COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK A   0      -0.440  -1.076   5.379  1.00  0.00           N  
HETATM    2  C   UNK A   0      -0.113  -0.446   6.524  1.00  0.00           C  
HETATM    3  O   UNK A   0       0.627  -1.079   7.453  1.00  0.00           O  
HETATM    4  C   UNK A   0       0.980  -0.400   8.687  1.00  0.00           C  
HETATM    5  C   UNK A   0       1.805  -1.320   9.549  1.00  0.00           C  
HETATM    6  C   UNK A   0       3.183  -1.327   9.430  1.00  0.00           C  
HETATM    7  C   UNK A   0       3.940  -2.171  10.221  1.00  0.00           C  
HETATM    8  C   UNK A   0       3.320  -3.008  11.130  1.00  0.00           C  
HETATM    9  C   UNK A   0       1.943  -3.000  11.249  1.00  0.00           C  
HETATM   10  C   UNK A   0       1.186  -2.153  10.462  1.00  0.00           C  
HETATM   11  O   UNK A   0      -0.487   0.693   6.719  1.00  0.00           O  
HETATM   12  C   UNK A   0      -1.149  -0.352   4.321  1.00  0.00           C  
HETATM   13  C   UNK A   0      -2.654  -0.586   4.464  1.00  0.00           C  
HETATM   14  C   UNK A   0      -3.405   0.303   3.471  1.00  0.00           C  
HETATM   15  C   UNK A   0      -4.895  -0.044   3.500  1.00  0.00           C  
HETATM   16  C   UNK A   0      -3.216   1.771   3.857  1.00  0.00           C  
HETATM   17  C   UNK A   0      -5.646   0.845   2.507  1.00  0.00           C  
HETATM   18  C   UNK A   0      -3.967   2.660   2.864  1.00  0.00           C  
HETATM   19  C   UNK A   0      -5.457   2.313   2.894  1.00  0.00           C  
HETATM   20  C   UNK A   0      -0.715   0.059   1.794  1.00  0.00           C  
HETATM   21  O   UNK A   0      -1.147   1.187   1.907  1.00  0.00           O  
HETATM   22  C   UNK A   0      -0.689  -0.850   2.975  1.00  0.00           C  
HETATM   23  O   UNK A   0      -0.298  -1.987   2.853  1.00  0.00           O  
ATOM     24  N   ARG A   1      -0.259  -0.371   0.602  1.00  0.00           N  
ATOM     25  CA  ARG A   1      -0.285   0.522  -0.558  1.00  0.00           C  
ATOM     26  CB  ARG A   1       1.027   1.305  -0.627  1.00  0.00           C  
ATOM     27  CG  ARG A   1       1.196   2.131   0.648  1.00  0.00           C  
ATOM     28  CD  ARG A   1       2.508   2.914   0.579  1.00  0.00           C  
ATOM     29  NE  ARG A   1       2.670   3.705   1.801  1.00  0.00           N  
ATOM     30  CZ  ARG A   1       3.783   4.496   1.966  1.00  0.00           C  
ATOM     31  NH1 ARG A   1       3.935   5.238   3.113  1.00  0.00           N  
ATOM     32  NH2 ARG A   1       4.694   4.541   1.035  1.00  0.00           N  
ATOM     33  C   ARG A   1      -0.452  -0.291  -1.815  1.00  0.00           C  
ATOM     34  O   ARG A   1      -0.540  -1.499  -1.749  1.00  0.00           O  
ATOM     35  N   GLU A   2      -0.502   0.323  -3.014  1.00  0.00           N  
ATOM     36  CA  GLU A   2      -0.664  -0.468  -4.236  1.00  0.00           C  
ATOM     37  C   GLU A   2       0.010   0.237  -5.384  1.00  0.00           C  
ATOM     38  O   GLU A   2       0.572   1.296  -5.199  1.00  0.00           O  
ATOM     39  CB  GLU A   2      -2.154  -0.631  -4.544  1.00  0.00           C  
ATOM     40  CG  GLU A   2      -2.840  -1.347  -3.379  1.00  0.00           C  
ATOM     41  CD  GLU A   2      -4.307  -1.508  -3.682  1.00  0.00           C  
ATOM     42  OE1 GLU A   2      -5.113  -2.113  -2.795  1.00  0.00           O  
ATOM     43  OE2 GLU A   2      -4.758  -1.093  -4.723  1.00  0.00           O  
ATOM     44  N   PHE A   3      -0.008  -0.309  -6.616  1.00  0.00           N  
ATOM     45  CA  PHE A   3       0.647   0.376  -7.732  1.00  0.00           C  
ATOM     46  CB  PHE A   3       1.145  -0.657  -8.744  1.00  0.00           C  
ATOM     47  CG  PHE A   3       2.143  -1.597  -8.064  1.00  0.00           C  
ATOM     48  CD1 PHE A   3       2.640  -2.631  -9.077  1.00  0.00           C  
ATOM     49  CD2 PHE A   3       3.329  -0.787  -7.538  1.00  0.00           C  
ATOM     50  CE1 PHE A   3       3.638  -3.571  -8.397  1.00  0.00           C  
ATOM     51  CE2 PHE A   3       4.327  -1.727  -6.859  1.00  0.00           C  
ATOM     52  CZ  PHE A   3       4.824  -2.761  -7.871  1.00  0.00           C  
