IID

Q96A58_Q9HBH0.1 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	H	LYS	V	176
R	-	ASP	A	2	L	H	ARG	V	179
R	H	THR	A	33	L	S	LYS	V	8
R	H	MET	A	37	L	S	LYS	V	8
R	-	PRO	A	4	L	H	ARG	V	168
R	-	PRO	A	4	L	H	MET	V	172
R	-	PRO	A	4	L	S	GLU	V	52
R	H	SER	A	40	L	-	LYS	V	3
R	H	GLN	A	41	L	-	LYS	V	3
R	H	GLN	A	41	L	-	GLU	V	6
R	-	SER	A	43	L	-	ALA	V	5
R	-	PRO	A	45	L	S	LYS	V	8
R	-	GLU	A	46	L	-	LYS	V	109
R	-	GLU	A	46	L	H	ARG	V	178
R	-	HIS	A	47	L	H	LYS	V	106
R	-	HIS	A	47	L	-	LYS	V	109
R	-	HIS	A	47	L	H	ARG	V	75
R	-	HIS	A	47	L	H	TRP	V	76
R	-	HIS	A	47	L	-	GLU	V	78
R	-	TYR	A	48	L	H	GLY	V	72
R	-	TYR	A	48	L	H	ARG	V	75
R	-	TYR	A	48	L	H	TRP	V	76
R	-	ALA	A	49	L	H	GLY	V	72
R	-	ALA	A	49	L	H	HIS	V	73
R	-	ALA	A	49	L	H	TRP	V	76
R	-	GLY	A	5	L	-	ALA	V	2
R	-	GLY	A	5	L	-	LYS	V	3
R	-	GLY	A	5	L	-	SER	V	4
R	-	PRO	A	50	L	H	GLY	V	72
R	-	PRO	A	50	L	H	HIS	V	73
R	-	PRO	A	50	L	H	TRP	V	76
R	-	VAL	A	52	L	-	GLU	V	40
R	-	VAL	A	52	L	S	SER	V	41
R	-	VAL	A	52	L	S	THR	V	42
R	S	PHE	A	53	L	S	THR	V	42
R	S	GLU	A	54	L	S	THR	V	42
R	S	GLU	A	54	L	S	ARG	V	44
R	S	GLU	A	54	L	S	GLU	V	57
R	S	GLU	A	54	L	H	TRP	V	76
R	S	LYS	A	55	L	S	ARG	V	44
R	S	TYR	A	56	L	S	ARG	V	44
R	S	THR	A	57	L	-	LYS	V	3
R	-	ALA	A	6	L	-	MET	V	1
R	-	ALA	A	6	L	-	ALA	V	2
R	-	ALA	A	6	L	-	LYS	V	3
R	-	ALA	A	6	L	-	SER	V	4
R	-	LEU	A	7	L	-	MET	V	1
R	-	LEU	A	7	L	-	ALA	V	2
R	-	LEU	A	7	L	-	LYS	V	3
R	-	LEU	A	7	L	-	SER	V	4
R	-	LEU	A	7	L	S	VAL	V	53
R	-	LEU	A	7	L	S	VAL	V	54
R	-	LEU	A	7	L	S	SER	V	55
R	-	GLN	A	77	L	H	GLN	V	69
R	-	ALA	A	8	L	-	MET	V	1
R	-	ALA	A	8	L	-	LYS	V	3
R	H	TYR	A	80	L	-	GLU	V	40
R	H	TYR	A	80	L	H	GLN	V	69
R	-	GLN	A	9	L	S	VAL	V	53

- 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

Q96A58_Q9HBH0.1 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	H	CE	LYS	V	176
R	-	N	MET	A	1	L	H	NZ	LYS	V	176
R	-	N	MET	A	1	L	H	HE2	LYS	V	176
R	-	N	MET	A	1	L	H	HZ1	LYS	V	176
R	-	N	MET	A	1	L	H	HZ3	LYS	V	176
R	-	CA	MET	A	1	L	H	HZ1	LYS	V	176
R	-	OD2	ASP	A	2	L	H	HH12	ARG	V	179
R	-	N	PRO	A	4	L	H	HE2	MET	V	172
R	-	CA	PRO	A	4	L	H	HE2	MET	V	172
R	-	CB	PRO	A	4	L	H	HH21	ARG	V	168
R	-	CB	PRO	A	4	L	H	HE2	MET	V	172
R	-	CG	PRO	A	4	L	S	CD	GLU	V	52
R	-	CG	PRO	A	4	L	S	OE1	GLU	V	52
R	-	CG	PRO	A	4	L	S	OE2	GLU	V	52
R	-	CG	PRO	A	4	L	H	NH2	ARG	V	168
R	-	CG	PRO	A	4	L	H	HH21	ARG	V	168
R	-	CG	PRO	A	4	L	H	HH22	ARG	V	168
R	-	CG	PRO	A	4	L	H	HE1	MET	V	172
R	-	CG	PRO	A	4	L	H	HE2	MET	V	172
R	-	CD	PRO	A	4	L	S	OE1	GLU	V	52
R	-	CD	PRO	A	4	L	S	OE2	GLU	V	52
R	-	CD	PRO	A	4	L	H	HH21	ARG	V	168
R	-	CD	PRO	A	4	L	H	CE	MET	V	172
R	-	CD	PRO	A	4	L	H	HE1	MET	V	172
R	-	CD	PRO	A	4	L	H	HE2	MET	V	172
