RESIDUE   A1DUT     38
CONECT      C13    4 C11  H18  H19  H17 
CONECT      C11    4 C13  C12  C4   O1  
CONECT      C12    4 C11  H15  H14  H16 
CONECT      C1     4 C2   H3   H1   H2  
CONECT      C10    3 C5   C7   C9  
CONECT      C2     4 C1   C3   C4   H4  
CONECT      C3     4 C2   H7   H6   H5  
CONECT      C4     4 C11  C2   N1   H8  
CONECT      C5     3 C10  N1   N2  
CONECT      C6     3 N2   N3   H10 
CONECT      C7     3 C10  N3   N4  
CONECT      C8     3 C9   N4   H12 
CONECT      C9     3 C10  C8   H13 
CONECT      N1     3 C4   C5   H9  
CONECT      N2     2 C5   C6  
CONECT      N3     2 C6   C7  
CONECT      N4     3 C7   C8   H11 
CONECT      O1     2 C11  H20 
CONECT      H18    1 C13 
CONECT      H19    1 C13 
CONECT      H17    1 C13 
CONECT      H15    1 C12 
CONECT      H14    1 C12 
CONECT      H16    1 C12 
CONECT      H3     1 C1  
CONECT      H1     1 C1  
CONECT      H2     1 C1  
CONECT      H4     1 C2  
CONECT      H7     1 C3  
CONECT      H6     1 C3  
CONECT      H5     1 C3  
CONECT      H8     1 C4  
CONECT      H10    1 C6  
CONECT      H12    1 C8  
CONECT      H13    1 C9  
CONECT      H9     1 N1  
CONECT      H11    1 N4  
CONECT      H20    1 O1  
END   
HET    A1DUT             38
HETNAM     A1DUT (3S)-2,4-dimethyl-3-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)a
HETNAM   2 A1DUT mino]pentan-2-ol
FORMUL      A1DUT    C13 H20 N4 O