IID

Q16696_P20815.5 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	-	PRO	V	35
R	-	MET	A	1	L	H	TYR	V	65
R	H	TRP	A	12	L	-	ARG	V	381
R	H	TRP	A	12	L	H	ASP	V	85
R	H	TRP	A	12	L	H	GLU	V	89
R	H	ALA	A	16	L	H	ASP	V	85
R	H	ALA	A	16	L	H	LYS	V	88
R	H	ALA	A	16	L	H	GLU	V	89
R	H	ALA	A	16	L	H	ASP	V	93
R	H	VAL	A	17	L	H	LYS	V	88
R	H	LEU	A	19	L	H	GLU	V	89
R	H	LEU	A	19	L	H	ASP	V	93
R	H	LEU	A	19	L	-	GLN	V	94
R	-	ASP	A	2	L	H	ARG	V	64
R	-	ASP	A	2	L	H	TYR	V	65
R	H	VAL	A	20	L	H	LYS	V	88
R	H	VAL	A	20	L	H	VAL	V	92
R	H	VAL	A	20	L	H	ASP	V	93
R	H	TYR	A	23	L	-	LYS	V	436
R	H	TYR	A	23	L	H	VAL	V	92
R	H	TYR	A	23	L	H	ASP	V	93
R	H	TYR	A	23	L	-	ALA	V	95
R	H	TYR	A	23	L	-	GLU	V	96
R	-	THR	A	27	L	-	LYS	V	436
R	-	LEU	A	3	L	-	LYS	V	32
R	-	LEU	A	3	L	-	PRO	V	35
R	-	LEU	A	3	L	S	PHE	V	383
R	H	PHE	A	33	L	H	ARG	V	129
R	H	LYS	A	34	L	H	ARG	V	129
R	-	LEU	A	36	L	H	ARG	V	129
R	-	GLY	A	37	L	H	ARG	V	129
R	-	ILE	A	38	L	H	ARG	V	129
R	-	PRO	A	39	L	H	ARG	V	129
R	-	ILE	A	4	L	S	PHE	V	383
R	-	ILE	A	4	L	H	TYR	V	65
R	-	ILE	A	4	L	-	GLY	V	66
R	-	ILE	A	4	L	-	PRO	V	67
R	-	ILE	A	4	L	S	VAL	V	68
R	-	GLY	A	40	L	H	GLU	V	122
R	-	GLY	A	40	L	H	LYS	V	125
R	-	PRO	A	41	L	H	LYS	V	125
R	-	THR	A	42	L	H	LYS	V	125
R	-	THR	A	42	L	-	GLU	V	96
R	-	PRO	A	43	L	-	GLU	V	96
R	-	LEU	A	44	L	-	LYS	V	376
R	-	LEU	A	44	L	-	GLU	V	96
R	-	PRO	A	45	L	-	GLN	V	94
R	-	PRO	A	45	L	-	ALA	V	95
R	-	PRO	A	45	L	-	GLU	V	96
R	-	PRO	A	45	L	-	GLU	V	97
R	-	LEU	A	47	L	-	LYS	V	376
R	H	LEU	A	51	L	-	LYS	V	376
R	H	LYS	A	66	L	-	ASN	V	283
R	H	LYS	A	67	L	H	GLU	V	122
R	H	LYS	A	67	L	-	ASN	V	283
R	H	TYR	A	68	L	H	GLU	V	122
R	H	TYR	A	68	L	H	LYS	V	125
R	H	VAL	A	9	L	-	ARG	V	403

- 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

Q16696_P20815.5 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	-	N	MET	A	1	L	H	HE1	TYR	V	65
R	-	O	MET	A	1	L	-	CB	PRO	V	35
R	-	O	MET	A	1	L	-	HB2	PRO	V	35
R	-	O	MET	A	1	L	-	HB3	PRO	V	35
R	-	O	MET	A	1	L	-	HG3	PRO	V	35
R	-	OD1	ASP	A	2	L	H	O	ARG	V	64
R	-	OD1	ASP	A	2	L	H	HA	TYR	V	65
R	-	N	LEU	A	3	L	-	HG3	PRO	V	35
R	-	CA	LEU	A	3	L	-	HG3	PRO	V	35
R	-	CA	LEU	A	3	L	S	HZ	PHE	V	383
R	-	C	LEU	A	3	L	S	HZ	PHE	V	383
R	-	CB	LEU	A	3	L	-	HG3	PRO	V	35
R	-	CB	LEU	A	3	L	-	HD2	PRO	V	35
R	-	CB	LEU	A	3	L	S	CE1	PHE	V	383
R	-	CB	LEU	A	3	L	S	CZ	PHE	V	383
R	-	CB	LEU	A	3	L	S	HE1	PHE	V	383
R	-	CB	LEU	A	3	L	S	HZ	PHE	V	383
