IID

Q15617_Q8NH79.1 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	TYR	A	102	L	H	LEU	V	97
R	H	PHE	A	103	L	H	SER	V	93
R	H	PHE	A	103	L	H	CYS	V	94
R	H	PHE	A	103	L	H	LEU	V	97
R	H	VAL	A	106	L	H	SER	V	93
R	H	PHE	A	107	L	S	CYS	V	91
R	H	PHE	A	107	L	H	SER	V	93
R	H	ASN	A	138	L	-	ASN	V	3
R	H	ASN	A	138	L	-	GLY	V	4
R	H	PHE	A	142	L	-	PRO	V	165
R	H	PHE	A	142	L	-	PHE	V	166
R	H	PHE	A	142	L	-	CYS	V	167
R	H	PHE	A	142	L	-	GLY	V	4
R	H	PHE	A	142	L	-	THR	V	5
R	H	PHE	A	142	L	-	VAL	V	6
R	H	PHE	A	142	L	-	ILE	V	7
R	H	ILE	A	145	L	-	VAL	V	6
R	H	LEU	A	146	L	H	GLN	V	163
R	H	LEU	A	146	L	-	LEU	V	164
R	H	LEU	A	146	L	-	PRO	V	165
R	H	LEU	A	146	L	-	VAL	V	6
R	H	LEU	A	146	L	H	MET	V	92
R	H	TYR	A	149	L	-	THR	V	8
R	H	ILE	A	150	L	H	ILE	V	162
R	H	ILE	A	150	L	H	GLN	V	163
R	H	LEU	A	153	L	H	MET	V	159
R	H	LEU	A	153	L	H	ILE	V	162
R	H	LEU	A	153	L	H	SER	V	93
R	H	LEU	A	153	L	H	LEU	V	96
R	H	VAL	A	154	L	H	MET	V	159
R	H	SER	A	157	L	H	PHE	V	155
R	H	SER	A	157	L	H	MET	V	159
R	H	VAL	A	158	L	H	PHE	V	155
R	H	GLY	A	161	L	H	PHE	V	151
R	H	PHE	A	164	L	H	PHE	V	101
R	H	PHE	A	164	L	H	PHE	V	151
R	H	TRP	A	50	L	-	VAL	V	6
R	H	TRP	A	50	L	-	ILE	V	7
R	H	TRP	A	50	L	-	THR	V	8
R	-	HIS	A	56	L	-	ASN	V	3
R	H	TYR	A	61	L	-	ASN	V	3
R	H	TYR	A	61	L	-	GLY	V	4
R	H	TYR	A	61	L	-	THR	V	5
R	H	PHE	A	68	L	-	THR	V	8
R	H	PHE	A	68	L	S	CYS	V	91
R	H	PRO	A	95	L	H	TRP	V	70
R	H	THR	A	99	L	H	LEU	V	97

- 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

Q15617_Q8NH79.1 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	H	CH2	TRP	A	50	L	-	O	VAL	V	6
R	H	CH2	TRP	A	50	L	-	HA	ILE	V	7
R	H	CH2	TRP	A	50	L	-	OG1	THR	V	8
R	H	CH2	TRP	A	50	L	-	H	THR	V	8
R	H	CH2	TRP	A	50	L	-	HG1	THR	V	8
R	H	CZ2	TRP	A	50	L	-	O	VAL	V	6
R	H	CZ2	TRP	A	50	L	-	OG1	THR	V	8
R	H	CZ2	TRP	A	50	L	-	H	THR	V	8
R	H	CZ2	TRP	A	50	L	-	HG1	THR	V	8
R	H	CZ2	TRP	A	50	L	-	HG21	THR	V	8
R	H	CZ2	TRP	A	50	L	-	HG23	THR	V	8
