REMARK Name = BDB026425 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.503 -1.205 -0.259 0.00 0.00 +0.142 C ENDROOT BRANCH 1 5 ATOM 2 N LIG 1 2.708 -1.252 1.461 0.00 0.00 -0.280 N ATOM 3 C LIG 1 1.441 -0.717 1.263 0.00 0.00 +0.305 C ATOM 4 O LIG 1 0.874 0.111 1.957 0.00 0.00 -0.252 OA ATOM 5 N LIG 1 0.894 -1.336 0.140 0.00 0.00 -0.281 N ATOM 6 C LIG 1 1.734 -2.434 -0.289 0.00 0.00 +0.128 C ATOM 7 C LIG 1 3.075 -2.123 0.366 0.00 0.00 +0.128 C BRANCH 2 8 ATOM 8 C LIG 1 3.668 -0.719 2.405 0.00 0.00 +0.144 C BRANCH 8 13 ATOM 9 C LIG 1 7.409 2.960 -0.131 0.00 0.00 +0.044 C ATOM 10 C LIG 1 6.456 2.022 0.549 0.00 0.00 -0.050 A ATOM 11 C LIG 1 5.124 2.396 0.759 0.00 0.00 +0.003 A ATOM 12 C LIG 1 4.228 1.513 1.365 0.00 0.00 +0.005 A ATOM 13 C LIG 1 4.645 0.236 1.764 0.00 0.00 -0.030 A ATOM 14 C LIG 1 5.974 -0.143 1.537 0.00 0.00 +0.005 A ATOM 15 C LIG 1 6.870 0.742 0.932 0.00 0.00 +0.003 A ENDBRANCH 8 13 ENDBRANCH 2 8 ENDBRANCH 1 5 BRANCH 1 16 ATOM 16 C LIG 1 -1.474 -1.837 0.759 0.00 0.00 +0.146 C BRANCH 16 17 ATOM 17 O LIG 1 -1.694 -0.987 1.893 0.00 0.00 -0.389 OA ATOM 18 H LIG 1 -0.853 -0.511 2.074 0.00 0.00 +0.210 HD ENDBRANCH 16 17 BRANCH 16 19 ATOM 19 C LIG 1 -2.835 -2.207 0.121 0.00 0.00 +0.117 C BRANCH 19 20 ATOM 20 N LIG 1 -3.469 -1.173 -0.727 0.00 0.00 -0.295 NA ATOM 21 C LIG 1 -3.842 0.017 0.071 0.00 0.00 +0.120 C ATOM 22 C LIG 1 -4.702 1.018 -0.679 0.00 0.00 -0.030 A ATOM 23 C LIG 1 -5.403 0.650 -1.840 0.00 0.00 -0.042 A ATOM 24 C LIG 1 -6.207 1.590 -2.498 0.00 0.00 +0.004 A ATOM 25 C LIG 1 -6.336 2.883 -1.991 0.00 0.00 +0.000 A ATOM 26 C LIG 1 -5.659 3.247 -0.830 0.00 0.00 +0.000 A ATOM 27 C LIG 1 -5.237 -0.736 -2.405 0.00 0.00 +0.051 C ATOM 28 C LIG 1 -4.848 2.319 -0.175 0.00 0.00 +0.005 A ATOM 29 C LIG 1 -4.674 -1.721 -1.373 0.00 0.00 +0.089 C ENDBRANCH 19 20 ENDBRANCH 16 19 ENDBRANCH 1 16 TORSDOF 7