IID

A1L453_P00749.1 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	-	LEU	A	10	L	-	ARG	V	159
R	-	LEU	A	10	L	-	ILE	V	160
R	-	LEU	A	10	L	-	VAL	V	161
R	-	LEU	A	10	L	-	PHE	V	162
R	-	HIS	A	107	L	S	ILE	V	136
R	-	CYS	A	11	L	-	ARG	V	159
R	-	LYS	A	118	L	-	ARG	V	104
R	-	LYS	A	118	L	S	LEU	V	137
R	-	LYS	A	118	L	-	HIS	V	138
R	-	LYS	A	118	L	-	PRO	V	139
R	-	LYS	A	118	L	-	THR	V	140
R	-	LYS	A	118	L	-	TYR	V	141
R	-	LYS	A	118	L	-	MET	V	143
R	-	HIS	A	119	L	-	MET	V	143
R	-	VAL	A	12	L	-	ARG	V	159
R	-	VAL	A	12	L	-	VAL	V	161
R	-	LEU	A	13	L	-	THR	V	158
R	-	LEU	A	13	L	-	GLN	V	300
R	-	LEU	A	13	L	-	PRO	V	301
R	-	LEU	A	13	L	-	PRO	V	303
R	-	VAL	A	14	L	-	PRO	V	301
R	-	VAL	A	15	L	S	TRP	V	129
R	-	VAL	A	15	L	-	THR	V	158
R	-	HIS	A	25	L	-	ASN	V	107
R	-	HIS	A	25	L	H	ILE	V	110
R	-	HIS	A	25	L	S	TYR	V	79
R	-	VAL	A	27	L	-	ASP	V	105
R	-	VAL	A	27	L	-	LYS	V	106
R	-	VAL	A	27	L	S	TYR	V	79
R	-	PRO	A	28	L	-	HIS	V	103
R	-	PRO	A	28	L	-	ASP	V	105
R	-	ASN	A	30	L	-	HIS	V	103
R	-	ASN	A	30	L	-	ASP	V	105
R	-	ASP	A	32	L	-	ASP	V	105
R	-	LEU	A	327	L	-	GLU	V	175
R	-	ASN	A	42	L	-	ILE	V	147
R	-	TYR	A	44	L	-	GLU	V	242
R	-	TYR	A	44	L	-	GLY	V	266
R	-	TYR	A	44	L	-	ARG	V	267
R	-	TYR	A	44	L	-	GLY	V	268
R	-	TYR	A	44	L	-	ASN	V	271
R	-	PHE	A	45	L	-	GLU	V	242
R	-	PHE	A	45	L	-	SER	V	245
R	-	PHE	A	45	L	S	TRP	V	265
R	-	PHE	A	45	L	-	GLY	V	266
R	-	ASN	A	47	L	H	HIS	V	100
R	-	ASN	A	47	L	H	CYS	V	101
R	-	ASN	A	47	L	-	HIS	V	103
R	-	ASN	A	47	L	-	LYS	V	106
R	-	ILE	A	48	L	H	HIS	V	100
R	-	ILE	A	48	L	-	TYR	V	141
R	-	ILE	A	48	L	-	PRO	V	146
R	-	ILE	A	48	L	-	ILE	V	147
R	S	HIS	A	49	L	-	HIS	V	103
R	S	HIS	A	49	L	-	TYR	V	141
R	S	HIS	A	49	L	-	GLU	V	142
R	S	TRP	A	50	L	-	GLU	V	142
R	S	TRP	A	50	L	-	PRO	V	146
R	-	GLN	A	60	L	-	ARG	V	104
R	-	GLN	A	60	L	-	TYR	V	141
R	-	GLN	A	60	L	-	GLU	V	142
R	-	HIS	A	61	L	-	ARG	V	104
R	-	LEU	A	8	L	-	SER	V	48
R	-	LEU	A	8	L	-	VAL	V	49
R	-	ASN	A	95	L	-	PRO	V	139
R	-	ALA	A	97	L	H	ILE	V	294

- 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

A1L453_P00749.1 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	-	CG	LEU	A	8	L	-	HA	SER	V	48
R	-	CG	LEU	A	8	L	-	HB3	SER	V	48
R	-	CD1	LEU	A	8	L	-	O	SER	V	48
R	-	CD1	LEU	A	8	L	-	HB3	SER	V	48
R	-	CD2	LEU	A	8	L	-	CA	SER	V	48
R	-	CD2	LEU	A	8	L	-	C	SER	V	48
R	-	CD2	LEU	A	8	L	-	CB	SER	V	48
R	-	CD2	LEU	A	8	L	-	O	SER	V	48
R	-	CD2	LEU	A	8	L	-	OG	SER	V	48
R	-	CD2	LEU	A	8	L	-	HA	SER	V	48
R	-	CD2	LEU	A	8	L	-	HB2	SER	V	48
R	-	CD2	LEU	A	8	L	-	HB3	SER	V	48
R	-	CD2	LEU	A	8	L	-	HG21	VAL	V	49
R	-	CA	LEU	A	10	L	-	NE	ARG	V	159
R	-	CA	LEU	A	10	L	-	NH1	ARG	V	159
R	-	CA	LEU	A	10	L	-	NH2	ARG	V	159
R	-	CA	LEU	A	10	L	-	CZ	ARG	V	159
R	-	CA	LEU	A	10	L	-	HE	ARG	V	159
R	-	CA	LEU	A	10	L	-	HH21	ARG	V	159
R	-	CA	LEU	A	10	L	-	HH22	ARG	V	159
R	-	C	LEU	A	10	L	-	NE	ARG	V	159
R	-	C	LEU	A	10	L	-	NH1	ARG	V	159
