REMARK Name = BDB053136 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 CA ALA A 1 -0.621 -0.692 1.733 0.00 0.00 +0.187 C ENDROOT BRANCH 1 4 ATOM 2 N ALA A 1 -3.051 -0.391 2.051 0.00 0.00 -0.303 N ATOM 3 H ALA A 1 -2.767 0.451 2.559 0.00 0.00 +0.149 HD ATOM 4 C ALA A 1 -2.069 -0.939 1.255 0.00 0.00 +0.236 C ATOM 5 O ALA A 1 -2.314 -1.638 0.269 0.00 0.00 -0.274 OA BRANCH 2 6 ATOM 6 CA ALA A 1 -4.453 -0.463 1.660 0.00 0.00 +0.156 C ATOM 7 CB ALA A 1 -5.344 -0.498 2.896 0.00 0.00 +0.038 C BRANCH 6 10 ATOM 8 N ALA A 1 -5.940 0.572 0.001 0.00 0.00 -0.301 N ATOM 9 H ALA A 1 -6.565 -0.186 0.251 0.00 0.00 +0.150 HD ATOM 10 C ALA A 1 -4.824 0.756 0.792 0.00 0.00 +0.234 C ATOM 11 O ALA A 1 -4.211 1.820 0.839 0.00 0.00 -0.274 OA BRANCH 8 12 ATOM 12 CA ALA A 1 -6.551 1.702 -0.710 0.00 0.00 +0.184 C BRANCH 12 14 ATOM 13 CG1 ALA A 1 -7.902 2.387 -2.760 0.00 0.00 +0.009 C ATOM 14 CB ALA A 1 -7.247 1.227 -2.003 0.00 0.00 +0.014 C ATOM 15 CG2 ALA A 1 -6.255 0.522 -2.937 0.00 0.00 +0.009 C ENDBRANCH 12 14 BRANCH 12 16 ATOM 16 C ALA A 1 -7.555 2.315 0.270 0.00 0.00 +0.326 C ATOM 17 O ALA A 1 -8.223 1.700 1.091 0.00 0.00 -0.249 OA BRANCH 16 18 ATOM 18 OXT ALA A 1 -7.679 3.650 0.148 0.00 0.00 -0.479 OA ATOM 19 HXT ALA A 1 -8.316 3.903 0.849 0.00 0.00 +0.295 HD ENDBRANCH 16 18 ENDBRANCH 12 16 ENDBRANCH 8 12 ENDBRANCH 6 10 ENDBRANCH 2 6 ENDBRANCH 1 4 BRANCH 1 20 ATOM 20 N ALA A 1 0.277 -1.366 0.797 0.00 0.00 -0.301 N ATOM 21 H ALA A 1 -0.169 -1.817 0.001 0.00 0.00 +0.150 HD ATOM 22 C ALA A 1 1.571 -1.683 1.131 0.00 0.00 +0.230 C ATOM 23 O ALA A 1 2.080 -1.336 2.195 0.00 0.00 -0.274 OA BRANCH 22 24 ATOM 24 CA ALA A 1 2.317 -2.515 0.066 0.00 0.00 +0.137 C ATOM 25 CB ALA A 1 1.921 -3.981 0.214 0.00 0.00 +0.034 C BRANCH 24 26 ATOM 26 N ALA A 1 3.781 -2.394 0.237 0.00 0.00 -0.306 NA ATOM 27 H ALA A 1 3.976 -2.460 1.241 0.00 0.00 +0.123 HD BRANCH 26 28 ATOM 28 C UNK A 0 4.279 -1.104 -0.249 0.00 0.00 +0.082 C BRANCH 28 29 ATOM 29 C UNK A 0 5.790 -1.016 -0.004 0.00 0.00 +0.018 C BRANCH 29 30 ATOM 30 C UNK A 0 6.393 0.357 -0.380 0.00 0.00 -0.010 C ATOM 31 C UNK A 0 7.864 0.450 0.067 0.00 0.00 +0.003 C ATOM 32 C UNK A 0 8.804 -0.393 -0.794 0.00 0.00 +0.000 C ATOM 33 C UNK A 0 8.659 -0.065 -2.277 0.00 0.00 +0.000 C ATOM 34 C UNK A 0 7.210 -0.156 -2.745 0.00 0.00 +0.000 C ATOM 35 C UNK A 0 6.286 0.695 -1.876 0.00 0.00 +0.003 C ENDBRANCH 29 30 ENDBRANCH 28 29 ENDBRANCH 26 28 ENDBRANCH 24 26 ENDBRANCH 22 24 ENDBRANCH 1 20 BRANCH 1 36 ATOM 36 CB ALA A 1 -0.283 0.802 1.916 0.00 0.00 +0.141 C ATOM 37 CG2 ALA A 1 -0.549 1.652 0.679 0.00 0.00 +0.040 C BRANCH 36 38 ATOM 38 OG1 ALA A 1 -1.030 1.343 3.016 0.00 0.00 -0.390 OA ATOM 39 HG1 ALA A 1 -0.470 1.240 3.809 0.00 0.00 +0.210 HD ENDBRANCH 36 38 ENDBRANCH 1 36 TORSDOF 15