IID

P58170_Q8NGQ1.2 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	S	ILE	A	107	L	H	PHE	V	103
R	S	SER	A	108	L	H	TYR	V	102
R	S	SER	A	108	L	H	LEU	V	157
R	H	ALA	A	110	L	H	PHE	V	103
R	H	ALA	A	110	L	H	THR	V	160
R	H	ALA	A	110	L	H	THR	V	99
R	H	GLY	A	111	L	H	TYR	V	102
R	H	GLY	A	111	L	H	PHE	V	103
R	H	GLY	A	111	L	H	THR	V	99
R	H	GLY	A	113	L	H	THR	V	99
R	H	ALA	A	114	L	H	PHE	V	103
R	H	ALA	A	114	L	H	GLY	V	96
R	H	ALA	A	114	L	H	THR	V	99
R	H	GLN	A	115	L	H	THR	V	99
R	H	PHE	A	117	L	H	LYS	V	80
R	H	PHE	A	117	L	-	ILE	V	92
R	H	PHE	A	117	L	-	SER	V	93
R	H	PHE	A	118	L	H	LYS	V	80
R	H	PHE	A	118	L	-	ILE	V	92
R	H	THR	A	157	L	-	GLN	V	88
R	H	ALA	A	161	L	-	GLN	V	88
R	H	TYR	A	164	L	H	VAL	V	83
R	H	TYR	A	164	L	-	SER	V	87
R	H	ILE	A	165	L	-	GLN	V	88
R	H	ILE	A	165	L	-	ASN	V	89
R	H	PHE	A	168	L	H	LYS	V	80
R	H	PHE	A	168	L	-	SER	V	87
R	H	PHE	A	168	L	-	ASN	V	89
R	H	PHE	A	168	L	-	ALA	V	91
R	H	LEU	A	169	L	-	GLN	V	11
R	H	ILE	A	172	L	-	GLN	V	11
R	H	ILE	A	172	L	-	ASN	V	9
R	H	ILE	A	172	L	-	SER	V	93
R	H	ALA	A	173	L	-	ASN	V	9
R	H	ALA	A	176	L	-	ASN	V	9
R	-	ILE	A	23	L	H	PHE	V	161
R	-	THR	A	25	L	H	LEU	V	157
R	S	GLU	A	26	L	H	LEU	V	157
R	H	PHE	A	43	L	H	ILE	V	46
R	H	LEU	A	47	L	H	VAL	V	43
R	H	LEU	A	47	L	H	LEU	V	47
R	H	TYR	A	50	L	H	TYR	V	35
R	H	TYR	A	50	L	H	THR	V	75
R	H	LEU	A	51	L	H	VAL	V	39
R	H	LEU	A	51	L	H	VAL	V	43
R	H	LEU	A	54	L	H	TYR	V	35
R	H	LEU	A	54	L	H	VAL	V	39
R	H	MET	A	58	L	H	LEU	V	32
R	H	MET	A	58	L	H	LEU	V	36
R	H	VAL	A	61	L	H	PHE	V	28
R	H	VAL	A	61	L	H	TRP	V	29
R	H	VAL	A	61	L	H	GLN	V	86
R	H	ILE	A	62	L	H	TRP	V	29
R	H	ILE	A	62	L	H	LEU	V	32
R	H	ILE	A	62	L	H	LEU	V	36
R	H	ARG	A	65	L	H	ARG	V	25
R	H	ARG	A	65	L	H	TRP	V	29
R	H	PHE	A	83	L	H	PHE	V	28
R	H	PHE	A	83	L	H	PRO	V	79
R	H	PHE	A	83	L	H	LEU	V	82
R	H	PHE	A	83	L	H	VAL	V	83
R	H	PHE	A	83	L	H	GLN	V	86
R	H	PHE	A	86	L	H	TYR	V	35
R	H	PHE	A	86	L	H	PRO	V	79
R	H	PHE	A	86	L	H	LEU	V	82
R	H	TRP	A	87	L	H	PRO	V	79
R	H	TRP	A	87	L	H	LYS	V	80
R	H	TRP	A	87	L	H	VAL	V	83
R	H	SER	A	90	L	H	TYR	V	35
R	H	SER	A	90	L	H	THR	V	75
R	H	SER	A	90	L	H	PRO	V	79
R	H	PRO	A	94	L	H	PHE	V	68
R	H	PRO	A	94	L	H	PHE	V	72
R	H	PRO	A	94	L	H	THR	V	75
R	H	LEU	A	97	L	H	PHE	V	68
R	H	ALA	A	98	L	H	PHE	V	68

- 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

P58170_Q8NGQ1.2 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	-	CD1	ILE	A	23	L	H	HE2	PHE	V	161
R	-	CB	THR	A	25	L	H	HD13	LEU	V	157
R	-	CB	THR	A	25	L	H	HD23	LEU	V	157
R	-	O	THR	A	25	L	H	HD22	LEU	V	157
R	S	OE2	GLU	A	26	L	H	HD12	LEU	V	157
R	H	CZ	PHE	A	43	L	H	HG23	ILE	V	46
R	H	CD1	LEU	A	47	L	H	HG12	VAL	V	43
R	H	CD1	LEU	A	47	L	H	HG23	VAL	V	43
