IID

P58170_Q8NGE5.1 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	GLN	V	86
R	H	PRO	A	154	L	H	LEU	V	47
R	H	LEU	A	158	L	H	VAL	V	43
R	H	LEU	A	158	L	H	LEU	V	47
R	H	TRP	A	162	L	H	TYR	V	35
R	H	TRP	A	162	L	H	LEU	V	36
R	H	TRP	A	162	L	H	VAL	V	39
R	H	TRP	A	162	L	H	LEU	V	40
R	H	ALA	A	165	L	H	TYR	V	35
R	H	ALA	A	165	L	H	THR	V	75
R	H	ALA	A	165	L	H	PRO	V	79
R	-	LEU	A	166	L	H	TYR	V	35
R	-	PRO	A	167	L	H	PRO	V	79
R	-	PRO	A	167	L	H	VAL	V	83
R	-	THR	A	189	L	H	PHE	V	28
R	-	THR	A	189	L	H	VAL	V	83
R	-	THR	A	189	L	H	GLN	V	86
R	-	VAL	A	190	L	H	PHE	V	28
R	-	VAL	A	190	L	H	LEU	V	32
R	-	VAL	A	190	L	H	LEU	V	82
R	-	VAL	A	190	L	H	GLN	V	86
R	-	ASP	A	191	L	H	PHE	V	28
R	-	ASP	A	191	L	H	TRP	V	29
R	-	ASP	A	191	L	H	LEU	V	32
R	-	ASP	A	191	L	H	LEU	V	36
R	H	MET	A	194	L	H	SER	V	33
R	H	MET	A	194	L	H	LEU	V	36
R	H	MET	A	194	L	H	VAL	V	37
R	H	MET	A	194	L	H	LEU	V	40
R	H	TYR	A	195	L	H	LEU	V	36
R	H	GLN	A	198	L	-	LEU	V	304
R	H	GLN	A	198	L	H	LEU	V	40
R	-	ILE	A	2	L	H	GLN	V	86
R	-	ILE	A	2	L	-	SER	V	87
R	-	ILE	A	2	L	-	GLN	V	88
R	H	ALA	A	201	L	-	PRO	V	307
R	H	LEU	A	204	L	-	PRO	V	307
R	H	LEU	A	204	L	-	PHE	V	308
R	H	LEU	A	205	L	-	VAL	V	303
R	H	LEU	A	205	L	-	ARG	V	306
R	H	LEU	A	205	L	-	PRO	V	307
R	H	CYS	A	212	L	-	ARG	V	310
R	H	CYS	A	212	L	-	PRO	V	311
R	H	VAL	A	216	L	-	PRO	V	311
R	-	CYS	A	3	L	H	VAL	V	83
R	-	CYS	A	3	L	-	SER	V	87
R	-	GLU	A	4	L	-	SER	V	87
R	-	GLU	A	4	L	-	ASN	V	89
R	-	ASN	A	5	L	-	ASN	V	89
R	-	HIS	A	6	L	H	LYS	V	80
R	-	HIS	A	6	L	H	VAL	V	83
R	-	HIS	A	6	L	H	ASN	V	84
R	-	HIS	A	6	L	-	SER	V	87
R	-	HIS	A	6	L	-	ASN	V	89
R	-	HIS	A	6	L	-	LYS	V	90
R	-	HIS	A	6	L	-	ALA	V	91

- 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_Q8NGE5.1 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	-	O	MET	A	1	L	H	OE1	GLN	V	86
R	-	O	MET	A	1	L	H	HB2	GLN	V	86
R	-	N	ILE	A	2	L	H	HB2	GLN	V	86
R	-	CA	ILE	A	2	L	H	C	GLN	V	86
R	-	CA	ILE	A	2	L	H	O	GLN	V	86
R	-	CA	ILE	A	2	L	H	HB2	GLN	V	86
R	-	CA	ILE	A	2	L	-	HA	SER	V	87
R	-	C	ILE	A	2	L	-	HA	SER	V	87
R	-	CB	ILE	A	2	L	H	C	GLN	V	86
R	-	CB	ILE	A	2	L	H	O	GLN	V	86
R	-	CB	ILE	A	2	L	H	HB2	GLN	V	86
R	-	CB	ILE	A	2	L	-	HA	SER	V	87
R	-	CG1	ILE	A	2	L	H	C	GLN	V	86
R	-	CG1	ILE	A	2	L	H	O	GLN	V	86
R	-	CG1	ILE	A	2	L	H	HA	GLN	V	86
R	-	CG1	ILE	A	2	L	H	HB2	GLN	V	86
R	-	CG2	ILE	A	2	L	H	CA	GLN	V	86
R	-	CG2	ILE	A	2	L	H	C	GLN	V	86
R	-	CG2	ILE	A	2	L	H	O	GLN	V	86
R	-	CG2	ILE	A	2	L	H	HB2	GLN	V	86
R	-	CG2	ILE	A	2	L	-	N	SER	V	87
R	-	CG2	ILE	A	2	L	-	CA	SER	V	87
R	-	CG2	ILE	A	2	L	-	C	SER	V	87