R	-	N	GLY	A	5	L	-	HB2	ALA	V	2
R	-	N	GLY	A	5	L	-	HA	SER	V	4
R	-	CA	GLY	A	5	L	-	CA	ALA	V	2
R	-	CA	GLY	A	5	L	-	C	ALA	V	2
R	-	CA	GLY	A	5	L	-	CB	ALA	V	2
R	-	CA	GLY	A	5	L	-	O	ALA	V	2
R	-	CA	GLY	A	5	L	-	HB1	ALA	V	2
R	-	CA	GLY	A	5	L	-	HB2	ALA	V	2
R	-	CA	GLY	A	5	L	-	HB3	ALA	V	2
R	-	CA	GLY	A	5	L	-	HA	SER	V	4
R	-	C	GLY	A	5	L	-	CA	ALA	V	2
R	-	C	GLY	A	5	L	-	C	ALA	V	2
R	-	C	GLY	A	5	L	-	CB	ALA	V	2
R	-	C	GLY	A	5	L	-	O	ALA	V	2
R	-	C	GLY	A	5	L	-	HB1	ALA	V	2
R	-	C	GLY	A	5	L	-	HB2	ALA	V	2
R	-	C	GLY	A	5	L	-	C	LYS	V	3
R	-	C	GLY	A	5	L	-	N	SER	V	4
R	-	C	GLY	A	5	L	-	CA	SER	V	4
R	-	C	GLY	A	5	L	-	H	SER	V	4
R	-	C	GLY	A	5	L	-	HA	SER	V	4
R	-	C	GLY	A	5	L	-	HB2	SER	V	4
R	-	O	GLY	A	5	L	-	C	ALA	V	2
R	-	O	GLY	A	5	L	-	O	ALA	V	2
R	-	O	GLY	A	5	L	-	HB2	ALA	V	2
R	-	O	GLY	A	5	L	-	C	LYS	V	3
R	-	O	GLY	A	5	L	-	O	LYS	V	3
R	-	O	GLY	A	5	L	-	N	SER	V	4
R	-	O	GLY	A	5	L	-	CA	SER	V	4
R	-	O	GLY	A	5	L	-	CB	SER	V	4
R	-	O	GLY	A	5	L	-	OG	SER	V	4
R	-	O	GLY	A	5	L	-	H	SER	V	4
R	-	O	GLY	A	5	L	-	HA	SER	V	4
R	-	O	GLY	A	5	L	-	HB2	SER	V	4
R	-	O	GLY	A	5	L	-	HB3	SER	V	4
R	-	N	ALA	A	6	L	-	C	MET	V	1
R	-	N	ALA	A	6	L	-	HB3	MET	V	1
R	-	N	ALA	A	6	L	-	N	ALA	V	2
R	-	N	ALA	A	6	L	-	CA	ALA	V	2
R	-	N	ALA	A	6	L	-	C	ALA	V	2
R	-	N	ALA	A	6	L	-	CB	ALA	V	2
R	-	N	ALA	A	6	L	-	O	ALA	V	2
R	-	N	ALA	A	6	L	-	H	ALA	V	2
R	-	N	ALA	A	6	L	-	HB2	ALA	V	2
R	-	CA	ALA	A	6	L	-	CA	MET	V	1
R	-	CA	ALA	A	6	L	-	C	MET	V	1
R	-	CA	ALA	A	6	L	-	CB	MET	V	1
R	-	CA	ALA	A	6	L	-	CG	MET	V	1
R	-	CA	ALA	A	6	L	-	HA	MET	V	1
R	-	CA	ALA	A	6	L	-	HB2	MET	V	1
R	-	CA	ALA	A	6	L	-	HB3	MET	V	1
R	-	CA	ALA	A	6	L	-	HG2	MET	V	1
R	-	CA	ALA	A	6	L	-	N	ALA	V	2
R	-	CA	ALA	A	6	L	-	CA	ALA	V	2
R	-	CA	ALA	A	6	L	-	C	ALA	V	2
R	-	CA	ALA	A	6	L	-	O	ALA	V	2
R	-	CA	ALA	A	6	L	-	H	ALA	V	2
R	-	CA	ALA	A	6	L	-	HB2	ALA	V	2
R	-	CA	ALA	A	6	L	-	H	SER	V	4
R	-	C	ALA	A	6	L	-	CA	MET	V	1
R	-	C	ALA	A	6	L	-	C	MET	V	1
R	-	C	ALA	A	6	L	-	CB	MET	V	1
R	-	C	ALA	A	6	L	-	O	MET	V	1
R	-	C	ALA	A	6	L	-	HB2	MET	V	1
R	-	C	ALA	A	6	L	-	HB3	MET	V	1
R	-	C	ALA	A	6	L	-	N	ALA	V	2
R	-	C	ALA	A	6	L	-	CA	ALA	V	2
R	-	C	ALA	A	6	L	-	C	ALA	V	2
R	-	C	ALA	A	6	L	-	O	ALA	V	2
R	-	C	ALA	A	6	L	-	N	LYS	V	3
R	-	C	ALA	A	6	L	-	CA	LYS	V	3
R	-	C	ALA	A	6	L	-	C	LYS	V	3
R	-	C	ALA	A	6	L	-	HA	LYS	V	3
R	-	C	ALA	A	6	L	-	N	SER	V	4
R	-	C	ALA	A	6	L	-	H	SER	V	4
R	-	CB	ALA	A	6	L	-	N	MET	V	1
R	-	CB	ALA	A	6	L	-	CA	MET	V	1
R	-	CB	ALA	A	6	L	-	C	MET	V	1
R	-	CB	ALA	A	6	L	-	CB	MET	V	1
R	-	CB	ALA	A	6	L	-	O	MET	V	1
R	-	CB	ALA	A	6	L	-	CG	MET	V	1
R	-	CB	ALA	A	6	L	-	SD	MET	V	1
R	-	CB	ALA	A	6	L	-	HA	MET	V	1
R	-	CB	ALA	A	6	L	-	HB2	MET	V	1
R	-	CB	ALA	A	6	L	-	HB3	MET	V	1
R	-	CB	ALA	A	6	L	-	HG2	MET	V	1
