REMARK Name = LIG001088 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N LIG 1 -0.389 -0.237 -0.999 0.00 0.00 -0.333 N ATOM 2 H LIG 1 -0.599 0.069 -1.955 0.00 0.00 +0.147 HD ENDROOT BRANCH 1 3 ATOM 3 C LIG 1 -1.390 0.277 -0.055 0.00 0.00 +0.158 C ATOM 4 C LIG 1 -2.592 0.831 -0.844 0.00 0.00 +0.239 C ATOM 5 O LIG 1 -2.503 1.226 -2.007 0.00 0.00 -0.273 OA ATOM 6 N LIG 1 -3.790 0.888 -0.174 0.00 0.00 -0.255 N ATOM 7 H LIG 1 -4.573 1.250 -0.702 0.00 0.00 +0.158 HD ATOM 8 C LIG 1 -4.106 0.276 1.012 0.00 0.00 +0.219 C ATOM 9 O LIG 1 -5.258 0.270 1.434 0.00 0.00 -0.275 OA ATOM 10 C LIG 1 -2.959 -0.333 1.781 0.00 0.00 +0.098 C ATOM 11 C LIG 1 -1.883 -0.855 0.844 0.00 0.00 +0.041 C ENDBRANCH 1 3 BRANCH 1 15 ATOM 12 C LIG 1 3.789 -0.041 -0.315 0.00 0.00 +0.025 A ATOM 13 C LIG 1 3.264 -0.268 -1.584 0.00 0.00 +0.024 A ATOM 14 C LIG 1 1.879 -0.302 -1.788 0.00 0.00 +0.025 A ATOM 15 C LIG 1 0.978 -0.126 -0.729 0.00 0.00 +0.028 A ATOM 16 C LIG 1 1.517 -0.003 0.553 0.00 0.00 +0.025 A ATOM 17 C LIG 1 2.904 0.033 0.759 0.00 0.00 +0.024 A BRANCH 12 18 ATOM 18 N LIG 1 5.168 -0.122 -0.092 0.00 0.00 -0.358 N ATOM 19 H LIG 1 5.476 0.349 0.751 0.00 0.00 +0.142 HD ATOM 20 H LIG 1 5.728 0.129 -0.901 0.00 0.00 +0.142 HD ENDBRANCH 12 18 ENDBRANCH 1 15 TORSDOF 3