COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   0      14.260   1.255   1.368  1.00  0.00           C  
HETATM    2  C   UNK A   0      14.941   0.052   1.430  1.00  0.00           C  
HETATM    3  C   UNK A   0      14.426  -1.070   0.815  1.00  0.00           C  
HETATM    4  C   UNK A   0      13.212  -0.994   0.129  1.00  0.00           C  
HETATM    5  C   UNK A   0      12.535   0.220   0.073  1.00  0.00           C  
HETATM    6  C   UNK A   0      13.057   1.337   0.690  1.00  0.00           C  
HETATM    7  C   UNK A   0      11.272   0.000  -0.724  1.00  0.00           C  
HETATM    8  C   UNK A   0      11.281  -1.454  -1.126  1.00  0.00           C  
HETATM    9  C   UNK A   0      10.395  -2.219  -1.855  1.00  0.00           C  
HETATM   10  C   UNK A   0      10.656  -3.559  -2.077  1.00  0.00           C  
HETATM   11  C   UNK A   0      11.806  -4.136  -1.567  1.00  0.00           C  
HETATM   12  C   UNK A   0      12.698  -3.378  -0.836  1.00  0.00           C  
HETATM   13  C   UNK A   0      12.441  -2.025  -0.609  1.00  0.00           C  
HETATM   14  C   UNK A   0      10.045   0.301   0.139  1.00  0.00           C  
HETATM   15  C   UNK A   0       7.573   0.491   0.132  1.00  0.00           C  
HETATM   16  O   UNK A   0       7.708   0.761   1.307  1.00  0.00           O  
HETATM   17  C   UNK A   0       8.781   0.194  -0.717  1.00  0.00           C  
ATOM     18  N   LYS A   1       6.341   0.456  -0.413  1.00  0.00           N  
ATOM     19  CA  LYS A   1       5.166   0.744   0.413  1.00  0.00           C  
ATOM     20  C   LYS A   1       3.955   0.075  -0.186  1.00  0.00           C  
ATOM     21  O   LYS A   1       4.063  -0.577  -1.202  1.00  0.00           O  
ATOM     22  CB  LYS A   1       4.939   2.256   0.467  1.00  0.00           C  
ATOM     23  CG  LYS A   1       6.113   2.922   1.187  1.00  0.00           C  
ATOM     24  CD  LYS A   1       5.886   4.434   1.242  1.00  0.00           C  
ATOM     25  CE  LYS A   1       7.060   5.100   1.962  1.00  0.00           C  
ATOM     26  NZ  LYS A   1       6.842   6.552   2.014  1.00  0.00           N1+
ATOM     27  N   LYS A   2       2.752   0.203   0.408  1.00  0.00           N  
ATOM     28  CA  LYS A   2       1.575  -0.447  -0.174  1.00  0.00           C  
ATOM     29  C   LYS A   2       0.332   0.292   0.250  1.00  0.00           C  
ATOM     30  O   LYS A   2       0.420   1.266   0.968  1.00  0.00           O  
ATOM     31  CB  LYS A   2       1.498  -1.895   0.314  1.00  0.00           C  
ATOM     32  CG  LYS A   2       2.699  -2.678  -0.222  1.00  0.00           C  
ATOM     33  CD  LYS A   2       2.622  -4.126   0.266  1.00  0.00           C  
ATOM     34  CE  LYS A   2       3.823  -4.908  -0.270  1.00  0.00           C  
ATOM     35  NZ  LYS A   2       3.750  -6.299   0.198  1.00  0.00           N1+
ATOM     36  N   GLU A   3      -0.878  -0.129  -0.168  1.00  0.00           N  
ATOM     37  CA  GLU A   3      -2.087   0.590   0.245  1.00  0.00           C  
ATOM     38  C   GLU A   3      -3.267  -0.345   0.199  1.00  0.00           C  
ATOM     39  O   GLU A   3      -3.115  -1.499  -0.144  1.00  0.00           O  
ATOM     40  CB  GLU A   3      -2.330   1.765  -0.705  1.00  0.00           C  
ATOM     41  CG  GLU A   3      -1.191   2.777  -0.566  1.00  0.00           C  
ATOM     42  CD  GLU A   3      -1.430   3.934  -1.501  1.00  0.00           C  
ATOM     43  OE1 GLU A   3      -2.412   3.948  -2.206  1.00  0.00           O  
ATOM     44  OE2 GLU A   3      -0.553   4.949  -1.551  1.00  0.00           O  
ATOM     45  N   THR A   4      -4.493   0.100   0.540  1.00  0.00           N  
ATOM     46  CA  THR A   4      -5.641  -0.810   0.496  1.00  0.00           C  
ATOM     47  C   THR A   4      -6.906  -0.013   0.308  1.00  0.00           C  
ATOM     48  O   THR A   4      -6.854   1.196   0.220  1.00  0.00           O  
ATOM     49  CB  THR A   4      -5.722  -1.593   1.807  1.00  0.00           C  
ATOM     50  OG1 THR A   4      -5.993  -0.693   2.884  1.00  0.00           O  
ATOM     51  CG2 THR A   4      -4.390  -2.303   2.060  1.00  0.00           C  
ATOM     52  N   GLU A   5      -8.095  -0.643   0.238  1.00  0.00           N  
