IID

P39877_P28482.1 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	-	GLU	A	109	L	-	VAL	V	15
R	-	PRO	A	11	L	-	TRP	V	92
R	S	GLU	A	12	L	S	ALA	V	91
R	-	SER	A	122	L	-	LEU	V	11
R	H	ASP	A	124	L	-	LEU	V	11
R	H	HIS	A	125	L	-	LEU	V	11
R	H	HIS	A	125	L	-	CYS	V	13
R	H	TYR	A	128	L	-	PHE	V	10
R	H	TYR	A	128	L	-	LEU	V	11
R	H	PHE	A	129	L	-	CYS	V	13
R	S	MET	A	13	L	S	PHE	V	90
R	S	MET	A	13	L	S	ALA	V	91
R	S	MET	A	13	L	-	TRP	V	92
R	H	TYR	A	131	L	-	PHE	V	10
R	S	VAL	A	14	L	H	LYS	V	31
R	S	VAL	A	14	L	S	PHE	V	90
R	-	ARG	A	15	L	H	GLU	V	30
R	-	ARG	A	15	L	H	LYS	V	31
R	-	ARG	A	15	L	-	GLY	V	34
R	-	ARG	A	15	L	S	PHE	V	90
R	-	ASN	A	158	L	-	VAL	V	15
R	-	THR	A	159	L	-	CYS	V	13
R	-	THR	A	159	L	-	SER	V	14
R	-	THR	A	159	L	-	VAL	V	15
R	-	THR	A	159	L	-	ALA	V	17
R	-	GLY	A	16	L	S	PHE	V	90
R	-	THR	A	160	L	-	ALA	V	12
R	-	THR	A	160	L	-	CYS	V	13
R	-	THR	A	160	L	-	VAL	V	15
R	-	CYS	A	161	L	-	CYS	V	13
R	-	CYS	A	161	L	-	VAL	V	15
R	-	ASN	A	27	L	S	ARG	V	89
R	-	LEU	A	28	L	H	LYS	V	31
R	S	SER	A	29	L	H	SER	V	27
R	S	SER	A	29	L	H	LYS	V	31
R	S	TYR	A	30	L	H	SER	V	27
R	S	TYR	A	30	L	H	GLU	V	30
R	S	TYR	A	30	L	H	LYS	V	31
R	-	GLU	A	314	L	-	PRO	V	6
R	-	GLN	A	315	L	-	LEU	V	7
R	-	GLN	A	315	L	-	ALA	V	8
R	-	GLN	A	315	L	-	TRP	V	9
R	-	TYR	A	316	L	-	PHE	V	10
R	-	TYR	A	316	L	-	LEU	V	11
R	-	TYR	A	316	L	-	ALA	V	8
R	-	TYR	A	316	L	-	TRP	V	9
R	-	TYR	A	317	L	-	PRO	V	6
R	-	TYR	A	317	L	-	ALA	V	8
R	-	ASP	A	321	L	-	PHE	V	10

- 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

P39877_P28482.1 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	PRO	A	11	L	-	HE1	TRP	V	92
R	S	CA	GLU	A	12	L	S	HB3	ALA	V	91
R	S	N	MET	A	13	L	S	O	PHE	V	90
R	S	N	MET	A	13	L	S	CA	ALA	V	91
R	S	N	MET	A	13	L	S	CB	ALA	V	91
R	S	N	MET	A	13	L	S	HA	ALA	V	91
R	S	N	MET	A	13	L	S	HB1	ALA	V	91
R	S	N	MET	A	13	L	S	HB3	ALA	V	91
R	S	CA	MET	A	13	L	S	HA	ALA	V	91
R	S	CA	MET	A	13	L	-	H	TRP	V	92
R	S	C	MET	A	13	L	S	O	PHE	V	90
R	S	C	MET	A	13	L	S	HD1	PHE	V	90
R	S	C	MET	A	13	L	S	HA	ALA	V	91
R	S	CB	MET	A	13	L	S	CA	ALA	V	91
R	S	CB	MET	A	13	L	S	C	ALA	V	91
R	S	CB	MET	A	13	L	S	HA	ALA	V	91
R	S	CB	MET	A	13	L	S	HB1	ALA	V	91
R	S	CB	MET	A	13	L	-	N	TRP	V	92