R	-	ND1	HIS	A	56	L	-	HD21	ASN	V	3
R	H	CD1	TYR	A	61	L	-	HA	THR	V	5
R	H	CE1	TYR	A	61	L	-	O	GLY	V	4
R	H	CE1	TYR	A	61	L	-	HA	THR	V	5
R	H	CE1	TYR	A	61	L	-	HG22	THR	V	5
R	H	OH	TYR	A	61	L	-	CB	ASN	V	3
R	H	OH	TYR	A	61	L	-	HB3	ASN	V	3
R	H	OH	TYR	A	61	L	-	HG22	THR	V	5
R	H	OH	TYR	A	61	L	-	HG23	THR	V	5
R	H	CZ	TYR	A	61	L	-	HB3	ASN	V	3
R	H	CZ	TYR	A	61	L	-	HG22	THR	V	5
R	H	CG	PHE	A	68	L	-	HB	THR	V	8
R	H	CG	PHE	A	68	L	-	HG21	THR	V	8
R	H	CD1	PHE	A	68	L	-	HB	THR	V	8
R	H	CD1	PHE	A	68	L	-	HG21	THR	V	8
R	H	CD2	PHE	A	68	L	-	HB	THR	V	8
R	H	CE1	PHE	A	68	L	-	O	THR	V	8
R	H	CE1	PHE	A	68	L	-	HB	THR	V	8
R	H	CE1	PHE	A	68	L	S	HB3	CYS	V	91
R	H	CE2	PHE	A	68	L	-	HB	THR	V	8
R	H	CE2	PHE	A	68	L	S	HB3	CYS	V	91
R	H	CZ	PHE	A	68	L	-	O	THR	V	8
R	H	CZ	PHE	A	68	L	-	HB	THR	V	8
R	H	CZ	PHE	A	68	L	S	CB	CYS	V	91
R	H	CZ	PHE	A	68	L	S	HB3	CYS	V	91
R	H	CB	PRO	A	95	L	H	HZ2	TRP	V	70
R	H	CG	PRO	A	95	L	H	CZ2	TRP	V	70
R	H	CG	PRO	A	95	L	H	HZ2	TRP	V	70
R	H	CG	PRO	A	95	L	H	HE1	TRP	V	70
R	H	CG2	THR	A	99	L	H	HD23	LEU	V	97
R	H	CG	TYR	A	102	L	H	HD12	LEU	V	97
R	H	CG	TYR	A	102	L	H	HD22	LEU	V	97
R	H	CD1	TYR	A	102	L	H	CD1	LEU	V	97
R	H	CD1	TYR	A	102	L	H	CD2	LEU	V	97
R	H	CD1	TYR	A	102	L	H	HD12	LEU	V	97
R	H	CD1	TYR	A	102	L	H	HD13	LEU	V	97
R	H	CD1	TYR	A	102	L	H	HD22	LEU	V	97
R	H	CD1	TYR	A	102	L	H	HD23	LEU	V	97
R	H	CD2	TYR	A	102	L	H	HD12	LEU	V	97
R	H	CE1	TYR	A	102	L	H	CD1	LEU	V	97
R	H	CE1	TYR	A	102	L	H	CD2	LEU	V	97
R	H	CE1	TYR	A	102	L	H	HB2	LEU	V	97
R	H	CE1	TYR	A	102	L	H	HD12	LEU	V	97
R	H	CE1	TYR	A	102	L	H	HD13	LEU	V	97
R	H	CE1	TYR	A	102	L	H	HD22	LEU	V	97
R	H	CE2	TYR	A	102	L	H	HD12	LEU	V	97
R	H	OH	TYR	A	102	L	H	HD12	LEU	V	97
R	H	CZ	TYR	A	102	L	H	CD1	LEU	V	97
R	H	CZ	TYR	A	102	L	H	HD12	LEU	V	97
R	H	CD1	PHE	A	103	L	H	HB2	SER	V	93
R	H	CD1	PHE	A	103	L	H	HD22	LEU	V	97
R	H	CD2	PHE	A	103	L	H	CD2	LEU	V	97
R	H	CD2	PHE	A	103	L	H	HD21	LEU	V	97
R	H	CD2	PHE	A	103	L	H	HD22	LEU	V	97
