REMARK Name = BDB051558 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -2.955 -1.988 0.388 0.00 0.00 +0.064 C ATOM 2 C LIG 1 -2.849 -0.512 0.160 0.00 0.00 +0.024 A ATOM 3 N LIG 1 -1.590 0.122 0.058 0.00 0.00 -0.283 N ATOM 4 C LIG 1 -1.452 1.507 -0.156 0.00 0.00 +0.140 A ATOM 5 N LIG 1 -0.190 1.887 -0.219 0.00 0.00 -0.226 NA ATOM 6 C LIG 1 0.518 0.739 -0.044 0.00 0.00 +0.115 A ATOM 7 C LIG 1 1.948 0.569 -0.022 0.00 0.00 +0.016 A ATOM 8 C LIG 1 2.455 -0.729 0.176 0.00 0.00 +0.049 A ATOM 9 C LIG 1 1.520 -1.888 0.357 0.00 0.00 +0.258 A ATOM 10 N LIG 1 0.157 -1.642 0.324 0.00 0.00 -0.306 N ATOM 11 H LIG 1 -0.453 -2.436 0.448 0.00 0.00 +0.170 HD ATOM 12 O LIG 1 1.947 -3.026 0.531 0.00 0.00 -0.267 OA ATOM 13 C LIG 1 3.838 -0.940 0.204 0.00 0.00 +0.014 A ATOM 14 C LIG 1 4.708 0.140 0.035 0.00 0.00 +0.001 A ATOM 15 C LIG 1 4.201 1.427 -0.162 0.00 0.00 +0.001 A ATOM 16 C LIG 1 2.822 1.645 -0.191 0.00 0.00 +0.011 A ATOM 17 C LIG 1 -2.640 2.279 -0.272 0.00 0.00 +0.047 A ATOM 18 C LIG 1 -3.839 1.681 -0.175 0.00 0.00 +0.005 A ATOM 19 C LIG 1 -0.294 -0.356 0.127 0.00 0.00 +0.146 A ATOM 20 C LIG 1 -3.957 0.252 0.045 0.00 0.00 +0.021 A ENDROOT TORSDOF 0