IID

P49788_P37173.1 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	-	PRO	A	11	L	-	SER	V	243
R	-	PRO	A	11	L	-	THR	V	244
R	-	LEU	A	12	L	-	SER	V	243
R	-	HIS	A	13	L	-	VAL	V	210
R	-	HIS	A	13	L	-	SER	V	211
R	-	HIS	A	13	L	-	HIS	V	212
R	-	HIS	A	13	L	-	SER	V	243
R	-	HIS	A	13	L	H	ARG	V	57
R	-	ILE	A	14	L	-	HIS	V	212
R	-	ILE	A	14	L	-	LEU	V	242
R	-	ILE	A	14	L	-	GLN	V	245
R	-	ASP	A	141	L	-	TRP	V	12
R	-	GLU	A	142	L	-	ALA	V	10
R	-	GLU	A	142	L	-	PRO	V	11
R	-	GLU	A	142	L	-	TRP	V	12
R	-	GLU	A	142	L	-	PRO	V	9
R	H	CYS	A	143	L	-	TRP	V	12
R	S	ASN	A	146	L	-	TRP	V	12
R	-	VAL	A	15	L	-	HIS	V	212
R	-	VAL	A	15	L	H	ARG	V	57
R	-	VAL	A	15	L	H	GLN	V	60
R	-	VAL	A	15	L	H	ARG	V	64
R	-	LEU	A	16	L	S	TYR	V	214
R	-	LEU	A	16	L	-	LEU	V	242
R	-	LEU	A	16	L	H	ARG	V	64
R	-	TRP	A	17	L	H	GLN	V	60
R	-	TRP	A	17	L	H	ARG	V	64
R	-	TRP	A	17	L	S	LEU	V	83
R	-	TRP	A	17	L	S	ALA	V	84
R	-	TRP	A	17	L	S	GLU	V	85
R	-	TRP	A	17	L	S	VAL	V	86
R	-	ARG	A	19	L	S	GLU	V	108
R	-	ARG	A	19	L	-	TYR	V	110
R	-	ARG	A	19	L	S	VAL	V	82
R	-	ILE	A	20	L	S	GLU	V	108
R	-	ILE	A	20	L	H	LEU	V	115
R	-	ILE	A	20	L	-	ARG	V	122
R	-	ALA	A	21	L	H	PRO	V	112
R	-	ALA	A	21	L	H	LEU	V	115
R	-	SER	A	22	L	H	PRO	V	112
R	-	SER	A	22	L	H	LEU	V	115
R	-	THR	A	23	L	H	PRO	V	112
R	-	PRO	A	280	L	-	GLN	V	2
R	H	TYR	A	281	L	-	GLN	V	2
R	H	TYR	A	281	L	-	ARG	V	4
R	H	GLU	A	282	L	-	GLN	V	2
R	H	GLU	A	282	L	-	PRO	V	3
R	H	GLU	A	282	L	-	ARG	V	4
R	H	GLU	A	282	L	-	ARG	V	5
R	H	GLU	A	283	L	-	ARG	V	5
R	-	GLN	A	29	L	-	MET	V	1
R	-	ARG	A	3	L	-	LYS	V	96
R	-	GLU	A	316	L	-	MET	V	1
R	-	LEU	A	317	L	-	MET	V	1
R	-	LEU	A	317	L	-	GLN	V	2
R	S	LYS	A	319	L	-	GLN	V	2
R	-	VAL	A	32	L	-	ARG	V	4
R	-	ASN	A	33	L	-	ARG	V	4
R	-	ASN	A	34	L	-	ARG	V	4
R	-	ARG	A	433	L	-	ARG	V	19
R	-	GLU	A	480	L	H	ARG	V	56
R	S	LEU	A	50	L	-	PRO	V	9
R	S	THR	A	74	L	-	LEU	V	8
R	S	THR	A	74	L	-	PRO	V	9
R	S	SER	A	75	L	-	LEU	V	8

- 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

P49788_P37173.1 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	-	NE	ARG	A	3	L	-	HE2	LYS	V	96
R	-	NH2	ARG	A	3	L	-	CE	LYS	V	96
R	-	NH2	ARG	A	3	L	-	NZ	LYS	V	96
R	-	NH2	ARG	A	3	L	-	HE2	LYS	V	96
R	-	NH2	ARG	A	3	L	-	HE3	LYS	V	96
R	-	NH2	ARG	A	3	L	-	HZ1	LYS	V	96
R	-	NH2	ARG	A	3	L	-	HZ2	LYS	V	96
R	-	CZ	ARG	A	3	L	-	HE2	LYS	V	96
R	-	CZ	ARG	A	3	L	-	HE3	LYS	V	96
R	-	CZ	ARG	A	3	L	-	HZ1	LYS	V	96
R	-	CB	PRO	A	11	L	-	HB3	SER	V	243
R	-	CB	PRO	A	11	L	-	HG22	THR	V	244
R	-	N	LEU	A	12	L	-	O	SER	V	243
R	-	CA	LEU	A	12	L	-	O	SER	V	243
R	-	C	LEU	A	12	L	-	CA	SER	V	243
R	-	C	LEU	A	12	L	-	C	SER	V	243
R	-	C	LEU	A	12	L	-	O	SER	V	243
R	-	C	LEU	A	12	L	-	HA	SER	V	243
R	-	CB	LEU	A	12	L	-	O	SER	V	243
R	-	O	LEU	A	12	L	-	N	SER	V	243
