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 1
 number of hydrogen bonds is    57                                               
 side chain atoms swapped for                                                    
 PHE   41  PHE   60  PHE   82                                                    

    Processing NMR model 2
 third (+) Hbond (N-C)   24    22 energy  -0.80 abandoned                        
 number of hydrogen bonds is    56                                               
 side chain atoms swapped for                                                    
 TYR   31  PHE   41  PHE   60  PHE   82                                          

    Processing NMR model 3
 number of hydrogen bonds is    51                                               
 side chain atoms swapped for                                                    
 TYR   31  PHE   60  PHE   82                                                    

    Processing NMR model 4
 number of hydrogen bonds is    56                                               
 side chain atoms swapped for                                                    
 TYR   31  PHE   41  PHE   60                                                    

    Processing NMR model 5
 number of hydrogen bonds is    54                                               
 side chain atoms swapped for                                                    
 TYR   31  PHE   41  PHE   60                                                    

    Processing NMR model 6
 number of hydrogen bonds is    52                                               
 side chain atoms swapped for                                                    
 TYR   31  PHE   41  PHE   60                                                    

    Processing NMR model 7
 number of hydrogen bonds is    58                                               
 side chain atoms swapped for                                                    
 PHE   60                                                                        

    Processing NMR model 8
 number of hydrogen bonds is    55                                               
 side chain atoms swapped for                                                    
 TYR   31  PHE   41  PHE   60  PHE   82                                          

    Processing NMR model 9
 number of hydrogen bonds is    52                                               
 side chain atoms swapped for                                                    
 TYR   31  PHE   41  PHE   60                                                    

    Processing NMR model 10
 number of hydrogen bonds is    54                                               
 side chain atoms swapped for                                                    
 PHE   60  PHE   82                                                              

 * NMR ensemble comprises 10 model structures
 * Program completed