R	H	CD2	LEU	A	47	L	H	HG12	VAL	V	43
R	H	CD2	LEU	A	47	L	H	CD2	LEU	V	47
R	H	CD2	LEU	A	47	L	H	HD22	LEU	V	47
R	H	OH	TYR	A	50	L	H	OH	TYR	V	35
R	H	OH	TYR	A	50	L	H	HH	TYR	V	35
R	H	OH	TYR	A	50	L	H	CG2	THR	V	75
R	H	OH	TYR	A	50	L	H	OG1	THR	V	75
R	H	OH	TYR	A	50	L	H	HG21	THR	V	75
R	H	OH	TYR	A	50	L	H	HG22	THR	V	75
R	H	CZ	TYR	A	50	L	H	HH	TYR	V	35
R	H	CG	LEU	A	51	L	H	HG13	VAL	V	43
R	H	CD1	LEU	A	51	L	H	CG1	VAL	V	43
R	H	CD1	LEU	A	51	L	H	HG12	VAL	V	43
R	H	CD1	LEU	A	51	L	H	HG13	VAL	V	43
R	H	CD2	LEU	A	51	L	H	HG11	VAL	V	39
R	H	CD2	LEU	A	51	L	H	HG13	VAL	V	43
R	H	CD2	LEU	A	51	L	H	HG22	VAL	V	43
R	H	CD1	LEU	A	54	L	H	HH	TYR	V	35
R	H	CD1	LEU	A	54	L	H	HG13	VAL	V	39
R	H	CD2	LEU	A	54	L	H	OH	TYR	V	35
R	H	CB	MET	A	58	L	H	HD13	LEU	V	32
R	H	CB	MET	A	58	L	H	HD13	LEU	V	36
R	H	CB	MET	A	58	L	H	HD23	LEU	V	36
R	H	CG	MET	A	58	L	H	HD13	LEU	V	32
R	H	CG	MET	A	58	L	H	HD23	LEU	V	36
R	H	SD	MET	A	58	L	H	CD1	LEU	V	32
R	H	SD	MET	A	58	L	H	HD12	LEU	V	32
R	H	SD	MET	A	58	L	H	HD13	LEU	V	32
R	H	CE	MET	A	58	L	H	CG	LEU	V	32
R	H	CE	MET	A	58	L	H	CD1	LEU	V	32
R	H	CE	MET	A	58	L	H	CD2	LEU	V	32
R	H	CE	MET	A	58	L	H	HG	LEU	V	32
R	H	CE	MET	A	58	L	H	HD11	LEU	V	32
R	H	CE	MET	A	58	L	H	HD12	LEU	V	32
R	H	CE	MET	A	58	L	H	HD13	LEU	V	32
R	H	CE	MET	A	58	L	H	HD21	LEU	V	32
R	H	CE	MET	A	58	L	H	HD22	LEU	V	32
R	H	CE	MET	A	58	L	H	HD23	LEU	V	32
R	H	CE	MET	A	58	L	H	HD13	LEU	V	36
R	H	C	VAL	A	61	L	H	HH2	TRP	V	29
R	H	O	VAL	A	61	L	H	HH2	TRP	V	29
R	H	CG1	VAL	A	61	L	H	HZ	PHE	V	28
R	H	CG1	VAL	A	61	L	H	HE22	GLN	V	86
R	H	N	ILE	A	62	L	H	HH2	TRP	V	29
R	H	CA	ILE	A	62	L	H	CH2	TRP	V	29
R	H	CA	ILE	A	62	L	H	CZ3	TRP	V	29
R	H	CA	ILE	A	62	L	H	HH2	TRP	V	29
R	H	CA	ILE	A	62	L	H	HZ3	TRP	V	29
R	H	C	ILE	A	62	L	H	HH2	TRP	V	29
R	H	CB	ILE	A	62	L	H	CH2	TRP	V	29
R	H	CB	ILE	A	62	L	H	CZ3	TRP	V	29
R	H	CB	ILE	A	62	L	H	HH2	TRP	V	29
R	H	CB	ILE	A	62	L	H	HZ3	TRP	V	29
R	H	O	ILE	A	62	L	H	CH2	TRP	V	29
R	H	O	ILE	A	62	L	H	HH2	TRP	V	29
R	H	O	ILE	A	62	L	H	HZ2	TRP	V	29
R	H	CG1	ILE	A	62	L	H	CH2	TRP	V	29
R	H	CG1	ILE	A	62	L	H	CZ3	TRP	V	29
R	H	CG1	ILE	A	62	L	H	HH2	TRP	V	29
R	H	CG1	ILE	A	62	L	H	HZ3	TRP	V	29
R	H	CG1	ILE	A	62	L	H	CD2	LEU	V	32
R	H	CG1	ILE	A	62	L	H	HD21	LEU	V	32
R	H	CG1	ILE	A	62	L	H	HD23	LEU	V	32
R	H	CG2	ILE	A	62	L	H	CH2	TRP	V	29
R	H	CG2	ILE	A	62	L	H	CZ3	TRP	V	29
R	H	CG2	ILE	A	62	L	H	HH2	TRP	V	29
R	H	CG2	ILE	A	62	L	H	HZ3	TRP	V	29
R	H	CD1	ILE	A	62	L	H	CZ3	TRP	V	29
R	H	CD1	ILE	A	62	L	H	HZ3	TRP	V	29
R	H	CD1	ILE	A	62	L	H	HD23	LEU	V	32
R	H	CD1	ILE	A	62	L	H	HD13	LEU	V	36
R	H	CA	ARG	A	65	L	H	HZ2	TRP	V	29
R	H	C	ARG	A	65	L	H	HZ2	TRP	V	29
R	H	CB	ARG	A	65	L	H	CH2	TRP	V	29
R	H	CB	ARG	A	65	L	H	CZ2	TRP	V	29