R	-	C	LEU	A	10	L	-	NH2	ARG	V	159
R	-	C	LEU	A	10	L	-	CZ	ARG	V	159
R	-	C	LEU	A	10	L	-	HD3	ARG	V	159
R	-	C	LEU	A	10	L	-	HE	ARG	V	159
R	-	C	LEU	A	10	L	-	HH11	ARG	V	159
R	-	C	LEU	A	10	L	-	HH12	ARG	V	159
R	-	C	LEU	A	10	L	-	HH21	ARG	V	159
R	-	C	LEU	A	10	L	-	HH22	ARG	V	159
R	-	CB	LEU	A	10	L	-	NE	ARG	V	159
R	-	CB	LEU	A	10	L	-	NH1	ARG	V	159
R	-	CB	LEU	A	10	L	-	NH2	ARG	V	159
R	-	CB	LEU	A	10	L	-	CZ	ARG	V	159
R	-	CB	LEU	A	10	L	-	HE	ARG	V	159
R	-	CB	LEU	A	10	L	-	HH12	ARG	V	159
R	-	CB	LEU	A	10	L	-	HH21	ARG	V	159
R	-	CB	LEU	A	10	L	-	HH22	ARG	V	159
R	-	O	LEU	A	10	L	-	NH1	ARG	V	159
R	-	O	LEU	A	10	L	-	NH2	ARG	V	159
R	-	O	LEU	A	10	L	-	CZ	ARG	V	159
R	-	O	LEU	A	10	L	-	HH11	ARG	V	159
R	-	O	LEU	A	10	L	-	HH12	ARG	V	159
R	-	O	LEU	A	10	L	-	HH22	ARG	V	159
R	-	CG	LEU	A	10	L	-	NE	ARG	V	159
R	-	CG	LEU	A	10	L	-	NH2	ARG	V	159
R	-	CG	LEU	A	10	L	-	CZ	ARG	V	159
R	-	CG	LEU	A	10	L	-	HE	ARG	V	159
R	-	CG	LEU	A	10	L	-	HH21	ARG	V	159
R	-	CG	LEU	A	10	L	-	HH22	ARG	V	159
R	-	CD1	LEU	A	10	L	-	NH2	ARG	V	159
R	-	CD1	LEU	A	10	L	-	HH21	ARG	V	159
R	-	CD1	LEU	A	10	L	-	HH22	ARG	V	159
R	-	CD2	LEU	A	10	L	-	NE	ARG	V	159
R	-	CD2	LEU	A	10	L	-	NH2	ARG	V	159
R	-	CD2	LEU	A	10	L	-	CZ	ARG	V	159
R	-	CD2	LEU	A	10	L	-	HE	ARG	V	159
R	-	CD2	LEU	A	10	L	-	HH21	ARG	V	159
R	-	CD2	LEU	A	10	L	-	HH22	ARG	V	159
R	-	CD2	LEU	A	10	L	-	O	ILE	V	160
R	-	CD2	LEU	A	10	L	-	HA	VAL	V	161
R	-	CD2	LEU	A	10	L	-	HG23	VAL	V	161
R	-	CD2	LEU	A	10	L	-	H	PHE	V	162
R	-	N	CYS	A	11	L	-	CD	ARG	V	159
R	-	N	CYS	A	11	L	-	NE	ARG	V	159
R	-	N	CYS	A	11	L	-	NH1	ARG	V	159
R	-	N	CYS	A	11	L	-	NH2	ARG	V	159
R	-	N	CYS	A	11	L	-	CZ	ARG	V	159
R	-	N	CYS	A	11	L	-	HD2	ARG	V	159
R	-	N	CYS	A	11	L	-	HD3	ARG	V	159
R	-	N	CYS	A	11	L	-	HE	ARG	V	159
R	-	N	CYS	A	11	L	-	HH11	ARG	V	159
R	-	N	CYS	A	11	L	-	HH12	ARG	V	159
R	-	CA	CYS	A	11	L	-	CD	ARG	V	159
R	-	CA	CYS	A	11	L	-	NE	ARG	V	159
R	-	CA	CYS	A	11	L	-	NH1	ARG	V	159
R	-	CA	CYS	A	11	L	-	CZ	ARG	V	159
R	-	CA	CYS	A	11	L	-	HD2	ARG	V	159
R	-	CA	CYS	A	11	L	-	HD3	ARG	V	159
R	-	CA	CYS	A	11	L	-	HH11	ARG	V	159
R	-	CA	CYS	A	11	L	-	HH12	ARG	V	159
R	-	C	CYS	A	11	L	-	CG	ARG	V	159
R	-	C	CYS	A	11	L	-	CD	ARG	V	159
R	-	C	CYS	A	11	L	-	NE	ARG	V	159
R	-	C	CYS	A	11	L	-	NH1	ARG	V	159
R	-	C	CYS	A	11	L	-	CZ	ARG	V	159
R	-	C	CYS	A	11	L	-	HG2	ARG	V	159
R	-	C	CYS	A	11	L	-	HG3	ARG	V	159
R	-	C	CYS	A	11	L	-	HD2	ARG	V	159
R	-	C	CYS	A	11	L	-	HD3	ARG	V	159
R	-	C	CYS	A	11	L	-	HE	ARG	V	159
R	-	C	CYS	A	11	L	-	HH11	ARG	V	159
R	-	C	CYS	A	11	L	-	HH12	ARG	V	159
R	-	CB	CYS	A	11	L	-	HD2	ARG	V	159
R	-	CB	CYS	A	11	L	-	HD3	ARG	V	159
R	-	O	CYS	A	11	L	-	CB	ARG	V	159
R	-	O	CYS	A	11	L	-	CG	ARG	V	159
R	-	O	CYS	A	11	L	-	CD	ARG	V	159
R	-	O	CYS	A	11	L	-	NE	ARG	V	159
R	-	O	CYS	A	11	L	-	NH1	ARG	V	159
R	-	O	CYS	A	11	L	-	CZ	ARG	V	159
R	-	O	CYS	A	11	L	-	HB2	ARG	V	159
