IID

Q00889_Q96IZ2.1 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	-	SER	A	153	L	-	VAL	V	32
R	-	ASN	A	154	L	-	VAL	V	32
R	-	VAL	A	160	L	H	THR	V	120
R	-	MET	A	161	L	H	THR	V	120
R	-	MET	A	161	L	-	VAL	V	121
R	-	GLU	A	162	L	H	THR	V	120
R	S	ALA	A	163	L	-	VAL	V	32
R	S	ALA	A	163	L	-	PRO	V	34
R	S	ARG	A	165	L	-	GLU	V	31
R	S	ARG	A	165	L	-	LYS	V	35
R	S	PHE	A	204	L	H	VAL	V	117
R	S	PHE	A	204	L	-	PRO	V	34
R	S	PHE	A	204	L	-	ILE	V	36
R	-	GLY	A	205	L	H	THR	V	120
R	-	MET	A	240	L	H	VAL	V	124
R	-	MET	A	240	L	H	TRP	V	125
R	-	ASN	A	275	L	H	LEU	V	12
R	-	ASN	A	275	L	H	SER	V	15
R	-	ASN	A	275	L	H	TRP	V	16
R	-	ASN	A	275	L	H	PHE	V	19
R	-	GLY	A	276	L	H	PHE	V	19
R	H	ARG	A	301	L	H	THR	V	4
R	H	ARG	A	301	L	H	ILE	V	8
R	H	ASN	A	302	L	H	LEU	V	12
R	-	THR	A	304	L	H	LEU	V	12
R	S	GLY	A	305	L	H	LEU	V	12
R	S	PRO	A	306	L	H	TRP	V	16
R	S	GLN	A	308	L	H	TRP	V	125
R	S	GLN	A	308	L	H	TRP	V	16
R	S	GLN	A	308	L	H	PHE	V	19
R	S	ARG	A	319	L	H	TRP	V	125
R	S	ARG	A	319	L	H	PHE	V	19
R	S	ARG	A	319	L	H	TYR	V	23
R	-	SER	A	320	L	H	TRP	V	125
R	-	ASN	A	321	L	H	VAL	V	124
R	-	ASN	A	321	L	H	TRP	V	125
R	-	ASN	A	321	L	H	HIS	V	128
R	-	PRO	A	322	L	H	TRP	V	125
R	-	PRO	A	322	L	-	PHE	V	133
R	-	TYR	A	329	L	H	SER	V	5
R	-	TYR	A	329	L	H	ILE	V	8
R	S	ARG	A	335	L	-	MET	V	1
R	S	TYR	A	337	L	-	MET	V	1
R	-	ASN	A	348	L	-	LYS	V	228
R	S	PHE	A	354	L	-	MET	V	1
R	S	PHE	A	354	L	-	THR	V	2
R	S	PHE	A	354	L	-	LYS	V	3
R	S	PHE	A	354	L	H	THR	V	4
R	S	PHE	A	354	L	H	ARG	V	69
R	-	ASP	A	356	L	-	LYS	V	3
R	-	ASP	A	356	L	H	THR	V	4
R	-	ASP	A	356	L	H	SER	V	5
R	-	ASP	A	356	L	H	ILE	V	8
R	-	SER	A	357	L	H	SER	V	5
R	-	ASN	A	358	L	H	SER	V	5
R	-	PRO	A	360	L	-	LYS	V	3
R	S	TYR	A	363	L	-	LYS	V	3
R	-	GLN	A	376	L	-	LYS	V	3
R	S	LYS	A	377	L	-	ARG	V	226
R	S	LEU	A	378	L	-	ARG	V	226
R	S	PHE	A	379	L	-	ARG	V	226
R	S	PHE	A	379	L	-	LYS	V	228
R	-	PRO	A	381	L	-	LYS	V	228
R	-	PRO	A	381	L	-	ARG	V	229
R	-	GLN	A	382	L	-	LYS	V	228

- 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

Q00889_Q96IZ2.1 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	-	CA	SER	A	153	L	-	HG12	VAL	V	32
R	-	CA	SER	A	153	L	-	HG23	VAL	V	32
R	-	C	SER	A	153	L	-	CG1	VAL	V	32
R	-	C	SER	A	153	L	-	CG2	VAL	V	32
R	-	C	SER	A	153	L	-	HG12	VAL	V	32
R	-	C	SER	A	153	L	-	HG13	VAL	V	32
R	-	C	SER	A	153	L	-	HG22	VAL	V	32
R	-	C	SER	A	153	L	-	HG23	VAL	V	32
R	-	CB	SER	A	153	L	-	CA	VAL	V	32
R	-	CB	SER	A	153	L	-	HA	VAL	V	32
R	-	CB	SER	A	153	L	-	HG12	VAL	V	32
