REMARK Name = BDB024364 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -1.089 -0.216 -0.158 0.00 0.00 +0.171 C ENDROOT BRANCH 1 2 ATOM 2 C LIG 1 -1.019 -1.552 0.575 0.00 0.00 -0.020 A ATOM 3 C LIG 1 -0.287 -2.614 0.019 0.00 0.00 +0.024 A ATOM 4 C LIG 1 -0.208 -3.850 0.671 0.00 0.00 +0.052 A ATOM 5 C LIG 1 -0.878 -4.042 1.882 0.00 0.00 +0.019 A ATOM 6 C LIG 1 -1.626 -3.003 2.436 0.00 0.00 +0.002 A ATOM 7 C LIG 1 -1.699 -1.769 1.786 0.00 0.00 +0.006 A BRANCH 4 8 ATOM 8 C LIG 1 0.566 -4.912 0.098 0.00 0.00 +0.099 C ATOM 9 N LIG 1 1.201 -5.765 -0.366 0.00 0.00 -0.191 NA ENDBRANCH 4 8 ENDBRANCH 1 2 BRANCH 1 12 ATOM 10 N LIG 1 0.439 1.391 1.130 0.00 0.00 -0.269 N ATOM 11 H LIG 1 0.424 2.158 1.787 0.00 0.00 +0.156 HD ATOM 12 C LIG 1 -0.818 0.975 0.806 0.00 0.00 +0.240 C ATOM 13 O LIG 1 -1.756 1.591 1.336 0.00 0.00 -0.273 OA BRANCH 10 17 ATOM 14 C LIG 1 4.218 0.035 0.003 0.00 0.00 +0.003 A ATOM 15 C LIG 1 3.039 -0.510 -0.492 0.00 0.00 +0.121 A ATOM 16 N LIG 1 1.790 -0.093 -0.152 0.00 0.00 -0.240 NA ATOM 17 C LIG 1 1.685 0.912 0.729 0.00 0.00 +0.125 A ATOM 18 C LIG 1 2.806 1.525 1.279 0.00 0.00 +0.044 A ATOM 19 C LIG 1 4.080 1.082 0.913 0.00 0.00 +0.013 A BRANCH 14 24 ATOM 20 C LIG 1 9.062 -0.301 -1.039 0.00 0.00 +0.172 C ATOM 21 N LIG 1 7.660 -0.596 -0.867 0.00 0.00 -0.274 N ATOM 22 N LIG 1 7.195 -1.810 -1.201 0.00 0.00 -0.179 NA ATOM 23 C LIG 1 5.891 -1.736 -0.921 0.00 0.00 +0.143 A ATOM 24 C LIG 1 5.513 -0.472 -0.408 0.00 0.00 +0.021 A ATOM 25 C LIG 1 6.694 0.243 -0.389 0.00 0.00 +0.116 A ENDBRANCH 14 24 ENDBRANCH 10 17 ENDBRANCH 1 12 BRANCH 1 26 ATOM 26 N LIG 1 -2.446 -0.083 -0.761 0.00 0.00 -0.302 NA ATOM 27 H LIG 1 -3.075 0.199 -0.002 0.00 0.00 +0.123 HD BRANCH 26 28 ATOM 28 C LIG 1 -2.484 0.955 -1.798 0.00 0.00 +0.086 C BRANCH 28 29 ATOM 29 C LIG 1 -3.895 1.110 -2.390 0.00 0.00 +0.050 C BRANCH 29 30 ATOM 30 C LIG 1 -4.912 1.640 -1.405 0.00 0.00 -0.046 A ATOM 31 C LIG 1 -4.929 2.998 -1.060 0.00 0.00 +0.005 A ATOM 32 C LIG 1 -5.855 3.482 -0.133 0.00 0.00 +0.019 A ATOM 33 C LIG 1 -6.774 2.611 0.460 0.00 0.00 +0.052 A ATOM 34 C LIG 1 -6.763 1.255 0.121 0.00 0.00 +0.019 A ATOM 35 C LIG 1 -5.836 0.773 -0.806 0.00 0.00 +0.005 A BRANCH 33 36 ATOM 36 C LIG 1 -7.723 3.107 1.414 0.00 0.00 +0.099 C ATOM 37 N LIG 1 -8.492 3.510 2.185 0.00 0.00 -0.191 NA ENDBRANCH 33 36 ENDBRANCH 29 30 ENDBRANCH 28 29 ENDBRANCH 26 28 ENDBRANCH 1 26 TORSDOF 10