R	-	O	CYS	A	11	L	-	HB3	ARG	V	159
R	-	O	CYS	A	11	L	-	HG2	ARG	V	159
R	-	O	CYS	A	11	L	-	HG3	ARG	V	159
R	-	O	CYS	A	11	L	-	HD2	ARG	V	159
R	-	O	CYS	A	11	L	-	HD3	ARG	V	159
R	-	O	CYS	A	11	L	-	HE	ARG	V	159
R	-	O	CYS	A	11	L	-	HH11	ARG	V	159
R	-	N	VAL	A	12	L	-	CG	ARG	V	159
R	-	N	VAL	A	12	L	-	CD	ARG	V	159
R	-	N	VAL	A	12	L	-	NE	ARG	V	159
R	-	N	VAL	A	12	L	-	NH1	ARG	V	159
R	-	N	VAL	A	12	L	-	CZ	ARG	V	159
R	-	N	VAL	A	12	L	-	HG2	ARG	V	159
R	-	N	VAL	A	12	L	-	HG3	ARG	V	159
R	-	N	VAL	A	12	L	-	HD2	ARG	V	159
R	-	N	VAL	A	12	L	-	HD3	ARG	V	159
R	-	N	VAL	A	12	L	-	HH11	ARG	V	159
R	-	N	VAL	A	12	L	-	HH12	ARG	V	159
R	-	CA	VAL	A	12	L	-	CG	ARG	V	159
R	-	CA	VAL	A	12	L	-	CD	ARG	V	159
R	-	CA	VAL	A	12	L	-	NE	ARG	V	159
R	-	CA	VAL	A	12	L	-	NH1	ARG	V	159
R	-	CA	VAL	A	12	L	-	CZ	ARG	V	159
R	-	CA	VAL	A	12	L	-	HG2	ARG	V	159
R	-	CA	VAL	A	12	L	-	HG3	ARG	V	159
R	-	CA	VAL	A	12	L	-	HD3	ARG	V	159
R	-	CA	VAL	A	12	L	-	HH11	ARG	V	159
R	-	CA	VAL	A	12	L	-	HH12	ARG	V	159
R	-	C	VAL	A	12	L	-	NH1	ARG	V	159
R	-	C	VAL	A	12	L	-	HD3	ARG	V	159
R	-	C	VAL	A	12	L	-	HH11	ARG	V	159
R	-	CB	VAL	A	12	L	-	CG	ARG	V	159
R	-	CB	VAL	A	12	L	-	CD	ARG	V	159
R	-	CB	VAL	A	12	L	-	NE	ARG	V	159
R	-	CB	VAL	A	12	L	-	NH1	ARG	V	159
R	-	CB	VAL	A	12	L	-	CZ	ARG	V	159
R	-	CB	VAL	A	12	L	-	HG2	ARG	V	159
R	-	CB	VAL	A	12	L	-	HG3	ARG	V	159
R	-	CB	VAL	A	12	L	-	HD3	ARG	V	159
R	-	CB	VAL	A	12	L	-	HH11	ARG	V	159
R	-	CB	VAL	A	12	L	-	HH12	ARG	V	159
R	-	CB	VAL	A	12	L	-	HG23	VAL	V	161
R	-	O	VAL	A	12	L	-	HH11	ARG	V	159
R	-	CG1	VAL	A	12	L	-	NH1	ARG	V	159
R	-	CG1	VAL	A	12	L	-	HG3	ARG	V	159
R	-	CG1	VAL	A	12	L	-	HH11	ARG	V	159
R	-	CG1	VAL	A	12	L	-	HG21	VAL	V	161
R	-	CG1	VAL	A	12	L	-	HG22	VAL	V	161
R	-	CG1	VAL	A	12	L	-	HG23	VAL	V	161
R	-	CG2	VAL	A	12	L	-	CG	ARG	V	159
R	-	CG2	VAL	A	12	L	-	CD	ARG	V	159
R	-	CG2	VAL	A	12	L	-	NE	ARG	V	159
R	-	CG2	VAL	A	12	L	-	NH1	ARG	V	159
R	-	CG2	VAL	A	12	L	-	NH2	ARG	V	159
R	-	CG2	VAL	A	12	L	-	CZ	ARG	V	159
R	-	CG2	VAL	A	12	L	-	HG2	ARG	V	159
R	-	CG2	VAL	A	12	L	-	HG3	ARG	V	159
R	-	CG2	VAL	A	12	L	-	HD3	ARG	V	159
R	-	CG2	VAL	A	12	L	-	HE	ARG	V	159
R	-	CG2	VAL	A	12	L	-	HH11	ARG	V	159
R	-	CG2	VAL	A	12	L	-	HH12	ARG	V	159
R	-	CG2	VAL	A	12	L	-	HH21	ARG	V	159
R	-	CG2	VAL	A	12	L	-	HH22	ARG	V	159
R	-	CG2	VAL	A	12	L	-	CG2	VAL	V	161
R	-	CG2	VAL	A	12	L	-	HG21	VAL	V	161
R	-	CG2	VAL	A	12	L	-	HG22	VAL	V	161
R	-	CG2	VAL	A	12	L	-	HG23	VAL	V	161
R	-	N	LEU	A	13	L	-	OE1	GLN	V	300
R	-	CA	LEU	A	13	L	-	HD3	PRO	V	301
R	-	C	LEU	A	13	L	-	HG2	PRO	V	301
R	-	C	LEU	A	13	L	-	HD3	PRO	V	301
R	-	CB	LEU	A	13	L	-	HB3	GLN	V	300
R	-	CB	LEU	A	13	L	-	O	PRO	V	301
R	-	CB	LEU	A	13	L	-	HD3	PRO	V	301
R	-	O	LEU	A	13	L	-	CG2	THR	V	158
R	-	O	LEU	A	13	L	-	HB	THR	V	158
R	-	O	LEU	A	13	L	-	HG21	THR	V	158
R	-	O	LEU	A	13	L	-	HG22	THR	V	158
R	-	O	LEU	A	13	L	-	OE1	GLN	V	300