ATOM     53  C   PHE A   3      -0.335   1.302  -8.401  1.00  0.00           C  
ATOM     54  O   PHE A   3       0.054   2.312  -8.937  1.00  0.00           O  
ATOM     55  OXT PHE A   3      -1.644   1.004  -8.402  1.00  0.00           O  
HETATM   56  H   UNK A   0      -0.206  -2.009   5.255  1.00  0.00           H  
HETATM   57  H   UNK A   0       1.556   0.496   8.457  1.00  0.00           H  
HETATM   58  H   UNK A   0       0.071  -0.121   9.220  1.00  0.00           H  
HETATM   59  H   UNK A   0       3.667  -0.673   8.720  1.00  0.00           H  
HETATM   60  H   UNK A   0       5.016  -2.177  10.128  1.00  0.00           H  
HETATM   61  H   UNK A   0       3.912  -3.668  11.747  1.00  0.00           H  
HETATM   62  H   UNK A   0       1.459  -3.654  11.959  1.00  0.00           H  
HETATM   63  H   UNK A   0       0.110  -2.147  10.554  1.00  0.00           H  
HETATM   64  H   UNK A   0      -0.937   0.713   4.405  1.00  0.00           H  
HETATM   65  H   UNK A   0      -2.881  -1.632   4.257  1.00  0.00           H  
HETATM   66  H   UNK A   0      -2.966  -0.340   5.479  1.00  0.00           H  
HETATM   67  H   UNK A   0      -3.013   0.138   2.467  1.00  0.00           H  
HETATM   68  H   UNK A   0      -5.030  -1.090   3.225  1.00  0.00           H  
HETATM   69  H   UNK A   0      -5.287   0.120   4.504  1.00  0.00           H  
HETATM   70  H   UNK A   0      -3.608   1.936   4.861  1.00  0.00           H  
HETATM   71  H   UNK A   0      -2.155   2.018   3.836  1.00  0.00           H  
HETATM   72  H   UNK A   0      -5.254   0.680   1.503  1.00  0.00           H  
HETATM   73  H   UNK A   0      -6.707   0.597   2.528  1.00  0.00           H  
HETATM   74  H   UNK A   0      -3.575   2.495   1.860  1.00  0.00           H  
HETATM   75  H   UNK A   0      -3.832   3.706   3.139  1.00  0.00           H  
HETATM   76  H   UNK A   0      -5.992   2.947   2.186  1.00  0.00           H  
HETATM   77  H   UNK A   0      -5.848   2.478   3.897  1.00  0.00           H  
ATOM     78  H   ARG A   1       0.085  -1.273   0.511  1.00  0.00           H  
ATOM     79  HA  ARG A   1      -1.118   1.217  -0.462  1.00  0.00           H  
ATOM     80  HB1 ARG A   1       1.008   1.970  -1.491  1.00  0.00           H  
ATOM     81  HB2 ARG A   1       1.860   0.609  -0.723  1.00  0.00           H  
ATOM     82  HG1 ARG A   1       1.215   1.466   1.512  1.00  0.00           H  
ATOM     83  HG2 ARG A   1       0.362   2.827   0.744  1.00  0.00           H  
ATOM     84  HD1 ARG A   1       2.489   3.579  -0.284  1.00  0.00           H  
ATOM     85  HD2 ARG A   1       3.342   2.219   0.483  1.00  0.00           H  
ATOM     86  HE  ARG A   1       1.993   3.671   2.494  1.00  0.00           H  
ATOM     87 HH11 ARG A   1       4.720   5.795   3.230  1.00  0.00           H  
ATOM     88 HH12 ARG A   1       3.256   5.207   3.805  1.00  0.00           H  
ATOM     89  HH2 ARG A   1       4.587   4.017   0.225  1.00  0.00           H  
ATOM     90  H   GLU A   2      -0.431   1.288  -3.067  1.00  0.00           H  
ATOM     91  HA  GLU A   2      -0.212  -1.449  -4.096  1.00  0.00           H  
ATOM     92  HB1 GLU A   2      -2.606   0.350  -4.684  1.00  0.00           H  
ATOM     93  HB2 GLU A   2      -2.274  -1.220  -5.454  1.00  0.00           H  
ATOM     94  HG1 GLU A   2      -2.388  -2.329  -3.239  1.00  0.00           H  
ATOM     95  HG2 GLU A   2      -2.719  -0.759  -2.469  1.00  0.00           H  
ATOM     96  HE1 GLU A   2      -6.055  -2.217  -2.990  1.00  0.00           H  
ATOM     97  H   PHE A   3      -0.458  -1.156  -6.764  1.00  0.00           H  
ATOM     98  HA  PHE A   3       1.493   0.953  -7.357  1.00  0.00           H  
ATOM     99  HB1 PHE A   3       0.299  -1.234  -9.119  1.00  0.00           H  
ATOM    100  HB2 PHE A   3       1.633  -0.147  -9.574  1.00  0.00           H  
ATOM    101  HG  PHE A   3       1.654  -2.107  -7.234  1.00  0.00           H  
ATOM    102 HD11 PHE A   3       1.795  -3.208  -9.451  1.00  0.00           H  
ATOM    103 HD12 PHE A   3       3.129  -2.121  -9.907  1.00  0.00           H  
ATOM    104 HD21 PHE A   3       3.818  -0.277  -8.368  1.00  0.00           H  
ATOM    105 HD22 PHE A   3       2.975  -0.050  -6.817  1.00  0.00           H  
