IID

A6NI03_P61086.1 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	H	MET	A	218	L	-	GLU	V	34
R	H	HIS	A	221	L	-	GLU	V	34
R	H	LEU	A	222	L	-	ASN	V	35
R	H	MET	A	225	L	-	VAL	V	32
R	H	MET	A	225	L	-	ASP	V	33
R	H	MET	A	225	L	-	GLU	V	34
R	H	LYS	A	226	L	-	ASN	V	35
R	H	MET	A	228	L	-	VAL	V	32
R	H	TYR	A	229	L	-	THR	V	37
R	H	TYR	A	229	L	S	GLU	V	38
R	H	TYR	A	229	L	S	LYS	V	61
R	H	TYR	A	229	L	S	LYS	V	72
R	H	LEU	A	232	L	S	GLU	V	38
R	H	LEU	A	232	L	S	GLU	V	59
R	H	LEU	A	232	L	S	LYS	V	61
R	H	TRP	A	233	L	S	LYS	V	61
R	H	TRP	A	233	L	S	LYS	V	72
R	H	CYS	A	236	L	S	GLU	V	59
R	H	CYS	A	236	L	S	LYS	V	61
R	H	CYS	A	236	L	S	ARG	V	74
R	H	ASP	A	240	L	-	VAL	V	87
R	H	ASP	A	240	L	-	THR	V	88
R	H	LEU	A	243	L	-	THR	V	88
R	H	LEU	A	244	L	-	LYS	V	78
R	H	LEU	A	244	L	-	VAL	V	87
R	H	ARG	A	248	L	H	ASN	V	177
R	H	SER	A	251	L	S	ARG	V	40
R	H	THR	A	254	L	S	ARG	V	40
R	H	ASP	A	255	L	S	ARG	V	40
R	H	GLN	A	258	L	S	ASP	V	30
R	H	GLN	A	258	L	S	LEU	V	31
R	H	GLN	A	258	L	-	VAL	V	32
R	-	LYS	A	261	L	S	LEU	V	31
R	-	LYS	A	261	L	-	GLU	V	34
R	-	PRO	A	262	L	-	GLU	V	34
R	H	ASP	A	312	L	H	GLN	V	7
R	H	ASP	A	313	L	H	LYS	V	10
R	H	ASP	A	313	L	H	LYS	V	14
R	H	ASP	A	313	L	H	GLN	V	7
R	H	HIS	A	314	L	H	LYS	V	14
R	-	SER	A	316	L	H	ARG	V	11
R	-	SER	A	316	L	H	GLN	V	7
R	-	ALA	A	317	L	H	ARG	V	11
R	-	PRO	A	318	L	H	ARG	V	11

- 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

A6NI03_P61086.1 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	H	CG	MET	A	218	L	-	OE2	GLU	V	34
R	H	CD2	HIS	A	221	L	-	CG	GLU	V	34
R	H	CD2	HIS	A	221	L	-	CD	GLU	V	34
R	H	CD2	HIS	A	221	L	-	OE1	GLU	V	34
R	H	CD2	HIS	A	221	L	-	OE2	GLU	V	34
R	H	CD2	HIS	A	221	L	-	H	GLU	V	34
R	H	CD2	HIS	A	221	L	-	HB2	GLU	V	34
R	H	CD2	HIS	A	221	L	-	HG3	GLU	V	34
R	H	NE2	HIS	A	221	L	-	CG	GLU	V	34
R	H	NE2	HIS	A	221	L	-	H	GLU	V	34
R	H	NE2	HIS	A	221	L	-	HG3	GLU	V	34
R	H	CB	LEU	A	222	L	-	HB3	ASN	V	35
R	H	O	LEU	A	222	L	-	HD21	ASN	V	35
