REMARK Name = BDB049490 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -3.802 -0.162 0.170 0.00 0.00 +0.030 A ATOM 2 C LIG 1 -2.672 -0.016 -0.656 0.00 0.00 +0.040 A ATOM 3 C LIG 1 -1.359 0.090 -0.149 0.00 0.00 +0.040 A ATOM 4 C LIG 1 -1.142 0.043 1.228 0.00 0.00 +0.078 A ATOM 5 N LIG 1 0.111 0.136 1.848 0.00 0.00 -0.246 NA ATOM 6 C LIG 1 1.197 0.240 1.158 0.00 0.00 +0.078 A ATOM 7 C LIG 1 1.357 0.291 -0.319 0.00 0.00 +0.040 A ATOM 8 C LIG 1 2.572 0.365 -0.886 0.00 0.00 +0.042 A ATOM 9 C LIG 1 3.842 0.401 -0.100 0.00 0.00 +0.039 A ATOM 10 N LIG 1 5.018 0.440 -0.664 0.00 0.00 -0.377 N ATOM 11 C LIG 1 6.285 0.595 0.121 0.00 0.00 +0.142 C ATOM 12 C LIG 1 5.208 0.329 -2.147 0.00 0.00 +0.142 C ATOM 13 C LIG 1 3.665 0.392 1.381 0.00 0.00 +0.027 A ATOM 14 C LIG 1 2.455 0.318 1.940 0.00 0.00 +0.031 A ATOM 15 C LIG 1 -2.246 -0.113 2.064 0.00 0.00 +0.031 A ATOM 16 S LIG 1 -0.040 0.274 -1.328 0.00 0.00 -0.085 S ATOM 17 C LIG 1 -3.543 -0.220 1.546 0.00 0.00 +0.025 A ENDROOT BRANCH 1 19 ATOM 18 C LIG 1 -5.359 0.203 -1.708 0.00 0.00 +0.129 C ATOM 19 N LIG 1 -5.091 -0.288 -0.356 0.00 0.00 -0.336 N ATOM 20 C LIG 1 -6.241 -0.295 0.548 0.00 0.00 +0.129 C ENDBRANCH 1 19 TORSDOF 1