R	S	CB	MET	A	13	L	-	H	TRP	V	92
R	S	CB	MET	A	13	L	-	HA	TRP	V	92
R	S	O	MET	A	13	L	S	C	PHE	V	90
R	S	O	MET	A	13	L	S	O	PHE	V	90
R	S	O	MET	A	13	L	S	CD1	PHE	V	90
R	S	O	MET	A	13	L	S	CE1	PHE	V	90
R	S	O	MET	A	13	L	S	HB3	PHE	V	90
R	S	O	MET	A	13	L	S	HD1	PHE	V	90
R	S	O	MET	A	13	L	S	HE1	PHE	V	90
R	S	O	MET	A	13	L	S	N	ALA	V	91
R	S	O	MET	A	13	L	S	CA	ALA	V	91
R	S	O	MET	A	13	L	S	HA	ALA	V	91
R	S	CG	MET	A	13	L	S	HA	ALA	V	91
R	S	CG	MET	A	13	L	S	HB1	ALA	V	91
R	S	CG	MET	A	13	L	-	N	TRP	V	92
R	S	CG	MET	A	13	L	-	CG	TRP	V	92
R	S	CG	MET	A	13	L	-	CD1	TRP	V	92
R	S	CG	MET	A	13	L	-	CE2	TRP	V	92
R	S	CG	MET	A	13	L	-	NE1	TRP	V	92
R	S	CG	MET	A	13	L	-	H	TRP	V	92
R	S	CG	MET	A	13	L	-	HA	TRP	V	92
R	S	CG	MET	A	13	L	-	HD1	TRP	V	92
R	S	CG	MET	A	13	L	-	HE1	TRP	V	92
R	S	N	VAL	A	14	L	S	HD1	PHE	V	90
R	S	CA	VAL	A	14	L	S	HD1	PHE	V	90
R	S	CA	VAL	A	14	L	S	HE1	PHE	V	90
R	S	C	VAL	A	14	L	S	HE1	PHE	V	90
R	S	CG1	VAL	A	14	L	H	HG2	LYS	V	31
R	S	CG1	VAL	A	14	L	H	HE3	LYS	V	31
R	S	CG2	VAL	A	14	L	H	HE3	LYS	V	31
R	-	N	ARG	A	15	L	H	HG2	LYS	V	31
R	-	N	ARG	A	15	L	S	CE1	PHE	V	90
R	-	N	ARG	A	15	L	S	HD1	PHE	V	90
R	-	N	ARG	A	15	L	S	HE1	PHE	V	90
R	-	CA	ARG	A	15	L	H	HA	LYS	V	31
R	-	CA	ARG	A	15	L	S	HE1	PHE	V	90
R	-	C	ARG	A	15	L	S	HE1	PHE	V	90
R	-	CB	ARG	A	15	L	H	HA	LYS	V	31
R	-	CG	ARG	A	15	L	H	O	GLU	V	30
R	-	CG	ARG	A	15	L	H	CA	LYS	V	31
R	-	CG	ARG	A	15	L	H	HA	LYS	V	31
R	-	CG	ARG	A	15	L	H	HG2	LYS	V	31
R	-	CD	ARG	A	15	L	H	O	GLU	V	30
R	-	CD	ARG	A	15	L	H	HA	LYS	V	31
R	-	CD	ARG	A	15	L	-	HA2	GLY	V	34
R	-	NE	ARG	A	15	L	H	C	GLU	V	30
R	-	NE	ARG	A	15	L	H	CB	GLU	V	30
R	-	NE	ARG	A	15	L	H	O	GLU	V	30
R	-	NE	ARG	A	15	L	H	HB3	GLU	V	30
R	-	NE	ARG	A	15	L	H	N	LYS	V	31
R	-	NE	ARG	A	15	L	H	HA	LYS	V	31
R	-	NE	ARG	A	15	L	-	HA2	GLY	V	34
R	-	NH1	ARG	A	15	L	H	HB3	GLU	V	30
R	-	NH1	ARG	A	15	L	-	HA2	GLY	V	34
R	-	NH2	ARG	A	15	L	H	CA	GLU	V	30
R	-	NH2	ARG	A	15	L	H	C	GLU	V	30
R	-	NH2	ARG	A	15	L	H	CB	GLU	V	30
R	-	NH2	ARG	A	15	L	H	O	GLU	V	30
R	-	NH2	ARG	A	15	L	H	CG	GLU	V	30
R	-	NH2	ARG	A	15	L	H	CD	GLU	V	30
R	-	NH2	ARG	A	15	L	H	HA	GLU	V	30
R	-	NH2	ARG	A	15	L	H	HB2	GLU	V	30
R	-	NH2	ARG	A	15	L	H	HB3	GLU	V	30
R	-	NH2	ARG	A	15	L	H	HG2	GLU	V	30
