IID

P47887_A6ND48.1 contacts (residues)

Receptor	R: Secondary Structure	R: Residue	R; Chain	R: Residue number	Ligand	L: Secondary Structure	L: Residue	L: Chain	L: Residue Number
R	-	MET	A	1	L	-	LEU	V	4
R	-	MET	A	1	L	-	THR	V	5
R	-	MET	A	1	L	-	LYS	V	6
R	H	PHE	A	113	L	H	TYR	V	140
R	H	PHE	A	113	L	H	VAL	V	144
R	H	TYR	A	120	L	-	THR	V	135
R	H	TYR	A	120	L	H	SER	V	136
R	-	LEU	A	139	L	H	ARG	V	131
R	-	HIS	A	140	L	H	ALA	V	132
R	H	ALA	A	143	L	H	ALA	V	132
R	-	ILE	A	144	L	H	ARG	V	131
R	-	ILE	A	144	L	H	ALA	V	132
R	-	ILE	A	144	L	-	THR	V	135
R	H	LEU	A	149	L	-	THR	V	135
R	H	SER	A	152	L	H	GLN	V	141
R	H	VAL	A	153	L	H	GLN	V	141
R	H	VAL	A	154	L	H	GLN	V	141
R	H	LEU	A	156	L	H	GLN	V	141
R	H	LEU	A	156	L	H	THR	V	145
R	H	SER	A	157	L	H	GLN	V	141
R	H	LEU	A	160	L	H	GLN	V	141
R	H	LEU	A	160	L	H	VAL	V	144
R	H	LEU	A	160	L	H	THR	V	145
R	H	LEU	A	160	L	H	LEU	V	148
R	H	PHE	A	163	L	H	LEU	V	148
R	H	PHE	A	163	L	H	SER	V	152
R	H	HIS	A	164	L	H	LEU	V	148
R	H	LEU	A	167	L	H	TYR	V	100
R	H	LEU	A	167	L	H	PHE	V	151
R	H	LEU	A	167	L	H	SER	V	152
R	H	LEU	A	167	L	H	ALA	V	155
R	H	ARG	A	174	L	H	ALA	V	155
R	H	ARG	A	174	L	H	THR	V	158
R	H	ARG	A	174	L	H	GLY	V	159
R	-	SER	A	199	L	H	LEU	V	93
R	-	ASP	A	200	L	H	LEU	V	93
R	H	VAL	A	203	L	H	PHE	V	101
R	H	VAL	A	203	L	H	ALA	V	97
R	H	TRP	A	206	L	H	PHE	V	101
R	H	VAL	A	207	L	H	TYR	V	100
R	H	VAL	A	207	L	H	PHE	V	101
R	H	ILE	A	210	L	H	PHE	V	101
R	H	ILE	A	210	L	H	PHE	V	105
R	H	ILE	A	210	L	H	PHE	V	151
R	H	MET	A	211	L	H	TRP	V	147
R	H	MET	A	211	L	H	LEU	V	148
R	H	MET	A	211	L	H	PHE	V	151
R	H	LEU	A	214	L	H	TYR	V	140
R	H	LEU	A	214	L	H	VAL	V	144
R	H	LEU	A	214	L	H	TRP	V	147
R	H	LEU	A	214	L	H	PHE	V	151
R	H	ILE	A	215	L	H	TYR	V	140
R	H	ILE	A	215	L	H	VAL	V	144
R	H	ILE	A	215	L	H	LEU	V	148
R	H	ILE	A	218	L	H	TYR	V	140
R	H	PRO	A	219	L	H	TYR	V	140
R	H	LEU	A	222	L	H	TYR	V	140

- Title of columns started by 'R:' means Receptor, 'L:' means Ligand
- In the Secondary Structure columns: 'H' means that residues in that row are part of Alpha Helix; 'S' - Beta Sheet

P47887_A6ND48.1 contacts (residues & atoms)