R	-	O	LEU	A	3	L	S	HZ	PHE	V	383
R	-	CG	LEU	A	3	L	S	CE1	PHE	V	383
R	-	CG	LEU	A	3	L	S	HE1	PHE	V	383
R	-	CD1	LEU	A	3	L	-	HD3	LYS	V	32
R	-	CD1	LEU	A	3	L	-	HB3	PRO	V	35
R	-	CD1	LEU	A	3	L	-	HD2	PRO	V	35
R	-	CD1	LEU	A	3	L	S	HE1	PHE	V	383
R	-	CD2	LEU	A	3	L	S	CE1	PHE	V	383
R	-	CD2	LEU	A	3	L	S	HE1	PHE	V	383
R	-	CB	ILE	A	4	L	-	HA3	GLY	V	66
R	-	CB	ILE	A	4	L	-	HD3	PRO	V	67
R	-	CG1	ILE	A	4	L	-	HA3	GLY	V	66
R	-	CG1	ILE	A	4	L	-	HD3	PRO	V	67
R	-	CG1	ILE	A	4	L	S	HZ	PHE	V	383
R	-	CG2	ILE	A	4	L	-	HD3	PRO	V	67
R	-	CD1	ILE	A	4	L	H	O	TYR	V	65
R	-	CD1	ILE	A	4	L	-	CA	GLY	V	66
R	-	CD1	ILE	A	4	L	-	C	GLY	V	66
R	-	CD1	ILE	A	4	L	-	HA2	GLY	V	66
R	-	CD1	ILE	A	4	L	-	HA3	GLY	V	66
R	-	CD1	ILE	A	4	L	-	N	PRO	V	67
R	-	CD1	ILE	A	4	L	-	CG	PRO	V	67
R	-	CD1	ILE	A	4	L	-	CD	PRO	V	67
R	-	CD1	ILE	A	4	L	-	HG2	PRO	V	67
R	-	CD1	ILE	A	4	L	-	HD2	PRO	V	67
R	-	CD1	ILE	A	4	L	-	HD3	PRO	V	67
R	-	CD1	ILE	A	4	L	S	N	VAL	V	68
R	-	CD1	ILE	A	4	L	S	H	VAL	V	68
R	-	CD1	ILE	A	4	L	S	HB	VAL	V	68
R	H	CG1	VAL	A	9	L	-	HD2	ARG	V	403
R	H	CG1	VAL	A	9	L	-	HH11	ARG	V	403
R	H	C	TRP	A	12	L	H	OD2	ASP	V	85
R	H	CB	TRP	A	12	L	H	OD2	ASP	V	85
R	H	CE3	TRP	A	12	L	H	OE1	GLU	V	89
R	H	CE3	TRP	A	12	L	-	NH2	ARG	V	381
R	H	CE3	TRP	A	12	L	-	CZ	ARG	V	381
R	H	CE3	TRP	A	12	L	-	HH21	ARG	V	381
R	H	CE3	TRP	A	12	L	-	HH22	ARG	V	381
R	H	CH2	TRP	A	12	L	-	NE	ARG	V	381
R	H	CH2	TRP	A	12	L	-	NH1	ARG	V	381
R	H	CH2	TRP	A	12	L	-	NH2	ARG	V	381
R	H	CH2	TRP	A	12	L	-	CZ	ARG	V	381
R	H	CH2	TRP	A	12	L	-	HD2	ARG	V	381
R	H	CH2	TRP	A	12	L	-	HH11	ARG	V	381
R	H	CH2	TRP	A	12	L	-	HH12	ARG	V	381
R	H	CH2	TRP	A	12	L	-	HH22	ARG	V	381
R	H	CZ2	TRP	A	12	L	-	HH12	ARG	V	381
R	H	CZ3	TRP	A	12	L	H	OE1	GLU	V	89
R	H	CZ3	TRP	A	12	L	-	NE	ARG	V	381
R	H	CZ3	TRP	A	12	L	-	NH1	ARG	V	381
R	H	CZ3	TRP	A	12	L	-	NH2	ARG	V	381
R	H	CZ3	TRP	A	12	L	-	CZ	ARG	V	381
R	H	CZ3	TRP	A	12	L	-	HD2	ARG	V	381
R	H	CZ3	TRP	A	12	L	-	HE	ARG	V	381
R	H	CZ3	TRP	A	12	L	-	HH11	ARG	V	381
R	H	CZ3	TRP	A	12	L	-	HH12	ARG	V	381
R	H	CZ3	TRP	A	12	L	-	HH21	ARG	V	381
R	H	CZ3	TRP	A	12	L	-	HH22	ARG	V	381
R	H	CA	ALA	A	16	L	H	HG2	GLU	V	89
R	H	CA	ALA	A	16	L	H	HG3	GLU	V	89
R	H	C	ALA	A	16	L	H	HZ2	LYS	V	88
R	H	CB	ALA	A	16	L	H	HB3	ASP	V	85
R	H	CB	ALA	A	16	L	H	HD3	LYS	V	88
R	H	CB	ALA	A	16	L	H	HZ2	LYS	V	88
R	H	CB	ALA	A	16	L	H	HG3	GLU	V	89
R	H	O	ALA	A	16	L	H	HE3	LYS	V	88
R	H	O	ALA	A	16	L	H	HZ2	LYS	V	88
R	H	O	ALA	A	16	L	H	CG	ASP	V	93