ATOM    106 HE11 PHE A   3       3.149  -4.081  -7.567  1.00  0.00           H  
ATOM    107 HE12 PHE A   3       3.992  -4.307  -9.118  1.00  0.00           H  
ATOM    108 HE21 PHE A   3       3.838  -2.237  -6.028  1.00  0.00           H  
ATOM    109 HE22 PHE A   3       5.172  -1.149  -6.484  1.00  0.00           H  
ATOM    110  HZ1 PHE A   3       5.535  -3.430  -7.386  1.00  0.00           H  
ATOM    111  HZ2 PHE A   3       5.313  -2.251  -8.701  1.00  0.00           H  
ATOM    112  HXT PHE A   3      -2.274   1.598  -8.832  1.00  0.00           H  
CONECT    1    2   12   56                                            
CONECT    2    1    3   11   11                                       
CONECT    3    2    4                                                 
CONECT    4    3    5   57   58                                       
CONECT    5    4    6    6   10                                       
CONECT    6    5    5    7   59                                       
CONECT    7    6    8    8   60                                       
CONECT    8    7    7    9   61                                       
CONECT    9    8   10   10   62                                       
CONECT   10    5    9    9   63                                       
CONECT   11    2    2                                                 
CONECT   12    1   13   22   64                                       
CONECT   13   12   14   65   66                                       
CONECT   14   13   15   16   67                                       
CONECT   15   14   17   68   69                                       
CONECT   16   14   18   70   71                                       
CONECT   17   15   19   72   73                                       
CONECT   18   16   19   74   75                                       
CONECT   19   17   18   76   77                                       
CONECT   20   21   21   22   24                                       
CONECT   21   20   20                                                 
CONECT   22   12   20   23   23                                       
CONECT   23   22   22                                                 
CONECT   24   20   25   78                                            
CONECT   25   24   26   33   79                                       
CONECT   26   25   27   80   81                                       
CONECT   27   26   28   82   83                                       
CONECT   28   27   29   84   85                                       
CONECT   29   28   30   86                                            
CONECT   30   29   31   32   32                                       
CONECT   31   30   87   88                                            
CONECT   32   30   30   89                                            
CONECT   33   25   34   34   35                                       
CONECT   34   33   33                                                 
CONECT   35   33   36   90                                            
CONECT   36   35   37   39   91                                       
CONECT   37   36   38   38   44                                       
CONECT   38   37   37                                                 
CONECT   39   36   40   92   93                                       
CONECT   40   39   41   94   95                                       
CONECT   41   40   42   43   43                                       
CONECT   42   41   96                                                 
CONECT   43   41   41                                                 
CONECT   44   37   45   97                                            
CONECT   45   44   46   53   98                                       
CONECT   46   45   47   99  100                                       
CONECT   47   46   48   49  101                                       
CONECT   48   47   50  102  103                                       
CONECT   49   47   51  104  105                                       
CONECT   50   48   52  106  107                                       
CONECT   51   49   52  108  109                                       
CONECT   52   50   51  110  111                                       
CONECT   53   45   54   54   55                                       
