IID

P47888_Q8NGN1.1 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	-	THR	A	10	L	H	GLY	V	92
R	-	THR	A	10	L	H	LEU	V	95
R	H	TYR	A	102	L	H	PHE	V	111
R	H	TYR	A	102	L	H	PHE	V	112
R	H	LEU	A	103	L	H	SER	V	108
R	H	LEU	A	103	L	H	PHE	V	112
R	H	PHE	A	106	L	H	PHE	V	162
R	H	TRP	A	149	L	H	PHE	V	162
R	H	TRP	A	149	L	H	LEU	V	166
R	H	LEU	A	150	L	H	ALA	V	159
R	H	PHE	A	153	L	H	PHE	V	111
R	H	PHE	A	153	L	H	LEU	V	115
R	H	PHE	A	153	L	H	TRP	V	158
R	H	PHE	A	153	L	H	PHE	V	162
R	H	PHE	A	68	L	H	VAL	V	170
R	H	LEU	A	72	L	H	LEU	V	166
R	H	LEU	A	72	L	H	VAL	V	170
R	H	THR	A	75	L	H	TYR	V	103
R	H	THR	A	75	L	H	ASP	V	104
R	H	VAL	A	76	L	H	ASP	V	104
R	H	PRO	A	79	L	H	ASP	V	104
R	-	GLN	A	8	L	H	TYR	V	44
R	H	LYS	A	80	L	S	SER	V	102
R	H	LYS	A	80	L	H	ASP	V	104
R	H	VAL	A	83	L	-	ALA	V	19
R	-	ASP	A	89	L	-	LYS	V	98
R	S	SER	A	93	L	H	ALA	V	89
R	H	VAL	A	95	L	H	THR	V	84
R	H	VAL	A	95	L	H	VAL	V	85
R	H	VAL	A	95	L	H	PRO	V	88
R	H	VAL	A	95	L	H	ALA	V	89
R	H	SER	A	96	L	H	ALA	V	105
R	H	ILE	A	99	L	H	SER	V	108
R	H	ILE	A	99	L	H	GLN	V	109
R	H	ILE	A	99	L	H	PHE	V	112
R	H	ILE	A	99	L	H	VAL	V	85

- 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

P47888_Q8NGN1.1 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	-	CD	GLN	A	8	L	H	HE1	TYR	V	44
R	-	NE2	GLN	A	8	L	H	CE1	TYR	V	44
R	-	NE2	GLN	A	8	L	H	OH	TYR	V	44
R	-	NE2	GLN	A	8	L	H	HE1	TYR	V	44
R	-	OE1	GLN	A	8	L	H	CE1	TYR	V	44
R	-	OE1	GLN	A	8	L	H	HE1	TYR	V	44
R	-	CB	THR	A	10	L	H	HA2	GLY	V	92
R	-	CB	THR	A	10	L	H	HD11	LEU	V	95
R	-	CG2	THR	A	10	L	H	HD11	LEU	V	95
R	-	OG1	THR	A	10	L	H	HA2	GLY	V	92
R	-	OG1	THR	A	10	L	H	CD1	LEU	V	95
R	-	OG1	THR	A	10	L	H	HD11	LEU	V	95
R	-	OG1	THR	A	10	L	H	HD12	LEU	V	95
R	H	CD2	PHE	A	68	L	H	HG12	VAL	V	170
R	H	CE1	PHE	A	68	L	H	CG2	VAL	V	170
R	H	CE1	PHE	A	68	L	H	HG12	VAL	V	170
R	H	CE1	PHE	A	68	L	H	HG13	VAL	V	170
R	H	CE1	PHE	A	68	L	H	HG22	VAL	V	170
