REMARK Name = BDB024819 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C UNK A 0 -5.209 -1.563 -1.946 0.00 0.00 +0.407 C ATOM 2 N UNK A 0 -4.381 -0.904 -1.022 0.00 0.00 -0.234 N ATOM 3 C UNK A 0 -5.058 -0.045 -0.026 0.00 0.00 +0.082 C ATOM 4 C UNK A 0 -5.812 -0.884 1.018 0.00 0.00 +0.028 C ATOM 5 C UNK A 0 -4.133 0.925 0.725 0.00 0.00 +0.027 C ATOM 6 C UNK A 0 -3.067 1.474 -0.200 0.00 0.00 +0.041 C ATOM 7 C UNK A 0 -2.272 0.305 -0.706 0.00 0.00 +0.002 A ATOM 8 C UNK A 0 -0.868 0.347 -0.823 0.00 0.00 +0.094 A ATOM 9 N UNK A 0 -0.003 1.370 -0.523 0.00 0.00 -0.232 NA ATOM 10 C UNK A 0 1.207 0.927 -0.795 0.00 0.00 +0.113 A ATOM 11 N UNK A 0 1.151 -0.371 -1.260 0.00 0.00 -0.319 N ATOM 12 C UNK A 0 -0.170 -0.761 -1.288 0.00 0.00 +0.070 A ATOM 13 C UNK A 0 -0.811 -1.948 -1.650 0.00 0.00 +0.030 A ATOM 14 C UNK A 0 -2.209 -1.973 -1.552 0.00 0.00 +0.026 A ATOM 15 C UNK A 0 -2.950 -0.867 -1.108 0.00 0.00 +0.045 A ATOM 16 O UNK A 0 -6.434 -1.594 -1.859 0.00 0.00 -0.226 OA ENDROOT BRANCH 1 18 ATOM 17 C UNK A 0 -5.392 -2.718 -3.985 0.00 0.00 +0.282 C ATOM 18 O UNK A 0 -4.547 -2.112 -3.006 0.00 0.00 -0.453 OA ENDBRANCH 1 18 BRANCH 11 19 ATOM 19 C UNK A 0 2.286 -1.198 -1.636 0.00 0.00 +0.219 C BRANCH 19 20 ATOM 20 C UNK A 0 3.191 -1.563 -0.475 0.00 0.00 +0.233 C ATOM 21 N ALA A 1 2.575 -1.831 0.730 0.00 0.00 -0.309 N ATOM 22 H ALA A 1 1.591 -1.611 0.843 0.00 0.00 +0.149 HD ATOM 23 O UNK A 0 4.408 -1.643 -0.631 0.00 0.00 -0.274 OA BRANCH 21 24 ATOM 24 CA ALA A 1 3.354 -2.003 1.956 0.00 0.00 +0.095 C ATOM 25 CB ALA A 1 2.510 -2.732 3.003 0.00 0.00 +0.030 C BRANCH 24 26 ATOM 26 C ALA A 1 3.869 -0.648 2.482 0.00 0.00 +0.177 C BRANCH 26 27 ATOM 27 O ALA A 1 4.599 -0.807 3.694 0.00 0.00 -0.393 OA ATOM 28 H ALA A 1 4.966 0.070 3.908 0.00 0.00 +0.209 HD ENDBRANCH 26 27 ENDBRANCH 24 26 ENDBRANCH 21 24 ENDBRANCH 19 20 ENDBRANCH 11 19 BRANCH 10 29 ATOM 29 C UNK A 0 2.473 1.703 -0.611 0.00 0.00 +0.097 C BRANCH 29 30 ATOM 30 C UNK A 0 2.246 2.960 0.224 0.00 0.00 +0.151 C BRANCH 30 31 ATOM 31 N UNK A 0 3.500 3.623 0.530 0.00 0.00 -0.271 N ATOM 32 N UNK A 0 4.338 3.080 1.438 0.00 0.00 -0.180 NA ATOM 33 C UNK A 0 5.369 3.928 1.458 0.00 0.00 +0.134 A ATOM 34 C UNK A 0 5.193 5.007 0.572 0.00 0.00 +0.041 A ATOM 35 C UNK A 0 3.971 4.781 -0.016 0.00 0.00 +0.108 A ENDBRANCH 30 31 ENDBRANCH 29 30 ENDBRANCH 10 29 TORSDOF 9