R	-	O	LEU	A	13	L	-	CG	PRO	V	301
R	-	O	LEU	A	13	L	-	CD	PRO	V	301
R	-	O	LEU	A	13	L	-	HG2	PRO	V	301
R	-	O	LEU	A	13	L	-	HD2	PRO	V	301
R	-	O	LEU	A	13	L	-	HD3	PRO	V	301
R	-	CG	LEU	A	13	L	-	HB3	GLN	V	300
R	-	CD1	LEU	A	13	L	-	CB	GLN	V	300
R	-	CD1	LEU	A	13	L	-	HB2	GLN	V	300
R	-	CD1	LEU	A	13	L	-	HB3	GLN	V	300
R	-	CD1	LEU	A	13	L	-	O	PRO	V	301
R	-	CD1	LEU	A	13	L	-	HD2	PRO	V	303
R	-	CD2	LEU	A	13	L	-	HB3	PRO	V	303
R	-	C	VAL	A	14	L	-	HG2	PRO	V	301
R	-	O	VAL	A	14	L	-	CB	PRO	V	301
R	-	O	VAL	A	14	L	-	CG	PRO	V	301
R	-	O	VAL	A	14	L	-	HB2	PRO	V	301
R	-	O	VAL	A	14	L	-	HB3	PRO	V	301
R	-	O	VAL	A	14	L	-	HG2	PRO	V	301
R	-	O	VAL	A	14	L	-	HG3	PRO	V	301
R	-	CB	VAL	A	15	L	S	HZ3	TRP	V	129
R	-	CG1	VAL	A	15	L	S	HZ3	TRP	V	129
R	-	CG2	VAL	A	15	L	S	HZ3	TRP	V	129
R	-	CG2	VAL	A	15	L	-	HG21	THR	V	158
R	-	N	HIS	A	25	L	H	HD12	ILE	V	110
R	-	CA	HIS	A	25	L	H	HD11	ILE	V	110
R	-	CA	HIS	A	25	L	H	HD12	ILE	V	110
R	-	CB	HIS	A	25	L	-	HD21	ASN	V	107
R	-	CB	HIS	A	25	L	H	CD1	ILE	V	110
R	-	CB	HIS	A	25	L	H	HD11	ILE	V	110
R	-	CB	HIS	A	25	L	H	HD12	ILE	V	110
R	-	CB	HIS	A	25	L	H	HD13	ILE	V	110
R	-	O	HIS	A	25	L	S	OH	TYR	V	79
R	-	O	HIS	A	25	L	H	HD12	ILE	V	110
R	-	CG	HIS	A	25	L	-	HD21	ASN	V	107
R	-	CG	HIS	A	25	L	H	CD1	ILE	V	110
R	-	CG	HIS	A	25	L	H	HD11	ILE	V	110
R	-	CD2	HIS	A	25	L	-	ND2	ASN	V	107
R	-	CD2	HIS	A	25	L	-	HD21	ASN	V	107
R	-	CD2	HIS	A	25	L	-	HD22	ASN	V	107
R	-	CD2	HIS	A	25	L	H	CD1	ILE	V	110
R	-	CD2	HIS	A	25	L	H	HD11	ILE	V	110
R	-	ND1	HIS	A	25	L	-	HD21	ASN	V	107
R	-	CE1	HIS	A	25	L	-	HD21	ASN	V	107
R	-	NE2	HIS	A	25	L	-	ND2	ASN	V	107
R	-	NE2	HIS	A	25	L	-	HD21	ASN	V	107
R	-	NE2	HIS	A	25	L	-	HD22	ASN	V	107
R	-	CB	VAL	A	27	L	S	HH	TYR	V	79
R	-	CB	VAL	A	27	L	-	HG2	LYS	V	106
R	-	CG1	VAL	A	27	L	-	HB2	ASP	V	105
R	-	CG1	VAL	A	27	L	-	CG	LYS	V	106
R	-	CG1	VAL	A	27	L	-	HG2	LYS	V	106
R	-	CG1	VAL	A	27	L	-	HG3	LYS	V	106
R	-	CG2	VAL	A	27	L	S	CE1	TYR	V	79
R	-	CG2	VAL	A	27	L	S	OH	TYR	V	79
R	-	CG2	VAL	A	27	L	S	CZ	TYR	V	79
R	-	CG2	VAL	A	27	L	S	HE1	TYR	V	79
R	-	CG2	VAL	A	27	L	S	HH	TYR	V	79
R	-	CG2	VAL	A	27	L	-	CG	LYS	V	106
R	-	CG2	VAL	A	27	L	-	HA	LYS	V	106
R	-	CG2	VAL	A	27	L	-	HG2	LYS	V	106
R	-	CG2	VAL	A	27	L	-	HE2	LYS	V	106
R	-	N	PRO	A	28	L	-	CB	ASP	V	105
R	-	N	PRO	A	28	L	-	HB2	ASP	V	105
R	-	N	PRO	A	28	L	-	HB3	ASP	V	105
R	-	CA	PRO	A	28	L	-	HB3	ASP	V	105
R	-	C	PRO	A	28	L	-	OD2	ASP	V	105
R	-	C	PRO	A	28	L	-	HB2	ASP	V	105
R	-	C	PRO	A	28	L	-	HB3	ASP	V	105
R	-	CB	PRO	A	28	L	-	CB	ASP	V	105
R	-	CB	PRO	A	28	L	-	CG	ASP	V	105
R	-	CB	PRO	A	28	L	-	OD2	ASP	V	105
R	-	CB	PRO	A	28	L	-	HB3	ASP	V	105
R	-	O	PRO	A	28	L	-	HD2	HIS	V	103
R	-	O	PRO	A	28	L	-	CB	ASP	V	105
R	-	O	PRO	A	28	L	-	CG	ASP	V	105
R	-	O	PRO	A	28	L	-	OD2	ASP	V	105
R	-	O	PRO	A	28	L	-	HB2	ASP	V	105
R	-	O	PRO	A	28	L	-	HB3	ASP	V	105
R	-	CG	PRO	A	28	L	-	CB	ASP	V	105
R	-	CG	PRO	A	28	L	-	O	ASP	V	105
