IID

A6NND4_Q9NYW2.1 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	ILE	A	140	L	-	ASP	V	313
R	H	ILE	A	140	L	-	GLY	V	315
R	H	LEU	A	143	L	-	GLY	V	315
R	H	LEU	A	143	L	-	ARG	V	318
R	H	VAL	A	144	L	-	PRO	V	314
R	-	PRO	A	178	L	H	LEU	V	77
R	-	PHE	A	180	L	H	ALA	V	48
R	-	PHE	A	180	L	H	VAL	V	52
R	-	LEU	A	185	L	H	VAL	V	52
R	H	LEU	A	188	L	H	MET	V	45
R	H	LEU	A	188	L	H	ALA	V	48
R	H	LEU	A	188	L	H	LEU	V	49
R	H	LEU	A	188	L	H	VAL	V	52
R	H	PHE	A	189	L	H	ILE	V	309
R	H	PHE	A	189	L	-	GLN	V	312
R	H	PHE	A	189	L	-	PRO	V	314
R	H	ILE	A	191	L	H	MET	V	310
R	H	ILE	A	191	L	H	LEU	V	49
R	H	VAL	A	192	L	H	MET	V	310
R	H	ILE	A	195	L	H	MET	V	310
R	H	PHE	A	245	L	H	LEU	V	38
R	H	TYR	A	248	L	H	MET	V	45
R	H	ILE	A	249	L	H	LEU	V	38
R	H	ILE	A	249	L	H	LEU	V	41
R	H	ILE	A	252	L	H	LEU	V	41
R	H	ILE	A	252	L	H	MET	V	45
R	H	LEU	A	253	L	H	LEU	V	37
R	H	LEU	A	253	L	H	LEU	V	41
R	-	PHE	A	256	L	H	LEU	V	44
R	-	PHE	A	256	L	H	MET	V	45
R	-	PHE	A	256	L	H	ALA	V	48
R	H	LEU	A	259	L	H	TYR	V	40
R	H	LEU	A	259	L	H	LEU	V	44
R	H	LEU	A	259	L	H	ILE	V	76
R	H	LEU	A	259	L	H	THR	V	80
R	-	MET	A	260	L	H	TYR	V	40
R	-	LYS	A	262	L	H	SER	V	88
R	-	LYS	A	262	L	H	LEU	V	92
R	-	LYS	A	262	L	-	ASP	V	94
R	H	LEU	A	265	L	H	LEU	V	92
R	H	PHE	A	269	L	H	PHE	V	33
R	H	PHE	A	269	L	H	PHE	V	34
R	H	PHE	A	269	L	H	LEU	V	37
R	H	TYR	A	94	L	-	PRO	V	314
R	H	TRP	A	98	L	-	ASP	V	313
R	H	TRP	A	98	L	-	PRO	V	314

- 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

A6NND4_Q9NYW2.1 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	CE1	TYR	A	94	L	-	HG2	PRO	V	314
R	H	OH	TYR	A	94	L	-	HG2	PRO	V	314
R	H	CE2	TRP	A	98	L	-	OD1	ASP	V	313
R	H	CH2	TRP	A	98	L	-	CG	ASP	V	313
R	H	CH2	TRP	A	98	L	-	OD1	ASP	V	313
R	H	CH2	TRP	A	98	L	-	OD2	ASP	V	313
R	H	CZ2	TRP	A	98	L	-	CG	ASP	V	313
R	H	CZ2	TRP	A	98	L	-	OD1	ASP	V	313
R	H	CZ2	TRP	A	98	L	-	HD3	PRO	V	314
R	H	CZ3	TRP	A	98	L	-	OD1	ASP	V	313