R	-	CB	SER	A	153	L	-	HG23	VAL	V	32
R	-	O	SER	A	153	L	-	CB	VAL	V	32
R	-	O	SER	A	153	L	-	CG1	VAL	V	32
R	-	O	SER	A	153	L	-	CG2	VAL	V	32
R	-	O	SER	A	153	L	-	HA	VAL	V	32
R	-	O	SER	A	153	L	-	HG12	VAL	V	32
R	-	O	SER	A	153	L	-	HG13	VAL	V	32
R	-	O	SER	A	153	L	-	HG21	VAL	V	32
R	-	O	SER	A	153	L	-	HG22	VAL	V	32
R	-	O	SER	A	153	L	-	HG23	VAL	V	32
R	-	OG	SER	A	153	L	-	CG1	VAL	V	32
R	-	OG	SER	A	153	L	-	HA	VAL	V	32
R	-	OG	SER	A	153	L	-	HG12	VAL	V	32
R	-	OG	SER	A	153	L	-	HG23	VAL	V	32
R	-	N	ASN	A	154	L	-	HG12	VAL	V	32
R	-	N	ASN	A	154	L	-	HG23	VAL	V	32
R	-	CA	ASN	A	154	L	-	HG12	VAL	V	32
R	-	CA	ASN	A	154	L	-	HG13	VAL	V	32
R	-	CB	ASN	A	154	L	-	CG1	VAL	V	32
R	-	CB	ASN	A	154	L	-	HG11	VAL	V	32
R	-	CB	ASN	A	154	L	-	HG12	VAL	V	32
R	-	CB	ASN	A	154	L	-	HG13	VAL	V	32
R	-	CG	ASN	A	154	L	-	CG1	VAL	V	32
R	-	CG	ASN	A	154	L	-	HG12	VAL	V	32
R	-	CG	ASN	A	154	L	-	HG13	VAL	V	32
R	-	ND2	ASN	A	154	L	-	HG13	VAL	V	32
R	-	C	VAL	A	160	L	H	CG2	THR	V	120
R	-	C	VAL	A	160	L	H	HB	THR	V	120
R	-	C	VAL	A	160	L	H	HG21	THR	V	120
R	-	C	VAL	A	160	L	H	HG22	THR	V	120
R	-	O	VAL	A	160	L	H	CB	THR	V	120
R	-	O	VAL	A	160	L	H	CG2	THR	V	120
R	-	O	VAL	A	160	L	H	HA	THR	V	120
R	-	O	VAL	A	160	L	H	HB	THR	V	120
R	-	O	VAL	A	160	L	H	HG21	THR	V	120
R	-	O	VAL	A	160	L	H	HG22	THR	V	120
R	-	O	VAL	A	160	L	H	HG23	THR	V	120
R	-	N	MET	A	161	L	H	HB	THR	V	120
R	-	N	MET	A	161	L	H	HG22	THR	V	120
R	-	CA	MET	A	161	L	H	CA	THR	V	120
R	-	CA	MET	A	161	L	H	CB	THR	V	120
R	-	CA	MET	A	161	L	H	CG2	THR	V	120
R	-	CA	MET	A	161	L	H	HA	THR	V	120
R	-	CA	MET	A	161	L	H	HB	THR	V	120
R	-	CA	MET	A	161	L	H	HG21	THR	V	120
R	-	CA	MET	A	161	L	H	HG22	THR	V	120
R	-	C	MET	A	161	L	H	CA	THR	V	120
R	-	C	MET	A	161	L	H	C	THR	V	120
R	-	C	MET	A	161	L	H	CB	THR	V	120
R	-	C	MET	A	161	L	H	O	THR	V	120
R	-	C	MET	A	161	L	H	CG2	THR	V	120
R	-	C	MET	A	161	L	H	OG1	THR	V	120
R	-	C	MET	A	161	L	H	HA	THR	V	120
R	-	C	MET	A	161	L	H	HB	THR	V	120
R	-	C	MET	A	161	L	H	HG21	THR	V	120
R	-	C	MET	A	161	L	H	HG22	THR	V	120
R	-	CB	MET	A	161	L	H	HA	THR	V	120
R	-	CB	MET	A	161	L	H	HB	THR	V	120
R	-	O	MET	A	161	L	H	CA	THR	V	120
R	-	O	MET	A	161	L	H	C	THR	V	120
R	-	O	MET	A	161	L	H	CB	THR	V	120
R	-	O	MET	A	161	L	H	O	THR	V	120
R	-	O	MET	A	161	L	H	CG2	THR	V	120
R	-	O	MET	A	161	L	H	OG1	THR	V	120
R	-	O	MET	A	161	L	H	HA	THR	V	120
R	-	O	MET	A	161	L	H	HB	THR	V	120
R	-	O	MET	A	161	L	H	HG1	THR	V	120
R	-	O	MET	A	161	L	H	HG21	THR	V	120
R	-	O	MET	A	161	L	H	HG22	THR	V	120