R	H	CB	ARG	A	65	L	H	HH2	TRP	V	29
R	H	CB	ARG	A	65	L	H	HZ2	TRP	V	29
R	H	CG	ARG	A	65	L	H	CZ2	TRP	V	29
R	H	CG	ARG	A	65	L	H	HH2	TRP	V	29
R	H	CG	ARG	A	65	L	H	HZ2	TRP	V	29
R	H	CD	ARG	A	65	L	H	HZ2	TRP	V	29
R	H	NE	ARG	A	65	L	H	HZ2	TRP	V	29
R	H	NH1	ARG	A	65	L	H	HD2	ARG	V	25
R	H	NH1	ARG	A	65	L	H	HD3	ARG	V	25
R	H	NH1	ARG	A	65	L	H	HH11	ARG	V	25
R	H	NH1	ARG	A	65	L	H	HE1	TRP	V	29
R	H	NH2	ARG	A	65	L	H	CG	ARG	V	25
R	H	NH2	ARG	A	65	L	H	CD	ARG	V	25
R	H	NH2	ARG	A	65	L	H	HG2	ARG	V	25
R	H	NH2	ARG	A	65	L	H	HD2	ARG	V	25
R	H	NH2	ARG	A	65	L	H	HD3	ARG	V	25
R	H	NH2	ARG	A	65	L	H	HE1	TRP	V	29
R	H	CZ	ARG	A	65	L	H	HG2	ARG	V	25
R	H	CZ	ARG	A	65	L	H	HD2	ARG	V	25
R	H	CZ	ARG	A	65	L	H	HD3	ARG	V	25
R	H	CZ	ARG	A	65	L	H	HE1	TRP	V	29
R	H	CB	PHE	A	83	L	H	OE1	GLN	V	86
R	H	CG	PHE	A	83	L	H	HG23	VAL	V	83
R	H	CG	PHE	A	83	L	H	OE1	GLN	V	86
R	H	CG	PHE	A	83	L	H	HE22	GLN	V	86
R	H	CD1	PHE	A	83	L	H	CG2	VAL	V	83
R	H	CD1	PHE	A	83	L	H	HA	VAL	V	83
R	H	CD1	PHE	A	83	L	H	HG13	VAL	V	83
R	H	CD1	PHE	A	83	L	H	HG21	VAL	V	83
R	H	CD1	PHE	A	83	L	H	HG23	VAL	V	83
R	H	CD1	PHE	A	83	L	H	OE1	GLN	V	86
R	H	CD2	PHE	A	83	L	H	HE2	PHE	V	28
R	H	CD2	PHE	A	83	L	H	HG23	VAL	V	83
R	H	CD2	PHE	A	83	L	H	OE1	GLN	V	86
R	H	CD2	PHE	A	83	L	H	HE22	GLN	V	86
R	H	CE1	PHE	A	83	L	H	N	VAL	V	83
R	H	CE1	PHE	A	83	L	H	CA	VAL	V	83
R	H	CE1	PHE	A	83	L	H	CB	VAL	V	83
R	H	CE1	PHE	A	83	L	H	CG1	VAL	V	83
R	H	CE1	PHE	A	83	L	H	CG2	VAL	V	83
R	H	CE1	PHE	A	83	L	H	HA	VAL	V	83
R	H	CE1	PHE	A	83	L	H	HG13	VAL	V	83
R	H	CE1	PHE	A	83	L	H	HG21	VAL	V	83
R	H	CE1	PHE	A	83	L	H	HG22	VAL	V	83
R	H	CE1	PHE	A	83	L	H	HG23	VAL	V	83
R	H	CE1	PHE	A	83	L	H	OE1	GLN	V	86
R	H	CE2	PHE	A	83	L	H	HE2	PHE	V	28
R	H	CE2	PHE	A	83	L	H	C	LEU	V	82
R	H	CE2	PHE	A	83	L	H	CB	LEU	V	82
R	H	CE2	PHE	A	83	L	H	HB2	LEU	V	82
R	H	CE2	PHE	A	83	L	H	HB3	LEU	V	82
R	H	CE2	PHE	A	83	L	H	N	VAL	V	83
R	H	CE2	PHE	A	83	L	H	CG2	VAL	V	83
R	H	CE2	PHE	A	83	L	H	H	VAL	V	83
R	H	CE2	PHE	A	83	L	H	HA	VAL	V	83
R	H	CE2	PHE	A	83	L	H	HG21	VAL	V	83
R	H	CE2	PHE	A	83	L	H	HG23	VAL	V	83
R	H	CE2	PHE	A	83	L	H	OE1	GLN	V	86
R	H	CZ	PHE	A	83	L	H	HE2	PHE	V	28
R	H	CZ	PHE	A	83	L	H	O	PRO	V	79
R	H	CZ	PHE	A	83	L	H	C	LEU	V	82
R	H	CZ	PHE	A	83	L	H	O	LEU	V	82
R	H	CZ	PHE	A	83	L	H	HB2	LEU	V	82
R	H	CZ	PHE	A	83	L	H	HB3	LEU	V	82
R	H	CZ	PHE	A	83	L	H	N	VAL	V	83
R	H	CZ	PHE	A	83	L	H	CA	VAL	V	83
R	H	CZ	PHE	A	83	L	H	CB	VAL	V	83
R	H	CZ	PHE	A	83	L	H	CG2	VAL	V	83
R	H	CZ	PHE	A	83	L	H	H	VAL	V	83
R	H	CZ	PHE	A	83	L	H	HA	VAL	V	83
R	H	CZ	PHE	A	83	L	H	HB	VAL	V	83
R	H	CZ	PHE	A	83	L	H	HG13	VAL	V	83
R	H	CZ	PHE	A	83	L	H	HG21	VAL	V	83
R	H	CZ	PHE	A	83	L	H	HG22	VAL	V	83
R	H	CZ	PHE	A	83	L	H	HG23	VAL	V	83
