IID

A6NMS3_Q8NGL1.1 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	TYR	A	200	L	H	GLU	V	23
R	H	ILE	A	204	L	H	PRO	V	22
R	H	ILE	A	204	L	H	GLU	V	23
R	H	ILE	A	208	L	-	TYR	V	21
R	H	ILE	A	211	L	-	ASP	V	20
R	H	LEU	A	215	L	-	ASN	V	176
R	H	LEU	A	215	L	H	ARG	V	269
R	H	LEU	A	215	L	H	HIS	V	270
R	H	TYR	A	218	L	H	ARG	V	269
R	H	LEU	A	219	L	-	ASN	V	267
R	H	LEU	A	219	L	-	SER	V	268
R	H	LEU	A	219	L	H	ARG	V	269
R	H	LEU	A	222	L	H	SER	V	187
R	H	LEU	A	222	L	H	ARG	V	269
R	H	PHE	A	226	L	H	LEU	V	186
R	H	PHE	A	226	L	H	SER	V	187
R	H	PHE	A	226	L	-	THR	V	193
R	H	PHE	A	226	L	H	TYR	V	194
R	H	PHE	A	226	L	H	GLN	V	197
R	H	LYS	A	227	L	-	ASN	V	264
R	H	ARG	A	234	L	-	ASP	V	192
R	H	ARG	A	234	L	H	TYR	V	194
R	H	PHE	A	245	L	S	THR	V	174
R	H	PHE	A	245	L	H	LEU	V	188
R	H	LEU	A	246	L	S	PHE	V	172
R	H	SER	A	249	L	S	THR	V	174
R	H	ILE	A	253	L	S	THR	V	14
R	H	ILE	A	253	L	-	LEU	V	16
R	H	ILE	A	253	L	S	THR	V	174
R	H	LEU	A	256	L	-	LEU	V	16
R	H	LEU	A	256	L	-	SER	V	19
R	H	LEU	A	256	L	-	ASP	V	20
R	H	LEU	A	256	L	-	ARG	V	91
R	H	MET	A	257	L	-	LYS	V	89
R	H	TYR	A	258	L	-	LYS	V	89
R	H	ILE	A	259	L	H	PRO	V	22
R	-	GLY	A	260	L	-	LYS	V	89
R	-	PRO	A	261	L	-	GLN	V	25
R	-	PRO	A	261	L	-	VAL	V	87
R	-	PRO	A	261	L	-	LYS	V	89
R	-	SER	A	262	L	-	LYS	V	89
R	-	LYS	A	267	L	-	LYS	V	89
R	H	ASP	A	268	L	-	LYS	V	89
R	H	VAL	A	271	L	-	LYS	V	89

- 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

A6NMS3_Q8NGL1.1 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	CD1	TYR	A	200	L	H	HB3	GLU	V	23
R	H	CG1	ILE	A	204	L	H	HG2	PRO	V	22
R	H	CG1	ILE	A	204	L	H	CD	GLU	V	23
R	H	CG1	ILE	A	204	L	H	OE2	GLU	V	23
R	H	CG2	ILE	A	204	L	H	CD	GLU	V	23
R	H	CG2	ILE	A	204	L	H	OE1	GLU	V	23
R	H	CG2	ILE	A	204	L	H	OE2	GLU	V	23
R	H	CD1	ILE	A	204	L	H	HG2	PRO	V	22
R	H	CD1	ILE	A	204	L	H	CB	GLU	V	23
R	H	CD1	ILE	A	204	L	H	CG	GLU	V	23
R	H	CD1	ILE	A	204	L	H	CD	GLU	V	23
R	H	CD1	ILE	A	204	L	H	OE1	GLU	V	23
R	H	CD1	ILE	A	204	L	H	OE2	GLU	V	23
R	H	CD1	ILE	A	204	L	H	H	GLU	V	23
R	H	CD1	ILE	A	204	L	H	HB3	GLU	V	23
R	H	CD1	ILE	A	204	L	H	HG3	GLU	V	23
R	H	CG1	ILE	A	208	L	-	CE1	TYR	V	21
R	H	CG1	ILE	A	208	L	-	HE1	TYR	V	21
R	H	CD1	ILE	A	208	L	-	CD1	TYR	V	21
R	H	CD1	ILE	A	208	L	-	CE1	TYR	V	21
