REMARK Name = BDB009407 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C UNK A 0 1.459 1.853 0.545 0.00 0.00 +0.070 A ATOM 2 C UNK A 0 1.081 3.166 0.845 0.00 0.00 +0.145 A ATOM 3 F UNK A 0 1.770 4.190 0.316 0.00 0.00 -0.204 F ATOM 4 C UNK A 0 0.001 3.439 1.678 0.00 0.00 +0.040 A ATOM 5 C UNK A 0 -0.724 2.385 2.229 0.00 0.00 +0.007 A ATOM 6 C UNK A 0 -0.370 1.057 1.947 0.00 0.00 -0.040 A ATOM 7 C UNK A 0 0.736 0.803 1.115 0.00 0.00 +0.030 A ENDROOT BRANCH 1 11 ATOM 8 N ALA A 1 4.163 0.723 -1.604 0.00 0.00 -0.286 N ATOM 9 H ALA A 1 4.784 1.383 -1.153 0.00 0.00 +0.151 HD ATOM 10 C UNK A 0 3.003 0.507 -0.885 0.00 0.00 +0.305 C ATOM 11 N UNK A 0 2.565 1.676 -0.311 0.00 0.00 -0.267 N ATOM 12 H UNK A 0 2.983 2.529 -0.661 0.00 0.00 +0.156 HD ATOM 13 O UNK A 0 2.466 -0.590 -0.814 0.00 0.00 -0.252 OA BRANCH 8 15 ATOM 14 CB ALA A 1 5.694 0.033 -3.388 0.00 0.00 +0.040 C ATOM 15 CA ALA A 1 4.848 -0.422 -2.209 0.00 0.00 +0.180 C BRANCH 15 16 ATOM 16 C ALA A 1 5.745 -1.067 -1.156 0.00 0.00 +0.325 C ATOM 17 O ALA A 1 6.227 -0.510 -0.180 0.00 0.00 -0.249 OA BRANCH 16 18 ATOM 18 OXT ALA A 1 6.034 -2.357 -1.420 0.00 0.00 -0.479 OA ATOM 19 HXT ALA A 1 6.590 -2.640 -0.664 0.00 0.00 +0.295 HD ENDBRANCH 16 18 ENDBRANCH 15 16 ENDBRANCH 8 15 ENDBRANCH 1 11 BRANCH 6 20 ATOM 20 C UNK A 0 -1.145 -0.094 2.553 0.00 0.00 +0.092 C BRANCH 20 21 ATOM 21 C UNK A 0 -2.628 -0.080 2.192 0.00 0.00 +0.069 A ATOM 22 C UNK A 0 -3.090 -0.739 0.929 0.00 0.00 -0.016 A ATOM 23 C UNK A 0 -2.111 -1.387 -0.010 0.00 0.00 +0.037 C ATOM 24 C UNK A 0 -2.713 -1.741 -1.373 0.00 0.00 +0.005 C ATOM 25 C UNK A 0 -4.103 -2.347 -1.224 0.00 0.00 +0.005 C ATOM 26 C UNK A 0 -5.046 -1.380 -0.506 0.00 0.00 +0.041 C ATOM 27 C UNK A 0 -4.413 -0.722 0.689 0.00 0.00 +0.023 A ATOM 28 C UNK A 0 -5.333 -0.039 1.632 0.00 0.00 +0.268 A ATOM 29 O UNK A 0 -6.543 0.012 1.434 0.00 0.00 -0.266 OA ATOM 30 N UNK A 0 -4.750 0.528 2.732 0.00 0.00 -0.243 N ATOM 31 H UNK A 0 -5.362 0.995 3.392 0.00 0.00 +0.192 HD ATOM 32 N UNK A 0 -3.424 0.514 3.032 0.00 0.00 -0.175 NA ENDBRANCH 20 21 ENDBRANCH 6 20 TORSDOF 6