R	H	CA	ILE	A	140	L	-	HA3	GLY	V	315
R	H	CB	ILE	A	140	L	-	HA3	GLY	V	315
R	H	CG1	ILE	A	140	L	-	CA	GLY	V	315
R	H	CG1	ILE	A	140	L	-	HA3	GLY	V	315
R	H	CG2	ILE	A	140	L	-	N	GLY	V	315
R	H	CG2	ILE	A	140	L	-	CA	GLY	V	315
R	H	CG2	ILE	A	140	L	-	H	GLY	V	315
R	H	CG2	ILE	A	140	L	-	HA3	GLY	V	315
R	H	CD1	ILE	A	140	L	-	OD2	ASP	V	313
R	H	CD1	ILE	A	140	L	-	HA3	GLY	V	315
R	H	CG	LEU	A	143	L	-	HA2	GLY	V	315
R	H	CD1	LEU	A	143	L	-	HD3	ARG	V	318
R	H	CD2	LEU	A	143	L	-	CA	GLY	V	315
R	H	CD2	LEU	A	143	L	-	O	GLY	V	315
R	H	CD2	LEU	A	143	L	-	HA2	GLY	V	315
R	H	CB	VAL	A	144	L	-	HB2	PRO	V	314
R	H	CG2	VAL	A	144	L	-	CB	PRO	V	314
R	H	CG2	VAL	A	144	L	-	O	PRO	V	314
R	H	CG2	VAL	A	144	L	-	HB2	PRO	V	314
R	H	CG2	VAL	A	144	L	-	HB3	PRO	V	314
R	-	CG	PRO	A	178	L	H	CD2	LEU	V	77
R	-	CG	PRO	A	178	L	H	HD22	LEU	V	77
R	-	CD	PRO	A	178	L	H	HD22	LEU	V	77
R	-	CG	PHE	A	180	L	H	HG21	VAL	V	52
R	-	CG	PHE	A	180	L	H	HG22	VAL	V	52
R	-	CD1	PHE	A	180	L	H	CG2	VAL	V	52
R	-	CD1	PHE	A	180	L	H	HG21	VAL	V	52
R	-	CD1	PHE	A	180	L	H	HG22	VAL	V	52
R	-	CD1	PHE	A	180	L	H	HG23	VAL	V	52
R	-	CD2	PHE	A	180	L	H	CB	ALA	V	48
R	-	CD2	PHE	A	180	L	H	HA	ALA	V	48
R	-	CD2	PHE	A	180	L	H	HB1	ALA	V	48
R	-	CD2	PHE	A	180	L	H	CG2	VAL	V	52
R	-	CD2	PHE	A	180	L	H	HG21	VAL	V	52
R	-	CD2	PHE	A	180	L	H	HG22	VAL	V	52
R	-	CD2	PHE	A	180	L	H	HG23	VAL	V	52
R	-	CE1	PHE	A	180	L	H	CG2	VAL	V	52
R	-	CE1	PHE	A	180	L	H	HG21	VAL	V	52
R	-	CE1	PHE	A	180	L	H	HG22	VAL	V	52
R	-	CE1	PHE	A	180	L	H	HG23	VAL	V	52
R	-	CE2	PHE	A	180	L	H	CB	ALA	V	48
R	-	CE2	PHE	A	180	L	H	O	ALA	V	48
R	-	CE2	PHE	A	180	L	H	HB1	ALA	V	48
R	-	CE2	PHE	A	180	L	H	HB3	ALA	V	48
R	-	CE2	PHE	A	180	L	H	CG2	VAL	V	52
R	-	CE2	PHE	A	180	L	H	HG21	VAL	V	52
R	-	CE2	PHE	A	180	L	H	HG22	VAL	V	52
R	-	CE2	PHE	A	180	L	H	HG23	VAL	V	52
R	-	CZ	PHE	A	180	L	H	HB1	ALA	V	48
R	-	CZ	PHE	A	180	L	H	CG2	VAL	V	52
R	-	CZ	PHE	A	180	L	H	HG21	VAL	V	52
R	-	CZ	PHE	A	180	L	H	HG22	VAL	V	52