R	H	O	ALA	A	16	L	H	OD2	ASP	V	93
R	H	N	VAL	A	17	L	H	HZ2	LYS	V	88
R	H	CA	VAL	A	17	L	H	HZ2	LYS	V	88
R	H	CA	LEU	A	19	L	H	CB	ASP	V	93
R	H	CA	LEU	A	19	L	H	CG	ASP	V	93
R	H	CA	LEU	A	19	L	H	OD1	ASP	V	93
R	H	CA	LEU	A	19	L	H	OD2	ASP	V	93
R	H	CA	LEU	A	19	L	H	HB2	ASP	V	93
R	H	CA	LEU	A	19	L	H	HB3	ASP	V	93
R	H	C	LEU	A	19	L	H	CB	ASP	V	93
R	H	C	LEU	A	19	L	H	CG	ASP	V	93
R	H	C	LEU	A	19	L	H	OD1	ASP	V	93
R	H	C	LEU	A	19	L	H	OD2	ASP	V	93
R	H	C	LEU	A	19	L	H	HA	ASP	V	93
R	H	C	LEU	A	19	L	H	HB2	ASP	V	93
R	H	C	LEU	A	19	L	H	HB3	ASP	V	93
R	H	CB	LEU	A	19	L	H	HA	GLU	V	89
R	H	CB	LEU	A	19	L	H	HG2	GLU	V	89
R	H	CB	LEU	A	19	L	H	CB	ASP	V	93
R	H	CB	LEU	A	19	L	H	CG	ASP	V	93
R	H	CB	LEU	A	19	L	H	OD1	ASP	V	93
R	H	CB	LEU	A	19	L	H	OD2	ASP	V	93
R	H	CB	LEU	A	19	L	H	HB2	ASP	V	93
R	H	CB	LEU	A	19	L	H	HB3	ASP	V	93
R	H	O	LEU	A	19	L	H	CA	ASP	V	93
R	H	O	LEU	A	19	L	H	CB	ASP	V	93
R	H	O	LEU	A	19	L	H	CG	ASP	V	93
R	H	O	LEU	A	19	L	H	OD1	ASP	V	93
R	H	O	LEU	A	19	L	H	OD2	ASP	V	93
R	H	O	LEU	A	19	L	H	HA	ASP	V	93
R	H	O	LEU	A	19	L	H	HB2	ASP	V	93
R	H	O	LEU	A	19	L	H	HB3	ASP	V	93
R	H	CG	LEU	A	19	L	H	HG2	GLU	V	89
R	H	CG	LEU	A	19	L	H	CB	ASP	V	93
R	H	CG	LEU	A	19	L	H	OD2	ASP	V	93
R	H	CG	LEU	A	19	L	H	HB2	ASP	V	93
R	H	CG	LEU	A	19	L	H	HB3	ASP	V	93
R	H	CD1	LEU	A	19	L	H	CB	GLU	V	89
R	H	CD1	LEU	A	19	L	H	CG	GLU	V	89
R	H	CD1	LEU	A	19	L	H	CD	GLU	V	89
R	H	CD1	LEU	A	19	L	H	OE2	GLU	V	89
R	H	CD1	LEU	A	19	L	H	HA	GLU	V	89
R	H	CD1	LEU	A	19	L	H	HB3	GLU	V	89
R	H	CD1	LEU	A	19	L	H	HG2	GLU	V	89
R	H	CD1	LEU	A	19	L	H	HG3	GLU	V	89
R	H	CD1	LEU	A	19	L	H	OD2	ASP	V	93
R	H	CD1	LEU	A	19	L	H	HB2	ASP	V	93
R	H	CD2	LEU	A	19	L	H	HB2	ASP	V	93
R	H	CD2	LEU	A	19	L	H	HB3	ASP	V	93
R	H	CD2	LEU	A	19	L	-	HE21	GLN	V	94
R	H	N	VAL	A	20	L	H	CB	ASP	V	93
R	H	N	VAL	A	20	L	H	CG	ASP	V	93
R	H	N	VAL	A	20	L	H	OD1	ASP	V	93
R	H	N	VAL	A	20	L	H	OD2	ASP	V	93
R	H	N	VAL	A	20	L	H	HB3	ASP	V	93
R	H	CA	VAL	A	20	L	H	HE3	LYS	V	88
R	H	CA	VAL	A	20	L	H	CG	ASP	V	93
R	H	CA	VAL	A	20	L	H	OD1	ASP	V	93
R	H	CA	VAL	A	20	L	H	OD2	ASP	V	93
R	H	C	VAL	A	20	L	H	OD1	ASP	V	93
R	H	CB	VAL	A	20	L	H	CE	LYS	V	88
R	H	CB	VAL	A	20	L	H	NZ	LYS	V	88
R	H	CB	VAL	A	20	L	H	HE3	LYS	V	88
R	H	CB	VAL	A	20	L	H	HZ1	LYS	V	88
R	H	CB	VAL	A	20	L	H	HZ2	LYS	V	88
R	H	CB	VAL	A	20	L	H	OD1	ASP	V	93
R	H	CG1	VAL	A	20	L	H	HE3	LYS	V	88
R	H	CG1	VAL	A	20	L	H	HZ1	LYS	V	88
R	H	CG2	VAL	A	20	L	H	CD	LYS	V	88
