REMARK Name = BDB032384 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 1.417 -2.202 0.711 0.00 0.00 -0.022 A ATOM 2 C LIG 1 0.769 -1.572 1.782 0.00 0.00 +0.006 A ATOM 3 C LIG 1 -0.583 -1.231 1.696 0.00 0.00 +0.005 A ATOM 4 C LIG 1 -1.317 -1.527 0.540 0.00 0.00 -0.030 A ATOM 5 C LIG 1 -0.668 -2.159 -0.531 0.00 0.00 +0.005 A ATOM 6 C LIG 1 0.684 -2.498 -0.444 0.00 0.00 +0.006 A ENDROOT BRANCH 1 7 ATOM 7 C LIG 1 2.874 -2.583 0.814 0.00 0.00 +0.195 C BRANCH 7 8 ATOM 8 O LIG 1 3.668 -1.518 1.341 0.00 0.00 -0.372 OA BRANCH 8 13 ATOM 9 C LIG 1 7.147 2.133 -0.283 0.00 0.00 +0.104 C ATOM 10 N LIG 1 6.680 0.795 0.070 0.00 0.00 -0.305 NA ATOM 11 C LIG 1 5.948 0.779 1.345 0.00 0.00 +0.086 C ATOM 12 C LIG 1 4.431 0.750 1.175 0.00 0.00 +0.047 C ATOM 13 C LIG 1 3.986 -0.491 0.391 0.00 0.00 +0.121 C ATOM 14 C LIG 1 5.072 -0.975 -0.579 0.00 0.00 +0.047 C ATOM 15 C LIG 1 5.942 0.187 -1.045 0.00 0.00 +0.086 C ENDBRANCH 8 13 ENDBRANCH 7 8 ENDBRANCH 1 7 BRANCH 4 16 ATOM 16 C LIG 1 -2.777 -1.153 0.433 0.00 0.00 +0.136 C BRANCH 16 17 ATOM 17 N LIG 1 -2.916 -0.026 -0.480 0.00 0.00 -0.340 N ATOM 18 H LIG 1 -2.153 0.640 -0.381 0.00 0.00 +0.146 HD BRANCH 17 19 ATOM 19 C LIG 1 -4.154 0.607 -0.622 0.00 0.00 +0.028 A ATOM 20 C LIG 1 -5.379 -0.014 -0.344 0.00 0.00 +0.031 A ATOM 21 C LIG 1 -6.610 0.636 -0.568 0.00 0.00 -0.013 A ATOM 22 C LIG 1 -6.612 1.932 -1.113 0.00 0.00 +0.000 A ATOM 23 C LIG 1 -7.852 2.544 -1.320 0.00 0.00 +0.119 A ATOM 24 N LIG 1 -9.046 1.975 -1.033 0.00 0.00 -0.263 NA ATOM 25 C LIG 1 -9.008 0.730 -0.516 0.00 0.00 +0.111 A ATOM 26 C LIG 1 -5.394 2.547 -1.434 0.00 0.00 +0.012 A ATOM 27 C LIG 1 -7.837 0.030 -0.270 0.00 0.00 +0.028 A ATOM 28 C LIG 1 -4.186 1.882 -1.202 0.00 0.00 +0.023 A ENDBRANCH 17 19 ENDBRANCH 16 17 ENDBRANCH 4 16 TORSDOF 6