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   18(A  18 ) and   19(A  20 )                               
 chain break between   32(A  33 ) and   33(A  35 )                               
 chain break between   48(A  50 ) and   49(A  52 )                               
 chain break between   64(A  67 ) and   65(A  69 )                               
 chain break between   69(A  73 ) and   70(A  75 )                               
 number of hydrogen bonds is    40                                               
 side chain atoms swapped for                                                    
 GLU    5  TYR   49  PHE   63  GLU   64                                          

 * NMR ensemble comprises 1 model structures
 * Program completed