R	H	CE1	PHE	A	68	L	H	HG23	VAL	V	170
R	H	CE2	PHE	A	68	L	H	CG1	VAL	V	170
R	H	CE2	PHE	A	68	L	H	CG2	VAL	V	170
R	H	CE2	PHE	A	68	L	H	HG11	VAL	V	170
R	H	CE2	PHE	A	68	L	H	HG12	VAL	V	170
R	H	CE2	PHE	A	68	L	H	HG13	VAL	V	170
R	H	CE2	PHE	A	68	L	H	HG22	VAL	V	170
R	H	CE2	PHE	A	68	L	H	HG23	VAL	V	170
R	H	CZ	PHE	A	68	L	H	CB	VAL	V	170
R	H	CZ	PHE	A	68	L	H	CG1	VAL	V	170
R	H	CZ	PHE	A	68	L	H	CG2	VAL	V	170
R	H	CZ	PHE	A	68	L	H	HG11	VAL	V	170
R	H	CZ	PHE	A	68	L	H	HG12	VAL	V	170
R	H	CZ	PHE	A	68	L	H	HG13	VAL	V	170
R	H	CZ	PHE	A	68	L	H	HG21	VAL	V	170
R	H	CZ	PHE	A	68	L	H	HG22	VAL	V	170
R	H	CZ	PHE	A	68	L	H	HG23	VAL	V	170
R	H	CG	LEU	A	72	L	H	HG23	VAL	V	170
R	H	CD1	LEU	A	72	L	H	HD13	LEU	V	166
R	H	CD1	LEU	A	72	L	H	HG23	VAL	V	170
R	H	CD2	LEU	A	72	L	H	HG23	VAL	V	170
R	H	C	THR	A	75	L	H	OD1	ASP	V	104
R	H	O	THR	A	75	L	H	CG	ASP	V	104
R	H	O	THR	A	75	L	H	OD1	ASP	V	104
R	H	O	THR	A	75	L	H	OD2	ASP	V	104
R	H	CG2	THR	A	75	L	H	HE1	TYR	V	103
R	H	CG2	THR	A	75	L	H	OD1	ASP	V	104
R	H	CA	VAL	A	76	L	H	HB3	ASP	V	104
R	H	O	VAL	A	76	L	H	OD2	ASP	V	104
R	H	O	VAL	A	76	L	H	HB3	ASP	V	104
R	H	CA	PRO	A	79	L	H	OD2	ASP	V	104
R	H	C	PRO	A	79	L	H	OD2	ASP	V	104
R	H	CB	PRO	A	79	L	H	CG	ASP	V	104
R	H	CB	PRO	A	79	L	H	OD1	ASP	V	104
R	H	CB	PRO	A	79	L	H	OD2	ASP	V	104
R	H	CG	PRO	A	79	L	H	OD2	ASP	V	104
R	H	CD	PRO	A	79	L	H	OD2	ASP	V	104
R	H	N	LYS	A	80	L	H	OD2	ASP	V	104
R	H	CA	LYS	A	80	L	H	OD2	ASP	V	104
R	H	CB	LYS	A	80	L	H	OD2	ASP	V	104
R	H	CB	LYS	A	80	L	H	HB2	ASP	V	104
R	H	CG	LYS	A	80	L	S	HG	SER	V	102
R	H	CD	LYS	A	80	L	S	CB	SER	V	102
R	H	CD	LYS	A	80	L	S	OG	SER	V	102
R	H	CD	LYS	A	80	L	S	HB2	SER	V	102
R	H	CD	LYS	A	80	L	S	HB3	SER	V	102
R	H	CD	LYS	A	80	L	S	HG	SER	V	102
R	H	CE	LYS	A	80	L	S	OG	SER	V	102
R	H	CE	LYS	A	80	L	S	HB3	SER	V	102
R	H	CE	LYS	A	80	L	S	HG	SER	V	102
R	H	NZ	LYS	A	80	L	S	CB	SER	V	102
R	H	NZ	LYS	A	80	L	S	OG	SER	V	102
R	H	NZ	LYS	A	80	L	S	HB3	SER	V	102
