1mol="ACB" Charge="0" 2lab="C" NH="0" 3lab="O" NH="0" 4lab="OXT" NH="1" 5lab="CA" NH="1" 6lab="N" NH="2" 7lab="CB" NH="1" 8lab="CG" NH="0" 9lab="OD1" NH="0" 10lab="C4" NH="3" 11lab="OD2" NH="1" 12