R	-	O	LEU	A	12	L	-	CA	SER	V	243
R	-	O	LEU	A	12	L	-	C	SER	V	243
R	-	O	LEU	A	12	L	-	CB	SER	V	243
R	-	O	LEU	A	12	L	-	O	SER	V	243
R	-	O	LEU	A	12	L	-	HA	SER	V	243
R	-	O	LEU	A	12	L	-	HB2	SER	V	243
R	-	O	LEU	A	12	L	-	HB3	SER	V	243
R	-	N	HIS	A	13	L	H	NH1	ARG	V	57
R	-	N	HIS	A	13	L	H	HH11	ARG	V	57
R	-	N	HIS	A	13	L	H	HH12	ARG	V	57
R	-	N	HIS	A	13	L	-	HA	SER	V	243
R	-	CA	HIS	A	13	L	H	HH11	ARG	V	57
R	-	CA	HIS	A	13	L	H	HH12	ARG	V	57
R	-	CA	HIS	A	13	L	-	HA	SER	V	243
R	-	C	HIS	A	13	L	H	NH1	ARG	V	57
R	-	C	HIS	A	13	L	H	HH11	ARG	V	57
R	-	C	HIS	A	13	L	H	HH12	ARG	V	57
R	-	CB	HIS	A	13	L	H	HD3	ARG	V	57
R	-	CB	HIS	A	13	L	H	HH11	ARG	V	57
R	-	CB	HIS	A	13	L	-	HE1	HIS	V	212
R	-	CB	HIS	A	13	L	-	HA	SER	V	243
R	-	CB	HIS	A	13	L	-	HB2	SER	V	243
R	-	O	HIS	A	13	L	H	NE	ARG	V	57
R	-	O	HIS	A	13	L	H	NH1	ARG	V	57
R	-	O	HIS	A	13	L	H	NH2	ARG	V	57
R	-	O	HIS	A	13	L	H	CZ	ARG	V	57
R	-	O	HIS	A	13	L	H	HD3	ARG	V	57
R	-	O	HIS	A	13	L	H	HE	ARG	V	57
R	-	O	HIS	A	13	L	H	HH11	ARG	V	57
R	-	O	HIS	A	13	L	H	HH12	ARG	V	57
R	-	O	HIS	A	13	L	H	HH21	ARG	V	57
R	-	O	HIS	A	13	L	H	HH22	ARG	V	57
R	-	CG	HIS	A	13	L	-	O	VAL	V	210
R	-	CG	HIS	A	13	L	-	HE1	HIS	V	212
R	-	CG	HIS	A	13	L	-	CA	SER	V	243
R	-	CG	HIS	A	13	L	-	CB	SER	V	243
R	-	CG	HIS	A	13	L	-	HA	SER	V	243
R	-	CG	HIS	A	13	L	-	HB2	SER	V	243
R	-	CD2	HIS	A	13	L	-	CA	VAL	V	210
R	-	CD2	HIS	A	13	L	-	C	VAL	V	210
R	-	CD2	HIS	A	13	L	-	O	VAL	V	210
R	-	CD2	HIS	A	13	L	-	HA	VAL	V	210
R	-	CD2	HIS	A	13	L	-	HB	VAL	V	210
R	-	CD2	HIS	A	13	L	-	HA	SER	V	211
R	-	CD2	HIS	A	13	L	-	CA	SER	V	243
R	-	CD2	HIS	A	13	L	-	CB	SER	V	243
R	-	CD2	HIS	A	13	L	-	OG	SER	V	243
R	-	CD2	HIS	A	13	L	-	HA	SER	V	243
R	-	CD2	HIS	A	13	L	-	HB2	SER	V	243
R	-	CD2	HIS	A	13	L	-	HB3	SER	V	243
R	-	ND1	HIS	A	13	L	-	O	VAL	V	210
R	-	ND1	HIS	A	13	L	-	HA	SER	V	211
R	-	ND1	HIS	A	13	L	-	ND1	HIS	V	212
R	-	ND1	HIS	A	13	L	-	CE1	HIS	V	212
R	-	ND1	HIS	A	13	L	-	H	HIS	V	212
R	-	ND1	HIS	A	13	L	-	HE1	HIS	V	212
R	-	ND1	HIS	A	13	L	-	N	SER	V	243
R	-	ND1	HIS	A	13	L	-	CA	SER	V	243
R	-	ND1	HIS	A	13	L	-	CB	SER	V	243
R	-	ND1	HIS	A	13	L	-	OG	SER	V	243
R	-	ND1	HIS	A	13	L	-	H	SER	V	243
R	-	ND1	HIS	A	13	L	-	HA	SER	V	243
R	-	ND1	HIS	A	13	L	-	HB2	SER	V	243
R	-	CE1	HIS	A	13	L	-	C	VAL	V	210
R	-	CE1	HIS	A	13	L	-	O	VAL	V	210
R	-	CE1	HIS	A	13	L	-	N	SER	V	211
R	-	CE1	HIS	A	13	L	-	CA	SER	V	211
R	-	CE1	HIS	A	13	L	-	C	SER	V	211
R	-	CE1	HIS	A	13	L	-	HA	SER	V	211
R	-	CE1	HIS	A	13	L	-	N	HIS	V	212
R	-	CE1	HIS	A	13	L	-	CG	HIS	V	212
R	-	CE1	HIS	A	13	L	-	ND1	HIS	V	212
R	-	CE1	HIS	A	13	L	-	CE1	HIS	V	212
R	-	CE1	HIS	A	13	L	-	H	HIS	V	212
R	-	CE1	HIS	A	13	L	-	HE1	HIS	V	212
R	-	CE1	HIS	A	13	L	-	N	SER	V	243