R	-	CB	ALA	A	6	L	-	HG3	MET	V	1
R	-	CB	ALA	A	6	L	-	HE2	MET	V	1
R	-	CB	ALA	A	6	L	-	N	ALA	V	2
R	-	CB	ALA	A	6	L	-	C	ALA	V	2
R	-	CB	ALA	A	6	L	-	O	ALA	V	2
R	-	CB	ALA	A	6	L	-	H	ALA	V	2
R	-	O	ALA	A	6	L	-	CA	MET	V	1
R	-	O	ALA	A	6	L	-	C	MET	V	1
R	-	O	ALA	A	6	L	-	CB	MET	V	1
R	-	O	ALA	A	6	L	-	O	MET	V	1
R	-	O	ALA	A	6	L	-	HB2	MET	V	1
R	-	O	ALA	A	6	L	-	HB3	MET	V	1
R	-	O	ALA	A	6	L	-	N	ALA	V	2
R	-	O	ALA	A	6	L	-	CA	ALA	V	2
R	-	O	ALA	A	6	L	-	C	ALA	V	2
R	-	O	ALA	A	6	L	-	O	ALA	V	2
R	-	O	ALA	A	6	L	-	H	ALA	V	2
R	-	O	ALA	A	6	L	-	HA	ALA	V	2
R	-	O	ALA	A	6	L	-	N	LYS	V	3
R	-	O	ALA	A	6	L	-	CA	LYS	V	3
R	-	O	ALA	A	6	L	-	C	LYS	V	3
R	-	O	ALA	A	6	L	-	CB	LYS	V	3
R	-	O	ALA	A	6	L	-	H	LYS	V	3
R	-	O	ALA	A	6	L	-	HA	LYS	V	3
R	-	O	ALA	A	6	L	-	N	SER	V	4
R	-	O	ALA	A	6	L	-	H	SER	V	4
R	-	N	LEU	A	7	L	-	HB3	MET	V	1
R	-	N	LEU	A	7	L	-	C	ALA	V	2
R	-	N	LEU	A	7	L	-	O	ALA	V	2
R	-	N	LEU	A	7	L	-	CA	LYS	V	3
R	-	N	LEU	A	7	L	-	C	LYS	V	3
R	-	N	LEU	A	7	L	-	HA	LYS	V	3
R	-	N	LEU	A	7	L	-	N	SER	V	4
R	-	N	LEU	A	7	L	-	H	SER	V	4
R	-	N	LEU	A	7	L	-	HB2	SER	V	4
R	-	CA	LEU	A	7	L	-	HB3	MET	V	1
R	-	CA	LEU	A	7	L	-	O	ALA	V	2
R	-	CA	LEU	A	7	L	-	CA	LYS	V	3
R	-	CA	LEU	A	7	L	-	C	LYS	V	3
R	-	CA	LEU	A	7	L	-	HA	LYS	V	3
R	-	CA	LEU	A	7	L	-	HG3	LYS	V	3
R	-	CA	LEU	A	7	L	-	N	SER	V	4
R	-	CA	LEU	A	7	L	-	H	SER	V	4
R	-	C	LEU	A	7	L	-	CB	MET	V	1
R	-	C	LEU	A	7	L	-	HB2	MET	V	1
R	-	C	LEU	A	7	L	-	HB3	MET	V	1
R	-	C	LEU	A	7	L	-	HA	LYS	V	3
R	-	C	LEU	A	7	L	-	HG3	LYS	V	3
R	-	C	LEU	A	7	L	-	H	SER	V	4
R	-	CB	LEU	A	7	L	-	HA	LYS	V	3
R	-	CB	LEU	A	7	L	-	H	SER	V	4
R	-	CB	LEU	A	7	L	-	HB3	SER	V	4
R	-	O	LEU	A	7	L	-	CB	MET	V	1
R	-	O	LEU	A	7	L	-	SD	MET	V	1
R	-	O	LEU	A	7	L	-	HB2	MET	V	1
R	-	O	LEU	A	7	L	-	HB3	MET	V	1
R	-	CG	LEU	A	7	L	-	N	SER	V	4
R	-	CG	LEU	A	7	L	-	CB	SER	V	4
R	-	CG	LEU	A	7	L	-	H	SER	V	4
R	-	CG	LEU	A	7	L	-	HB2	SER	V	4
R	-	CG	LEU	A	7	L	-	HB3	SER	V	4
R	-	CG	LEU	A	7	L	S	O	VAL	V	53
R	-	CD1	LEU	A	7	L	-	HB2	SER	V	4
R	-	CD1	LEU	A	7	L	-	HB3	SER	V	4
R	-	CD1	LEU	A	7	L	S	C	VAL	V	53
R	-	CD1	LEU	A	7	L	S	CB	VAL	V	53
R	-	CD1	LEU	A	7	L	S	O	VAL	V	53
R	-	CD1	LEU	A	7	L	S	CG1	VAL	V	53
R	-	CD1	LEU	A	7	L	S	HB	VAL	V	53
R	-	CD1	LEU	A	7	L	S	HG11	VAL	V	53
R	-	CD1	LEU	A	7	L	S	HA	VAL	V	54
R	-	CD1	LEU	A	7	L	S	H	SER	V	55
R	-	CD2	LEU	A	7	L	-	HG2	LYS	V	3
R	-	CD2	LEU	A	7	L	-	N	SER	V	4
R	-	CD2	LEU	A	7	L	-	O	SER	V	4
R	-	CD2	LEU	A	7	L	-	H	SER	V	4
R	-	CD2	LEU	A	7	L	-	HB3	SER	V	4
R	-	CD2	LEU	A	7	L	S	HB2	SER	V	55
R	-	N	ALA	A	8	L	-	O	MET	V	1
R	-	N	ALA	A	8	L	-	HB2	MET	V	1
R	-	N	ALA	A	8	L	-	HB3	MET	V	1
R	-	N	ALA	A	8	L	-	N	LYS	V	3
R	-	N	ALA	A	8	L	-	CA	LYS	V	3
R	-	N	ALA	A	8	L	-	CG	LYS	V	3
