# Rosetta params file for a symmetric version of the # 1,3,5-tris(bromomethyl)benzene crosslinker. This # is actually just a third of the molecule, with connection # points to attach to symmetric copies of itself. File # created 2 June 2015 by Vikram K. Mulligan, Baker laboratory. NAME TBMBSYMM IO_STRING TBS X TYPE LIGAND AA UNK ATOM CM1 CH2 CT2 0.02 ATOM C1 aroC CA -0.08 ATOM C2 aroC CA -0.08 ATOM V3 VIRT VIRT 0.00 ATOM V4 VIRT VIRT 0.00 ATOM V5 VIRT VIRT 0.00 ATOM V6 VIRT VIRT 0.00 ATOM V1 VIRT VIRT 0.00 ATOM H1 Hapo HA 0.04 ATOM H2 Hapo HA 0.04 ATOM H3 Haro HP 0.06 CONNECT CM1 CONNECT C2 CONNECT C1 BOND_TYPE CM1 C1 1 BOND_TYPE C1 C2 ARO BOND_TYPE C2 V3 ARO BOND_TYPE V3 V4 ARO BOND_TYPE V4 V5 ARO BOND_TYPE V5 V6 ARO BOND_TYPE V6 C1 ARO BOND_TYPE CM1 V1 1 BOND_TYPE CM1 H1 1 BOND_TYPE CM1 H2 1 BOND_TYPE C2 H3 1 #CUT_BOND V5 V6 CHI 1 C2 C1 CM1 V1 PROTON_CHI 1 SAMPLES 3 -60 60 180 EXTRA 1 20 NBR_ATOM C1 NBR_RADIUS 6.0 ICOOR_INTERNAL CM1 0.000000 0.000000 0.000000 CM1 C1 C2 ICOOR_INTERNAL C1 0.000000 180.000000 1.507412 CM1 C1 C2 ICOOR_INTERNAL C2 0.000000 59.466536 1.402807 C1 CM1 C2 ICOOR_INTERNAL V3 -179.804316 58.952618 1.402964 C2 C1 CM1 ICOOR_INTERNAL V4 0.980577 61.044429 1.402776 V3 C2 C1 ICOOR_INTERNAL V5 -0.956983 58.969224 1.402947 V4 V3 C2 ICOOR_INTERNAL V6 -0.956983 61.044429 1.402964 C1 C2 V3 ICOOR_INTERNAL CONN3 -0.956983 61.044429 1.402964 C1 C2 V3 #Same as V6 ICOOR_INTERNAL CONN2 -179.804316 58.952618 1.402964 C2 C1 CM1 #Same as V3 ICOOR_INTERNAL CONN1 89.638221 68.089550 1.793000 CM1 C1 C2 ICOOR_INTERNAL V1 0.000000 68.089550 1.793000 CM1 C1 CONN1 ICOOR_INTERNAL H1 121.411644 70.404074 1.096281 CM1 C1 V1 ICOOR_INTERNAL H2 117.197337 70.383674 1.096044 CM1 C1 H1 ICOOR_INTERNAL H3 -179.109860 60.539188 1.088803 C2 V3 C1