R	-	CG2	ILE	A	2	L	-	CB	SER	V	87
R	-	CG2	ILE	A	2	L	-	H	SER	V	87
R	-	CG2	ILE	A	2	L	-	HA	SER	V	87
R	-	CG2	ILE	A	2	L	-	HB3	SER	V	87
R	-	CG2	ILE	A	2	L	-	N	GLN	V	88
R	-	CG2	ILE	A	2	L	-	H	GLN	V	88
R	-	CG2	ILE	A	2	L	-	HG2	GLN	V	88
R	-	CD1	ILE	A	2	L	H	O	GLN	V	86
R	-	N	CYS	A	3	L	-	HA	SER	V	87
R	-	N	CYS	A	3	L	-	HB3	SER	V	87
R	-	CA	CYS	A	3	L	-	HB3	SER	V	87
R	-	C	CYS	A	3	L	-	CB	SER	V	87
R	-	C	CYS	A	3	L	-	OG	SER	V	87
R	-	C	CYS	A	3	L	-	HA	SER	V	87
R	-	C	CYS	A	3	L	-	HB3	SER	V	87
R	-	C	CYS	A	3	L	-	HG	SER	V	87
R	-	CB	CYS	A	3	L	H	CG1	VAL	V	83
R	-	CB	CYS	A	3	L	H	HG12	VAL	V	83
R	-	CB	CYS	A	3	L	H	HG13	VAL	V	83
R	-	CB	CYS	A	3	L	-	HB3	SER	V	87
R	-	O	CYS	A	3	L	-	CA	SER	V	87
R	-	O	CYS	A	3	L	-	CB	SER	V	87
R	-	O	CYS	A	3	L	-	OG	SER	V	87
R	-	O	CYS	A	3	L	-	HA	SER	V	87
R	-	O	CYS	A	3	L	-	HB2	SER	V	87
R	-	O	CYS	A	3	L	-	HB3	SER	V	87
R	-	O	CYS	A	3	L	-	HG	SER	V	87
R	-	SG	CYS	A	3	L	H	HG13	VAL	V	83
R	-	SG	CYS	A	3	L	H	HG23	VAL	V	83
R	-	N	GLU	A	4	L	-	OG	SER	V	87
R	-	CA	GLU	A	4	L	-	OG	SER	V	87
R	-	C	GLU	A	4	L	-	OG	SER	V	87
R	-	C	GLU	A	4	L	-	HG	SER	V	87
R	-	C	GLU	A	4	L	-	HB2	ASN	V	89
R	-	O	GLU	A	4	L	-	HG	SER	V	87
R	-	O	GLU	A	4	L	-	CB	ASN	V	89
R	-	O	GLU	A	4	L	-	ND2	ASN	V	89
R	-	O	GLU	A	4	L	-	H	ASN	V	89
R	-	O	GLU	A	4	L	-	HB2	ASN	V	89
R	-	O	GLU	A	4	L	-	HB3	ASN	V	89
R	-	O	GLU	A	4	L	-	HD21	ASN	V	89
R	-	N	ASN	A	5	L	-	HB2	ASN	V	89
R	-	CA	ASN	A	5	L	-	HB2	ASN	V	89
R	-	CG	ASN	A	5	L	-	HD21	ASN	V	89
R	-	OD1	ASN	A	5	L	-	ND2	ASN	V	89
R	-	OD1	ASN	A	5	L	-	HB2	ASN	V	89
R	-	OD1	ASN	A	5	L	-	HD21	ASN	V	89
R	-	OD1	ASN	A	5	L	-	HD22	ASN	V	89
R	-	N	HIS	A	6	L	H	HZ3	LYS	V	80
R	-	CA	HIS	A	6	L	H	NZ	LYS	V	80
R	-	CA	HIS	A	6	L	H	HZ1	LYS	V	80
R	-	CA	HIS	A	6	L	H	HZ2	LYS	V	80
R	-	CA	HIS	A	6	L	H	HZ3	LYS	V	80
R	-	CA	HIS	A	6	L	H	HG12	VAL	V	83
R	-	C	HIS	A	6	L	H	NZ	LYS	V	80
R	-	C	HIS	A	6	L	H	HZ1	LYS	V	80
R	-	C	HIS	A	6	L	H	HZ2	LYS	V	80
R	-	C	HIS	A	6	L	H	HZ3	LYS	V	80
R	-	CB	HIS	A	6	L	H	CD	LYS	V	80
R	-	CB	HIS	A	6	L	H	CE	LYS	V	80
R	-	CB	HIS	A	6	L	H	NZ	LYS	V	80
R	-	CB	HIS	A	6	L	H	HD2	LYS	V	80
R	-	CB	HIS	A	6	L	H	HE2	LYS	V	80
R	-	CB	HIS	A	6	L	H	HE3	LYS	V	80
R	-	CB	HIS	A	6	L	H	HZ1	LYS	V	80
R	-	CB	HIS	A	6	L	H	HZ2	LYS	V	80
R	-	CB	HIS	A	6	L	H	HZ3	LYS	V	80
R	-	O	HIS	A	6	L	H	NZ	LYS	V	80
R	-	O	HIS	A	6	L	H	HD3	LYS	V	80
R	-	O	HIS	A	6	L	H	HZ1	LYS	V	80
R	-	O	HIS	A	6	L	H	HZ2	LYS	V	80
R	-	O	HIS	A	6	L	H	HZ3	LYS	V	80
R	-	CG	HIS	A	6	L	H	CD	LYS	V	80
R	-	CG	HIS	A	6	L	H	CE	LYS	V	80
R	-	CG	HIS	A	6	L	H	NZ	LYS	V	80
R	-	CG	HIS	A	6	L	H	HD2	LYS	V	80
R	-	CG	HIS	A	6	L	H	HE2	LYS	V	80
