REMARK Name = BDB057802 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -2.051 -1.282 0.226 0.00 0.00 +0.005 A ATOM 2 C LIG 1 -2.775 -0.242 0.812 0.00 0.00 -0.046 A ATOM 3 C LIG 1 -2.091 0.912 1.195 0.00 0.00 +0.005 A ATOM 4 C LIG 1 -0.707 1.013 1.004 0.00 0.00 +0.023 A ATOM 5 C LIG 1 0.044 -0.027 0.430 0.00 0.00 +0.030 A ATOM 6 C LIG 1 -0.666 -1.171 0.038 0.00 0.00 +0.023 A ENDROOT BRANCH 5 7 ATOM 7 N LIG 1 1.429 0.117 0.251 0.00 0.00 -0.330 N ATOM 8 C LIG 1 2.140 -0.828 -0.610 0.00 0.00 +0.106 C ATOM 9 C LIG 1 3.471 -0.243 -1.088 0.00 0.00 +0.038 C ATOM 10 C LIG 1 4.176 0.631 -0.034 0.00 0.00 +0.060 C ATOM 11 C LIG 1 3.653 0.303 1.368 0.00 0.00 +0.038 C ATOM 12 C LIG 1 2.153 0.597 1.442 0.00 0.00 +0.106 C BRANCH 10 13 ATOM 13 N LIG 1 5.634 0.578 -0.225 0.00 0.00 -0.299 NA ATOM 14 C LIG 1 6.316 -0.611 0.284 0.00 0.00 +0.085 C ATOM 15 C LIG 1 7.779 -0.234 0.116 0.00 0.00 +0.017 C ATOM 16 C LIG 1 7.814 1.281 0.283 0.00 0.00 +0.017 C ATOM 17 C LIG 1 6.354 1.712 0.353 0.00 0.00 +0.085 C ENDBRANCH 10 13 ENDBRANCH 5 7 BRANCH 2 18 ATOM 18 C LIG 1 -4.270 -0.348 0.991 0.00 0.00 +0.050 C BRANCH 18 19 ATOM 19 C LIG 1 -5.025 0.170 -0.245 0.00 0.00 +0.089 C BRANCH 19 20 ATOM 20 N LIG 1 -6.490 0.129 -0.060 0.00 0.00 -0.302 NA ATOM 21 C LIG 1 -7.038 -1.230 -0.202 0.00 0.00 +0.084 C ATOM 22 C LIG 1 -7.258 -1.449 -1.693 0.00 0.00 +0.017 C ATOM 23 C LIG 1 -7.306 -0.054 -2.298 0.00 0.00 +0.017 C ATOM 24 C LIG 1 -7.181 0.891 -1.114 0.00 0.00 +0.084 C ENDBRANCH 19 20 ENDBRANCH 18 19 ENDBRANCH 2 18 TORSDOF 5