Receptor	R: Secondary Structure	R: Atom	R: Residue	R; Chain	R: Residue number	Ligand	L: Secondary Structure	L; Atom	L: Residue	L: Chain	L: Residue Number
R	-	N	MET	A	1	L	-	O	LEU	V	4
R	-	N	MET	A	1	L	-	HA	THR	V	5
R	-	N	MET	A	1	L	-	H	LYS	V	6
R	-	CB	MET	A	1	L	-	H	LYS	V	6
R	-	CB	MET	A	1	L	-	HB2	LYS	V	6
R	-	CB	MET	A	1	L	-	HB3	LYS	V	6
R	-	CG	MET	A	1	L	-	HB3	LYS	V	6
R	-	SD	MET	A	1	L	-	HB3	LYS	V	6
R	H	CD1	PHE	A	113	L	H	HE1	TYR	V	140
R	H	CE1	PHE	A	113	L	H	CE1	TYR	V	140
R	H	CE1	PHE	A	113	L	H	OH	TYR	V	140
R	H	CE1	PHE	A	113	L	H	HE1	TYR	V	140
R	H	CE1	PHE	A	113	L	H	HG13	VAL	V	144
R	H	CE1	PHE	A	113	L	H	HG23	VAL	V	144
R	H	CE2	PHE	A	113	L	H	HG13	VAL	V	144
R	H	CZ	PHE	A	113	L	H	HE1	TYR	V	140
R	H	CZ	PHE	A	113	L	H	CG1	VAL	V	144
R	H	CZ	PHE	A	113	L	H	HG13	VAL	V	144
R	H	CZ	PHE	A	113	L	H	HG23	VAL	V	144
R	H	CD2	TYR	A	120	L	H	HB2	SER	V	136
R	H	CE2	TYR	A	120	L	H	HB2	SER	V	136
R	H	OH	TYR	A	120	L	-	HB	THR	V	135
R	H	OH	TYR	A	120	L	H	H	SER	V	136
R	H	CZ	TYR	A	120	L	H	HB2	SER	V	136
R	-	CD1	LEU	A	139	L	H	HD2	ARG	V	131
R	-	O	HIS	A	140	L	H	HB2	ALA	V	132
R	H	CA	ALA	A	143	L	H	HB1	ALA	V	132
R	H	C	ALA	A	143	L	H	HB1	ALA	V	132
R	H	CB	ALA	A	143	L	H	CB	ALA	V	132
R	H	CB	ALA	A	143	L	H	HB1	ALA	V	132
R	H	CB	ALA	A	143	L	H	HB2	ALA	V	132
R	H	CB	ALA	A	143	L	H	HB3	ALA	V	132
R	H	O	ALA	A	143	L	H	HB1	ALA	V	132
R	-	CA	ILE	A	144	L	H	HA	ALA	V	132
R	-	CB	ILE	A	144	L	H	HA	ALA	V	132
R	-	O	ILE	A	144	L	-	HG21	THR	V	135
R	-	CG1	ILE	A	144	L	H	CA	ALA	V	132
R	-	CG1	ILE	A	144	L	H	HA	ALA	V	132
R	-	CG1	ILE	A	144	L	H	HB2	ALA	V	132
R	-	CG2	ILE	A	144	L	-	HG21	THR	V	135
R	-	CG2	ILE	A	144	L	-	HG22	THR	V	135
R	-	CD1	ILE	A	144	L	H	C	ARG	V	131
R	-	CD1	ILE	A	144	L	H	O	ARG	V	131
R	-	CD1	ILE	A	144	L	H	HB2	ARG	V	131
R	-	CD1	ILE	A	144	L	H	N	ALA	V	132
R	-	CD1	ILE	A	144	L	H	CA	ALA	V	132
R	-	CD1	ILE	A	144	L	H	HA	ALA	V	132
R	-	CD1	ILE	A	144	L	-	HG22	THR	V	135
R	H	CD2	LEU	A	149	L	-	HG1	THR	V	135
R	H	CD2	LEU	A	149	L	-	HG21	THR	V	135
R	H	C	SER	A	152	L	H	HE22	GLN	V	141
R	H	O	SER	A	152	L	H	HE22	GLN	V	141
R	H	N	VAL	A	153	L	H	HE22	GLN	V	141
R	H	CA	VAL	A	153	L	H	CD	GLN	V	141
R	H	CA	VAL	A	153	L	H	NE2	GLN	V	141
R	H	CA	VAL	A	153	L	H	OE1	GLN	V	141
R	H	CA	VAL	A	153	L	H	HE21	GLN	V	141
