REMARK Name = BDB057795 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 2.511 -0.738 -0.201 0.00 0.00 -0.046 A ATOM 2 C LIG 1 1.810 -0.377 -1.353 0.00 0.00 +0.005 A ATOM 3 C LIG 1 0.410 -0.313 -1.347 0.00 0.00 +0.023 A ATOM 4 C LIG 1 -0.338 -0.595 -0.194 0.00 0.00 +0.030 A ATOM 5 C LIG 1 0.388 -0.959 0.953 0.00 0.00 +0.023 A ATOM 6 C LIG 1 1.787 -1.027 0.956 0.00 0.00 +0.005 A ENDROOT BRANCH 4 7 ATOM 7 N LIG 1 -1.740 -0.546 -0.158 0.00 0.00 -0.330 N ATOM 8 C LIG 1 -2.488 -0.471 -1.412 0.00 0.00 +0.106 C ATOM 9 C LIG 1 -3.926 -0.958 -1.218 0.00 0.00 +0.038 C ATOM 10 C LIG 1 -4.551 -0.515 0.119 0.00 0.00 +0.060 C ATOM 11 C LIG 1 -3.746 0.626 0.749 0.00 0.00 +0.038 C ATOM 12 C LIG 1 -2.306 0.175 0.996 0.00 0.00 +0.106 C BRANCH 10 13 ATOM 13 N LIG 1 -5.989 -0.210 0.082 0.00 0.00 -0.299 NA ATOM 14 C LIG 1 -6.391 0.971 -0.678 0.00 0.00 +0.085 C ATOM 15 C LIG 1 -7.888 0.784 -0.909 0.00 0.00 +0.017 C ATOM 16 C LIG 1 -8.194 -0.639 -0.459 0.00 0.00 +0.017 C ATOM 17 C LIG 1 -6.835 -1.308 -0.378 0.00 0.00 +0.085 C ENDBRANCH 10 13 ENDBRANCH 4 7 BRANCH 1 18 ATOM 18 C LIG 1 4.019 -0.787 -0.201 0.00 0.00 +0.050 C BRANCH 18 19 ATOM 19 C LIG 1 4.628 0.564 0.209 0.00 0.00 +0.089 C BRANCH 19 22 ATOM 20 C LIG 1 8.097 0.300 1.433 0.00 0.00 +0.107 C ATOM 21 C LIG 1 6.732 -0.331 1.133 0.00 0.00 +0.102 C ATOM 22 N LIG 1 6.095 0.564 0.154 0.00 0.00 -0.301 NA ATOM 23 C LIG 1 6.660 1.893 0.389 0.00 0.00 +0.086 C ATOM 24 C LIG 1 8.129 1.574 0.594 0.00 0.00 +0.035 C BRANCH 20 26 ATOM 25 N LIG 1 10.099 -1.315 0.904 0.00 0.00 -0.196 NA ATOM 26 C LIG 1 9.211 -0.602 1.125 0.00 0.00 +0.067 C ENDBRANCH 20 26 ENDBRANCH 19 22 ENDBRANCH 18 19 ENDBRANCH 1 18 TORSDOF 6