R	-	CG	HIS	A	6	L	H	HZ1	LYS	V	80
R	-	CG	HIS	A	6	L	H	HZ2	LYS	V	80
R	-	CG	HIS	A	6	L	H	HZ3	LYS	V	80
R	-	CG	HIS	A	6	L	H	HG11	VAL	V	83
R	-	CG	HIS	A	6	L	H	HG12	VAL	V	83
R	-	CG	HIS	A	6	L	H	OD1	ASN	V	84
R	-	CG	HIS	A	6	L	-	O	ASN	V	89
R	-	CD2	HIS	A	6	L	H	NZ	LYS	V	80
R	-	CD2	HIS	A	6	L	H	HE2	LYS	V	80
R	-	CD2	HIS	A	6	L	H	HZ1	LYS	V	80
R	-	CD2	HIS	A	6	L	H	HZ3	LYS	V	80
R	-	CD2	HIS	A	6	L	H	CG	ASN	V	84
R	-	CD2	HIS	A	6	L	H	OD1	ASN	V	84
R	-	CD2	HIS	A	6	L	-	HG	SER	V	87
R	-	CD2	HIS	A	6	L	-	C	ASN	V	89
R	-	CD2	HIS	A	6	L	-	O	ASN	V	89
R	-	CD2	HIS	A	6	L	-	CA	LYS	V	90
R	-	CD2	HIS	A	6	L	-	C	LYS	V	90
R	-	CD2	HIS	A	6	L	-	O	LYS	V	90
R	-	CD2	HIS	A	6	L	-	HA	LYS	V	90
R	-	CD2	HIS	A	6	L	-	O	ALA	V	91
R	-	ND1	HIS	A	6	L	H	O	LYS	V	80
R	-	ND1	HIS	A	6	L	H	CD	LYS	V	80
R	-	ND1	HIS	A	6	L	H	CE	LYS	V	80
R	-	ND1	HIS	A	6	L	H	NZ	LYS	V	80
R	-	ND1	HIS	A	6	L	H	HD2	LYS	V	80
R	-	ND1	HIS	A	6	L	H	HE2	LYS	V	80
R	-	ND1	HIS	A	6	L	H	HZ1	LYS	V	80
R	-	ND1	HIS	A	6	L	H	HZ2	LYS	V	80
R	-	ND1	HIS	A	6	L	H	HZ3	LYS	V	80
R	-	ND1	HIS	A	6	L	H	CB	VAL	V	83
R	-	ND1	HIS	A	6	L	H	CG1	VAL	V	83
R	-	ND1	HIS	A	6	L	H	HB	VAL	V	83
R	-	ND1	HIS	A	6	L	H	HG11	VAL	V	83
R	-	ND1	HIS	A	6	L	H	HG12	VAL	V	83
R	-	ND1	HIS	A	6	L	H	N	ASN	V	84
R	-	ND1	HIS	A	6	L	H	CG	ASN	V	84
R	-	ND1	HIS	A	6	L	H	OD1	ASN	V	84
R	-	ND1	HIS	A	6	L	H	H	ASN	V	84
R	-	ND1	HIS	A	6	L	H	HA	ASN	V	84
R	-	CE1	HIS	A	6	L	H	O	LYS	V	80
R	-	CE1	HIS	A	6	L	H	NZ	LYS	V	80
R	-	CE1	HIS	A	6	L	H	HD2	LYS	V	80
R	-	CE1	HIS	A	6	L	H	HE2	LYS	V	80
R	-	CE1	HIS	A	6	L	H	HZ3	LYS	V	80
R	-	CE1	HIS	A	6	L	H	C	VAL	V	83
R	-	CE1	HIS	A	6	L	H	CB	VAL	V	83
R	-	CE1	HIS	A	6	L	H	O	VAL	V	83
R	-	CE1	HIS	A	6	L	H	CG1	VAL	V	83
R	-	CE1	HIS	A	6	L	H	HB	VAL	V	83
R	-	CE1	HIS	A	6	L	H	HG11	VAL	V	83
R	-	CE1	HIS	A	6	L	H	HG12	VAL	V	83
R	-	CE1	HIS	A	6	L	H	N	ASN	V	84
R	-	CE1	HIS	A	6	L	H	CA	ASN	V	84
R	-	CE1	HIS	A	6	L	H	CB	ASN	V	84
R	-	CE1	HIS	A	6	L	H	CG	ASN	V	84
R	-	CE1	HIS	A	6	L	H	ND2	ASN	V	84
R	-	CE1	HIS	A	6	L	H	OD1	ASN	V	84
R	-	CE1	HIS	A	6	L	H	H	ASN	V	84
R	-	CE1	HIS	A	6	L	H	HA	ASN	V	84
R	-	CE1	HIS	A	6	L	H	HB3	ASN	V	84
R	-	CE1	HIS	A	6	L	H	HD22	ASN	V	84
R	-	CE1	HIS	A	6	L	-	HB2	SER	V	87
R	-	CE1	HIS	A	6	L	-	O	ASN	V	89
R	-	CE1	HIS	A	6	L	-	HA	LYS	V	90
R	-	NE2	HIS	A	6	L	H	HE2	LYS	V	80
R	-	NE2	HIS	A	6	L	H	HZ3	LYS	V	80
R	-	NE2	HIS	A	6	L	H	HG11	VAL	V	83
R	-	NE2	HIS	A	6	L	H	N	ASN	V	84
R	-	NE2	HIS	A	6	L	H	CA	ASN	V	84
R	-	NE2	HIS	A	6	L	H	CB	ASN	V	84
R	-	NE2	HIS	A	6	L	H	CG	ASN	V	84
R	-	NE2	HIS	A	6	L	H	ND2	ASN	V	84
R	-	NE2	HIS	A	6	L	H	OD1	ASN	V	84