R	H	NZ	LYS	A	80	L	S	HG	SER	V	102
R	H	CB	VAL	A	83	L	-	HB1	ALA	V	19
R	H	CG2	VAL	A	83	L	-	CB	ALA	V	19
R	H	CG2	VAL	A	83	L	-	O	ALA	V	19
R	H	CG2	VAL	A	83	L	-	HB1	ALA	V	19
R	H	CG2	VAL	A	83	L	-	HB3	ALA	V	19
R	-	CB	ASP	A	89	L	-	NZ	LYS	V	98
R	-	CB	ASP	A	89	L	-	HZ2	LYS	V	98
R	-	CB	ASP	A	89	L	-	HZ3	LYS	V	98
R	-	CG	ASP	A	89	L	-	NZ	LYS	V	98
R	-	CG	ASP	A	89	L	-	HZ1	LYS	V	98
R	-	CG	ASP	A	89	L	-	HZ2	LYS	V	98
R	-	CG	ASP	A	89	L	-	HZ3	LYS	V	98
R	-	OD1	ASP	A	89	L	-	NZ	LYS	V	98
R	-	OD1	ASP	A	89	L	-	HZ2	LYS	V	98
R	-	OD1	ASP	A	89	L	-	HZ3	LYS	V	98
R	-	OD2	ASP	A	89	L	-	CD	LYS	V	98
R	-	OD2	ASP	A	89	L	-	NZ	LYS	V	98
R	-	OD2	ASP	A	89	L	-	HD2	LYS	V	98
R	-	OD2	ASP	A	89	L	-	HD3	LYS	V	98
R	-	OD2	ASP	A	89	L	-	HZ1	LYS	V	98
R	-	OD2	ASP	A	89	L	-	HZ2	LYS	V	98
R	-	OD2	ASP	A	89	L	-	HZ3	LYS	V	98
R	S	CB	SER	A	93	L	H	HA	ALA	V	89
R	S	OG	SER	A	93	L	H	CB	ALA	V	89
R	S	OG	SER	A	93	L	H	HA	ALA	V	89
R	S	OG	SER	A	93	L	H	HB1	ALA	V	89
R	S	OG	SER	A	93	L	H	HB2	ALA	V	89
R	H	N	VAL	A	95	L	H	HB2	PRO	V	88
R	H	CB	VAL	A	95	L	H	O	THR	V	84
R	H	CB	VAL	A	95	L	H	HB2	PRO	V	88
R	H	CB	VAL	A	95	L	H	H	ALA	V	89
R	H	CB	VAL	A	95	L	H	HB1	ALA	V	89
R	H	CG1	VAL	A	95	L	H	C	THR	V	84
R	H	CG1	VAL	A	95	L	H	O	THR	V	84
R	H	CG1	VAL	A	95	L	H	HG22	THR	V	84
R	H	CG1	VAL	A	95	L	H	CA	VAL	V	85
R	H	CG1	VAL	A	95	L	H	C	VAL	V	85
R	H	CG1	VAL	A	95	L	H	O	VAL	V	85
R	H	CG1	VAL	A	95	L	H	HA	VAL	V	85
R	H	CG1	VAL	A	95	L	H	HB1	ALA	V	89
R	H	CG2	VAL	A	95	L	H	C	THR	V	84
R	H	CG2	VAL	A	95	L	H	O	THR	V	84
R	H	CG2	VAL	A	95	L	H	CG2	THR	V	84
R	H	CG2	VAL	A	95	L	H	HG22	THR	V	84
R	H	CG2	VAL	A	95	L	H	HG23	THR	V	84
R	H	CG2	VAL	A	95	L	H	CB	PRO	V	88
R	H	CG2	VAL	A	95	L	H	CG	PRO	V	88
R	H	CG2	VAL	A	95	L	H	CD	PRO	V	88
R	H	CG2	VAL	A	95	L	H	HB2	PRO	V	88
R	H	CG2	VAL	A	95	L	H	HB3	PRO	V	88
R	H	CG2	VAL	A	95	L	H	HG2	PRO	V	88
R	H	CG2	VAL	A	95	L	H	HD3	PRO	V	88
R	H	CG2	VAL	A	95	L	H	H	ALA	V	89