R	-	O	MET	A	161	L	-	N	VAL	V	121
R	-	CG	MET	A	161	L	H	HA	THR	V	120
R	-	N	GLU	A	162	L	H	CB	THR	V	120
R	-	N	GLU	A	162	L	H	HB	THR	V	120
R	-	CA	GLU	A	162	L	H	HB	THR	V	120
R	-	C	GLU	A	162	L	H	HB	THR	V	120
R	S	N	ALA	A	163	L	-	CG	PRO	V	34
R	S	N	ALA	A	163	L	-	CD	PRO	V	34
R	S	N	ALA	A	163	L	-	HG2	PRO	V	34
R	S	N	ALA	A	163	L	-	HG3	PRO	V	34
R	S	N	ALA	A	163	L	-	HD2	PRO	V	34
R	S	CA	ALA	A	163	L	-	CG	PRO	V	34
R	S	CA	ALA	A	163	L	-	CD	PRO	V	34
R	S	CA	ALA	A	163	L	-	HG2	PRO	V	34
R	S	CA	ALA	A	163	L	-	HG3	PRO	V	34
R	S	CA	ALA	A	163	L	-	HD2	PRO	V	34
R	S	C	ALA	A	163	L	-	O	VAL	V	32
R	S	C	ALA	A	163	L	-	HG2	PRO	V	34
R	S	C	ALA	A	163	L	-	HD2	PRO	V	34
R	S	CB	ALA	A	163	L	-	N	PRO	V	34
R	S	CB	ALA	A	163	L	-	CA	PRO	V	34
R	S	CB	ALA	A	163	L	-	CB	PRO	V	34
R	S	CB	ALA	A	163	L	-	CG	PRO	V	34
R	S	CB	ALA	A	163	L	-	CD	PRO	V	34
R	S	CB	ALA	A	163	L	-	HA	PRO	V	34
R	S	CB	ALA	A	163	L	-	HB3	PRO	V	34
R	S	CB	ALA	A	163	L	-	HG2	PRO	V	34
R	S	CB	ALA	A	163	L	-	HG3	PRO	V	34
R	S	CB	ALA	A	163	L	-	HD2	PRO	V	34
R	S	CB	ALA	A	163	L	-	HD3	PRO	V	34
R	S	O	ALA	A	163	L	-	O	VAL	V	32
R	S	O	ALA	A	163	L	-	HG11	VAL	V	32
R	S	O	ALA	A	163	L	-	HG2	PRO	V	34
R	S	O	ALA	A	163	L	-	HD2	PRO	V	34
R	S	NH1	ARG	A	165	L	-	O	GLU	V	31
R	S	NH1	ARG	A	165	L	-	CE	LYS	V	35
R	S	NH1	ARG	A	165	L	-	HE3	LYS	V	35
R	S	NH2	ARG	A	165	L	-	HB3	GLU	V	31
R	S	CZ	ARG	A	165	L	-	HE3	LYS	V	35
R	S	CB	PHE	A	204	L	H	HG21	VAL	V	117
R	S	CG	PHE	A	204	L	H	HG23	VAL	V	117
R	S	CD1	PHE	A	204	L	-	HB3	PRO	V	34
R	S	CD1	PHE	A	204	L	-	HG2	PRO	V	34
R	S	CD1	PHE	A	204	L	H	HG21	VAL	V	117
R	S	CD1	PHE	A	204	L	H	HG23	VAL	V	117
R	S	CE1	PHE	A	204	L	-	HB3	PRO	V	34
R	S	CE1	PHE	A	204	L	-	HD11	ILE	V	36
R	-	N	GLY	A	205	L	H	HG21	THR	V	120
R	-	CA	GLY	A	205	L	H	HG21	THR	V	120
R	-	SD	MET	A	240	L	H	HB	VAL	V	124
R	-	CE	MET	A	240	L	H	HB	VAL	V	124
R	-	CE	MET	A	240	L	H	H	TRP	V	125
R	-	CE	MET	A	240	L	H	HB3	TRP	V	125
R	-	C	ASN	A	275	L	H	HE3	TRP	V	16
R	-	O	ASN	A	275	L	H	HB3	SER	V	15
R	-	O	ASN	A	275	L	H	HB2	PHE	V	19
R	-	CG	ASN	A	275	L	H	CD2	LEU	V	12
R	-	CG	ASN	A	275	L	H	HD21	LEU	V	12
R	-	CG	ASN	A	275	L	H	HD23	LEU	V	12
R	-	ND2	ASN	A	275	L	H	CD2	LEU	V	12
R	-	ND2	ASN	A	275	L	H	HD21	LEU	V	12
R	-	ND2	ASN	A	275	L	H	HD22	LEU	V	12
R	-	ND2	ASN	A	275	L	H	HD23	LEU	V	12
R	-	OD1	ASN	A	275	L	H	CD2	LEU	V	12
R	-	OD1	ASN	A	275	L	H	HB2	LEU	V	12
R	-	OD1	ASN	A	275	L	H	HD21	LEU	V	12
R	-	OD1	ASN	A	275	L	H	HD23	LEU	V	12
R	-	CA	GLY	A	276	L	H	CG	PHE	V	19
R	-	CA	GLY	A	276	L	H	CD1	PHE	V	19
