REMARK Name = BDB061610 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N LIG 1 0.115 -2.520 0.654 0.00 0.00 -0.208 N ATOM 2 C LIG 1 1.260 -1.737 0.855 0.00 0.00 +0.351 A ATOM 3 O LIG 1 1.471 -1.046 1.842 0.00 0.00 -0.244 OA ATOM 4 N LIG 1 2.036 -1.933 -0.276 0.00 0.00 -0.250 N ATOM 5 C LIG 1 1.304 -2.767 -1.050 0.00 0.00 +0.230 A ATOM 6 N LIG 1 0.163 -3.146 -0.565 0.00 0.00 -0.157 NA ENDROOT BRANCH 4 7 ATOM 7 C LIG 1 3.303 -1.372 -0.573 0.00 0.00 +0.052 A ATOM 8 C LIG 1 3.950 -0.506 0.319 0.00 0.00 +0.027 A ATOM 9 C LIG 1 5.206 0.045 0.023 0.00 0.00 +0.010 A ATOM 10 C LIG 1 5.864 -0.248 -1.177 0.00 0.00 -0.018 A ATOM 11 C LIG 1 5.221 -1.112 -2.071 0.00 0.00 +0.010 A ATOM 12 C LIG 1 3.965 -1.665 -1.775 0.00 0.00 +0.027 A BRANCH 10 13 ATOM 13 C LIG 1 7.182 0.330 -1.487 0.00 0.00 -0.018 A ATOM 14 C LIG 1 8.255 0.207 -0.589 0.00 0.00 +0.008 A ATOM 15 C LIG 1 9.508 0.754 -0.883 0.00 0.00 +0.001 A ATOM 16 C LIG 1 9.707 1.436 -2.081 0.00 0.00 +0.000 A ATOM 17 C LIG 1 8.656 1.570 -2.985 0.00 0.00 +0.001 A ATOM 18 C LIG 1 7.405 1.021 -2.690 0.00 0.00 +0.008 A ENDBRANCH 10 13 ENDBRANCH 4 7 BRANCH 1 19 ATOM 19 C LIG 1 -1.050 -2.538 1.506 0.00 0.00 +0.184 C BRANCH 19 26 ATOM 20 C LIG 1 -2.741 2.174 1.958 0.00 0.00 +0.047 C ATOM 21 C LIG 1 -2.879 0.816 1.331 0.00 0.00 -0.008 A ATOM 22 C LIG 1 -3.904 0.515 0.418 0.00 0.00 +0.128 A ATOM 23 C LIG 1 -3.941 -0.732 -0.228 0.00 0.00 -0.008 A ATOM 24 C LIG 1 -4.937 -1.041 -1.308 0.00 0.00 +0.047 C ATOM 25 C LIG 1 -3.020 -1.721 0.151 0.00 0.00 +0.012 A ATOM 26 C LIG 1 -2.046 -1.470 1.126 0.00 0.00 -0.025 A ATOM 27 C LIG 1 -1.973 -0.192 1.695 0.00 0.00 +0.012 A BRANCH 22 28 ATOM 28 O LIG 1 -4.803 1.491 0.083 0.00 0.00 -0.475 OA BRANCH 28 29 ATOM 29 C LIG 1 -6.062 1.517 0.797 0.00 0.00 +0.200 C ATOM 30 C LIG 1 -6.217 0.525 1.965 0.00 0.00 +0.067 C ATOM 31 C LIG 1 -6.216 2.952 1.325 0.00 0.00 +0.067 C BRANCH 29 32 ATOM 32 C LIG 1 -7.196 1.311 -0.226 0.00 0.00 +0.348 C ATOM 33 O LIG 1 -7.108 1.289 -1.444 0.00 0.00 -0.247 OA BRANCH 32 34 ATOM 34 O LIG 1 -8.420 1.184 0.336 0.00 0.00 -0.478 OA ATOM 35 H LIG 1 -9.015 1.087 -0.437 0.00 0.00 +0.295 HD ENDBRANCH 32 34 ENDBRANCH 29 32 ENDBRANCH 28 29 ENDBRANCH 22 28 ENDBRANCH 19 26 ENDBRANCH 1 19 TORSDOF 8