R	H	CE1	PHE	A	103	L	H	C	SER	V	93
R	H	CE1	PHE	A	103	L	H	CB	SER	V	93
R	H	CE1	PHE	A	103	L	H	O	SER	V	93
R	H	CE1	PHE	A	103	L	H	HB2	SER	V	93
R	H	CE1	PHE	A	103	L	H	HB3	SER	V	93
R	H	CE1	PHE	A	103	L	H	N	CYS	V	94
R	H	CE1	PHE	A	103	L	H	CA	CYS	V	94
R	H	CE1	PHE	A	103	L	H	HA	CYS	V	94
R	H	CE1	PHE	A	103	L	H	HD21	LEU	V	97
R	H	CE1	PHE	A	103	L	H	HD22	LEU	V	97
R	H	CE2	PHE	A	103	L	H	HA	CYS	V	94
R	H	CE2	PHE	A	103	L	H	CD2	LEU	V	97
R	H	CE2	PHE	A	103	L	H	HD21	LEU	V	97
R	H	CE2	PHE	A	103	L	H	HD22	LEU	V	97
R	H	CE2	PHE	A	103	L	H	HD23	LEU	V	97
R	H	CZ	PHE	A	103	L	H	CA	CYS	V	94
R	H	CZ	PHE	A	103	L	H	HA	CYS	V	94
R	H	CZ	PHE	A	103	L	H	CB	LEU	V	97
R	H	CZ	PHE	A	103	L	H	CD2	LEU	V	97
R	H	CZ	PHE	A	103	L	H	HB2	LEU	V	97
R	H	CZ	PHE	A	103	L	H	HB3	LEU	V	97
R	H	CZ	PHE	A	103	L	H	HD21	LEU	V	97
R	H	CZ	PHE	A	103	L	H	HD22	LEU	V	97
R	H	CZ	PHE	A	103	L	H	HD23	LEU	V	97
R	H	CG1	VAL	A	106	L	H	HG	SER	V	93
R	H	CE1	PHE	A	107	L	H	HG	SER	V	93
R	H	CZ	PHE	A	107	L	S	HG	CYS	V	91
R	H	CZ	PHE	A	107	L	H	HB2	SER	V	93
R	H	CZ	PHE	A	107	L	H	HG	SER	V	93
R	H	C	ASN	A	138	L	-	H	GLY	V	4
R	H	C	ASN	A	138	L	-	HA3	GLY	V	4
R	H	CB	ASN	A	138	L	-	HA	ASN	V	3
R	H	CB	ASN	A	138	L	-	H	GLY	V	4
R	H	O	ASN	A	138	L	-	H	GLY	V	4
R	H	O	ASN	A	138	L	-	HA3	GLY	V	4
R	H	CG	ASN	A	138	L	-	HA	ASN	V	3
R	H	CG	ASN	A	138	L	-	H	GLY	V	4
R	H	ND2	ASN	A	138	L	-	CG	ASN	V	3
R	H	ND2	ASN	A	138	L	-	OD1	ASN	V	3
R	H	ND2	ASN	A	138	L	-	HA	ASN	V	3
R	H	ND2	ASN	A	138	L	-	HB3	ASN	V	3
R	H	CA	PHE	A	142	L	-	CG2	VAL	V	6
R	H	CA	PHE	A	142	L	-	HG21	VAL	V	6
R	H	CA	PHE	A	142	L	-	HG22	VAL	V	6
R	H	CA	PHE	A	142	L	-	HG23	VAL	V	6
R	H	C	PHE	A	142	L	-	HG22	VAL	V	6
R	H	C	PHE	A	142	L	-	HG23	VAL	V	6
R	H	CB	PHE	A	142	L	-	O	GLY	V	4
R	H	CB	PHE	A	142	L	-	HA3	GLY	V	4
R	H	CB	PHE	A	142	L	-	CG2	VAL	V	6
R	H	CB	PHE	A	142	L	-	HG21	VAL	V	6
R	H	CB	PHE	A	142	L	-	HG23	VAL	V	6
R	H	O	PHE	A	142	L	-	CG2	VAL	V	6
R	H	O	PHE	A	142	L	-	HG22	VAL	V	6