ATOM     53  CA  GLU A   5      -9.325   0.132   0.056  1.00  0.00           C  
ATOM     54  C   GLU A   5     -10.494  -0.645   0.604  1.00  0.00           C  
ATOM     55  O   GLU A   5     -10.318  -1.738   1.099  1.00  0.00           O  
ATOM     56  CB  GLU A   5      -9.544   0.398  -1.435  1.00  0.00           C  
ATOM     57  CG  GLU A   5      -8.421   1.291  -1.964  1.00  0.00           C  
ATOM     58  CD  GLU A   5      -8.636   1.553  -3.433  1.00  0.00           C  
ATOM     59  OE1 GLU A   5      -9.591   1.074  -3.998  1.00  0.00           O  
ATOM     60  OE2 GLU A   5      -7.768   2.318  -4.113  1.00  0.00           O  
ATOM     61  N   VAL A   6     -11.736  -0.125   0.545  1.00  0.00           N  
ATOM     62  CA  VAL A   6     -12.873  -0.880   1.079  1.00  0.00           C  
ATOM     63  C   VAL A   6     -13.379  -1.835   0.028  1.00  0.00           C  
ATOM     64  O   VAL A   6     -12.845  -1.880  -1.055  1.00  0.00           O  
ATOM     65  CB  VAL A   6     -13.991   0.089   1.468  1.00  0.00           C  
ATOM     66  CG1 VAL A   6     -15.178  -0.700   2.026  1.00  0.00           C  
ATOM     67  CG2 VAL A   6     -13.477   1.058   2.535  1.00  0.00           C  
ATOM     68  OXT VAL A   6     -14.423  -2.635   0.296  1.00  0.00           O  
HETATM   69  H   UNK A   0      14.666   2.130   1.855  1.00  0.00           H  
HETATM   70  H   UNK A   0      15.880  -0.008   1.960  1.00  0.00           H  
HETATM   71  H   UNK A   0      14.961  -2.007   0.865  1.00  0.00           H  
HETATM   72  H   UNK A   0      12.525   2.276   0.647  1.00  0.00           H  
HETATM   73  H   UNK A   0      11.273   0.635  -1.610  1.00  0.00           H  
HETATM   74  H   UNK A   0       9.497  -1.771  -2.254  1.00  0.00           H  
HETATM   75  H   UNK A   0       9.962  -4.157  -2.648  1.00  0.00           H  
HETATM   76  H   UNK A   0      12.006  -5.182  -1.741  1.00  0.00           H  
HETATM   77  H   UNK A   0      13.594  -3.832  -0.439  1.00  0.00           H  
HETATM   78  H   UNK A   0       9.991  -0.417   0.957  1.00  0.00           H  
HETATM   79  H   UNK A   0      10.125   1.309   0.545  1.00  0.00           H  
HETATM   80  H   UNK A   0       8.835   0.912  -1.536  1.00  0.00           H  
HETATM   81  H   UNK A   0       8.702  -0.814  -1.124  1.00  0.00           H  
ATOM     82  H   LYS A   1       6.232   0.240  -1.353  1.00  0.00           H  
ATOM     83  HA  LYS A   1       5.328   0.364   1.421  1.00  0.00           H  
ATOM     84  HB1 LYS A   1       4.864   2.649  -0.547  1.00  0.00           H  
ATOM     85  HB2 LYS A   1       4.015   2.466   1.007  1.00  0.00           H  
ATOM     86  HG1 LYS A   1       6.187   2.529   2.201  1.00  0.00           H  
ATOM     87  HG2 LYS A   1       7.036   2.712   0.648  1.00  0.00           H  
ATOM     88  HD1 LYS A   1       5.811   4.827   0.228  1.00  0.00           H  
ATOM     89  HD2 LYS A   1       4.962   4.644   1.782  1.00  0.00           H  
ATOM     90  HE1 LYS A   1       7.134   4.707   2.976  1.00  0.00           H  
ATOM     91  HE2 LYS A   1       7.983   4.891   1.422  1.00  0.00           H  
ATOM     92  HZ1 LYS A   1       6.773   6.916   1.076  1.00  0.00           H  
ATOM     93  HZ2 LYS A   1       5.987   6.746   2.514  1.00  0.00           H  
ATOM     94  HZ3 LYS A   1       7.616   6.991   2.489  1.00  0.00           H  
ATOM     95  H   LYS A   2       2.665   0.725   1.221  1.00  0.00           H  
ATOM     96  HA  LYS A   2       1.652  -0.433  -1.261  1.00  0.00           H  
ATOM     97  HB1 LYS A   2       1.510  -1.913   1.404  1.00  0.00           H  
ATOM     98  HB2 LYS A   2       0.577  -2.352  -0.047  1.00  0.00           H  
ATOM     99  HG1 LYS A   2       2.687  -2.660  -1.312  1.00  0.00           H  
ATOM    100  HG2 LYS A   2       3.621  -2.221   0.139  1.00  0.00           H  
ATOM    101  HD1 LYS A   2       2.634  -4.143   1.355  1.00  0.00           H  
ATOM    102  HD2 LYS A   2       1.701  -4.582  -0.095  1.00  0.00           H  
ATOM    103  HE1 LYS A   2       3.811  -4.891  -1.360  1.00  0.00           H  
ATOM    104  HE2 LYS A   2       4.745  -4.452   0.091  1.00  0.00           H  
