG  60 -28.404  -9.433  -5.134
  298   HH21  ARG  60          HH21      ARG  60 -28.202  -7.161  -7.787
  299   HH22  ARG  60          HH22      ARG  60 -29.248  -8.192  -6.867
  Start of MODEL   20
    1    H1   ARG  28           HT1      ARG  28  24.588   0.653  -5.238
    2    H2   ARG  28           HT2      ARG  28  24.471  -0.815  -6.069
    3    H3   ARG  28           HT3      ARG  28  25.915   0.065  -6.109
    4    HA   ARG  28           HA       ARG  28  26.108  -1.813  -4.626
    5    HB2  ARG  28           HB2      ARG  28  27.333   0.290  -4.154
    6    HB3  ARG  28           HB1      ARG  28  25.993   0.826  -3.151
    7    HG2  ARG  28           HG2      ARG  28  27.688  -0.001  -1.710
    8    HG3  ARG  28           HG1      ARG  28  26.372  -1.178  -1.708
    9    HD2  ARG  28           HD2      ARG  28  27.608  -2.542  -3.332
   10    HD3  ARG  28           HD1      ARG  28  28.925  -1.370  -3.305
   11    HE   ARG  28           HE       ARG  28  28.179  -2.570  -0.761
   12   HH11  ARG  28          HH11      ARG  28  30.353  -2.514  -3.485
   13   HH12  ARG  28          HH12      ARG  28  31.610  -3.377  -2.663
   14   HH21  ARG  28          HH21      ARG  28  29.829  -3.704   0.329
   15   HH22  ARG  28          HH22      ARG  28  31.311  -4.053  -0.495
   16    H    ARG  29           HN       ARG  29  23.414   0.321  -3.899
   17    HA   ARG  29           HA       ARG  29  22.523  -1.074  -1.588
   18    HB2  ARG  29           HB2      ARG  29  21.912   1.267  -2.070
   19    HB3  ARG  29           HB1      ARG  29  20.973   0.730  -3.457
   20    HG2  ARG  29           HG2      ARG  29  19.461  -0.481  -2.003
   21    HG3  ARG  29           HG1      ARG  29  20.429  -0.037  -0.596
   22    HD2  ARG  29           HD2      ARG  29  18.483   1.402  -0.771
   23    HD3  ARG  29           HD1      ARG  29  19.958   2.330  -1.031
   24    HE   ARG  29           HE       ARG  29  18.752   1.382  -3.458
   25   HH11  ARG  29          HH11      ARG  29  18.769   3.925  -1.076
   26   HH12  ARG  29          HH12      ARG  29  18.124   5.116  -2.155
   27   HH21  ARG  29          HH21      ARG  29  17.900   2.944  -4.885
   28   HH22  ARG  29          HH22      ARG  29  17.629   4.559  -4.320
   29    H    CYS  30           HN       CYS  30  20.896  -2.580  -1.340
   30    HA   CYS  30           HA       CYS  30  20.501  -4.363  -3.561
   31    HB2  CYS  30           HB2      CYS  30  19.410  -4.432  -0.741
   32    HB3  CYS  30           HB1      CYS  30  19.240  -5.729  -1.918
   33    HG   CYS  30           HG       CYS  30  21.615  -6.767  -1.670
   34    H    LEU  31           HN       LEU  31  18.553  -4.931  -4.531
   35    HA   LEU  31           HA       LEU  31  16.654  -2.783  -4.764
   36    HB2  LEU  31           HB2      LEU  31  16.648  -5.529  -6.017
   37    HB3  LEU  31           HB1      LEU  31  15.600  -4.198  -6.467
   38    HG   LEU  31           HG       LEU  31  18.606  -4.171  -6.739
   39   HD11  LEU  31          HD11      LEU  31  18.210  -4.420  -9.132
   40   HD12  LEU  31          HD12      LEU  31  16.479  -4.583  -8.835
