REMARK Name = BDB036014 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 3.629 2.222 -0.203 0.00 0.00 +0.056 A ATOM 2 N LIG 1 3.312 1.506 -1.328 0.00 0.00 -0.255 NA ATOM 3 C LIG 1 2.087 0.927 -1.456 0.00 0.00 +0.050 A ATOM 4 C LIG 1 1.166 1.083 -0.445 0.00 0.00 +0.004 A ATOM 5 C LIG 1 -0.224 0.574 -0.324 0.00 0.00 +0.151 C ATOM 6 N LIG 1 -0.663 1.092 0.968 0.00 0.00 -0.263 N ATOM 7 C LIG 1 0.351 1.832 1.585 0.00 0.00 +0.252 C ATOM 8 O LIG 1 0.385 2.415 2.653 0.00 0.00 -0.270 OA ATOM 9 C LIG 1 1.503 1.818 0.678 0.00 0.00 +0.045 A ATOM 10 C LIG 1 2.734 2.406 0.840 0.00 0.00 +0.038 A ENDROOT BRANCH 6 11 ATOM 11 C LIG 1 -1.968 0.850 1.477 0.00 0.00 +0.037 A ATOM 12 C LIG 1 -2.881 0.060 0.756 0.00 0.00 +0.028 A ATOM 13 C LIG 1 -4.206 -0.208 1.187 0.00 0.00 -0.032 A ATOM 14 C LIG 1 -4.576 0.356 2.419 0.00 0.00 +0.005 A ATOM 15 C LIG 1 -3.689 1.136 3.162 0.00 0.00 +0.002 A ATOM 16 C LIG 1 -2.398 1.381 2.693 0.00 0.00 +0.023 A BRANCH 13 17 ATOM 17 C LIG 1 -5.189 -1.115 0.281 0.00 0.00 +0.056 C ATOM 18 C LIG 1 -4.875 -2.658 0.284 0.00 0.00 +0.022 C ATOM 19 C LIG 1 -5.955 -2.816 1.382 0.00 0.00 -0.012 C ATOM 20 C LIG 1 -6.796 -4.075 1.329 0.00 0.00 +0.007 C ATOM 21 C LIG 1 -6.603 -1.529 0.818 0.00 0.00 +0.022 C BRANCH 17 22 ATOM 22 C LIG 1 -5.261 -0.511 -1.179 0.00 0.00 +0.144 A ATOM 23 N LIG 1 -5.911 0.624 -1.577 0.00 0.00 -0.320 N ATOM 24 C LIG 1 -6.697 1.515 -0.769 0.00 0.00 +0.151 C ATOM 25 C LIG 1 -5.641 0.765 -2.903 0.00 0.00 +0.224 A ATOM 26 N LIG 1 -4.863 -0.215 -3.299 0.00 0.00 -0.138 NA ATOM 27 N LIG 1 -4.615 -1.016 -2.211 0.00 0.00 -0.134 NA ENDBRANCH 17 22 ENDBRANCH 13 17 ENDBRANCH 6 11 BRANCH 3 28 ATOM 28 C LIG 1 1.770 0.157 -2.712 0.00 0.00 +0.038 C ATOM 29 C LIG 1 2.804 -0.762 -3.321 0.00 0.00 +0.010 C ATOM 30 C LIG 1 1.593 -1.344 -2.657 0.00 0.00 +0.010 C ENDBRANCH 3 28 BRANCH 1 31 ATOM 31 C LIG 1 5.027 2.819 -0.121 0.00 0.00 +0.139 C BRANCH 31 35 ATOM 32 C LIG 1 6.620 -1.609 -1.096 0.00 0.00 +0.009 C ATOM 33 C LIG 1 6.230 -0.553 -0.062 0.00 0.00 +0.000 C ATOM 34 C LIG 1 6.447 0.867 -0.608 0.00 0.00 +0.088 C ATOM 35 N LIG 1 6.101 1.928 0.346 0.00 0.00 -0.296 NA ATOM 36 C LIG 1 5.950 1.490 1.732 0.00 0.00 +0.085 C ATOM 37 C LIG 1 7.046 0.499 2.115 0.00 0.00 +0.016 C ATOM 38 C LIG 1 7.011 -0.759 1.244 0.00 0.00 +0.006 C ENDBRANCH 31 35 ENDBRANCH 1 31 TORSDOF 6