R	-	CG	PRO	A	28	L	-	CG	ASP	V	105
R	-	CG	PRO	A	28	L	-	HB2	ASP	V	105
R	-	CG	PRO	A	28	L	-	HB3	ASP	V	105
R	-	CD	PRO	A	28	L	-	CA	ASP	V	105
R	-	CD	PRO	A	28	L	-	C	ASP	V	105
R	-	CD	PRO	A	28	L	-	CB	ASP	V	105
R	-	CD	PRO	A	28	L	-	O	ASP	V	105
R	-	CD	PRO	A	28	L	-	HB2	ASP	V	105
R	-	CD	PRO	A	28	L	-	HB3	ASP	V	105
R	-	N	ASN	A	30	L	-	OD2	ASP	V	105
R	-	C	ASN	A	30	L	-	OD2	ASP	V	105
R	-	O	ASN	A	30	L	-	HE2	HIS	V	103
R	-	O	ASN	A	30	L	-	CG	ASP	V	105
R	-	O	ASN	A	30	L	-	OD2	ASP	V	105
R	-	OD2	ASP	A	32	L	-	OD1	ASP	V	105
R	-	CB	ASN	A	42	L	-	HD11	ILE	V	147
R	-	CG	ASN	A	42	L	-	CD1	ILE	V	147
R	-	CG	ASN	A	42	L	-	HD11	ILE	V	147
R	-	CG	ASN	A	42	L	-	HD12	ILE	V	147
R	-	ND2	ASN	A	42	L	-	CG1	ILE	V	147
R	-	ND2	ASN	A	42	L	-	CD1	ILE	V	147
R	-	ND2	ASN	A	42	L	-	HD11	ILE	V	147
R	-	ND2	ASN	A	42	L	-	HD12	ILE	V	147
R	-	ND2	ASN	A	42	L	-	HD13	ILE	V	147
R	-	CA	TYR	A	44	L	-	OE1	GLU	V	242
R	-	C	TYR	A	44	L	-	CD	GLU	V	242
R	-	C	TYR	A	44	L	-	OE1	GLU	V	242
R	-	CB	TYR	A	44	L	-	OE1	GLU	V	242
R	-	O	TYR	A	44	L	-	CG	GLU	V	242
R	-	O	TYR	A	44	L	-	CD	GLU	V	242
R	-	O	TYR	A	44	L	-	OE1	GLU	V	242
R	-	O	TYR	A	44	L	-	OE2	GLU	V	242
R	-	O	TYR	A	44	L	-	HG2	GLU	V	242
R	-	O	TYR	A	44	L	-	HG3	GLU	V	242
R	-	CG	TYR	A	44	L	-	HA	ARG	V	267
R	-	CD1	TYR	A	44	L	-	HA3	GLY	V	268
R	-	CD2	TYR	A	44	L	-	O	GLY	V	266
R	-	CD2	TYR	A	44	L	-	HA	ARG	V	267
R	-	CE1	TYR	A	44	L	-	C	ARG	V	267
R	-	CE1	TYR	A	44	L	-	O	ARG	V	267
R	-	CE1	TYR	A	44	L	-	HA3	GLY	V	268
R	-	CE2	TYR	A	44	L	-	CA	ARG	V	267
R	-	CE2	TYR	A	44	L	-	C	ARG	V	267
R	-	CE2	TYR	A	44	L	-	HA	ARG	V	267
R	-	CE2	TYR	A	44	L	-	HG2	ARG	V	267
R	-	OH	TYR	A	44	L	-	O	ARG	V	267
R	-	OH	TYR	A	44	L	-	HA	ARG	V	267
R	-	OH	TYR	A	44	L	-	HB3	ARG	V	267
R	-	OH	TYR	A	44	L	-	HD21	ASN	V	271
R	-	OH	TYR	A	44	L	-	HD22	ASN	V	271
R	-	CZ	TYR	A	44	L	-	C	ARG	V	267
R	-	CZ	TYR	A	44	L	-	O	ARG	V	267
R	-	CZ	TYR	A	44	L	-	HA	ARG	V	267
R	-	CZ	TYR	A	44	L	-	HB3	ARG	V	267
R	-	N	PHE	A	45	L	-	OE1	GLU	V	242
R	-	CG	PHE	A	45	L	-	HG2	GLU	V	242
R	-	CD1	PHE	A	45	L	-	CG	GLU	V	242
R	-	CD1	PHE	A	45	L	-	HA	GLU	V	242
R	-	CD1	PHE	A	45	L	-	HG2	GLU	V	242
R	-	CD1	PHE	A	45	L	-	OG	SER	V	245
R	-	CD1	PHE	A	45	L	-	HG	SER	V	245
R	-	CD2	PHE	A	45	L	S	HA	TRP	V	265
R	-	CD2	PHE	A	45	L	S	HB2	TRP	V	265
R	-	CD2	PHE	A	45	L	-	H	GLY	V	266
R	-	CE1	PHE	A	45	L	-	CA	GLU	V	242
R	-	CE1	PHE	A	45	L	-	CG	GLU	V	242
R	-	CE1	PHE	A	45	L	-	HA	GLU	V	242
R	-	CE1	PHE	A	45	L	-	HG2	GLU	V	242
R	-	CE1	PHE	A	45	L	-	OG	SER	V	245
R	-	CE1	PHE	A	45	L	-	HG	SER	V	245
R	-	CE2	PHE	A	45	L	S	CA	TRP	V	265
R	-	CE2	PHE	A	45	L	S	HA	TRP	V	265
R	-	CE2	PHE	A	45	L	S	HB2	TRP	V	265
R	-	CE2	PHE	A	45	L	-	N	GLY	V	266
R	-	CE2	PHE	A	45	L	-	H	GLY	V	266
R	-	CZ	PHE	A	45	L	-	HA	GLU	V	242
R	-	CZ	PHE	A	45	L	-	HG2	GLU	V	242
R	-	CZ	PHE	A	45	L	S	HA	TRP	V	265
R	-	CZ	PHE	A	45	L	-	H	GLY	V	266
R	-	CB	ASN	A	47	L	-	HZ2	LYS	V	106