R	-	NH2	ARG	A	15	L	-	HA2	GLY	V	34
R	-	CZ	ARG	A	15	L	H	CA	GLU	V	30
R	-	CZ	ARG	A	15	L	H	C	GLU	V	30
R	-	CZ	ARG	A	15	L	H	CB	GLU	V	30
R	-	CZ	ARG	A	15	L	H	O	GLU	V	30
R	-	CZ	ARG	A	15	L	H	HA	GLU	V	30
R	-	CZ	ARG	A	15	L	H	HB3	GLU	V	30
R	-	CZ	ARG	A	15	L	-	HA2	GLY	V	34
R	-	N	GLY	A	16	L	S	HE1	PHE	V	90
R	-	OD1	ASN	A	27	L	S	HG2	ARG	V	89
R	-	CA	LEU	A	28	L	H	HZ1	LYS	V	31
R	-	C	LEU	A	28	L	H	CE	LYS	V	31
R	-	C	LEU	A	28	L	H	NZ	LYS	V	31
R	-	C	LEU	A	28	L	H	HE3	LYS	V	31
R	-	C	LEU	A	28	L	H	HZ1	LYS	V	31
R	-	C	LEU	A	28	L	H	HZ2	LYS	V	31
R	-	C	LEU	A	28	L	H	HZ3	LYS	V	31
R	-	O	LEU	A	28	L	H	CE	LYS	V	31
R	-	O	LEU	A	28	L	H	NZ	LYS	V	31
R	-	O	LEU	A	28	L	H	HE2	LYS	V	31
R	-	O	LEU	A	28	L	H	HE3	LYS	V	31
R	-	O	LEU	A	28	L	H	HZ1	LYS	V	31
R	-	O	LEU	A	28	L	H	HZ2	LYS	V	31
R	-	O	LEU	A	28	L	H	HZ3	LYS	V	31
R	S	N	SER	A	29	L	H	CE	LYS	V	31
R	S	N	SER	A	29	L	H	NZ	LYS	V	31
R	S	N	SER	A	29	L	H	HE2	LYS	V	31
R	S	N	SER	A	29	L	H	HE3	LYS	V	31
R	S	N	SER	A	29	L	H	HZ1	LYS	V	31
R	S	N	SER	A	29	L	H	HZ2	LYS	V	31
R	S	N	SER	A	29	L	H	HZ3	LYS	V	31
R	S	CA	SER	A	29	L	H	OG	SER	V	27
R	S	CA	SER	A	29	L	H	HG	SER	V	27
R	S	CA	SER	A	29	L	H	CE	LYS	V	31
R	S	CA	SER	A	29	L	H	NZ	LYS	V	31
R	S	CA	SER	A	29	L	H	HE2	LYS	V	31
R	S	CA	SER	A	29	L	H	HE3	LYS	V	31
R	S	CA	SER	A	29	L	H	HZ1	LYS	V	31
R	S	CA	SER	A	29	L	H	HZ2	LYS	V	31
R	S	CA	SER	A	29	L	H	HZ3	LYS	V	31
R	S	C	SER	A	29	L	H	OG	SER	V	27
R	S	C	SER	A	29	L	H	CE	LYS	V	31
R	S	C	SER	A	29	L	H	NZ	LYS	V	31
R	S	C	SER	A	29	L	H	HE2	LYS	V	31
R	S	C	SER	A	29	L	H	HE3	LYS	V	31
R	S	C	SER	A	29	L	H	HZ1	LYS	V	31
R	S	CB	SER	A	29	L	H	OG	SER	V	27
R	S	CB	SER	A	29	L	H	HG	SER	V	27
R	S	CB	SER	A	29	L	H	CE	LYS	V	31
R	S	CB	SER	A	29	L	H	NZ	LYS	V	31
R	S	CB	SER	A	29	L	H	HE2	LYS	V	31
R	S	CB	SER	A	29	L	H	HZ1	LYS	V	31
R	S	CB	SER	A	29	L	H	HZ2	LYS	V	31
R	S	CB	SER	A	29	L	H	HZ3	LYS	V	31
R	S	OG	SER	A	29	L	H	CB	SER	V	27
R	S	OG	SER	A	29	L	H	OG	SER	V	27
R	S	OG	SER	A	29	L	H	HB2	SER	V	27
R	S	OG	SER	A	29	L	H	HB3	SER	V	27
R	S	OG	SER	A	29	L	H	HG	SER	V	27
R	S	OG	SER	A	29	L	H	CE	LYS	V	31
R	S	OG	SER	A	29	L	H	NZ	LYS	V	31
R	S	OG	SER	A	29	L	H	HE2	LYS	V	31
R	S	OG	SER	A	29	L	H	HZ1	LYS	V	31
R	S	OG	SER	A	29	L	H	HZ2	LYS	V	31