R	-	NE2	HIS	A	6	L	H	HA	ASN	V	84
R	-	NE2	HIS	A	6	L	H	HB3	ASN	V	84
R	-	NE2	HIS	A	6	L	H	HD22	ASN	V	84
R	-	NE2	HIS	A	6	L	-	HB2	SER	V	87
R	-	NE2	HIS	A	6	L	-	HG	SER	V	87
R	-	NE2	HIS	A	6	L	-	C	ASN	V	89
R	-	NE2	HIS	A	6	L	-	O	ASN	V	89
R	-	NE2	HIS	A	6	L	-	N	LYS	V	90
R	-	NE2	HIS	A	6	L	-	CA	LYS	V	90
R	-	NE2	HIS	A	6	L	-	C	LYS	V	90
R	-	NE2	HIS	A	6	L	-	O	LYS	V	90
R	-	NE2	HIS	A	6	L	-	HA	LYS	V	90
R	-	NE2	HIS	A	6	L	-	HG3	LYS	V	90
R	H	CA	PRO	A	154	L	H	CD2	LEU	V	47
R	H	CA	PRO	A	154	L	H	HD22	LEU	V	47
R	H	CA	PRO	A	154	L	H	HD23	LEU	V	47
R	H	C	PRO	A	154	L	H	HD22	LEU	V	47
R	H	C	PRO	A	154	L	H	HD23	LEU	V	47
R	H	CB	PRO	A	154	L	H	CD2	LEU	V	47
R	H	CB	PRO	A	154	L	H	HD22	LEU	V	47
R	H	CB	PRO	A	154	L	H	HD23	LEU	V	47
R	H	O	PRO	A	154	L	H	CD2	LEU	V	47
R	H	O	PRO	A	154	L	H	HD13	LEU	V	47
R	H	O	PRO	A	154	L	H	HD22	LEU	V	47
R	H	O	PRO	A	154	L	H	HD23	LEU	V	47
R	H	CG	PRO	A	154	L	H	HD23	LEU	V	47
R	H	CA	LEU	A	158	L	H	HG13	VAL	V	43
R	H	CB	LEU	A	158	L	H	CG1	VAL	V	43
R	H	CB	LEU	A	158	L	H	HG12	VAL	V	43
R	H	CB	LEU	A	158	L	H	HG13	VAL	V	43
R	H	CB	LEU	A	158	L	H	HD13	LEU	V	47
R	H	CG	LEU	A	158	L	H	CG1	VAL	V	43
R	H	CG	LEU	A	158	L	H	HG11	VAL	V	43
R	H	CG	LEU	A	158	L	H	HG12	VAL	V	43
R	H	CG	LEU	A	158	L	H	HG13	VAL	V	43
R	H	CG	LEU	A	158	L	H	HD13	LEU	V	47
R	H	CD1	LEU	A	158	L	H	CB	VAL	V	43
R	H	CD1	LEU	A	158	L	H	CG1	VAL	V	43
R	H	CD1	LEU	A	158	L	H	CG2	VAL	V	43
R	H	CD1	LEU	A	158	L	H	HB	VAL	V	43
R	H	CD1	LEU	A	158	L	H	HG11	VAL	V	43
R	H	CD1	LEU	A	158	L	H	HG12	VAL	V	43
R	H	CD1	LEU	A	158	L	H	HG13	VAL	V	43
R	H	CD1	LEU	A	158	L	H	HG22	VAL	V	43
R	H	CD1	LEU	A	158	L	H	HD13	LEU	V	47
R	H	CD2	LEU	A	158	L	H	HG11	VAL	V	43
R	H	CD2	LEU	A	158	L	H	HG13	VAL	V	43
R	H	CD2	LEU	A	158	L	H	CD1	LEU	V	47
R	H	CD2	LEU	A	158	L	H	HD11	LEU	V	47
R	H	CD2	LEU	A	158	L	H	HD12	LEU	V	47
R	H	CD2	LEU	A	158	L	H	HD13	LEU	V	47
R	H	CB	TRP	A	162	L	H	HG13	VAL	V	39
R	H	CG	TRP	A	162	L	H	CG1	VAL	V	39
R	H	CG	TRP	A	162	L	H	HG11	VAL	V	39
R	H	CG	TRP	A	162	L	H	HG13	VAL	V	39
R	H	CD1	TRP	A	162	L	H	CG1	VAL	V	39
R	H	CD1	TRP	A	162	L	H	HG13	VAL	V	39
R	H	CD2	TRP	A	162	L	H	CG1	VAL	V	39
R	H	CD2	TRP	A	162	L	H	HG11	VAL	V	39
R	H	CD2	TRP	A	162	L	H	HG13	VAL	V	39
R	H	CE2	TRP	A	162	L	H	CD2	LEU	V	36
R	H	CE2	TRP	A	162	L	H	HD21	LEU	V	36
R	H	CE2	TRP	A	162	L	H	HD22	LEU	V	36
R	H	CE2	TRP	A	162	L	H	CG1	VAL	V	39
R	H	CE2	TRP	A	162	L	H	HB	VAL	V	39
R	H	CE2	TRP	A	162	L	H	HG11	VAL	V	39
R	H	CE2	TRP	A	162	L	H	HG13	VAL	V	39
R	H	CE3	TRP	A	162	L	H	HG11	VAL	V	39
R	H	CE3	TRP	A	162	L	H	HD13	LEU	V	40
R	H	NE1	TRP	A	162	L	H	HE1	TYR	V	35