R	-	O	ASN	A	47	L	H	O	HIS	V	100
R	-	O	ASN	A	47	L	-	ND1	HIS	V	103
R	-	O	ASN	A	47	L	-	HB3	HIS	V	103
R	-	CG	ASN	A	47	L	H	HD2	HIS	V	100
R	-	ND2	ASN	A	47	L	H	O	HIS	V	100
R	-	ND2	ASN	A	47	L	H	CD2	HIS	V	100
R	-	ND2	ASN	A	47	L	H	HD2	HIS	V	100
R	-	ND2	ASN	A	47	L	H	HA	CYS	V	101
R	-	ND2	ASN	A	47	L	-	HZ2	LYS	V	106
R	-	OD1	ASN	A	47	L	H	HD2	HIS	V	100
R	-	CA	ILE	A	48	L	H	HB2	HIS	V	100
R	-	CB	ILE	A	48	L	H	HB2	HIS	V	100
R	-	CB	ILE	A	48	L	-	HG12	ILE	V	147
R	-	CB	ILE	A	48	L	-	HD12	ILE	V	147
R	-	CG1	ILE	A	48	L	H	CB	HIS	V	100
R	-	CG1	ILE	A	48	L	H	CG	HIS	V	100
R	-	CG1	ILE	A	48	L	H	CD2	HIS	V	100
R	-	CG1	ILE	A	48	L	H	HB2	HIS	V	100
R	-	CG1	ILE	A	48	L	H	HB3	HIS	V	100
R	-	CG1	ILE	A	48	L	H	HD2	HIS	V	100
R	-	CG1	ILE	A	48	L	-	HD12	ILE	V	147
R	-	CG2	ILE	A	48	L	H	HB2	HIS	V	100
R	-	CG2	ILE	A	48	L	-	OH	TYR	V	141
R	-	CG2	ILE	A	48	L	-	HH	TYR	V	141
R	-	CG2	ILE	A	48	L	-	O	PRO	V	146
R	-	CG2	ILE	A	48	L	-	CG1	ILE	V	147
R	-	CG2	ILE	A	48	L	-	HG12	ILE	V	147
R	-	CG2	ILE	A	48	L	-	HG22	ILE	V	147
R	-	CG2	ILE	A	48	L	-	HD12	ILE	V	147
R	-	CD1	ILE	A	48	L	H	CB	HIS	V	100
R	-	CD1	ILE	A	48	L	H	CG	HIS	V	100
R	-	CD1	ILE	A	48	L	H	CD2	HIS	V	100
R	-	CD1	ILE	A	48	L	H	ND1	HIS	V	100
R	-	CD1	ILE	A	48	L	H	CE1	HIS	V	100
R	-	CD1	ILE	A	48	L	H	NE2	HIS	V	100
R	-	CD1	ILE	A	48	L	H	HB2	HIS	V	100
R	-	CD1	ILE	A	48	L	H	HB3	HIS	V	100
R	-	CD1	ILE	A	48	L	H	HD2	HIS	V	100
R	-	CD1	ILE	A	48	L	-	CD1	ILE	V	147
R	-	CD1	ILE	A	48	L	-	HG12	ILE	V	147
R	-	CD1	ILE	A	48	L	-	HG22	ILE	V	147
R	-	CD1	ILE	A	48	L	-	HG23	ILE	V	147
R	-	CD1	ILE	A	48	L	-	HD12	ILE	V	147
R	S	N	HIS	A	49	L	-	HE1	HIS	V	103
R	S	CA	HIS	A	49	L	-	HE1	HIS	V	103
R	S	C	HIS	A	49	L	-	HE1	HIS	V	103
R	S	C	HIS	A	49	L	-	CD	GLU	V	142
R	S	C	HIS	A	49	L	-	OE1	GLU	V	142
R	S	CB	HIS	A	49	L	-	CE1	HIS	V	103
R	S	CB	HIS	A	49	L	-	HE1	HIS	V	103
R	S	O	HIS	A	49	L	-	HE1	HIS	V	103
R	S	O	HIS	A	49	L	-	HH	TYR	V	141
R	S	O	HIS	A	49	L	-	CD	GLU	V	142
R	S	O	HIS	A	49	L	-	OE1	GLU	V	142
R	S	O	HIS	A	49	L	-	OE2	GLU	V	142
R	S	CG	HIS	A	49	L	-	CE1	HIS	V	103
R	S	CG	HIS	A	49	L	-	HE1	HIS	V	103
R	S	CD2	HIS	A	49	L	-	ND1	HIS	V	103
R	S	CD2	HIS	A	49	L	-	CE1	HIS	V	103
R	S	CD2	HIS	A	49	L	-	NE2	HIS	V	103
R	S	CD2	HIS	A	49	L	-	HE1	HIS	V	103
R	S	CD2	HIS	A	49	L	-	HE2	HIS	V	103
R	S	CA	TRP	A	50	L	-	OE2	GLU	V	142
R	S	CB	TRP	A	50	L	-	HB3	GLU	V	142
R	S	CB	TRP	A	50	L	-	HG2	GLU	V	142
R	S	CB	TRP	A	50	L	-	HA	PRO	V	146
R	S	CB	TRP	A	50	L	-	HB3	PRO	V	146
R	S	CG	TRP	A	50	L	-	CB	PRO	V	146
R	S	CG	TRP	A	50	L	-	HA	PRO	V	146
R	S	CG	TRP	A	50	L	-	HB3	PRO	V	146
R	S	CG	TRP	A	50	L	-	HG3	PRO	V	146
R	S	CD1	TRP	A	50	L	-	HB3	PRO	V	146
R	S	CD1	TRP	A	50	L	-	HG3	PRO	V	146
R	S	CD2	TRP	A	50	L	-	CB	PRO	V	146
R	S	CD2	TRP	A	50	L	-	HB2	PRO	V	146
R	S	CD2	TRP	A	50	L	-	HB3	PRO	V	146
R	S	CD2	TRP	A	50	L	-	HG3	PRO	V	146
R	S	CE2	TRP	A	50	L	-	CB	PRO	V	146