R	-	CZ	PHE	A	180	L	H	HG23	VAL	V	52
R	-	CG	LEU	A	185	L	H	CG2	VAL	V	52
R	-	CG	LEU	A	185	L	H	HG12	VAL	V	52
R	-	CG	LEU	A	185	L	H	HG13	VAL	V	52
R	-	CG	LEU	A	185	L	H	HG22	VAL	V	52
R	-	CG	LEU	A	185	L	H	HG23	VAL	V	52
R	-	CD1	LEU	A	185	L	H	HG13	VAL	V	52
R	-	CD1	LEU	A	185	L	H	HG22	VAL	V	52
R	-	CD2	LEU	A	185	L	H	CB	VAL	V	52
R	-	CD2	LEU	A	185	L	H	CG1	VAL	V	52
R	-	CD2	LEU	A	185	L	H	CG2	VAL	V	52
R	-	CD2	LEU	A	185	L	H	HG11	VAL	V	52
R	-	CD2	LEU	A	185	L	H	HG12	VAL	V	52
R	-	CD2	LEU	A	185	L	H	HG13	VAL	V	52
R	-	CD2	LEU	A	185	L	H	HG21	VAL	V	52
R	-	CD2	LEU	A	185	L	H	HG22	VAL	V	52
R	-	CD2	LEU	A	185	L	H	HG23	VAL	V	52
R	H	CD1	LEU	A	188	L	H	HB1	ALA	V	48
R	H	CD1	LEU	A	188	L	H	HB2	ALA	V	48
R	H	CD1	LEU	A	188	L	H	HA	LEU	V	49
R	H	CD1	LEU	A	188	L	H	HG23	VAL	V	52
R	H	CD2	LEU	A	188	L	H	HA	MET	V	45
R	H	CD2	LEU	A	188	L	H	HG2	MET	V	45
R	H	CB	PHE	A	189	L	-	CG	PRO	V	314
R	H	CB	PHE	A	189	L	-	HG2	PRO	V	314
R	H	CB	PHE	A	189	L	-	HG3	PRO	V	314
R	H	O	PHE	A	189	L	-	HG2	PRO	V	314
R	H	CG	PHE	A	189	L	-	CG	PRO	V	314
R	H	CG	PHE	A	189	L	-	HG2	PRO	V	314
R	H	CG	PHE	A	189	L	-	HG3	PRO	V	314
R	H	CD1	PHE	A	189	L	H	HG22	ILE	V	309
R	H	CD1	PHE	A	189	L	-	O	GLN	V	312
R	H	CD1	PHE	A	189	L	-	CG	PRO	V	314
R	H	CD1	PHE	A	189	L	-	HG3	PRO	V	314
R	H	CD2	PHE	A	189	L	-	HG3	PRO	V	314
R	H	CE1	PHE	A	189	L	H	O	ILE	V	309
R	H	CE1	PHE	A	189	L	H	CG2	ILE	V	309
R	H	CE1	PHE	A	189	L	H	HG21	ILE	V	309
R	H	CE1	PHE	A	189	L	H	HG22	ILE	V	309
R	H	CE1	PHE	A	189	L	-	O	GLN	V	312
R	H	CE1	PHE	A	189	L	-	HG3	PRO	V	314
R	H	CZ	PHE	A	189	L	H	HG22	ILE	V	309
R	H	CB	ILE	A	191	L	H	HE2	MET	V	310
R	H	O	ILE	A	191	L	H	HE2	MET	V	310
R	H	CG1	ILE	A	191	L	H	HE2	MET	V	310
R	H	CG2	ILE	A	191	L	H	HG2	MET	V	310
R	H	CG2	ILE	A	191	L	H	HE2	MET	V	310
R	H	CD1	ILE	A	191	L	H	HD22	LEU	V	49
R	H	CD1	ILE	A	191	L	H	HE2	MET	V	310
R	H	CB	VAL	A	192	L	H	O	MET	V	310
R	H	CG1	VAL	A	192	L	H	O	MET	V	310
