REMARK Name = BDB052432 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.730 0.618 0.332 0.00 0.00 +0.193 C ENDROOT BRANCH 1 3 ATOM 2 N LIG 1 -3.090 0.074 0.566 0.00 0.00 -0.203 NA ATOM 3 C LIG 1 -1.847 -0.390 0.825 0.00 0.00 +0.255 C ATOM 4 O LIG 1 -1.580 -1.484 1.331 0.00 0.00 -0.272 OA BRANCH 2 5 ATOM 5 C LIG 1 -4.171 -0.723 1.170 0.00 0.00 +0.193 C ATOM 6 C LIG 1 -5.184 0.324 1.877 0.00 0.00 +0.027 C BRANCH 5 9 ATOM 7 C LIG 1 -6.056 -3.780 -0.040 0.00 0.00 +0.139 C ATOM 8 N LIG 1 -5.040 -2.870 0.570 0.00 0.00 -0.202 NA ATOM 9 C LIG 1 -4.975 -1.595 0.120 0.00 0.00 +0.255 C ATOM 10 O LIG 1 -5.489 -1.123 -0.906 0.00 0.00 -0.272 OA ENDBRANCH 5 9 ENDBRANCH 2 5 ENDBRANCH 1 3 BRANCH 1 11 ATOM 11 N LIG 1 0.388 0.681 1.313 0.00 0.00 -0.203 NA ATOM 12 C LIG 1 1.252 1.720 1.183 0.00 0.00 +0.255 C ATOM 13 O LIG 1 1.133 2.685 0.423 0.00 0.00 -0.272 OA BRANCH 12 14 ATOM 14 C LIG 1 2.475 1.560 2.157 0.00 0.00 +0.192 C ATOM 15 C LIG 1 2.728 2.783 3.165 0.00 0.00 +0.027 C BRANCH 14 16 ATOM 16 N LIG 1 3.741 1.140 1.548 0.00 0.00 -0.204 NA ATOM 17 C LIG 1 4.297 1.971 0.691 0.00 0.00 +0.242 C ATOM 18 O LIG 1 4.142 3.133 0.348 0.00 0.00 -0.273 OA ATOM 19 C LIG 1 5.589 1.443 -0.017 0.00 0.00 +0.096 C ENDBRANCH 14 16 ENDBRANCH 12 14 ENDBRANCH 1 11 BRANCH 1 20 ATOM 20 C LIG 1 -0.190 0.125 -0.957 0.00 0.00 +0.027 C BRANCH 20 21 ATOM 21 C LIG 1 0.497 -0.360 -2.247 0.00 0.00 +0.028 C BRANCH 21 22 ATOM 22 C LIG 1 1.320 -0.829 -3.461 0.00 0.00 +0.129 C BRANCH 22 23 ATOM 23 N LIG 1 2.125 -1.232 -4.458 0.00 0.00 -0.234 NA ATOM 24 C LIG 1 3.350 -1.500 -4.144 0.00 0.00 +0.284 C ATOM 25 N LIG 1 3.916 -1.419 -2.800 0.00 0.00 -0.104 NA ATOM 26 N LIG 1 4.239 -1.933 -5.226 0.00 0.00 -0.104 NA ENDBRANCH 22 23 ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 1 20 TORSDOF 10