R	-	N	ALA	A	8	L	-	HA	LYS	V	3
R	-	N	ALA	A	8	L	-	HB2	LYS	V	3
R	-	N	ALA	A	8	L	-	HG3	LYS	V	3
R	-	CA	ALA	A	8	L	-	O	MET	V	1
R	-	CA	ALA	A	8	L	-	HB2	MET	V	1
R	-	CA	ALA	A	8	L	-	HG3	LYS	V	3
R	-	CB	ALA	A	8	L	-	O	MET	V	1
R	-	CB	ALA	A	8	L	-	HB2	LYS	V	3
R	-	CB	ALA	A	8	L	-	HG3	LYS	V	3
R	-	O	ALA	A	8	L	-	HG3	LYS	V	3
R	-	O	ALA	A	8	L	-	HE3	LYS	V	3
R	-	NE2	GLN	A	9	L	S	HB	VAL	V	53
R	-	NE2	GLN	A	9	L	S	HG13	VAL	V	53
R	-	NE2	GLN	A	9	L	S	HG22	VAL	V	53
R	H	CG2	THR	A	33	L	S	HZ1	LYS	V	8
R	H	SD	MET	A	37	L	S	NZ	LYS	V	8
R	H	SD	MET	A	37	L	S	HE2	LYS	V	8
R	H	SD	MET	A	37	L	S	HZ1	LYS	V	8
R	H	SD	MET	A	37	L	S	HZ3	LYS	V	8
R	H	CE	MET	A	37	L	S	CE	LYS	V	8
R	H	CE	MET	A	37	L	S	NZ	LYS	V	8
R	H	CE	MET	A	37	L	S	HE2	LYS	V	8
R	H	CE	MET	A	37	L	S	HZ1	LYS	V	8
R	H	CE	MET	A	37	L	S	HZ3	LYS	V	8
R	H	CA	SER	A	40	L	-	HZ2	LYS	V	3
R	H	CA	SER	A	40	L	-	HZ3	LYS	V	3
R	H	C	SER	A	40	L	-	CD	LYS	V	3
R	H	C	SER	A	40	L	-	NZ	LYS	V	3
R	H	C	SER	A	40	L	-	HD2	LYS	V	3
R	H	C	SER	A	40	L	-	HD3	LYS	V	3
R	H	C	SER	A	40	L	-	HZ2	LYS	V	3
R	H	C	SER	A	40	L	-	HZ3	LYS	V	3
R	H	CB	SER	A	40	L	-	NZ	LYS	V	3
R	H	CB	SER	A	40	L	-	HZ2	LYS	V	3
R	H	CB	SER	A	40	L	-	HZ3	LYS	V	3
R	H	O	SER	A	40	L	-	CD	LYS	V	3
R	H	O	SER	A	40	L	-	CE	LYS	V	3
R	H	O	SER	A	40	L	-	NZ	LYS	V	3
R	H	O	SER	A	40	L	-	HB2	LYS	V	3
R	H	O	SER	A	40	L	-	HD2	LYS	V	3
R	H	O	SER	A	40	L	-	HD3	LYS	V	3
R	H	O	SER	A	40	L	-	HE3	LYS	V	3
R	H	O	SER	A	40	L	-	HZ2	LYS	V	3
R	H	O	SER	A	40	L	-	HZ3	LYS	V	3
R	H	OG	SER	A	40	L	-	NZ	LYS	V	3
R	H	OG	SER	A	40	L	-	HZ2	LYS	V	3
R	H	OG	SER	A	40	L	-	HZ3	LYS	V	3
R	H	N	GLN	A	41	L	-	CD	LYS	V	3
R	H	N	GLN	A	41	L	-	HD2	LYS	V	3
R	H	N	GLN	A	41	L	-	HD3	LYS	V	3
R	H	N	GLN	A	41	L	-	HZ3	LYS	V	3
R	H	CA	GLN	A	41	L	-	CB	LYS	V	3
R	H	CA	GLN	A	41	L	-	CD	LYS	V	3
R	H	CA	GLN	A	41	L	-	HB2	LYS	V	3
R	H	CA	GLN	A	41	L	-	HB3	LYS	V	3
R	H	CA	GLN	A	41	L	-	HD2	LYS	V	3
R	H	CA	GLN	A	41	L	-	HD3	LYS	V	3
R	H	C	GLN	A	41	L	-	HB3	LYS	V	3
R	H	C	GLN	A	41	L	-	HD3	LYS	V	3
R	H	CB	GLN	A	41	L	-	CD	LYS	V	3
R	H	CB	GLN	A	41	L	-	HB3	LYS	V	3
R	H	CB	GLN	A	41	L	-	HD3	LYS	V	3
R	H	O	GLN	A	41	L	-	CB	LYS	V	3
R	H	O	GLN	A	41	L	-	O	LYS	V	3
R	H	O	GLN	A	41	L	-	HB2	LYS	V	3
R	H	O	GLN	A	41	L	-	HB3	LYS	V	3
R	H	CG	GLN	A	41	L	-	CD	LYS	V	3
R	H	CG	GLN	A	41	L	-	CE	LYS	V	3
R	H	CG	GLN	A	41	L	-	NZ	LYS	V	3
R	H	CG	GLN	A	41	L	-	HD2	LYS	V	3
R	H	CG	GLN	A	41	L	-	HD3	LYS	V	3
R	H	CG	GLN	A	41	L	-	HE2	LYS	V	3
R	H	CG	GLN	A	41	L	-	HZ3	LYS	V	3
R	H	CD	GLN	A	41	L	-	HD3	LYS	V	3
R	H	CD	GLN	A	41	L	-	HZ3	LYS	V	3
R	H	CD	GLN	A	41	L	-	H	GLU	V	6
R	H	CD	GLN	A	41	L	-	HB2	GLU	V	6
R	H	NE2	GLN	A	41	L	-	HZ3	LYS	V	3
R	H	NE2	GLN	A	41	L	-	CB	GLU	V	6
R	H	NE2	GLN	A	41	L	-	OE2	GLU	V	6
