REMARK Name = BDB057482 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 CA LIG 1 3.213 0.431 -0.376 0.00 0.00 +0.184 C ENDROOT BRANCH 1 2 ATOM 2 N LIG 1 4.647 0.062 -0.320 0.00 0.00 -0.331 N ATOM 3 H LIG 1 5.117 0.547 0.463 0.00 0.00 +0.147 HD BRANCH 2 5 ATOM 4 C LIG 1 6.873 0.228 -1.320 0.00 0.00 +0.043 A ATOM 5 C LIG 1 5.466 0.157 -1.460 0.00 0.00 +0.039 A ATOM 6 C LIG 1 4.960 0.032 -2.762 0.00 0.00 +0.023 A ATOM 7 C LIG 1 5.802 0.067 -3.881 0.00 0.00 +0.002 A ATOM 8 C LIG 1 7.176 0.204 -3.723 0.00 0.00 +0.001 A ATOM 9 C LIG 1 7.716 0.283 -2.443 0.00 0.00 +0.013 A BRANCH 4 11 ATOM 10 O LIG 1 6.972 1.024 0.887 0.00 0.00 -0.287 OA ATOM 11 C LIG 1 7.482 0.298 0.035 0.00 0.00 +0.195 C BRANCH 11 12 ATOM 12 C LIG 1 8.688 -0.499 0.381 0.00 0.00 +0.022 A ATOM 13 C LIG 1 9.573 0.009 1.339 0.00 0.00 +0.012 A ATOM 14 C LIG 1 10.712 -0.716 1.694 0.00 0.00 +0.001 A ATOM 15 C LIG 1 10.962 -1.954 1.103 0.00 0.00 +0.000 A ATOM 16 C LIG 1 10.072 -2.474 0.162 0.00 0.00 +0.001 A ATOM 17 C LIG 1 8.932 -1.752 -0.197 0.00 0.00 +0.012 A ENDBRANCH 11 12 ENDBRANCH 4 11 ENDBRANCH 2 5 ENDBRANCH 1 2 BRANCH 1 18 ATOM 18 C LIG 1 3.040 1.930 -0.637 0.00 0.00 +0.326 C ATOM 19 O LIG 1 3.351 2.847 0.109 0.00 0.00 -0.249 OA BRANCH 18 20 ATOM 20 OXT LIG 1 2.490 2.199 -1.843 0.00 0.00 -0.479 OA ATOM 21 HXT LIG 1 2.465 3.179 -1.868 0.00 0.00 +0.295 HD ENDBRANCH 18 20 ENDBRANCH 1 18 BRANCH 1 22 ATOM 22 C LIG 1 2.563 0.077 0.976 0.00 0.00 +0.068 C BRANCH 22 23 ATOM 23 C LIG 1 1.055 0.163 0.950 0.00 0.00 -0.045 A ATOM 24 C LIG 1 0.399 1.307 1.417 0.00 0.00 +0.007 A ATOM 25 C LIG 1 -0.994 1.390 1.365 0.00 0.00 +0.046 A ATOM 26 C LIG 1 -1.753 0.338 0.849 0.00 0.00 +0.121 A ATOM 27 C LIG 1 -1.105 -0.805 0.384 0.00 0.00 +0.046 A ATOM 28 C LIG 1 0.291 -0.891 0.433 0.00 0.00 +0.007 A BRANCH 26 29 ATOM 29 O LIG 1 -3.103 0.553 0.858 0.00 0.00 -0.489 OA BRANCH 29 30 ATOM 30 C LIG 1 -3.931 -0.477 0.322 0.00 0.00 +0.262 C BRANCH 30 31 ATOM 31 C LIG 1 -5.404 -0.046 0.398 0.00 0.00 +0.181 C ATOM 32 O LIG 1 -6.224 -1.137 -0.070 0.00 0.00 -0.369 OA ATOM 33 C LIG 1 -6.764 -1.921 1.001 0.00 0.00 +0.188 C ATOM 34 C LIG 1 -7.913 -2.797 0.488 0.00 0.00 +0.188 C ATOM 35 O LIG 1 -9.172 -2.110 0.482 0.00 0.00 -0.375 OA ATOM 36 C LIG 1 -9.339 -1.212 -0.620 0.00 0.00 +0.188 C ATOM 37 C LIG 1 -9.598 0.215 -0.127 0.00 0.00 +0.188 C ATOM 38 O LIG 1 -8.408 0.713 0.480 0.00 0.00 -0.375 OA ATOM 39 C LIG 1 -8.323 2.135 0.513 0.00 0.00 +0.188 C ATOM 40 C LIG 1 -6.960 2.520 1.097 0.00 0.00 +0.188 C ATOM 41 O LIG 1 -5.856 2.425 0.188 0.00 0.00 -0.375 OA ATOM 42 C LIG 1 -5.685 1.179 -0.502 0.00 0.00 +0.194 C ENDBRANCH 30 31 ENDBRANCH 29 30 ENDBRANCH 26 29 ENDBRANCH 22 23 ENDBRANCH 1 22 TORSDOF 11