REMARK Name = BDB058796 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C UNK A 0 -0.331 -0.601 2.031 0.00 0.00 +0.056 A ATOM 2 C UNK A 0 -0.242 -1.407 0.872 0.00 0.00 +0.006 A ATOM 3 C UNK A 0 -1.171 -1.189 -0.185 0.00 0.00 +0.005 A ATOM 4 C UNK A 0 -1.088 -2.041 -1.315 0.00 0.00 +0.010 A ATOM 5 C UNK A 0 -0.119 -3.039 -1.432 0.00 0.00 +0.001 A ATOM 6 C UNK A 0 0.799 -3.225 -0.414 0.00 0.00 +0.001 A ATOM 7 C UNK A 0 -2.146 -0.142 -0.084 0.00 0.00 +0.036 A ATOM 8 C UNK A 0 -2.216 0.591 1.107 0.00 0.00 +0.025 A ATOM 9 C UNK A 0 0.736 -2.423 0.723 0.00 0.00 +0.010 A ATOM 10 C UNK A 0 -1.314 0.377 2.144 0.00 0.00 +0.027 A ENDROOT BRANCH 1 11 ATOM 11 N UNK A 0 0.596 -0.736 3.110 0.00 0.00 -0.216 N ATOM 12 H UNK A 0 0.915 -1.667 3.364 0.00 0.00 +0.174 HD BRANCH 11 13 ATOM 13 S UNK A 0 1.761 0.459 3.355 0.00 0.00 +0.072 S ATOM 14 O UNK A 0 2.702 -0.095 4.307 0.00 0.00 -0.150 OA ATOM 15 O UNK A 0 1.108 1.726 3.603 0.00 0.00 -0.150 OA BRANCH 13 19 ATOM 16 C UNK A 0 3.914 0.745 -0.669 0.00 0.00 +0.120 A ATOM 17 C UNK A 0 2.809 1.558 -0.398 0.00 0.00 +0.047 A ATOM 18 C UNK A 0 2.148 1.479 0.829 0.00 0.00 +0.032 A ATOM 19 C UNK A 0 2.590 0.565 1.786 0.00 0.00 +0.109 A ATOM 20 C UNK A 0 3.707 -0.238 1.537 0.00 0.00 +0.032 A ATOM 21 C UNK A 0 4.364 -0.150 0.305 0.00 0.00 +0.047 A BRANCH 16 23 ATOM 22 C UNK A 0 5.582 0.114 -2.243 0.00 0.00 +0.277 C ATOM 23 O UNK A 0 4.463 0.926 -1.908 0.00 0.00 -0.495 OA ENDBRANCH 16 23 ENDBRANCH 13 19 ENDBRANCH 11 13 ENDBRANCH 1 11 BRANCH 7 24 ATOM 24 N SER A 1 -3.060 0.058 -1.131 0.00 0.00 -0.329 N ATOM 25 H SER A 1 -2.606 -0.044 -2.040 0.00 0.00 +0.147 HD BRANCH 24 26 ATOM 26 CA SER A 1 -4.012 1.188 -1.164 0.00 0.00 +0.205 C BRANCH 26 27 ATOM 27 C SER A 1 -5.274 0.901 -0.355 0.00 0.00 +0.327 C ATOM 28 O SER A 1 -6.085 0.006 -0.534 0.00 0.00 -0.249 OA BRANCH 27 29 ATOM 29 OXT SER A 1 -5.473 1.795 0.640 0.00 0.00 -0.479 OA ATOM 30 HXT SER A 1 -6.282 1.463 1.086 0.00 0.00 +0.295 HD ENDBRANCH 27 29 ENDBRANCH 26 27 BRANCH 26 31 ATOM 31 CB SER A 1 -4.450 1.428 -2.620 0.00 0.00 +0.189 C BRANCH 31 32 ATOM 32 OG SER A 1 -3.315 1.675 -3.461 0.00 0.00 -0.393 OA ATOM 33 H SER A 1 -2.867 2.474 -3.132 0.00 0.00 +0.209 HD ENDBRANCH 31 32 ENDBRANCH 26 31 ENDBRANCH 24 26 ENDBRANCH 7 24 TORSDOF 10