R	H	O	PHE	A	142	L	-	HG23	VAL	V	6
R	H	CG	PHE	A	142	L	-	O	GLY	V	4
R	H	CG	PHE	A	142	L	-	HA3	GLY	V	4
R	H	CG	PHE	A	142	L	-	CG2	VAL	V	6
R	H	CG	PHE	A	142	L	-	HG21	VAL	V	6
R	H	CG	PHE	A	142	L	-	HG22	VAL	V	6
R	H	CG	PHE	A	142	L	-	HG23	VAL	V	6
R	H	CD1	PHE	A	142	L	-	HG23	VAL	V	6
R	H	CD2	PHE	A	142	L	-	C	GLY	V	4
R	H	CD2	PHE	A	142	L	-	O	GLY	V	4
R	H	CD2	PHE	A	142	L	-	C	THR	V	5
R	H	CD2	PHE	A	142	L	-	N	VAL	V	6
R	H	CD2	PHE	A	142	L	-	CA	VAL	V	6
R	H	CD2	PHE	A	142	L	-	CB	VAL	V	6
R	H	CD2	PHE	A	142	L	-	CG2	VAL	V	6
R	H	CD2	PHE	A	142	L	-	H	VAL	V	6
R	H	CD2	PHE	A	142	L	-	HA	VAL	V	6
R	H	CD2	PHE	A	142	L	-	HB	VAL	V	6
R	H	CD2	PHE	A	142	L	-	HG13	VAL	V	6
R	H	CD2	PHE	A	142	L	-	HG21	VAL	V	6
R	H	CD2	PHE	A	142	L	-	HG22	VAL	V	6
R	H	CD2	PHE	A	142	L	-	HG23	VAL	V	6
R	H	CE1	PHE	A	142	L	-	HG23	VAL	V	6
R	H	CE1	PHE	A	142	L	-	CB	PRO	V	165
R	H	CE1	PHE	A	142	L	-	HA	PRO	V	165
R	H	CE1	PHE	A	142	L	-	HB2	PRO	V	165
R	H	CE1	PHE	A	142	L	-	HB3	PRO	V	165
R	H	CE1	PHE	A	142	L	-	HB3	CYS	V	167
R	H	CE2	PHE	A	142	L	-	C	THR	V	5
R	H	CE2	PHE	A	142	L	-	N	VAL	V	6
R	H	CE2	PHE	A	142	L	-	CA	VAL	V	6
R	H	CE2	PHE	A	142	L	-	CB	VAL	V	6
R	H	CE2	PHE	A	142	L	-	CG1	VAL	V	6
R	H	CE2	PHE	A	142	L	-	CG2	VAL	V	6
R	H	CE2	PHE	A	142	L	-	H	VAL	V	6
R	H	CE2	PHE	A	142	L	-	HA	VAL	V	6
R	H	CE2	PHE	A	142	L	-	HG13	VAL	V	6
R	H	CE2	PHE	A	142	L	-	HG21	VAL	V	6
R	H	CE2	PHE	A	142	L	-	HG22	VAL	V	6
R	H	CE2	PHE	A	142	L	-	HG23	VAL	V	6
R	H	CE2	PHE	A	142	L	-	H	ILE	V	7
R	H	CE2	PHE	A	142	L	-	O	PHE	V	166
R	H	CE2	PHE	A	142	L	-	HB3	CYS	V	167
R	H	CZ	PHE	A	142	L	-	CA	VAL	V	6
R	H	CZ	PHE	A	142	L	-	CG2	VAL	V	6
R	H	CZ	PHE	A	142	L	-	HA	VAL	V	6
R	H	CZ	PHE	A	142	L	-	HG13	VAL	V	6
R	H	CZ	PHE	A	142	L	-	HG23	VAL	V	6
R	H	CZ	PHE	A	142	L	-	CB	PRO	V	165
R	H	CZ	PHE	A	142	L	-	HA	PRO	V	165
R	H	CZ	PHE	A	142	L	-	HB2	PRO	V	165
R	H	CZ	PHE	A	142	L	-	HB3	PRO	V	165
R	H	CZ	PHE	A	142	L	-	O	PHE	V	166
R	H	CZ	PHE	A	142	L	-	HB3	CYS	V	167