R	H	CG	LEU	A	222	L	-	CB	ASN	V	35
R	H	CG	LEU	A	222	L	-	HB3	ASN	V	35
R	H	CG	LEU	A	222	L	-	HD21	ASN	V	35
R	H	CD1	LEU	A	222	L	-	N	ASN	V	35
R	H	CD1	LEU	A	222	L	-	CA	ASN	V	35
R	H	CD1	LEU	A	222	L	-	CB	ASN	V	35
R	H	CD1	LEU	A	222	L	-	CG	ASN	V	35
R	H	CD1	LEU	A	222	L	-	ND2	ASN	V	35
R	H	CD1	LEU	A	222	L	-	H	ASN	V	35
R	H	CD1	LEU	A	222	L	-	HA	ASN	V	35
R	H	CD1	LEU	A	222	L	-	HB2	ASN	V	35
R	H	CD1	LEU	A	222	L	-	HB3	ASN	V	35
R	H	CD1	LEU	A	222	L	-	HD21	ASN	V	35
R	H	CD2	LEU	A	222	L	-	HB3	ASN	V	35
R	H	CB	MET	A	225	L	-	CB	ASP	V	33
R	H	CB	MET	A	225	L	-	HB2	ASP	V	33
R	H	CB	MET	A	225	L	-	HB3	ASP	V	33
R	H	CG	MET	A	225	L	-	CA	ASP	V	33
R	H	CG	MET	A	225	L	-	CB	ASP	V	33
R	H	CG	MET	A	225	L	-	HA	ASP	V	33
R	H	CG	MET	A	225	L	-	HB2	ASP	V	33
R	H	CG	MET	A	225	L	-	HB3	ASP	V	33
R	H	CG	MET	A	225	L	-	H	GLU	V	34
R	H	SD	MET	A	225	L	-	O	VAL	V	32
R	H	SD	MET	A	225	L	-	CB	ASP	V	33
R	H	SD	MET	A	225	L	-	HA	ASP	V	33
R	H	SD	MET	A	225	L	-	HB2	ASP	V	33
R	H	SD	MET	A	225	L	-	HB3	ASP	V	33
R	H	N	LYS	A	226	L	-	HD22	ASN	V	35
R	H	CG	LYS	A	226	L	-	ND2	ASN	V	35
R	H	CG	LYS	A	226	L	-	HD21	ASN	V	35
R	H	CG	LYS	A	226	L	-	HD22	ASN	V	35
R	H	CD	LYS	A	226	L	-	HD21	ASN	V	35
R	H	CE	LYS	A	226	L	-	HD21	ASN	V	35
R	H	CE	MET	A	228	L	-	HG11	VAL	V	32
R	H	CA	TYR	A	229	L	S	OE2	GLU	V	38
R	H	CA	TYR	A	229	L	S	HE3	LYS	V	61
R	H	C	TYR	A	229	L	S	HE3	LYS	V	61
R	H	CB	TYR	A	229	L	S	OE2	GLU	V	38
R	H	O	TYR	A	229	L	S	CE	LYS	V	61
R	H	O	TYR	A	229	L	S	NZ	LYS	V	61
R	H	O	TYR	A	229	L	S	HE3	LYS	V	61
R	H	O	TYR	A	229	L	S	HZ2	LYS	V	61
R	H	O	TYR	A	229	L	S	HZ3	LYS	V	61
R	H	CG	TYR	A	229	L	S	HB2	GLU	V	38
R	H	CG	TYR	A	229	L	S	HD3	LYS	V	61
R	H	CG	TYR	A	229	L	S	HE3	LYS	V	61
R	H	CD1	TYR	A	229	L	S	HD3	LYS	V	61
R	H	CD2	TYR	A	229	L	-	O	THR	V	37
R	H	CD2	TYR	A	229	L	-	HB	THR	V	37
R	H	CD2	TYR	A	229	L	S	CB	GLU	V	38
R	H	CD2	TYR	A	229	L	S	OE2	GLU	V	38
R	H	CD2	TYR	A	229	L	S	HB2	GLU	V	38
R	H	CD2	TYR	A	229	L	S	CG	LYS	V	61
