IID

P58181_Q8NGS7.1 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	H	GLN	A	100	L	H	SER	V	95
R	H	TYR	A	102	L	-	THR	V	10
R	H	TYR	A	102	L	-	THR	V	8
R	H	PHE	A	103	L	-	THR	V	10
R	H	PHE	A	103	L	-	THR	V	8
R	H	PHE	A	103	L	-	SER	V	9
R	H	PHE	A	103	L	H	PHE	V	94
R	H	LEU	A	106	L	-	THR	V	10
R	H	PHE	A	107	L	-	THR	V	10
R	H	PHE	A	107	L	S	GLU	V	11
R	S	GLU	A	11	L	H	VAL	V	157
R	H	PHE	A	28	L	H	TYR	V	35
R	H	PHE	A	28	L	H	SER	V	75
R	H	PHE	A	28	L	H	PRO	V	79
R	H	HIS	A	312	L	H	LYS	V	22
R	H	LEU	A	32	L	H	TYR	V	35
R	H	LEU	A	32	L	H	PRO	V	79
R	H	TYR	A	35	L	H	ALA	V	83
R	H	TYR	A	35	L	S	LYS	V	91
R	H	VAL	A	36	L	H	ALA	V	83
R	H	VAL	A	36	L	-	LEU	V	86
R	H	LEU	A	39	L	H	ALA	V	83
R	H	LEU	A	39	L	-	ALA	V	87
R	H	MET	A	40	L	-	LEU	V	86
R	H	MET	A	40	L	-	ALA	V	87
R	H	ALA	A	43	L	-	VAL	V	88
R	H	ALA	A	43	L	-	LYS	V	89
R	H	ILE	A	44	L	-	VAL	V	88
R	H	THR	A	46	L	-	LYS	V	89
R	H	VAL	A	47	L	-	VAL	V	88
R	H	VAL	A	47	L	-	LYS	V	89
R	H	VAL	A	68	L	-	LYS	V	89
R	H	VAL	A	68	L	S	LYS	V	91
R	H	VAL	A	71	L	S	LYS	V	91
R	H	SER	A	72	L	S	GLU	V	11
R	H	SER	A	72	L	S	LYS	V	91
R	H	SER	A	72	L	S	SER	V	93
R	H	ALA	A	75	L	S	LYS	V	91
R	H	ALA	A	75	L	S	VAL	V	92
R	H	ALA	A	75	L	S	SER	V	93
R	H	ALA	A	75	L	H	GLY	V	96
R	H	VAL	A	76	L	S	SER	V	93
R	H	VAL	A	76	L	H	SER	V	95
R	H	VAL	A	76	L	H	GLY	V	96
R	H	ILE	A	77	L	S	SER	V	93
R	H	PRO	A	79	L	H	LEU	V	80
R	H	PRO	A	79	L	S	VAL	V	92
R	H	PRO	A	79	L	H	GLY	V	96
R	H	GLU	A	80	L	H	GLY	V	96
R	H	GLU	A	80	L	H	VAL	V	99
R	H	LEU	A	82	L	H	PRO	V	79
R	H	VAL	A	83	L	H	ILE	V	103
R	H	VAL	A	83	L	H	SER	V	76
R	H	VAL	A	83	L	H	VAL	V	99
R	H	SER	A	86	L	H	VAL	V	71
R	H	SER	A	86	L	H	CYS	V	72
R	H	SER	A	86	L	H	SER	V	75
R	H	SER	A	86	L	H	SER	V	76
R	-	THR	A	87	L	H	MET	V	107
R	-	THR	A	87	L	H	PHE	V	68
R	-	THR	A	87	L	H	CYS	V	72
R	-	GLU	A	88	L	H	PHE	V	68
R	S	THR	A	90	L	H	ILE	V	103
R	S	THR	A	90	L	H	VAL	V	99
R	S	MET	A	91	L	H	PHE	V	102
R	S	MET	A	91	L	H	LEU	V	153
R	S	ILE	A	92	L	H	SER	V	95
R	S	ILE	A	92	L	H	VAL	V	99
R	S	SER	A	93	L	H	THR	V	160
R	S	SER	A	93	L	H	MET	V	164
R	H	VAL	A	95	L	H	MET	V	164
R	H	GLY	A	96	L	H	MET	V	164
R	H	GLY	A	96	L	H	SER	V	95
R	H	ALA	A	99	L	H	PHE	V	94
R	H	ALA	A	99	L	H	SER	V	95

- 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

P58181_Q8NGS7.1 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	S	CD	GLU	A	11	L	H	HG22	VAL	V	157
R	S	OE1	GLU	A	11	L	H	HG22	VAL	V	157
R	S	OE2	GLU	A	11	L	H	CG2	VAL	V	157
R	S	OE2	GLU	A	11	L	H	HG13	VAL	V	157
R	S	OE2	GLU	A	11	L	H	HG21	VAL	V	157
R	S	OE2	GLU	A	11	L	H	HG22	VAL	V	157
R	S	OE2	GLU	A	11	L	H	HG23	VAL	V	157
R	H	CD1	PHE	A	28	L	H	OH	TYR	V	35
R	H	CD1	PHE	A	28	L	H	HH	TYR	V	35
R	H	CD2	PHE	A	28	L	H	HB3	SER	V	75
R	H	CE1	PHE	A	28	L	H	OH	TYR	V	35
R	H	CE1	PHE	A	28	L	H	CZ	TYR	V	35
R	H	CE1	PHE	A	28	L	H	HE1	TYR	V	35
R	H	CE1	PHE	A	28	L	H	HH	TYR	V	35
R	H	CE1	PHE	A	28	L	H	HB3	SER	V	75
R	H	CE1	PHE	A	28	L	H	CG	PRO	V	79
