REMARK Name = BDB024848 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C UNK A 0 4.174 -1.599 3.508 0.00 0.00 +0.407 C ATOM 2 N UNK A 0 3.874 -1.278 2.170 0.00 0.00 -0.234 N ATOM 3 C UNK A 0 4.968 -1.145 1.177 0.00 0.00 +0.082 C ATOM 4 C UNK A 0 5.598 -2.512 0.854 0.00 0.00 +0.028 C ATOM 5 C UNK A 0 4.557 -0.507 -0.160 0.00 0.00 +0.027 C ATOM 6 C UNK A 0 3.579 0.623 0.065 0.00 0.00 +0.041 C ATOM 7 C UNK A 0 2.371 0.041 0.738 0.00 0.00 +0.002 A ATOM 8 C UNK A 0 1.062 0.431 0.384 0.00 0.00 +0.094 A ATOM 9 N UNK A 0 0.653 1.317 -0.582 0.00 0.00 -0.232 NA ATOM 10 C UNK A 0 -0.663 1.342 -0.532 0.00 0.00 +0.113 A ATOM 11 N UNK A 0 -1.123 0.485 0.447 0.00 0.00 -0.319 N ATOM 12 C UNK A 0 -0.033 -0.106 1.048 0.00 0.00 +0.070 A ATOM 13 C UNK A 0 0.103 -1.038 2.078 0.00 0.00 +0.030 A ATOM 14 C UNK A 0 1.407 -1.415 2.427 0.00 0.00 +0.026 A ATOM 15 C UNK A 0 2.542 -0.892 1.786 0.00 0.00 +0.045 A ATOM 16 O UNK A 0 3.371 -1.688 4.430 0.00 0.00 -0.226 OA ENDROOT BRANCH 1 18 ATOM 17 C UNK A 0 5.880 -2.071 5.060 0.00 0.00 +0.282 C ATOM 18 O UNK A 0 5.516 -1.770 3.712 0.00 0.00 -0.453 OA ENDBRANCH 1 18 BRANCH 11 19 ATOM 19 C UNK A 0 -2.511 0.233 0.789 0.00 0.00 +0.219 C BRANCH 19 20 ATOM 20 C UNK A 0 -3.234 -0.613 -0.238 0.00 0.00 +0.233 C ATOM 21 N ALA A 1 -2.555 -1.725 -0.689 0.00 0.00 -0.309 N ATOM 22 H ALA A 1 -1.667 -1.972 -0.265 0.00 0.00 +0.149 HD ATOM 23 O UNK A 0 -4.373 -0.326 -0.600 0.00 0.00 -0.274 OA BRANCH 21 24 ATOM 24 CA ALA A 1 -3.149 -2.672 -1.632 0.00 0.00 +0.095 C ATOM 25 CB ALA A 1 -4.036 -3.673 -0.889 0.00 0.00 +0.030 C BRANCH 24 26 ATOM 26 C ALA A 1 -2.053 -3.388 -2.441 0.00 0.00 +0.177 C BRANCH 26 27 ATOM 27 O ALA A 1 -2.619 -4.245 -3.423 0.00 0.00 -0.393 OA ATOM 28 H ALA A 1 -1.880 -4.667 -3.897 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 -1.534 2.172 -1.420 0.00 0.00 +0.096 C BRANCH 29 30 ATOM 30 C UNK A 0 -1.856 3.527 -0.787 0.00 0.00 +0.132 C BRANCH 30 31 ATOM 31 N UNK A 0 -2.849 4.269 -1.566 0.00 0.00 -0.315 N ATOM 32 C UNK A 0 -2.403 5.112 -2.586 0.00 0.00 +0.251 A ATOM 33 O UNK A 0 -1.225 5.298 -2.876 0.00 0.00 -0.268 OA ATOM 34 C UNK A 0 -3.463 5.818 -3.359 0.00 0.00 +0.070 A ATOM 35 C UNK A 0 -4.755 5.602 -3.085 0.00 0.00 +0.007 A ATOM 36 C UNK A 0 -5.137 4.688 -2.041 0.00 0.00 +0.018 A ATOM 37 C UNK A 0 -4.197 4.059 -1.324 0.00 0.00 +0.089 A ENDBRANCH 30 31 ENDBRANCH 29 30 ENDBRANCH 10 29 TORSDOF 9