R	S	N	TYR	A	30	L	H	OG	SER	V	27
R	S	N	TYR	A	30	L	H	CE	LYS	V	31
R	S	N	TYR	A	30	L	H	NZ	LYS	V	31
R	S	N	TYR	A	30	L	H	HG3	LYS	V	31
R	S	N	TYR	A	30	L	H	HE2	LYS	V	31
R	S	N	TYR	A	30	L	H	HE3	LYS	V	31
R	S	N	TYR	A	30	L	H	HZ1	LYS	V	31
R	S	CA	TYR	A	30	L	H	HE2	LYS	V	31
R	S	CA	TYR	A	30	L	H	HE3	LYS	V	31
R	S	CB	TYR	A	30	L	H	HG2	LYS	V	31
R	S	CB	TYR	A	30	L	H	HG3	LYS	V	31
R	S	CB	TYR	A	30	L	H	HE2	LYS	V	31
R	S	CB	TYR	A	30	L	H	HE3	LYS	V	31
R	S	CD1	TYR	A	30	L	H	HB3	GLU	V	30
R	S	CE1	TYR	A	30	L	H	HB3	GLU	V	30
R	-	CB	GLU	A	109	L	-	HG13	VAL	V	15
R	-	CG	GLU	A	109	L	-	HG13	VAL	V	15
R	-	OG	SER	A	122	L	-	HD22	LEU	V	11
R	-	OG	SER	A	122	L	-	HD23	LEU	V	11
R	H	CA	ASP	A	124	L	-	HD12	LEU	V	11
R	H	CA	ASP	A	124	L	-	HD23	LEU	V	11
R	H	C	ASP	A	124	L	-	CD2	LEU	V	11
R	H	C	ASP	A	124	L	-	HD12	LEU	V	11
R	H	C	ASP	A	124	L	-	HD23	LEU	V	11
R	H	CB	ASP	A	124	L	-	CG	LEU	V	11
R	H	CB	ASP	A	124	L	-	CD1	LEU	V	11
R	H	CB	ASP	A	124	L	-	CD2	LEU	V	11
R	H	CB	ASP	A	124	L	-	HD12	LEU	V	11
R	H	CB	ASP	A	124	L	-	HD13	LEU	V	11
R	H	CB	ASP	A	124	L	-	HD22	LEU	V	11
R	H	CB	ASP	A	124	L	-	HD23	LEU	V	11
R	H	O	ASP	A	124	L	-	HB2	LEU	V	11
R	H	O	ASP	A	124	L	-	HD23	LEU	V	11
R	H	CG	ASP	A	124	L	-	CD1	LEU	V	11
R	H	CG	ASP	A	124	L	-	HD12	LEU	V	11
R	H	CG	ASP	A	124	L	-	HD13	LEU	V	11
R	H	CG	ASP	A	124	L	-	HD23	LEU	V	11
R	H	OD1	ASP	A	124	L	-	HD12	LEU	V	11
R	H	OD2	ASP	A	124	L	-	CD1	LEU	V	11
R	H	OD2	ASP	A	124	L	-	HD12	LEU	V	11
R	H	OD2	ASP	A	124	L	-	HD13	LEU	V	11
R	H	OD2	ASP	A	124	L	-	HD22	LEU	V	11
R	H	N	HIS	A	125	L	-	CD2	LEU	V	11
R	H	N	HIS	A	125	L	-	HD21	LEU	V	11
R	H	N	HIS	A	125	L	-	HD23	LEU	V	11
R	H	CA	HIS	A	125	L	-	HD23	LEU	V	11
R	H	CB	HIS	A	125	L	-	HG	CYS	V	13
R	H	CG	HIS	A	125	L	-	HD21	LEU	V	11
R	H	CG	HIS	A	125	L	-	HD23	LEU	V	11
R	H	CG	HIS	A	125	L	-	SG	CYS	V	13
R	H	CG	HIS	A	125	L	-	HG	CYS	V	13
R	H	CD2	HIS	A	125	L	-	HD21	LEU	V	11
R	H	CD2	HIS	A	125	L	-	CB	CYS	V	13
R	H	CD2	HIS	A	125	L	-	SG	CYS	V	13
R	H	CD2	HIS	A	125	L	-	HB2	CYS	V	13
R	H	CD2	HIS	A	125	L	-	HG	CYS	V	13
R	H	ND1	HIS	A	125	L	-	CD2	LEU	V	11
R	H	ND1	HIS	A	125	L	-	HD21	LEU	V	11
R	H	ND1	HIS	A	125	L	-	HD22	LEU	V	11
R	H	ND1	HIS	A	125	L	-	HD23	LEU	V	11
R	H	ND1	HIS	A	125	L	-	SG	CYS	V	13