R	H	NE2	GLN	A	41	L	-	H	GLU	V	6
R	H	NE2	GLN	A	41	L	-	HB2	GLU	V	6
R	H	NE2	GLN	A	41	L	-	HB3	GLU	V	6
R	H	OE1	GLN	A	41	L	-	H	GLU	V	6
R	H	OE1	GLN	A	41	L	-	HB2	GLU	V	6
R	H	OE1	GLN	A	41	L	-	HB3	GLU	V	6
R	-	OG	SER	A	43	L	-	HB1	ALA	V	5
R	-	OG	SER	A	43	L	-	HB3	ALA	V	5
R	-	CB	PRO	A	45	L	S	HZ3	LYS	V	8
R	-	CD	GLU	A	46	L	-	NZ	LYS	V	109
R	-	CD	GLU	A	46	L	-	HZ2	LYS	V	109
R	-	CD	GLU	A	46	L	-	HZ3	LYS	V	109
R	-	OE1	GLU	A	46	L	-	HZ3	LYS	V	109
R	-	OE1	GLU	A	46	L	H	NH1	ARG	V	178
R	-	OE1	GLU	A	46	L	H	HH11	ARG	V	178
R	-	OE1	GLU	A	46	L	H	HH12	ARG	V	178
R	-	OE2	GLU	A	46	L	-	CE	LYS	V	109
R	-	OE2	GLU	A	46	L	-	NZ	LYS	V	109
R	-	OE2	GLU	A	46	L	-	HZ1	LYS	V	109
R	-	OE2	GLU	A	46	L	-	HZ2	LYS	V	109
R	-	OE2	GLU	A	46	L	-	HZ3	LYS	V	109
R	-	CA	HIS	A	47	L	H	O	ARG	V	75
R	-	CA	HIS	A	47	L	H	HB2	ARG	V	75
R	-	CA	HIS	A	47	L	H	HA	TRP	V	76
R	-	C	HIS	A	47	L	H	C	ARG	V	75
R	-	C	HIS	A	47	L	H	O	ARG	V	75
R	-	C	HIS	A	47	L	H	HB2	ARG	V	75
R	-	C	HIS	A	47	L	H	HA	TRP	V	76
R	-	CB	HIS	A	47	L	H	C	ARG	V	75
R	-	CB	HIS	A	47	L	H	O	ARG	V	75
R	-	CB	HIS	A	47	L	H	HA	ARG	V	75
R	-	CB	HIS	A	47	L	H	HB2	ARG	V	75
R	-	CB	HIS	A	47	L	H	HA	TRP	V	76
R	-	CB	HIS	A	47	L	H	NZ	LYS	V	106
R	-	CB	HIS	A	47	L	H	HZ2	LYS	V	106
R	-	CB	HIS	A	47	L	H	HZ3	LYS	V	106
R	-	O	HIS	A	47	L	H	CA	TRP	V	76
R	-	O	HIS	A	47	L	H	HA	TRP	V	76
R	-	CG	HIS	A	47	L	H	O	ARG	V	75
R	-	CG	HIS	A	47	L	H	NZ	LYS	V	106
R	-	CG	HIS	A	47	L	H	HZ2	LYS	V	106
R	-	CG	HIS	A	47	L	H	HZ3	LYS	V	106
R	-	CD2	HIS	A	47	L	H	O	ARG	V	75
R	-	CD2	HIS	A	47	L	-	HG2	GLU	V	78
R	-	CD2	HIS	A	47	L	H	NZ	LYS	V	106
R	-	CD2	HIS	A	47	L	H	HZ2	LYS	V	106
R	-	CD2	HIS	A	47	L	H	HZ3	LYS	V	106
R	-	CD2	HIS	A	47	L	-	HZ2	LYS	V	109
R	-	ND1	HIS	A	47	L	H	O	ARG	V	75
R	-	ND1	HIS	A	47	L	H	HZ2	LYS	V	106
R	-	ND1	HIS	A	47	L	H	HZ3	LYS	V	106
R	-	CE1	HIS	A	47	L	H	HD2	LYS	V	106
R	-	CE1	HIS	A	47	L	H	HD3	LYS	V	106
R	-	CE1	HIS	A	47	L	H	HZ2	LYS	V	106
R	-	CE1	HIS	A	47	L	-	HD2	LYS	V	109
R	-	CE1	HIS	A	47	L	-	HZ2	LYS	V	109
R	-	NE2	HIS	A	47	L	H	HD3	LYS	V	106
R	-	NE2	HIS	A	47	L	H	HZ2	LYS	V	106
R	-	NE2	HIS	A	47	L	-	NZ	LYS	V	109
R	-	NE2	HIS	A	47	L	-	HD2	LYS	V	109
R	-	NE2	HIS	A	47	L	-	HZ2	LYS	V	109
R	-	N	TYR	A	48	L	H	C	ARG	V	75
R	-	N	TYR	A	48	L	H	O	ARG	V	75
R	-	N	TYR	A	48	L	H	HB2	ARG	V	75
R	-	N	TYR	A	48	L	H	HA	TRP	V	76
R	-	CA	TYR	A	48	L	H	HB2	ARG	V	75
R	-	CA	TYR	A	48	L	H	HA	TRP	V	76
R	-	CA	TYR	A	48	L	H	HB2	TRP	V	76
R	-	C	TYR	A	48	L	H	O	GLY	V	72
R	-	C	TYR	A	48	L	H	C	ARG	V	75
R	-	C	TYR	A	48	L	H	CB	ARG	V	75
R	-	C	TYR	A	48	L	H	HB2	ARG	V	75
R	-	C	TYR	A	48	L	H	HB3	ARG	V	75
R	-	C	TYR	A	48	L	H	N	TRP	V	76
R	-	C	TYR	A	48	L	H	CA	TRP	V	76
R	-	C	TYR	A	48	L	H	CB	TRP	V	76