   41   HD13  LEU  31          HD13      LEU  31  17.596  -5.810  -8.237
   42   HD21  LEU  31          HD21      LEU  31  17.643  -1.953  -6.448
   43   HD22  LEU  31          HD22      LEU  31  16.487  -2.273  -7.742
   44   HD23  LEU  31          HD23      LEU  31  18.211  -2.175  -8.104
   45    H    PHE  32           HN       PHE  32  16.898  -5.696  -2.961
   46    HA   PHE  32           HA       PHE  32  14.066  -6.019  -2.535
   47    HB2  PHE  32           HB2      PHE  32  16.430  -7.283  -1.130
   48    HB3  PHE  32           HB1      PHE  32  14.749  -7.752  -0.904
   49    HD1  PHE  32           HD1      PHE  32  13.493  -8.759  -2.808
   50    HD2  PHE  32           HD2      PHE  32  17.690  -8.073  -2.955
   51    HE1  PHE  32           HE1      PHE  32  13.681 -10.337  -4.686
   52    HE2  PHE  32           HE2      PHE  32  17.886  -9.648  -4.835
   53    HZ   PHE  32           HZ       PHE  32  15.871 -10.777  -5.709
   54    H    LEU  33           HN       LEU  33  16.699  -4.349  -1.023
   55    HA   LEU  33           HA       LEU  33  15.410  -3.948   1.502
   56    HB2  LEU  33           HB2      LEU  33  17.818  -2.725   0.193
   57    HB3  LEU  33           HB1      LEU  33  17.231  -2.186   1.756
   58    HG   LEU  33           HG       LEU  33  18.176  -4.977   1.095
   59   HD11  LEU  33          HD11      LEU  33  20.025  -4.425   2.607
   60   HD12  LEU  33          HD12      LEU  33  19.412  -2.777   2.731
   61   HD13  LEU  33          HD13      LEU  33  19.993  -3.386   1.183
   62   HD21  LEU  33          HD21      LEU  33  16.413  -5.022   2.768
   63   HD22  LEU  33          HD22      LEU  33  17.246  -3.779   3.704
   64   HD23  LEU  33          HD23      LEU  33  17.974  -5.374   3.512
   65    H    SER  34           HN       SER  34  15.725  -2.115  -1.486
   66    HA   SER  34           HA       SER  34  14.594   0.293  -0.497
   67    HB2  SER  34           HB2      SER  34  14.748  -0.740  -3.340
   68    HB3  SER  34           HB1      SER  34  14.370   0.918  -2.871
   69    HG   SER  34           HG       SER  34  16.442   1.212  -2.900
   70    H    LEU  35           HN       LEU  35  13.258  -2.709  -1.488
   71    HA   LEU  35           HA       LEU  35  10.633  -1.671  -2.091
   72    HB2  LEU  35           HB2      LEU  35  11.579  -3.691  -3.185
   73    HB3  LEU  35           HB1      LEU  35  11.512  -4.521  -1.641
   74    HG   LEU  35           HG       LEU  35   9.041  -4.224  -1.635
   75   HD11  LEU  35          HD11      LEU  35   9.478  -3.237  -4.450
   76   HD12  LEU  35          HD12      LEU  35   8.929  -2.260  -3.089
   77   HD13  LEU  35          HD13      LEU  35   7.921  -3.574  -3.695
   78   HD21  LEU  35          HD21      LEU  35  10.195  -5.642  -4.030
   79   HD22  LEU  35          HD22      LEU  35   8.600  -5.926  -3.334
   80   HD23  LEU  35          HD23      LEU  35  10.048  -6.301  -2.401
   81    H    PHE  36           HN       PHE  36  12.341  -2.410   0.719
   82    HA   PHE  36           HA       PHE  36  10.389  -3.528   2.378
   83    HB2  PHE  36           HB2      PHE  36  12.781  -3.381   2.965