R	H	ND1	HIS	A	125	L	-	HG	CYS	V	13
R	H	CE1	HIS	A	125	L	-	CD2	LEU	V	11
R	H	CE1	HIS	A	125	L	-	HD21	LEU	V	11
R	H	CE1	HIS	A	125	L	-	HD22	LEU	V	11
R	H	CE1	HIS	A	125	L	-	SG	CYS	V	13
R	H	CE1	HIS	A	125	L	-	HG	CYS	V	13
R	H	NE2	HIS	A	125	L	-	HD21	LEU	V	11
R	H	NE2	HIS	A	125	L	-	CB	CYS	V	13
R	H	NE2	HIS	A	125	L	-	SG	CYS	V	13
R	H	NE2	HIS	A	125	L	-	HA	CYS	V	13
R	H	NE2	HIS	A	125	L	-	HB2	CYS	V	13
R	H	NE2	HIS	A	125	L	-	HB3	CYS	V	13
R	H	NE2	HIS	A	125	L	-	HG	CYS	V	13
R	H	CB	TYR	A	128	L	-	HB2	LEU	V	11
R	H	CG	TYR	A	128	L	-	H	LEU	V	11
R	H	CD1	TYR	A	128	L	-	O	LEU	V	11
R	H	CD1	TYR	A	128	L	-	HB3	LEU	V	11
R	H	CD2	TYR	A	128	L	-	HA	PHE	V	10
R	H	CD2	TYR	A	128	L	-	HD1	PHE	V	10
R	H	CD2	TYR	A	128	L	-	H	LEU	V	11
R	H	CE1	TYR	A	128	L	-	HD1	PHE	V	10
R	H	CE1	TYR	A	128	L	-	O	LEU	V	11
R	H	CE2	TYR	A	128	L	-	CG	PHE	V	10
R	H	CE2	TYR	A	128	L	-	CD1	PHE	V	10
R	H	CE2	TYR	A	128	L	-	CE1	PHE	V	10
R	H	CE2	TYR	A	128	L	-	HA	PHE	V	10
R	H	CE2	TYR	A	128	L	-	HB3	PHE	V	10
R	H	CE2	TYR	A	128	L	-	HD1	PHE	V	10
R	H	CE2	TYR	A	128	L	-	HE1	PHE	V	10
R	H	OH	TYR	A	128	L	-	CG	PHE	V	10
R	H	OH	TYR	A	128	L	-	CD1	PHE	V	10
R	H	OH	TYR	A	128	L	-	CE1	PHE	V	10
R	H	OH	TYR	A	128	L	-	HB3	PHE	V	10
R	H	OH	TYR	A	128	L	-	HD1	PHE	V	10
R	H	OH	TYR	A	128	L	-	HE1	PHE	V	10
R	H	CZ	TYR	A	128	L	-	CD1	PHE	V	10
R	H	CZ	TYR	A	128	L	-	HA	PHE	V	10
R	H	CZ	TYR	A	128	L	-	HB3	PHE	V	10
R	H	CZ	TYR	A	128	L	-	HD1	PHE	V	10
R	H	CZ	TYR	A	128	L	-	HE1	PHE	V	10
R	H	CZ	PHE	A	129	L	-	HG	CYS	V	13
R	H	CE1	TYR	A	131	L	-	HE1	PHE	V	10
R	-	CA	ASN	A	158	L	-	HG22	VAL	V	15
R	-	C	ASN	A	158	L	-	CG2	VAL	V	15
R	-	C	ASN	A	158	L	-	HB	VAL	V	15
R	-	C	ASN	A	158	L	-	HG21	VAL	V	15
R	-	C	ASN	A	158	L	-	HG22	VAL	V	15
R	-	O	ASN	A	158	L	-	CB	VAL	V	15
R	-	O	ASN	A	158	L	-	CG2	VAL	V	15
R	-	O	ASN	A	158	L	-	HB	VAL	V	15
R	-	O	ASN	A	158	L	-	HG13	VAL	V	15
R	-	O	ASN	A	158	L	-	HG21	VAL	V	15
R	-	O	ASN	A	158	L	-	HG22	VAL	V	15
R	-	O	ASN	A	158	L	-	HG23	VAL	V	15
R	-	N	THR	A	159	L	-	CB	VAL	V	15
R	-	N	THR	A	159	L	-	CG2	VAL	V	15
R	-	N	THR	A	159	L	-	HB	VAL	V	15
R	-	N	THR	A	159	L	-	HG13	VAL	V	15
R	-	N	THR	A	159	L	-	HG21	VAL	V	15
R	-	N	THR	A	159	L	-	HG22	VAL	V	15