R	H	NE1	TRP	A	162	L	H	CD2	LEU	V	36
R	H	NE1	TRP	A	162	L	H	HD21	LEU	V	36
R	H	NE1	TRP	A	162	L	H	HD22	LEU	V	36
R	H	NE1	TRP	A	162	L	H	HD23	LEU	V	36
R	H	NE1	TRP	A	162	L	H	HG13	VAL	V	39
R	H	CH2	TRP	A	162	L	H	HD22	LEU	V	36
R	H	CH2	TRP	A	162	L	H	CB	LEU	V	40
R	H	CH2	TRP	A	162	L	H	CD1	LEU	V	40
R	H	CH2	TRP	A	162	L	H	HB2	LEU	V	40
R	H	CH2	TRP	A	162	L	H	HD13	LEU	V	40
R	H	CH2	TRP	A	162	L	H	HD22	LEU	V	40
R	H	CZ2	TRP	A	162	L	H	CD2	LEU	V	36
R	H	CZ2	TRP	A	162	L	H	HA	LEU	V	36
R	H	CZ2	TRP	A	162	L	H	HB3	LEU	V	36
R	H	CZ2	TRP	A	162	L	H	HD21	LEU	V	36
R	H	CZ2	TRP	A	162	L	H	HD22	LEU	V	36
R	H	CZ2	TRP	A	162	L	H	HB2	LEU	V	40
R	H	CZ3	TRP	A	162	L	H	CB	LEU	V	40
R	H	CZ3	TRP	A	162	L	H	CD1	LEU	V	40
R	H	CZ3	TRP	A	162	L	H	HA	LEU	V	40
R	H	CZ3	TRP	A	162	L	H	HB2	LEU	V	40
R	H	CZ3	TRP	A	162	L	H	HD11	LEU	V	40
R	H	CZ3	TRP	A	162	L	H	HD13	LEU	V	40
R	H	CA	ALA	A	165	L	H	OH	TYR	V	35
R	H	CA	ALA	A	165	L	H	HH	TYR	V	35
R	H	CA	ALA	A	165	L	H	CG2	THR	V	75
R	H	CA	ALA	A	165	L	H	HG21	THR	V	75
R	H	CA	ALA	A	165	L	H	HG22	THR	V	75
R	H	C	ALA	A	165	L	H	OH	TYR	V	35
R	H	C	ALA	A	165	L	H	HH	TYR	V	35
R	H	C	ALA	A	165	L	H	HG22	THR	V	75
R	H	CB	ALA	A	165	L	H	OH	TYR	V	35
R	H	CB	ALA	A	165	L	H	HH	TYR	V	35
R	H	CB	ALA	A	165	L	H	CG2	THR	V	75
R	H	CB	ALA	A	165	L	H	OG1	THR	V	75
R	H	CB	ALA	A	165	L	H	HG21	THR	V	75
R	H	CB	ALA	A	165	L	H	HG22	THR	V	75
R	H	O	ALA	A	165	L	H	OH	TYR	V	35
R	H	O	ALA	A	165	L	H	CZ	TYR	V	35
R	H	O	ALA	A	165	L	H	HH	TYR	V	35
R	H	O	ALA	A	165	L	H	CG2	THR	V	75
R	H	O	ALA	A	165	L	H	HG22	THR	V	75
R	H	O	ALA	A	165	L	H	CG	PRO	V	79
R	H	O	ALA	A	165	L	H	HB3	PRO	V	79
R	H	O	ALA	A	165	L	H	HG2	PRO	V	79
R	H	O	ALA	A	165	L	H	HG3	PRO	V	79
R	-	N	LEU	A	166	L	H	OH	TYR	V	35
R	-	CG	LEU	A	166	L	H	HE1	TYR	V	35
R	-	CD2	LEU	A	166	L	H	CE1	TYR	V	35
R	-	CD2	LEU	A	166	L	H	HE1	TYR	V	35
R	-	N	PRO	A	167	L	H	HB3	PRO	V	79
R	-	CA	PRO	A	167	L	H	HB3	PRO	V	79
R	-	CB	PRO	A	167	L	H	HB3	PRO	V	79
R	-	CB	PRO	A	167	L	H	CG2	VAL	V	83
R	-	CB	PRO	A	167	L	H	HG21	VAL	V	83
R	-	CB	PRO	A	167	L	H	HG22	VAL	V	83
R	-	CB	PRO	A	167	L	H	HG23	VAL	V	83
R	-	CG	PRO	A	167	L	H	HA	PRO	V	79
R	-	CG	PRO	A	167	L	H	HB3	PRO	V	79
R	-	CG	PRO	A	167	L	H	HG21	VAL	V	83
R	-	CD	PRO	A	167	L	H	HB3	PRO	V	79
R	-	C	THR	A	189	L	H	HZ	PHE	V	28
R	-	C	THR	A	189	L	H	NE2	GLN	V	86
R	-	C	THR	A	189	L	H	HE22	GLN	V	86
R	-	CB	THR	A	189	L	H	OE1	GLN	V	86
R	-	O	THR	A	189	L	H	HZ	PHE	V	28
R	-	O	THR	A	189	L	H	CD	GLN	V	86
R	-	O	THR	A	189	L	H	NE2	GLN	V	86
R	-	O	THR	A	189	L	H	OE1	GLN	V	86
R	-	O	THR	A	189	L	H	HE21	GLN	V	86
