REMARK VINA RESULT: -3.6 3.229 4.064 REMARK 4 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_14 REMARK 2 A between atoms: O_2 and C_15 REMARK 3 A between atoms: C_3 and C_4 REMARK 4 A between atoms: C_3 and C_5 ROOT ATOM 1 C UNL d 1 31.922 7.567 33.605 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 32.251 8.430 32.404 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 33.491 9.079 32.302 0.00 0.00 0.010 A ATOM 4 C UNL d 1 33.773 9.917 31.217 0.00 0.00 0.037 A ATOM 5 C UNL d 1 32.808 10.112 30.236 0.00 0.00 0.065 A ATOM 6 C UNL d 1 31.579 9.472 30.311 0.00 0.00 0.037 A ATOM 7 C UNL d 1 31.300 8.629 31.390 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 33.029 10.935 29.172 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 32.203 11.407 28.969 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 32.450 6.154 33.488 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 32.661 5.373 34.636 0.00 0.00 0.010 A ATOM 12 C UNL d 1 33.236 4.103 34.541 0.00 0.00 0.037 A ATOM 13 C UNL d 1 33.591 3.603 33.293 0.00 0.00 0.065 A ATOM 14 C UNL d 1 33.352 4.341 32.140 0.00 0.00 0.037 A ATOM 15 C UNL d 1 32.788 5.615 32.237 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 34.180 2.380 33.159 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 34.426 2.261 32.227 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4