R	-	CA	GLY	A	276	L	H	CD2	PHE	V	19
R	-	CA	GLY	A	276	L	H	CE2	PHE	V	19
R	-	CA	GLY	A	276	L	H	CZ	PHE	V	19
R	-	CA	GLY	A	276	L	H	HD2	PHE	V	19
R	-	O	GLY	A	276	L	H	CD2	PHE	V	19
R	-	O	GLY	A	276	L	H	CE2	PHE	V	19
R	-	O	GLY	A	276	L	H	HD2	PHE	V	19
R	-	O	GLY	A	276	L	H	HE2	PHE	V	19
R	H	CB	ARG	A	301	L	H	HD12	ILE	V	8
R	H	O	ARG	A	301	L	H	HG22	ILE	V	8
R	H	O	ARG	A	301	L	H	HD12	ILE	V	8
R	H	CG	ARG	A	301	L	H	HD11	ILE	V	8
R	H	CG	ARG	A	301	L	H	HD12	ILE	V	8
R	H	CD	ARG	A	301	L	H	CD1	ILE	V	8
R	H	CD	ARG	A	301	L	H	HD11	ILE	V	8
R	H	CD	ARG	A	301	L	H	HD12	ILE	V	8
R	H	NH1	ARG	A	301	L	H	HG21	THR	V	4
R	H	O	ASN	A	302	L	H	HD22	LEU	V	12
R	-	CA	THR	A	304	L	H	HD12	LEU	V	12
R	-	C	THR	A	304	L	H	CD1	LEU	V	12
R	-	C	THR	A	304	L	H	HD12	LEU	V	12
R	-	C	THR	A	304	L	H	HD13	LEU	V	12
R	-	C	THR	A	304	L	H	HD22	LEU	V	12
R	-	C	THR	A	304	L	H	HD23	LEU	V	12
R	-	CB	THR	A	304	L	H	CD1	LEU	V	12
R	-	CB	THR	A	304	L	H	HD12	LEU	V	12
R	-	CB	THR	A	304	L	H	HD13	LEU	V	12
R	-	O	THR	A	304	L	H	CG	LEU	V	12
R	-	O	THR	A	304	L	H	CD1	LEU	V	12
R	-	O	THR	A	304	L	H	CD2	LEU	V	12
R	-	O	THR	A	304	L	H	HD12	LEU	V	12
R	-	O	THR	A	304	L	H	HD13	LEU	V	12
R	-	O	THR	A	304	L	H	HD22	LEU	V	12
R	-	O	THR	A	304	L	H	HD23	LEU	V	12
R	-	CG2	THR	A	304	L	H	CD1	LEU	V	12
R	-	CG2	THR	A	304	L	H	HD11	LEU	V	12
R	-	CG2	THR	A	304	L	H	HD12	LEU	V	12
R	-	CG2	THR	A	304	L	H	HD13	LEU	V	12
R	S	N	GLY	A	305	L	H	HD13	LEU	V	12
R	S	CA	GLY	A	305	L	H	HD13	LEU	V	12
R	S	CA	GLY	A	305	L	H	HD23	LEU	V	12
R	S	CG	PRO	A	306	L	H	CE3	TRP	V	16
R	S	CG	PRO	A	306	L	H	HE3	TRP	V	16
R	S	CD	GLN	A	308	L	H	HH2	TRP	V	16
R	S	CD	GLN	A	308	L	H	HZ3	TRP	V	16
R	S	NE2	GLN	A	308	L	H	HH2	TRP	V	16
R	S	NE2	GLN	A	308	L	H	CG	TRP	V	125
R	S	NE2	GLN	A	308	L	H	CD2	TRP	V	125
R	S	NE2	GLN	A	308	L	H	CE3	TRP	V	125
R	S	NE2	GLN	A	308	L	H	HB2	TRP	V	125
R	S	NE2	GLN	A	308	L	H	HE3	TRP	V	125
R	S	OE1	GLN	A	308	L	H	CZ3	TRP	V	16
R	S	OE1	GLN	A	308	L	H	HH2	TRP	V	16
R	S	OE1	GLN	A	308	L	H	HZ3	TRP	V	16
R	S	OE1	GLN	A	308	L	H	HE1	PHE	V	19
R	S	C	ARG	A	319	L	H	HD1	TRP	V	125
R	S	CB	ARG	A	319	L	H	CD1	TRP	V	125
R	S	CB	ARG	A	319	L	H	NE1	TRP	V	125
R	S	CB	ARG	A	319	L	H	HE1	TRP	V	125
R	S	O	ARG	A	319	L	H	CD1	TRP	V	125
R	S	O	ARG	A	319	L	H	HB3	TRP	V	125
R	S	O	ARG	A	319	L	H	HD1	TRP	V	125
R	S	NH1	ARG	A	319	L	H	CE1	PHE	V	19
R	S	NH1	ARG	A	319	L	H	CE2	PHE	V	19
R	S	NH1	ARG	A	319	L	H	CZ	PHE	V	19
R	S	NH1	ARG	A	319	L	H	HE2	PHE	V	19
R	S	NH1	ARG	A	319	L	H	HZ	PHE	V	19
R	S	NH1	ARG	A	319	L	H	HD2	TYR	V	23