R	H	CE1	PHE	A	28	L	H	HG2	PRO	V	79
R	H	CE1	PHE	A	28	L	H	HG3	PRO	V	79
R	H	CE2	PHE	A	28	L	H	CB	SER	V	75
R	H	CE2	PHE	A	28	L	H	O	SER	V	75
R	H	CE2	PHE	A	28	L	H	HA	SER	V	75
R	H	CE2	PHE	A	28	L	H	HB3	SER	V	75
R	H	CE2	PHE	A	28	L	H	HG2	PRO	V	79
R	H	CZ	PHE	A	28	L	H	OH	TYR	V	35
R	H	CZ	PHE	A	28	L	H	HH	TYR	V	35
R	H	CZ	PHE	A	28	L	H	CA	SER	V	75
R	H	CZ	PHE	A	28	L	H	C	SER	V	75
R	H	CZ	PHE	A	28	L	H	CB	SER	V	75
R	H	CZ	PHE	A	28	L	H	O	SER	V	75
R	H	CZ	PHE	A	28	L	H	HA	SER	V	75
R	H	CZ	PHE	A	28	L	H	HB3	SER	V	75
R	H	CZ	PHE	A	28	L	H	CG	PRO	V	79
R	H	CZ	PHE	A	28	L	H	HG2	PRO	V	79
R	H	CZ	PHE	A	28	L	H	HG3	PRO	V	79
R	H	CB	LEU	A	32	L	H	HB3	PRO	V	79
R	H	CG	LEU	A	32	L	H	CB	PRO	V	79
R	H	CG	LEU	A	32	L	H	HB3	PRO	V	79
R	H	CD1	LEU	A	32	L	H	CA	PRO	V	79
R	H	CD1	LEU	A	32	L	H	CB	PRO	V	79
R	H	CD1	LEU	A	32	L	H	O	PRO	V	79
R	H	CD1	LEU	A	32	L	H	CG	PRO	V	79
R	H	CD1	LEU	A	32	L	H	HA	PRO	V	79
R	H	CD1	LEU	A	32	L	H	HB2	PRO	V	79
R	H	CD1	LEU	A	32	L	H	HB3	PRO	V	79
R	H	CD1	LEU	A	32	L	H	HG3	PRO	V	79
R	H	CD2	LEU	A	32	L	H	HE1	TYR	V	35
R	H	CD2	LEU	A	32	L	H	CB	PRO	V	79
R	H	CD2	LEU	A	32	L	H	CG	PRO	V	79
R	H	CD2	LEU	A	32	L	H	HA	PRO	V	79
R	H	CD2	LEU	A	32	L	H	HB3	PRO	V	79
R	H	CD2	LEU	A	32	L	H	HG3	PRO	V	79
R	H	CD1	TYR	A	35	L	H	HB1	ALA	V	83
R	H	CD1	TYR	A	35	L	H	HB3	ALA	V	83
R	H	CE1	TYR	A	35	L	H	CB	ALA	V	83
R	H	CE1	TYR	A	35	L	H	HB1	ALA	V	83
R	H	CE1	TYR	A	35	L	H	HB2	ALA	V	83
R	H	CE1	TYR	A	35	L	H	HB3	ALA	V	83
R	H	OH	TYR	A	35	L	S	O	LYS	V	91
R	H	CB	VAL	A	36	L	-	HD12	LEU	V	86
R	H	CB	VAL	A	36	L	-	HD13	LEU	V	86
R	H	CG1	VAL	A	36	L	H	HA	ALA	V	83
R	H	CG1	VAL	A	36	L	-	CB	LEU	V	86
R	H	CG1	VAL	A	36	L	-	CG	LEU	V	86
R	H	CG1	VAL	A	36	L	-	CD1	LEU	V	86
R	H	CG1	VAL	A	36	L	-	HB2	LEU	V	86
R	H	CG1	VAL	A	36	L	-	HB3	LEU	V	86
R	H	CG1	VAL	A	36	L	-	HD11	LEU	V	86
R	H	CG1	VAL	A	36	L	-	HD12	LEU	V	86
R	H	CG1	VAL	A	36	L	-	HD13	LEU	V	86
R	H	CG2	VAL	A	36	L	H	CB	ALA	V	83
R	H	CG2	VAL	A	36	L	H	HA	ALA	V	83
R	H	CG2	VAL	A	36	L	H	HB3	ALA	V	83
R	H	CG2	VAL	A	36	L	-	HD12	LEU	V	86
R	H	CB	LEU	A	39	L	-	HB3	ALA	V	87
R	H	CD1	LEU	A	39	L	H	HB1	ALA	V	83
R	H	CD1	LEU	A	39	L	-	HB3	ALA	V	87
R	H	CA	MET	A	40	L	-	HA	ALA	V	87
R	H	SD	MET	A	40	L	-	HB3	LEU	V	86
R	H	CA	ALA	A	43	L	-	HB	VAL	V	88
R	H	CA	ALA	A	43	L	-	H	LYS	V	89
R	H	CA	ALA	A	43	L	-	HB2	LYS	V	89
R	H	CA	ALA	A	43	L	-	HG2	LYS	V	89
R	H	CA	ALA	A	43	L	-	HD2	LYS	V	89
R	H	C	ALA	A	43	L	-	HB	VAL	V	88
R	H	CB	ALA	A	43	L	-	N	VAL	V	88
R	H	CB	ALA	A	43	L	-	CB	VAL	V	88
R	H	CB	ALA	A	43	L	-	H	VAL	V	88
R	H	CB	ALA	A	43	L	-	HB	VAL	V	88
R	H	CB	ALA	A	43	L	-	N	LYS	V	89
R	H	CB	ALA	A	43	L	-	H	LYS	V	89
R	H	CB	ALA	A	43	L	-	HB2	LYS	V	89
R	H	CB	ALA	A	43	L	-	HG2	LYS	V	89
R	H	O	ALA	A	43	L	-	HB	VAL	V	88
R	H	O	ALA	A	43	L	-	HG12	VAL	V	88
R	H	N	ILE	A	44	L	-	HB	VAL	V	88
R	H	N	ILE	A	44	L	-	HG22	VAL	V	88
R	H	CA	ILE	A	44	L	-	HG22	VAL	V	88
R	H	CG1	ILE	A	44	L	-	HG22	VAL	V	88