   84    HB3  PHE  36           HB1      PHE  36  12.622  -1.637   3.145
   85    HD1  PHE  36           HD1      PHE  36  11.380  -4.866   4.487
   86    HD2  PHE  36           HD2      PHE  36  11.981  -0.710   5.180
   87    HE1  PHE  36           HE1      PHE  36  10.754  -5.172   6.848
   88    HE2  PHE  36           HE2      PHE  36  11.357  -1.009   7.541
   89    HZ   PHE  36           HZ       PHE  36  10.734  -3.247   8.374
   90    H    SER  37           HN       SER  37  10.694  -0.321   1.142
   91    HA   SER  37           HA       SER  37   8.911   0.801   3.156
   92    HB2  SER  37           HB2      SER  37  10.220   2.096   0.755
   93    HB3  SER  37           HB1      SER  37   9.283   2.939   1.987
   94    HG   SER  37           HG       SER  37  11.852   2.385   2.028
   95    H    PHE  38           HN       PHE  38   8.972   0.457  -0.393
   96    HA   PHE  38           HA       PHE  38   6.363   1.373  -0.852
   97    HB2  PHE  38           HB2      PHE  38   7.897  -0.648  -2.488
   98    HB3  PHE  38           HB1      PHE  38   6.551   0.340  -3.044
   99    HD1  PHE  38           HD1      PHE  38   6.868   2.886  -2.994
  100    HD2  PHE  38           HD2      PHE  38  10.080   0.106  -2.734
  101    HE1  PHE  38           HE1      PHE  38   8.439   4.639  -3.710
  102    HE2  PHE  38           HE2      PHE  38  11.657   1.856  -3.445
  103    HZ   PHE  38           HZ       PHE  38  10.837   4.126  -3.935
  104    H    LEU  39           HN       LEU  39   7.497  -1.592   0.436
  105    HA   LEU  39           HA       LEU  39   5.254  -3.201  -0.306
  106    HB2  LEU  39           HB2      LEU  39   7.566  -4.016   0.339
  107    HB3  LEU  39           HB1      LEU  39   7.133  -3.673   2.002
  108    HG   LEU  39           HG       LEU  39   5.347  -5.438   0.406
  109   HD11  LEU  39          HD11      LEU  39   6.701  -7.389   0.976
  110   HD12  LEU  39          HD12      LEU  39   7.950  -6.332   1.637
  111   HD13  LEU  39          HD13      LEU  39   7.578  -6.287  -0.087
  112   HD21  LEU  39          HD21      LEU  39   6.228  -5.383   3.290
  113   HD22  LEU  39          HD22      LEU  39   5.076  -6.526   2.598
  114   HD23  LEU  39          HD23      LEU  39   4.688  -4.808   2.655
  115    H    ILE  40           HN       ILE  40   6.044  -1.087   2.352
  116    HA   ILE  40           HA       ILE  40   3.847  -1.936   4.008
  117    HB   ILE  40           HB       ILE  40   5.505   0.578   4.245
  118   HG12  ILE  40          HG12      ILE  40   5.938  -2.034   5.700
  119   HG13  ILE  40          HG11      ILE  40   6.811  -1.602   4.233
  120   HG21  ILE  40          HG21      ILE  40   3.845  -0.911   6.275
  121   HG22  ILE  40          HG22      ILE  40   3.416   0.618   5.509
  122   HG23  ILE  40          HG23      ILE  40   4.811   0.532   6.586
  123   HD11  ILE  40          HD11      ILE  40   8.111  -1.141   6.243
  124   HD12  ILE  40          HD12      ILE  40   6.847  -0.048   6.811
  125   HD13  ILE  40          HD13      ILE  40   7.755   0.337   5.347
  126    H    VAL  41           HN       VAL  41   4.469   0.584   1.656
  127    HA   VAL  41           HA       VAL  41   2.094   2.077   2.251