R	-	CA	THR	A	159	L	-	N	VAL	V	15
R	-	CA	THR	A	159	L	-	CA	VAL	V	15
R	-	CA	THR	A	159	L	-	CB	VAL	V	15
R	-	CA	THR	A	159	L	-	CG1	VAL	V	15
R	-	CA	THR	A	159	L	-	CG2	VAL	V	15
R	-	CA	THR	A	159	L	-	H	VAL	V	15
R	-	CA	THR	A	159	L	-	HB	VAL	V	15
R	-	CA	THR	A	159	L	-	HG11	VAL	V	15
R	-	CA	THR	A	159	L	-	HG13	VAL	V	15
R	-	CA	THR	A	159	L	-	HG21	VAL	V	15
R	-	CA	THR	A	159	L	-	HG22	VAL	V	15
R	-	CA	THR	A	159	L	-	HG23	VAL	V	15
R	-	C	THR	A	159	L	-	O	CYS	V	13
R	-	C	THR	A	159	L	-	N	VAL	V	15
R	-	C	THR	A	159	L	-	CA	VAL	V	15
R	-	C	THR	A	159	L	-	CB	VAL	V	15
R	-	C	THR	A	159	L	-	CG2	VAL	V	15
R	-	C	THR	A	159	L	-	H	VAL	V	15
R	-	C	THR	A	159	L	-	HB	VAL	V	15
R	-	C	THR	A	159	L	-	HG21	VAL	V	15
R	-	C	THR	A	159	L	-	HG22	VAL	V	15
R	-	C	THR	A	159	L	-	HG23	VAL	V	15
R	-	CB	THR	A	159	L	-	CA	VAL	V	15
R	-	CB	THR	A	159	L	-	CB	VAL	V	15
R	-	CB	THR	A	159	L	-	O	VAL	V	15
R	-	CB	THR	A	159	L	-	CG1	VAL	V	15
R	-	CB	THR	A	159	L	-	CG2	VAL	V	15
R	-	CB	THR	A	159	L	-	H	VAL	V	15
R	-	CB	THR	A	159	L	-	HB	VAL	V	15
R	-	CB	THR	A	159	L	-	HG11	VAL	V	15
R	-	CB	THR	A	159	L	-	HG13	VAL	V	15
R	-	CB	THR	A	159	L	-	HG21	VAL	V	15
R	-	CB	THR	A	159	L	-	HG22	VAL	V	15
R	-	O	THR	A	159	L	-	C	CYS	V	13
R	-	O	THR	A	159	L	-	O	CYS	V	13
R	-	O	THR	A	159	L	-	CA	SER	V	14
R	-	O	THR	A	159	L	-	C	SER	V	14
R	-	O	THR	A	159	L	-	HA	SER	V	14
R	-	O	THR	A	159	L	-	N	VAL	V	15
R	-	O	THR	A	159	L	-	CA	VAL	V	15
R	-	O	THR	A	159	L	-	C	VAL	V	15
R	-	O	THR	A	159	L	-	CB	VAL	V	15
R	-	O	THR	A	159	L	-	O	VAL	V	15
R	-	O	THR	A	159	L	-	CG1	VAL	V	15
R	-	O	THR	A	159	L	-	CG2	VAL	V	15
R	-	O	THR	A	159	L	-	H	VAL	V	15
R	-	O	THR	A	159	L	-	HA	VAL	V	15
R	-	O	THR	A	159	L	-	HB	VAL	V	15
R	-	O	THR	A	159	L	-	HG21	VAL	V	15
R	-	O	THR	A	159	L	-	HG22	VAL	V	15
R	-	O	THR	A	159	L	-	HG23	VAL	V	15
R	-	CG2	THR	A	159	L	-	CB	VAL	V	15
R	-	CG2	THR	A	159	L	-	O	VAL	V	15
R	-	CG2	THR	A	159	L	-	CG1	VAL	V	15
R	-	CG2	THR	A	159	L	-	HB	VAL	V	15
R	-	CG2	THR	A	159	L	-	HG11	VAL	V	15
R	-	CG2	THR	A	159	L	-	HG13	VAL	V	15
R	-	CG2	THR	A	159	L	-	HA	ALA	V	17
R	-	OG1	THR	A	159	L	-	HB	VAL	V	15
R	-	N	THR	A	160	L	-	O	CYS	V	13
R	-	N	THR	A	160	L	-	CG2	VAL	V	15
R	-	N	THR	A	160	L	-	H	VAL	V	15
R	-	N	THR	A	160	L	-	HB	VAL	V	15