R	-	C	TYR	A	48	L	H	H	TRP	V	76
R	-	C	TYR	A	48	L	H	HA	TRP	V	76
R	-	C	TYR	A	48	L	H	HB2	TRP	V	76
R	-	CB	TYR	A	48	L	H	HB2	ARG	V	75
R	-	O	TYR	A	48	L	H	C	GLY	V	72
R	-	O	TYR	A	48	L	H	O	GLY	V	72
R	-	O	TYR	A	48	L	H	HA2	GLY	V	72
R	-	O	TYR	A	48	L	H	N	ARG	V	75
R	-	O	TYR	A	48	L	H	CA	ARG	V	75
R	-	O	TYR	A	48	L	H	C	ARG	V	75
R	-	O	TYR	A	48	L	H	CB	ARG	V	75
R	-	O	TYR	A	48	L	H	O	ARG	V	75
R	-	O	TYR	A	48	L	H	H	ARG	V	75
R	-	O	TYR	A	48	L	H	HB2	ARG	V	75
R	-	O	TYR	A	48	L	H	HB3	ARG	V	75
R	-	O	TYR	A	48	L	H	HD3	ARG	V	75
R	-	O	TYR	A	48	L	H	N	TRP	V	76
R	-	O	TYR	A	48	L	H	CA	TRP	V	76
R	-	O	TYR	A	48	L	H	CB	TRP	V	76
R	-	O	TYR	A	48	L	H	H	TRP	V	76
R	-	O	TYR	A	48	L	H	HA	TRP	V	76
R	-	O	TYR	A	48	L	H	HB2	TRP	V	76
R	-	O	TYR	A	48	L	H	HB3	TRP	V	76
R	-	CD1	TYR	A	48	L	H	HA2	GLY	V	72
R	-	N	ALA	A	49	L	H	O	GLY	V	72
R	-	N	ALA	A	49	L	H	N	TRP	V	76
R	-	N	ALA	A	49	L	H	CA	TRP	V	76
R	-	N	ALA	A	49	L	H	CB	TRP	V	76
R	-	N	ALA	A	49	L	H	CG	TRP	V	76
R	-	N	ALA	A	49	L	H	CD1	TRP	V	76
R	-	N	ALA	A	49	L	H	H	TRP	V	76
R	-	N	ALA	A	49	L	H	HA	TRP	V	76
R	-	N	ALA	A	49	L	H	HB2	TRP	V	76
R	-	N	ALA	A	49	L	H	HB3	TRP	V	76
R	-	N	ALA	A	49	L	H	HD1	TRP	V	76
R	-	CA	ALA	A	49	L	H	C	GLY	V	72
R	-	CA	ALA	A	49	L	H	O	GLY	V	72
R	-	CA	ALA	A	49	L	H	HA	HIS	V	73
R	-	CA	ALA	A	49	L	H	N	TRP	V	76
R	-	CA	ALA	A	49	L	H	CA	TRP	V	76
R	-	CA	ALA	A	49	L	H	CB	TRP	V	76
R	-	CA	ALA	A	49	L	H	CG	TRP	V	76
R	-	CA	ALA	A	49	L	H	CD1	TRP	V	76
R	-	CA	ALA	A	49	L	H	H	TRP	V	76
R	-	CA	ALA	A	49	L	H	HA	TRP	V	76
R	-	CA	ALA	A	49	L	H	HB2	TRP	V	76
R	-	CA	ALA	A	49	L	H	HB3	TRP	V	76
R	-	CA	ALA	A	49	L	H	HD1	TRP	V	76
R	-	C	ALA	A	49	L	H	CB	TRP	V	76
R	-	C	ALA	A	49	L	H	CG	TRP	V	76
R	-	C	ALA	A	49	L	H	CD1	TRP	V	76
R	-	C	ALA	A	49	L	H	HB2	TRP	V	76
R	-	C	ALA	A	49	L	H	HB3	TRP	V	76
R	-	C	ALA	A	49	L	H	HD1	TRP	V	76
R	-	CB	ALA	A	49	L	H	O	GLY	V	72
R	-	CB	ALA	A	49	L	H	HA	HIS	V	73
R	-	CB	ALA	A	49	L	H	N	TRP	V	76
R	-	CB	ALA	A	49	L	H	CA	TRP	V	76
R	-	CB	ALA	A	49	L	H	C	TRP	V	76
R	-	CB	ALA	A	49	L	H	CB	TRP	V	76
R	-	CB	ALA	A	49	L	H	CG	TRP	V	76
R	-	CB	ALA	A	49	L	H	CD1	TRP	V	76
R	-	CB	ALA	A	49	L	H	CD2	TRP	V	76
R	-	CB	ALA	A	49	L	H	CE2	TRP	V	76
R	-	CB	ALA	A	49	L	H	CE3	TRP	V	76
R	-	CB	ALA	A	49	L	H	NE1	TRP	V	76
R	-	CB	ALA	A	49	L	H	H	TRP	V	76
R	-	CB	ALA	A	49	L	H	HA	TRP	V	76
R	-	CB	ALA	A	49	L	H	HB2	TRP	V	76
R	-	CB	ALA	A	49	L	H	HB3	TRP	V	76
R	-	CB	ALA	A	49	L	H	HD1	TRP	V	76
R	-	CB	ALA	A	49	L	H	HE3	TRP	V	76
R	-	O	ALA	A	49	L	H	CD1	TRP	V	76
R	-	O	ALA	A	49	L	H	HB2	TRP	V	76
R	-	O	ALA	A	49	L	H	HD1	TRP	V	76
R	-	N	PRO	A	50	L	H	HB2	TRP	V	76
R	-	CB	PRO	A	50	L	H	HE1	HIS	V	73
R	-	O	PRO	A	50	L	H	HE1	HIS	V	73
R	-	CG	PRO	A	50	L	H	HA3	GLY	V	72