R	H	CG2	VAL	A	20	L	H	CE	LYS	V	88
R	H	CG2	VAL	A	20	L	H	NZ	LYS	V	88
R	H	CG2	VAL	A	20	L	H	HG2	LYS	V	88
R	H	CG2	VAL	A	20	L	H	HD3	LYS	V	88
R	H	CG2	VAL	A	20	L	H	HE2	LYS	V	88
R	H	CG2	VAL	A	20	L	H	HE3	LYS	V	88
R	H	CG2	VAL	A	20	L	H	HZ1	LYS	V	88
R	H	CG2	VAL	A	20	L	H	HZ2	LYS	V	88
R	H	CG2	VAL	A	20	L	H	HZ3	LYS	V	88
R	H	CG2	VAL	A	20	L	H	HG12	VAL	V	92
R	H	CG2	VAL	A	20	L	H	CG	ASP	V	93
R	H	CG2	VAL	A	20	L	H	OD1	ASP	V	93
R	H	CG2	VAL	A	20	L	H	OD2	ASP	V	93
R	H	N	TYR	A	23	L	H	HA	ASP	V	93
R	H	CA	TYR	A	23	L	H	O	ASP	V	93
R	H	CA	TYR	A	23	L	H	HA	ASP	V	93
R	H	CB	TYR	A	23	L	H	C	VAL	V	92
R	H	CB	TYR	A	23	L	H	O	VAL	V	92
R	H	CB	TYR	A	23	L	H	HG11	VAL	V	92
R	H	CB	TYR	A	23	L	H	CA	ASP	V	93
R	H	CB	TYR	A	23	L	H	C	ASP	V	93
R	H	CB	TYR	A	23	L	H	O	ASP	V	93
R	H	CB	TYR	A	23	L	H	HA	ASP	V	93
R	H	CG	TYR	A	23	L	H	C	VAL	V	92
R	H	CG	TYR	A	23	L	H	O	VAL	V	92
R	H	CG	TYR	A	23	L	H	HG11	VAL	V	92
R	H	CG	TYR	A	23	L	H	CA	ASP	V	93
R	H	CG	TYR	A	23	L	H	C	ASP	V	93
R	H	CG	TYR	A	23	L	H	O	ASP	V	93
R	H	CG	TYR	A	23	L	H	HA	ASP	V	93
R	H	CG	TYR	A	23	L	-	H	ALA	V	95
R	H	CD1	TYR	A	23	L	H	C	VAL	V	92
R	H	CD1	TYR	A	23	L	H	O	VAL	V	92
R	H	CD1	TYR	A	23	L	H	CG1	VAL	V	92
R	H	CD1	TYR	A	23	L	H	HG11	VAL	V	92
R	H	CD1	TYR	A	23	L	H	HG13	VAL	V	92
R	H	CD1	TYR	A	23	L	H	HA	ASP	V	93
R	H	CD2	TYR	A	23	L	H	C	VAL	V	92
R	H	CD2	TYR	A	23	L	H	O	VAL	V	92
R	H	CD2	TYR	A	23	L	H	CA	ASP	V	93
R	H	CD2	TYR	A	23	L	H	C	ASP	V	93
R	H	CD2	TYR	A	23	L	H	O	ASP	V	93
R	H	CD2	TYR	A	23	L	H	HA	ASP	V	93
R	H	CD2	TYR	A	23	L	-	N	ALA	V	95
R	H	CD2	TYR	A	23	L	-	CB	ALA	V	95
R	H	CD2	TYR	A	23	L	-	H	ALA	V	95
R	H	CD2	TYR	A	23	L	-	HB2	ALA	V	95
R	H	CD2	TYR	A	23	L	-	HB3	ALA	V	95
R	H	CE1	TYR	A	23	L	H	O	VAL	V	92
R	H	CE1	TYR	A	23	L	H	HG11	VAL	V	92
R	H	CE1	TYR	A	23	L	H	HG13	VAL	V	92
R	H	CE1	TYR	A	23	L	-	HB2	ALA	V	95
R	H	CE1	TYR	A	23	L	-	HB3	ALA	V	95
R	H	CE2	TYR	A	23	L	H	C	VAL	V	92
R	H	CE2	TYR	A	23	L	H	O	VAL	V	92
R	H	CE2	TYR	A	23	L	-	N	ALA	V	95
R	H	CE2	TYR	A	23	L	-	CA	ALA	V	95
R	H	CE2	TYR	A	23	L	-	CB	ALA	V	95
R	H	CE2	TYR	A	23	L	-	H	ALA	V	95
R	H	CE2	TYR	A	23	L	-	HB1	ALA	V	95
R	H	CE2	TYR	A	23	L	-	HB2	ALA	V	95
R	H	CE2	TYR	A	23	L	-	HB3	ALA	V	95
R	H	CE2	TYR	A	23	L	-	H	GLU	V	96
R	H	CE2	TYR	A	23	L	-	HE2	LYS	V	436
R	H	OH	TYR	A	23	L	-	CB	ALA	V	95
R	H	OH	TYR	A	23	L	-	HB1	ALA	V	95
R	H	OH	TYR	A	23	L	-	HB2	ALA	V	95
R	H	OH	TYR	A	23	L	-	HB3	ALA	V	95
R	H	OH	TYR	A	23	L	-	CG	LYS	V	436
