REMARK Name = BDB056890 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -4.261 -1.343 -1.235 0.00 0.00 +0.109 C ATOM 2 C LIG 1 -3.315 -2.275 -0.519 0.00 0.00 +0.213 C ATOM 3 N LIG 1 -2.129 -1.730 -0.038 0.00 0.00 -0.297 N ATOM 4 C LIG 1 -1.919 -0.268 0.050 0.00 0.00 +0.146 C ATOM 5 C LIG 1 -0.483 0.048 0.272 0.00 0.00 +0.018 A ATOM 6 C LIG 1 0.201 1.293 0.344 0.00 0.00 +0.098 A ATOM 7 N LIG 1 1.502 1.104 0.627 0.00 0.00 -0.171 NA ATOM 8 N LIG 1 1.657 -0.235 0.691 0.00 0.00 -0.267 N ATOM 9 C LIG 1 0.486 -0.902 0.511 0.00 0.00 +0.046 A ATOM 10 C LIG 1 0.240 -2.363 0.540 0.00 0.00 +0.074 C ATOM 11 C LIG 1 -1.264 -2.597 0.789 0.00 0.00 +0.114 C ATOM 12 O LIG 1 -3.603 -3.465 -0.394 0.00 0.00 -0.276 OA ENDROOT BRANCH 6 13 ATOM 13 C LIG 1 -0.343 2.638 0.187 0.00 0.00 +0.002 A ATOM 14 C LIG 1 -1.145 2.967 -0.914 0.00 0.00 +0.010 A ATOM 15 C LIG 1 -1.671 4.255 -1.044 0.00 0.00 +0.001 A ATOM 16 C LIG 1 -1.395 5.223 -0.081 0.00 0.00 +0.000 A ATOM 17 C LIG 1 -0.586 4.910 1.010 0.00 0.00 +0.001 A ATOM 18 C LIG 1 -0.059 3.624 1.142 0.00 0.00 +0.010 A ENDBRANCH 6 13 BRANCH 8 19 ATOM 19 C LIG 1 2.981 -0.788 0.948 0.00 0.00 +0.147 C BRANCH 19 20 ATOM 20 C LIG 1 3.716 -1.088 -0.325 0.00 0.00 +0.010 C ATOM 21 C LIG 1 3.683 -2.462 -0.945 0.00 0.00 +0.005 C ATOM 22 C LIG 1 4.944 -1.963 -0.298 0.00 0.00 +0.005 C ENDBRANCH 19 20 ENDBRANCH 8 19 TORSDOF 3