R	H	CZ	PHE	A	83	L	H	OE1	GLN	V	86
R	H	CD1	PHE	A	86	L	H	HB3	PRO	V	79
R	H	CD2	PHE	A	86	L	H	HE1	TYR	V	35
R	H	CE1	PHE	A	86	L	H	CB	PRO	V	79
R	H	CE1	PHE	A	86	L	H	HA	PRO	V	79
R	H	CE1	PHE	A	86	L	H	HB3	PRO	V	79
R	H	CE1	PHE	A	86	L	H	HG3	PRO	V	79
R	H	CE1	PHE	A	86	L	H	HD11	LEU	V	82
R	H	CE2	PHE	A	86	L	H	CE1	TYR	V	35
R	H	CE2	PHE	A	86	L	H	OH	TYR	V	35
R	H	CE2	PHE	A	86	L	H	CZ	TYR	V	35
R	H	CE2	PHE	A	86	L	H	HE1	TYR	V	35
R	H	CZ	PHE	A	86	L	H	CD1	TYR	V	35
R	H	CZ	PHE	A	86	L	H	CE1	TYR	V	35
R	H	CZ	PHE	A	86	L	H	OH	TYR	V	35
R	H	CZ	PHE	A	86	L	H	CZ	TYR	V	35
R	H	CZ	PHE	A	86	L	H	HD1	TYR	V	35
R	H	CZ	PHE	A	86	L	H	HE1	TYR	V	35
R	H	CZ	PHE	A	86	L	H	HB3	PRO	V	79
R	H	CZ	PHE	A	86	L	H	HG3	PRO	V	79
R	H	CB	TRP	A	87	L	H	HG22	VAL	V	83
R	H	CG	TRP	A	87	L	H	CG2	VAL	V	83
R	H	CG	TRP	A	87	L	H	HG22	VAL	V	83
R	H	CD1	TRP	A	87	L	H	HB2	PRO	V	79
R	H	CD1	TRP	A	87	L	H	HG22	VAL	V	83
R	H	CD2	TRP	A	87	L	H	CG2	VAL	V	83
R	H	CD2	TRP	A	87	L	H	HG12	VAL	V	83
R	H	CD2	TRP	A	87	L	H	HG21	VAL	V	83
R	H	CD2	TRP	A	87	L	H	HG22	VAL	V	83
R	H	CD2	TRP	A	87	L	H	HG23	VAL	V	83
R	H	CE2	TRP	A	87	L	H	HA	LYS	V	80
R	H	CE2	TRP	A	87	L	H	HD2	LYS	V	80
R	H	CE2	TRP	A	87	L	H	HD3	LYS	V	80
R	H	CE2	TRP	A	87	L	H	CG2	VAL	V	83
R	H	CE2	TRP	A	87	L	H	HG12	VAL	V	83
R	H	CE2	TRP	A	87	L	H	HG22	VAL	V	83
R	H	CE3	TRP	A	87	L	H	CB	VAL	V	83
R	H	CE3	TRP	A	87	L	H	CG1	VAL	V	83
R	H	CE3	TRP	A	87	L	H	CG2	VAL	V	83
R	H	CE3	TRP	A	87	L	H	HB	VAL	V	83
R	H	CE3	TRP	A	87	L	H	HG12	VAL	V	83
R	H	CE3	TRP	A	87	L	H	HG13	VAL	V	83
R	H	CE3	TRP	A	87	L	H	HG21	VAL	V	83
R	H	CE3	TRP	A	87	L	H	HG22	VAL	V	83
R	H	CE3	TRP	A	87	L	H	HG23	VAL	V	83
R	H	NE1	TRP	A	87	L	H	HG22	VAL	V	83
R	H	CH2	TRP	A	87	L	H	CD	LYS	V	80
R	H	CH2	TRP	A	87	L	H	NZ	LYS	V	80
R	H	CH2	TRP	A	87	L	H	HA	LYS	V	80
R	H	CH2	TRP	A	87	L	H	HD2	LYS	V	80
R	H	CH2	TRP	A	87	L	H	HD3	LYS	V	80
R	H	CH2	TRP	A	87	L	H	HZ2	LYS	V	80
R	H	CH2	TRP	A	87	L	H	HZ3	LYS	V	80
R	H	CH2	TRP	A	87	L	H	CB	VAL	V	83
R	H	CH2	TRP	A	87	L	H	CG1	VAL	V	83
R	H	CH2	TRP	A	87	L	H	CG2	VAL	V	83
R	H	CH2	TRP	A	87	L	H	HB	VAL	V	83
R	H	CH2	TRP	A	87	L	H	HG11	VAL	V	83
R	H	CH2	TRP	A	87	L	H	HG12	VAL	V	83
R	H	CH2	TRP	A	87	L	H	HG13	VAL	V	83
R	H	CH2	TRP	A	87	L	H	HG22	VAL	V	83
R	H	CZ2	TRP	A	87	L	H	CD	LYS	V	80
R	H	CZ2	TRP	A	87	L	H	NZ	LYS	V	80
R	H	CZ2	TRP	A	87	L	H	HA	LYS	V	80
R	H	CZ2	TRP	A	87	L	H	HD2	LYS	V	80
R	H	CZ2	TRP	A	87	L	H	HD3	LYS	V	80
R	H	CZ2	TRP	A	87	L	H	HZ2	LYS	V	80
R	H	CZ2	TRP	A	87	L	H	HZ3	LYS	V	80
R	H	CZ2	TRP	A	87	L	H	HB	VAL	V	83
R	H	CZ2	TRP	A	87	L	H	HG12	VAL	V	83
R	H	CZ2	TRP	A	87	L	H	HG22	VAL	V	83
R	H	CZ3	TRP	A	87	L	H	CB	VAL	V	83
R	H	CZ3	TRP	A	87	L	H	CG1	VAL	V	83
R	H	CZ3	TRP	A	87	L	H	CG2	VAL	V	83