R	H	CG2	VAL	A	95	L	H	HB1	ALA	V	89
R	H	CB	SER	A	96	L	H	HB1	ALA	V	105
R	H	OG	SER	A	96	L	H	HB1	ALA	V	105
R	H	N	ILE	A	99	L	H	HE2	PHE	V	112
R	H	CA	ILE	A	99	L	H	HB2	SER	V	108
R	H	CA	ILE	A	99	L	H	CE2	PHE	V	112
R	H	CA	ILE	A	99	L	H	HE2	PHE	V	112
R	H	CA	ILE	A	99	L	H	HZ	PHE	V	112
R	H	C	ILE	A	99	L	H	HB2	SER	V	108
R	H	C	ILE	A	99	L	H	CE2	PHE	V	112
R	H	C	ILE	A	99	L	H	HE2	PHE	V	112
R	H	CB	ILE	A	99	L	H	CB	SER	V	108
R	H	CB	ILE	A	99	L	H	HB2	SER	V	108
R	H	CB	ILE	A	99	L	H	HB3	SER	V	108
R	H	CB	ILE	A	99	L	H	CD2	PHE	V	112
R	H	CB	ILE	A	99	L	H	CE2	PHE	V	112
R	H	CB	ILE	A	99	L	H	HD2	PHE	V	112
R	H	CB	ILE	A	99	L	H	HE2	PHE	V	112
R	H	O	ILE	A	99	L	H	HB2	SER	V	108
R	H	O	ILE	A	99	L	H	CE2	PHE	V	112
R	H	O	ILE	A	99	L	H	HE2	PHE	V	112
R	H	O	ILE	A	99	L	H	HZ	PHE	V	112
R	H	CG1	ILE	A	99	L	H	HB2	SER	V	108
R	H	CG1	ILE	A	99	L	H	CG	PHE	V	112
R	H	CG1	ILE	A	99	L	H	CD2	PHE	V	112
R	H	CG1	ILE	A	99	L	H	CE2	PHE	V	112
R	H	CG1	ILE	A	99	L	H	HD2	PHE	V	112
R	H	CG1	ILE	A	99	L	H	HE2	PHE	V	112
R	H	CG2	ILE	A	99	L	H	CA	SER	V	108
R	H	CG2	ILE	A	99	L	H	C	SER	V	108
R	H	CG2	ILE	A	99	L	H	CB	SER	V	108
R	H	CG2	ILE	A	99	L	H	O	SER	V	108
R	H	CG2	ILE	A	99	L	H	OG	SER	V	108
R	H	CG2	ILE	A	99	L	H	HA	SER	V	108
R	H	CG2	ILE	A	99	L	H	HB2	SER	V	108
R	H	CG2	ILE	A	99	L	H	HB3	SER	V	108
R	H	CG2	ILE	A	99	L	H	CD2	PHE	V	112
R	H	CG2	ILE	A	99	L	H	CE2	PHE	V	112
R	H	CG2	ILE	A	99	L	H	HD2	PHE	V	112
R	H	CG2	ILE	A	99	L	H	HE2	PHE	V	112
R	H	CD1	ILE	A	99	L	H	HA	VAL	V	85
R	H	CD1	ILE	A	99	L	H	HG13	VAL	V	85
R	H	CD1	ILE	A	99	L	H	HG22	VAL	V	85
R	H	CD1	ILE	A	99	L	H	HB2	SER	V	108
R	H	CD1	ILE	A	99	L	H	HA	GLN	V	109
R	H	CD1	ILE	A	99	L	H	CD2	PHE	V	112
R	H	CD1	ILE	A	99	L	H	HB3	PHE	V	112
R	H	CD1	ILE	A	99	L	H	HD2	PHE	V	112
R	H	CA	TYR	A	102	L	H	HZ	PHE	V	112
R	H	CB	TYR	A	102	L	H	CZ	PHE	V	112
R	H	CB	TYR	A	102	L	H	HZ	PHE	V	112
R	H	CG	TYR	A	102	L	H	CE1	PHE	V	112
R	H	CG	TYR	A	102	L	H	CZ	PHE	V	112
