REMARK Name = BDB026476 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N LIG 1 0.214 -2.597 -3.909 0.00 0.00 -0.278 N ATOM 2 C LIG 1 -0.315 -3.423 -2.917 0.00 0.00 +0.305 C ATOM 3 O LIG 1 0.321 -4.152 -2.174 0.00 0.00 -0.252 OA ATOM 4 N LIG 1 -1.686 -3.193 -2.870 0.00 0.00 -0.281 N ATOM 5 C LIG 1 -2.098 -2.231 -3.868 0.00 0.00 +0.128 C ATOM 6 C LIG 1 -0.781 -1.654 -4.371 0.00 0.00 +0.128 C ENDROOT BRANCH 1 7 ATOM 7 C LIG 1 1.633 -2.288 -3.944 0.00 0.00 +0.164 C BRANCH 7 11 ATOM 8 C LIG 1 2.714 0.231 -0.665 0.00 0.00 +0.055 A ATOM 9 C LIG 1 2.135 0.716 -1.828 0.00 0.00 +0.124 A ATOM 10 N LIG 1 1.795 -0.063 -2.886 0.00 0.00 -0.258 NA ATOM 11 C LIG 1 2.065 -1.394 -2.793 0.00 0.00 +0.059 A ATOM 12 C LIG 1 2.670 -1.954 -1.666 0.00 0.00 +0.025 A ATOM 13 C LIG 1 3.006 -1.129 -0.595 0.00 0.00 +0.016 A BRANCH 8 15 ATOM 14 O LIG 1 4.053 0.909 1.134 0.00 0.00 -0.270 OA ATOM 15 C LIG 1 3.038 1.107 0.478 0.00 0.00 +0.246 C ATOM 16 N LIG 1 2.128 2.104 0.768 0.00 0.00 -0.304 N ATOM 17 H LIG 1 1.243 2.129 0.278 0.00 0.00 +0.149 HD BRANCH 16 18 ATOM 18 C LIG 1 2.350 3.026 1.912 0.00 0.00 +0.124 C ATOM 19 C LIG 1 1.363 4.195 2.011 0.00 0.00 +0.184 C ATOM 20 O LIG 1 2.361 5.140 1.561 0.00 0.00 -0.376 OA ATOM 21 C LIG 1 3.391 4.124 1.655 0.00 0.00 +0.184 C ENDBRANCH 16 18 ENDBRANCH 8 15 ENDBRANCH 7 11 ENDBRANCH 1 7 BRANCH 4 22 ATOM 22 C LIG 1 -2.550 -3.648 -1.794 0.00 0.00 +0.142 C BRANCH 22 23 ATOM 23 C LIG 1 -2.187 -3.055 -0.419 0.00 0.00 +0.146 C BRANCH 23 24 ATOM 24 O LIG 1 -3.197 -3.418 0.534 0.00 0.00 -0.389 OA ATOM 25 H LIG 1 -3.090 -2.772 1.262 0.00 0.00 +0.210 HD ENDBRANCH 23 24 BRANCH 23 26 ATOM 26 C LIG 1 -2.080 -1.512 -0.448 0.00 0.00 +0.117 C BRANCH 26 27 ATOM 27 N LIG 1 -1.883 -0.931 0.904 0.00 0.00 -0.295 NA ATOM 28 C LIG 1 -2.132 0.526 0.841 0.00 0.00 +0.120 C ATOM 29 C LIG 1 -1.774 1.270 2.109 0.00 0.00 -0.030 A ATOM 30 C LIG 1 -0.882 0.720 3.043 0.00 0.00 -0.042 A ATOM 31 C LIG 1 -0.553 1.437 4.201 0.00 0.00 +0.004 A ATOM 32 C LIG 1 -1.095 2.703 4.423 0.00 0.00 +0.000 A ATOM 33 C LIG 1 -1.965 3.261 3.489 0.00 0.00 +0.000 A ATOM 34 C LIG 1 -0.347 -0.674 2.838 0.00 0.00 +0.051 C ATOM 35 C LIG 1 -2.297 2.552 2.334 0.00 0.00 +0.005 A ATOM 36 C LIG 1 -0.511 -1.165 1.394 0.00 0.00 +0.089 C ENDBRANCH 26 27 ENDBRANCH 23 26 ENDBRANCH 22 23 ENDBRANCH 4 22 TORSDOF 9