REMARK Name = LIG000341 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -0.279 -0.237 1.213 0.00 0.00 +0.034 A ATOM 2 C LIG 1 -1.269 -0.163 0.225 0.00 0.00 +0.029 A ATOM 3 C LIG 1 -2.597 -0.276 0.606 0.00 0.00 -0.016 A ATOM 4 C LIG 1 -3.832 -0.218 -0.229 0.00 0.00 +0.144 C ATOM 5 N LIG 1 -4.885 -0.481 0.744 0.00 0.00 -0.282 N ATOM 6 C LIG 1 -4.395 -0.541 2.041 0.00 0.00 +0.248 C ATOM 7 O LIG 1 -5.023 -0.651 3.076 0.00 0.00 -0.270 OA ATOM 8 C LIG 1 -2.934 -0.455 1.945 0.00 0.00 +0.042 A ATOM 9 C LIG 1 -1.988 -0.526 2.945 0.00 0.00 +0.015 A ATOM 10 C LIG 1 -0.646 -0.416 2.566 0.00 0.00 +0.024 A ENDROOT BRANCH 5 11 ATOM 11 C LIG 1 -6.304 -0.303 0.462 0.00 0.00 +0.163 C ATOM 12 C LIG 1 -6.674 1.173 0.238 0.00 0.00 +0.240 C ATOM 13 O LIG 1 -5.940 2.123 0.499 0.00 0.00 -0.273 OA ATOM 14 N LIG 1 -7.925 1.390 -0.296 0.00 0.00 -0.255 N ATOM 15 H LIG 1 -8.154 2.363 -0.455 0.00 0.00 +0.158 HD ATOM 16 C LIG 1 -8.646 0.499 -1.049 0.00 0.00 +0.219 C ATOM 17 O LIG 1 -9.563 0.876 -1.772 0.00 0.00 -0.275 OA ATOM 18 C LIG 1 -8.267 -0.958 -0.916 0.00 0.00 +0.098 C ATOM 19 C LIG 1 -6.764 -1.120 -0.741 0.00 0.00 +0.041 C ENDBRANCH 5 11 BRANCH 1 21 ATOM 20 C LIG 1 1.719 0.029 -0.284 0.00 0.00 +0.267 C ATOM 21 N LIG 1 1.096 -0.140 0.938 0.00 0.00 -0.280 N ATOM 22 H LIG 1 1.743 -0.201 1.723 0.00 0.00 +0.155 HD ATOM 23 O LIG 1 1.183 0.126 -1.382 0.00 0.00 -0.268 OA BRANCH 20 29 ATOM 24 C LIG 1 8.183 0.398 -0.811 0.00 0.00 +0.121 A ATOM 25 C LIG 1 7.347 0.225 0.292 0.00 0.00 +0.055 A ATOM 26 C LIG 1 5.948 0.179 0.128 0.00 0.00 +0.004 A ATOM 27 C LIG 1 5.385 0.310 -1.158 0.00 0.00 -0.014 A ATOM 28 C LIG 1 3.994 0.263 -1.304 0.00 0.00 +0.041 A ATOM 29 C LIG 1 3.215 0.087 -0.168 0.00 0.00 +0.126 A ATOM 30 N LIG 1 3.719 -0.044 1.092 0.00 0.00 -0.250 NA ATOM 31 C LIG 1 6.235 0.484 -2.258 0.00 0.00 +0.012 A ATOM 32 C LIG 1 5.067 0.007 1.201 0.00 0.00 +0.120 A ATOM 33 C LIG 1 7.620 0.525 -2.082 0.00 0.00 +0.046 A BRANCH 24 35 ATOM 34 C LIG 1 10.179 0.367 0.485 0.00 0.00 +0.277 C ATOM 35 O LIG 1 9.549 0.456 -0.786 0.00 0.00 -0.495 OA ENDBRANCH 24 35 ENDBRANCH 20 29 ENDBRANCH 1 21 TORSDOF 4