REMARK Name = BDB015882 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 1.186 -1.994 0.689 0.00 0.00 +0.162 A ATOM 2 N LIG 1 0.159 -1.214 0.302 0.00 0.00 -0.212 NA ATOM 3 C LIG 1 -1.062 -1.770 0.175 0.00 0.00 +0.131 A ATOM 4 C LIG 1 -1.277 -3.123 0.445 0.00 0.00 +0.043 A ATOM 5 C LIG 1 -0.156 -3.833 0.836 0.00 0.00 +0.125 A ATOM 6 N LIG 1 1.077 -3.305 0.960 0.00 0.00 -0.235 NA ENDROOT BRANCH 1 9 ATOM 7 C LIG 1 3.985 0.600 0.568 0.00 0.00 -0.014 A ATOM 8 C LIG 1 2.726 -0.014 0.463 0.00 0.00 +0.020 A ATOM 9 C LIG 1 2.518 -1.366 0.811 0.00 0.00 +0.020 A ATOM 10 C LIG 1 3.632 -2.087 1.277 0.00 0.00 +0.011 A ATOM 11 C LIG 1 4.890 -1.492 1.390 0.00 0.00 +0.001 A ATOM 12 C LIG 1 5.065 -0.155 1.036 0.00 0.00 +0.008 A BRANCH 7 17 ATOM 13 C LIG 1 5.579 5.298 0.331 0.00 0.00 +0.172 C ATOM 14 N LIG 1 4.870 4.065 0.093 0.00 0.00 -0.274 N ATOM 15 N LIG 1 3.902 4.029 -0.839 0.00 0.00 -0.179 NA ATOM 16 C LIG 1 3.459 2.771 -0.778 0.00 0.00 +0.142 A ATOM 17 C LIG 1 4.149 1.991 0.180 0.00 0.00 +0.020 A ATOM 18 C LIG 1 5.060 2.872 0.728 0.00 0.00 +0.116 A ENDBRANCH 7 17 ENDBRANCH 1 9 BRANCH 4 19 ATOM 19 C LIG 1 -2.574 -3.769 0.359 0.00 0.00 +0.024 A ATOM 20 C LIG 1 -2.796 -5.042 -0.128 0.00 0.00 +0.116 A ATOM 21 N LIG 1 -4.142 -5.256 -0.038 0.00 0.00 -0.274 N ATOM 22 C LIG 1 -4.862 -6.444 -0.427 0.00 0.00 +0.172 C ATOM 23 N LIG 1 -4.816 -4.211 0.470 0.00 0.00 -0.179 NA ATOM 24 C LIG 1 -3.862 -3.310 0.720 0.00 0.00 +0.143 A ENDBRANCH 4 19 BRANCH 3 25 ATOM 25 N LIG 1 -2.137 -0.950 -0.227 0.00 0.00 -0.326 N ATOM 26 H LIG 1 -2.595 -1.400 -1.019 0.00 0.00 +0.148 HD BRANCH 25 27 ATOM 27 C LIG 1 -1.847 0.467 -0.479 0.00 0.00 +0.072 C ATOM 28 C LIG 1 -1.720 1.230 0.856 0.00 0.00 +0.024 C ATOM 29 C LIG 1 -2.126 2.706 0.773 0.00 0.00 +0.020 C ATOM 30 C LIG 1 -1.898 3.269 -0.627 0.00 0.00 +0.051 C ATOM 31 C LIG 1 -2.760 2.532 -1.663 0.00 0.00 +0.020 C ATOM 32 C LIG 1 -2.986 1.056 -1.322 0.00 0.00 +0.024 C BRANCH 30 33 ATOM 33 N LIG 1 -2.174 4.702 -0.657 0.00 0.00 -0.327 NA ATOM 34 H LIG 1 -2.039 5.063 -1.601 0.00 0.00 +0.118 HD ATOM 35 H LIG 1 -3.150 4.878 -0.421 0.00 0.00 +0.118 HD ENDBRANCH 30 33 ENDBRANCH 25 27 ENDBRANCH 3 25 TORSDOF 6