ATOM    105  HZ1 LYS A   2       4.542  -6.815  -0.155  1.00  0.00           H  
ATOM    106  HZ2 LYS A   2       3.761  -6.315   1.207  1.00  0.00           H  
ATOM    107  HZ3 LYS A   2       2.897  -6.721  -0.136  1.00  0.00           H  
ATOM    108  H   GLU A   3      -0.949  -0.907  -0.742  1.00  0.00           H  
ATOM    109  HA  GLU A   3      -1.958   0.964   1.260  1.00  0.00           H  
ATOM    110  HB1 GLU A   3      -2.370   1.401  -1.731  1.00  0.00           H  
ATOM    111  HB2 GLU A   3      -3.275   2.246  -0.452  1.00  0.00           H  
ATOM    112  HG1 GLU A   3      -1.151   3.141   0.460  1.00  0.00           H  
ATOM    113  HG2 GLU A   3      -0.245   2.296  -0.818  1.00  0.00           H  
ATOM    114  HE2 GLU A   3      -0.750   5.669  -2.166  1.00  0.00           H  
ATOM    115  H   THR A   4      -4.615   1.022   0.814  1.00  0.00           H  
ATOM    116  HA  THR A   4      -5.522  -1.504  -0.336  1.00  0.00           H  
ATOM    117  HB  THR A   4      -6.520  -2.332   1.741  1.00  0.00           H  
ATOM    118  HG1 THR A   4      -6.058  -1.122   3.748  1.00  0.00           H  
ATOM    119 HG21 THR A   4      -3.591  -1.565   2.126  1.00  0.00           H  
ATOM    120 HG22 THR A   4      -4.448  -2.862   2.994  1.00  0.00           H  
ATOM    121 HG23 THR A   4      -4.183  -2.990   1.239  1.00  0.00           H  
ATOM    122  H   GLU A   5      -8.137  -1.610   0.309  1.00  0.00           H  
ATOM    123  HA  GLU A   5      -9.239   1.081   0.585  1.00  0.00           H  
ATOM    124  HB1 GLU A   5      -9.542  -0.548  -1.977  1.00  0.00           H  
ATOM    125  HB2 GLU A   5     -10.503   0.896  -1.579  1.00  0.00           H  
ATOM    126  HG1 GLU A   5      -8.423   2.237  -1.422  1.00  0.00           H  
ATOM    127  HG2 GLU A   5      -7.462   0.793  -1.821  1.00  0.00           H  
ATOM    128  HE2 GLU A   5      -7.948   2.458  -5.052  1.00  0.00           H  
ATOM    129  H   VAL A   6     -11.878   0.749   0.149  1.00  0.00           H  
ATOM    130  HA  VAL A   6     -12.556  -1.441   1.958  1.00  0.00           H  
ATOM    131  HB  VAL A   6     -14.308   0.650   0.590  1.00  0.00           H  
ATOM    132 HG11 VAL A   6     -14.861  -1.261   2.904  1.00  0.00           H  
ATOM    133 HG12 VAL A   6     -15.974  -0.010   2.303  1.00  0.00           H  
ATOM    134 HG13 VAL A   6     -15.544  -1.390   1.266  1.00  0.00           H  
ATOM    135 HG21 VAL A   6     -12.632   1.620   2.138  1.00  0.00           H  
ATOM    136 HG22 VAL A   6     -14.274   1.748   2.812  1.00  0.00           H  
ATOM    137 HG23 VAL A   6     -13.160   0.497   3.414  1.00  0.00           H  
ATOM    138  HXT VAL A   6     -14.711  -3.231  -0.409  1.00  0.00           H  
CONECT    1    2    6    6   69                                       
CONECT    2    3    3    1   70                                       
CONECT    3    2    2    4   71                                       
CONECT    4    3   13    5    5                                       
CONECT    5    4    4    6    7                                       
CONECT    6    1    1    5   72                                       
CONECT    7    5    8   14   73                                       
CONECT    8   13   13    7    9                                       
CONECT    9   10   10    8   74                                       
CONECT   10   11    9    9   75                                       
CONECT   11   12   12   10   76                                       
CONECT   12   11   11   13   77                                       
CONECT   13   12    4    8    8                                       
CONECT   14    7   17   78   79                                       
CONECT   15   17   16   16   18                                       
CONECT   16   15   15                                                 
CONECT   17   14   15   80   81                                       
CONECT   18   19   82   15                                            
CONECT   19   18   20   22   83                                       
CONECT   20   19   21   21   27                                       
