REMARK Name = BDB050140 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -1.361 -0.984 -0.922 0.00 0.00 +0.140 A ATOM 2 N LIG 1 -0.282 -0.774 -0.217 0.00 0.00 -0.150 NA ATOM 3 N LIG 1 0.425 -1.902 0.111 0.00 0.00 -0.209 N ATOM 4 C LIG 1 0.103 -3.208 -0.223 0.00 0.00 +0.155 A ATOM 5 N LIG 1 0.953 -4.073 0.282 0.00 0.00 -0.234 NA ATOM 6 C LIG 1 1.854 -3.308 0.974 0.00 0.00 +0.143 A ATOM 7 C LIG 1 -1.043 -3.408 -1.015 0.00 0.00 +0.051 A ATOM 8 C LIG 1 1.583 -1.955 0.864 0.00 0.00 +0.111 A ATOM 9 C LIG 1 -1.778 -2.352 -1.376 0.00 0.00 +0.049 A ENDROOT BRANCH 8 10 ATOM 10 C LIG 1 2.299 -0.821 1.430 0.00 0.00 +0.096 A ATOM 11 N LIG 1 2.943 -1.103 2.582 0.00 0.00 -0.213 NA ATOM 12 C LIG 1 3.621 -0.106 3.153 0.00 0.00 +0.213 A ATOM 13 N LIG 1 3.748 1.123 2.645 0.00 0.00 -0.223 NA ATOM 14 C LIG 1 3.109 1.358 1.487 0.00 0.00 +0.116 A ATOM 15 C LIG 1 2.365 0.413 0.826 0.00 0.00 +0.050 A BRANCH 12 16 ATOM 16 N LIG 1 4.287 -0.378 4.329 0.00 0.00 -0.327 N ATOM 17 H LIG 1 5.068 0.253 4.431 0.00 0.00 +0.145 HD ATOM 18 H LIG 1 4.474 -1.369 4.392 0.00 0.00 +0.145 HD ENDBRANCH 12 16 ENDBRANCH 8 10 BRANCH 1 19 ATOM 19 N LIG 1 -2.177 0.069 -1.287 0.00 0.00 -0.323 N ATOM 20 H LIG 1 -3.142 -0.214 -1.467 0.00 0.00 +0.148 HD BRANCH 19 21 ATOM 21 CA LIG 1 -2.177 1.357 -0.580 0.00 0.00 +0.097 C BRANCH 21 23 ATOM 22 C LIG 1 -0.925 2.557 -2.493 0.00 0.00 +0.006 C ATOM 23 C LIG 1 -1.001 2.249 -1.002 0.00 0.00 +0.021 C ENDBRANCH 21 23 BRANCH 21 24 ATOM 24 C LIG 1 -3.535 2.051 -0.826 0.00 0.00 +0.178 C BRANCH 24 25 ATOM 25 O LIG 1 -4.599 1.156 -0.483 0.00 0.00 -0.393 OA ATOM 26 H LIG 1 -5.426 1.667 -0.536 0.00 0.00 +0.209 HD ENDBRANCH 24 25 ENDBRANCH 21 24 ENDBRANCH 19 21 ENDBRANCH 1 19 TORSDOF 7