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   53(A  54 ) and   54(A  56 )                               
 number of hydrogen bonds is    48                                               
 side chain atoms swapped for                                                    
 TYR    5  GLU   40  TYR   43  GLU   56  ASP   58  PHE   61                      

 * NMR ensemble comprises 1 model structures
 * Program completed