  128    HB   VAL  41           HB       VAL  41   4.225   3.008   1.208
  129   HG11  VAL  41          HG11      VAL  41   2.987   1.864  -1.285
  130   HG12  VAL  41          HG12      VAL  41   4.467   1.296  -0.517
  131   HG13  VAL  41          HG13      VAL  41   4.399   2.918  -1.207
  132   HG21  VAL  41          HG21      VAL  41   2.987   4.659  -0.122
  133   HG22  VAL  41          HG22      VAL  41   2.176   4.308   1.406
  134   HG23  VAL  41          HG23      VAL  41   1.570   3.609  -0.096
  135    H    LEU  42           HN       LEU  42   2.914  -0.572   0.168
  136    HA   LEU  42           HA       LEU  42   0.577  -0.287  -1.505
  137    HB2  LEU  42           HB2      LEU  42   2.852  -1.287  -2.163
  138    HB3  LEU  42           HB1      LEU  42   2.320  -2.728  -1.306
  139    HG   LEU  42           HG       LEU  42   0.662  -1.544  -3.517
  140   HD11  LEU  42          HD11      LEU  42   2.895  -3.548  -3.810
  141   HD12  LEU  42          HD12      LEU  42   2.896  -1.897  -4.429
  142   HD13  LEU  42          HD13      LEU  42   1.754  -3.078  -5.070
  143   HD21  LEU  42          HD21      LEU  42  -0.416  -3.202  -2.107
  144   HD22  LEU  42          HD22      LEU  42   0.922  -4.321  -2.366
  145   HD23  LEU  42          HD23      LEU  42  -0.121  -3.865  -3.714
  146    H    LEU  43           HN       LEU  43   1.669  -2.493   1.052
  147    HA   LEU  43           HA       LEU  43  -0.480  -4.243   1.088
  148    HB2  LEU  43           HB2      LEU  43   1.790  -4.028   2.505
  149    HB3  LEU  43           HB1      LEU  43   0.663  -3.423   3.701
  150    HG   LEU  43           HG       LEU  43   1.072  -5.793   4.033
  151   HD11  LEU  43          HD11      LEU  43  -1.219  -6.599   4.050
  152   HD12  LEU  43          HD12      LEU  43  -1.698  -5.302   2.956
  153   HD13  LEU  43          HD13      LEU  43  -1.141  -4.920   4.585
  154   HD21  LEU  43          HD21      LEU  43  -0.039  -6.179   1.258
  155   HD22  LEU  43          HD22      LEU  43   0.432  -7.453   2.383
  156   HD23  LEU  43          HD23      LEU  43   1.652  -6.364   1.722
  157    H    LEU  44           HN       LEU  44  -0.175  -1.030   2.481
  158    HA   LEU  44           HA       LEU  44  -2.660  -1.202   3.924
  159    HB2  LEU  44           HB2      LEU  44  -0.767   1.066   3.355
  160    HB3  LEU  44           HB1      LEU  44  -2.273   1.291   4.225
  161    HG   LEU  44           HG       LEU  44  -0.016  -0.513   5.104
  162   HD11  LEU  44          HD11      LEU  44  -0.888   2.192   6.108
  163   HD12  LEU  44          HD12      LEU  44   0.609   1.829   5.249
  164   HD13  LEU  44          HD13      LEU  44   0.332   1.164   6.860
  165   HD21  LEU  44          HD21      LEU  44  -1.266  -0.678   7.195
  166   HD22  LEU  44          HD22      LEU  44  -2.212  -1.297   5.840
  167   HD23  LEU  44          HD23      LEU  44  -2.561   0.299   6.506
  168    H    THR  45           HN       THR  45  -1.545   0.535   1.020
  169    HA   THR  45           HA       THR  45  -3.905   1.890   0.445
  170    HB   THR  45           HB       THR  45  -3.107   1.783  -1.981
