REMARK Name = BDB002612 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C UNK A 0 -2.260 0.214 0.674 0.00 0.00 +0.121 A ATOM 2 C UNK A 0 -1.409 -0.732 0.104 0.00 0.00 +0.046 A ATOM 3 C UNK A 0 -0.020 -0.622 0.262 0.00 0.00 +0.016 A ATOM 4 C UNK A 0 0.527 0.445 0.985 0.00 0.00 +0.037 A ATOM 5 C UNK A 0 -0.328 1.386 1.567 0.00 0.00 +0.016 A ATOM 6 C UNK A 0 -1.710 1.271 1.404 0.00 0.00 +0.046 A ENDROOT BRANCH 4 7 ATOM 7 C UNK A 0 1.995 0.604 1.182 0.00 0.00 +0.245 C ATOM 8 N ALA A 1 2.809 0.046 0.223 0.00 0.00 -0.299 N ATOM 9 H ALA A 1 2.414 -0.283 -0.652 0.00 0.00 +0.150 HD ATOM 10 O UNK A 0 2.428 1.230 2.143 0.00 0.00 -0.270 OA BRANCH 8 11 ATOM 11 CA ALA A 1 4.262 0.209 0.261 0.00 0.00 +0.179 C ATOM 12 CB ALA A 1 4.898 -0.774 1.235 0.00 0.00 +0.040 C BRANCH 11 13 ATOM 13 C ALA A 1 4.800 -0.017 -1.149 0.00 0.00 +0.325 C ATOM 14 O ALA A 1 4.152 -0.416 -2.108 0.00 0.00 -0.249 OA BRANCH 13 15 ATOM 15 OXT ALA A 1 6.107 0.279 -1.284 0.00 0.00 -0.479 OA ATOM 16 HXT ALA A 1 6.304 0.103 -2.228 0.00 0.00 +0.295 HD ENDBRANCH 13 15 ENDBRANCH 11 13 ENDBRANCH 8 11 ENDBRANCH 4 7 BRANCH 1 17 ATOM 17 O UNK A 0 -3.623 0.233 0.596 0.00 0.00 -0.492 OA BRANCH 17 18 ATOM 18 C UNK A 0 -4.298 -0.847 -0.049 0.00 0.00 +0.229 C BRANCH 18 20 ATOM 19 C UNK A 0 -5.181 0.661 -1.885 0.00 0.00 +0.007 C ATOM 20 C UNK A 0 -4.427 -0.620 -1.555 0.00 0.00 +0.038 C ENDBRANCH 18 20 ENDBRANCH 17 18 ENDBRANCH 1 17 TORSDOF 7