R	H	CD2	TYR	A	229	L	S	CD	LYS	V	61
R	H	CD2	TYR	A	229	L	S	CE	LYS	V	61
R	H	CD2	TYR	A	229	L	S	HB3	LYS	V	61
R	H	CD2	TYR	A	229	L	S	HG2	LYS	V	61
R	H	CD2	TYR	A	229	L	S	HD3	LYS	V	61
R	H	CD2	TYR	A	229	L	S	HE3	LYS	V	61
R	H	CE1	TYR	A	229	L	S	HB3	LYS	V	61
R	H	CE1	TYR	A	229	L	S	HD3	LYS	V	61
R	H	CE2	TYR	A	229	L	-	O	THR	V	37
R	H	CE2	TYR	A	229	L	-	HB	THR	V	37
R	H	CE2	TYR	A	229	L	S	HB2	GLU	V	38
R	H	CE2	TYR	A	229	L	S	CA	LYS	V	61
R	H	CE2	TYR	A	229	L	S	CB	LYS	V	61
R	H	CE2	TYR	A	229	L	S	CG	LYS	V	61
R	H	CE2	TYR	A	229	L	S	CD	LYS	V	61
R	H	CE2	TYR	A	229	L	S	CE	LYS	V	61
R	H	CE2	TYR	A	229	L	S	HA	LYS	V	61
R	H	CE2	TYR	A	229	L	S	HB2	LYS	V	61
R	H	CE2	TYR	A	229	L	S	HB3	LYS	V	61
R	H	CE2	TYR	A	229	L	S	HG2	LYS	V	61
R	H	CE2	TYR	A	229	L	S	HG3	LYS	V	61
R	H	CE2	TYR	A	229	L	S	HD2	LYS	V	61
R	H	CE2	TYR	A	229	L	S	HD3	LYS	V	61
R	H	CE2	TYR	A	229	L	S	HE3	LYS	V	61
R	H	OH	TYR	A	229	L	S	CA	LYS	V	61
R	H	OH	TYR	A	229	L	S	CB	LYS	V	61
R	H	OH	TYR	A	229	L	S	CG	LYS	V	61
R	H	OH	TYR	A	229	L	S	CD	LYS	V	61
R	H	OH	TYR	A	229	L	S	HB2	LYS	V	61
R	H	OH	TYR	A	229	L	S	HB3	LYS	V	61
R	H	OH	TYR	A	229	L	S	HG2	LYS	V	61
R	H	OH	TYR	A	229	L	S	HD3	LYS	V	61
R	H	OH	TYR	A	229	L	S	HD2	LYS	V	72
R	H	CZ	TYR	A	229	L	S	CB	LYS	V	61
R	H	CZ	TYR	A	229	L	S	CG	LYS	V	61
R	H	CZ	TYR	A	229	L	S	CD	LYS	V	61
R	H	CZ	TYR	A	229	L	S	HB2	LYS	V	61
R	H	CZ	TYR	A	229	L	S	HB3	LYS	V	61
R	H	CZ	TYR	A	229	L	S	HG2	LYS	V	61
R	H	CZ	TYR	A	229	L	S	HD3	LYS	V	61
R	H	CZ	TYR	A	229	L	S	HE3	LYS	V	61
R	H	N	LEU	A	232	L	S	HZ3	LYS	V	61
R	H	CA	LEU	A	232	L	S	NZ	LYS	V	61
R	H	CA	LEU	A	232	L	S	HZ1	LYS	V	61
R	H	CA	LEU	A	232	L	S	HZ2	LYS	V	61
R	H	CA	LEU	A	232	L	S	HZ3	LYS	V	61
R	H	C	LEU	A	232	L	S	NZ	LYS	V	61
R	H	C	LEU	A	232	L	S	HZ1	LYS	V	61
R	H	C	LEU	A	232	L	S	HZ2	LYS	V	61
R	H	C	LEU	A	232	L	S	HZ3	LYS	V	61
R	H	CB	LEU	A	232	L	S	CE	LYS	V	61
R	H	CB	LEU	A	232	L	S	NZ	LYS	V	61
R	H	CB	LEU	A	232	L	S	HE2	LYS	V	61