  171    HG1  THR  45           HG1      THR  45  -0.612   1.139  -1.550
  172   HG21  THR  45          HG21      THR  45  -2.621   3.676  -0.538
  173   HG22  THR  45          HG22      THR  45  -1.215   3.302  -1.533
  174   HG23  THR  45          HG23      THR  45  -1.249   2.818   0.163
  175    H    THR  46           HN       THR  46  -3.190  -1.474   0.096
  176    HA   THR  46           HA       THR  46  -5.106  -2.064  -1.920
  177    HB   THR  46           HB       THR  46  -3.967  -3.909   0.188
  178    HG1  THR  46           HG1      THR  46  -2.342  -4.260  -1.221
  179   HG21  THR  46          HG21      THR  46  -6.025  -4.763  -0.883
  180   HG22  THR  46          HG22      THR  46  -4.603  -5.710  -1.321
  181   HG23  THR  46          HG23      THR  46  -5.271  -4.546  -2.463
  182    H    LEU  47           HN       LEU  47  -5.192  -2.709   1.594
  183    HA   LEU  47           HA       LEU  47  -7.993  -3.306   1.531
  184    HB2  LEU  47           HB2      LEU  47  -6.089  -2.880   3.830
  185    HB3  LEU  47           HB1      LEU  47  -7.758  -3.381   4.019
  186    HG   LEU  47           HG       LEU  47  -5.657  -4.950   2.521
  187   HD11  LEU  47          HD11      LEU  47  -5.149  -4.875   4.894
  188   HD12  LEU  47          HD12      LEU  47  -5.728  -6.476   4.436
  189   HD13  LEU  47          HD13      LEU  47  -6.800  -5.358   5.280
  190   HD21  LEU  47          HD21      LEU  47  -7.320  -6.756   2.605
  191   HD22  LEU  47          HD22      LEU  47  -7.904  -5.363   1.694
  192   HD23  LEU  47          HD23      LEU  47  -8.476  -5.644   3.339
  193    H    PHE  48           HN       PHE  48  -6.150  -0.428   1.892
  194    HA   PHE  48           HA       PHE  48  -8.162   1.027   3.349
  195    HB2  PHE  48           HB2      PHE  48  -5.850   1.672   3.637
  196    HB3  PHE  48           HB1      PHE  48  -5.668   1.947   1.908
  197    HD1  PHE  48           HD1      PHE  48  -6.132   4.039   0.978
  198    HD2  PHE  48           HD2      PHE  48  -7.456   3.149   4.924
  199    HE1  PHE  48           HE1      PHE  48  -6.775   6.394   1.288
  200    HE2  PHE  48           HE2      PHE  48  -8.102   5.503   5.240
  201    HZ   PHE  48           HZ       PHE  48  -7.767   7.127   3.415
  202    H    CYS  49           HN       CYS  49  -7.170   0.712  -0.024
  203    HA   CYS  49           HA       CYS  49  -8.848   2.792  -0.999
  204    HB2  CYS  49           HB2      CYS  49  -6.911   2.012  -2.274
  205    HB3  CYS  49           HB1      CYS  49  -7.646   0.423  -2.447
  206    HG   CYS  49           HG       CYS  49  -7.697   2.492  -4.698
  207    H    LEU  50           HN       LEU  50  -9.251  -0.675  -0.543
  208    HA   LEU  50           HA       LEU  50 -11.658  -1.000  -1.950
  209    HB2  LEU  50           HB2      LEU  50 -10.663  -2.474   0.494
  210    HB3  LEU  50           HB1      LEU  50 -11.980  -3.009  -0.546
  211    HG   LEU  50           HG       LEU  50  -9.188  -2.585  -1.593
  212   HD11  LEU  50          HD11      LEU  50 -10.343  -5.200  -0.649
  213   HD12  LEU  50          HD12      LEU  50  -9.215  -4.227   0.293
