TITLE = "3D CONVEX SHELL" VARIABLES = "X" "Y" "Z" "U" ZONE T="isoleucine", N=16, E=28, DATAPACKING=POINT, ZONETYPE=FETRIANGLE 0.2541 -1.7722 -0.4353 0 2.1353 -0.3658 0.8877 0 2.3008 1.2182 -0.6443 0 0.373 -0.1415 -1.7544 0 -0.7085 1.4717 -0.2128 2 0.2625 -1.8979 0.5658 0 -0.6641 -2.0432 -0.7539 0 -2.1153 0.079 -1.706 2 -2.2024 -1.1795 -0.4502 2 0.1403 0.5006 1.9051 0 -1.6324 0.6577 1.9395 1 -0.8852 -0.9332 1.6585 0 3.1295 1.5403 -0.2641 0 -3.2838 0.4338 1.0914 1 -3.1968 1.6922 -0.1644 0 -4.2222 0.2583 -0.4109 0 1 2 13 1 4 13 1 4 7 1 2 6 1 6 7 4 7 8 7 8 9 8 9 16 3 4 13 3 4 8 3 5 8 5 8 15 3 5 13 8 15 16 6 7 12 7 9 12 9 12 14 9 14 16 11 12 14 10 11 12 2 10 12 2 6 12 2 10 13 10 11 13 5 11 13 5 11 15 11 14 15 14 15 16