mmpformat 080327 required; 080529 preferred kelvin 300 group (View Data) info opengroup open = True csys (HomeView) (1.000000, 0.000000, 0.000000, 0.000000) (10.000000) (0.000000, 0.000000, 0.000000) (1.000000) csys (LastView) (1.000000, 0.000000, 0.000000, 0.000000) (11.027374) (0.000000, 0.000000, 0.000000) (1.000000) csys (HomeView1) (1.000000, 0.000000, 0.000000, 0.000000) (10.000000) (0.000000, 0.000000, 0.000000) (1.000000) csys (LastView1) (0.965474, 0.127192, -0.200452, 0.107242) (9.547311) (0.000000, 0.000000, 0.000000) (1.000000) egroup (View Data) group (TRP_TRYPTOPHAN) info opengroup open = True mol (Chunk1) def atom 1 (7) (-4678, -1653, -216) def info atom atomtype = sp2(graphitic) atom 2 (1) (-5182, -1570, 663) def bond1 1 atom 3 (1) (-4881, -2428, -843) def bond1 1 atom 4 (6) (-3632, -632, -590) def bond1 1 atom 5 (1) (-3394, -8, 272) def bond1 4 atom 6 (6) (-4125, 347, -1695) def info atom atomtype = sp2 bond1 4 atom 7 (8) (-4731, -37, -2676) def info atom atomtype = sp2 bond2 6 atom 8 (8) (-3830, 1764, -1520) def bond1 6 atom 9 (1) (-4508, 2162, -958) def bond1 8 atom 10 (6) (-2283, -1282, -1029) def bond1 4 atom 11 (1) (-1522, -514, -1157) def bond1 10 atom 12 (1) (-2407, -1766, -1989) def bond1 10 atom 13 (6) (-1782, -2326, 6) def info atom atomtype = sp2 bond1 10 atom 14 (6) (-1414, -2051, 1489) def info atom atomtype = sp2 bond1 13 atom 15 (1) (-1432, -1139, 1946) def bond1 14 atom 16 (6) (-1570, -3844, -235) def info atom atomtype = sp2 bond1 13 atom 17 (6) (-1110, -4499, 1090) def info atom atomtype = sp2 bond1 16 atom 18 (7) (-1015, -3387, 2159) def info atom atomtype = sp2(graphitic) bond1 14 17 atom 19 (6) (-828, -5876, 1288) def info atom atomtype = sp2 bond1 17 atom 20 (1) (-529, -6209, 2205) def bond1 19 atom 21 (6) (-1765, -4521, -1468) def info atom atomtype = sp2 bond1 16 atom 22 (1) (-2070, -4003, -2292) def bond1 21 atom 23 (6) (-1525, -5984, -1558) def info atom atomtype = sp2 bond1 21 atom 24 (1) (-1665, -6470, -2443) def bond1 23 atom 25 (6) (-1024, -6785, -99) def info atom atomtype = sp2 bond1 19 23 atom 26 (1) (-850, -7790, -79) def bond1 25 atom 27 (1) (-777, -3404, 3058) def bond1 18 egroup (TRP_TRYPTOPHAN) end1 group (Clipboard) info opengroup open = False group (Clipboard item 1) info opengroup open = True mol (Chunk1) def atom 28 (7) (-5956, -1311, 53) def info atom atomtype = sp2(graphitic) atom 29 (1) (-6647, -648, 393) def bond1 28 atom 30 (1) (-6234, -2264, -166) def bond1 28 atom 31 (6) (-4521, -878, -132) def bond1 28 atom 32 (1) (-4223, -240, 701) def bond1 31 atom 33 (6) (-4335, -23, -1421) def info atom atomtype = sp2 bond1 31 atom 34 (8) (-4820, -345, -2485) def info atom atomtype = sp2 bond2 33 atom 35 (8) (-3544, 1199, -1313) def bond1 33 atom 36 (1) (-4100, 1908, -964) def bond1 35 atom 37 (6) (-3527, -2085, -141) def bond1 31 atom 38 (1) (-3647, -2708, 744) def bond1 37 atom 39 (1) (-3647, -2700, -1031) def bond1 37 mol (CYM_CYSTEINE_with_negative_charge.in_frag) def atom 40 (16) (-1759, -1529, -132) def info atom atomtype = sp2 bond1 37 egroup (Clipboard item 1) egroup (Clipboard) end molecular machine part TRP_TRYPTOPHAN