CONECT   54   53   53                                                 
CONECT   55   53  112                                                 
CONECT   56    1                                                      
CONECT   57    4                                                      
CONECT   58    4                                                      
CONECT   59    6                                                      
CONECT   60    7                                                      
CONECT   61    8                                                      
CONECT   62    9                                                      
CONECT   63   10                                                      
CONECT   64   12                                                      
CONECT   65   13                                                      
CONECT   66   13                                                      
CONECT   67   14                                                      
CONECT   68   15                                                      
CONECT   69   15                                                      
CONECT   70   16                                                      
CONECT   71   16                                                      
CONECT   72   17                                                      
CONECT   73   17                                                      
CONECT   74   18                                                      
CONECT   75   18                                                      
CONECT   76   19                                                      
CONECT   77   19                                                      
CONECT   78   24                                                      
CONECT   79   25                                                      
CONECT   80   26                                                      
CONECT   81   26                                                      
CONECT   82   27                                                      
CONECT   83   27                                                      
CONECT   84   28                                                      
CONECT   85   28                                                      
CONECT   86   29                                                      
CONECT   87   31                                                      
CONECT   88   31                                                      
CONECT   89   32                                                      
CONECT   90   35                                                      
CONECT   91   36                                                      
CONECT   92   39                                                      
CONECT   93   39                                                      
CONECT   94   40                                                      
CONECT   95   40                                                      
CONECT   96   42                                                      
CONECT   97   44                                                      
CONECT   98   45                                                      
CONECT   99   46                                                      
CONECT  100   46                                                      
CONECT  101   47                                                      
CONECT  102   48                                                      
CONECT  103   48                                                      
CONECT  104   49                                                      
CONECT  105   49                                                      
CONECT  106   50                                                      
CONECT  107   50                                                      
CONECT  108   51                                                      
CONECT  109   51                                                      
CONECT  110   52                                                      
CONECT  111   52                                                      
CONECT  112   55                                                      
MASTER        0    0    0    0    0    0    0    0  112    0  112    0
END