R	S	NH1	ARG	A	319	L	H	HE2	TYR	V	23
R	S	NH2	ARG	A	319	L	H	HE2	PHE	V	19
R	S	NH2	ARG	A	319	L	H	HZ	PHE	V	19
R	S	NH2	ARG	A	319	L	H	HE2	TYR	V	23
R	S	CZ	ARG	A	319	L	H	HE2	PHE	V	19
R	S	CZ	ARG	A	319	L	H	HZ	PHE	V	19
R	S	CZ	ARG	A	319	L	H	HE2	TYR	V	23
R	-	C	SER	A	320	L	H	CB	TRP	V	125
R	-	C	SER	A	320	L	H	HB2	TRP	V	125
R	-	C	SER	A	320	L	H	HB3	TRP	V	125
R	-	O	SER	A	320	L	H	CB	TRP	V	125
R	-	O	SER	A	320	L	H	CG	TRP	V	125
R	-	O	SER	A	320	L	H	HB2	TRP	V	125
R	-	O	SER	A	320	L	H	HB3	TRP	V	125
R	-	N	ASN	A	321	L	H	CB	TRP	V	125
R	-	N	ASN	A	321	L	H	HB2	TRP	V	125
R	-	N	ASN	A	321	L	H	HB3	TRP	V	125
R	-	CA	ASN	A	321	L	H	CB	TRP	V	125
R	-	CA	ASN	A	321	L	H	HB2	TRP	V	125
R	-	CA	ASN	A	321	L	H	HB3	TRP	V	125
R	-	CG	ASN	A	321	L	H	HG11	VAL	V	124
R	-	CG	ASN	A	321	L	H	HA	TRP	V	125
R	-	CG	ASN	A	321	L	H	HB3	TRP	V	125
R	-	ND2	ASN	A	321	L	H	HG11	VAL	V	124
R	-	ND2	ASN	A	321	L	H	HD2	HIS	V	128
R	-	OD1	ASN	A	321	L	H	C	VAL	V	124
R	-	OD1	ASN	A	321	L	H	HG11	VAL	V	124
R	-	OD1	ASN	A	321	L	H	N	TRP	V	125
R	-	OD1	ASN	A	321	L	H	CA	TRP	V	125
R	-	OD1	ASN	A	321	L	H	CB	TRP	V	125
R	-	OD1	ASN	A	321	L	H	H	TRP	V	125
R	-	OD1	ASN	A	321	L	H	HA	TRP	V	125
R	-	OD1	ASN	A	321	L	H	HB2	TRP	V	125
R	-	OD1	ASN	A	321	L	H	HB3	TRP	V	125
R	-	OD1	ASN	A	321	L	H	HD2	HIS	V	128
R	-	N	PRO	A	322	L	-	HE2	PHE	V	133
R	-	CB	PRO	A	322	L	-	HE2	PHE	V	133
R	-	O	PRO	A	322	L	-	HZ	PHE	V	133
R	-	CG	PRO	A	322	L	-	CD2	PHE	V	133
R	-	CG	PRO	A	322	L	-	CE2	PHE	V	133
R	-	CG	PRO	A	322	L	-	CZ	PHE	V	133
R	-	CG	PRO	A	322	L	-	HE2	PHE	V	133
R	-	CG	PRO	A	322	L	-	HZ	PHE	V	133
R	-	CD	PRO	A	322	L	H	HB2	TRP	V	125
R	-	CD	PRO	A	322	L	-	CE2	PHE	V	133
R	-	CD	PRO	A	322	L	-	HE2	PHE	V	133
R	-	CD	PRO	A	322	L	-	HZ	PHE	V	133
R	-	OH	TYR	A	329	L	H	N	SER	V	5
R	-	OH	TYR	A	329	L	H	CA	SER	V	5
R	-	OH	TYR	A	329	L	H	CB	SER	V	5
R	-	OH	TYR	A	329	L	H	H	SER	V	5
R	-	OH	TYR	A	329	L	H	HA	SER	V	5
R	-	OH	TYR	A	329	L	H	HB2	SER	V	5
R	-	OH	TYR	A	329	L	H	HB3	SER	V	5
R	-	OH	TYR	A	329	L	H	HD13	ILE	V	8
R	-	CZ	TYR	A	329	L	H	HB3	SER	V	5
R	S	NH1	ARG	A	335	L	-	CE	MET	V	1
R	S	NH1	ARG	A	335	L	-	HE1	MET	V	1
R	S	NH1	ARG	A	335	L	-	HE3	MET	V	1
R	S	CZ	ARG	A	335	L	-	HE1	MET	V	1
R	S	CE1	TYR	A	337	L	-	SD	MET	V	1
R	S	CE2	TYR	A	337	L	-	SD	MET	V	1
R	S	OH	TYR	A	337	L	-	SD	MET	V	1
R	S	OH	TYR	A	337	L	-	CE	MET	V	1
R	S	OH	TYR	A	337	L	-	HE1	MET	V	1
R	S	OH	TYR	A	337	L	-	HE2	MET	V	1
R	S	CZ	TYR	A	337	L	-	SD	MET	V	1
R	S	CZ	TYR	A	337	L	-	HE1	MET	V	1
R	-	CB	ASN	A	348	L	-	HE2	LYS	V	228