CONECT   21   20   20                                                 
CONECT   22   19   23   84   85                                       
CONECT   23   22   24   86   87                                       
CONECT   24   23   25   88   89                                       
CONECT   25   24   26   90   91                                       
CONECT   26   25   92   93   94                                       
CONECT   27   28   95   20                                            
CONECT   28   27   29   31   96                                       
CONECT   29   28   30   30   36                                       
CONECT   30   29   29                                                 
CONECT   31   28   32   97   98                                       
CONECT   32   31   33   99  100                                       
CONECT   33   32   34  101  102                                       
CONECT   34   33   35  103  104                                       
CONECT   35   34  105  106  107                                       
CONECT   36   37  108   29                                            
CONECT   37   36   38   40  109                                       
CONECT   38   37   39   39   45                                       
CONECT   39   38   38                                                 
CONECT   40   37   41  110  111                                       
CONECT   41   40   42  112  113                                       
CONECT   42   41   43   43   44                                       
CONECT   43   42   42                                                 
CONECT   44   42  114                                                 
CONECT   45   46  115   38                                            
CONECT   46   45   47   49  116                                       
CONECT   47   46   48   48   52                                       
CONECT   48   47   47                                                 
CONECT   49   46   50   51  117                                       
CONECT   50   49  118                                                 
CONECT   51   49  119  120  121                                       
CONECT   52   53  122   47                                            
CONECT   53   52   54   56  123                                       
CONECT   54   53   55   55   61                                       
CONECT   55   54   54                                                 
CONECT   56   53   57  124  125                                       
CONECT   57   56   58  126  127                                       
CONECT   58   57   59   59   60                                       
CONECT   59   58   58                                                 
CONECT   60   58  128                                                 
CONECT   61   62  129   54                                            
CONECT   62   61   63   65  130                                       
CONECT   63   62   64   64   68                                       
CONECT   64   63   63                                                 
CONECT   65   62   66   67  131                                       
CONECT   66   65  132  133  134                                       
CONECT   67   65  135  136  137                                       
CONECT   68   63  138                                                 
CONECT   69    1                                                      
CONECT   70    2                                                      
CONECT   71    3                                                      
CONECT   72    6                                                      
CONECT   73    7                                                      
CONECT   74    9                                                      
CONECT   75   10                                                      
CONECT   76   11                                                      
CONECT   77   12                                                      
CONECT   78   14                                                      
CONECT   79   14                                                      
CONECT   80   17                                                      