R	H	CA	VAL	A	153	L	H	HE22	GLN	V	141
R	H	C	VAL	A	153	L	H	NE2	GLN	V	141
R	H	C	VAL	A	153	L	H	HE21	GLN	V	141
R	H	C	VAL	A	153	L	H	HE22	GLN	V	141
R	H	CB	VAL	A	153	L	H	NE2	GLN	V	141
R	H	CB	VAL	A	153	L	H	HE21	GLN	V	141
R	H	CB	VAL	A	153	L	H	HE22	GLN	V	141
R	H	O	VAL	A	153	L	H	CD	GLN	V	141
R	H	O	VAL	A	153	L	H	NE2	GLN	V	141
R	H	O	VAL	A	153	L	H	HE21	GLN	V	141
R	H	O	VAL	A	153	L	H	HE22	GLN	V	141
R	H	CG1	VAL	A	153	L	H	CD	GLN	V	141
R	H	CG1	VAL	A	153	L	H	NE2	GLN	V	141
R	H	CG1	VAL	A	153	L	H	HE21	GLN	V	141
R	H	CG1	VAL	A	153	L	H	HE22	GLN	V	141
R	H	CG2	VAL	A	153	L	H	NE2	GLN	V	141
R	H	CG2	VAL	A	153	L	H	OE1	GLN	V	141
R	H	CG2	VAL	A	153	L	H	HE22	GLN	V	141
R	H	N	VAL	A	154	L	H	HE22	GLN	V	141
R	H	CB	LEU	A	156	L	H	CG	GLN	V	141
R	H	CB	LEU	A	156	L	H	CD	GLN	V	141
R	H	CB	LEU	A	156	L	H	NE2	GLN	V	141
R	H	CB	LEU	A	156	L	H	OE1	GLN	V	141
R	H	CB	LEU	A	156	L	H	HB2	GLN	V	141
R	H	CB	LEU	A	156	L	H	HG2	GLN	V	141
R	H	CB	LEU	A	156	L	H	HE22	GLN	V	141
R	H	CG	LEU	A	156	L	H	CA	GLN	V	141
R	H	CG	LEU	A	156	L	H	CB	GLN	V	141
R	H	CG	LEU	A	156	L	H	CG	GLN	V	141
R	H	CG	LEU	A	156	L	H	CD	GLN	V	141
R	H	CG	LEU	A	156	L	H	OE1	GLN	V	141
R	H	CG	LEU	A	156	L	H	HA	GLN	V	141
R	H	CG	LEU	A	156	L	H	HB2	GLN	V	141
R	H	CG	LEU	A	156	L	H	HB3	GLN	V	141
R	H	CG	LEU	A	156	L	H	HG2	GLN	V	141
R	H	CG	LEU	A	156	L	H	HG1	THR	V	145
R	H	CD1	LEU	A	156	L	H	CB	GLN	V	141
R	H	CD1	LEU	A	156	L	H	O	GLN	V	141
R	H	CD1	LEU	A	156	L	H	HB2	GLN	V	141
R	H	CD1	LEU	A	156	L	H	OG1	THR	V	145
R	H	CD1	LEU	A	156	L	H	HG1	THR	V	145
R	H	CD2	LEU	A	156	L	H	CA	GLN	V	141
R	H	CD2	LEU	A	156	L	H	C	GLN	V	141
R	H	CD2	LEU	A	156	L	H	CB	GLN	V	141
R	H	CD2	LEU	A	156	L	H	O	GLN	V	141
R	H	CD2	LEU	A	156	L	H	CG	GLN	V	141
R	H	CD2	LEU	A	156	L	H	CD	GLN	V	141
R	H	CD2	LEU	A	156	L	H	NE2	GLN	V	141
R	H	CD2	LEU	A	156	L	H	OE1	GLN	V	141
R	H	CD2	LEU	A	156	L	H	HA	GLN	V	141
R	H	CD2	LEU	A	156	L	H	HB2	GLN	V	141
R	H	CD2	LEU	A	156	L	H	HB3	GLN	V	141
R	H	CD2	LEU	A	156	L	H	HG2	GLN	V	141
R	H	CD2	LEU	A	156	L	H	HG3	GLN	V	141
R	H	CD2	LEU	A	156	L	H	HG1	THR	V	145
R	H	OG	SER	A	157	L	H	NE2	GLN	V	141
R	H	OG	SER	A	157	L	H	HE21	GLN	V	141
R	H	CA	LEU	A	160	L	H	CD1	LEU	V	148