R	H	CG	TYR	A	102	L	H	HE1	PHE	V	112
R	H	CG	TYR	A	102	L	H	HZ	PHE	V	112
R	H	CD1	TYR	A	102	L	H	HE1	PHE	V	111
R	H	CD1	TYR	A	102	L	H	CE1	PHE	V	112
R	H	CD1	TYR	A	102	L	H	CE2	PHE	V	112
R	H	CD1	TYR	A	102	L	H	CZ	PHE	V	112
R	H	CD1	TYR	A	102	L	H	HE1	PHE	V	112
R	H	CD1	TYR	A	102	L	H	HZ	PHE	V	112
R	H	CD2	TYR	A	102	L	H	HE1	PHE	V	112
R	H	CD2	TYR	A	102	L	H	HZ	PHE	V	112
R	H	CE1	TYR	A	102	L	H	HE1	PHE	V	111
R	H	CE1	TYR	A	102	L	H	CE1	PHE	V	112
R	H	CE1	TYR	A	102	L	H	CZ	PHE	V	112
R	H	CE1	TYR	A	102	L	H	HE1	PHE	V	112
R	H	CE1	TYR	A	102	L	H	HZ	PHE	V	112
R	H	CZ	TYR	A	102	L	H	HE1	PHE	V	112
R	H	CG	LEU	A	103	L	H	HE2	PHE	V	112
R	H	CD1	LEU	A	103	L	H	CA	SER	V	108
R	H	CD1	LEU	A	103	L	H	CB	SER	V	108
R	H	CD1	LEU	A	103	L	H	OG	SER	V	108
R	H	CD1	LEU	A	103	L	H	HA	SER	V	108
R	H	CD1	LEU	A	103	L	H	HB2	SER	V	108
R	H	CD1	LEU	A	103	L	H	HG	SER	V	108
R	H	CD1	PHE	A	106	L	H	HE2	PHE	V	162
R	H	CD1	PHE	A	106	L	H	HZ	PHE	V	162
R	H	CE1	PHE	A	106	L	H	CE2	PHE	V	162
R	H	CE1	PHE	A	106	L	H	CZ	PHE	V	162
R	H	CE1	PHE	A	106	L	H	HE2	PHE	V	162
R	H	CE1	PHE	A	106	L	H	HZ	PHE	V	162
R	H	CE2	PHE	A	106	L	H	CE2	PHE	V	162
R	H	CE2	PHE	A	106	L	H	CZ	PHE	V	162
R	H	CE2	PHE	A	106	L	H	HE2	PHE	V	162
R	H	CE2	PHE	A	106	L	H	HZ	PHE	V	162
R	H	CZ	PHE	A	106	L	H	CE1	PHE	V	162
R	H	CZ	PHE	A	106	L	H	CE2	PHE	V	162
R	H	CZ	PHE	A	106	L	H	CZ	PHE	V	162
R	H	CZ	PHE	A	106	L	H	HE2	PHE	V	162
R	H	CZ	PHE	A	106	L	H	HZ	PHE	V	162
R	H	CB	TRP	A	149	L	H	HE1	PHE	V	162
R	H	CD2	TRP	A	149	L	H	HD23	LEU	V	166
R	H	CE3	TRP	A	149	L	H	HE1	PHE	V	162
R	H	CE3	TRP	A	149	L	H	HZ	PHE	V	162
R	H	CE3	TRP	A	149	L	H	HD22	LEU	V	166
R	H	CE3	TRP	A	149	L	H	HD23	LEU	V	166
R	H	CH2	TRP	A	149	L	H	HD23	LEU	V	166
R	H	CZ3	TRP	A	149	L	H	HD13	LEU	V	166
R	H	CZ3	TRP	A	149	L	H	HD22	LEU	V	166
R	H	CZ3	TRP	A	149	L	H	HD23	LEU	V	166
R	H	CD1	LEU	A	150	L	H	HB1	ALA	V	159
R	H	CD1	LEU	A	150	L	H	HB2	ALA	V	159
