; When using this new tolopolgy, make sure you have included the required parameters ; (see http://swisssidechain.ch/MD/gromacs.html) [ D3FG ] ; (2s)-amino(3,5-dihydroxyphenyl)ethanoic acid [ atoms ] N NH1 -0.4700 0 HN H 0.3100 1 CA CT1 0.0700 2 HA HB 0.0900 3 CB CA 0.0000 4 CG1 CA -0.1150 5 HG1 HP 0.1150 6 CG2 CA -0.1150 7 HG2 HP 0.1150 8 CZ CA -0.1150 9 HZ HP 0.1150 10 CD1 CA 0.1100 11 OD1 OH1 -0.5400 12 HD1 H 0.4300 13 CD2 CA 0.1100 14 OD2 OH1 -0.5400 15 HD2 H 0.4300 16 C C 0.5100 17 O O -0.5100 18 [ bonds ] N HN N CA C CA C +N CA HA CB CA O C CG1 CB CG2 CB CG1 CD1 CZ CD1 OD1 CD1 CG2 CD2 CZ CD2 OD2 CD2 HG1 CG1 HG2 CG2 HZ CZ OD1 HD1 OD2 HD2 [ impropers ] N -C CA HN C CA +N O [ cmap ] -C N CA C +N