R	H	CA	LEU	A	160	L	H	HD11	LEU	V	148
R	H	CA	LEU	A	160	L	H	HD12	LEU	V	148
R	H	CA	LEU	A	160	L	H	HD13	LEU	V	148
R	H	C	LEU	A	160	L	H	CD1	LEU	V	148
R	H	C	LEU	A	160	L	H	HD11	LEU	V	148
R	H	C	LEU	A	160	L	H	HD12	LEU	V	148
R	H	C	LEU	A	160	L	H	HD13	LEU	V	148
R	H	CB	LEU	A	160	L	H	CG1	VAL	V	144
R	H	CB	LEU	A	160	L	H	HG11	VAL	V	144
R	H	CB	LEU	A	160	L	H	HG13	VAL	V	144
R	H	CB	LEU	A	160	L	H	CD1	LEU	V	148
R	H	CB	LEU	A	160	L	H	HD11	LEU	V	148
R	H	CB	LEU	A	160	L	H	HD12	LEU	V	148
R	H	CB	LEU	A	160	L	H	HD13	LEU	V	148
R	H	O	LEU	A	160	L	H	CG	LEU	V	148
R	H	O	LEU	A	160	L	H	CD1	LEU	V	148
R	H	O	LEU	A	160	L	H	HD11	LEU	V	148
R	H	O	LEU	A	160	L	H	HD12	LEU	V	148
R	H	O	LEU	A	160	L	H	HD13	LEU	V	148
R	H	O	LEU	A	160	L	H	HD22	LEU	V	148
R	H	CG	LEU	A	160	L	H	CG1	VAL	V	144
R	H	CG	LEU	A	160	L	H	HB	VAL	V	144
R	H	CG	LEU	A	160	L	H	HG11	VAL	V	144
R	H	CG	LEU	A	160	L	H	HG13	VAL	V	144
R	H	CG	LEU	A	160	L	H	N	THR	V	145
R	H	CG	LEU	A	160	L	H	OG1	THR	V	145
R	H	CG	LEU	A	160	L	H	H	THR	V	145
R	H	CG	LEU	A	160	L	H	HA	THR	V	145
R	H	CG	LEU	A	160	L	H	HG1	THR	V	145
R	H	CG	LEU	A	160	L	H	HD11	LEU	V	148
R	H	CD1	LEU	A	160	L	H	CA	GLN	V	141
R	H	CD1	LEU	A	160	L	H	O	GLN	V	141
R	H	CD1	LEU	A	160	L	H	HA	GLN	V	141
R	H	CD1	LEU	A	160	L	H	HB2	GLN	V	141
R	H	CD1	LEU	A	160	L	H	HG2	GLN	V	141
R	H	CD1	LEU	A	160	L	H	CB	VAL	V	144
R	H	CD1	LEU	A	160	L	H	CG1	VAL	V	144
R	H	CD1	LEU	A	160	L	H	HB	VAL	V	144
R	H	CD1	LEU	A	160	L	H	HG11	VAL	V	144
R	H	CD1	LEU	A	160	L	H	HG13	VAL	V	144
R	H	CD1	LEU	A	160	L	H	N	THR	V	145
R	H	CD1	LEU	A	160	L	H	OG1	THR	V	145
R	H	CD1	LEU	A	160	L	H	H	THR	V	145
R	H	CD1	LEU	A	160	L	H	HG1	THR	V	145
R	H	CD2	LEU	A	160	L	H	O	GLN	V	141
R	H	CD2	LEU	A	160	L	H	C	VAL	V	144
R	H	CD2	LEU	A	160	L	H	CB	VAL	V	144
R	H	CD2	LEU	A	160	L	H	O	VAL	V	144
R	H	CD2	LEU	A	160	L	H	CG1	VAL	V	144
R	H	CD2	LEU	A	160	L	H	HB	VAL	V	144
R	H	CD2	LEU	A	160	L	H	HG11	VAL	V	144
R	H	CD2	LEU	A	160	L	H	HG13	VAL	V	144
R	H	CD2	LEU	A	160	L	H	N	THR	V	145
R	H	CD2	LEU	A	160	L	H	CA	THR	V	145
R	H	CD2	LEU	A	160	L	H	CB	THR	V	145
R	H	CD2	LEU	A	160	L	H	CG2	THR	V	145
R	H	CD2	LEU	A	160	L	H	OG1	THR	V	145
R	H	CD2	LEU	A	160	L	H	H	THR	V	145