R	H	OH	TYR	A	23	L	-	CD	LYS	V	436
R	H	OH	TYR	A	23	L	-	CE	LYS	V	436
R	H	OH	TYR	A	23	L	-	NZ	LYS	V	436
R	H	OH	TYR	A	23	L	-	HG3	LYS	V	436
R	H	OH	TYR	A	23	L	-	HD3	LYS	V	436
R	H	OH	TYR	A	23	L	-	HE2	LYS	V	436
R	H	OH	TYR	A	23	L	-	HE3	LYS	V	436
R	H	OH	TYR	A	23	L	-	HZ1	LYS	V	436
R	H	OH	TYR	A	23	L	-	HZ2	LYS	V	436
R	H	CZ	TYR	A	23	L	H	O	VAL	V	92
R	H	CZ	TYR	A	23	L	H	HA	VAL	V	92
R	H	CZ	TYR	A	23	L	-	CB	ALA	V	95
R	H	CZ	TYR	A	23	L	-	H	ALA	V	95
R	H	CZ	TYR	A	23	L	-	HB1	ALA	V	95
R	H	CZ	TYR	A	23	L	-	HB2	ALA	V	95
R	H	CZ	TYR	A	23	L	-	HB3	ALA	V	95
R	H	CZ	TYR	A	23	L	-	HE2	LYS	V	436
R	-	CG2	THR	A	27	L	-	HZ1	LYS	V	436
R	H	O	PHE	A	33	L	H	HH22	ARG	V	129
R	H	O	LYS	A	34	L	H	NH2	ARG	V	129
R	H	O	LYS	A	34	L	H	CZ	ARG	V	129
R	H	O	LYS	A	34	L	H	HE	ARG	V	129
R	H	O	LYS	A	34	L	H	HH21	ARG	V	129
R	H	O	LYS	A	34	L	H	HH22	ARG	V	129
R	H	CG	LYS	A	34	L	H	HD2	ARG	V	129
R	H	CE	LYS	A	34	L	H	HG3	ARG	V	129
R	-	C	LEU	A	36	L	H	HH22	ARG	V	129
R	-	N	GLY	A	37	L	H	NH2	ARG	V	129
R	-	N	GLY	A	37	L	H	HH21	ARG	V	129
R	-	N	GLY	A	37	L	H	HH22	ARG	V	129
R	-	CA	GLY	A	37	L	H	NH1	ARG	V	129
R	-	CA	GLY	A	37	L	H	NH2	ARG	V	129
R	-	CA	GLY	A	37	L	H	CZ	ARG	V	129
R	-	CA	GLY	A	37	L	H	HH12	ARG	V	129
R	-	CA	GLY	A	37	L	H	HH21	ARG	V	129
R	-	CA	GLY	A	37	L	H	HH22	ARG	V	129
R	-	C	GLY	A	37	L	H	NH1	ARG	V	129
R	-	C	GLY	A	37	L	H	NH2	ARG	V	129
R	-	C	GLY	A	37	L	H	CZ	ARG	V	129
R	-	C	GLY	A	37	L	H	HH12	ARG	V	129
R	-	C	GLY	A	37	L	H	HH21	ARG	V	129
R	-	C	GLY	A	37	L	H	HH22	ARG	V	129
R	-	O	GLY	A	37	L	H	NH1	ARG	V	129
R	-	O	GLY	A	37	L	H	NH2	ARG	V	129
R	-	O	GLY	A	37	L	H	HH12	ARG	V	129
R	-	O	GLY	A	37	L	H	HH22	ARG	V	129
R	-	N	ILE	A	38	L	H	HH12	ARG	V	129
R	-	N	ILE	A	38	L	H	HH22	ARG	V	129
R	-	CA	ILE	A	38	L	H	HH12	ARG	V	129
R	-	C	ILE	A	38	L	H	HH12	ARG	V	129
R	-	O	ILE	A	38	L	H	HH12	ARG	V	129
R	-	N	PRO	A	39	L	H	HH12	ARG	V	129
R	-	N	GLY	A	40	L	H	NZ	LYS	V	125
R	-	N	GLY	A	40	L	H	HZ1	LYS	V	125
R	-	N	GLY	A	40	L	H	HZ2	LYS	V	125
R	-	CA	GLY	A	40	L	H	NZ	LYS	V	125
R	-	CA	GLY	A	40	L	H	HZ1	LYS	V	125
R	-	CA	GLY	A	40	L	H	HZ2	LYS	V	125
R	-	C	GLY	A	40	L	H	NZ	LYS	V	125
R	-	C	GLY	A	40	L	H	HZ1	LYS	V	125
R	-	C	GLY	A	40	L	H	HZ2	LYS	V	125
R	-	C	GLY	A	40	L	H	HZ3	LYS	V	125
R	-	O	GLY	A	40	L	H	OE2	GLU	V	122
R	-	O	GLY	A	40	L	H	CD	LYS	V	125
R	-	O	GLY	A	40	L	H	CE	LYS	V	125
R	-	O	GLY	A	40	L	H	NZ	LYS	V	125
R	-	O	GLY	A	40	L	H	HD2	LYS	V	125
R	-	O	GLY	A	40	L	H	HE2	LYS	V	125
