REMARK Name = BDB001928 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.030 1.099 -0.592 0.00 0.00 +0.019 A ATOM 2 C LIG 1 -1.369 0.710 -0.301 0.00 0.00 +0.042 A ATOM 3 CA LIG 1 -2.004 1.764 0.341 0.00 0.00 +0.102 A ATOM 4 N LIG 1 -1.072 2.774 0.443 0.00 0.00 -0.356 N ATOM 5 H LIG 1 -1.262 3.670 0.877 0.00 0.00 +0.165 HD ATOM 6 C LIG 1 0.121 2.380 -0.098 0.00 0.00 +0.093 A ENDROOT BRANCH 1 9 ATOM 7 C LIG 1 3.261 -0.276 -1.067 0.00 0.00 +0.220 A ATOM 8 N LIG 1 2.220 0.396 -0.558 0.00 0.00 -0.214 NA ATOM 9 C LIG 1 1.051 0.364 -1.236 0.00 0.00 +0.080 A ATOM 10 C LIG 1 0.888 -0.307 -2.434 0.00 0.00 -0.006 A ATOM 11 C LIG 1 -0.374 -0.354 -3.228 0.00 0.00 +0.047 C ATOM 12 C LIG 1 2.014 -0.975 -2.861 0.00 0.00 +0.120 A ATOM 13 N LIG 1 3.189 -0.974 -2.207 0.00 0.00 -0.222 NA BRANCH 7 14 ATOM 14 N LIG 1 4.422 -0.211 -0.302 0.00 0.00 -0.283 N ATOM 15 H LIG 1 4.230 0.376 0.494 0.00 0.00 +0.155 HD BRANCH 14 17 ATOM 16 C LIG 1 6.687 -0.505 0.568 0.00 0.00 -0.026 A ATOM 17 C LIG 1 5.748 -0.628 -0.487 0.00 0.00 +0.037 A ATOM 18 C LIG 1 6.184 -1.226 -1.680 0.00 0.00 +0.023 A ATOM 19 C LIG 1 7.503 -1.658 -1.850 0.00 0.00 +0.002 A ATOM 20 C LIG 1 8.421 -1.509 -0.820 0.00 0.00 +0.000 A ATOM 21 C LIG 1 8.016 -0.937 0.381 0.00 0.00 +0.005 A BRANCH 16 23 ATOM 22 C LIG 1 6.427 1.618 1.897 0.00 0.00 +0.009 C ATOM 23 C LIG 1 6.332 0.099 1.911 0.00 0.00 +0.033 C ENDBRANCH 16 23 ENDBRANCH 14 17 ENDBRANCH 7 14 ENDBRANCH 1 9 BRANCH 3 24 ATOM 24 C LIG 1 -3.347 1.927 0.852 0.00 0.00 +0.261 C ATOM 25 N LIG 1 -4.136 0.804 0.797 0.00 0.00 -0.301 N ATOM 26 H LIG 1 -3.669 -0.084 0.687 0.00 0.00 +0.150 HD ATOM 27 O LIG 1 -3.748 2.994 1.307 0.00 0.00 -0.269 OA BRANCH 25 28 ATOM 28 CA LIG 1 -5.440 0.766 1.456 0.00 0.00 +0.129 C BRANCH 28 29 ATOM 29 C LIG 1 -6.359 -0.224 0.738 0.00 0.00 -0.025 A ATOM 30 C LIG 1 -7.254 -1.071 1.412 0.00 0.00 +0.005 A ATOM 31 C LIG 1 -8.094 -1.941 0.707 0.00 0.00 +0.000 A ATOM 32 C LIG 1 -8.069 -1.967 -0.684 0.00 0.00 +0.000 A ATOM 33 C LIG 1 -7.213 -1.116 -1.374 0.00 0.00 +0.000 A ATOM 34 C LIG 1 -6.375 -0.248 -0.671 0.00 0.00 +0.005 A ENDBRANCH 28 29 BRANCH 28 35 ATOM 35 C LIG 1 -5.224 0.516 2.971 0.00 0.00 +0.182 C BRANCH 35 36 ATOM 36 O LIG 1 -4.498 -0.695 3.218 0.00 0.00 -0.393 OA ATOM 37 H LIG 1 -4.966 -1.421 2.772 0.00 0.00 +0.209 HD ENDBRANCH 35 36 ENDBRANCH 28 35 ENDBRANCH 25 28 ENDBRANCH 3 24 TORSDOF 9