R	H	CD2	LEU	A	160	L	H	HA	THR	V	145
R	H	CD2	LEU	A	160	L	H	HB	THR	V	145
R	H	CD2	LEU	A	160	L	H	HG1	THR	V	145
R	H	CD2	LEU	A	160	L	H	HG22	THR	V	145
R	H	CD2	LEU	A	160	L	H	CD1	LEU	V	148
R	H	CD2	LEU	A	160	L	H	HB2	LEU	V	148
R	H	CD2	LEU	A	160	L	H	HD11	LEU	V	148
R	H	N	PHE	A	163	L	H	HD13	LEU	V	148
R	H	CA	PHE	A	163	L	H	HB3	LEU	V	148
R	H	CA	PHE	A	163	L	H	HD13	LEU	V	148
R	H	C	PHE	A	163	L	H	HB3	LEU	V	148
R	H	C	PHE	A	163	L	H	HD13	LEU	V	148
R	H	C	PHE	A	163	L	H	HD22	LEU	V	148
R	H	CB	PHE	A	163	L	H	CB	LEU	V	148
R	H	CB	PHE	A	163	L	H	HB2	LEU	V	148
R	H	CB	PHE	A	163	L	H	HB3	LEU	V	148
R	H	CB	PHE	A	163	L	H	HD13	LEU	V	148
R	H	CB	PHE	A	163	L	H	HD22	LEU	V	148
R	H	CB	PHE	A	163	L	H	HG	SER	V	152
R	H	O	PHE	A	163	L	H	HD22	LEU	V	148
R	H	CG	PHE	A	163	L	H	HB3	LEU	V	148
R	H	CD1	PHE	A	163	L	H	OG	SER	V	152
R	H	CD1	PHE	A	163	L	H	HG	SER	V	152
R	H	N	HIS	A	164	L	H	CD1	LEU	V	148
R	H	N	HIS	A	164	L	H	CD2	LEU	V	148
R	H	N	HIS	A	164	L	H	HB3	LEU	V	148
R	H	N	HIS	A	164	L	H	HD12	LEU	V	148
R	H	N	HIS	A	164	L	H	HD13	LEU	V	148
R	H	N	HIS	A	164	L	H	HD22	LEU	V	148
R	H	N	HIS	A	164	L	H	HD23	LEU	V	148
R	H	CA	HIS	A	164	L	H	CD2	LEU	V	148
R	H	CA	HIS	A	164	L	H	HD13	LEU	V	148
R	H	CA	HIS	A	164	L	H	HD22	LEU	V	148
R	H	CA	HIS	A	164	L	H	HD23	LEU	V	148
R	H	C	HIS	A	164	L	H	HD22	LEU	V	148
R	H	CB	HIS	A	164	L	H	CD1	LEU	V	148
R	H	CB	HIS	A	164	L	H	CD2	LEU	V	148
R	H	CB	HIS	A	164	L	H	HD12	LEU	V	148
R	H	CB	HIS	A	164	L	H	HD13	LEU	V	148
R	H	CB	HIS	A	164	L	H	HD22	LEU	V	148
R	H	CB	HIS	A	164	L	H	HD23	LEU	V	148
R	H	CG	HIS	A	164	L	H	HD22	LEU	V	148
R	H	CG	HIS	A	164	L	H	HD23	LEU	V	148
R	H	CD2	HIS	A	164	L	H	CD2	LEU	V	148
R	H	CD2	HIS	A	164	L	H	HD22	LEU	V	148
R	H	CD2	HIS	A	164	L	H	HD23	LEU	V	148
R	H	CG	LEU	A	167	L	H	HB3	PHE	V	151
R	H	CD1	LEU	A	167	L	H	OH	TYR	V	100
R	H	CD1	LEU	A	167	L	H	HH	TYR	V	100
R	H	CD1	LEU	A	167	L	H	O	PHE	V	151
R	H	CD1	LEU	A	167	L	H	HB3	PHE	V	151
R	H	CD1	LEU	A	167	L	H	HA	SER	V	152
R	H	CD1	LEU	A	167	L	H	HB3	ALA	V	155
R	H	CD2	LEU	A	167	L	H	CB	PHE	V	151
R	H	CD2	LEU	A	167	L	H	HB2	PHE	V	151
R	H	CD2	LEU	A	167	L	H	HB3	PHE	V	151
R	H	NH1	ARG	A	174	L	H	O	ALA	V	155
R	H	NH1	ARG	A	174	L	H	HA	ALA	V	155
