0 B7R0.16 CC(C)[C@@H](C(=O)[O-])[NH3+] C00183_2 [0,1,0,0,0,0|1,0,2]=4 1 B7R0.16 CC(C)[C@H](C(=O)[O-])[NH3+] C00183_1 [0,1,0,0,0,0|1,0,2]=4 2 B5R0.5 C[C@@H](C(=O)[O-])[NH3+] C00041_2 [0,0,0,0,1,0|2,0,1]=4 3 B5R0.5 C[C@H](C(=O)[O-])[NH3+] C00041_1 [0,0,0,0,1,0|2,0,1]=4 4 B7R0.6 CC(=O)NCC(=O)O Glycine_nacetyl [0,0,0,0,0,1|2,0,1]=4