REMARK Name = BDB063104 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -4.873 -1.113 -0.060 0.00 0.00 +0.002 A ATOM 2 C LIG 1 -3.648 -1.777 -0.121 0.00 0.00 +0.026 A ATOM 3 C LIG 1 -2.454 -1.057 -0.026 0.00 0.00 +0.050 A ATOM 4 N LIG 1 -1.213 -1.706 -0.085 0.00 0.00 -0.339 N ATOM 5 H LIG 1 -1.149 -2.705 -0.197 0.00 0.00 +0.167 HD ATOM 6 C LIG 1 0.015 -1.041 0.005 0.00 0.00 +0.142 A ATOM 7 C LIG 1 0.022 0.347 0.162 0.00 0.00 +0.051 A ATOM 8 C LIG 1 1.251 1.020 0.252 0.00 0.00 -0.002 A ATOM 9 C LIG 1 1.186 2.422 0.410 0.00 0.00 +0.029 A ATOM 10 C LIG 1 -0.047 3.055 0.468 0.00 0.00 +0.112 A ATOM 11 N LIG 1 -1.228 2.413 0.381 0.00 0.00 -0.254 NA ATOM 12 C LIG 1 2.452 0.244 0.178 0.00 0.00 +0.008 A ATOM 13 C LIG 1 2.319 -1.157 0.018 0.00 0.00 +0.074 A ATOM 14 C LIG 1 3.462 -1.940 -0.057 0.00 0.00 +0.028 A ATOM 15 C LIG 1 4.743 -1.392 0.019 0.00 0.00 +0.002 A ATOM 16 C LIG 1 4.892 -0.024 0.176 0.00 0.00 +0.001 A ATOM 17 C LIG 1 3.760 0.787 0.255 0.00 0.00 +0.010 A ATOM 18 C LIG 1 -1.186 1.065 0.229 0.00 0.00 +0.084 A ATOM 19 N LIG 1 1.136 -1.781 -0.066 0.00 0.00 -0.229 NA ATOM 20 C LIG 1 -2.478 0.350 0.133 0.00 0.00 +0.024 A ATOM 21 C LIG 1 -3.721 0.999 0.192 0.00 0.00 +0.012 A ATOM 22 C LIG 1 -4.910 0.272 0.096 0.00 0.00 +0.001 A ENDROOT TORSDOF 0