R	S	CE2	TRP	A	50	L	-	CG	PRO	V	146
R	S	CE2	TRP	A	50	L	-	HB3	PRO	V	146
R	S	CE2	TRP	A	50	L	-	HG2	PRO	V	146
R	S	CE2	TRP	A	50	L	-	HG3	PRO	V	146
R	S	CE3	TRP	A	50	L	-	CB	PRO	V	146
R	S	CE3	TRP	A	50	L	-	HB2	PRO	V	146
R	S	CE3	TRP	A	50	L	-	HB3	PRO	V	146
R	S	NE1	TRP	A	50	L	-	CG	PRO	V	146
R	S	NE1	TRP	A	50	L	-	HB3	PRO	V	146
R	S	NE1	TRP	A	50	L	-	HG3	PRO	V	146
R	S	CH2	TRP	A	50	L	-	HB3	PRO	V	146
R	S	CZ2	TRP	A	50	L	-	HB3	PRO	V	146
R	S	CZ2	TRP	A	50	L	-	HG2	PRO	V	146
R	S	CZ3	TRP	A	50	L	-	HB2	PRO	V	146
R	S	CZ3	TRP	A	50	L	-	HB3	PRO	V	146
R	-	CB	GLN	A	60	L	-	HH12	ARG	V	104
R	-	CB	GLN	A	60	L	-	HH22	ARG	V	104
R	-	CG	GLN	A	60	L	-	NH1	ARG	V	104
R	-	CG	GLN	A	60	L	-	NH2	ARG	V	104
R	-	CG	GLN	A	60	L	-	HH12	ARG	V	104
R	-	CG	GLN	A	60	L	-	HH22	ARG	V	104
R	-	CG	GLN	A	60	L	-	HB2	GLU	V	142
R	-	CG	GLN	A	60	L	-	HB3	GLU	V	142
R	-	CD	GLN	A	60	L	-	NE	ARG	V	104
R	-	CD	GLN	A	60	L	-	NH1	ARG	V	104
R	-	CD	GLN	A	60	L	-	NH2	ARG	V	104
R	-	CD	GLN	A	60	L	-	CZ	ARG	V	104
R	-	CD	GLN	A	60	L	-	HH11	ARG	V	104
R	-	CD	GLN	A	60	L	-	HH12	ARG	V	104
R	-	CD	GLN	A	60	L	-	HH21	ARG	V	104
R	-	CD	GLN	A	60	L	-	HH22	ARG	V	104
R	-	CD	GLN	A	60	L	-	O	TYR	V	141
R	-	CD	GLN	A	60	L	-	HB2	GLU	V	142
R	-	NE2	GLN	A	60	L	-	CD	ARG	V	104
R	-	NE2	GLN	A	60	L	-	NE	ARG	V	104
R	-	NE2	GLN	A	60	L	-	NH1	ARG	V	104
R	-	NE2	GLN	A	60	L	-	NH2	ARG	V	104
R	-	NE2	GLN	A	60	L	-	CZ	ARG	V	104
R	-	NE2	GLN	A	60	L	-	HD3	ARG	V	104
R	-	NE2	GLN	A	60	L	-	HE	ARG	V	104
R	-	NE2	GLN	A	60	L	-	HH11	ARG	V	104
R	-	NE2	GLN	A	60	L	-	HH12	ARG	V	104
R	-	NE2	GLN	A	60	L	-	HH21	ARG	V	104
R	-	NE2	GLN	A	60	L	-	HH22	ARG	V	104
R	-	NE2	GLN	A	60	L	-	HD1	TYR	V	141
R	-	NE2	GLN	A	60	L	-	OE2	GLU	V	142
R	-	NE2	GLN	A	60	L	-	HB2	GLU	V	142
R	-	OE1	GLN	A	60	L	-	NE	ARG	V	104
R	-	OE1	GLN	A	60	L	-	NH1	ARG	V	104
R	-	OE1	GLN	A	60	L	-	NH2	ARG	V	104
R	-	OE1	GLN	A	60	L	-	CZ	ARG	V	104
R	-	OE1	GLN	A	60	L	-	HH12	ARG	V	104
R	-	OE1	GLN	A	60	L	-	HH21	ARG	V	104
R	-	OE1	GLN	A	60	L	-	HH22	ARG	V	104
R	-	OE1	GLN	A	60	L	-	O	TYR	V	141
R	-	OE1	GLN	A	60	L	-	HB2	GLU	V	142
R	-	CG	HIS	A	61	L	-	HH12	ARG	V	104
R	-	CD2	HIS	A	61	L	-	NH1	ARG	V	104
R	-	CD2	HIS	A	61	L	-	HH11	ARG	V	104
R	-	CD2	HIS	A	61	L	-	HH12	ARG	V	104
R	-	ND1	HIS	A	61	L	-	HH11	ARG	V	104
R	-	CE1	HIS	A	61	L	-	NH1	ARG	V	104
R	-	CE1	HIS	A	61	L	-	HD3	ARG	V	104
R	-	CE1	HIS	A	61	L	-	HH11	ARG	V	104
R	-	CE1	HIS	A	61	L	-	HH12	ARG	V	104
R	-	NE2	HIS	A	61	L	-	NH1	ARG	V	104
R	-	NE2	HIS	A	61	L	-	CZ	ARG	V	104
R	-	NE2	HIS	A	61	L	-	HD3	ARG	V	104
R	-	NE2	HIS	A	61	L	-	HH11	ARG	V	104
R	-	NE2	HIS	A	61	L	-	HH12	ARG	V	104
R	-	CB	ASN	A	95	L	-	HB2	PRO	V	139
R	-	CG	ASN	A	95	L	-	CB	PRO	V	139
R	-	CG	ASN	A	95	L	-	HB2	PRO	V	139
R	-	CG	ASN	A	95	L	-	HB3	PRO	V	139
R	-	CG	ASN	A	95	L	-	HG3	PRO	V	139
R	-	ND2	ASN	A	95	L	-	CA	PRO	V	139
R	-	ND2	ASN	A	95	L	-	CB	PRO	V	139
R	-	ND2	ASN	A	95	L	-	CG	PRO	V	139