R	-	CD	PRO	A	50	L	H	CA	GLY	V	72
R	-	CD	PRO	A	50	L	H	C	GLY	V	72
R	-	CD	PRO	A	50	L	H	O	GLY	V	72
R	-	CD	PRO	A	50	L	H	HA2	GLY	V	72
R	-	CD	PRO	A	50	L	H	HA3	GLY	V	72
R	-	CD	PRO	A	50	L	H	N	HIS	V	73
R	-	CD	PRO	A	50	L	H	ND1	HIS	V	73
R	-	CD	PRO	A	50	L	H	H	HIS	V	73
R	-	CD	PRO	A	50	L	H	HA	HIS	V	73
R	-	CD	PRO	A	50	L	H	HB2	TRP	V	76
R	-	CB	VAL	A	52	L	S	OG1	THR	V	42
R	-	CB	VAL	A	52	L	S	HG1	THR	V	42
R	-	CG1	VAL	A	52	L	S	HA	SER	V	41
R	-	CG1	VAL	A	52	L	S	H	THR	V	42
R	-	CG2	VAL	A	52	L	-	OE1	GLU	V	40
R	-	CG2	VAL	A	52	L	-	HG2	GLU	V	40
R	-	CG2	VAL	A	52	L	S	OG1	THR	V	42
R	-	CG2	VAL	A	52	L	S	HG1	THR	V	42
R	S	N	PHE	A	53	L	S	HB	THR	V	42
R	S	C	PHE	A	53	L	S	HB	THR	V	42
R	S	O	PHE	A	53	L	S	CB	THR	V	42
R	S	O	PHE	A	53	L	S	HB	THR	V	42
R	S	N	GLU	A	54	L	S	HH22	ARG	V	44
R	S	CA	GLU	A	54	L	S	NH1	ARG	V	44
R	S	CA	GLU	A	54	L	S	NH2	ARG	V	44
R	S	CA	GLU	A	54	L	S	CZ	ARG	V	44
R	S	CA	GLU	A	54	L	S	HH12	ARG	V	44
R	S	CA	GLU	A	54	L	S	HH21	ARG	V	44
R	S	CA	GLU	A	54	L	S	HH22	ARG	V	44
R	S	C	GLU	A	54	L	S	NH1	ARG	V	44
R	S	C	GLU	A	54	L	S	NH2	ARG	V	44
R	S	C	GLU	A	54	L	S	CZ	ARG	V	44
R	S	C	GLU	A	54	L	S	HH12	ARG	V	44
R	S	C	GLU	A	54	L	S	HH21	ARG	V	44
R	S	C	GLU	A	54	L	S	HH22	ARG	V	44
R	S	CB	GLU	A	54	L	S	NH1	ARG	V	44
R	S	CB	GLU	A	54	L	S	NH2	ARG	V	44
R	S	CB	GLU	A	54	L	S	CZ	ARG	V	44
R	S	CB	GLU	A	54	L	S	HH11	ARG	V	44
R	S	CB	GLU	A	54	L	S	HH12	ARG	V	44
R	S	CB	GLU	A	54	L	S	HH21	ARG	V	44
R	S	CB	GLU	A	54	L	S	HH22	ARG	V	44
R	S	CB	GLU	A	54	L	S	OE1	GLU	V	57
R	S	O	GLU	A	54	L	S	NH2	ARG	V	44
R	S	O	GLU	A	54	L	S	HH12	ARG	V	44
R	S	O	GLU	A	54	L	S	HH21	ARG	V	44
R	S	O	GLU	A	54	L	S	HH22	ARG	V	44
R	S	CG	GLU	A	54	L	S	HG21	THR	V	42
R	S	CG	GLU	A	54	L	S	HG22	THR	V	42
R	S	CG	GLU	A	54	L	S	CD	GLU	V	57
R	S	CG	GLU	A	54	L	S	OE1	GLU	V	57
R	S	CD	GLU	A	54	L	S	HG21	THR	V	42
R	S	CD	GLU	A	54	L	S	CG	GLU	V	57
R	S	CD	GLU	A	54	L	S	CD	GLU	V	57
R	S	CD	GLU	A	54	L	S	OE1	GLU	V	57
R	S	CD	GLU	A	54	L	S	OE2	GLU	V	57
R	S	OE1	GLU	A	54	L	S	CG2	THR	V	42
R	S	OE1	GLU	A	54	L	S	HG21	THR	V	42
R	S	OE1	GLU	A	54	L	S	CG	GLU	V	57
R	S	OE1	GLU	A	54	L	S	CD	GLU	V	57
R	S	OE1	GLU	A	54	L	S	OE1	GLU	V	57
R	S	OE1	GLU	A	54	L	S	OE2	GLU	V	57
R	S	OE1	GLU	A	54	L	S	HG2	GLU	V	57
R	S	OE1	GLU	A	54	L	H	HZ2	TRP	V	76
R	S	OE1	GLU	A	54	L	H	HE1	TRP	V	76
R	S	OE2	GLU	A	54	L	S	HH11	ARG	V	44
R	S	OE2	GLU	A	54	L	S	CD	GLU	V	57
R	S	OE2	GLU	A	54	L	S	OE1	GLU	V	57
R	S	OE2	GLU	A	54	L	S	OE2	GLU	V	57
R	S	N	LYS	A	55	L	S	NE	ARG	V	44
R	S	N	LYS	A	55	L	S	NH1	ARG	V	44
R	S	N	LYS	A	55	L	S	NH2	ARG	V	44
R	S	N	LYS	A	55	L	S	CZ	ARG	V	44
R	S	N	LYS	A	55	L	S	HE	ARG	V	44
R	S	N	LYS	A	55	L	S	HH11	ARG	V	44
R	S	N	LYS	A	55	L	S	HH12	ARG	V	44