R	-	N	THR	A	160	L	-	HG21	VAL	V	15
R	-	N	THR	A	160	L	-	HG22	VAL	V	15
R	-	CA	THR	A	160	L	-	O	CYS	V	13
R	-	CA	THR	A	160	L	-	H	VAL	V	15
R	-	CA	THR	A	160	L	-	HG21	VAL	V	15
R	-	C	THR	A	160	L	-	O	CYS	V	13
R	-	C	THR	A	160	L	-	HB2	CYS	V	13
R	-	C	THR	A	160	L	-	HG21	VAL	V	15
R	-	O	THR	A	160	L	-	HA	ALA	V	12
R	-	O	THR	A	160	L	-	N	CYS	V	13
R	-	O	THR	A	160	L	-	O	CYS	V	13
R	-	O	THR	A	160	L	-	H	CYS	V	13
R	-	O	THR	A	160	L	-	HB2	CYS	V	13
R	-	N	CYS	A	161	L	-	O	CYS	V	13
R	-	N	CYS	A	161	L	-	HB2	CYS	V	13
R	-	N	CYS	A	161	L	-	HG21	VAL	V	15
R	-	N	CYS	A	161	L	-	HG22	VAL	V	15
R	-	CA	CYS	A	161	L	-	HB2	CYS	V	13
R	-	CB	CYS	A	161	L	-	N	CYS	V	13
R	-	CB	CYS	A	161	L	-	CA	CYS	V	13
R	-	CB	CYS	A	161	L	-	CB	CYS	V	13
R	-	CB	CYS	A	161	L	-	O	CYS	V	13
R	-	CB	CYS	A	161	L	-	H	CYS	V	13
R	-	CB	CYS	A	161	L	-	HB2	CYS	V	13
R	-	CB	CYS	A	161	L	-	HB3	CYS	V	13
R	-	SG	CYS	A	161	L	-	N	CYS	V	13
R	-	SG	CYS	A	161	L	-	CA	CYS	V	13
R	-	SG	CYS	A	161	L	-	C	CYS	V	13
R	-	SG	CYS	A	161	L	-	CB	CYS	V	13
R	-	SG	CYS	A	161	L	-	O	CYS	V	13
R	-	SG	CYS	A	161	L	-	SG	CYS	V	13
R	-	SG	CYS	A	161	L	-	H	CYS	V	13
R	-	SG	CYS	A	161	L	-	HA	CYS	V	13
R	-	SG	CYS	A	161	L	-	HB2	CYS	V	13
R	-	SG	CYS	A	161	L	-	HB3	CYS	V	13
R	-	SG	CYS	A	161	L	-	HG	CYS	V	13
R	-	SG	CYS	A	161	L	-	HG21	VAL	V	15
R	-	O	GLU	A	314	L	-	CB	PRO	V	6
R	-	O	GLU	A	314	L	-	HB2	PRO	V	6
R	-	O	GLU	A	314	L	-	HB3	PRO	V	6
R	-	CA	GLN	A	315	L	-	HA	ALA	V	8
R	-	C	GLN	A	315	L	-	N	ALA	V	8
R	-	C	GLN	A	315	L	-	CA	ALA	V	8
R	-	C	GLN	A	315	L	-	CB	ALA	V	8
R	-	C	GLN	A	315	L	-	HA	ALA	V	8
R	-	C	GLN	A	315	L	-	HB1	ALA	V	8
R	-	C	GLN	A	315	L	-	HB3	ALA	V	8
R	-	C	GLN	A	315	L	-	H	TRP	V	9
R	-	CB	GLN	A	315	L	-	HA	ALA	V	8
R	-	CB	GLN	A	315	L	-	H	TRP	V	9
R	-	O	GLN	A	315	L	-	C	LEU	V	7
R	-	O	GLN	A	315	L	-	O	LEU	V	7
R	-	O	GLN	A	315	L	-	N	ALA	V	8
R	-	O	GLN	A	315	L	-	CA	ALA	V	8
R	-	O	GLN	A	315	L	-	C	ALA	V	8
R	-	O	GLN	A	315	L	-	CB	ALA	V	8
R	-	O	GLN	A	315	L	-	H	ALA	V	8
R	-	O	GLN	A	315	L	-	HA	ALA	V	8
R	-	O	GLN	A	315	L	-	HB1	ALA	V	8
R	-	O	GLN	A	315	L	-	HB2	ALA	V	8
R	-	O	GLN	A	315	L	-	HB3	ALA	V	8
R	-	O	GLN	A	315	L	-	N	TRP	V	9
R	-	O	GLN	A	315	L	-	H	TRP	V	9
R	-	CD	GLN	A	315	L	-	HB2	TRP	V	9