R	-	O	GLY	A	40	L	H	HE3	LYS	V	125
R	-	O	GLY	A	40	L	H	HZ1	LYS	V	125
R	-	O	GLY	A	40	L	H	HZ2	LYS	V	125
R	-	O	GLY	A	40	L	H	HZ3	LYS	V	125
R	-	N	PRO	A	41	L	H	NZ	LYS	V	125
R	-	N	PRO	A	41	L	H	HZ1	LYS	V	125
R	-	N	PRO	A	41	L	H	HZ2	LYS	V	125
R	-	N	PRO	A	41	L	H	HZ3	LYS	V	125
R	-	CA	PRO	A	41	L	H	NZ	LYS	V	125
R	-	CA	PRO	A	41	L	H	HZ1	LYS	V	125
R	-	CA	PRO	A	41	L	H	HZ2	LYS	V	125
R	-	CA	PRO	A	41	L	H	HZ3	LYS	V	125
R	-	C	PRO	A	41	L	H	NZ	LYS	V	125
R	-	C	PRO	A	41	L	H	HZ1	LYS	V	125
R	-	C	PRO	A	41	L	H	HZ3	LYS	V	125
R	-	O	PRO	A	41	L	H	HZ1	LYS	V	125
R	-	O	PRO	A	41	L	H	HZ3	LYS	V	125
R	-	N	THR	A	42	L	H	NZ	LYS	V	125
R	-	N	THR	A	42	L	H	HD3	LYS	V	125
R	-	N	THR	A	42	L	H	HZ1	LYS	V	125
R	-	N	THR	A	42	L	H	HZ3	LYS	V	125
R	-	CA	THR	A	42	L	H	HD3	LYS	V	125
R	-	CA	THR	A	42	L	H	HE3	LYS	V	125
R	-	CA	THR	A	42	L	H	HZ3	LYS	V	125
R	-	C	THR	A	42	L	-	OE1	GLU	V	96
R	-	CB	THR	A	42	L	-	OE1	GLU	V	96
R	-	CB	THR	A	42	L	H	HD3	LYS	V	125
R	-	CB	THR	A	42	L	H	HZ3	LYS	V	125
R	-	O	THR	A	42	L	-	OE1	GLU	V	96
R	-	CG2	THR	A	42	L	-	CD	GLU	V	96
R	-	CG2	THR	A	42	L	-	OE1	GLU	V	96
R	-	CG2	THR	A	42	L	-	OE2	GLU	V	96
R	-	OG1	THR	A	42	L	H	CG	LYS	V	125
R	-	OG1	THR	A	42	L	H	CD	LYS	V	125
R	-	OG1	THR	A	42	L	H	CE	LYS	V	125
R	-	OG1	THR	A	42	L	H	NZ	LYS	V	125
R	-	OG1	THR	A	42	L	H	HB2	LYS	V	125
R	-	OG1	THR	A	42	L	H	HG3	LYS	V	125
R	-	OG1	THR	A	42	L	H	HD2	LYS	V	125
R	-	OG1	THR	A	42	L	H	HD3	LYS	V	125
R	-	OG1	THR	A	42	L	H	HE3	LYS	V	125
R	-	OG1	THR	A	42	L	H	HZ3	LYS	V	125
R	-	CA	PRO	A	43	L	-	HG2	GLU	V	96
R	-	C	PRO	A	43	L	-	CG	GLU	V	96
R	-	C	PRO	A	43	L	-	CD	GLU	V	96
R	-	C	PRO	A	43	L	-	OE1	GLU	V	96
R	-	C	PRO	A	43	L	-	OE2	GLU	V	96
R	-	C	PRO	A	43	L	-	HG2	GLU	V	96
R	-	O	PRO	A	43	L	-	CB	GLU	V	96
R	-	O	PRO	A	43	L	-	CG	GLU	V	96
R	-	O	PRO	A	43	L	-	CD	GLU	V	96
R	-	O	PRO	A	43	L	-	OE1	GLU	V	96
R	-	O	PRO	A	43	L	-	OE2	GLU	V	96
R	-	O	PRO	A	43	L	-	HB3	GLU	V	96
R	-	O	PRO	A	43	L	-	HG2	GLU	V	96
R	-	O	PRO	A	43	L	-	HG3	GLU	V	96
R	-	N	LEU	A	44	L	-	CG	GLU	V	96
R	-	N	LEU	A	44	L	-	CD	GLU	V	96
R	-	N	LEU	A	44	L	-	HG2	GLU	V	96
R	-	N	LEU	A	44	L	-	HG3	GLU	V	96
R	-	CA	LEU	A	44	L	-	CB	GLU	V	96
R	-	CA	LEU	A	44	L	-	CG	GLU	V	96
R	-	CA	LEU	A	44	L	-	CD	GLU	V	96
R	-	CA	LEU	A	44	L	-	HB2	GLU	V	96
R	-	CA	LEU	A	44	L	-	HB3	GLU	V	96
R	-	CA	LEU	A	44	L	-	HG2	GLU	V	96
R	-	CA	LEU	A	44	L	-	HG3	GLU	V	96
R	-	CA	LEU	A	44	L	-	HZ3	LYS	V	376