R	-	CG	ASN	A	348	L	-	CE	LYS	V	228
R	-	CG	ASN	A	348	L	-	NZ	LYS	V	228
R	-	CG	ASN	A	348	L	-	HE2	LYS	V	228
R	-	CG	ASN	A	348	L	-	HE3	LYS	V	228
R	-	CG	ASN	A	348	L	-	HZ1	LYS	V	228
R	-	CG	ASN	A	348	L	-	HZ2	LYS	V	228
R	-	ND2	ASN	A	348	L	-	CD	LYS	V	228
R	-	ND2	ASN	A	348	L	-	CE	LYS	V	228
R	-	ND2	ASN	A	348	L	-	NZ	LYS	V	228
R	-	ND2	ASN	A	348	L	-	HD3	LYS	V	228
R	-	ND2	ASN	A	348	L	-	HE2	LYS	V	228
R	-	ND2	ASN	A	348	L	-	HE3	LYS	V	228
R	-	ND2	ASN	A	348	L	-	HZ1	LYS	V	228
R	-	ND2	ASN	A	348	L	-	HZ2	LYS	V	228
R	-	ND2	ASN	A	348	L	-	HZ3	LYS	V	228
R	-	OD1	ASN	A	348	L	-	CE	LYS	V	228
R	-	OD1	ASN	A	348	L	-	NZ	LYS	V	228
R	-	OD1	ASN	A	348	L	-	HD3	LYS	V	228
R	-	OD1	ASN	A	348	L	-	HE2	LYS	V	228
R	-	OD1	ASN	A	348	L	-	HZ1	LYS	V	228
R	-	OD1	ASN	A	348	L	-	HZ2	LYS	V	228
R	S	CG	PHE	A	354	L	-	HB3	MET	V	1
R	S	CD1	PHE	A	354	L	-	HB3	MET	V	1
R	S	CD1	PHE	A	354	L	-	HA	LYS	V	3
R	S	CD2	PHE	A	354	L	-	O	MET	V	1
R	S	CD2	PHE	A	354	L	-	HA	LYS	V	3
R	S	CD2	PHE	A	354	L	-	HG3	LYS	V	3
R	S	CE1	PHE	A	354	L	-	O	THR	V	2
R	S	CE1	PHE	A	354	L	-	CA	LYS	V	3
R	S	CE1	PHE	A	354	L	-	HA	LYS	V	3
R	S	CE1	PHE	A	354	L	H	H	THR	V	4
R	S	CE1	PHE	A	354	L	H	HG1	THR	V	4
R	S	CE1	PHE	A	354	L	H	HH22	ARG	V	69
R	S	CE2	PHE	A	354	L	-	O	MET	V	1
R	S	CE2	PHE	A	354	L	-	C	THR	V	2
R	S	CE2	PHE	A	354	L	-	O	THR	V	2
R	S	CE2	PHE	A	354	L	-	N	LYS	V	3
R	S	CE2	PHE	A	354	L	-	CA	LYS	V	3
R	S	CE2	PHE	A	354	L	-	CB	LYS	V	3
R	S	CE2	PHE	A	354	L	-	CG	LYS	V	3
R	S	CE2	PHE	A	354	L	-	H	LYS	V	3
R	S	CE2	PHE	A	354	L	-	HA	LYS	V	3
R	S	CE2	PHE	A	354	L	-	HB3	LYS	V	3
R	S	CE2	PHE	A	354	L	-	HG2	LYS	V	3
R	S	CE2	PHE	A	354	L	-	HG3	LYS	V	3
R	S	CZ	PHE	A	354	L	-	C	THR	V	2
R	S	CZ	PHE	A	354	L	-	O	THR	V	2
R	S	CZ	PHE	A	354	L	-	N	LYS	V	3
R	S	CZ	PHE	A	354	L	-	CA	LYS	V	3
R	S	CZ	PHE	A	354	L	-	C	LYS	V	3
R	S	CZ	PHE	A	354	L	-	CB	LYS	V	3
R	S	CZ	PHE	A	354	L	-	CG	LYS	V	3
R	S	CZ	PHE	A	354	L	-	H	LYS	V	3
R	S	CZ	PHE	A	354	L	-	HA	LYS	V	3
R	S	CZ	PHE	A	354	L	-	HB3	LYS	V	3
R	S	CZ	PHE	A	354	L	-	HG2	LYS	V	3
R	S	CZ	PHE	A	354	L	-	HG3	LYS	V	3
R	S	CZ	PHE	A	354	L	H	N	THR	V	4
R	S	CZ	PHE	A	354	L	H	H	THR	V	4
R	-	N	ASP	A	356	L	H	HG1	THR	V	4
R	-	CA	ASP	A	356	L	H	H	THR	V	4
R	-	CA	ASP	A	356	L	H	HB	THR	V	4
R	-	CA	ASP	A	356	L	H	HG1	THR	V	4
R	-	CB	ASP	A	356	L	H	N	THR	V	4
R	-	CB	ASP	A	356	L	H	CA	THR	V	4
R	-	CB	ASP	A	356	L	H	CB	THR	V	4
R	-	CB	ASP	A	356	L	H	CG2	THR	V	4
R	-	CB	ASP	A	356	L	H	OG1	THR	V	4
R	-	CB	ASP	A	356	L	H	H	THR	V	4
R	-	CB	ASP	A	356	L	H	HB	THR	V	4
