REMARK Name = BDB063488 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.030 0.282 -0.300 0.00 0.00 +0.228 A ATOM 2 O LIG 1 0.189 1.540 0.176 0.00 0.00 -0.338 OA ATOM 3 N LIG 1 1.566 1.667 0.337 0.00 0.00 -0.056 NA ATOM 4 C LIG 1 2.047 0.475 -0.056 0.00 0.00 +0.204 A ATOM 5 N LIG 1 1.072 -0.412 -0.461 0.00 0.00 -0.191 NA ENDROOT BRANCH 4 6 ATOM 6 C LIG 1 3.459 0.133 -0.062 0.00 0.00 +0.041 A ATOM 7 C LIG 1 3.883 -1.124 -0.483 0.00 0.00 +0.122 A ATOM 8 N LIG 1 5.181 -1.523 -0.519 0.00 0.00 -0.263 NA ATOM 9 C LIG 1 6.102 -0.623 -0.115 0.00 0.00 +0.111 A ATOM 10 C LIG 1 5.788 0.653 0.322 0.00 0.00 +0.020 A ATOM 11 C LIG 1 4.447 1.034 0.347 0.00 0.00 +0.014 A ENDBRANCH 4 6 BRANCH 1 12 ATOM 12 C LIG 1 -1.438 -0.105 -0.553 0.00 0.00 +0.099 C BRANCH 12 13 ATOM 13 C LIG 1 -2.096 -0.649 0.716 0.00 0.00 +0.009 C BRANCH 13 14 ATOM 14 C LIG 1 -3.512 -1.184 0.485 0.00 0.00 +0.000 C BRANCH 14 16 ATOM 15 C LIG 1 -4.725 1.028 0.874 0.00 0.00 +0.004 C ATOM 16 C LIG 1 -4.528 -0.168 -0.043 0.00 0.00 -0.003 C ENDBRANCH 14 16 ENDBRANCH 13 14 ENDBRANCH 12 13 ENDBRANCH 1 12 TORSDOF 5