R	H	CZ3	TRP	A	87	L	H	HB	VAL	V	83
R	H	CZ3	TRP	A	87	L	H	HG11	VAL	V	83
R	H	CZ3	TRP	A	87	L	H	HG12	VAL	V	83
R	H	CZ3	TRP	A	87	L	H	HG13	VAL	V	83
R	H	CZ3	TRP	A	87	L	H	HG21	VAL	V	83
R	H	CZ3	TRP	A	87	L	H	HG22	VAL	V	83
R	H	CZ3	TRP	A	87	L	H	HG23	VAL	V	83
R	H	CA	SER	A	90	L	H	CG2	THR	V	75
R	H	CA	SER	A	90	L	H	HG21	THR	V	75
R	H	CA	SER	A	90	L	H	HG22	THR	V	75
R	H	CA	SER	A	90	L	H	HG23	THR	V	75
R	H	C	SER	A	90	L	H	CG2	THR	V	75
R	H	C	SER	A	90	L	H	HG21	THR	V	75
R	H	C	SER	A	90	L	H	HG22	THR	V	75
R	H	C	SER	A	90	L	H	HG23	THR	V	75
R	H	CB	SER	A	90	L	H	CG2	THR	V	75
R	H	CB	SER	A	90	L	H	HG21	THR	V	75
R	H	CB	SER	A	90	L	H	HG22	THR	V	75
R	H	CB	SER	A	90	L	H	HG23	THR	V	75
R	H	CB	SER	A	90	L	H	HG2	PRO	V	79
R	H	O	SER	A	90	L	H	CG2	THR	V	75
R	H	O	SER	A	90	L	H	HG21	THR	V	75
R	H	O	SER	A	90	L	H	HG22	THR	V	75
R	H	O	SER	A	90	L	H	HG23	THR	V	75
R	H	OG	SER	A	90	L	H	OH	TYR	V	35
R	H	OG	SER	A	90	L	H	HG22	THR	V	75
R	H	OG	SER	A	90	L	H	HG2	PRO	V	79
R	H	CB	PRO	A	94	L	H	CD2	PHE	V	72
R	H	CB	PRO	A	94	L	H	HD2	PHE	V	72
R	H	CB	PRO	A	94	L	H	HE2	PHE	V	72
R	H	CB	PRO	A	94	L	H	HG21	THR	V	75
R	H	O	PRO	A	94	L	H	HE2	PHE	V	68
R	H	O	PRO	A	94	L	H	HZ	PHE	V	68
R	H	CG	PRO	A	94	L	H	HD2	PHE	V	72
R	H	CG	PRO	A	94	L	H	CG2	THR	V	75
R	H	CG	PRO	A	94	L	H	HB	THR	V	75
R	H	CG	PRO	A	94	L	H	HG21	THR	V	75
R	H	CG	PRO	A	94	L	H	HG22	THR	V	75
R	H	CG	PRO	A	94	L	H	HG23	THR	V	75
R	H	CD	PRO	A	94	L	H	HG21	THR	V	75
R	H	C	LEU	A	97	L	H	HE2	PHE	V	68
R	H	C	LEU	A	97	L	H	HZ	PHE	V	68
R	H	CB	LEU	A	97	L	H	HE2	PHE	V	68
R	H	N	ALA	A	98	L	H	CE2	PHE	V	68
R	H	N	ALA	A	98	L	H	CZ	PHE	V	68
R	H	N	ALA	A	98	L	H	HE2	PHE	V	68
R	H	N	ALA	A	98	L	H	HZ	PHE	V	68
R	H	CA	ALA	A	98	L	H	CE2	PHE	V	68
R	H	CA	ALA	A	98	L	H	CZ	PHE	V	68
R	H	CA	ALA	A	98	L	H	HE2	PHE	V	68
R	H	CA	ALA	A	98	L	H	HZ	PHE	V	68
R	H	C	ALA	A	98	L	H	HZ	PHE	V	68
R	H	CB	ALA	A	98	L	H	CE1	PHE	V	68
R	H	CB	ALA	A	98	L	H	CE2	PHE	V	68
R	H	CB	ALA	A	98	L	H	CZ	PHE	V	68
R	H	CB	ALA	A	98	L	H	HE1	PHE	V	68
R	H	CB	ALA	A	98	L	H	HE2	PHE	V	68
R	H	CB	ALA	A	98	L	H	HZ	PHE	V	68
R	S	CG1	ILE	A	107	L	H	HZ	PHE	V	103
R	S	CD1	ILE	A	107	L	H	HZ	PHE	V	103
R	S	N	SER	A	108	L	H	HE1	TYR	V	102
R	S	CA	SER	A	108	L	H	HD22	LEU	V	157
R	S	CB	SER	A	108	L	H	CD1	TYR	V	102
R	S	CB	SER	A	108	L	H	CE1	TYR	V	102
R	S	CB	SER	A	108	L	H	OH	TYR	V	102
R	S	CB	SER	A	108	L	H	CZ	TYR	V	102
R	S	CB	SER	A	108	L	H	HE1	TYR	V	102
R	S	CB	SER	A	108	L	H	CD2	LEU	V	157
R	S	CB	SER	A	108	L	H	HD22	LEU	V	157
R	S	OG	SER	A	108	L	H	CG	TYR	V	102
R	S	OG	SER	A	108	L	H	CD1	TYR	V	102
R	S	OG	SER	A	108	L	H	CE1	TYR	V	102
R	S	OG	SER	A	108	L	H	OH	TYR	V	102
R	S	OG	SER	A	108	L	H	CZ	TYR	V	102
R	S	OG	SER	A	108	L	H	HD1	TYR	V	102