R	-	CB	ASP	A	356	L	H	HG1	THR	V	4
R	-	CB	ASP	A	356	L	H	HG21	THR	V	4
R	-	CB	ASP	A	356	L	H	H	SER	V	5
R	-	CG	ASP	A	356	L	H	N	THR	V	4
R	-	CG	ASP	A	356	L	H	CA	THR	V	4
R	-	CG	ASP	A	356	L	H	C	THR	V	4
R	-	CG	ASP	A	356	L	H	CB	THR	V	4
R	-	CG	ASP	A	356	L	H	CG2	THR	V	4
R	-	CG	ASP	A	356	L	H	OG1	THR	V	4
R	-	CG	ASP	A	356	L	H	H	THR	V	4
R	-	CG	ASP	A	356	L	H	HB	THR	V	4
R	-	CG	ASP	A	356	L	H	HG1	THR	V	4
R	-	CG	ASP	A	356	L	H	HG21	THR	V	4
R	-	CG	ASP	A	356	L	H	HG23	THR	V	4
R	-	CG	ASP	A	356	L	H	N	SER	V	5
R	-	CG	ASP	A	356	L	H	H	SER	V	5
R	-	OD1	ASP	A	356	L	-	C	LYS	V	3
R	-	OD1	ASP	A	356	L	-	HB3	LYS	V	3
R	-	OD1	ASP	A	356	L	H	N	THR	V	4
R	-	OD1	ASP	A	356	L	H	CA	THR	V	4
R	-	OD1	ASP	A	356	L	H	C	THR	V	4
R	-	OD1	ASP	A	356	L	H	CB	THR	V	4
R	-	OD1	ASP	A	356	L	H	CG2	THR	V	4
R	-	OD1	ASP	A	356	L	H	OG1	THR	V	4
R	-	OD1	ASP	A	356	L	H	H	THR	V	4
R	-	OD1	ASP	A	356	L	H	HA	THR	V	4
R	-	OD1	ASP	A	356	L	H	HB	THR	V	4
R	-	OD1	ASP	A	356	L	H	HG1	THR	V	4
R	-	OD1	ASP	A	356	L	H	HG23	THR	V	4
R	-	OD1	ASP	A	356	L	H	N	SER	V	5
R	-	OD1	ASP	A	356	L	H	CA	SER	V	5
R	-	OD1	ASP	A	356	L	H	CB	SER	V	5
R	-	OD1	ASP	A	356	L	H	OG	SER	V	5
R	-	OD1	ASP	A	356	L	H	H	SER	V	5
R	-	OD1	ASP	A	356	L	H	HA	SER	V	5
R	-	OD1	ASP	A	356	L	H	HB3	SER	V	5
R	-	OD2	ASP	A	356	L	H	CA	THR	V	4
R	-	OD2	ASP	A	356	L	H	C	THR	V	4
R	-	OD2	ASP	A	356	L	H	CB	THR	V	4
R	-	OD2	ASP	A	356	L	H	CG2	THR	V	4
R	-	OD2	ASP	A	356	L	H	OG1	THR	V	4
R	-	OD2	ASP	A	356	L	H	H	THR	V	4
R	-	OD2	ASP	A	356	L	H	HB	THR	V	4
R	-	OD2	ASP	A	356	L	H	HG1	THR	V	4
R	-	OD2	ASP	A	356	L	H	HG21	THR	V	4
R	-	OD2	ASP	A	356	L	H	HG22	THR	V	4
R	-	OD2	ASP	A	356	L	H	HG23	THR	V	4
R	-	OD2	ASP	A	356	L	H	N	SER	V	5
R	-	OD2	ASP	A	356	L	H	H	SER	V	5
R	-	OD2	ASP	A	356	L	H	HD13	ILE	V	8
R	-	C	SER	A	357	L	H	HB3	SER	V	5
R	-	O	SER	A	357	L	H	OG	SER	V	5
R	-	O	SER	A	357	L	H	HB3	SER	V	5
R	-	O	SER	A	357	L	H	HG	SER	V	5
R	-	CB	ASN	A	358	L	H	HB3	SER	V	5
R	-	CA	PRO	A	360	L	-	HZ3	LYS	V	3
R	-	CB	PRO	A	360	L	-	NZ	LYS	V	3
R	-	CB	PRO	A	360	L	-	HZ1	LYS	V	3
R	-	CB	PRO	A	360	L	-	HZ2	LYS	V	3
R	-	CB	PRO	A	360	L	-	HZ3	LYS	V	3
R	-	CG	PRO	A	360	L	-	NZ	LYS	V	3
R	-	CG	PRO	A	360	L	-	HZ2	LYS	V	3
R	-	CG	PRO	A	360	L	-	HZ3	LYS	V	3
R	S	OH	TYR	A	363	L	-	HE3	LYS	V	3
R	-	NE2	GLN	A	376	L	-	HE3	LYS	V	3
R	S	CA	LYS	A	377	L	-	HH22	ARG	V	226
R	S	C	LYS	A	377	L	-	NH2	ARG	V	226
R	S	C	LYS	A	377	L	-	HH12	ARG	V	226
R	S	C	LYS	A	377	L	-	HH22	ARG	V	226
R	S	CB	LYS	A	377	L	-	NH2	ARG	V	226
R	S	CB	LYS	A	377	L	-	HH22	ARG	V	226
