REMARK Name = BDB026511 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N LIG 1 3.789 -0.051 0.369 0.00 0.00 -0.261 N ATOM 2 C LIG 1 3.406 -1.266 0.982 0.00 0.00 +0.075 A ATOM 3 C LIG 1 2.232 -1.708 0.360 0.00 0.00 +0.070 A ATOM 4 C LIG 1 1.595 -2.881 0.722 0.00 0.00 +0.028 A ATOM 5 C LIG 1 2.179 -3.646 1.734 0.00 0.00 +0.002 A ATOM 6 C LIG 1 3.380 -3.237 2.337 0.00 0.00 +0.002 A ATOM 7 N LIG 1 1.900 -0.801 -0.651 0.00 0.00 -0.289 N ATOM 8 C LIG 1 4.010 -2.046 1.953 0.00 0.00 +0.028 A ATOM 9 C LIG 1 2.861 0.237 -0.682 0.00 0.00 +0.335 A ATOM 10 O LIG 1 2.866 1.179 -1.462 0.00 0.00 -0.246 OA ENDROOT BRANCH 1 14 ATOM 11 C LIG 1 7.067 2.429 1.431 0.00 0.00 +0.052 A ATOM 12 C LIG 1 6.621 2.366 0.111 0.00 0.00 +0.021 A ATOM 13 C LIG 1 5.537 1.545 -0.226 0.00 0.00 +0.027 A ATOM 14 C LIG 1 4.887 0.760 0.738 0.00 0.00 +0.052 A ATOM 15 C LIG 1 5.332 0.857 2.064 0.00 0.00 +0.027 A ATOM 16 C LIG 1 6.415 1.677 2.409 0.00 0.00 +0.021 A BRANCH 11 18 ATOM 17 N LIG 1 9.075 3.941 2.074 0.00 0.00 -0.191 NA ATOM 18 C LIG 1 8.175 3.268 1.783 0.00 0.00 +0.099 C ENDBRANCH 11 18 ENDBRANCH 1 14 BRANCH 7 19 ATOM 19 C LIG 1 0.719 -0.847 -1.484 0.00 0.00 +0.159 C BRANCH 19 20 ATOM 20 C LIG 1 -0.559 -0.410 -0.746 0.00 0.00 +0.148 C BRANCH 20 21 ATOM 21 O LIG 1 -0.485 0.975 -0.387 0.00 0.00 -0.389 OA ATOM 22 H LIG 1 -1.415 1.264 -0.285 0.00 0.00 +0.210 HD ENDBRANCH 20 21 BRANCH 20 23 ATOM 23 C LIG 1 -1.799 -0.617 -1.644 0.00 0.00 +0.117 C BRANCH 23 24 ATOM 24 N LIG 1 -3.021 -0.050 -1.029 0.00 0.00 -0.295 NA ATOM 25 C LIG 1 -4.071 0.106 -2.060 0.00 0.00 +0.120 C ATOM 26 C LIG 1 -5.413 0.536 -1.508 0.00 0.00 -0.030 A ATOM 27 C LIG 1 -5.730 0.349 -0.151 0.00 0.00 -0.042 A ATOM 28 C LIG 1 -6.990 0.728 0.329 0.00 0.00 +0.004 A ATOM 29 C LIG 1 -7.942 1.264 -0.538 0.00 0.00 +0.000 A ATOM 30 C LIG 1 -7.639 1.433 -1.887 0.00 0.00 +0.000 A ATOM 31 C LIG 1 -4.691 -0.195 0.793 0.00 0.00 +0.051 C ATOM 32 C LIG 1 -6.383 1.068 -2.371 0.00 0.00 +0.005 A ATOM 33 C LIG 1 -3.538 -0.896 0.061 0.00 0.00 +0.089 C ENDBRANCH 23 24 ENDBRANCH 20 23 ENDBRANCH 19 20 ENDBRANCH 7 19 TORSDOF 7