R	H	CB	LEU	A	232	L	S	HE3	LYS	V	61
R	H	CB	LEU	A	232	L	S	HZ1	LYS	V	61
R	H	CB	LEU	A	232	L	S	HZ2	LYS	V	61
R	H	CB	LEU	A	232	L	S	HZ3	LYS	V	61
R	H	O	LEU	A	232	L	S	NZ	LYS	V	61
R	H	O	LEU	A	232	L	S	HZ1	LYS	V	61
R	H	O	LEU	A	232	L	S	HZ2	LYS	V	61
R	H	O	LEU	A	232	L	S	HZ3	LYS	V	61
R	H	CG	LEU	A	232	L	S	OE1	GLU	V	38
R	H	CG	LEU	A	232	L	S	NZ	LYS	V	61
R	H	CG	LEU	A	232	L	S	HZ3	LYS	V	61
R	H	CD1	LEU	A	232	L	S	CD	GLU	V	38
R	H	CD1	LEU	A	232	L	S	OE1	GLU	V	38
R	H	CD1	LEU	A	232	L	S	OE2	GLU	V	38
R	H	CD1	LEU	A	232	L	S	HE2	LYS	V	61
R	H	CD1	LEU	A	232	L	S	HE3	LYS	V	61
R	H	CD1	LEU	A	232	L	S	HZ3	LYS	V	61
R	H	CD2	LEU	A	232	L	S	OE1	GLU	V	59
R	H	CD2	LEU	A	232	L	S	HZ3	LYS	V	61
R	H	N	TRP	A	233	L	S	NZ	LYS	V	61
R	H	N	TRP	A	233	L	S	HZ1	LYS	V	61
R	H	N	TRP	A	233	L	S	HZ2	LYS	V	61
R	H	N	TRP	A	233	L	S	HZ3	LYS	V	61
R	H	CA	TRP	A	233	L	S	NZ	LYS	V	61
R	H	CA	TRP	A	233	L	S	HZ2	LYS	V	61
R	H	CA	TRP	A	233	L	S	HZ3	LYS	V	61
R	H	CB	TRP	A	233	L	S	HZ2	LYS	V	61
R	H	CD1	TRP	A	233	L	S	NZ	LYS	V	72
R	H	CD1	TRP	A	233	L	S	HZ2	LYS	V	72
R	H	CD1	TRP	A	233	L	S	HZ3	LYS	V	72
R	H	CE2	TRP	A	233	L	S	HZ2	LYS	V	72
R	H	CE2	TRP	A	233	L	S	HZ3	LYS	V	72
R	H	NE1	TRP	A	233	L	S	NZ	LYS	V	72
R	H	NE1	TRP	A	233	L	S	HZ1	LYS	V	72
R	H	NE1	TRP	A	233	L	S	HZ2	LYS	V	72
R	H	NE1	TRP	A	233	L	S	HZ3	LYS	V	72
R	H	SG	CYS	A	236	L	S	OE2	GLU	V	59
R	H	SG	CYS	A	236	L	S	HZ1	LYS	V	61
R	H	SG	CYS	A	236	L	S	CD	ARG	V	74
R	H	SG	CYS	A	236	L	S	NE	ARG	V	74
R	H	SG	CYS	A	236	L	S	HD3	ARG	V	74
R	H	SG	CYS	A	236	L	S	HE	ARG	V	74
R	H	CA	ASP	A	240	L	-	HG12	VAL	V	87
R	H	CB	ASP	A	240	L	-	CG1	VAL	V	87
R	H	CB	ASP	A	240	L	-	HG12	VAL	V	87
R	H	CG	ASP	A	240	L	-	CG1	VAL	V	87
R	H	CG	ASP	A	240	L	-	HG12	VAL	V	87
R	H	OD1	ASP	A	240	L	-	HG12	VAL	V	87
R	H	OD1	ASP	A	240	L	-	CG2	THR	V	88
R	H	OD1	ASP	A	240	L	-	HG21	THR	V	88
R	H	OD1	ASP	A	240	L	-	HG22	THR	V	88
R	H	OD1	ASP	A	240	L	-	HG23	THR	V	88
R	H	OD2	ASP	A	240	L	-	HG12	VAL	V	87
R	H	OD2	ASP	A	240	L	-	HG23	VAL	V	87