R	S	OG	SER	A	108	L	H	HE1	TYR	V	102
R	H	CA	ALA	A	110	L	H	OG1	THR	V	99
R	H	CA	ALA	A	110	L	H	HA	THR	V	99
R	H	CA	ALA	A	110	L	H	HG1	THR	V	99
R	H	CA	ALA	A	110	L	H	HG23	THR	V	99
R	H	C	ALA	A	110	L	H	CB	THR	V	99
R	H	C	ALA	A	110	L	H	CG2	THR	V	99
R	H	C	ALA	A	110	L	H	OG1	THR	V	99
R	H	C	ALA	A	110	L	H	HA	THR	V	99
R	H	C	ALA	A	110	L	H	HG1	THR	V	99
R	H	C	ALA	A	110	L	H	HG21	THR	V	99
R	H	C	ALA	A	110	L	H	HG22	THR	V	99
R	H	C	ALA	A	110	L	H	HG23	THR	V	99
R	H	CB	ALA	A	110	L	H	CA	THR	V	99
R	H	CB	ALA	A	110	L	H	OG1	THR	V	99
R	H	CB	ALA	A	110	L	H	HA	THR	V	99
R	H	CB	ALA	A	110	L	H	HG23	THR	V	99
R	H	CB	ALA	A	110	L	H	HG21	THR	V	160
R	H	O	ALA	A	110	L	H	CA	THR	V	99
R	H	O	ALA	A	110	L	H	CB	THR	V	99
R	H	O	ALA	A	110	L	H	CG2	THR	V	99
R	H	O	ALA	A	110	L	H	OG1	THR	V	99
R	H	O	ALA	A	110	L	H	HA	THR	V	99
R	H	O	ALA	A	110	L	H	HB	THR	V	99
R	H	O	ALA	A	110	L	H	HG1	THR	V	99
R	H	O	ALA	A	110	L	H	HG21	THR	V	99
R	H	O	ALA	A	110	L	H	HG22	THR	V	99
R	H	O	ALA	A	110	L	H	HG23	THR	V	99
R	H	O	ALA	A	110	L	H	HE2	PHE	V	103
R	H	N	GLY	A	111	L	H	CG2	THR	V	99
R	H	N	GLY	A	111	L	H	HG21	THR	V	99
R	H	N	GLY	A	111	L	H	HG22	THR	V	99
R	H	N	GLY	A	111	L	H	HG23	THR	V	99
R	H	N	GLY	A	111	L	H	HD1	TYR	V	102
R	H	N	GLY	A	111	L	H	CE2	PHE	V	103
R	H	N	GLY	A	111	L	H	HE2	PHE	V	103
R	H	N	GLY	A	111	L	H	HZ	PHE	V	103
R	H	CA	GLY	A	111	L	H	CG2	THR	V	99
R	H	CA	GLY	A	111	L	H	HG21	THR	V	99
R	H	CA	GLY	A	111	L	H	HG22	THR	V	99
R	H	CA	GLY	A	111	L	H	HG23	THR	V	99
R	H	CA	GLY	A	111	L	H	CE2	PHE	V	103
R	H	CA	GLY	A	111	L	H	CZ	PHE	V	103
R	H	CA	GLY	A	111	L	H	HE2	PHE	V	103
R	H	CA	GLY	A	111	L	H	HZ	PHE	V	103
R	H	C	GLY	A	111	L	H	CG2	THR	V	99
R	H	C	GLY	A	111	L	H	HG21	THR	V	99
R	H	C	GLY	A	111	L	H	HG23	THR	V	99
R	H	C	GLY	A	111	L	H	CE2	PHE	V	103
R	H	C	GLY	A	111	L	H	CZ	PHE	V	103
R	H	C	GLY	A	111	L	H	HE2	PHE	V	103
R	H	C	GLY	A	111	L	H	HZ	PHE	V	103
R	H	O	GLY	A	111	L	H	CG2	THR	V	99
R	H	O	GLY	A	111	L	H	HG21	THR	V	99
R	H	O	GLY	A	111	L	H	HG23	THR	V	99
R	H	O	GLY	A	111	L	H	CE2	PHE	V	103
R	H	O	GLY	A	111	L	H	HE2	PHE	V	103
R	H	O	GLY	A	111	L	H	HZ	PHE	V	103
R	H	C	GLY	A	113	L	H	HG21	THR	V	99
R	H	N	ALA	A	114	L	H	CG2	THR	V	99
R	H	N	ALA	A	114	L	H	OG1	THR	V	99
R	H	N	ALA	A	114	L	H	HG1	THR	V	99
R	H	N	ALA	A	114	L	H	HG21	THR	V	99
R	H	N	ALA	A	114	L	H	HG23	THR	V	99
R	H	CA	ALA	A	114	L	H	CG2	THR	V	99
R	H	CA	ALA	A	114	L	H	HB	THR	V	99
R	H	CA	ALA	A	114	L	H	HG21	THR	V	99
R	H	CA	ALA	A	114	L	H	HG22	THR	V	99
R	H	C	ALA	A	114	L	H	HG21	THR	V	99
R	H	CB	ALA	A	114	L	H	HA3	GLY	V	96
R	H	CB	ALA	A	114	L	H	CB	THR	V	99
R	H	CB	ALA	A	114	L	H	CG2	THR	V	99
R	H	CB	ALA	A	114	L	H	OG1	THR	V	99
R	H	CB	ALA	A	114	L	H	HB	THR	V	99
R	H	CB	ALA	A	114	L	H	HG1	THR	V	99