R	-	ND2	ASN	A	95	L	-	CD	PRO	V	139
R	-	ND2	ASN	A	95	L	-	HA	PRO	V	139
R	-	ND2	ASN	A	95	L	-	HB2	PRO	V	139
R	-	ND2	ASN	A	95	L	-	HB3	PRO	V	139
R	-	ND2	ASN	A	95	L	-	HG2	PRO	V	139
R	-	ND2	ASN	A	95	L	-	HG3	PRO	V	139
R	-	OD1	ASN	A	95	L	-	HB2	PRO	V	139
R	-	OD1	ASN	A	95	L	-	HB3	PRO	V	139
R	-	CB	ALA	A	97	L	H	HG22	ILE	V	294
R	-	CB	ALA	A	97	L	H	HD12	ILE	V	294
R	-	CB	ALA	A	97	L	H	HD13	ILE	V	294
R	-	CE1	HIS	A	107	L	S	HG23	ILE	V	136
R	-	CA	LYS	A	118	L	-	HB3	PRO	V	139
R	-	C	LYS	A	118	L	-	HE1	MET	V	143
R	-	C	LYS	A	118	L	-	HE3	MET	V	143
R	-	CB	LYS	A	118	L	-	C	PRO	V	139
R	-	CB	LYS	A	118	L	-	O	PRO	V	139
R	-	CB	LYS	A	118	L	-	HA	PRO	V	139
R	-	CB	LYS	A	118	L	-	HB3	PRO	V	139
R	-	O	LYS	A	118	L	-	SD	MET	V	143
R	-	O	LYS	A	118	L	-	CE	MET	V	143
R	-	O	LYS	A	118	L	-	HE1	MET	V	143
R	-	O	LYS	A	118	L	-	HE3	MET	V	143
R	-	CG	LYS	A	118	L	-	CA	PRO	V	139
R	-	CG	LYS	A	118	L	-	C	PRO	V	139
R	-	CG	LYS	A	118	L	-	CB	PRO	V	139
R	-	CG	LYS	A	118	L	-	O	PRO	V	139
R	-	CG	LYS	A	118	L	-	HA	PRO	V	139
R	-	CG	LYS	A	118	L	-	HB2	PRO	V	139
R	-	CG	LYS	A	118	L	-	HB3	PRO	V	139
R	-	CD	LYS	A	118	L	-	HH22	ARG	V	104
R	-	CD	LYS	A	118	L	-	O	HIS	V	138
R	-	CD	LYS	A	118	L	-	N	PRO	V	139
R	-	CD	LYS	A	118	L	-	CA	PRO	V	139
R	-	CD	LYS	A	118	L	-	C	PRO	V	139
R	-	CD	LYS	A	118	L	-	CB	PRO	V	139
R	-	CD	LYS	A	118	L	-	O	PRO	V	139
R	-	CD	LYS	A	118	L	-	HA	PRO	V	139
R	-	CD	LYS	A	118	L	-	HB2	PRO	V	139
R	-	CD	LYS	A	118	L	-	HB3	PRO	V	139
R	-	CD	LYS	A	118	L	-	N	THR	V	140
R	-	CD	LYS	A	118	L	-	HA	THR	V	140
R	-	CD	LYS	A	118	L	-	H	TYR	V	141
R	-	CE	LYS	A	118	L	-	NH2	ARG	V	104
R	-	CE	LYS	A	118	L	-	HH21	ARG	V	104
R	-	CE	LYS	A	118	L	-	HH22	ARG	V	104
R	-	CE	LYS	A	118	L	-	C	HIS	V	138
R	-	CE	LYS	A	118	L	-	O	HIS	V	138
R	-	CE	LYS	A	118	L	-	N	PRO	V	139
R	-	CE	LYS	A	118	L	-	CA	PRO	V	139
R	-	CE	LYS	A	118	L	-	C	PRO	V	139
R	-	CE	LYS	A	118	L	-	O	PRO	V	139
R	-	CE	LYS	A	118	L	-	HA	PRO	V	139
R	-	CE	LYS	A	118	L	-	H	TYR	V	141
R	-	CE	LYS	A	118	L	-	HB3	TYR	V	141
R	-	NZ	LYS	A	118	L	-	NH2	ARG	V	104
R	-	NZ	LYS	A	118	L	-	HH21	ARG	V	104
R	-	NZ	LYS	A	118	L	-	HH22	ARG	V	104
R	-	NZ	LYS	A	118	L	S	HB2	LEU	V	137
R	-	NZ	LYS	A	118	L	-	C	HIS	V	138
R	-	NZ	LYS	A	118	L	-	O	HIS	V	138
R	-	NZ	LYS	A	118	L	-	N	PRO	V	139
R	-	NZ	LYS	A	118	L	-	CA	PRO	V	139
R	-	NZ	LYS	A	118	L	-	C	PRO	V	139
R	-	NZ	LYS	A	118	L	-	O	PRO	V	139
R	-	NZ	LYS	A	118	L	-	HA	PRO	V	139
R	-	NZ	LYS	A	118	L	-	N	TYR	V	141
R	-	NZ	LYS	A	118	L	-	CA	TYR	V	141
R	-	NZ	LYS	A	118	L	-	CB	TYR	V	141
R	-	NZ	LYS	A	118	L	-	O	TYR	V	141
R	-	NZ	LYS	A	118	L	-	H	TYR	V	141
R	-	NZ	LYS	A	118	L	-	HB2	TYR	V	141
R	-	NZ	LYS	A	118	L	-	HB3	TYR	V	141
R	-	NZ	LYS	A	118	L	-	HD1	TYR	V	141
R	-	CA	HIS	A	119	L	-	HE1	MET	V	143
R	-	CD1	LEU	A	327	L	-	HG2	GLU	V	175
R	-	CD1	LEU	A	327	L	-	HG3	GLU	V	175

- 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