R	H	CG2	VAL	A	192	L	H	CA	MET	V	310
R	H	CG2	VAL	A	192	L	H	C	MET	V	310
R	H	CG2	VAL	A	192	L	H	O	MET	V	310
R	H	CG2	VAL	A	192	L	H	HA	MET	V	310
R	H	CB	ILE	A	195	L	H	CE	MET	V	310
R	H	CB	ILE	A	195	L	H	HE1	MET	V	310
R	H	CB	ILE	A	195	L	H	HE2	MET	V	310
R	H	CB	ILE	A	195	L	H	HE3	MET	V	310
R	H	CG1	ILE	A	195	L	H	CE	MET	V	310
R	H	CG1	ILE	A	195	L	H	HE1	MET	V	310
R	H	CG1	ILE	A	195	L	H	HE2	MET	V	310
R	H	CG1	ILE	A	195	L	H	HE3	MET	V	310
R	H	CG2	ILE	A	195	L	H	CE	MET	V	310
R	H	CG2	ILE	A	195	L	H	HE1	MET	V	310
R	H	CG2	ILE	A	195	L	H	HE3	MET	V	310
R	H	CD1	ILE	A	195	L	H	CE	MET	V	310
R	H	CD1	ILE	A	195	L	H	HE1	MET	V	310
R	H	CD1	ILE	A	195	L	H	HE2	MET	V	310
R	H	CD1	ILE	A	195	L	H	HE3	MET	V	310
R	H	CZ	PHE	A	245	L	H	HD13	LEU	V	38
R	H	OH	TYR	A	248	L	H	SD	MET	V	45
R	H	CA	ILE	A	249	L	H	HD12	LEU	V	41
R	H	C	ILE	A	249	L	H	HD12	LEU	V	41
R	H	CB	ILE	A	249	L	H	HD12	LEU	V	41
R	H	O	ILE	A	249	L	H	CD1	LEU	V	41
R	H	O	ILE	A	249	L	H	HD12	LEU	V	41
R	H	O	ILE	A	249	L	H	HD13	LEU	V	41
R	H	O	ILE	A	249	L	H	HD23	LEU	V	41
R	H	CG1	ILE	A	249	L	H	HD12	LEU	V	38
R	H	CG2	ILE	A	249	L	H	CD1	LEU	V	41
R	H	CG2	ILE	A	249	L	H	HD11	LEU	V	41
R	H	CG2	ILE	A	249	L	H	HD12	LEU	V	41
R	H	CG2	ILE	A	249	L	H	HD13	LEU	V	41
R	H	CD1	ILE	A	249	L	H	HD11	LEU	V	38
R	H	CD1	ILE	A	249	L	H	HD13	LEU	V	38
R	H	C	ILE	A	252	L	H	HD23	LEU	V	41
R	H	CB	ILE	A	252	L	H	HD23	LEU	V	41
R	H	O	ILE	A	252	L	H	HD23	LEU	V	41
R	H	CG2	ILE	A	252	L	H	CD2	LEU	V	41
R	H	CG2	ILE	A	252	L	H	HB3	LEU	V	41
R	H	CG2	ILE	A	252	L	H	HD23	LEU	V	41
R	H	CG2	ILE	A	252	L	H	HB2	MET	V	45
R	H	CD1	ILE	A	252	L	H	SD	MET	V	45
R	H	CD1	ILE	A	252	L	H	HB2	MET	V	45
R	H	N	LEU	A	253	L	H	CD2	LEU	V	41
R	H	N	LEU	A	253	L	H	HD12	LEU	V	41
R	H	N	LEU	A	253	L	H	HD22	LEU	V	41
R	H	N	LEU	A	253	L	H	HD23	LEU	V	41
R	H	CA	LEU	A	253	L	H	CD2	LEU	V	41
R	H	CA	LEU	A	253	L	H	HD12	LEU	V	41
R	H	CA	LEU	A	253	L	H	HD13	LEU	V	41
R	H	CA	LEU	A	253	L	H	HD22	LEU	V	41