R	H	CA	THR	A	46	L	-	HE3	LYS	V	89
R	H	CA	THR	A	46	L	-	HZ2	LYS	V	89
R	H	C	THR	A	46	L	-	HE3	LYS	V	89
R	H	CB	THR	A	46	L	-	CE	LYS	V	89
R	H	CB	THR	A	46	L	-	NZ	LYS	V	89
R	H	CB	THR	A	46	L	-	HD2	LYS	V	89
R	H	CB	THR	A	46	L	-	HE3	LYS	V	89
R	H	CB	THR	A	46	L	-	HZ1	LYS	V	89
R	H	CB	THR	A	46	L	-	HZ2	LYS	V	89
R	H	CB	THR	A	46	L	-	HZ3	LYS	V	89
R	H	CG2	THR	A	46	L	-	CD	LYS	V	89
R	H	CG2	THR	A	46	L	-	CE	LYS	V	89
R	H	CG2	THR	A	46	L	-	NZ	LYS	V	89
R	H	CG2	THR	A	46	L	-	HD2	LYS	V	89
R	H	CG2	THR	A	46	L	-	HE2	LYS	V	89
R	H	CG2	THR	A	46	L	-	HE3	LYS	V	89
R	H	CG2	THR	A	46	L	-	HZ1	LYS	V	89
R	H	CG2	THR	A	46	L	-	HZ2	LYS	V	89
R	H	CG2	THR	A	46	L	-	HZ3	LYS	V	89
R	H	OG1	THR	A	46	L	-	NZ	LYS	V	89
R	H	OG1	THR	A	46	L	-	HD2	LYS	V	89
R	H	OG1	THR	A	46	L	-	HE3	LYS	V	89
R	H	OG1	THR	A	46	L	-	HZ1	LYS	V	89
R	H	OG1	THR	A	46	L	-	HZ2	LYS	V	89
R	H	OG1	THR	A	46	L	-	HZ3	LYS	V	89
R	H	N	VAL	A	47	L	-	HE3	LYS	V	89
R	H	CB	VAL	A	47	L	-	CG1	VAL	V	88
R	H	CB	VAL	A	47	L	-	HG12	VAL	V	88
R	H	CG1	VAL	A	47	L	-	HG12	VAL	V	88
R	H	CG2	VAL	A	47	L	-	CB	VAL	V	88
R	H	CG2	VAL	A	47	L	-	CG1	VAL	V	88
R	H	CG2	VAL	A	47	L	-	HB	VAL	V	88
R	H	CG2	VAL	A	47	L	-	HG11	VAL	V	88
R	H	CG2	VAL	A	47	L	-	HG12	VAL	V	88
R	H	CG2	VAL	A	47	L	-	HG13	VAL	V	88
R	H	CG2	VAL	A	47	L	-	HG22	VAL	V	88
R	H	CA	VAL	A	68	L	S	HZ3	LYS	V	91
R	H	C	VAL	A	68	L	S	HZ3	LYS	V	91
R	H	CB	VAL	A	68	L	S	HZ2	LYS	V	91
R	H	O	VAL	A	68	L	S	NZ	LYS	V	91
R	H	O	VAL	A	68	L	S	HZ3	LYS	V	91
R	H	CG1	VAL	A	68	L	S	NZ	LYS	V	91
R	H	CG1	VAL	A	68	L	S	HZ1	LYS	V	91
R	H	CG1	VAL	A	68	L	S	HZ2	LYS	V	91
R	H	CG1	VAL	A	68	L	S	HZ3	LYS	V	91
R	H	CG2	VAL	A	68	L	-	NZ	LYS	V	89
R	H	CG2	VAL	A	68	L	-	HZ1	LYS	V	89
R	H	CG2	VAL	A	68	L	-	HZ2	LYS	V	89
R	H	CG2	VAL	A	68	L	-	HZ3	LYS	V	89
R	H	CG2	VAL	A	68	L	S	HZ2	LYS	V	91
R	H	CB	VAL	A	71	L	S	HD2	LYS	V	91
R	H	CG1	VAL	A	71	L	S	CB	LYS	V	91
R	H	CG1	VAL	A	71	L	S	CG	LYS	V	91
R	H	CG1	VAL	A	71	L	S	CD	LYS	V	91
R	H	CG1	VAL	A	71	L	S	HB2	LYS	V	91
R	H	CG1	VAL	A	71	L	S	HG3	LYS	V	91
R	H	CG1	VAL	A	71	L	S	HD2	LYS	V	91
R	H	CG1	VAL	A	71	L	S	HD3	LYS	V	91
R	H	N	SER	A	72	L	S	OE1	GLU	V	11
R	H	CA	SER	A	72	L	S	OE1	GLU	V	11
R	H	CA	SER	A	72	L	S	HD3	LYS	V	91
R	H	CB	SER	A	72	L	S	CD	GLU	V	11
R	H	CB	SER	A	72	L	S	OE1	GLU	V	11
R	H	CB	SER	A	72	L	S	HG2	GLU	V	11
R	H	CB	SER	A	72	L	S	HZ3	LYS	V	91
R	H	O	SER	A	72	L	S	HB3	SER	V	93
R	H	OG	SER	A	72	L	S	CG	GLU	V	11
R	H	OG	SER	A	72	L	S	CD	GLU	V	11
R	H	OG	SER	A	72	L	S	OE1	GLU	V	11
R	H	OG	SER	A	72	L	S	OE2	GLU	V	11
R	H	OG	SER	A	72	L	S	HG2	GLU	V	11
R	H	OG	SER	A	72	L	S	CD	LYS	V	91
R	H	OG	SER	A	72	L	S	NZ	LYS	V	91
R	H	OG	SER	A	72	L	S	HD3	LYS	V	91
R	H	OG	SER	A	72	L	S	HZ1	LYS	V	91
R	H	OG	SER	A	72	L	S	HZ2	LYS	V	91
R	H	OG	SER	A	72	L	S	HZ3	LYS	V	91
R	H	CA	ALA	A	75	L	S	HA	VAL	V	92
R	H	CA	ALA	A	75	L	S	H	SER	V	93
R	H	CA	ALA	A	75	L	S	HB3	SER	V	93
R	H	C	ALA	A	75	L	S	N	SER	V	93
R	H	C	ALA	A	75	L	S	CB	SER	V	93
R	H	C	ALA	A	75	L	S	OG	SER	V	93