R	H	CB	ALA	A	114	L	H	HG21	THR	V	99
R	H	CB	ALA	A	114	L	H	HG22	THR	V	99
R	H	CB	ALA	A	114	L	H	HG23	THR	V	99
R	H	CB	ALA	A	114	L	H	HE2	PHE	V	103
R	H	N	GLN	A	115	L	H	HG21	THR	V	99
R	H	CG	PHE	A	117	L	-	HG	SER	V	93
R	H	CD2	PHE	A	117	L	-	HG	SER	V	93
R	H	CE1	PHE	A	117	L	H	HZ2	LYS	V	80
R	H	CE1	PHE	A	117	L	-	HG13	ILE	V	92
R	H	CE1	PHE	A	117	L	-	H	SER	V	93
R	H	CE2	PHE	A	117	L	-	OG	SER	V	93
R	H	CE2	PHE	A	117	L	-	HB3	SER	V	93
R	H	CE2	PHE	A	117	L	-	HG	SER	V	93
R	H	CZ	PHE	A	117	L	-	H	SER	V	93
R	H	CZ	PHE	A	117	L	-	HB3	SER	V	93
R	H	CG	PHE	A	118	L	H	HD3	LYS	V	80
R	H	CD1	PHE	A	118	L	H	CD	LYS	V	80
R	H	CD1	PHE	A	118	L	H	CE	LYS	V	80
R	H	CD1	PHE	A	118	L	H	NZ	LYS	V	80
R	H	CD1	PHE	A	118	L	H	HD3	LYS	V	80
R	H	CD1	PHE	A	118	L	H	HE3	LYS	V	80
R	H	CD1	PHE	A	118	L	H	HZ2	LYS	V	80
R	H	CE1	PHE	A	118	L	H	CG	LYS	V	80
R	H	CE1	PHE	A	118	L	H	CD	LYS	V	80
R	H	CE1	PHE	A	118	L	H	CE	LYS	V	80
R	H	CE1	PHE	A	118	L	H	NZ	LYS	V	80
R	H	CE1	PHE	A	118	L	H	HG2	LYS	V	80
R	H	CE1	PHE	A	118	L	H	HD2	LYS	V	80
R	H	CE1	PHE	A	118	L	H	HD3	LYS	V	80
R	H	CE1	PHE	A	118	L	H	HE2	LYS	V	80
R	H	CE1	PHE	A	118	L	H	HE3	LYS	V	80
R	H	CE1	PHE	A	118	L	H	HZ1	LYS	V	80
R	H	CE1	PHE	A	118	L	H	HZ2	LYS	V	80
R	H	CE2	PHE	A	118	L	H	HD3	LYS	V	80
R	H	CZ	PHE	A	118	L	H	CG	LYS	V	80
R	H	CZ	PHE	A	118	L	H	CD	LYS	V	80
R	H	CZ	PHE	A	118	L	H	CE	LYS	V	80
R	H	CZ	PHE	A	118	L	H	HG2	LYS	V	80
R	H	CZ	PHE	A	118	L	H	HD3	LYS	V	80
R	H	CZ	PHE	A	118	L	H	HE3	LYS	V	80
R	H	CZ	PHE	A	118	L	H	HZ2	LYS	V	80
R	H	CZ	PHE	A	118	L	-	HG13	ILE	V	92
R	H	CZ	PHE	A	118	L	-	HD11	ILE	V	92
R	H	CG2	THR	A	157	L	-	NE2	GLN	V	88
R	H	CG2	THR	A	157	L	-	HE21	GLN	V	88
R	H	CG2	THR	A	157	L	-	HE22	GLN	V	88
R	H	CA	ALA	A	161	L	-	HB2	GLN	V	88
R	H	CB	ALA	A	161	L	-	CB	GLN	V	88
R	H	CB	ALA	A	161	L	-	CG	GLN	V	88
R	H	CB	ALA	A	161	L	-	CD	GLN	V	88
R	H	CB	ALA	A	161	L	-	NE2	GLN	V	88
R	H	CB	ALA	A	161	L	-	OE1	GLN	V	88
R	H	CB	ALA	A	161	L	-	HB2	GLN	V	88
R	H	CB	ALA	A	161	L	-	HG2	GLN	V	88
R	H	CB	ALA	A	161	L	-	HE22	GLN	V	88
R	H	CB	TYR	A	164	L	-	OG	SER	V	87
R	H	CB	TYR	A	164	L	-	HG	SER	V	87
R	H	CG	TYR	A	164	L	-	OG	SER	V	87
R	H	CG	TYR	A	164	L	-	HB3	SER	V	87
R	H	CD1	TYR	A	164	L	H	HG13	VAL	V	83
R	H	CD1	TYR	A	164	L	-	HB3	SER	V	87
R	H	CD2	TYR	A	164	L	-	HA	SER	V	87
R	H	CE1	TYR	A	164	L	H	CG1	VAL	V	83
R	H	CE1	TYR	A	164	L	H	HG12	VAL	V	83
R	H	CE1	TYR	A	164	L	H	HG13	VAL	V	83
R	H	CE1	TYR	A	164	L	-	HB3	SER	V	87
R	H	OH	TYR	A	164	L	H	HG13	VAL	V	83
R	H	CZ	TYR	A	164	L	H	HG13	VAL	V	83
R	H	N	ILE	A	165	L	-	HB2	ASN	V	89
R	H	N	ILE	A	165	L	-	HD21	ASN	V	89
R	H	CA	ILE	A	165	L	-	ND2	ASN	V	89
R	H	CA	ILE	A	165	L	-	HB2	ASN	V	89
R	H	CA	ILE	A	165	L	-	HB3	ASN	V	89
