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  159(M 174 ) and  160(M 184 )                               
 chain break between  173(M 197 ) and  174(M 208 )                               
 chain break between  332(M 366 ) and  333(M 376 )                               
 number of hydrogen bonds is   238                                               
 side chain atoms swapped for                                                    
 GLU    1  ASP    4  PHE    5  GLU   23  GLU   58  ASP   72  PHE  112  GLU  120  
 GLU  172  ASP  177  PHE  178  GLU  196  GLU  231  ASP  245  PHE  285  GLU  293  

 * NMR ensemble comprises 1 model structures
 * Program completed