R	H	NH1	ARG	A	174	L	H	HB	THR	V	158
R	H	NH1	ARG	A	174	L	H	N	GLY	V	159
R	H	NH1	ARG	A	174	L	H	CA	GLY	V	159
R	H	NH1	ARG	A	174	L	H	H	GLY	V	159
R	H	NH1	ARG	A	174	L	H	HA2	GLY	V	159
R	H	NH1	ARG	A	174	L	H	HA3	GLY	V	159
R	H	NH2	ARG	A	174	L	H	CA	ALA	V	155
R	H	NH2	ARG	A	174	L	H	C	ALA	V	155
R	H	NH2	ARG	A	174	L	H	O	ALA	V	155
R	H	NH2	ARG	A	174	L	H	HA	ALA	V	155
R	H	NH2	ARG	A	174	L	H	HB1	ALA	V	155
R	H	NH2	ARG	A	174	L	H	N	GLY	V	159
R	H	NH2	ARG	A	174	L	H	CA	GLY	V	159
R	H	NH2	ARG	A	174	L	H	H	GLY	V	159
R	H	NH2	ARG	A	174	L	H	HA2	GLY	V	159
R	H	NH2	ARG	A	174	L	H	HA3	GLY	V	159
R	H	CZ	ARG	A	174	L	H	O	ALA	V	155
R	H	CZ	ARG	A	174	L	H	HB1	ALA	V	155
R	H	CZ	ARG	A	174	L	H	CA	GLY	V	159
R	H	CZ	ARG	A	174	L	H	HA2	GLY	V	159
R	H	CZ	ARG	A	174	L	H	HA3	GLY	V	159
R	-	C	SER	A	199	L	H	HD12	LEU	V	93
R	-	N	ASP	A	200	L	H	CD1	LEU	V	93
R	-	N	ASP	A	200	L	H	HD11	LEU	V	93
R	-	N	ASP	A	200	L	H	HD12	LEU	V	93
R	-	N	ASP	A	200	L	H	HD13	LEU	V	93
R	-	N	ASP	A	200	L	H	HD22	LEU	V	93
R	-	N	ASP	A	200	L	H	HD23	LEU	V	93
R	-	CA	ASP	A	200	L	H	CD1	LEU	V	93
R	-	CA	ASP	A	200	L	H	HD11	LEU	V	93
R	-	CA	ASP	A	200	L	H	HD12	LEU	V	93
R	-	CA	ASP	A	200	L	H	HD13	LEU	V	93
R	-	CA	ASP	A	200	L	H	HD22	LEU	V	93
R	-	C	ASP	A	200	L	H	HD13	LEU	V	93
R	-	C	ASP	A	200	L	H	HD22	LEU	V	93
R	-	CB	ASP	A	200	L	H	CB	LEU	V	93
R	-	CB	ASP	A	200	L	H	CG	LEU	V	93
R	-	CB	ASP	A	200	L	H	CD1	LEU	V	93
R	-	CB	ASP	A	200	L	H	CD2	LEU	V	93
R	-	CB	ASP	A	200	L	H	HB2	LEU	V	93
R	-	CB	ASP	A	200	L	H	HB3	LEU	V	93
R	-	CB	ASP	A	200	L	H	HG	LEU	V	93
R	-	CB	ASP	A	200	L	H	HD11	LEU	V	93
R	-	CB	ASP	A	200	L	H	HD12	LEU	V	93
R	-	CB	ASP	A	200	L	H	HD13	LEU	V	93
R	-	CB	ASP	A	200	L	H	HD22	LEU	V	93
R	-	CB	ASP	A	200	L	H	HD23	LEU	V	93
R	-	O	ASP	A	200	L	H	HD13	LEU	V	93
R	-	O	ASP	A	200	L	H	HD22	LEU	V	93
R	-	CG	ASP	A	200	L	H	CB	LEU	V	93
R	-	CG	ASP	A	200	L	H	CG	LEU	V	93
R	-	CG	ASP	A	200	L	H	CD1	LEU	V	93
R	-	CG	ASP	A	200	L	H	HB2	LEU	V	93
R	-	CG	ASP	A	200	L	H	HB3	LEU	V	93
R	-	CG	ASP	A	200	L	H	HD11	LEU	V	93
R	-	CG	ASP	A	200	L	H	HD12	LEU	V	93
R	-	CG	ASP	A	200	L	H	HD13	LEU	V	93
R	-	CG	ASP	A	200	L	H	HD22	LEU	V	93
R	-	OD1	ASP	A	200	L	H	CD1	LEU	V	93
R	-	OD1	ASP	A	200	L	H	HB3	LEU	V	93