R	-	CE1	HIS	A	13	L	-	CA	SER	V	243
R	-	CE1	HIS	A	13	L	-	CB	SER	V	243
R	-	CE1	HIS	A	13	L	-	OG	SER	V	243
R	-	CE1	HIS	A	13	L	-	H	SER	V	243
R	-	CE1	HIS	A	13	L	-	HA	SER	V	243
R	-	CE1	HIS	A	13	L	-	HB2	SER	V	243
R	-	CE1	HIS	A	13	L	-	HB3	SER	V	243
R	-	CE1	HIS	A	13	L	-	HG	SER	V	243
R	-	NE2	HIS	A	13	L	-	CA	VAL	V	210
R	-	NE2	HIS	A	13	L	-	C	VAL	V	210
R	-	NE2	HIS	A	13	L	-	CB	VAL	V	210
R	-	NE2	HIS	A	13	L	-	O	VAL	V	210
R	-	NE2	HIS	A	13	L	-	HA	VAL	V	210
R	-	NE2	HIS	A	13	L	-	HB	VAL	V	210
R	-	NE2	HIS	A	13	L	-	N	SER	V	211
R	-	NE2	HIS	A	13	L	-	CA	SER	V	211
R	-	NE2	HIS	A	13	L	-	HA	SER	V	211
R	-	NE2	HIS	A	13	L	-	H	HIS	V	212
R	-	NE2	HIS	A	13	L	-	CA	SER	V	243
R	-	NE2	HIS	A	13	L	-	CB	SER	V	243
R	-	NE2	HIS	A	13	L	-	OG	SER	V	243
R	-	NE2	HIS	A	13	L	-	H	SER	V	243
R	-	NE2	HIS	A	13	L	-	HA	SER	V	243
R	-	NE2	HIS	A	13	L	-	HB2	SER	V	243
R	-	NE2	HIS	A	13	L	-	HB3	SER	V	243
R	-	NE2	HIS	A	13	L	-	HG	SER	V	243
R	-	N	ILE	A	14	L	-	O	LEU	V	242
R	-	C	ILE	A	14	L	-	HE1	HIS	V	212
R	-	C	ILE	A	14	L	-	HB3	LEU	V	242
R	-	C	ILE	A	14	L	-	HD11	LEU	V	242
R	-	CB	ILE	A	14	L	-	O	LEU	V	242
R	-	CB	ILE	A	14	L	-	HB3	LEU	V	242
R	-	CB	ILE	A	14	L	-	NE2	GLN	V	245
R	-	CB	ILE	A	14	L	-	HE21	GLN	V	245
R	-	CB	ILE	A	14	L	-	HE22	GLN	V	245
R	-	O	ILE	A	14	L	-	CE1	HIS	V	212
R	-	O	ILE	A	14	L	-	NE2	HIS	V	212
R	-	O	ILE	A	14	L	-	HE1	HIS	V	212
R	-	O	ILE	A	14	L	-	HE2	HIS	V	212
R	-	O	ILE	A	14	L	-	CB	LEU	V	242
R	-	O	ILE	A	14	L	-	CD1	LEU	V	242
R	-	O	ILE	A	14	L	-	HB2	LEU	V	242
R	-	O	ILE	A	14	L	-	HB3	LEU	V	242
R	-	O	ILE	A	14	L	-	HD11	LEU	V	242
R	-	O	ILE	A	14	L	-	HD12	LEU	V	242
R	-	CG1	ILE	A	14	L	-	HE21	GLN	V	245
R	-	CG2	ILE	A	14	L	-	HE22	GLN	V	245
R	-	CD1	ILE	A	14	L	-	CD	GLN	V	245
R	-	CD1	ILE	A	14	L	-	NE2	GLN	V	245
R	-	CD1	ILE	A	14	L	-	HG2	GLN	V	245
R	-	CD1	ILE	A	14	L	-	HG3	GLN	V	245
R	-	CD1	ILE	A	14	L	-	HE21	GLN	V	245
R	-	CD1	ILE	A	14	L	-	HE22	GLN	V	245
R	-	CA	VAL	A	15	L	H	HH22	ARG	V	64
R	-	CA	VAL	A	15	L	-	HE2	HIS	V	212
R	-	C	VAL	A	15	L	H	HH22	ARG	V	64
R	-	CB	VAL	A	15	L	H	HG2	ARG	V	57
R	-	CB	VAL	A	15	L	H	OE1	GLN	V	60
R	-	CB	VAL	A	15	L	H	NH2	ARG	V	64
R	-	CB	VAL	A	15	L	H	HH12	ARG	V	64
R	-	CB	VAL	A	15	L	H	HH22	ARG	V	64
R	-	CG1	VAL	A	15	L	H	CD	GLN	V	60
R	-	CG1	VAL	A	15	L	H	NE2	GLN	V	60
R	-	CG1	VAL	A	15	L	H	OE1	GLN	V	60
R	-	CG1	VAL	A	15	L	H	HB2	GLN	V	60
R	-	CG1	VAL	A	15	L	H	HE22	GLN	V	60
R	-	CG1	VAL	A	15	L	H	NH1	ARG	V	64
R	-	CG1	VAL	A	15	L	H	NH2	ARG	V	64
R	-	CG1	VAL	A	15	L	H	CZ	ARG	V	64
R	-	CG1	VAL	A	15	L	H	HH12	ARG	V	64
R	-	CG1	VAL	A	15	L	H	HH21	ARG	V	64
R	-	CG1	VAL	A	15	L	H	HH22	ARG	V	64
R	-	CG2	VAL	A	15	L	H	HA	ARG	V	57
R	-	CG2	VAL	A	15	L	H	HG2	ARG	V	57
R	-	CG2	VAL	A	15	L	H	OE1	GLN	V	60
R	-	CG2	VAL	A	15	L	H	HH12	ARG	V	64