R	H	CB	ILE	A	145	L	-	HG22	VAL	V	6
R	H	CG2	ILE	A	145	L	-	CG2	VAL	V	6
R	H	CG2	ILE	A	145	L	-	HB	VAL	V	6
R	H	CG2	ILE	A	145	L	-	HG12	VAL	V	6
R	H	CG2	ILE	A	145	L	-	HG22	VAL	V	6
R	H	N	LEU	A	146	L	-	HG22	VAL	V	6
R	H	CG	LEU	A	146	L	-	HA	PRO	V	165
R	H	CG	LEU	A	146	L	-	HB3	PRO	V	165
R	H	CD1	LEU	A	146	L	H	HE3	MET	V	92
R	H	CD1	LEU	A	146	L	-	O	LEU	V	164
R	H	CD1	LEU	A	146	L	-	HA	PRO	V	165
R	H	CD2	LEU	A	146	L	H	O	GLN	V	163
R	H	CD2	LEU	A	146	L	-	N	PRO	V	165
R	H	CD2	LEU	A	146	L	-	CA	PRO	V	165
R	H	CD2	LEU	A	146	L	-	CB	PRO	V	165
R	H	CD2	LEU	A	146	L	-	CD	PRO	V	165
R	H	CD2	LEU	A	146	L	-	HA	PRO	V	165
R	H	CD2	LEU	A	146	L	-	HB3	PRO	V	165
R	H	CD2	LEU	A	146	L	-	HD2	PRO	V	165
R	H	OH	TYR	A	149	L	-	HG22	THR	V	8
R	H	CA	ILE	A	150	L	H	CG2	ILE	V	162
R	H	CA	ILE	A	150	L	H	HG21	ILE	V	162
R	H	CA	ILE	A	150	L	H	HG22	ILE	V	162
R	H	CA	ILE	A	150	L	H	HG23	ILE	V	162
R	H	CB	ILE	A	150	L	H	HG21	ILE	V	162
R	H	CB	ILE	A	150	L	H	HA	GLN	V	163
R	H	CB	ILE	A	150	L	H	HG2	GLN	V	163
R	H	O	ILE	A	150	L	H	HG23	ILE	V	162
R	H	CG1	ILE	A	150	L	H	C	ILE	V	162
R	H	CG1	ILE	A	150	L	H	O	ILE	V	162
R	H	CG1	ILE	A	150	L	H	CG2	ILE	V	162
R	H	CG1	ILE	A	150	L	H	HG21	ILE	V	162
R	H	CG1	ILE	A	150	L	H	N	GLN	V	163
R	H	CG1	ILE	A	150	L	H	CA	GLN	V	163
R	H	CG1	ILE	A	150	L	H	HA	GLN	V	163
R	H	CG1	ILE	A	150	L	H	HG2	GLN	V	163
R	H	CG2	ILE	A	150	L	H	HG21	ILE	V	162
R	H	CG2	ILE	A	150	L	H	CG	GLN	V	163
R	H	CG2	ILE	A	150	L	H	HA	GLN	V	163
R	H	CG2	ILE	A	150	L	H	HG2	GLN	V	163
R	H	CG2	ILE	A	150	L	H	HG3	GLN	V	163
R	H	CG2	ILE	A	150	L	H	HE21	GLN	V	163
R	H	CD1	ILE	A	150	L	H	O	ILE	V	162
R	H	CD1	ILE	A	150	L	H	N	GLN	V	163
R	H	CD1	ILE	A	150	L	H	CA	GLN	V	163
R	H	CD1	ILE	A	150	L	H	C	GLN	V	163
R	H	CD1	ILE	A	150	L	H	CB	GLN	V	163
R	H	CD1	ILE	A	150	L	H	O	GLN	V	163
R	H	CD1	ILE	A	150	L	H	CG	GLN	V	163
R	H	CD1	ILE	A	150	L	H	HA	GLN	V	163
R	H	CD1	ILE	A	150	L	H	HB3	GLN	V	163