R	-	O	THR	A	189	L	H	HE22	GLN	V	86
R	-	OG1	THR	A	189	L	H	HG23	VAL	V	83
R	-	OG1	THR	A	189	L	H	OE1	GLN	V	86
R	-	N	VAL	A	190	L	H	HZ	PHE	V	28
R	-	N	VAL	A	190	L	H	HE22	GLN	V	86
R	-	CA	VAL	A	190	L	H	CZ	PHE	V	28
R	-	CA	VAL	A	190	L	H	HZ	PHE	V	28
R	-	CA	VAL	A	190	L	H	HD22	LEU	V	32
R	-	CA	VAL	A	190	L	H	HE22	GLN	V	86
R	-	C	VAL	A	190	L	H	HZ	PHE	V	28
R	-	C	VAL	A	190	L	H	HD22	LEU	V	32
R	-	C	VAL	A	190	L	H	HD23	LEU	V	32
R	-	CB	VAL	A	190	L	H	CZ	PHE	V	28
R	-	CB	VAL	A	190	L	H	HZ	PHE	V	28
R	-	CB	VAL	A	190	L	H	CD1	LEU	V	32
R	-	CB	VAL	A	190	L	H	HD12	LEU	V	32
R	-	CB	VAL	A	190	L	H	HD13	LEU	V	32
R	-	CB	VAL	A	190	L	H	HD22	LEU	V	32
R	-	CB	VAL	A	190	L	H	HD13	LEU	V	82
R	-	CG1	VAL	A	190	L	H	CE2	PHE	V	28
R	-	CG1	VAL	A	190	L	H	CZ	PHE	V	28
R	-	CG1	VAL	A	190	L	H	HE2	PHE	V	28
R	-	CG1	VAL	A	190	L	H	HZ	PHE	V	28
R	-	CG1	VAL	A	190	L	H	HD12	LEU	V	32
R	-	CG1	VAL	A	190	L	H	CB	LEU	V	82
R	-	CG1	VAL	A	190	L	H	CD1	LEU	V	82
R	-	CG1	VAL	A	190	L	H	HB2	LEU	V	82
R	-	CG1	VAL	A	190	L	H	HB3	LEU	V	82
R	-	CG1	VAL	A	190	L	H	HD11	LEU	V	82
R	-	CG1	VAL	A	190	L	H	HD13	LEU	V	82
R	-	CG2	VAL	A	190	L	H	CD1	LEU	V	32
R	-	CG2	VAL	A	190	L	H	HD12	LEU	V	32
R	-	CG2	VAL	A	190	L	H	HD13	LEU	V	32
R	-	N	ASP	A	191	L	H	HE1	PHE	V	28
R	-	N	ASP	A	191	L	H	HZ	PHE	V	28
R	-	N	ASP	A	191	L	H	CD2	LEU	V	32
R	-	N	ASP	A	191	L	H	HD13	LEU	V	32
R	-	N	ASP	A	191	L	H	HD21	LEU	V	32
R	-	N	ASP	A	191	L	H	HD22	LEU	V	32
R	-	N	ASP	A	191	L	H	HD23	LEU	V	32
R	-	CA	ASP	A	191	L	H	HH2	TRP	V	29
R	-	CA	ASP	A	191	L	H	HZ3	TRP	V	29
R	-	CA	ASP	A	191	L	H	CD2	LEU	V	32
R	-	CA	ASP	A	191	L	H	HD22	LEU	V	32
R	-	CA	ASP	A	191	L	H	HD23	LEU	V	32
R	-	C	ASP	A	191	L	H	HD13	LEU	V	32
R	-	C	ASP	A	191	L	H	HD23	LEU	V	32
R	-	CB	ASP	A	191	L	H	CH2	TRP	V	29
R	-	CB	ASP	A	191	L	H	CZ3	TRP	V	29
R	-	CB	ASP	A	191	L	H	HH2	TRP	V	29
R	-	CB	ASP	A	191	L	H	HZ3	TRP	V	29
R	-	CB	ASP	A	191	L	H	CD2	LEU	V	32
R	-	CB	ASP	A	191	L	H	HD21	LEU	V	32
R	-	CB	ASP	A	191	L	H	HD22	LEU	V	32
R	-	CB	ASP	A	191	L	H	HD23	LEU	V	32
R	-	O	ASP	A	191	L	H	CD1	LEU	V	32
R	-	O	ASP	A	191	L	H	CD2	LEU	V	32
R	-	O	ASP	A	191	L	H	HD13	LEU	V	32
R	-	O	ASP	A	191	L	H	HD23	LEU	V	32
R	-	O	ASP	A	191	L	H	HD13	LEU	V	36
R	-	O	ASP	A	191	L	H	HD23	LEU	V	36
R	-	CG	ASP	A	191	L	H	CH2	TRP	V	29
R	-	CG	ASP	A	191	L	H	CZ3	TRP	V	29
R	-	CG	ASP	A	191	L	H	HH2	TRP	V	29
R	-	CG	ASP	A	191	L	H	HZ3	TRP	V	29
R	-	CG	ASP	A	191	L	H	HD23	LEU	V	32
R	-	OD1	ASP	A	191	L	H	HH2	TRP	V	29
R	-	OD1	ASP	A	191	L	H	HZ3	TRP	V	29
R	-	OD2	ASP	A	191	L	H	CE3	TRP	V	29
R	-	OD2	ASP	A	191	L	H	CH2	TRP	V	29