  214   HD13  LEU  50          HD13      LEU  50  -8.716  -4.896  -1.260
  215   HD21  LEU  50          HD21      LEU  50 -11.540  -4.192  -2.581
  216   HD22  LEU  50          HD22      LEU  50  -9.954  -4.108  -3.349
  217   HD23  LEU  50          HD23      LEU  50 -10.964  -2.666  -3.252
  218    H    LEU  51           HN       LEU  51 -10.971   0.061   1.323
  219    HA   LEU  51           HA       LEU  51 -13.742   0.153   2.109
  220    HB2  LEU  51           HB2      LEU  51 -11.231   1.208   3.406
  221    HB3  LEU  51           HB1      LEU  51 -12.822   1.287   4.139
  222    HG   LEU  51           HG       LEU  51 -11.483  -1.302   3.361
  223   HD11  LEU  51          HD11      LEU  51 -10.131  -0.195   5.042
  224   HD12  LEU  51          HD12      LEU  51 -10.988  -1.565   5.750
  225   HD13  LEU  51          HD13      LEU  51 -11.560   0.077   6.040
  226   HD21  LEU  51          HD21      LEU  51 -13.913  -1.409   3.528
  227   HD22  LEU  51          HD22      LEU  51 -13.845  -0.688   5.136
  228   HD23  LEU  51          HD23      LEU  51 -13.152  -2.286   4.856
  229    H    HIS  52           HN       HIS  52 -11.322   2.387   0.913
  230    HA   HIS  52           HA       HIS  52 -12.805   4.761   1.454
  231    HB2  HIS  52           HB2      HIS  52 -10.345   4.733   1.196
  232    HB3  HIS  52           HB1      HIS  52 -10.543   4.326  -0.506
  233    HD1  HIS  52           HD1      HIS  52 -11.293   6.211  -2.096
  234    HD2  HIS  52           HD2      HIS  52 -10.871   7.408   1.860
  235    HE1  HIS  52           HE1      HIS  52 -11.358   8.724  -2.145
  236    HE2  HIS  52           HE2      HIS  52 -11.030   9.428   0.252
  237    H    PHE  53           HN       PHE  53 -12.796   2.447  -1.133
  238    HA   PHE  53           HA       PHE  53 -14.436   4.246  -2.778
  239    HB2  PHE  53           HB2      PHE  53 -12.375   3.155  -3.774
  240    HB3  PHE  53           HB1      PHE  53 -13.228   1.619  -3.645
  241    HD1  PHE  53           HD1      PHE  53 -14.865   0.992  -5.218
  242    HD2  PHE  53           HD2      PHE  53 -13.290   4.945  -5.246
  243    HE1  PHE  53           HE1      PHE  53 -15.942   1.401  -7.392
  244    HE2  PHE  53           HE2      PHE  53 -14.365   5.362  -7.420
  245    HZ   PHE  53           HZ       PHE  53 -15.688   3.599  -8.496
  246    H    GLY  54           HN       GLY  54 -14.527   1.398  -0.857
  247    HA2  GLY  54           HA2      GLY  54 -16.305   0.116  -0.165
  248    HA3  GLY  54           HA1      GLY  54 -17.365   1.260  -0.973
  249    H    VAL  55           HN       VAL  55 -14.848  -0.307  -2.767
  250    HA   VAL  55           HA       VAL  55 -16.459  -1.260  -4.790
  251    HB   VAL  55           HB       VAL  55 -14.365  -3.138  -4.599
  252   HG11  VAL  55          HG11      VAL  55 -13.470  -1.910  -6.526
  253   HG12  VAL  55          HG12      VAL  55 -14.589  -0.591  -6.192
  254   HG13  VAL  55          HG13      VAL  55 -15.208  -2.175  -6.654
  255   HG21  VAL  55          HG21      VAL  55 -13.425  -0.356  -3.904
  256   HG22  VAL  55          HG22      VAL  55 -12.392  -1.721  -4.327