R	H	CA	LEU	A	253	L	H	HD23	LEU	V	41
R	H	CB	LEU	A	253	L	H	CD1	LEU	V	41
R	H	CB	LEU	A	253	L	H	CD2	LEU	V	41
R	H	CB	LEU	A	253	L	H	HD12	LEU	V	41
R	H	CB	LEU	A	253	L	H	HD13	LEU	V	41
R	H	CB	LEU	A	253	L	H	HD22	LEU	V	41
R	H	CB	LEU	A	253	L	H	HD23	LEU	V	41
R	H	CG	LEU	A	253	L	H	HD12	LEU	V	37
R	H	CG	LEU	A	253	L	H	HD13	LEU	V	41
R	H	CG	LEU	A	253	L	H	HD22	LEU	V	41
R	H	CD1	LEU	A	253	L	H	CD1	LEU	V	37
R	H	CD1	LEU	A	253	L	H	HD11	LEU	V	37
R	H	CD1	LEU	A	253	L	H	HD12	LEU	V	37
R	H	CD1	LEU	A	253	L	H	HD13	LEU	V	37
R	H	CD1	LEU	A	253	L	H	CD2	LEU	V	41
R	H	CD1	LEU	A	253	L	H	HD13	LEU	V	41
R	H	CD1	LEU	A	253	L	H	HD22	LEU	V	41
R	H	CD2	LEU	A	253	L	H	CD2	LEU	V	37
R	H	CD2	LEU	A	253	L	H	HD12	LEU	V	37
R	H	CD2	LEU	A	253	L	H	HD23	LEU	V	37
R	H	CD2	LEU	A	253	L	H	HD13	LEU	V	41
R	-	CB	PHE	A	256	L	H	CD1	LEU	V	44
R	-	CB	PHE	A	256	L	H	HD12	LEU	V	44
R	-	CB	PHE	A	256	L	H	HD13	LEU	V	44
R	-	CG	PHE	A	256	L	H	HB3	LEU	V	44
R	-	CG	PHE	A	256	L	H	HD13	LEU	V	44
R	-	CD1	PHE	A	256	L	H	HB3	LEU	V	44
R	-	CD1	PHE	A	256	L	H	HD13	LEU	V	44
R	-	CD2	PHE	A	256	L	H	HB3	LEU	V	44
R	-	CE1	PHE	A	256	L	H	HB3	LEU	V	44
R	-	CE1	PHE	A	256	L	H	HB1	ALA	V	48
R	-	CE1	PHE	A	256	L	H	HB3	ALA	V	48
R	-	CE2	PHE	A	256	L	H	HA	MET	V	45
R	-	CZ	PHE	A	256	L	H	HB3	LEU	V	44
R	-	CZ	PHE	A	256	L	H	HA	MET	V	45
R	-	CZ	PHE	A	256	L	H	CB	ALA	V	48
R	-	CZ	PHE	A	256	L	H	HB1	ALA	V	48
R	-	CZ	PHE	A	256	L	H	HB2	ALA	V	48
R	-	CZ	PHE	A	256	L	H	HB3	ALA	V	48
R	H	C	LEU	A	259	L	H	HG21	THR	V	80
R	H	C	LEU	A	259	L	H	HG22	THR	V	80
R	H	CB	LEU	A	259	L	H	HH	TYR	V	40
R	H	CB	LEU	A	259	L	H	HG21	THR	V	80
R	H	O	LEU	A	259	L	H	CG2	THR	V	80
R	H	O	LEU	A	259	L	H	HG21	THR	V	80
R	H	O	LEU	A	259	L	H	HG22	THR	V	80
R	H	O	LEU	A	259	L	H	HG23	THR	V	80
R	H	CD1	LEU	A	259	L	H	HD13	LEU	V	44
R	H	CD1	LEU	A	259	L	H	HD22	LEU	V	44
R	H	CD1	LEU	A	259	L	H	HG22	ILE	V	76
R	-	CG	MET	A	260	L	H	HE1	TYR	V	40
R	-	SD	MET	A	260	L	H	HE1	TYR	V	40