R	-	OD1	ASP	A	200	L	H	HD11	LEU	V	93
R	-	OD1	ASP	A	200	L	H	HD13	LEU	V	93
R	-	OD2	ASP	A	200	L	H	CA	LEU	V	93
R	-	OD2	ASP	A	200	L	H	CB	LEU	V	93
R	-	OD2	ASP	A	200	L	H	CG	LEU	V	93
R	-	OD2	ASP	A	200	L	H	CD1	LEU	V	93
R	-	OD2	ASP	A	200	L	H	HB2	LEU	V	93
R	-	OD2	ASP	A	200	L	H	HB3	LEU	V	93
R	-	OD2	ASP	A	200	L	H	HD11	LEU	V	93
R	-	OD2	ASP	A	200	L	H	HD12	LEU	V	93
R	-	OD2	ASP	A	200	L	H	HD13	LEU	V	93
R	-	OD2	ASP	A	200	L	H	HD22	LEU	V	93
R	H	CA	VAL	A	203	L	H	HE2	PHE	V	101
R	H	CA	VAL	A	203	L	H	HZ	PHE	V	101
R	H	C	VAL	A	203	L	H	HZ	PHE	V	101
R	H	CB	VAL	A	203	L	H	HB3	ALA	V	97
R	H	O	VAL	A	203	L	H	HZ	PHE	V	101
R	H	CG2	VAL	A	203	L	H	CA	ALA	V	97
R	H	CG2	VAL	A	203	L	H	CB	ALA	V	97
R	H	CG2	VAL	A	203	L	H	HA	ALA	V	97
R	H	CG2	VAL	A	203	L	H	HB1	ALA	V	97
R	H	CG2	VAL	A	203	L	H	HB3	ALA	V	97
R	H	CG2	VAL	A	203	L	H	HE2	PHE	V	101
R	H	CA	TRP	A	206	L	H	HZ	PHE	V	101
R	H	C	TRP	A	206	L	H	HZ	PHE	V	101
R	H	CB	TRP	A	206	L	H	CE2	PHE	V	101
R	H	CB	TRP	A	206	L	H	CZ	PHE	V	101
R	H	CB	TRP	A	206	L	H	HE2	PHE	V	101
R	H	CB	TRP	A	206	L	H	HZ	PHE	V	101
R	H	CG	TRP	A	206	L	H	HE2	PHE	V	101
R	H	CG	TRP	A	206	L	H	HZ	PHE	V	101
R	H	CD1	TRP	A	206	L	H	HE2	PHE	V	101
R	H	N	VAL	A	207	L	H	HZ	PHE	V	101
R	H	CG2	VAL	A	207	L	H	CE1	TYR	V	100
R	H	CG2	VAL	A	207	L	H	OH	TYR	V	100
R	H	CG2	VAL	A	207	L	H	HE1	TYR	V	100
R	H	CG2	VAL	A	207	L	H	HE1	PHE	V	101
R	H	CG2	VAL	A	207	L	H	HZ	PHE	V	101
R	H	CG2	ILE	A	210	L	H	CZ	PHE	V	151
R	H	CG2	ILE	A	210	L	H	HE2	PHE	V	151
R	H	CG2	ILE	A	210	L	H	HZ	PHE	V	151
R	H	CD1	ILE	A	210	L	H	HE1	PHE	V	101
R	H	CD1	ILE	A	210	L	H	HZ	PHE	V	105
R	H	CD1	ILE	A	210	L	H	HZ	PHE	V	151
R	H	SD	MET	A	211	L	H	HB2	TRP	V	147
R	H	SD	MET	A	211	L	H	HD21	LEU	V	148
R	H	SD	MET	A	211	L	H	CD2	PHE	V	151
R	H	SD	MET	A	211	L	H	CE2	PHE	V	151
R	H	SD	MET	A	211	L	H	HD2	PHE	V	151
R	H	SD	MET	A	211	L	H	HE2	PHE	V	151
R	H	CE	MET	A	211	L	H	CG	LEU	V	148
R	H	CE	MET	A	211	L	H	CD2	LEU	V	148
R	H	CE	MET	A	211	L	H	HG	LEU	V	148
R	H	CE	MET	A	211	L	H	HD21	LEU	V	148
R	H	CE	MET	A	211	L	H	HD22	LEU	V	148
R	H	CE	MET	A	211	L	H	HD23	LEU	V	148
R	H	C	LEU	A	214	L	H	OH	TYR	V	140
R	H	C	LEU	A	214	L	H	HH	TYR	V	140
R	H	O	LEU	A	214	L	H	OH	TYR	V	140
