REMARK Name = BDB050151 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.781 3.608 -0.154 0.00 0.00 +0.093 A ATOM 2 N LIG 1 -1.891 2.782 -0.254 0.00 0.00 -0.211 N ATOM 3 C LIG 1 -3.002 3.563 0.015 0.00 0.00 +0.155 A ATOM 4 C LIG 1 -4.260 2.931 -0.031 0.00 0.00 +0.051 A ATOM 5 C LIG 1 -4.329 1.631 -0.338 0.00 0.00 +0.049 A ATOM 6 C LIG 1 -3.061 0.890 -0.617 0.00 0.00 +0.140 A ATOM 7 N LIG 1 -2.679 4.811 0.273 0.00 0.00 -0.234 NA ATOM 8 N LIG 1 -1.879 1.452 -0.577 0.00 0.00 -0.150 NA ATOM 9 C LIG 1 -1.315 4.847 0.164 0.00 0.00 +0.141 A ENDROOT BRANCH 1 12 ATOM 10 C LIG 1 2.439 1.631 -0.111 0.00 0.00 -0.007 A ATOM 11 C LIG 1 1.101 1.984 0.098 0.00 0.00 +0.019 A ATOM 12 C LIG 1 0.610 3.210 -0.371 0.00 0.00 +0.003 A ATOM 13 C LIG 1 1.491 4.075 -1.040 0.00 0.00 +0.010 A ATOM 14 C LIG 1 2.827 3.721 -1.247 0.00 0.00 +0.001 A ATOM 15 C LIG 1 3.303 2.496 -0.783 0.00 0.00 +0.009 A BRANCH 10 17 ATOM 16 N LIG 1 4.139 -0.052 0.257 0.00 0.00 -0.285 NA ATOM 17 C LIG 1 2.913 0.328 0.393 0.00 0.00 +0.113 C BRANCH 16 18 ATOM 18 CA LIG 1 4.436 -1.389 0.823 0.00 0.00 +0.130 C BRANCH 18 20 ATOM 19 C LIG 1 4.411 -3.872 0.231 0.00 0.00 +0.006 C ATOM 20 C LIG 1 4.213 -2.448 -0.265 0.00 0.00 +0.025 C ENDBRANCH 18 20 BRANCH 18 21 ATOM 21 C LIG 1 5.891 -1.352 1.320 0.00 0.00 +0.182 C BRANCH 21 22 ATOM 22 O LIG 1 6.045 -0.267 2.236 0.00 0.00 -0.393 OA ATOM 23 H LIG 1 5.601 0.482 1.790 0.00 0.00 +0.209 HD ENDBRANCH 21 22 ENDBRANCH 18 21 ENDBRANCH 16 18 ENDBRANCH 10 17 ENDBRANCH 1 12 BRANCH 6 24 ATOM 24 N LIG 1 -3.042 -0.440 -0.960 0.00 0.00 -0.323 N ATOM 25 H LIG 1 -2.087 -0.779 -1.016 0.00 0.00 +0.148 HD BRANCH 24 26 ATOM 26 CA LIG 1 -4.024 -1.451 -0.563 0.00 0.00 +0.097 C BRANCH 26 27 ATOM 27 C LIG 1 -3.797 -2.684 -1.458 0.00 0.00 +0.021 C ATOM 28 C LIG 1 -4.903 -3.724 -1.351 0.00 0.00 +0.006 C ENDBRANCH 26 27 BRANCH 26 29 ATOM 29 C LIG 1 -3.867 -1.788 0.936 0.00 0.00 +0.178 C BRANCH 29 30 ATOM 30 O LIG 1 -4.364 -0.722 1.744 0.00 0.00 -0.393 OA ATOM 31 H LIG 1 -4.113 -0.917 2.664 0.00 0.00 +0.209 HD ENDBRANCH 29 30 ENDBRANCH 26 29 ENDBRANCH 24 26 ENDBRANCH 6 24 TORSDOF 11