R	-	C	LEU	A	44	L	-	CB	GLU	V	96
R	-	C	LEU	A	44	L	-	CG	GLU	V	96
R	-	C	LEU	A	44	L	-	HB2	GLU	V	96
R	-	C	LEU	A	44	L	-	HB3	GLU	V	96
R	-	C	LEU	A	44	L	-	HG2	GLU	V	96
R	-	CB	LEU	A	44	L	-	CG	GLU	V	96
R	-	CB	LEU	A	44	L	-	HB2	GLU	V	96
R	-	CB	LEU	A	44	L	-	HG2	GLU	V	96
R	-	CB	LEU	A	44	L	-	HG3	GLU	V	96
R	-	CB	LEU	A	44	L	-	NZ	LYS	V	376
R	-	CB	LEU	A	44	L	-	HZ1	LYS	V	376
R	-	CB	LEU	A	44	L	-	HZ2	LYS	V	376
R	-	CB	LEU	A	44	L	-	HZ3	LYS	V	376
R	-	O	LEU	A	44	L	-	HG2	GLU	V	96
R	-	CG	LEU	A	44	L	-	CG	GLU	V	96
R	-	CG	LEU	A	44	L	-	HG2	GLU	V	96
R	-	CG	LEU	A	44	L	-	HG3	GLU	V	96
R	-	CG	LEU	A	44	L	-	CE	LYS	V	376
R	-	CG	LEU	A	44	L	-	NZ	LYS	V	376
R	-	CG	LEU	A	44	L	-	HD2	LYS	V	376
R	-	CG	LEU	A	44	L	-	HE2	LYS	V	376
R	-	CG	LEU	A	44	L	-	HZ1	LYS	V	376
R	-	CG	LEU	A	44	L	-	HZ2	LYS	V	376
R	-	CG	LEU	A	44	L	-	HZ3	LYS	V	376
R	-	CD1	LEU	A	44	L	-	CD	LYS	V	376
R	-	CD1	LEU	A	44	L	-	CE	LYS	V	376
R	-	CD1	LEU	A	44	L	-	NZ	LYS	V	376
R	-	CD1	LEU	A	44	L	-	HD2	LYS	V	376
R	-	CD1	LEU	A	44	L	-	HD3	LYS	V	376
R	-	CD1	LEU	A	44	L	-	HE2	LYS	V	376
R	-	CD1	LEU	A	44	L	-	HE3	LYS	V	376
R	-	CD1	LEU	A	44	L	-	HZ1	LYS	V	376
R	-	CD1	LEU	A	44	L	-	HZ2	LYS	V	376
R	-	CD1	LEU	A	44	L	-	HZ3	LYS	V	376
R	-	CD2	LEU	A	44	L	-	CB	GLU	V	96
R	-	CD2	LEU	A	44	L	-	CG	GLU	V	96
R	-	CD2	LEU	A	44	L	-	CD	GLU	V	96
R	-	CD2	LEU	A	44	L	-	HB2	GLU	V	96
R	-	CD2	LEU	A	44	L	-	HG2	GLU	V	96
R	-	CD2	LEU	A	44	L	-	HG3	GLU	V	96
R	-	CD2	LEU	A	44	L	-	CE	LYS	V	376
R	-	CD2	LEU	A	44	L	-	NZ	LYS	V	376
R	-	CD2	LEU	A	44	L	-	HD2	LYS	V	376
R	-	CD2	LEU	A	44	L	-	HE2	LYS	V	376
R	-	CD2	LEU	A	44	L	-	HZ3	LYS	V	376
R	-	N	PRO	A	45	L	-	CB	GLU	V	96
R	-	N	PRO	A	45	L	-	CG	GLU	V	96
R	-	N	PRO	A	45	L	-	HB2	GLU	V	96
R	-	N	PRO	A	45	L	-	HB3	GLU	V	96
R	-	N	PRO	A	45	L	-	HG2	GLU	V	96
R	-	CA	PRO	A	45	L	-	HB2	GLU	V	96
R	-	CA	PRO	A	45	L	-	HB3	GLU	V	96
R	-	CB	PRO	A	45	L	-	H	GLU	V	96
R	-	CB	PRO	A	45	L	-	HB2	GLU	V	96
R	-	CB	PRO	A	45	L	-	HB3	GLU	V	96
R	-	CG	PRO	A	45	L	-	HA	GLN	V	94
R	-	CG	PRO	A	45	L	-	N	ALA	V	95
R	-	CG	PRO	A	45	L	-	H	ALA	V	95
R	-	CG	PRO	A	45	L	-	N	GLU	V	96
R	-	CG	PRO	A	45	L	-	CA	GLU	V	96
R	-	CG	PRO	A	45	L	-	CB	GLU	V	96
R	-	CG	PRO	A	45	L	-	H	GLU	V	96
R	-	CG	PRO	A	45	L	-	HB2	GLU	V	96
R	-	CG	PRO	A	45	L	-	HB3	GLU	V	96
R	-	CG	PRO	A	45	L	-	OE2	GLU	V	97
R	-	CG	PRO	A	45	L	-	H	GLU	V	97
R	-	CD	PRO	A	45	L	-	N	GLU	V	96
R	-	CD	PRO	A	45	L	-	CA	GLU	V	96
R	-	CD	PRO	A	45	L	-	CB	GLU	V	96
