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  108(M 110 ) and  109(M 127 )                               
 chain break between  129(M 147 ) and  130(M 158 )                               
 chain break between  240(M 268 ) and  241(M 284 )                               
 third (+) Hbond (N-C)  127   124 energy  -0.61 abandoned                        
 number of hydrogen bonds is   188                                               
 side chain atoms swapped for                                                    
 ASP   40  GLU   49  TYR  147  GLU  217                                          

 * NMR ensemble comprises 1 model structures
 * Program completed