1TAB

structure of the trypsin-binding domain of bowman-birk type protease inhibitor and its interaction with trypsin

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: E-I
  • Int. Res.: 87
  • Norm. En. per Res.: -2.8998
• Hub Node: E(1)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
E-I	-47.145	-14.2686	-190.868	-252.2816	87	24	0	8447	1	10	11

Interface residues

• E-I: ALA171E, ALA183E, ALA221E, ALA55E, ALA56E, ARG33I, ASN100E, ASN143E, ASN223E, ASN65I, ASN95E, ASN97E, ASP102E, ASP189E, ASP194E, ASP20I, ASP36I, CYS191E, CYS220E, CYS22I, CYS24I, CYS32I, CYS34I, CYS42E, CYS58E, CYS68I, GLN175E, GLN192E, GLN21I, GLN221E, GLU13I, GLY142E, GLY193E, GLY196E, GLY197E, GLY216E, GLY219E, GLY226E, GLY43E, HIS40E, HIS57E, ILE138E, ILE16E, ILE176E, ILE212E, LEU158E, LEU99E, LYS188E, LYS222E, LYS224E, LYS26I, LYS31I, LYS60E, MET104E, MET180E, MET28I, PHE41E, PRO173E, PRO225E, PRO29I, PRO30I, SER14I, SER15I, SER190E, SER195E, SER214E, SER217E, SER23I, SER27I, SER35I, SER37E, SER96E, THR149E, THR177E, THR25I, THR98E, TRP141E, TRP215E, TYR151E, TYR172E, TYR228E, TYR39E, TYR59E, TYR94E, VAL17E, VAL213E, VAL227E