R	H	C	ALA	A	75	L	S	H	SER	V	93
R	H	C	ALA	A	75	L	S	HB3	SER	V	93
R	H	C	ALA	A	75	L	S	HG	SER	V	93
R	H	CB	ALA	A	75	L	S	C	LYS	V	91
R	H	CB	ALA	A	75	L	S	O	LYS	V	91
R	H	CB	ALA	A	75	L	S	HB3	LYS	V	91
R	H	CB	ALA	A	75	L	S	CA	VAL	V	92
R	H	CB	ALA	A	75	L	S	C	VAL	V	92
R	H	CB	ALA	A	75	L	S	HA	VAL	V	92
R	H	CB	ALA	A	75	L	S	N	SER	V	93
R	H	CB	ALA	A	75	L	S	H	SER	V	93
R	H	CB	ALA	A	75	L	S	HB3	SER	V	93
R	H	O	ALA	A	75	L	S	HA	VAL	V	92
R	H	O	ALA	A	75	L	S	HG21	VAL	V	92
R	H	O	ALA	A	75	L	S	N	SER	V	93
R	H	O	ALA	A	75	L	S	CA	SER	V	93
R	H	O	ALA	A	75	L	S	CB	SER	V	93
R	H	O	ALA	A	75	L	S	OG	SER	V	93
R	H	O	ALA	A	75	L	S	H	SER	V	93
R	H	O	ALA	A	75	L	S	HB3	SER	V	93
R	H	O	ALA	A	75	L	S	HG	SER	V	93
R	H	O	ALA	A	75	L	H	HA3	GLY	V	96
R	H	N	VAL	A	76	L	S	CB	SER	V	93
R	H	N	VAL	A	76	L	S	OG	SER	V	93
R	H	N	VAL	A	76	L	S	H	SER	V	93
R	H	N	VAL	A	76	L	S	HB2	SER	V	93
R	H	N	VAL	A	76	L	S	HB3	SER	V	93
R	H	N	VAL	A	76	L	S	HG	SER	V	93
R	H	CA	VAL	A	76	L	S	CB	SER	V	93
R	H	CA	VAL	A	76	L	S	OG	SER	V	93
R	H	CA	VAL	A	76	L	S	HB2	SER	V	93
R	H	CA	VAL	A	76	L	S	HB3	SER	V	93
R	H	CA	VAL	A	76	L	S	HG	SER	V	93
R	H	C	VAL	A	76	L	S	OG	SER	V	93
R	H	C	VAL	A	76	L	S	HB3	SER	V	93
R	H	C	VAL	A	76	L	S	HG	SER	V	93
R	H	CB	VAL	A	76	L	S	CB	SER	V	93
R	H	CB	VAL	A	76	L	S	OG	SER	V	93
R	H	CB	VAL	A	76	L	S	HB2	SER	V	93
R	H	CB	VAL	A	76	L	S	HB3	SER	V	93
R	H	CB	VAL	A	76	L	S	HG	SER	V	93
R	H	O	VAL	A	76	L	S	OG	SER	V	93
R	H	O	VAL	A	76	L	S	HG	SER	V	93
R	H	O	VAL	A	76	L	H	HB2	SER	V	95
R	H	O	VAL	A	76	L	H	H	GLY	V	96
R	H	CG1	VAL	A	76	L	S	HB2	SER	V	93
R	H	CG1	VAL	A	76	L	S	HG	SER	V	93
R	H	CG1	VAL	A	76	L	H	HB2	SER	V	95
R	H	CG2	VAL	A	76	L	S	CB	SER	V	93
R	H	CG2	VAL	A	76	L	S	OG	SER	V	93
R	H	CG2	VAL	A	76	L	S	HA	SER	V	93
R	H	CG2	VAL	A	76	L	S	HB2	SER	V	93
R	H	CG2	VAL	A	76	L	S	HB3	SER	V	93
R	H	CG2	VAL	A	76	L	S	HG	SER	V	93
R	H	N	ILE	A	77	L	S	HG	SER	V	93
R	H	CB	PRO	A	79	L	H	CA	GLY	V	96
R	H	CB	PRO	A	79	L	H	HA2	GLY	V	96
R	H	CB	PRO	A	79	L	H	HA3	GLY	V	96
R	H	CG	PRO	A	79	L	H	HD13	LEU	V	80
R	H	CG	PRO	A	79	L	S	HG21	VAL	V	92
R	H	CG	PRO	A	79	L	H	HA3	GLY	V	96
R	H	N	GLU	A	80	L	H	HA2	GLY	V	96
R	H	CA	GLU	A	80	L	H	HG13	VAL	V	99
R	H	CB	GLU	A	80	L	H	HG13	VAL	V	99
R	H	CB	GLU	A	80	L	H	HG23	VAL	V	99
R	H	O	GLU	A	80	L	H	HG13	VAL	V	99
R	H	CG	GLU	A	80	L	H	CG2	VAL	V	99
R	H	CG	GLU	A	80	L	H	HG13	VAL	V	99
R	H	CG	GLU	A	80	L	H	HG23	VAL	V	99
R	H	CD	GLU	A	80	L	H	CB	VAL	V	99
R	H	CD	GLU	A	80	L	H	CG1	VAL	V	99
R	H	CD	GLU	A	80	L	H	CG2	VAL	V	99
R	H	CD	GLU	A	80	L	H	HB	VAL	V	99
R	H	CD	GLU	A	80	L	H	HG11	VAL	V	99
R	H	CD	GLU	A	80	L	H	HG12	VAL	V	99
R	H	CD	GLU	A	80	L	H	HG13	VAL	V	99
R	H	CD	GLU	A	80	L	H	HG21	VAL	V	99
R	H	CD	GLU	A	80	L	H	HG22	VAL	V	99
R	H	CD	GLU	A	80	L	H	HG23	VAL	V	99
R	H	OE1	GLU	A	80	L	H	CB	VAL	V	99
R	H	OE1	GLU	A	80	L	H	CG1	VAL	V	99
R	H	OE1	GLU	A	80	L	H	CG2	VAL	V	99
R	H	OE1	GLU	A	80	L	H	HG11	VAL	V	99