  257   HG23  VAL  55          HG23      VAL  55 -13.353  -1.770  -2.851
  258    H    ILE  56           HN       ILE  56 -14.874  -3.455  -2.508
  259    HA   ILE  56           HA       ILE  56 -17.359  -4.964  -2.232
  260    HB   ILE  56           HB       ILE  56 -16.059  -7.098  -2.517
  261   HG12  ILE  56          HG12      ILE  56 -14.048  -5.360  -3.951
  262   HG13  ILE  56          HG11      ILE  56 -13.815  -5.892  -2.289
  263   HG21  ILE  56          HG21      ILE  56 -17.579  -6.295  -4.227
  264   HG22  ILE  56          HG22      ILE  56 -16.163  -7.042  -4.967
  265   HG23  ILE  56          HG23      ILE  56 -16.305  -5.285  -4.912
  266   HD11  ILE  56          HD11      ILE  56 -12.629  -7.292  -3.909
  267   HD12  ILE  56          HD12      ILE  56 -14.169  -7.714  -4.657
  268   HD13  ILE  56          HD13      ILE  56 -13.832  -8.200  -2.995
  269    H    GLY  57           HN       GLY  57 -14.966  -6.899  -1.129
  270    HA2  GLY  57           HA2      GLY  57 -13.713  -6.135   1.037
  271    HA3  GLY  57           HA1      GLY  57 -15.367  -5.969   1.613
  272    HA   PRO  58           HA       PRO  58 -15.527 -10.315   2.414
  273    HB2  PRO  58           HB2      PRO  58 -17.881 -11.197   1.481
  274    HB3  PRO  58           HB1      PRO  58 -17.795 -10.013   2.791
  275    HG2  PRO  58           HG2      PRO  58 -18.332  -9.580  -0.120
  276    HG3  PRO  58           HG1      PRO  58 -19.130  -8.852   1.286
  277    HD2  PRO  58           HD2      PRO  58 -17.167  -7.611  -0.177
  278    HD3  PRO  58           HD1      PRO  58 -17.509  -7.256   1.525
  279    H    GLN  59           HN       GLN  59 -16.887 -12.362   0.906
  280    HA   GLN  59           HA       GLN  59 -14.984 -12.657  -1.322
  281    HB2  GLN  59           HB2      GLN  59 -16.388 -14.866   0.185
  282    HB3  GLN  59           HB1      GLN  59 -15.096 -15.043  -0.993
  283    HG2  GLN  59           HG2      GLN  59 -14.875 -13.768   1.724
  284    HG3  GLN  59           HG1      GLN  59 -14.250 -15.345   1.246
  285   HE21  GLN  59          HE21      GLN  59 -12.839 -13.041   2.320
  286   HE22  GLN  59          HE22      GLN  59 -11.631 -12.627   1.156
  287    H    ARG  60           HN       ARG  60 -17.606 -11.340  -1.404
  288    HA   ARG  60           HA       ARG  60 -18.794 -12.976  -3.532
  289    HB2  ARG  60           HB2      ARG  60 -20.314 -11.548  -1.344
  290    HB3  ARG  60           HB1      ARG  60 -21.055 -12.269  -2.767
  291    HG2  ARG  60           HG2      ARG  60 -20.287 -14.467  -2.082
  292    HG3  ARG  60           HG1      ARG  60 -19.475 -13.762  -0.682
  293    HD2  ARG  60           HD2      ARG  60 -21.630 -14.753  -0.075
  294    HD3  ARG  60           HD1      ARG  60 -21.610 -13.012   0.203
  295    HE   ARG  60           HE       ARG  60 -22.672 -13.197  -2.263
  296   HH11  ARG  60          HH11      ARG  60 -23.411 -14.804   0.740
  297   HH12  ARG  60          HH12      ARG  60 -25.096 -14.984   0.376
  298   HH21  ARG  60          HH21      ARG  60 -24.887 -13.434  -2.749
  299   HH22  ARG  60          HH22      ARG  60 -25.934 -14.207  -1.607