CONECT   81   17                                                      
CONECT   82   18                                                      
CONECT   83   19                                                      
CONECT   84   22                                                      
CONECT   85   22                                                      
CONECT   86   23                                                      
CONECT   87   23                                                      
CONECT   88   24                                                      
CONECT   89   24                                                      
CONECT   90   25                                                      
CONECT   91   25                                                      
CONECT   92   26                                                      
CONECT   93   26                                                      
CONECT   94   26                                                      
CONECT   95   27                                                      
CONECT   96   28                                                      
CONECT   97   31                                                      
CONECT   98   31                                                      
CONECT   99   32                                                      
CONECT  100   32                                                      
CONECT  101   33                                                      
CONECT  102   33                                                      
CONECT  103   34                                                      
CONECT  104   34                                                      
CONECT  105   35                                                      
CONECT  106   35                                                      
CONECT  107   35                                                      
CONECT  108   36                                                      
CONECT  109   37                                                      
CONECT  110   40                                                      
CONECT  111   40                                                      
CONECT  112   41                                                      
CONECT  113   41                                                      
CONECT  114   44                                                      
CONECT  115   45                                                      
CONECT  116   46                                                      
CONECT  117   49                                                      
CONECT  118   50                                                      
CONECT  119   51                                                      
CONECT  120   51                                                      
CONECT  121   51                                                      
CONECT  122   52                                                      
CONECT  123   53                                                      
CONECT  124   56                                                      
CONECT  125   56                                                      
CONECT  126   57                                                      
CONECT  127   57                                                      
CONECT  128   60                                                      
CONECT  129   61                                                      
CONECT  130   62                                                      
CONECT  131   65                                                      
CONECT  132   66                                                      
CONECT  133   66                                                      
CONECT  134   66                                                      
CONECT  135   67                                                      
CONECT  136   67                                                      
CONECT  137   67                                                      
CONECT  138   68                                                      
MASTER        0    0    0    0    0    0    0    0  138    0  138    0
END
