sim/src/tests/amino_acids/trp_l_aminoacid.pdb


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COMPND  trp.pdb                                                                 
HETATM    1  N                   0.674   1.181  -2.133                
HETATM    2  C                   1.877   1.182  -1.303                
HETATM    3  C                   3.115   1.049  -2.177                
HETATM    4  O                   4.148   1.664  -2.033                
HETATM    5  O                   2.967   0.084  -3.122                
HETATM    6  C                   1.949   0.090  -0.185                
HETATM    7  C                   0.854   0.205   0.835                
HETATM    8  C                   0.924   0.888   2.026                
HETATM    9  C                  -0.480  -0.351   0.769                
HETATM   10  N                  -0.279   0.797   2.700                
HETATM   11  C                  -1.159   0.038   1.958                
HETATM   12  C                  -1.163  -1.155  -0.163                
HETATM   13  C                  -2.478  -0.345   2.229                
HETATM   14  C                  -3.123  -1.135   1.286                
HETATM   15  C                  -2.471  -1.538   0.102                
HETATM   16  H                  -0.146   1.228  -1.533                
HETATM   17  H                   0.617   0.307  -2.650                
HETATM   18  H                   1.959   2.160  -0.818                
HETATM   22  H                   3.808   0.052  -3.609                
HETATM   19  H                   2.924   0.174   0.311                
HETATM   20  H                   1.924  -0.897  -0.664                
HETATM   21  H                   1.754   1.433   2.454                
HETATM   23  H                  -0.466   1.188   3.609                
HETATM   26  H                  -0.672  -1.473  -1.079                
HETATM   24  H                  -2.978  -0.037   3.143                
HETATM   25  H                  -4.148  -1.448   1.463                
HETATM   27  H                  -3.005  -2.160  -0.612                
CONECT    1    2   16   17                                   
CONECT    2    1    3    6   18                              
CONECT    3    2    4    5                                   
CONECT    4    3                                             
CONECT    5    3   22                                        
CONECT    6    2    7   19   20                              
CONECT    7    6    8    9                                   
CONECT    8    7   10   21                                   
CONECT    9    7   11   12                                   
CONECT   10    8   11   23                                   
CONECT   11    9   10   13                                   
CONECT   12    9   15   26                                   
CONECT   13   11   14   24                                   
CONECT   14   13   15   25                                   
CONECT   15   12   14   27                                   
CONECT   16    1                                             
CONECT   17    1                                             
CONECT   18    2                                             
CONECT   22    5                                             
CONECT   19    6                                             
CONECT   20    6                                             
CONECT   21    8                                             
CONECT   23   10                                             
CONECT   26   12                                             
CONECT   24   13                                             
CONECT   25   14                                             
CONECT   27   15                                             
END