R	H	CD1	ILE	A	208	L	-	HD1	TYR	V	21
R	H	CD1	ILE	A	208	L	-	HE1	TYR	V	21
R	H	CG2	ILE	A	211	L	-	OD1	ASP	V	20
R	H	CD1	ILE	A	211	L	-	OD1	ASP	V	20
R	H	CD1	ILE	A	211	L	-	HB3	ASP	V	20
R	H	CA	LEU	A	215	L	H	NH1	ARG	V	269
R	H	CA	LEU	A	215	L	H	CZ	ARG	V	269
R	H	CA	LEU	A	215	L	H	HD2	ARG	V	269
R	H	CA	LEU	A	215	L	H	HH11	ARG	V	269
R	H	CA	LEU	A	215	L	H	HH12	ARG	V	269
R	H	C	LEU	A	215	L	H	NH1	ARG	V	269
R	H	C	LEU	A	215	L	H	HD2	ARG	V	269
R	H	C	LEU	A	215	L	H	HH11	ARG	V	269
R	H	C	LEU	A	215	L	H	HH12	ARG	V	269
R	H	CB	LEU	A	215	L	-	HD21	ASN	V	176
R	H	CB	LEU	A	215	L	H	CD	ARG	V	269
R	H	CB	LEU	A	215	L	H	NH1	ARG	V	269
R	H	CB	LEU	A	215	L	H	HD2	ARG	V	269
R	H	CB	LEU	A	215	L	H	HH11	ARG	V	269
R	H	CB	LEU	A	215	L	H	HH12	ARG	V	269
R	H	O	LEU	A	215	L	H	NE	ARG	V	269
R	H	O	LEU	A	215	L	H	NH1	ARG	V	269
R	H	O	LEU	A	215	L	H	NH2	ARG	V	269
R	H	O	LEU	A	215	L	H	CZ	ARG	V	269
R	H	O	LEU	A	215	L	H	HD2	ARG	V	269
R	H	O	LEU	A	215	L	H	HH11	ARG	V	269
R	H	O	LEU	A	215	L	H	HH12	ARG	V	269
R	H	O	LEU	A	215	L	H	HH22	ARG	V	269
R	H	CG	LEU	A	215	L	-	ND2	ASN	V	176
R	H	CG	LEU	A	215	L	-	HD21	ASN	V	176
R	H	CG	LEU	A	215	L	-	HD22	ASN	V	176
R	H	CG	LEU	A	215	L	H	NH1	ARG	V	269
R	H	CG	LEU	A	215	L	H	HD2	ARG	V	269
R	H	CG	LEU	A	215	L	H	HH11	ARG	V	269
R	H	CG	LEU	A	215	L	H	HH12	ARG	V	269
R	H	CD1	LEU	A	215	L	-	CG	ASN	V	176
R	H	CD1	LEU	A	215	L	-	ND2	ASN	V	176
R	H	CD1	LEU	A	215	L	-	HD21	ASN	V	176
R	H	CD1	LEU	A	215	L	-	HD22	ASN	V	176
R	H	CD1	LEU	A	215	L	H	HD2	ARG	V	269
R	H	CD1	LEU	A	215	L	H	HH11	ARG	V	269
R	H	CD1	LEU	A	215	L	H	HE2	HIS	V	270
R	H	CD2	LEU	A	215	L	-	ND2	ASN	V	176
R	H	CD2	LEU	A	215	L	-	HB2	ASN	V	176
R	H	CD2	LEU	A	215	L	-	HD21	ASN	V	176
R	H	CD2	LEU	A	215	L	-	HD22	ASN	V	176
R	H	CD2	LEU	A	215	L	H	NH1	ARG	V	269
R	H	CD2	LEU	A	215	L	H	CZ	ARG	V	269
R	H	CD2	LEU	A	215	L	H	HD2	ARG	V	269
R	H	CD2	LEU	A	215	L	H	HD3	ARG	V	269
R	H	CD2	LEU	A	215	L	H	HH11	ARG	V	269
R	H	CD2	LEU	A	215	L	H	HH12	ARG	V	269
R	H	C	TYR	A	218	L	H	NH2	ARG	V	269
R	H	C	TYR	A	218	L	H	HH21	ARG	V	269
R	H	C	TYR	A	218	L	H	HH22	ARG	V	269
R	H	CB	TYR	A	218	L	H	HH12	ARG	V	269
R	H	CB	TYR	A	218	L	H	HH22	ARG	V	269
R	H	N	LEU	A	219	L	H	NH2	ARG	V	269
R	H	N	LEU	A	219	L	H	HH21	ARG	V	269