R	-	OE1	GLN	A	315	L	-	HB2	TRP	V	9
R	-	N	TYR	A	316	L	-	CA	ALA	V	8
R	-	N	TYR	A	316	L	-	CB	ALA	V	8
R	-	N	TYR	A	316	L	-	HA	ALA	V	8
R	-	N	TYR	A	316	L	-	HB1	ALA	V	8
R	-	N	TYR	A	316	L	-	HB3	ALA	V	8
R	-	CA	TYR	A	316	L	-	CA	ALA	V	8
R	-	CA	TYR	A	316	L	-	CB	ALA	V	8
R	-	CA	TYR	A	316	L	-	HA	ALA	V	8
R	-	CA	TYR	A	316	L	-	HB1	ALA	V	8
R	-	CA	TYR	A	316	L	-	HB2	ALA	V	8
R	-	CA	TYR	A	316	L	-	HB3	ALA	V	8
R	-	C	TYR	A	316	L	-	CB	ALA	V	8
R	-	C	TYR	A	316	L	-	HB1	ALA	V	8
R	-	C	TYR	A	316	L	-	HB3	ALA	V	8
R	-	CB	TYR	A	316	L	-	CB	ALA	V	8
R	-	CB	TYR	A	316	L	-	HB1	ALA	V	8
R	-	CB	TYR	A	316	L	-	HB3	ALA	V	8
R	-	O	TYR	A	316	L	-	CB	ALA	V	8
R	-	O	TYR	A	316	L	-	HB1	ALA	V	8
R	-	O	TYR	A	316	L	-	HB2	ALA	V	8
R	-	O	TYR	A	316	L	-	HB3	ALA	V	8
R	-	CG	TYR	A	316	L	-	HB1	ALA	V	8
R	-	CD1	TYR	A	316	L	-	C	ALA	V	8
R	-	CD1	TYR	A	316	L	-	CB	ALA	V	8
R	-	CD1	TYR	A	316	L	-	HA	ALA	V	8
R	-	CD1	TYR	A	316	L	-	HB1	ALA	V	8
R	-	CD1	TYR	A	316	L	-	N	TRP	V	9
R	-	CD1	TYR	A	316	L	-	C	TRP	V	9
R	-	CD1	TYR	A	316	L	-	O	TRP	V	9
R	-	CD1	TYR	A	316	L	-	HA	PHE	V	10
R	-	CE1	TYR	A	316	L	-	HB1	ALA	V	8
R	-	CE1	TYR	A	316	L	-	N	TRP	V	9
R	-	CE1	TYR	A	316	L	-	CA	TRP	V	9
R	-	CE1	TYR	A	316	L	-	C	TRP	V	9
R	-	CE1	TYR	A	316	L	-	O	TRP	V	9
R	-	CE1	TYR	A	316	L	-	N	PHE	V	10
R	-	CE1	TYR	A	316	L	-	CA	PHE	V	10
R	-	CE1	TYR	A	316	L	-	HA	PHE	V	10
R	-	CE1	TYR	A	316	L	-	H	LEU	V	11
R	-	CE2	TYR	A	316	L	-	O	TRP	V	9
R	-	OH	TYR	A	316	L	-	C	TRP	V	9
R	-	OH	TYR	A	316	L	-	O	TRP	V	9
R	-	OH	TYR	A	316	L	-	HA	PHE	V	10
R	-	OH	TYR	A	316	L	-	N	LEU	V	11
R	-	OH	TYR	A	316	L	-	CB	LEU	V	11
R	-	OH	TYR	A	316	L	-	H	LEU	V	11
R	-	OH	TYR	A	316	L	-	HB2	LEU	V	11
R	-	OH	TYR	A	316	L	-	HD12	LEU	V	11
R	-	CZ	TYR	A	316	L	-	C	TRP	V	9
R	-	CZ	TYR	A	316	L	-	O	TRP	V	9
R	-	CZ	TYR	A	316	L	-	HA	PHE	V	10
R	-	CZ	TYR	A	316	L	-	H	LEU	V	11
R	-	CZ	TYR	A	316	L	-	HB2	LEU	V	11
R	-	N	TYR	A	317	L	-	HB3	ALA	V	8
R	-	C	TYR	A	317	L	-	HG3	PRO	V	6
R	-	O	TYR	A	317	L	-	CB	PRO	V	6
R	-	O	TYR	A	317	L	-	CG	PRO	V	6
R	-	O	TYR	A	317	L	-	HB2	PRO	V	6
R	-	O	TYR	A	317	L	-	HG2	PRO	V	6
R	-	O	TYR	A	317	L	-	HG3	PRO	V	6
R	-	OD2	ASP	A	321	L	-	HZ	PHE	V	10

- 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