R	H	CG	LEU	A	243	L	-	HG23	THR	V	88
R	H	CD2	LEU	A	243	L	-	CG2	THR	V	88
R	H	CD2	LEU	A	243	L	-	HA	THR	V	88
R	H	CD2	LEU	A	243	L	-	HB	THR	V	88
R	H	CD2	LEU	A	243	L	-	HG21	THR	V	88
R	H	CD2	LEU	A	243	L	-	HG23	THR	V	88
R	H	CG	LEU	A	244	L	-	HG13	VAL	V	87
R	H	CD1	LEU	A	244	L	-	HG13	VAL	V	87
R	H	CD2	LEU	A	244	L	-	HE2	LYS	V	78
R	H	CD2	LEU	A	244	L	-	HZ1	LYS	V	78
R	H	CD2	LEU	A	244	L	-	HG13	VAL	V	87
R	H	NH2	ARG	A	248	L	H	ND2	ASN	V	177
R	H	NH2	ARG	A	248	L	H	HD21	ASN	V	177
R	H	NH2	ARG	A	248	L	H	HD22	ASN	V	177
R	H	OG	SER	A	251	L	S	HH22	ARG	V	40
R	H	CB	THR	A	254	L	S	HH21	ARG	V	40
R	H	OG1	THR	A	254	L	S	NH2	ARG	V	40
R	H	OG1	THR	A	254	L	S	HH21	ARG	V	40
R	H	OG1	THR	A	254	L	S	HH22	ARG	V	40
R	H	OD1	ASP	A	255	L	S	NH1	ARG	V	40
R	H	OD1	ASP	A	255	L	S	NH2	ARG	V	40
R	H	OD1	ASP	A	255	L	S	HH12	ARG	V	40
R	H	OD1	ASP	A	255	L	S	HH22	ARG	V	40
R	H	CG	GLN	A	258	L	-	HA	VAL	V	32
R	H	CD	GLN	A	258	L	S	O	LEU	V	31
R	H	CD	GLN	A	258	L	-	HA	VAL	V	32
R	H	NE2	GLN	A	258	L	S	HB3	ASP	V	30
R	H	NE2	GLN	A	258	L	S	O	LEU	V	31
R	H	NE2	GLN	A	258	L	-	HA	VAL	V	32
R	-	CG	LYS	A	261	L	-	OE1	GLU	V	34
R	-	CG	LYS	A	261	L	-	HG2	GLU	V	34
R	-	CG	LYS	A	261	L	-	HG3	GLU	V	34
R	-	CD	LYS	A	261	L	-	HG2	GLU	V	34
R	-	CE	LYS	A	261	L	-	CG	GLU	V	34
R	-	CE	LYS	A	261	L	-	HG2	GLU	V	34
R	-	NZ	LYS	A	261	L	S	HB2	LEU	V	31
R	-	NZ	LYS	A	261	L	S	HD11	LEU	V	31
R	-	NZ	LYS	A	261	L	S	HD13	LEU	V	31
R	-	NZ	LYS	A	261	L	-	HG2	GLU	V	34
R	-	N	PRO	A	262	L	-	OE1	GLU	V	34
R	-	CA	PRO	A	262	L	-	OE1	GLU	V	34
R	-	C	PRO	A	262	L	-	OE1	GLU	V	34
R	-	CB	PRO	A	262	L	-	OE1	GLU	V	34
R	-	O	PRO	A	262	L	-	OE1	GLU	V	34
R	-	CG	PRO	A	262	L	-	CD	GLU	V	34
R	-	CG	PRO	A	262	L	-	OE1	GLU	V	34
R	-	CG	PRO	A	262	L	-	OE2	GLU	V	34
R	-	CD	PRO	A	262	L	-	CD	GLU	V	34
R	-	CD	PRO	A	262	L	-	OE1	GLU	V	34
R	H	C	ASP	A	312	L	H	HE22	GLN	V	7
R	H	CB	ASP	A	312	L	H	HE22	GLN	V	7
R	H	O	ASP	A	312	L	H	NE2	GLN	V	7
R	H	O	ASP	A	312	L	H	OE1	GLN	V	7