R	S	N	LYS	A	55	L	S	HH21	ARG	V	44
R	S	N	LYS	A	55	L	S	HH22	ARG	V	44
R	S	CA	LYS	A	55	L	S	NE	ARG	V	44
R	S	CA	LYS	A	55	L	S	NH1	ARG	V	44
R	S	CA	LYS	A	55	L	S	NH2	ARG	V	44
R	S	CA	LYS	A	55	L	S	CZ	ARG	V	44
R	S	CA	LYS	A	55	L	S	HH12	ARG	V	44
R	S	CA	LYS	A	55	L	S	HH21	ARG	V	44
R	S	CA	LYS	A	55	L	S	HH22	ARG	V	44
R	S	C	LYS	A	55	L	S	NE	ARG	V	44
R	S	C	LYS	A	55	L	S	NH1	ARG	V	44
R	S	C	LYS	A	55	L	S	NH2	ARG	V	44
R	S	C	LYS	A	55	L	S	CZ	ARG	V	44
R	S	C	LYS	A	55	L	S	HH11	ARG	V	44
R	S	C	LYS	A	55	L	S	HH12	ARG	V	44
R	S	C	LYS	A	55	L	S	HH21	ARG	V	44
R	S	C	LYS	A	55	L	S	HH22	ARG	V	44
R	S	CB	LYS	A	55	L	S	NH2	ARG	V	44
R	S	CB	LYS	A	55	L	S	CZ	ARG	V	44
R	S	CB	LYS	A	55	L	S	HH21	ARG	V	44
R	S	CB	LYS	A	55	L	S	HH22	ARG	V	44
R	S	O	LYS	A	55	L	S	CD	ARG	V	44
R	S	O	LYS	A	55	L	S	NE	ARG	V	44
R	S	O	LYS	A	55	L	S	NH1	ARG	V	44
R	S	O	LYS	A	55	L	S	NH2	ARG	V	44
R	S	O	LYS	A	55	L	S	CZ	ARG	V	44
R	S	O	LYS	A	55	L	S	HD2	ARG	V	44
R	S	O	LYS	A	55	L	S	HE	ARG	V	44
R	S	O	LYS	A	55	L	S	HH11	ARG	V	44
R	S	O	LYS	A	55	L	S	HH12	ARG	V	44
R	S	O	LYS	A	55	L	S	HH21	ARG	V	44
R	S	O	LYS	A	55	L	S	HH22	ARG	V	44
R	S	CG	LYS	A	55	L	S	HH22	ARG	V	44
R	S	N	TYR	A	56	L	S	NH1	ARG	V	44
R	S	N	TYR	A	56	L	S	NH2	ARG	V	44
R	S	N	TYR	A	56	L	S	CZ	ARG	V	44
R	S	N	TYR	A	56	L	S	HH11	ARG	V	44
R	S	N	TYR	A	56	L	S	HH12	ARG	V	44
R	S	N	TYR	A	56	L	S	HH22	ARG	V	44
R	S	CA	TYR	A	56	L	S	HH12	ARG	V	44
R	S	CB	TYR	A	56	L	S	HH12	ARG	V	44
R	S	CG	TYR	A	56	L	S	NH1	ARG	V	44
R	S	CG	TYR	A	56	L	S	HH11	ARG	V	44
R	S	CG	TYR	A	56	L	S	HH12	ARG	V	44
R	S	CD1	TYR	A	56	L	S	HH11	ARG	V	44
R	S	CD1	TYR	A	56	L	S	HH12	ARG	V	44
R	S	CD2	TYR	A	56	L	S	NH1	ARG	V	44
R	S	CD2	TYR	A	56	L	S	HH11	ARG	V	44
R	S	CD2	TYR	A	56	L	S	HH12	ARG	V	44
R	S	CE1	TYR	A	56	L	S	HH11	ARG	V	44
R	S	CE1	TYR	A	56	L	S	HH12	ARG	V	44
R	S	CE2	TYR	A	56	L	S	NH1	ARG	V	44
R	S	CE2	TYR	A	56	L	S	HH11	ARG	V	44
R	S	CE2	TYR	A	56	L	S	HH12	ARG	V	44
R	S	CZ	TYR	A	56	L	S	NH1	ARG	V	44
R	S	CZ	TYR	A	56	L	S	HH11	ARG	V	44
R	S	CZ	TYR	A	56	L	S	HH12	ARG	V	44
R	S	N	THR	A	57	L	-	HZ1	LYS	V	3
R	S	C	THR	A	57	L	-	HZ2	LYS	V	3
R	S	O	THR	A	57	L	-	NZ	LYS	V	3
R	S	O	THR	A	57	L	-	HZ1	LYS	V	3
R	S	O	THR	A	57	L	-	HZ2	LYS	V	3
R	-	NE2	GLN	A	77	L	H	HG3	GLN	V	69
R	-	OE1	GLN	A	77	L	H	HG3	GLN	V	69
R	H	OH	TYR	A	80	L	-	CB	GLU	V	40
R	H	OH	TYR	A	80	L	-	CG	GLU	V	40
R	H	OH	TYR	A	80	L	-	CD	GLU	V	40
R	H	OH	TYR	A	80	L	-	OE1	GLU	V	40
R	H	OH	TYR	A	80	L	-	HB3	GLU	V	40
R	H	OH	TYR	A	80	L	-	HG2	GLU	V	40
R	H	OH	TYR	A	80	L	H	NE2	GLN	V	69
R	H	OH	TYR	A	80	L	H	HE21	GLN	V	69
R	H	OH	TYR	A	80	L	H	HE22	GLN	V	69
R	H	CZ	TYR	A	80	L	-	HB3	GLU	V	40

- 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