REMARK Name = BDB001929 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.789 1.029 0.232 0.00 0.00 +0.019 A ATOM 2 C LIG 1 0.301 1.341 1.090 0.00 0.00 +0.042 A ATOM 3 CA LIG 1 1.486 1.021 0.444 0.00 0.00 +0.102 A ATOM 4 N LIG 1 1.130 0.539 -0.797 0.00 0.00 -0.356 N ATOM 5 H LIG 1 1.779 0.261 -1.521 0.00 0.00 +0.165 HD ATOM 6 C LIG 1 -0.233 0.519 -0.924 0.00 0.00 +0.093 A ENDROOT BRANCH 1 9 ATOM 7 C LIG 1 -2.099 3.462 1.508 0.00 0.00 +0.047 C ATOM 8 C LIG 1 -2.821 2.249 1.026 0.00 0.00 -0.006 A ATOM 9 C LIG 1 -2.229 1.146 0.436 0.00 0.00 +0.080 A ATOM 10 N LIG 1 -2.935 0.079 -0.006 0.00 0.00 -0.214 NA ATOM 11 C LIG 1 -4.263 0.086 0.165 0.00 0.00 +0.220 A ATOM 12 N LIG 1 -4.918 1.097 0.747 0.00 0.00 -0.222 NA ATOM 13 C LIG 1 -4.188 2.148 1.163 0.00 0.00 +0.120 A BRANCH 11 14 ATOM 14 N LIG 1 -4.921 -1.042 -0.307 0.00 0.00 -0.281 N ATOM 15 H LIG 1 -4.251 -1.692 -0.697 0.00 0.00 +0.155 HD BRANCH 14 16 ATOM 16 C LIG 1 -6.257 -1.460 -0.332 0.00 0.00 +0.069 A ATOM 17 C LIG 1 -6.561 -2.707 -0.904 0.00 0.00 +0.144 A ATOM 18 F LIG 1 -5.565 -3.459 -1.403 0.00 0.00 -0.204 F ATOM 19 C LIG 1 -7.863 -3.199 -0.973 0.00 0.00 +0.040 A ATOM 20 C LIG 1 -8.909 -2.438 -0.464 0.00 0.00 +0.003 A ATOM 21 C LIG 1 -8.639 -1.195 0.108 0.00 0.00 +0.002 A ATOM 22 C LIG 1 -7.325 -0.712 0.172 0.00 0.00 +0.026 A ENDBRANCH 14 16 ENDBRANCH 11 14 ENDBRANCH 1 9 BRANCH 3 23 ATOM 23 C LIG 1 2.833 1.187 0.943 0.00 0.00 +0.261 C ATOM 24 N LIG 1 3.788 0.441 0.290 0.00 0.00 -0.301 N ATOM 25 H LIG 1 3.456 -0.376 -0.203 0.00 0.00 +0.150 HD ATOM 26 O LIG 1 3.113 1.923 1.884 0.00 0.00 -0.269 OA BRANCH 24 27 ATOM 27 CA LIG 1 5.170 0.353 0.769 0.00 0.00 +0.129 C BRANCH 27 28 ATOM 28 C LIG 1 5.898 -0.682 -0.074 0.00 0.00 -0.025 A ATOM 29 C LIG 1 6.296 -1.899 0.499 0.00 0.00 +0.005 A ATOM 30 C LIG 1 6.946 -2.867 -0.270 0.00 0.00 +0.000 A ATOM 31 C LIG 1 7.201 -2.632 -1.619 0.00 0.00 +0.000 A ATOM 32 C LIG 1 6.806 -1.430 -2.204 0.00 0.00 +0.000 A ATOM 33 C LIG 1 6.156 -0.461 -1.438 0.00 0.00 +0.005 A ENDBRANCH 27 28 BRANCH 27 34 ATOM 34 C LIG 1 5.916 1.713 0.758 0.00 0.00 +0.182 C BRANCH 34 35 ATOM 35 O LIG 1 5.681 2.469 1.947 0.00 0.00 -0.393 OA ATOM 36 H LIG 1 4.708 2.487 2.087 0.00 0.00 +0.209 HD ENDBRANCH 34 35 ENDBRANCH 27 34 ENDBRANCH 24 27 ENDBRANCH 3 23 TORSDOF 8