R	-	CG2	VAL	A	15	L	H	HH22	ARG	V	64
R	-	CG2	VAL	A	15	L	-	HE1	HIS	V	212
R	-	N	LEU	A	16	L	-	HD11	LEU	V	242
R	-	CA	LEU	A	16	L	-	HD11	LEU	V	242
R	-	C	LEU	A	16	L	H	HH21	ARG	V	64
R	-	C	LEU	A	16	L	H	HH22	ARG	V	64
R	-	CB	LEU	A	16	L	S	HH	TYR	V	214
R	-	CB	LEU	A	16	L	-	CD1	LEU	V	242
R	-	CB	LEU	A	16	L	-	HD11	LEU	V	242
R	-	CB	LEU	A	16	L	-	HD12	LEU	V	242
R	-	CB	LEU	A	16	L	-	HD13	LEU	V	242
R	-	O	LEU	A	16	L	H	NH2	ARG	V	64
R	-	O	LEU	A	16	L	H	HH21	ARG	V	64
R	-	O	LEU	A	16	L	H	HH22	ARG	V	64
R	-	O	LEU	A	16	L	S	OH	TYR	V	214
R	-	O	LEU	A	16	L	S	HH	TYR	V	214
R	-	CG	LEU	A	16	L	-	HD11	LEU	V	242
R	-	CG	LEU	A	16	L	-	HD13	LEU	V	242
R	-	CD1	LEU	A	16	L	-	CD1	LEU	V	242
R	-	CD1	LEU	A	16	L	-	HD11	LEU	V	242
R	-	CD1	LEU	A	16	L	-	HD13	LEU	V	242
R	-	CD1	LEU	A	16	L	-	HD22	LEU	V	242
R	-	CD1	LEU	A	16	L	-	HD23	LEU	V	242
R	-	CD2	LEU	A	16	L	-	HD13	LEU	V	242
R	-	CD2	LEU	A	16	L	-	HD22	LEU	V	242
R	-	CD1	TRP	A	17	L	H	NE2	GLN	V	60
R	-	CD1	TRP	A	17	L	H	HE21	GLN	V	60
R	-	CD1	TRP	A	17	L	H	HE22	GLN	V	60
R	-	CD1	TRP	A	17	L	H	HH22	ARG	V	64
R	-	CE2	TRP	A	17	L	H	NE2	GLN	V	60
R	-	CE2	TRP	A	17	L	H	HG2	GLN	V	60
R	-	CE2	TRP	A	17	L	H	HE21	GLN	V	60
R	-	CE2	TRP	A	17	L	H	HE22	GLN	V	60
R	-	CE3	TRP	A	17	L	S	O	ALA	V	84
R	-	CE3	TRP	A	17	L	S	HA	GLU	V	85
R	-	NE1	TRP	A	17	L	H	CG	GLN	V	60
R	-	NE1	TRP	A	17	L	H	CD	GLN	V	60
R	-	NE1	TRP	A	17	L	H	NE2	GLN	V	60
R	-	NE1	TRP	A	17	L	H	OE1	GLN	V	60
R	-	NE1	TRP	A	17	L	H	HG2	GLN	V	60
R	-	NE1	TRP	A	17	L	H	HE21	GLN	V	60
R	-	NE1	TRP	A	17	L	H	HE22	GLN	V	60
R	-	NE1	TRP	A	17	L	H	HH22	ARG	V	64
R	-	CH2	TRP	A	17	L	S	CG	LEU	V	83
R	-	CH2	TRP	A	17	L	S	HG	LEU	V	83
R	-	CH2	TRP	A	17	L	S	HD21	LEU	V	83
R	-	CH2	TRP	A	17	L	S	HD23	LEU	V	83
R	-	CH2	TRP	A	17	L	S	C	ALA	V	84
R	-	CH2	TRP	A	17	L	S	O	ALA	V	84
R	-	CH2	TRP	A	17	L	S	N	GLU	V	85
R	-	CH2	TRP	A	17	L	S	CA	GLU	V	85
R	-	CH2	TRP	A	17	L	S	C	GLU	V	85
R	-	CH2	TRP	A	17	L	S	HA	GLU	V	85
R	-	CH2	TRP	A	17	L	S	N	VAL	V	86
R	-	CH2	TRP	A	17	L	S	H	VAL	V	86
R	-	CH2	TRP	A	17	L	S	HG21	VAL	V	86
R	-	CZ2	TRP	A	17	L	H	NE2	GLN	V	60
R	-	CZ2	TRP	A	17	L	H	HG2	GLN	V	60
R	-	CZ2	TRP	A	17	L	H	HE21	GLN	V	60
R	-	CZ2	TRP	A	17	L	S	HG	LEU	V	83
R	-	CZ2	TRP	A	17	L	S	HD21	LEU	V	83
R	-	CZ2	TRP	A	17	L	S	HD23	LEU	V	83
R	-	CZ2	TRP	A	17	L	S	HA	GLU	V	85
R	-	CZ2	TRP	A	17	L	S	H	VAL	V	86
R	-	CZ2	TRP	A	17	L	S	HG21	VAL	V	86
R	-	CZ3	TRP	A	17	L	S	O	LEU	V	83
R	-	CZ3	TRP	A	17	L	S	HG	LEU	V	83
R	-	CZ3	TRP	A	17	L	S	C	ALA	V	84
R	-	CZ3	TRP	A	17	L	S	O	ALA	V	84
R	-	CZ3	TRP	A	17	L	S	HA	ALA	V	84
R	-	CZ3	TRP	A	17	L	S	N	GLU	V	85
R	-	CZ3	TRP	A	17	L	S	CA	GLU	V	85
R	-	CZ3	TRP	A	17	L	S	HA	GLU	V	85
R	-	O	ARG	A	19	L	S	OE1	GLU	V	108
R	-	NE	ARG	A	19	L	-	HE2	TYR	V	110