R	H	OE1	GLU	A	80	L	H	HG12	VAL	V	99
R	H	OE1	GLU	A	80	L	H	HG13	VAL	V	99
R	H	OE1	GLU	A	80	L	H	HG21	VAL	V	99
R	H	OE1	GLU	A	80	L	H	HG22	VAL	V	99
R	H	OE1	GLU	A	80	L	H	HG23	VAL	V	99
R	H	OE2	GLU	A	80	L	H	HA2	GLY	V	96
R	H	OE2	GLU	A	80	L	H	CA	VAL	V	99
R	H	OE2	GLU	A	80	L	H	CB	VAL	V	99
R	H	OE2	GLU	A	80	L	H	CG1	VAL	V	99
R	H	OE2	GLU	A	80	L	H	CG2	VAL	V	99
R	H	OE2	GLU	A	80	L	H	HA	VAL	V	99
R	H	OE2	GLU	A	80	L	H	HB	VAL	V	99
R	H	OE2	GLU	A	80	L	H	HG11	VAL	V	99
R	H	OE2	GLU	A	80	L	H	HG12	VAL	V	99
R	H	OE2	GLU	A	80	L	H	HG13	VAL	V	99
R	H	OE2	GLU	A	80	L	H	HG21	VAL	V	99
R	H	OE2	GLU	A	80	L	H	HG22	VAL	V	99
R	H	OE2	GLU	A	80	L	H	HG23	VAL	V	99
R	H	CD1	LEU	A	82	L	H	HB2	PRO	V	79
R	H	CD1	LEU	A	82	L	H	HB3	PRO	V	79
R	H	CA	VAL	A	83	L	H	CD1	ILE	V	103
R	H	CA	VAL	A	83	L	H	HD11	ILE	V	103
R	H	CA	VAL	A	83	L	H	HD13	ILE	V	103
R	H	CB	VAL	A	83	L	H	CG1	VAL	V	99
R	H	CB	VAL	A	83	L	H	HG11	VAL	V	99
R	H	CB	VAL	A	83	L	H	HG13	VAL	V	99
R	H	CB	VAL	A	83	L	H	CD1	ILE	V	103
R	H	CB	VAL	A	83	L	H	HD11	ILE	V	103
R	H	CB	VAL	A	83	L	H	HD12	ILE	V	103
R	H	CB	VAL	A	83	L	H	HD13	ILE	V	103
R	H	CG1	VAL	A	83	L	H	CG1	VAL	V	99
R	H	CG1	VAL	A	83	L	H	HG11	VAL	V	99
R	H	CG1	VAL	A	83	L	H	HG12	VAL	V	99
R	H	CG1	VAL	A	83	L	H	HG13	VAL	V	99
R	H	CG1	VAL	A	83	L	H	CG1	ILE	V	103
R	H	CG1	VAL	A	83	L	H	CD1	ILE	V	103
R	H	CG1	VAL	A	83	L	H	HG12	ILE	V	103
R	H	CG1	VAL	A	83	L	H	HG13	ILE	V	103
R	H	CG1	VAL	A	83	L	H	HD11	ILE	V	103
R	H	CG1	VAL	A	83	L	H	HD12	ILE	V	103
R	H	CG1	VAL	A	83	L	H	HD13	ILE	V	103
R	H	CG2	VAL	A	83	L	H	CB	SER	V	76
R	H	CG2	VAL	A	83	L	H	HA	SER	V	76
R	H	CG2	VAL	A	83	L	H	HB2	SER	V	76
R	H	CG2	VAL	A	83	L	H	HB3	SER	V	76
R	H	CG2	VAL	A	83	L	H	CG1	VAL	V	99
R	H	CG2	VAL	A	83	L	H	HG11	VAL	V	99
R	H	CG2	VAL	A	83	L	H	HG13	VAL	V	99
R	H	CG2	VAL	A	83	L	H	CD1	ILE	V	103
R	H	CG2	VAL	A	83	L	H	HD11	ILE	V	103
R	H	CG2	VAL	A	83	L	H	HD12	ILE	V	103
R	H	CG2	VAL	A	83	L	H	HD13	ILE	V	103
R	H	CA	SER	A	86	L	H	HB2	SER	V	75
R	H	CA	SER	A	86	L	H	HB3	SER	V	75
R	H	C	SER	A	86	L	H	SG	CYS	V	72
R	H	C	SER	A	86	L	H	HA	CYS	V	72
R	H	CB	SER	A	86	L	H	HA	CYS	V	72
R	H	CB	SER	A	86	L	H	CB	SER	V	75
R	H	CB	SER	A	86	L	H	OG	SER	V	75
R	H	CB	SER	A	86	L	H	HB2	SER	V	75
R	H	CB	SER	A	86	L	H	HB3	SER	V	75
R	H	O	SER	A	86	L	H	HG11	VAL	V	71
R	H	O	SER	A	86	L	H	CA	CYS	V	72
R	H	O	SER	A	86	L	H	CB	CYS	V	72
R	H	O	SER	A	86	L	H	SG	CYS	V	72
R	H	O	SER	A	86	L	H	HA	CYS	V	72
R	H	O	SER	A	86	L	H	HG	CYS	V	72
R	H	OG	SER	A	86	L	H	O	CYS	V	72
R	H	OG	SER	A	86	L	H	HA	CYS	V	72
R	H	OG	SER	A	86	L	H	CB	SER	V	75
R	H	OG	SER	A	86	L	H	HB2	SER	V	75
R	H	OG	SER	A	86	L	H	HB3	SER	V	75
R	H	OG	SER	A	86	L	H	HB3	SER	V	76
R	-	CA	THR	A	87	L	H	HZ	PHE	V	68
R	-	CA	THR	A	87	L	H	SG	CYS	V	72
R	-	C	THR	A	87	L	H	HZ	PHE	V	68
R	-	CB	THR	A	87	L	H	SG	CYS	V	72
R	-	CB	THR	A	87	L	H	HB2	CYS	V	72
R	-	CG2	THR	A	87	L	H	CB	CYS	V	72
R	-	CG2	THR	A	87	L	H	SG	CYS	V	72
R	-	CG2	THR	A	87	L	H	HA	CYS	V	72
