REMARK Name = BDB007475 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N LIG 1 0.908 -0.248 0.044 0.00 0.00 -0.201 N ATOM 2 C LIG 1 2.136 0.365 -0.221 0.00 0.00 +0.281 A ATOM 3 O LIG 1 2.629 0.728 -1.276 0.00 0.00 -0.265 OA ATOM 4 C LIG 1 2.811 0.530 1.113 0.00 0.00 +0.067 A ATOM 5 C LIG 1 1.939 0.004 1.988 0.00 0.00 +0.116 A ATOM 6 N LIG 1 0.762 -0.444 1.431 0.00 0.00 -0.295 N ATOM 7 H LIG 1 0.583 -1.421 1.672 0.00 0.00 +0.187 HD ENDROOT BRANCH 1 10 ATOM 8 C LIG 1 -2.374 -1.318 -1.320 0.00 0.00 -0.025 A ATOM 9 C LIG 1 -1.355 -1.004 -0.408 0.00 0.00 +0.053 A ATOM 10 C LIG 1 -0.117 -0.555 -0.871 0.00 0.00 +0.156 A ATOM 11 N LIG 1 0.120 -0.415 -2.193 0.00 0.00 -0.236 NA ATOM 12 C LIG 1 -0.867 -0.717 -3.062 0.00 0.00 +0.113 A ATOM 13 C LIG 1 -2.118 -1.164 -2.681 0.00 0.00 +0.025 A BRANCH 8 14 ATOM 14 C LIG 1 -3.721 -1.767 -0.830 0.00 0.00 +0.139 C BRANCH 14 17 ATOM 15 C LIG 1 -6.363 0.387 0.788 0.00 0.00 +0.109 C ATOM 16 C LIG 1 -5.625 -0.869 0.412 0.00 0.00 +0.210 C ATOM 17 N LIG 1 -4.469 -0.652 -0.299 0.00 0.00 -0.311 N ATOM 18 H LIG 1 -4.310 0.262 -0.703 0.00 0.00 +0.149 HD ATOM 19 O LIG 1 -6.037 -1.985 0.710 0.00 0.00 -0.276 OA ENDBRANCH 14 17 ENDBRANCH 8 14 ENDBRANCH 1 10 BRANCH 4 20 ATOM 20 C LIG 1 4.142 1.071 1.381 0.00 0.00 +0.007 A ATOM 21 C LIG 1 4.466 1.638 2.614 0.00 0.00 +0.119 A ATOM 22 N LIG 1 5.678 2.154 2.938 0.00 0.00 -0.263 NA ATOM 23 C LIG 1 6.624 2.120 1.977 0.00 0.00 +0.111 A ATOM 24 C LIG 1 6.413 1.593 0.716 0.00 0.00 +0.020 A ATOM 25 C LIG 1 5.157 1.064 0.419 0.00 0.00 +0.012 A ENDBRANCH 4 20 TORSDOF 4