R	-	NH1	ARG	A	19	L	S	HG11	VAL	V	82
R	-	NH1	ARG	A	19	L	-	CD2	TYR	V	110
R	-	NH1	ARG	A	19	L	-	CE2	TYR	V	110
R	-	NH1	ARG	A	19	L	-	OH	TYR	V	110
R	-	NH1	ARG	A	19	L	-	CZ	TYR	V	110
R	-	NH1	ARG	A	19	L	-	HD2	TYR	V	110
R	-	NH1	ARG	A	19	L	-	HE2	TYR	V	110
R	-	NH1	ARG	A	19	L	-	HH	TYR	V	110
R	-	NH2	ARG	A	19	L	-	CE2	TYR	V	110
R	-	NH2	ARG	A	19	L	-	OH	TYR	V	110
R	-	NH2	ARG	A	19	L	-	HE2	TYR	V	110
R	-	NH2	ARG	A	19	L	-	HH	TYR	V	110
R	-	CZ	ARG	A	19	L	-	CE2	TYR	V	110
R	-	CZ	ARG	A	19	L	-	HE2	TYR	V	110
R	-	CZ	ARG	A	19	L	-	HH	TYR	V	110
R	-	CB	ILE	A	20	L	-	NH2	ARG	V	122
R	-	CB	ILE	A	20	L	-	HH21	ARG	V	122
R	-	CB	ILE	A	20	L	-	HH22	ARG	V	122
R	-	CG1	ILE	A	20	L	S	OE1	GLU	V	108
R	-	CG1	ILE	A	20	L	S	OE2	GLU	V	108
R	-	CG1	ILE	A	20	L	-	NH2	ARG	V	122
R	-	CG1	ILE	A	20	L	-	HH21	ARG	V	122
R	-	CG1	ILE	A	20	L	-	HH22	ARG	V	122
R	-	CG2	ILE	A	20	L	H	CD1	LEU	V	115
R	-	CG2	ILE	A	20	L	H	HD11	LEU	V	115
R	-	CG2	ILE	A	20	L	H	HD12	LEU	V	115
R	-	CG2	ILE	A	20	L	H	HD13	LEU	V	115
R	-	CG2	ILE	A	20	L	-	NH2	ARG	V	122
R	-	CG2	ILE	A	20	L	-	HH12	ARG	V	122
R	-	CG2	ILE	A	20	L	-	HH21	ARG	V	122
R	-	CG2	ILE	A	20	L	-	HH22	ARG	V	122
R	-	CD1	ILE	A	20	L	S	OE1	GLU	V	108
R	-	CD1	ILE	A	20	L	S	OE2	GLU	V	108
R	-	CD1	ILE	A	20	L	-	NH2	ARG	V	122
R	-	CD1	ILE	A	20	L	-	CZ	ARG	V	122
R	-	CD1	ILE	A	20	L	-	HH21	ARG	V	122
R	-	CD1	ILE	A	20	L	-	HH22	ARG	V	122
R	-	O	ALA	A	21	L	H	CB	PRO	V	112
R	-	O	ALA	A	21	L	H	CG	PRO	V	112
R	-	O	ALA	A	21	L	H	HB2	PRO	V	112
R	-	O	ALA	A	21	L	H	HB3	PRO	V	112
R	-	O	ALA	A	21	L	H	HG2	PRO	V	112
R	-	O	ALA	A	21	L	H	HD12	LEU	V	115
R	-	N	SER	A	22	L	H	HB2	PRO	V	112
R	-	N	SER	A	22	L	H	HD12	LEU	V	115
R	-	CA	SER	A	22	L	H	HB2	PRO	V	112
R	-	CA	SER	A	22	L	H	HD12	LEU	V	115
R	-	CB	SER	A	22	L	H	HB2	PRO	V	112
R	-	CB	SER	A	22	L	H	HB2	LEU	V	115
R	-	CB	SER	A	22	L	H	HD12	LEU	V	115
R	-	OG1	THR	A	23	L	H	HG3	PRO	V	112
R	-	NE2	GLN	A	29	L	-	SD	MET	V	1
R	-	NE2	GLN	A	29	L	-	CE	MET	V	1
R	-	NE2	GLN	A	29	L	-	HE1	MET	V	1
R	-	CA	VAL	A	32	L	-	NH1	ARG	V	4
R	-	CA	VAL	A	32	L	-	HH11	ARG	V	4
R	-	CA	VAL	A	32	L	-	HH12	ARG	V	4
R	-	C	VAL	A	32	L	-	NH1	ARG	V	4
R	-	C	VAL	A	32	L	-	HH11	ARG	V	4
R	-	C	VAL	A	32	L	-	HH12	ARG	V	4
R	-	CB	VAL	A	32	L	-	CD	ARG	V	4
R	-	CB	VAL	A	32	L	-	NE	ARG	V	4
R	-	CB	VAL	A	32	L	-	NH1	ARG	V	4
R	-	CB	VAL	A	32	L	-	CZ	ARG	V	4
R	-	CB	VAL	A	32	L	-	HD2	ARG	V	4
R	-	CB	VAL	A	32	L	-	HD3	ARG	V	4
R	-	CB	VAL	A	32	L	-	HH11	ARG	V	4
R	-	CB	VAL	A	32	L	-	HH12	ARG	V	4
R	-	O	VAL	A	32	L	-	NH1	ARG	V	4
R	-	O	VAL	A	32	L	-	HH11	ARG	V	4
R	-	O	VAL	A	32	L	-	HH12	ARG	V	4
R	-	CG1	VAL	A	32	L	-	CD	ARG	V	4
R	-	CG1	VAL	A	32	L	-	NE	ARG	V	4
R	-	CG1	VAL	A	32	L	-	NH1	ARG	V	4
R	-	CG1	VAL	A	32	L	-	NH2	ARG	V	4
R	-	CG1	VAL	A	32	L	-	CZ	ARG	V	4