R	-	CG2	THR	A	87	L	H	HB2	CYS	V	72
R	-	CG2	THR	A	87	L	H	CE	MET	V	107
R	-	CG2	THR	A	87	L	H	HE2	MET	V	107
R	-	CG2	THR	A	87	L	H	HE3	MET	V	107
R	-	N	GLU	A	88	L	H	CZ	PHE	V	68
R	-	N	GLU	A	88	L	H	HZ	PHE	V	68
R	-	CA	GLU	A	88	L	H	HZ	PHE	V	68
R	-	CB	GLU	A	88	L	H	CZ	PHE	V	68
R	-	CB	GLU	A	88	L	H	HZ	PHE	V	68
R	-	CG	GLU	A	88	L	H	CE1	PHE	V	68
R	-	CG	GLU	A	88	L	H	CE2	PHE	V	68
R	-	CG	GLU	A	88	L	H	CZ	PHE	V	68
R	-	CG	GLU	A	88	L	H	HE2	PHE	V	68
R	-	CG	GLU	A	88	L	H	HZ	PHE	V	68
R	-	CD	GLU	A	88	L	H	CE1	PHE	V	68
R	-	CD	GLU	A	88	L	H	CE2	PHE	V	68
R	-	CD	GLU	A	88	L	H	CZ	PHE	V	68
R	-	CD	GLU	A	88	L	H	HE2	PHE	V	68
R	-	CD	GLU	A	88	L	H	HZ	PHE	V	68
R	-	OE1	GLU	A	88	L	H	CD2	PHE	V	68
R	-	OE1	GLU	A	88	L	H	CE2	PHE	V	68
R	-	OE1	GLU	A	88	L	H	CZ	PHE	V	68
R	-	OE1	GLU	A	88	L	H	HE2	PHE	V	68
R	-	OE1	GLU	A	88	L	H	HZ	PHE	V	68
R	-	OE2	GLU	A	88	L	H	CZ	PHE	V	68
R	-	OE2	GLU	A	88	L	H	HZ	PHE	V	68
R	S	CG2	THR	A	90	L	H	HG12	VAL	V	99
R	S	CG2	THR	A	90	L	H	HD11	ILE	V	103
R	S	N	MET	A	91	L	H	HE1	PHE	V	102
R	S	CA	MET	A	91	L	H	HE1	PHE	V	102
R	S	C	MET	A	91	L	H	HE1	PHE	V	102
R	S	CB	MET	A	91	L	H	CE1	PHE	V	102
R	S	CB	MET	A	91	L	H	CZ	PHE	V	102
R	S	CB	MET	A	91	L	H	HE1	PHE	V	102
R	S	CB	MET	A	91	L	H	HZ	PHE	V	102
R	S	O	MET	A	91	L	H	CG	PHE	V	102
R	S	O	MET	A	91	L	H	CD1	PHE	V	102
R	S	O	MET	A	91	L	H	CE1	PHE	V	102
R	S	O	MET	A	91	L	H	CZ	PHE	V	102
R	S	O	MET	A	91	L	H	HD1	PHE	V	102
R	S	O	MET	A	91	L	H	HE1	PHE	V	102
R	S	CG	MET	A	91	L	H	HE1	PHE	V	102
R	S	CG	MET	A	91	L	H	HZ	PHE	V	102
R	S	CG	MET	A	91	L	H	HD23	LEU	V	153
R	S	CB	ILE	A	92	L	H	HG22	VAL	V	99
R	S	CG1	ILE	A	92	L	H	HG22	VAL	V	99
R	S	CD1	ILE	A	92	L	H	HG	SER	V	95
R	S	CD1	ILE	A	92	L	H	HG21	VAL	V	99
R	S	CD1	ILE	A	92	L	H	HG22	VAL	V	99
R	S	CD1	ILE	A	92	L	H	HG23	VAL	V	99
R	S	CA	SER	A	93	L	H	HE1	MET	V	164
R	S	C	SER	A	93	L	H	HE1	MET	V	164
R	S	CB	SER	A	93	L	H	SD	MET	V	164
R	S	CB	SER	A	93	L	H	CE	MET	V	164
R	S	CB	SER	A	93	L	H	HE1	MET	V	164
R	S	CB	SER	A	93	L	H	HE2	MET	V	164
R	S	CB	SER	A	93	L	H	HE3	MET	V	164
R	S	OG	SER	A	93	L	H	HG23	THR	V	160
R	S	OG	SER	A	93	L	H	SD	MET	V	164
R	S	OG	SER	A	93	L	H	CE	MET	V	164
R	S	OG	SER	A	93	L	H	HE1	MET	V	164
R	S	OG	SER	A	93	L	H	HE2	MET	V	164
R	S	OG	SER	A	93	L	H	HE3	MET	V	164
R	H	N	VAL	A	95	L	H	HE1	MET	V	164
R	H	N	VAL	A	95	L	H	HE2	MET	V	164
R	H	CA	VAL	A	95	L	H	SD	MET	V	164
R	H	CA	VAL	A	95	L	H	HE2	MET	V	164
R	H	C	VAL	A	95	L	H	SD	MET	V	164
R	H	CB	VAL	A	95	L	H	CB	MET	V	164
R	H	CB	VAL	A	95	L	H	SD	MET	V	164
R	H	CB	VAL	A	95	L	H	CE	MET	V	164
R	H	CB	VAL	A	95	L	H	HB3	MET	V	164
R	H	CB	VAL	A	95	L	H	HE1	MET	V	164
R	H	CB	VAL	A	95	L	H	HE2	MET	V	164
R	H	CG1	VAL	A	95	L	H	CB	MET	V	164
R	H	CG1	VAL	A	95	L	H	CG	MET	V	164
R	H	CG1	VAL	A	95	L	H	SD	MET	V	164
R	H	CG1	VAL	A	95	L	H	HB3	MET	V	164
R	H	CG1	VAL	A	95	L	H	HE2	MET	V	164
R	H	CG2	VAL	A	95	L	H	HB3	MET	V	164
R	H	CG2	VAL	A	95	L	H	HE2	MET	V	164
