REMARK Name = BDB015416 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -2.305 0.437 -0.744 0.00 0.00 +0.253 C ATOM 2 N LIG 1 -1.653 -0.268 0.271 0.00 0.00 -0.238 N ATOM 3 C LIG 1 -0.412 -0.914 0.230 0.00 0.00 +0.188 C ATOM 4 N LIG 1 -0.154 -1.659 1.269 0.00 0.00 -0.254 NA ATOM 5 C LIG 1 -1.335 -1.601 2.142 0.00 0.00 +0.164 C ATOM 6 C LIG 1 -2.221 -0.521 1.568 0.00 0.00 +0.140 C ATOM 7 O LIG 1 -1.939 0.558 -1.909 0.00 0.00 -0.270 OA ENDROOT BRANCH 1 10 ATOM 8 C LIG 1 -4.881 -0.699 -1.625 0.00 0.00 +0.044 C ATOM 9 C LIG 1 -4.811 0.550 -0.793 0.00 0.00 -0.038 A ATOM 10 C LIG 1 -3.582 1.093 -0.381 0.00 0.00 +0.040 A ATOM 11 C LIG 1 -3.527 2.282 0.359 0.00 0.00 +0.013 A ATOM 12 C LIG 1 -4.709 2.929 0.714 0.00 0.00 +0.001 A ATOM 13 C LIG 1 -5.936 2.397 0.321 0.00 0.00 +0.000 A ATOM 14 C LIG 1 -5.989 1.220 -0.431 0.00 0.00 +0.004 A ENDBRANCH 1 10 BRANCH 3 15 ATOM 15 N LIG 1 0.467 -0.784 -0.818 0.00 0.00 -0.301 N ATOM 16 C LIG 1 1.513 -1.808 -1.006 0.00 0.00 +0.123 C ATOM 17 C LIG 1 2.791 -1.445 -0.217 0.00 0.00 +0.103 C ATOM 18 N LIG 1 3.323 -0.129 -0.633 0.00 0.00 -0.296 NA ATOM 19 C LIG 1 2.269 0.894 -0.446 0.00 0.00 +0.103 C ATOM 20 C LIG 1 0.960 0.553 -1.198 0.00 0.00 +0.123 C BRANCH 18 21 ATOM 21 C LIG 1 4.566 0.321 0.007 0.00 0.00 +0.057 C ATOM 22 C LIG 1 4.860 -0.215 1.426 0.00 0.00 +0.019 C ATOM 23 C LIG 1 6.329 -0.368 0.958 0.00 0.00 +0.003 C ATOM 24 C LIG 1 5.774 -0.514 -0.480 0.00 0.00 +0.019 C ENDBRANCH 18 21 ENDBRANCH 3 15 TORSDOF 3