R	-	CG1	VAL	A	32	L	-	HD2	ARG	V	4
R	-	CG1	VAL	A	32	L	-	HD3	ARG	V	4
R	-	CG1	VAL	A	32	L	-	HH11	ARG	V	4
R	-	CG1	VAL	A	32	L	-	HH12	ARG	V	4
R	-	CG1	VAL	A	32	L	-	HH22	ARG	V	4
R	-	CG2	VAL	A	32	L	-	CD	ARG	V	4
R	-	CG2	VAL	A	32	L	-	NH1	ARG	V	4
R	-	CG2	VAL	A	32	L	-	HB2	ARG	V	4
R	-	CG2	VAL	A	32	L	-	HD2	ARG	V	4
R	-	CG2	VAL	A	32	L	-	HD3	ARG	V	4
R	-	CG2	VAL	A	32	L	-	HH11	ARG	V	4
R	-	C	ASN	A	33	L	-	HH12	ARG	V	4
R	-	O	ASN	A	33	L	-	HH12	ARG	V	4
R	-	N	ASN	A	34	L	-	HH12	ARG	V	4
R	-	CG	ASN	A	34	L	-	HH22	ARG	V	4
R	-	OD1	ASN	A	34	L	-	NH1	ARG	V	4
R	-	OD1	ASN	A	34	L	-	NH2	ARG	V	4
R	-	OD1	ASN	A	34	L	-	HH12	ARG	V	4
R	-	OD1	ASN	A	34	L	-	HH21	ARG	V	4
R	-	OD1	ASN	A	34	L	-	HH22	ARG	V	4
R	S	CB	LEU	A	50	L	-	HG3	PRO	V	9
R	S	CG	LEU	A	50	L	-	HB3	PRO	V	9
R	S	CG	LEU	A	50	L	-	HG3	PRO	V	9
R	S	CD1	LEU	A	50	L	-	CB	PRO	V	9
R	S	CD1	LEU	A	50	L	-	HB3	PRO	V	9
R	S	CD1	LEU	A	50	L	-	HG3	PRO	V	9
R	S	CD2	LEU	A	50	L	-	HG3	PRO	V	9
R	S	N	THR	A	74	L	-	HD23	LEU	V	8
R	S	CA	THR	A	74	L	-	CD2	LEU	V	8
R	S	CA	THR	A	74	L	-	HD22	LEU	V	8
R	S	CA	THR	A	74	L	-	HD23	LEU	V	8
R	S	C	THR	A	74	L	-	CD2	LEU	V	8
R	S	C	THR	A	74	L	-	HD21	LEU	V	8
R	S	C	THR	A	74	L	-	HD22	LEU	V	8
R	S	C	THR	A	74	L	-	HD23	LEU	V	8
R	S	CB	THR	A	74	L	-	CD2	LEU	V	8
R	S	CB	THR	A	74	L	-	HD21	LEU	V	8
R	S	CB	THR	A	74	L	-	HD22	LEU	V	8
R	S	CB	THR	A	74	L	-	HD23	LEU	V	8
R	S	CB	THR	A	74	L	-	CG	PRO	V	9
R	S	CB	THR	A	74	L	-	CD	PRO	V	9
R	S	CB	THR	A	74	L	-	HG2	PRO	V	9
R	S	CB	THR	A	74	L	-	HG3	PRO	V	9
R	S	CB	THR	A	74	L	-	HD2	PRO	V	9
R	S	CB	THR	A	74	L	-	HD3	PRO	V	9
R	S	O	THR	A	74	L	-	CG	LEU	V	8
R	S	O	THR	A	74	L	-	CD1	LEU	V	8
R	S	O	THR	A	74	L	-	CD2	LEU	V	8
R	S	O	THR	A	74	L	-	HD12	LEU	V	8
R	S	O	THR	A	74	L	-	HD13	LEU	V	8
R	S	O	THR	A	74	L	-	HD21	LEU	V	8
R	S	O	THR	A	74	L	-	HD22	LEU	V	8
R	S	O	THR	A	74	L	-	HD23	LEU	V	8
R	S	CG2	THR	A	74	L	-	CD2	LEU	V	8
R	S	CG2	THR	A	74	L	-	HD21	LEU	V	8
R	S	CG2	THR	A	74	L	-	HD22	LEU	V	8
R	S	CG2	THR	A	74	L	-	HD23	LEU	V	8
R	S	CG2	THR	A	74	L	-	CB	PRO	V	9
R	S	CG2	THR	A	74	L	-	CG	PRO	V	9
R	S	CG2	THR	A	74	L	-	CD	PRO	V	9
R	S	CG2	THR	A	74	L	-	HG2	PRO	V	9
R	S	CG2	THR	A	74	L	-	HG3	PRO	V	9
R	S	CG2	THR	A	74	L	-	HD2	PRO	V	9
R	S	CG2	THR	A	74	L	-	HD3	PRO	V	9
R	S	OG1	THR	A	74	L	-	HD23	LEU	V	8
R	S	OG1	THR	A	74	L	-	CG	PRO	V	9
R	S	OG1	THR	A	74	L	-	CD	PRO	V	9
R	S	OG1	THR	A	74	L	-	HG2	PRO	V	9
R	S	OG1	THR	A	74	L	-	HG3	PRO	V	9
R	S	OG1	THR	A	74	L	-	HD2	PRO	V	9
R	S	OG1	THR	A	74	L	-	HD3	PRO	V	9
R	S	N	SER	A	75	L	-	HD22	LEU	V	8
R	S	CA	SER	A	75	L	-	HD22	LEU	V	8
R	-	C	ASP	A	141	L	-	HZ2	TRP	V	12
R	-	C	ASP	A	141	L	-	HE1	TRP	V	12
R	-	O	ASP	A	141	L	-	CE2	TRP	V	12
R	-	O	ASP	A	141	L	-	NE1	TRP	V	12
R	-	O	ASP	A	141	L	-	CZ2	TRP	V	12