R	H	O	ASP	A	312	L	H	HE22	GLN	V	7
R	H	N	ASP	A	313	L	H	HE22	GLN	V	7
R	H	CA	ASP	A	313	L	H	OE1	GLN	V	7
R	H	CA	ASP	A	313	L	H	HE22	GLN	V	7
R	H	C	ASP	A	313	L	H	OE1	GLN	V	7
R	H	CB	ASP	A	313	L	H	HD3	LYS	V	10
R	H	O	ASP	A	313	L	H	OE1	GLN	V	7
R	H	O	ASP	A	313	L	H	HZ2	LYS	V	14
R	H	CG	ASP	A	313	L	H	NZ	LYS	V	10
R	H	CG	ASP	A	313	L	H	HD3	LYS	V	10
R	H	CG	ASP	A	313	L	H	HZ2	LYS	V	10
R	H	CG	ASP	A	313	L	H	HZ3	LYS	V	10
R	H	OD1	ASP	A	313	L	H	HE22	GLN	V	7
R	H	OD1	ASP	A	313	L	H	CD	LYS	V	10
R	H	OD1	ASP	A	313	L	H	CE	LYS	V	10
R	H	OD1	ASP	A	313	L	H	NZ	LYS	V	10
R	H	OD1	ASP	A	313	L	H	HD2	LYS	V	10
R	H	OD1	ASP	A	313	L	H	HD3	LYS	V	10
R	H	OD1	ASP	A	313	L	H	HZ1	LYS	V	10
R	H	OD1	ASP	A	313	L	H	HZ2	LYS	V	10
R	H	OD1	ASP	A	313	L	H	HZ3	LYS	V	10
R	H	OD2	ASP	A	313	L	H	HZ3	LYS	V	10
R	H	ND1	HIS	A	314	L	H	HZ2	LYS	V	14
R	H	ND1	HIS	A	314	L	H	HZ3	LYS	V	14
R	H	CE1	HIS	A	314	L	H	NZ	LYS	V	14
R	H	CE1	HIS	A	314	L	H	HZ1	LYS	V	14
R	H	CE1	HIS	A	314	L	H	HZ2	LYS	V	14
R	H	CE1	HIS	A	314	L	H	HZ3	LYS	V	14
R	H	NE2	HIS	A	314	L	H	NZ	LYS	V	14
R	H	NE2	HIS	A	314	L	H	HZ1	LYS	V	14
R	H	NE2	HIS	A	314	L	H	HZ2	LYS	V	14
R	H	NE2	HIS	A	314	L	H	HZ3	LYS	V	14
R	-	CA	SER	A	316	L	H	HH11	ARG	V	11
R	-	C	SER	A	316	L	H	HD2	ARG	V	11
R	-	C	SER	A	316	L	H	HH11	ARG	V	11
R	-	CB	SER	A	316	L	H	HB2	GLN	V	7
R	-	CB	SER	A	316	L	H	HD2	ARG	V	11
R	-	CB	SER	A	316	L	H	HH11	ARG	V	11
R	-	O	SER	A	316	L	H	CD	ARG	V	11
R	-	O	SER	A	316	L	H	NH1	ARG	V	11
R	-	O	SER	A	316	L	H	HD2	ARG	V	11
R	-	O	SER	A	316	L	H	HD3	ARG	V	11
R	-	O	SER	A	316	L	H	HH11	ARG	V	11
R	-	O	SER	A	316	L	H	HH12	ARG	V	11
R	-	OG	SER	A	316	L	H	CB	GLN	V	7
R	-	OG	SER	A	316	L	H	O	GLN	V	7
R	-	OG	SER	A	316	L	H	CD	GLN	V	7
R	-	OG	SER	A	316	L	H	OE1	GLN	V	7
R	-	OG	SER	A	316	L	H	HB2	GLN	V	7
R	-	OG	SER	A	316	L	H	HB2	ARG	V	11
R	-	N	ALA	A	317	L	H	HD2	ARG	V	11
R	-	CD	PRO	A	318	L	H	HD3	ARG	V	11

- 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