R	H	CD1	ILE	A	150	L	H	HG2	GLN	V	163
R	H	CA	LEU	A	153	L	H	HG23	ILE	V	162
R	H	CA	LEU	A	153	L	H	HD12	ILE	V	162
R	H	C	LEU	A	153	L	H	HD12	ILE	V	162
R	H	CB	LEU	A	153	L	H	CG2	ILE	V	162
R	H	CB	LEU	A	153	L	H	CD1	ILE	V	162
R	H	CB	LEU	A	153	L	H	HG13	ILE	V	162
R	H	CB	LEU	A	153	L	H	HG22	ILE	V	162
R	H	CB	LEU	A	153	L	H	HG23	ILE	V	162
R	H	CB	LEU	A	153	L	H	HD12	ILE	V	162
R	H	O	LEU	A	153	L	H	HE2	MET	V	159
R	H	O	LEU	A	153	L	H	HD12	ILE	V	162
R	H	CG	LEU	A	153	L	H	CG2	ILE	V	162
R	H	CG	LEU	A	153	L	H	HG13	ILE	V	162
R	H	CG	LEU	A	153	L	H	HG22	ILE	V	162
R	H	CG	LEU	A	153	L	H	HG23	ILE	V	162
R	H	CG	LEU	A	153	L	H	HD12	ILE	V	162
R	H	CD1	LEU	A	153	L	H	CD1	LEU	V	96
R	H	CD1	LEU	A	153	L	H	HD11	LEU	V	96
R	H	CD1	LEU	A	153	L	H	HD13	LEU	V	96
R	H	CD1	LEU	A	153	L	H	CB	ILE	V	162
R	H	CD1	LEU	A	153	L	H	CG1	ILE	V	162
R	H	CD1	LEU	A	153	L	H	CG2	ILE	V	162
R	H	CD1	LEU	A	153	L	H	HG13	ILE	V	162
R	H	CD1	LEU	A	153	L	H	HG21	ILE	V	162
R	H	CD1	LEU	A	153	L	H	HG22	ILE	V	162
R	H	CD1	LEU	A	153	L	H	HG23	ILE	V	162
R	H	CD1	LEU	A	153	L	H	HD12	ILE	V	162
R	H	CD2	LEU	A	153	L	H	HA	SER	V	93
R	H	CD2	LEU	A	153	L	H	HB3	SER	V	93
R	H	CD2	LEU	A	153	L	H	HG13	ILE	V	162
R	H	CD2	LEU	A	153	L	H	HD12	ILE	V	162
R	H	CG2	VAL	A	154	L	H	SD	MET	V	159
R	H	CA	SER	A	157	L	H	HE2	PHE	V	155
R	H	C	SER	A	157	L	H	HE2	PHE	V	155
R	H	CB	SER	A	157	L	H	CE2	PHE	V	155
R	H	CB	SER	A	157	L	H	HE2	PHE	V	155
R	H	CB	SER	A	157	L	H	CE	MET	V	159
R	H	CB	SER	A	157	L	H	HE1	MET	V	159
R	H	CB	SER	A	157	L	H	HE2	MET	V	159
R	H	O	SER	A	157	L	H	HE2	PHE	V	155
R	H	OG	SER	A	157	L	H	HE2	PHE	V	155
R	H	OG	SER	A	157	L	H	CE	MET	V	159
R	H	OG	SER	A	157	L	H	HE1	MET	V	159
R	H	OG	SER	A	157	L	H	HE2	MET	V	159
R	H	CG2	VAL	A	158	L	H	HZ	PHE	V	155
R	H	CA	GLY	A	161	L	H	HZ	PHE	V	151
R	H	CD2	PHE	A	164	L	H	HE2	PHE	V	151
R	H	CE2	PHE	A	164	L	H	HE2	PHE	V	151
R	H	CZ	PHE	A	164	L	H	HZ	PHE	V	101

- 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