R	-	O	ASP	A	141	L	-	HZ2	TRP	V	12
R	-	O	ASP	A	141	L	-	HE1	TRP	V	12
R	-	N	GLU	A	142	L	-	HZ2	TRP	V	12
R	-	CA	GLU	A	142	L	-	HZ2	TRP	V	12
R	-	C	GLU	A	142	L	-	CZ2	TRP	V	12
R	-	C	GLU	A	142	L	-	HZ2	TRP	V	12
R	-	CB	GLU	A	142	L	-	NE1	TRP	V	12
R	-	CB	GLU	A	142	L	-	HZ2	TRP	V	12
R	-	CB	GLU	A	142	L	-	HE1	TRP	V	12
R	-	O	GLU	A	142	L	-	CH2	TRP	V	12
R	-	O	GLU	A	142	L	-	CZ2	TRP	V	12
R	-	O	GLU	A	142	L	-	HH2	TRP	V	12
R	-	O	GLU	A	142	L	-	HZ2	TRP	V	12
R	-	CG	GLU	A	142	L	-	HB2	PRO	V	9
R	-	CG	GLU	A	142	L	-	HG2	PRO	V	9
R	-	CG	GLU	A	142	L	-	HE1	TRP	V	12
R	-	CD	GLU	A	142	L	-	CB	PRO	V	9
R	-	CD	GLU	A	142	L	-	CG	PRO	V	9
R	-	CD	GLU	A	142	L	-	HB2	PRO	V	9
R	-	CD	GLU	A	142	L	-	HG2	PRO	V	9
R	-	OE1	GLU	A	142	L	-	CB	PRO	V	9
R	-	OE1	GLU	A	142	L	-	CG	PRO	V	9
R	-	OE1	GLU	A	142	L	-	CD	PRO	V	9
R	-	OE1	GLU	A	142	L	-	HB2	PRO	V	9
R	-	OE1	GLU	A	142	L	-	HB3	PRO	V	9
R	-	OE1	GLU	A	142	L	-	HG2	PRO	V	9
R	-	OE1	GLU	A	142	L	-	HG3	PRO	V	9
R	-	OE1	GLU	A	142	L	-	HD2	PRO	V	9
R	-	OE1	GLU	A	142	L	-	HD3	PRO	V	9
R	-	OE2	GLU	A	142	L	-	HB2	PRO	V	9
R	-	OE2	GLU	A	142	L	-	HG2	PRO	V	9
R	-	OE2	GLU	A	142	L	-	O	ALA	V	10
R	-	OE2	GLU	A	142	L	-	HA	PRO	V	11
R	-	OE2	GLU	A	142	L	-	HE1	TRP	V	12
R	H	N	CYS	A	143	L	-	CZ2	TRP	V	12
R	H	N	CYS	A	143	L	-	HH2	TRP	V	12
R	H	N	CYS	A	143	L	-	HZ2	TRP	V	12
R	H	CA	CYS	A	143	L	-	CH2	TRP	V	12
R	H	CA	CYS	A	143	L	-	CZ2	TRP	V	12
R	H	CA	CYS	A	143	L	-	HH2	TRP	V	12
R	H	CA	CYS	A	143	L	-	HZ2	TRP	V	12
R	H	C	CYS	A	143	L	-	HH2	TRP	V	12
R	H	CB	CYS	A	143	L	-	HH2	TRP	V	12
R	H	O	CYS	A	143	L	-	HH2	TRP	V	12
R	S	CB	ASN	A	146	L	-	HZ3	TRP	V	12
R	S	ND2	ASN	A	146	L	-	HZ3	TRP	V	12
R	-	CA	PRO	A	280	L	-	NE2	GLN	V	2
R	-	CA	PRO	A	280	L	-	HE21	GLN	V	2
R	-	CA	PRO	A	280	L	-	HE22	GLN	V	2
R	-	C	PRO	A	280	L	-	NE2	GLN	V	2
R	-	C	PRO	A	280	L	-	HE22	GLN	V	2
R	-	CB	PRO	A	280	L	-	NE2	GLN	V	2
R	-	CB	PRO	A	280	L	-	HE21	GLN	V	2
R	-	CB	PRO	A	280	L	-	HE22	GLN	V	2
R	H	N	TYR	A	281	L	-	CD	GLN	V	2
R	H	N	TYR	A	281	L	-	NE2	GLN	V	2
R	H	N	TYR	A	281	L	-	OE1	GLN	V	2
R	H	N	TYR	A	281	L	-	HE21	GLN	V	2
R	H	N	TYR	A	281	L	-	HE22	GLN	V	2
R	H	CA	TYR	A	281	L	-	HE22	GLN	V	2
R	H	CB	TYR	A	281	L	-	CD	GLN	V	2
R	H	CB	TYR	A	281	L	-	NE2	GLN	V	2
R	H	CB	TYR	A	281	L	-	OE1	GLN	V	2
R	H	CB	TYR	A	281	L	-	HE22	GLN	V	2
R	H	CD1	TYR	A	281	L	-	HG2	ARG	V	4
R	H	CE1	TYR	A	281	L	-	HG2	ARG	V	4
R	H	CE1	TYR	A	281	L	-	HE	ARG	V	4
R	H	OH	TYR	A	281	L	-	HE	ARG	V	4
R	H	OH	TYR	A	281	L	-	HH21	ARG	V	4
R	H	CZ	TYR	A	281	L	-	HE	ARG	V	4
R	H	CB	GLU	A	282	L	-	HB2	ARG	V	5
R	H	CB	GLU	A	282	L	-	HG3	ARG	V	5
R	H	CB	GLU	A	282	L	-	HD2	ARG	V	5
R	H	CG	GLU	A	282	L	-	H	ARG	V	5
R	H	CG	GLU	A	282	L	-	HB2	ARG	V	5
R	H	CG	GLU	A	282	L	-	HG3	ARG	V	5
R	H	CG	GLU	A	282	L	-	HD2	ARG	V	5