R	H	CA	ILE	A	165	L	-	HD21	ASN	V	89
R	H	C	ILE	A	165	L	-	HD21	ASN	V	89
R	H	CB	ILE	A	165	L	-	HB3	ASN	V	89
R	H	CB	ILE	A	165	L	-	HD21	ASN	V	89
R	H	O	ILE	A	165	L	-	HD21	ASN	V	89
R	H	CG1	ILE	A	165	L	-	CB	ASN	V	89
R	H	CG1	ILE	A	165	L	-	H	ASN	V	89
R	H	CG1	ILE	A	165	L	-	HB2	ASN	V	89
R	H	CG1	ILE	A	165	L	-	HB3	ASN	V	89
R	H	CG1	ILE	A	165	L	-	HD21	ASN	V	89
R	H	CG2	ILE	A	165	L	-	HD21	ASN	V	89
R	H	CD1	ILE	A	165	L	-	HB2	GLN	V	88
R	H	CD1	ILE	A	165	L	-	HB3	ASN	V	89
R	H	CB	PHE	A	168	L	-	ND2	ASN	V	89
R	H	CB	PHE	A	168	L	-	HD21	ASN	V	89
R	H	CB	PHE	A	168	L	-	HD22	ASN	V	89
R	H	CG	PHE	A	168	L	-	ND2	ASN	V	89
R	H	CG	PHE	A	168	L	-	HD21	ASN	V	89
R	H	CG	PHE	A	168	L	-	HD22	ASN	V	89
R	H	CD1	PHE	A	168	L	H	HZ1	LYS	V	80
R	H	CD1	PHE	A	168	L	-	O	ALA	V	91
R	H	CD2	PHE	A	168	L	-	HG	SER	V	87
R	H	CD2	PHE	A	168	L	-	O	ASN	V	89
R	H	CD2	PHE	A	168	L	-	ND2	ASN	V	89
R	H	CD2	PHE	A	168	L	-	HB2	ASN	V	89
R	H	CD2	PHE	A	168	L	-	HD21	ASN	V	89
R	H	CE1	PHE	A	168	L	H	NZ	LYS	V	80
R	H	CE1	PHE	A	168	L	H	HZ1	LYS	V	80
R	H	CE1	PHE	A	168	L	H	HZ2	LYS	V	80
R	H	CE1	PHE	A	168	L	H	HZ3	LYS	V	80
R	H	CE1	PHE	A	168	L	-	O	ALA	V	91
R	H	CE2	PHE	A	168	L	H	HZ3	LYS	V	80
R	H	CE2	PHE	A	168	L	-	HG	SER	V	87
R	H	CE2	PHE	A	168	L	-	O	ASN	V	89
R	H	CE2	PHE	A	168	L	-	HB2	ASN	V	89
R	H	CZ	PHE	A	168	L	H	NZ	LYS	V	80
R	H	CZ	PHE	A	168	L	H	HZ1	LYS	V	80
R	H	CZ	PHE	A	168	L	H	HZ2	LYS	V	80
R	H	CZ	PHE	A	168	L	H	HZ3	LYS	V	80
R	H	CZ	PHE	A	168	L	-	O	ASN	V	89
R	H	CD2	LEU	A	169	L	-	NE2	GLN	V	11
R	H	CD2	LEU	A	169	L	-	HE22	GLN	V	11
R	H	C	ILE	A	172	L	-	HD22	ASN	V	9
R	H	CB	ILE	A	172	L	-	HD22	ASN	V	9
R	H	CB	ILE	A	172	L	-	NE2	GLN	V	11
R	H	CB	ILE	A	172	L	-	HE21	GLN	V	11
R	H	CB	ILE	A	172	L	-	HE22	GLN	V	11
R	H	O	ILE	A	172	L	-	HD22	ASN	V	9
R	H	CG1	ILE	A	172	L	-	NE2	GLN	V	11
R	H	CG1	ILE	A	172	L	-	HG2	GLN	V	11
R	H	CG1	ILE	A	172	L	-	HE21	GLN	V	11
R	H	CG1	ILE	A	172	L	-	HE22	GLN	V	11
R	H	CG1	ILE	A	172	L	-	HB3	SER	V	93
R	H	CG2	ILE	A	172	L	-	CG	ASN	V	9
R	H	CG2	ILE	A	172	L	-	ND2	ASN	V	9
R	H	CG2	ILE	A	172	L	-	OD1	ASN	V	9
R	H	CG2	ILE	A	172	L	-	HD21	ASN	V	9
R	H	CG2	ILE	A	172	L	-	HD22	ASN	V	9
R	H	CG2	ILE	A	172	L	-	NE2	GLN	V	11
R	H	CG2	ILE	A	172	L	-	HG2	GLN	V	11
R	H	CG2	ILE	A	172	L	-	HE21	GLN	V	11
R	H	CG2	ILE	A	172	L	-	HE22	GLN	V	11
R	H	CD1	ILE	A	172	L	-	CG	GLN	V	11
R	H	CD1	ILE	A	172	L	-	CD	GLN	V	11
R	H	CD1	ILE	A	172	L	-	NE2	GLN	V	11
R	H	CD1	ILE	A	172	L	-	OE1	GLN	V	11
R	H	CD1	ILE	A	172	L	-	HG2	GLN	V	11
R	H	CD1	ILE	A	172	L	-	HE21	GLN	V	11
R	H	CD1	ILE	A	172	L	-	HE22	GLN	V	11
R	H	N	ALA	A	173	L	-	HD22	ASN	V	9
R	H	CB	ALA	A	176	L	-	HD22	ASN	V	9

- 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