REMARK Name = BDB057560 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 CA LIG 1 -0.926 -2.379 0.109 0.00 0.00 +0.184 C ENDROOT BRANCH 1 2 ATOM 2 C LIG 1 -0.853 -3.895 0.314 0.00 0.00 +0.326 C ATOM 3 O LIG 1 -0.367 -4.497 1.261 0.00 0.00 -0.249 OA BRANCH 2 4 ATOM 4 OXT LIG 1 -1.423 -4.583 -0.702 0.00 0.00 -0.479 OA ATOM 5 HXT LIG 1 -1.363 -5.521 -0.429 0.00 0.00 +0.295 HD ENDBRANCH 2 4 ENDBRANCH 1 2 BRANCH 1 6 ATOM 6 N LIG 1 -2.321 -1.874 0.052 0.00 0.00 -0.331 N ATOM 7 H LIG 1 -2.695 -1.999 -0.902 0.00 0.00 +0.147 HD BRANCH 6 8 ATOM 8 C LIG 1 -3.332 -2.198 0.966 0.00 0.00 +0.039 A ATOM 9 C LIG 1 -4.688 -1.958 0.629 0.00 0.00 +0.043 A ATOM 10 C LIG 1 -5.731 -2.229 1.532 0.00 0.00 +0.013 A ATOM 11 C LIG 1 -5.440 -2.690 2.811 0.00 0.00 +0.001 A ATOM 12 C LIG 1 -4.114 -2.879 3.183 0.00 0.00 +0.002 A ATOM 13 C LIG 1 -3.077 -2.626 2.276 0.00 0.00 +0.023 A BRANCH 9 14 ATOM 14 C LIG 1 -5.039 -1.460 -0.729 0.00 0.00 +0.195 C ATOM 15 O LIG 1 -4.500 -1.967 -1.711 0.00 0.00 -0.287 OA BRANCH 14 16 ATOM 16 C LIG 1 -6.024 -0.362 -0.916 0.00 0.00 +0.022 A ATOM 17 C LIG 1 -6.762 -0.324 -2.104 0.00 0.00 +0.012 A ATOM 18 C LIG 1 -7.696 0.692 -2.320 0.00 0.00 +0.005 A ATOM 19 C LIG 1 -7.897 1.687 -1.353 0.00 0.00 -0.033 A ATOM 20 C LIG 1 -7.136 1.655 -0.175 0.00 0.00 +0.005 A ATOM 21 C LIG 1 -6.201 0.640 0.043 0.00 0.00 +0.012 A BRANCH 19 22 ATOM 22 C LIG 1 -8.899 2.800 -1.589 0.00 0.00 +0.119 C BRANCH 22 23 ATOM 23 N LIG 1 -9.926 2.892 -0.535 0.00 0.00 -0.304 NA ATOM 24 C LIG 1 -10.684 4.136 -0.683 0.00 0.00 +0.104 C ATOM 25 C LIG 1 -10.840 1.747 -0.578 0.00 0.00 +0.104 C ENDBRANCH 22 23 ENDBRANCH 19 22 ENDBRANCH 14 16 ENDBRANCH 9 14 ENDBRANCH 6 8 ENDBRANCH 1 6 BRANCH 1 26 ATOM 26 C LIG 1 -0.072 -1.583 1.111 0.00 0.00 +0.068 C BRANCH 26 30 ATOM 27 C LIG 1 4.101 -1.480 -0.040 0.00 0.00 +0.121 A ATOM 28 C LIG 1 3.647 -2.437 0.866 0.00 0.00 +0.046 A ATOM 29 C LIG 1 2.300 -2.466 1.244 0.00 0.00 +0.007 A ATOM 30 C LIG 1 1.391 -1.539 0.721 0.00 0.00 -0.045 A ATOM 31 C LIG 1 1.850 -0.583 -0.193 0.00 0.00 +0.007 A ATOM 32 C LIG 1 3.195 -0.558 -0.568 0.00 0.00 +0.046 A BRANCH 27 33 ATOM 33 O LIG 1 5.382 -1.345 -0.497 0.00 0.00 -0.492 OA BRANCH 33 34 ATOM 34 C LIG 1 6.383 -2.154 0.122 0.00 0.00 +0.235 C BRANCH 34 35 ATOM 35 C LIG 1 7.752 -1.804 -0.463 0.00 0.00 +0.100 C BRANCH 35 38 ATOM 36 C LIG 1 8.620 -0.516 2.543 0.00 0.00 +0.088 C ATOM 37 C LIG 1 8.595 0.031 1.176 0.00 0.00 +0.126 A ATOM 38 C LIG 1 8.244 -0.455 -0.067 0.00 0.00 +0.086 A ATOM 39 N LIG 1 8.445 0.527 -1.012 0.00 0.00 -0.214 NA ATOM 40 C LIG 1 8.877 1.566 -0.323 0.00 0.00 +0.228 A ATOM 41 O LIG 1 8.996 1.328 1.022 0.00 0.00 -0.440 OA BRANCH 40 42 ATOM 42 C LIG 1 9.240 2.900 -0.793 0.00 0.00 +0.037 A ATOM 43 C LIG 1 9.127 3.208 -2.158 0.00 0.00 +0.013 A ATOM 44 C LIG 1 9.466 4.475 -2.639 0.00 0.00 +0.001 A ATOM 45 C LIG 1 9.924 5.453 -1.759 0.00 0.00 +0.000 A ATOM 46 C LIG 1 10.043 5.165 -0.401 0.00 0.00 +0.001 A ATOM 47 C LIG 1 9.703 3.897 0.079 0.00 0.00 +0.013 A ENDBRANCH 40 42 ENDBRANCH 35 38 ENDBRANCH 34 35 ENDBRANCH 33 34 ENDBRANCH 27 33 ENDBRANCH 26 30 ENDBRANCH 1 26 TORSDOF 15