R	H	CD2	LEU	A	150	L	H	CA	ALA	V	159
R	H	CD2	LEU	A	150	L	H	CB	ALA	V	159
R	H	CD2	LEU	A	150	L	H	HA	ALA	V	159
R	H	CD2	LEU	A	150	L	H	HB1	ALA	V	159
R	H	CD2	LEU	A	150	L	H	HB2	ALA	V	159
R	H	CB	PHE	A	153	L	H	CE2	PHE	V	162
R	H	CB	PHE	A	153	L	H	HE2	PHE	V	162
R	H	CG	PHE	A	153	L	H	CD2	PHE	V	162
R	H	CG	PHE	A	153	L	H	CE2	PHE	V	162
R	H	CG	PHE	A	153	L	H	HD2	PHE	V	162
R	H	CG	PHE	A	153	L	H	HE2	PHE	V	162
R	H	CD1	PHE	A	153	L	H	HD2	PHE	V	162
R	H	CD2	PHE	A	153	L	H	HZ	PHE	V	111
R	H	CD2	PHE	A	153	L	H	CG	PHE	V	162
R	H	CD2	PHE	A	153	L	H	CD2	PHE	V	162
R	H	CD2	PHE	A	153	L	H	CE2	PHE	V	162
R	H	CD2	PHE	A	153	L	H	CZ	PHE	V	162
R	H	CD2	PHE	A	153	L	H	HD2	PHE	V	162
R	H	CD2	PHE	A	153	L	H	HE2	PHE	V	162
R	H	CE1	PHE	A	153	L	H	HD13	LEU	V	115
R	H	CE1	PHE	A	153	L	H	HD22	LEU	V	115
R	H	CE1	PHE	A	153	L	H	CE3	TRP	V	158
R	H	CE1	PHE	A	153	L	H	HB3	TRP	V	158
R	H	CE1	PHE	A	153	L	H	HE3	TRP	V	158
R	H	CE1	PHE	A	153	L	H	HD2	PHE	V	162
R	H	CE2	PHE	A	153	L	H	HZ	PHE	V	111
R	H	CE2	PHE	A	153	L	H	CD2	LEU	V	115
R	H	CE2	PHE	A	153	L	H	HD12	LEU	V	115
R	H	CE2	PHE	A	153	L	H	HD13	LEU	V	115
R	H	CE2	PHE	A	153	L	H	HD22	LEU	V	115
R	H	CE2	PHE	A	153	L	H	HD23	LEU	V	115
R	H	CE2	PHE	A	153	L	H	CD2	PHE	V	162
R	H	CE2	PHE	A	153	L	H	CE2	PHE	V	162
R	H	CE2	PHE	A	153	L	H	HB2	PHE	V	162
R	H	CE2	PHE	A	153	L	H	HD2	PHE	V	162
R	H	CE2	PHE	A	153	L	H	HE2	PHE	V	162
R	H	CZ	PHE	A	153	L	H	CD1	LEU	V	115
R	H	CZ	PHE	A	153	L	H	CD2	LEU	V	115
R	H	CZ	PHE	A	153	L	H	HD12	LEU	V	115
R	H	CZ	PHE	A	153	L	H	HD13	LEU	V	115
R	H	CZ	PHE	A	153	L	H	HD22	LEU	V	115
R	H	CZ	PHE	A	153	L	H	HD23	LEU	V	115
R	H	CZ	PHE	A	153	L	H	CE3	TRP	V	158
R	H	CZ	PHE	A	153	L	H	CZ3	TRP	V	158
R	H	CZ	PHE	A	153	L	H	HE3	TRP	V	158
R	H	CZ	PHE	A	153	L	H	HZ3	TRP	V	158
R	H	CZ	PHE	A	153	L	H	CD2	PHE	V	162
R	H	CZ	PHE	A	153	L	H	HB2	PHE	V	162
R	H	CZ	PHE	A	153	L	H	HD2	PHE	V	162

- 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