R	-	CE	MET	A	260	L	H	CD1	TYR	V	40
R	-	CE	MET	A	260	L	H	CE1	TYR	V	40
R	-	CE	MET	A	260	L	H	HD1	TYR	V	40
R	-	CE	MET	A	260	L	H	HE1	TYR	V	40
R	-	CD	LYS	A	262	L	H	OG	SER	V	88
R	-	CD	LYS	A	262	L	H	HB2	SER	V	88
R	-	CD	LYS	A	262	L	H	HG	SER	V	88
R	-	CD	LYS	A	262	L	H	CD1	LEU	V	92
R	-	CD	LYS	A	262	L	H	HD11	LEU	V	92
R	-	CD	LYS	A	262	L	H	HD13	LEU	V	92
R	-	CE	LYS	A	262	L	H	CB	SER	V	88
R	-	CE	LYS	A	262	L	H	OG	SER	V	88
R	-	CE	LYS	A	262	L	H	HB2	SER	V	88
R	-	CE	LYS	A	262	L	H	HG	SER	V	88
R	-	CE	LYS	A	262	L	H	CD1	LEU	V	92
R	-	CE	LYS	A	262	L	H	HD11	LEU	V	92
R	-	CE	LYS	A	262	L	-	OD2	ASP	V	94
R	-	NZ	LYS	A	262	L	H	CB	SER	V	88
R	-	NZ	LYS	A	262	L	H	OG	SER	V	88
R	-	NZ	LYS	A	262	L	H	HB2	SER	V	88
R	-	NZ	LYS	A	262	L	H	HG	SER	V	88
R	-	NZ	LYS	A	262	L	H	CD1	LEU	V	92
R	-	NZ	LYS	A	262	L	H	HB2	LEU	V	92
R	-	NZ	LYS	A	262	L	H	HD11	LEU	V	92
R	-	NZ	LYS	A	262	L	H	HD12	LEU	V	92
R	-	NZ	LYS	A	262	L	H	HD13	LEU	V	92
R	-	NZ	LYS	A	262	L	-	CB	ASP	V	94
R	-	NZ	LYS	A	262	L	-	CG	ASP	V	94
R	-	NZ	LYS	A	262	L	-	OD2	ASP	V	94
R	-	NZ	LYS	A	262	L	-	HB2	ASP	V	94
R	-	NZ	LYS	A	262	L	-	HB3	ASP	V	94
R	H	CD1	LEU	A	265	L	H	CD1	LEU	V	92
R	H	CD1	LEU	A	265	L	H	HD12	LEU	V	92
R	H	CD1	LEU	A	265	L	H	HD13	LEU	V	92
R	H	CE1	PHE	A	269	L	H	HE1	PHE	V	33
R	H	CE1	PHE	A	269	L	H	HZ	PHE	V	33
R	H	CE1	PHE	A	269	L	H	CE1	PHE	V	34
R	H	CE1	PHE	A	269	L	H	HE1	PHE	V	34
R	H	CE1	PHE	A	269	L	H	CD2	LEU	V	37
R	H	CE1	PHE	A	269	L	H	HD21	LEU	V	37
R	H	CE1	PHE	A	269	L	H	HD22	LEU	V	37
R	H	CE1	PHE	A	269	L	H	HD23	LEU	V	37
R	H	CE2	PHE	A	269	L	H	HE1	PHE	V	33
R	H	CE2	PHE	A	269	L	H	HE1	PHE	V	34
R	H	CE2	PHE	A	269	L	H	HZ	PHE	V	34
R	H	CZ	PHE	A	269	L	H	CE1	PHE	V	33
R	H	CZ	PHE	A	269	L	H	HE1	PHE	V	33
R	H	CZ	PHE	A	269	L	H	CE1	PHE	V	34
R	H	CZ	PHE	A	269	L	H	CZ	PHE	V	34
R	H	CZ	PHE	A	269	L	H	HE1	PHE	V	34
R	H	CZ	PHE	A	269	L	H	HZ	PHE	V	34

- 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