SECSTR - Secondary structure assignment
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 Secondary structure calculation program - copyright by David Keith Smith, 1989

 Amended by R A Laskowski, 1992

 Enter filename containing coordinates of structure
   (for file containing ensemble of NMR structures enter @filename;
    for set of separate PDB files to be processed, enter %filelist,
    where filelist contains a list of PDB files to be cleaned up)

    Processing NMR model 0
 chain break between    7(A   7 ) and    8(A   9 )                               
 chain break between   28(A  29 ) and   29(A  34 )                               
 chain break between   73(A  78 ) and   74(A  81 )                               
 number of hydrogen bonds is    70                                               
 side chain atoms swapped for                                                    
 GLU   17  TYR   22  PHE   27  PHE   37  ASP   41  GLU   52  ASP   55  GLU   65  
 ASP   80                                                                        

 * NMR ensemble comprises 1 model structures
 * Program completed