 
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    81                                               

    Processing NMR model 2
 number of hydrogen bonds is    89                                               

    Processing NMR model 3
 third (+) Hbond (N-C)   25    21 energy  -0.59 abandoned                        
 number of hydrogen bonds is    93                                               

    Processing NMR model 4
 third (+) Hbond (N-C)   72    70 energy  -0.58 abandoned                        
 number of hydrogen bonds is    81                                               

    Processing NMR model 5
 number of hydrogen bonds is    87                                               

    Processing NMR model 6
 third (+) Hbond (N-C)   63    57 energy  -0.71 abandoned                        
 number of hydrogen bonds is    94                                               

    Processing NMR model 7
 number of hydrogen bonds is    86                                               

    Processing NMR model 8
 third (+) Hbond (N-C)   59    57 energy  -0.56 abandoned                        
 number of hydrogen bonds is    91                                               

    Processing NMR model 9
 number of hydrogen bonds is    82                                               

    Processing NMR model 10
 number of hydrogen bonds is    82                                               

    Processing NMR model 11
 number of hydrogen bonds is    90                                               

    Processing NMR model 12
 third (+) Hbond (N-C)  101    96 energy  -0.51 abandoned                        
 number of hydrogen bonds is    86                                               

    Processing NMR model 13
 number of hydrogen bonds is    81                                               

    Processing NMR model 14
 number of hydrogen bonds is    87                                               

    Processing NMR model 15
 third (+) Hbond (N-C)   25    21 energy  -0.59 abandoned                        
 number of hydrogen bonds is    73                                               

    Processing NMR model 16
 number of hydrogen bonds is    83                                               

    Processing NMR model 17
 third (+) Hbond (N-C)   25    21 energy  -1.17 abandoned                        
 third (+) Hbond (N-C)   78    76 energy  -0.61 abandoned                        
 number of hydrogen bonds is    93                                               

    Processing NMR model 18
 third (+) Hbond (N-C)   39    33 energy  -0.53 abandoned                        
 number of hydrogen bonds is    83                                               

    Processing NMR model 19
 third (+) Hbond (N-C)   25    21 energy  -0.66 abandoned                        
 third (+) Hbond (N-C)   78    76 energy  -0.56 abandoned                        
 number of hydrogen bonds is    86                                               

    Processing NMR model 20
 number of hydrogen bonds is    86                                               

 * NMR ensemble comprises 20 model structures
 * Program completed
