Descriptions of the files in this .zip file:

hBeta2_predicted_Method3_2_arrestin.pdb
Coordinates of the predicted minimum-energy hbeta2AR structure in one of the energy wells accommodating arrestin but not Galpha_s shown in Figure 2.5 (Chapter 2).

hSSTR5_ActiveConf2_L817818_Galphai_MD51ns.pdb
Coordinates of the predicted agonist(L-817,818)-hSSTR5(ActiveConf2)-Galpha_i complex after 51 ns molecular dynamics (MD) simulation shown in Figure 3.10 (Chapter 3).

hSSTR5.InactiveConf1.pdb
Coordinates of the predicted inactive-state hSSTR5 (InactiveConf1) structure discussed in Chapter 4.

hSSTR5.M59_InactiveConf1.pdb
Coordinates of the predicted antagonist(M59)-hSSTR5(InactiveConf1) complex (before MD simulation) discussed in Chapter 4.

hSSTR5.M59_InactiveConf1.49960psMD.pdb
Coordinates of the predicted antagonist(M59)-hSSTR5(InactiveConf1) complex after ~50 ns MD simulation in explicit lipid and water discussed in Chapter 4.