R	H	N	GLY	A	96	L	H	SD	MET	V	164
R	H	N	GLY	A	96	L	H	HE1	MET	V	164
R	H	CA	GLY	A	96	L	H	SD	MET	V	164
R	H	O	GLY	A	96	L	H	CB	SER	V	95
R	H	O	GLY	A	96	L	H	OG	SER	V	95
R	H	O	GLY	A	96	L	H	HB3	SER	V	95
R	H	O	GLY	A	96	L	H	HG	SER	V	95
R	H	CA	ALA	A	99	L	H	HB3	SER	V	95
R	H	C	ALA	A	99	L	H	HB3	SER	V	95
R	H	CB	ALA	A	99	L	H	CD1	PHE	V	94
R	H	CB	ALA	A	99	L	H	CE1	PHE	V	94
R	H	CB	ALA	A	99	L	H	HD1	PHE	V	94
R	H	CB	ALA	A	99	L	H	HE1	PHE	V	94
R	H	CB	ALA	A	99	L	H	HB3	SER	V	95
R	H	O	ALA	A	99	L	H	HB3	SER	V	95
R	H	N	GLN	A	100	L	H	CB	SER	V	95
R	H	N	GLN	A	100	L	H	OG	SER	V	95
R	H	N	GLN	A	100	L	H	HB2	SER	V	95
R	H	N	GLN	A	100	L	H	HB3	SER	V	95
R	H	N	GLN	A	100	L	H	HG	SER	V	95
R	H	CA	GLN	A	100	L	H	CB	SER	V	95
R	H	CA	GLN	A	100	L	H	OG	SER	V	95
R	H	CA	GLN	A	100	L	H	HB2	SER	V	95
R	H	CA	GLN	A	100	L	H	HB3	SER	V	95
R	H	CA	GLN	A	100	L	H	HG	SER	V	95
R	H	CB	GLN	A	100	L	H	CB	SER	V	95
R	H	CB	GLN	A	100	L	H	OG	SER	V	95
R	H	CB	GLN	A	100	L	H	HB2	SER	V	95
R	H	CB	GLN	A	100	L	H	HB3	SER	V	95
R	H	CB	GLN	A	100	L	H	HG	SER	V	95
R	H	CG	GLN	A	100	L	H	OG	SER	V	95
R	H	CG	GLN	A	100	L	H	HB2	SER	V	95
R	H	CG	GLN	A	100	L	H	HG	SER	V	95
R	H	CD	GLN	A	100	L	H	OG	SER	V	95
R	H	CD	GLN	A	100	L	H	HG	SER	V	95
R	H	NE2	GLN	A	100	L	H	OG	SER	V	95
R	H	NE2	GLN	A	100	L	H	HG	SER	V	95
R	H	OE1	GLN	A	100	L	H	HG	SER	V	95
R	H	CG	TYR	A	102	L	-	HG21	THR	V	8
R	H	CD1	TYR	A	102	L	-	CB	THR	V	8
R	H	CD1	TYR	A	102	L	-	OG1	THR	V	8
R	H	CD1	TYR	A	102	L	-	HB	THR	V	8
R	H	CD1	TYR	A	102	L	-	HG1	THR	V	8
R	H	CD1	TYR	A	102	L	-	HG21	THR	V	8
R	H	CD2	TYR	A	102	L	-	HG21	THR	V	8
R	H	CE1	TYR	A	102	L	-	CB	THR	V	8
R	H	CE1	TYR	A	102	L	-	CG2	THR	V	8
R	H	CE1	TYR	A	102	L	-	OG1	THR	V	8
R	H	CE1	TYR	A	102	L	-	HB	THR	V	8
R	H	CE1	TYR	A	102	L	-	HG1	THR	V	8
R	H	CE1	TYR	A	102	L	-	HG21	THR	V	8
R	H	CE1	TYR	A	102	L	-	HG23	THR	V	10
R	H	CE2	TYR	A	102	L	-	OG1	THR	V	8
R	H	CE2	TYR	A	102	L	-	HG21	THR	V	8
R	H	OH	TYR	A	102	L	-	CB	THR	V	8
R	H	OH	TYR	A	102	L	-	OG1	THR	V	8
R	H	OH	TYR	A	102	L	-	HG1	THR	V	8
R	H	OH	TYR	A	102	L	-	HG21	THR	V	8
R	H	CZ	TYR	A	102	L	-	CB	THR	V	8
R	H	CZ	TYR	A	102	L	-	CG2	THR	V	8
R	H	CZ	TYR	A	102	L	-	OG1	THR	V	8
R	H	CZ	TYR	A	102	L	-	HB	THR	V	8
R	H	CZ	TYR	A	102	L	-	HG1	THR	V	8
R	H	CZ	TYR	A	102	L	-	HG21	THR	V	8
R	H	CA	PHE	A	103	L	-	HG22	THR	V	10
R	H	CB	PHE	A	103	L	-	CG2	THR	V	10
R	H	CB	PHE	A	103	L	-	HG22	THR	V	10
R	H	CG	PHE	A	103	L	-	CA	THR	V	10
R	H	CG	PHE	A	103	L	-	CB	THR	V	10
R	H	CG	PHE	A	103	L	-	CG2	THR	V	10
R	H	CG	PHE	A	103	L	-	HA	THR	V	10
R	H	CG	PHE	A	103	L	-	HB	THR	V	10
R	H	CG	PHE	A	103	L	-	HG21	THR	V	10
R	H	CG	PHE	A	103	L	-	HG22	THR	V	10
R	H	CG	PHE	A	103	L	-	HG23	THR	V	10
R	H	CD1	PHE	A	103	L	-	CA	THR	V	10
R	H	CD1	PHE	A	103	L	-	CB	THR	V	10
R	H	CD1	PHE	A	103	L	-	CG2	THR	V	10
R	H	CD1	PHE	A	103	L	-	OG1	THR	V	10
R	H	CD1	PHE	A	103	L	-	HA	THR	V	10
R	H	CD1	PHE	A	103	L	-	HB	THR	V	10
R	H	CD1	PHE	A	103	L	-	HG21	THR	V	10