R	H	O	LEU	A	214	L	H	CZ	TYR	V	140
R	H	O	LEU	A	214	L	H	HE2	TYR	V	140
R	H	O	LEU	A	214	L	H	HH	TYR	V	140
R	H	O	LEU	A	214	L	H	HG22	VAL	V	144
R	H	CD1	LEU	A	214	L	H	CG	TRP	V	147
R	H	CD1	LEU	A	214	L	H	HB2	TRP	V	147
R	H	CD1	LEU	A	214	L	H	HE2	PHE	V	151
R	H	CD2	LEU	A	214	L	H	CD1	TRP	V	147
R	H	CD2	LEU	A	214	L	H	NE1	TRP	V	147
R	H	CD2	LEU	A	214	L	H	HD1	TRP	V	147
R	H	CD2	LEU	A	214	L	H	HE1	TRP	V	147
R	H	N	ILE	A	215	L	H	HH	TYR	V	140
R	H	CA	ILE	A	215	L	H	HH	TYR	V	140
R	H	CD1	ILE	A	215	L	H	CG1	VAL	V	144
R	H	CD1	ILE	A	215	L	H	HG12	VAL	V	144
R	H	CD1	ILE	A	215	L	H	HG13	VAL	V	144
R	H	CD1	ILE	A	215	L	H	HD12	LEU	V	148
R	H	CD1	ILE	A	215	L	H	HD23	LEU	V	148
R	H	CA	ILE	A	218	L	H	HE2	TYR	V	140
R	H	C	ILE	A	218	L	H	HE2	TYR	V	140
R	H	CB	ILE	A	218	L	H	CE2	TYR	V	140
R	H	CB	ILE	A	218	L	H	OH	TYR	V	140
R	H	CB	ILE	A	218	L	H	HE2	TYR	V	140
R	H	CB	ILE	A	218	L	H	HH	TYR	V	140
R	H	CG1	ILE	A	218	L	H	HE2	TYR	V	140
R	H	CG2	ILE	A	218	L	H	CD2	TYR	V	140
R	H	CG2	ILE	A	218	L	H	CE2	TYR	V	140
R	H	CG2	ILE	A	218	L	H	OH	TYR	V	140
R	H	CG2	ILE	A	218	L	H	CZ	TYR	V	140
R	H	CG2	ILE	A	218	L	H	HD2	TYR	V	140
R	H	CG2	ILE	A	218	L	H	HE2	TYR	V	140
R	H	CG2	ILE	A	218	L	H	HH	TYR	V	140
R	H	CD1	ILE	A	218	L	H	HE2	TYR	V	140
R	H	N	PRO	A	219	L	H	OH	TYR	V	140
R	H	N	PRO	A	219	L	H	HE2	TYR	V	140
R	H	N	PRO	A	219	L	H	HH	TYR	V	140
R	H	CB	PRO	A	219	L	H	OH	TYR	V	140
R	H	CG	PRO	A	219	L	H	OH	TYR	V	140
R	H	CG	PRO	A	219	L	H	CZ	TYR	V	140
R	H	CG	PRO	A	219	L	H	HE1	TYR	V	140
R	H	CG	PRO	A	219	L	H	HH	TYR	V	140
R	H	CD	PRO	A	219	L	H	OH	TYR	V	140
R	H	CD	PRO	A	219	L	H	CZ	TYR	V	140
R	H	CD	PRO	A	219	L	H	HE2	TYR	V	140
R	H	CD	PRO	A	219	L	H	HH	TYR	V	140
R	H	CD1	LEU	A	222	L	H	CG	TYR	V	140
R	H	CD1	LEU	A	222	L	H	CD2	TYR	V	140
R	H	CD1	LEU	A	222	L	H	CE2	TYR	V	140
R	H	CD1	LEU	A	222	L	H	HB2	TYR	V	140
R	H	CD1	LEU	A	222	L	H	HD2	TYR	V	140
R	H	CD1	LEU	A	222	L	H	HE2	TYR	V	140

- Title of columns started by 'R:' means Receptor, 'L:' means Ligand
- In the Secondary Structure columns: 'H' means that residues/atoms in that row are part of Alpha Helix; 'S' - Beta Sheet

Krembil, Jurisica Lab. July 16, 2025 Database: 1.0.4.1