R	-	OD2	ASP	A	191	L	H	CZ3	TRP	V	29
R	-	OD2	ASP	A	191	L	H	HH2	TRP	V	29
R	-	OD2	ASP	A	191	L	H	HZ3	TRP	V	29
R	-	OD2	ASP	A	191	L	H	HD23	LEU	V	32
R	H	N	MET	A	194	L	H	HD12	LEU	V	36
R	H	CA	MET	A	194	L	H	HD12	LEU	V	36
R	H	CA	MET	A	194	L	H	HD22	LEU	V	36
R	H	CB	MET	A	194	L	H	CG	LEU	V	36
R	H	CB	MET	A	194	L	H	CD1	LEU	V	36
R	H	CB	MET	A	194	L	H	CD2	LEU	V	36
R	H	CB	MET	A	194	L	H	HB3	LEU	V	36
R	H	CB	MET	A	194	L	H	HD11	LEU	V	36
R	H	CB	MET	A	194	L	H	HD12	LEU	V	36
R	H	CB	MET	A	194	L	H	HD13	LEU	V	36
R	H	CB	MET	A	194	L	H	HD22	LEU	V	36
R	H	CG	MET	A	194	L	H	CB	LEU	V	36
R	H	CG	MET	A	194	L	H	CG	LEU	V	36
R	H	CG	MET	A	194	L	H	CD1	LEU	V	36
R	H	CG	MET	A	194	L	H	HB2	LEU	V	36
R	H	CG	MET	A	194	L	H	HB3	LEU	V	36
R	H	CG	MET	A	194	L	H	HD11	LEU	V	36
R	H	CG	MET	A	194	L	H	HD12	LEU	V	36
R	H	CG	MET	A	194	L	H	HD13	LEU	V	36
R	H	CG	MET	A	194	L	H	HD22	LEU	V	36
R	H	SD	MET	A	194	L	H	HA	SER	V	33
R	H	SD	MET	A	194	L	H	CA	LEU	V	36
R	H	SD	MET	A	194	L	H	CB	LEU	V	36
R	H	SD	MET	A	194	L	H	CG	LEU	V	36
R	H	SD	MET	A	194	L	H	CD1	LEU	V	36
R	H	SD	MET	A	194	L	H	HB2	LEU	V	36
R	H	SD	MET	A	194	L	H	HB3	LEU	V	36
R	H	SD	MET	A	194	L	H	HD11	LEU	V	36
R	H	SD	MET	A	194	L	H	HD12	LEU	V	36
R	H	SD	MET	A	194	L	H	HD13	LEU	V	36
R	H	SD	MET	A	194	L	H	HD22	LEU	V	36
R	H	CE	MET	A	194	L	H	C	LEU	V	36
R	H	CE	MET	A	194	L	H	CB	LEU	V	36
R	H	CE	MET	A	194	L	H	O	LEU	V	36
R	H	CE	MET	A	194	L	H	HB2	LEU	V	36
R	H	CE	MET	A	194	L	H	HB3	LEU	V	36
R	H	CE	MET	A	194	L	H	HD12	LEU	V	36
R	H	CE	MET	A	194	L	H	N	VAL	V	37
R	H	CE	MET	A	194	L	H	HA	VAL	V	37
R	H	CE	MET	A	194	L	H	HG21	VAL	V	37
R	H	CE	MET	A	194	L	H	HG23	VAL	V	37
R	H	CE	MET	A	194	L	H	HD21	LEU	V	40
R	H	CE	MET	A	194	L	H	HD22	LEU	V	40
R	H	N	TYR	A	195	L	H	HD22	LEU	V	36
R	H	CG	GLN	A	198	L	H	HD13	LEU	V	40
R	H	CD	GLN	A	198	L	H	HD12	LEU	V	40
R	H	CD	GLN	A	198	L	H	HD13	LEU	V	40
R	H	OE1	GLN	A	198	L	H	HD12	LEU	V	40
R	H	OE1	GLN	A	198	L	H	HD13	LEU	V	40
R	H	OE1	GLN	A	198	L	-	HD11	LEU	V	304
R	H	OE1	GLN	A	198	L	-	HD12	LEU	V	304
R	H	OE1	GLN	A	198	L	-	HD13	LEU	V	304
R	H	CA	ALA	A	201	L	-	CG	PRO	V	307
R	H	CA	ALA	A	201	L	-	HG2	PRO	V	307
R	H	CA	ALA	A	201	L	-	HG3	PRO	V	307
R	H	C	ALA	A	201	L	-	HG2	PRO	V	307
R	H	C	ALA	A	201	L	-	HG3	PRO	V	307
R	H	CB	ALA	A	201	L	-	HG3	PRO	V	307
R	H	O	ALA	A	201	L	-	CG	PRO	V	307
R	H	O	ALA	A	201	L	-	HB3	PRO	V	307
R	H	O	ALA	A	201	L	-	HG2	PRO	V	307
R	H	O	ALA	A	201	L	-	HG3	PRO	V	307
R	H	N	LEU	A	204	L	-	HB3	PRO	V	307
R	H	CA	LEU	A	204	L	-	CB	PRO	V	307
R	H	CA	LEU	A	204	L	-	HA	PRO	V	307
R	H	CA	LEU	A	204	L	-	HB3	PRO	V	307