R	-	CD	PRO	A	45	L	-	CG	GLU	V	96
R	-	CD	PRO	A	45	L	-	H	GLU	V	96
R	-	CD	PRO	A	45	L	-	HB2	GLU	V	96
R	-	CD	PRO	A	45	L	-	HB3	GLU	V	96
R	-	CD	PRO	A	45	L	-	HG2	GLU	V	96
R	-	CD	PRO	A	45	L	-	HG3	GLU	V	96
R	-	CD	PRO	A	45	L	-	CD	GLU	V	97
R	-	CD	PRO	A	45	L	-	OE1	GLU	V	97
R	-	CD	PRO	A	45	L	-	OE2	GLU	V	97
R	-	CD	PRO	A	45	L	-	H	GLU	V	97
R	-	CD1	LEU	A	47	L	-	HZ2	LYS	V	376
R	H	CG	LEU	A	51	L	-	HZ2	LYS	V	376
R	H	CD1	LEU	A	51	L	-	CD	LYS	V	376
R	H	CD1	LEU	A	51	L	-	NZ	LYS	V	376
R	H	CD1	LEU	A	51	L	-	HD2	LYS	V	376
R	H	CD1	LEU	A	51	L	-	HD3	LYS	V	376
R	H	CD1	LEU	A	51	L	-	HZ2	LYS	V	376
R	H	CD1	LEU	A	51	L	-	HZ3	LYS	V	376
R	H	CA	LYS	A	66	L	-	HD21	ASN	V	283
R	H	CA	LYS	A	66	L	-	HD22	ASN	V	283
R	H	C	LYS	A	66	L	-	ND2	ASN	V	283
R	H	C	LYS	A	66	L	-	HD21	ASN	V	283
R	H	C	LYS	A	66	L	-	HD22	ASN	V	283
R	H	CB	LYS	A	66	L	-	HD22	ASN	V	283
R	H	O	LYS	A	66	L	-	CG	ASN	V	283
R	H	O	LYS	A	66	L	-	ND2	ASN	V	283
R	H	O	LYS	A	66	L	-	HB2	ASN	V	283
R	H	O	LYS	A	66	L	-	HD21	ASN	V	283
R	H	O	LYS	A	66	L	-	HD22	ASN	V	283
R	H	N	LYS	A	67	L	-	ND2	ASN	V	283
R	H	N	LYS	A	67	L	-	HD21	ASN	V	283
R	H	CA	LYS	A	67	L	-	ND2	ASN	V	283
R	H	CA	LYS	A	67	L	-	HD21	ASN	V	283
R	H	C	LYS	A	67	L	-	HD21	ASN	V	283
R	H	O	LYS	A	67	L	-	HB2	ASN	V	283
R	H	O	LYS	A	67	L	-	HD21	ASN	V	283
R	H	CG	LYS	A	67	L	H	HG2	GLU	V	122
R	H	CD	LYS	A	67	L	H	HB2	GLU	V	122
R	H	CD	LYS	A	67	L	H	HG2	GLU	V	122
R	H	CE	LYS	A	67	L	H	CB	GLU	V	122
R	H	CE	LYS	A	67	L	H	CG	GLU	V	122
R	H	CE	LYS	A	67	L	H	CD	GLU	V	122
R	H	CE	LYS	A	67	L	H	OE2	GLU	V	122
R	H	CE	LYS	A	67	L	H	HB2	GLU	V	122
R	H	CE	LYS	A	67	L	H	HB3	GLU	V	122
R	H	CE	LYS	A	67	L	H	HG2	GLU	V	122
R	H	CE	LYS	A	67	L	H	HG3	GLU	V	122
R	H	NZ	LYS	A	67	L	H	CB	GLU	V	122
R	H	NZ	LYS	A	67	L	H	CG	GLU	V	122
R	H	NZ	LYS	A	67	L	H	CD	GLU	V	122
R	H	NZ	LYS	A	67	L	H	OE2	GLU	V	122
R	H	NZ	LYS	A	67	L	H	H	GLU	V	122
R	H	NZ	LYS	A	67	L	H	HB2	GLU	V	122
R	H	NZ	LYS	A	67	L	H	HB3	GLU	V	122
R	H	NZ	LYS	A	67	L	H	HG2	GLU	V	122
R	H	CE1	TYR	A	68	L	H	CD	GLU	V	122
R	H	CE1	TYR	A	68	L	H	OE1	GLU	V	122
R	H	CE1	TYR	A	68	L	H	OE2	GLU	V	122
R	H	CE1	TYR	A	68	L	H	HG2	GLU	V	122
R	H	CE1	TYR	A	68	L	H	HZ2	LYS	V	125
R	H	OH	TYR	A	68	L	H	CD	GLU	V	122
R	H	OH	TYR	A	68	L	H	OE2	GLU	V	122
R	H	OH	TYR	A	68	L	H	HZ2	LYS	V	125
R	H	CZ	TYR	A	68	L	H	CD	GLU	V	122
R	H	CZ	TYR	A	68	L	H	OE2	GLU	V	122

- 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