REMARK Name = BDB018766 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -2.231 -0.026 -0.237 0.00 0.00 -0.012 A ATOM 2 C LIG 1 -1.111 -0.206 0.586 0.00 0.00 +0.014 A ATOM 3 C LIG 1 0.115 -0.599 0.035 0.00 0.00 -0.025 A ATOM 4 C LIG 1 1.310 -0.879 0.908 0.00 0.00 +0.054 C ATOM 5 C LIG 1 2.625 -0.603 0.169 0.00 0.00 +0.069 C ATOM 6 C LIG 1 2.855 0.902 -0.064 0.00 0.00 +0.132 C ATOM 7 N LIG 1 4.299 1.158 0.223 0.00 0.00 -0.268 N ATOM 8 C LIG 1 4.960 -0.138 0.505 0.00 0.00 +0.117 C ATOM 9 C LIG 1 2.597 -1.318 -1.183 0.00 0.00 +0.225 C ATOM 10 N LIG 1 1.423 -1.243 -1.888 0.00 0.00 -0.285 N ATOM 11 H LIG 1 1.456 -1.595 -2.838 0.00 0.00 +0.155 HD ATOM 12 O LIG 1 3.578 -1.871 -1.677 0.00 0.00 -0.275 OA ATOM 13 C LIG 1 3.832 -1.022 1.012 0.00 0.00 +0.037 C ATOM 14 C LIG 1 0.208 -0.823 -1.342 0.00 0.00 +0.037 A ATOM 15 C LIG 1 -0.903 -0.663 -2.166 0.00 0.00 +0.024 A ATOM 16 C LIG 1 -2.120 -0.255 -1.614 0.00 0.00 +0.010 A ENDROOT BRANCH 1 19 ATOM 17 C LIG 1 -4.057 2.636 -0.895 0.00 0.00 +0.070 C ATOM 18 C LIG 1 -4.306 1.526 0.053 0.00 0.00 +0.088 A ATOM 19 C LIG 1 -3.496 0.392 0.325 0.00 0.00 +0.047 A ATOM 20 C LIG 1 -4.204 -0.303 1.281 0.00 0.00 +0.142 A ATOM 21 C LIG 1 -4.000 -1.567 2.016 0.00 0.00 +0.090 C ATOM 22 O LIG 1 -5.349 0.373 1.568 0.00 0.00 -0.359 OA ATOM 23 N LIG 1 -5.419 1.518 0.798 0.00 0.00 -0.083 NA ENDBRANCH 1 19 BRANCH 7 24 ATOM 24 C LIG 1 4.954 2.253 -0.187 0.00 0.00 +0.169 C ATOM 25 N LIG 1 5.512 3.201 -0.545 0.00 0.00 -0.174 NA ENDBRANCH 7 24 TORSDOF 2