R	H	CD1	PHE	A	103	L	-	HG22	THR	V	10
R	H	CD1	PHE	A	103	L	-	HG23	THR	V	10
R	H	CD2	PHE	A	103	L	-	CA	THR	V	10
R	H	CD2	PHE	A	103	L	-	CG2	THR	V	10
R	H	CD2	PHE	A	103	L	-	HA	THR	V	10
R	H	CD2	PHE	A	103	L	-	HG22	THR	V	10
R	H	CD2	PHE	A	103	L	-	HG23	THR	V	10
R	H	CD2	PHE	A	103	L	H	HB3	PHE	V	94
R	H	CE1	PHE	A	103	L	-	O	THR	V	8
R	H	CE1	PHE	A	103	L	-	HG1	THR	V	8
R	H	CE1	PHE	A	103	L	-	C	SER	V	9
R	H	CE1	PHE	A	103	L	-	O	SER	V	9
R	H	CE1	PHE	A	103	L	-	N	THR	V	10
R	H	CE1	PHE	A	103	L	-	CA	THR	V	10
R	H	CE1	PHE	A	103	L	-	C	THR	V	10
R	H	CE1	PHE	A	103	L	-	CB	THR	V	10
R	H	CE1	PHE	A	103	L	-	O	THR	V	10
R	H	CE1	PHE	A	103	L	-	CG2	THR	V	10
R	H	CE1	PHE	A	103	L	-	OG1	THR	V	10
R	H	CE1	PHE	A	103	L	-	H	THR	V	10
R	H	CE1	PHE	A	103	L	-	HA	THR	V	10
R	H	CE1	PHE	A	103	L	-	HB	THR	V	10
R	H	CE1	PHE	A	103	L	-	HG1	THR	V	10
R	H	CE1	PHE	A	103	L	-	HG21	THR	V	10
R	H	CE1	PHE	A	103	L	-	HG22	THR	V	10
R	H	CE1	PHE	A	103	L	-	HG23	THR	V	10
R	H	CE2	PHE	A	103	L	-	HB	THR	V	8
R	H	CE2	PHE	A	103	L	-	C	SER	V	9
R	H	CE2	PHE	A	103	L	-	O	SER	V	9
R	H	CE2	PHE	A	103	L	-	N	THR	V	10
R	H	CE2	PHE	A	103	L	-	CA	THR	V	10
R	H	CE2	PHE	A	103	L	-	CG2	THR	V	10
R	H	CE2	PHE	A	103	L	-	HA	THR	V	10
R	H	CE2	PHE	A	103	L	-	HG22	THR	V	10
R	H	CE2	PHE	A	103	L	-	HG23	THR	V	10
R	H	CE2	PHE	A	103	L	H	CB	PHE	V	94
R	H	CE2	PHE	A	103	L	H	HB2	PHE	V	94
R	H	CE2	PHE	A	103	L	H	HB3	PHE	V	94
R	H	CZ	PHE	A	103	L	-	C	THR	V	8
R	H	CZ	PHE	A	103	L	-	O	THR	V	8
R	H	CZ	PHE	A	103	L	-	HB	THR	V	8
R	H	CZ	PHE	A	103	L	-	N	SER	V	9
R	H	CZ	PHE	A	103	L	-	CA	SER	V	9
R	H	CZ	PHE	A	103	L	-	C	SER	V	9
R	H	CZ	PHE	A	103	L	-	O	SER	V	9
R	H	CZ	PHE	A	103	L	-	N	THR	V	10
R	H	CZ	PHE	A	103	L	-	CA	THR	V	10
R	H	CZ	PHE	A	103	L	-	C	THR	V	10
R	H	CZ	PHE	A	103	L	-	CB	THR	V	10
R	H	CZ	PHE	A	103	L	-	O	THR	V	10
R	H	CZ	PHE	A	103	L	-	CG2	THR	V	10
R	H	CZ	PHE	A	103	L	-	H	THR	V	10
R	H	CZ	PHE	A	103	L	-	HA	THR	V	10
R	H	CZ	PHE	A	103	L	-	HB	THR	V	10
R	H	CZ	PHE	A	103	L	-	HG21	THR	V	10
R	H	CZ	PHE	A	103	L	-	HG22	THR	V	10
R	H	CZ	PHE	A	103	L	-	HG23	THR	V	10
R	H	CZ	PHE	A	103	L	H	HB3	PHE	V	94
R	H	CG	LEU	A	106	L	-	HG21	THR	V	10
R	H	CD2	LEU	A	106	L	-	CG2	THR	V	10
R	H	CD2	LEU	A	106	L	-	HG21	THR	V	10
R	H	CD2	LEU	A	106	L	-	HG23	THR	V	10
R	H	CE1	PHE	A	107	L	-	HB	THR	V	10
R	H	CE1	PHE	A	107	L	-	HG21	THR	V	10
R	H	CE2	PHE	A	107	L	-	HB	THR	V	10
R	H	CE2	PHE	A	107	L	-	HG21	THR	V	10
R	H	CE2	PHE	A	107	L	-	HG22	THR	V	10
R	H	CZ	PHE	A	107	L	-	CB	THR	V	10
R	H	CZ	PHE	A	107	L	-	CG2	THR	V	10
R	H	CZ	PHE	A	107	L	-	OG1	THR	V	10
R	H	CZ	PHE	A	107	L	-	HB	THR	V	10
R	H	CZ	PHE	A	107	L	-	HG21	THR	V	10
R	H	CZ	PHE	A	107	L	-	HG22	THR	V	10
R	H	CZ	PHE	A	107	L	S	OE1	GLU	V	11
R	H	CZ	PHE	A	107	L	S	HG3	GLU	V	11
R	H	ND1	HIS	A	312	L	H	HE2	LYS	V	22
R	H	CE1	HIS	A	312	L	H	HE2	LYS	V	22
R	H	CE1	HIS	A	312	L	H	HE3	LYS	V	22

- 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