R	S	O	LYS	A	377	L	-	NH2	ARG	V	226
R	S	O	LYS	A	377	L	-	HH12	ARG	V	226
R	S	O	LYS	A	377	L	-	HH21	ARG	V	226
R	S	O	LYS	A	377	L	-	HH22	ARG	V	226
R	S	N	LEU	A	378	L	-	HH12	ARG	V	226
R	S	N	LEU	A	378	L	-	HH22	ARG	V	226
R	S	CA	LEU	A	378	L	-	NH1	ARG	V	226
R	S	CA	LEU	A	378	L	-	HH12	ARG	V	226
R	S	CA	LEU	A	378	L	-	HH22	ARG	V	226
R	S	C	LEU	A	378	L	-	NH1	ARG	V	226
R	S	C	LEU	A	378	L	-	HH11	ARG	V	226
R	S	C	LEU	A	378	L	-	HH12	ARG	V	226
R	S	C	LEU	A	378	L	-	HH22	ARG	V	226
R	S	O	LEU	A	378	L	-	NH1	ARG	V	226
R	S	O	LEU	A	378	L	-	HH12	ARG	V	226
R	S	N	PHE	A	379	L	-	NH1	ARG	V	226
R	S	N	PHE	A	379	L	-	NH2	ARG	V	226
R	S	N	PHE	A	379	L	-	CZ	ARG	V	226
R	S	N	PHE	A	379	L	-	HH11	ARG	V	226
R	S	N	PHE	A	379	L	-	HH12	ARG	V	226
R	S	N	PHE	A	379	L	-	HH22	ARG	V	226
R	S	CA	PHE	A	379	L	-	NH1	ARG	V	226
R	S	CA	PHE	A	379	L	-	CZ	ARG	V	226
R	S	CA	PHE	A	379	L	-	HH11	ARG	V	226
R	S	CA	PHE	A	379	L	-	HH12	ARG	V	226
R	S	C	PHE	A	379	L	-	NH1	ARG	V	226
R	S	C	PHE	A	379	L	-	HH11	ARG	V	226
R	S	C	PHE	A	379	L	-	HH12	ARG	V	226
R	S	CB	PHE	A	379	L	-	CD	ARG	V	226
R	S	CB	PHE	A	379	L	-	NE	ARG	V	226
R	S	CB	PHE	A	379	L	-	NH1	ARG	V	226
R	S	CB	PHE	A	379	L	-	NH2	ARG	V	226
R	S	CB	PHE	A	379	L	-	CZ	ARG	V	226
R	S	CB	PHE	A	379	L	-	HD2	ARG	V	226
R	S	CB	PHE	A	379	L	-	HD3	ARG	V	226
R	S	CB	PHE	A	379	L	-	HH11	ARG	V	226
R	S	CB	PHE	A	379	L	-	HH12	ARG	V	226
R	S	CG	PHE	A	379	L	-	CD	ARG	V	226
R	S	CG	PHE	A	379	L	-	NH1	ARG	V	226
R	S	CG	PHE	A	379	L	-	HD2	ARG	V	226
R	S	CG	PHE	A	379	L	-	HD3	ARG	V	226
R	S	CG	PHE	A	379	L	-	HH11	ARG	V	226
R	S	CG	PHE	A	379	L	-	HH12	ARG	V	226
R	S	CD1	PHE	A	379	L	-	CD	ARG	V	226
R	S	CD1	PHE	A	379	L	-	HB3	ARG	V	226
R	S	CD1	PHE	A	379	L	-	HD2	ARG	V	226
R	S	CD1	PHE	A	379	L	-	HD3	ARG	V	226
R	S	CD1	PHE	A	379	L	-	HH11	ARG	V	226
R	S	CD2	PHE	A	379	L	-	HD2	ARG	V	226
R	S	CD2	PHE	A	379	L	-	HD3	ARG	V	226
R	S	CD2	PHE	A	379	L	-	HH11	ARG	V	226
R	S	CE1	PHE	A	379	L	-	HB3	ARG	V	226
R	S	CE1	PHE	A	379	L	-	HD2	ARG	V	226
R	S	CE1	PHE	A	379	L	-	HA	LYS	V	228
R	S	CE1	PHE	A	379	L	-	HG2	LYS	V	228
R	S	CE2	PHE	A	379	L	-	HG2	LYS	V	228
R	S	CZ	PHE	A	379	L	-	CG	LYS	V	228
R	S	CZ	PHE	A	379	L	-	HA	LYS	V	228
R	S	CZ	PHE	A	379	L	-	HG2	LYS	V	228
R	S	CZ	PHE	A	379	L	-	HE2	LYS	V	228
R	-	CB	PRO	A	381	L	-	HB3	LYS	V	228
R	-	CB	PRO	A	381	L	-	HG2	LYS	V	228
R	-	CB	PRO	A	381	L	-	HD3	LYS	V	228
R	-	CG	PRO	A	381	L	-	O	ARG	V	229
R	-	NE2	GLN	A	382	L	-	HZ2	LYS	V	228

- 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