R	H	CD	GLU	A	282	L	-	HB3	GLN	V	2
R	H	OE1	GLU	A	282	L	-	CB	GLN	V	2
R	H	OE1	GLU	A	282	L	-	CD	GLN	V	2
R	H	OE1	GLU	A	282	L	-	HB3	GLN	V	2
R	H	OE1	GLU	A	282	L	-	O	PRO	V	3
R	H	OE1	GLU	A	282	L	-	HA	ARG	V	4
R	H	OE2	GLU	A	282	L	-	NE2	GLN	V	2
R	H	OE2	GLU	A	282	L	-	HE21	GLN	V	2
R	H	OE2	GLU	A	282	L	-	HE22	GLN	V	2
R	H	CD	GLU	A	283	L	-	HH12	ARG	V	5
R	H	OE1	GLU	A	283	L	-	NH1	ARG	V	5
R	H	OE1	GLU	A	283	L	-	HH11	ARG	V	5
R	H	OE1	GLU	A	283	L	-	HH12	ARG	V	5
R	-	C	GLU	A	316	L	-	H3	MET	V	1
R	-	O	GLU	A	316	L	-	H3	MET	V	1
R	-	N	LEU	A	317	L	-	H1	MET	V	1
R	-	N	LEU	A	317	L	-	H3	MET	V	1
R	-	CA	LEU	A	317	L	-	N	MET	V	1
R	-	CA	LEU	A	317	L	-	CA	MET	V	1
R	-	CA	LEU	A	317	L	-	HA	MET	V	1
R	-	CA	LEU	A	317	L	-	H1	MET	V	1
R	-	CA	LEU	A	317	L	-	H2	MET	V	1
R	-	CA	LEU	A	317	L	-	H3	MET	V	1
R	-	C	LEU	A	317	L	-	N	MET	V	1
R	-	C	LEU	A	317	L	-	CA	MET	V	1
R	-	C	LEU	A	317	L	-	HA	MET	V	1
R	-	C	LEU	A	317	L	-	H1	MET	V	1
R	-	C	LEU	A	317	L	-	H3	MET	V	1
R	-	C	LEU	A	317	L	-	N	GLN	V	2
R	-	C	LEU	A	317	L	-	H	GLN	V	2
R	-	C	LEU	A	317	L	-	HG3	GLN	V	2
R	-	CB	LEU	A	317	L	-	N	MET	V	1
R	-	CB	LEU	A	317	L	-	H1	MET	V	1
R	-	CB	LEU	A	317	L	-	H2	MET	V	1
R	-	CB	LEU	A	317	L	-	H3	MET	V	1
R	-	CB	LEU	A	317	L	-	HG3	GLN	V	2
R	-	O	LEU	A	317	L	-	N	MET	V	1
R	-	O	LEU	A	317	L	-	CA	MET	V	1
R	-	O	LEU	A	317	L	-	C	MET	V	1
R	-	O	LEU	A	317	L	-	HA	MET	V	1
R	-	O	LEU	A	317	L	-	H1	MET	V	1
R	-	O	LEU	A	317	L	-	H3	MET	V	1
R	-	O	LEU	A	317	L	-	N	GLN	V	2
R	-	O	LEU	A	317	L	-	CA	GLN	V	2
R	-	O	LEU	A	317	L	-	CB	GLN	V	2
R	-	O	LEU	A	317	L	-	CG	GLN	V	2
R	-	O	LEU	A	317	L	-	H	GLN	V	2
R	-	O	LEU	A	317	L	-	HB2	GLN	V	2
R	-	O	LEU	A	317	L	-	HG3	GLN	V	2
R	-	CG	LEU	A	317	L	-	N	MET	V	1
R	-	CG	LEU	A	317	L	-	H1	MET	V	1
R	-	CG	LEU	A	317	L	-	H2	MET	V	1
R	-	CG	LEU	A	317	L	-	H3	MET	V	1
R	-	CD1	LEU	A	317	L	-	H1	MET	V	1
R	-	CD2	LEU	A	317	L	-	N	MET	V	1
R	-	CD2	LEU	A	317	L	-	H1	MET	V	1
R	-	CD2	LEU	A	317	L	-	H2	MET	V	1
R	-	CD2	LEU	A	317	L	-	H3	MET	V	1
R	S	N	LYS	A	319	L	-	OE1	GLN	V	2
R	S	O	LYS	A	319	L	-	OE1	GLN	V	2
R	S	O	LYS	A	319	L	-	HE22	GLN	V	2
R	-	NE	ARG	A	433	L	-	HH12	ARG	V	19
R	-	NH1	ARG	A	433	L	-	HH12	ARG	V	19
R	-	NH2	ARG	A	433	L	-	NH1	ARG	V	19
R	-	NH2	ARG	A	433	L	-	CZ	ARG	V	19
R	-	NH2	ARG	A	433	L	-	HH11	ARG	V	19
R	-	NH2	ARG	A	433	L	-	HH12	ARG	V	19
R	-	NH2	ARG	A	433	L	-	HH22	ARG	V	19
R	-	CZ	ARG	A	433	L	-	NH1	ARG	V	19
R	-	CZ	ARG	A	433	L	-	HH12	ARG	V	19
R	-	CB	GLU	A	480	L	H	HH12	ARG	V	56
R	-	CD	GLU	A	480	L	H	HH12	ARG	V	56
R	-	OE2	GLU	A	480	L	H	NH1	ARG	V	56
R	-	OE2	GLU	A	480	L	H	HH11	ARG	V	56
R	-	OE2	GLU	A	480	L	H	HH12	ARG	V	56
R	-	OE2	GLU	A	480	L	H	HH22	ARG	V	56

- 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