REMARK Name = BDB037063 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C UNK A 0 -1.865 -0.013 0.509 0.00 0.00 +0.040 A ATOM 2 C UNK A 0 -0.473 -0.041 0.482 0.00 0.00 +0.070 A ATOM 3 C UNK A 0 0.465 0.637 -0.417 0.00 0.00 +0.256 C ATOM 4 N UNK A 0 1.730 0.299 -0.012 0.00 0.00 -0.222 N ATOM 5 C UNK A 0 1.695 -0.595 1.018 0.00 0.00 +0.255 C ATOM 6 O UNK A 0 2.617 -1.166 1.566 0.00 0.00 -0.270 OA ATOM 7 O UNK A 0 0.130 1.350 -1.347 0.00 0.00 -0.269 OA ATOM 8 C UNK A 0 0.289 -0.800 1.355 0.00 0.00 +0.051 A ATOM 9 C UNK A 0 -0.280 -1.590 2.330 0.00 0.00 +0.014 A ATOM 10 C UNK A 0 -1.671 -1.581 2.406 0.00 0.00 +0.003 A ATOM 11 C UNK A 0 -2.445 -0.797 1.516 0.00 0.00 +0.024 A ENDROOT BRANCH 4 12 ATOM 12 C UNK A 0 2.928 0.698 -0.739 0.00 0.00 +0.171 C ATOM 13 C UNK A 0 3.423 -0.493 -1.566 0.00 0.00 +0.240 C ATOM 14 O UNK A 0 2.669 -1.267 -2.153 0.00 0.00 -0.273 OA ATOM 15 N UNK A 0 4.781 -0.648 -1.647 0.00 0.00 -0.255 N ATOM 16 H UNK A 0 5.086 -1.401 -2.251 0.00 0.00 +0.158 HD ATOM 17 C UNK A 0 5.640 -0.425 -0.606 0.00 0.00 +0.219 C ATOM 18 O UNK A 0 6.746 -0.959 -0.582 0.00 0.00 -0.275 OA ATOM 19 C UNK A 0 5.127 0.412 0.538 0.00 0.00 +0.098 C ATOM 20 C UNK A 0 4.014 1.355 0.113 0.00 0.00 +0.041 C ENDBRANCH 4 12 BRANCH 1 21 ATOM 21 N ALA A 1 -2.566 0.819 -0.346 0.00 0.00 -0.338 N ATOM 22 H ALA A 1 -1.976 1.187 -1.102 0.00 0.00 +0.146 HD BRANCH 21 24 ATOM 23 CB ALA A 1 -4.894 1.328 0.343 0.00 0.00 +0.030 C ATOM 24 CA ALA A 1 -3.979 0.734 -0.725 0.00 0.00 +0.093 C BRANCH 24 25 ATOM 25 C ALA A 1 -4.410 -0.667 -1.194 0.00 0.00 +0.177 C BRANCH 25 26 ATOM 26 O ALA A 1 -5.658 -0.621 -1.887 0.00 0.00 -0.393 OA ATOM 27 H ALA A 1 -5.501 -0.173 -2.736 0.00 0.00 +0.209 HD ENDBRANCH 25 26 ENDBRANCH 24 25 ENDBRANCH 21 24 ENDBRANCH 1 21 TORSDOF 5