R	H	CA	LEU	A	204	L	-	HG2	PRO	V	307
R	H	C	LEU	A	204	L	-	CB	PRO	V	307
R	H	C	LEU	A	204	L	-	HA	PRO	V	307
R	H	C	LEU	A	204	L	-	HB3	PRO	V	307
R	H	C	LEU	A	204	L	-	HG2	PRO	V	307
R	H	CB	LEU	A	204	L	-	CA	PRO	V	307
R	H	CB	LEU	A	204	L	-	CB	PRO	V	307
R	H	CB	LEU	A	204	L	-	CG	PRO	V	307
R	H	CB	LEU	A	204	L	-	HA	PRO	V	307
R	H	CB	LEU	A	204	L	-	HB2	PRO	V	307
R	H	CB	LEU	A	204	L	-	HB3	PRO	V	307
R	H	CB	LEU	A	204	L	-	HG2	PRO	V	307
R	H	CB	LEU	A	204	L	-	HG3	PRO	V	307
R	H	O	LEU	A	204	L	-	HA	PRO	V	307
R	H	O	LEU	A	204	L	-	HB3	PRO	V	307
R	H	CG	LEU	A	204	L	-	CB	PRO	V	307
R	H	CG	LEU	A	204	L	-	CG	PRO	V	307
R	H	CG	LEU	A	204	L	-	HB2	PRO	V	307
R	H	CG	LEU	A	204	L	-	HB3	PRO	V	307
R	H	CG	LEU	A	204	L	-	HG3	PRO	V	307
R	H	CD1	LEU	A	204	L	-	CB	PRO	V	307
R	H	CD1	LEU	A	204	L	-	O	PRO	V	307
R	H	CD1	LEU	A	204	L	-	CG	PRO	V	307
R	H	CD1	LEU	A	204	L	-	HB2	PRO	V	307
R	H	CD1	LEU	A	204	L	-	HB3	PRO	V	307
R	H	CD1	LEU	A	204	L	-	HG3	PRO	V	307
R	H	CD1	LEU	A	204	L	-	CE2	PHE	V	308
R	H	CD1	LEU	A	204	L	-	HD2	PHE	V	308
R	H	CD1	LEU	A	204	L	-	HE2	PHE	V	308
R	H	CD2	LEU	A	204	L	-	CB	PRO	V	307
R	H	CD2	LEU	A	204	L	-	HB2	PRO	V	307
R	H	CD2	LEU	A	204	L	-	HB3	PRO	V	307
R	H	N	LEU	A	205	L	-	CG	PRO	V	307
R	H	N	LEU	A	205	L	-	HA	PRO	V	307
R	H	N	LEU	A	205	L	-	HB3	PRO	V	307
R	H	N	LEU	A	205	L	-	HG2	PRO	V	307
R	H	CA	LEU	A	205	L	-	HG2	PRO	V	307
R	H	CB	LEU	A	205	L	-	HG2	PRO	V	307
R	H	CG	LEU	A	205	L	-	HG12	VAL	V	303
R	H	CD1	LEU	A	205	L	-	CB	ARG	V	306
R	H	CD1	LEU	A	205	L	-	HB2	ARG	V	306
R	H	CD1	LEU	A	205	L	-	HB3	ARG	V	306
R	H	CD2	LEU	A	205	L	-	O	VAL	V	303
R	H	CD2	LEU	A	205	L	-	CG1	VAL	V	303
R	H	CD2	LEU	A	205	L	-	HA	VAL	V	303
R	H	CD2	LEU	A	205	L	-	HG11	VAL	V	303
R	H	CD2	LEU	A	205	L	-	HG12	VAL	V	303
R	H	CD2	LEU	A	205	L	-	HG22	VAL	V	303
R	H	CA	CYS	A	212	L	-	HG3	PRO	V	311
R	H	C	CYS	A	212	L	-	HG3	PRO	V	311
R	H	CB	CYS	A	212	L	-	CG	PRO	V	311
R	H	CB	CYS	A	212	L	-	CD	PRO	V	311
R	H	CB	CYS	A	212	L	-	HG3	PRO	V	311
R	H	CB	CYS	A	212	L	-	HD2	PRO	V	311
R	H	CB	CYS	A	212	L	-	HD3	PRO	V	311
R	H	O	CYS	A	212	L	-	HG2	PRO	V	311
R	H	O	CYS	A	212	L	-	HG3	PRO	V	311
R	H	SG	CYS	A	212	L	-	HA	ARG	V	310
R	H	SG	CYS	A	212	L	-	CD	PRO	V	311
R	H	SG	CYS	A	212	L	-	HG3	PRO	V	311
R	H	SG	CYS	A	212	L	-	HD2	PRO	V	311
R	H	SG	CYS	A	212	L	-	HD3	PRO	V	311
R	H	CG2	VAL	A	216	L	-	CB	PRO	V	311
R	H	CG2	VAL	A	216	L	-	CG	PRO	V	311
R	H	CG2	VAL	A	216	L	-	HB2	PRO	V	311
R	H	CG2	VAL	A	216	L	-	HG2	PRO	V	311
R	H	CG2	VAL	A	216	L	-	HG3	PRO	V	311

- 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