R	H	N	LEU	A	219	L	H	HH22	ARG	V	269
R	H	CA	LEU	A	219	L	H	NH2	ARG	V	269
R	H	CA	LEU	A	219	L	H	HH21	ARG	V	269
R	H	CB	LEU	A	219	L	H	NE	ARG	V	269
R	H	CB	LEU	A	219	L	H	NH2	ARG	V	269
R	H	CB	LEU	A	219	L	H	HE	ARG	V	269
R	H	CB	LEU	A	219	L	H	HH21	ARG	V	269
R	H	CG	LEU	A	219	L	H	HE	ARG	V	269
R	H	CD1	LEU	A	219	L	H	HE	ARG	V	269
R	H	CD1	LEU	A	219	L	H	HH21	ARG	V	269
R	H	CD2	LEU	A	219	L	-	O	ASN	V	267
R	H	CD2	LEU	A	219	L	-	HA	SER	V	268
R	H	CD2	LEU	A	219	L	H	H	ARG	V	269
R	H	CD2	LEU	A	219	L	H	HG3	ARG	V	269
R	H	CD2	LEU	A	219	L	H	HE	ARG	V	269
R	H	CD1	LEU	A	222	L	H	CB	SER	V	187
R	H	CD1	LEU	A	222	L	H	O	SER	V	187
R	H	CD1	LEU	A	222	L	H	HB3	SER	V	187
R	H	CD1	LEU	A	222	L	H	HH21	ARG	V	269
R	H	CD1	LEU	A	222	L	H	HH22	ARG	V	269
R	H	CD2	LEU	A	222	L	H	O	SER	V	187
R	H	CB	PHE	A	226	L	H	NE2	GLN	V	197
R	H	CB	PHE	A	226	L	H	OE1	GLN	V	197
R	H	CB	PHE	A	226	L	H	HE22	GLN	V	197
R	H	O	PHE	A	226	L	H	HD2	TYR	V	194
R	H	CG	PHE	A	226	L	-	HG1	THR	V	193
R	H	CG	PHE	A	226	L	H	CD	GLN	V	197
R	H	CG	PHE	A	226	L	H	NE2	GLN	V	197
R	H	CG	PHE	A	226	L	H	HE21	GLN	V	197
R	H	CG	PHE	A	226	L	H	HE22	GLN	V	197
R	H	CD1	PHE	A	226	L	-	OG1	THR	V	193
R	H	CD1	PHE	A	226	L	-	HG1	THR	V	193
R	H	CD1	PHE	A	226	L	H	NE2	GLN	V	197
R	H	CD1	PHE	A	226	L	H	HE21	GLN	V	197
R	H	CD1	PHE	A	226	L	H	HE22	GLN	V	197
R	H	CD2	PHE	A	226	L	H	NE2	GLN	V	197
R	H	CD2	PHE	A	226	L	H	HE21	GLN	V	197
R	H	CD2	PHE	A	226	L	H	HE22	GLN	V	197
R	H	CE1	PHE	A	226	L	-	CB	THR	V	193
R	H	CE1	PHE	A	226	L	-	OG1	THR	V	193
R	H	CE1	PHE	A	226	L	-	HG1	THR	V	193
R	H	CE1	PHE	A	226	L	-	HG21	THR	V	193
R	H	CE1	PHE	A	226	L	H	NE2	GLN	V	197
R	H	CE1	PHE	A	226	L	H	HE21	GLN	V	197
R	H	CE1	PHE	A	226	L	H	HE22	GLN	V	197
R	H	CE2	PHE	A	226	L	H	HA	SER	V	187
R	H	CE2	PHE	A	226	L	H	NE2	GLN	V	197
R	H	CE2	PHE	A	226	L	H	HE21	GLN	V	197
R	H	CE2	PHE	A	226	L	H	HE22	GLN	V	197
R	H	CZ	PHE	A	226	L	H	O	LEU	V	186
R	H	CZ	PHE	A	226	L	H	HA	SER	V	187
R	H	CZ	PHE	A	226	L	-	OG1	THR	V	193
R	H	CZ	PHE	A	226	L	-	HG1	THR	V	193
R	H	CZ	PHE	A	226	L	-	HG21	THR	V	193
R	H	CZ	PHE	A	226	L	H	NE2	GLN	V	197
R	H	CZ	PHE	A	226	L	H	HE21	GLN	V	197
R	H	CZ	PHE	A	226	L	H	HE22	GLN	V	197
R	H	CE	LYS	A	227	L	-	OD1	ASN	V	264
R	H	NZ	LYS	A	227	L	-	OD1	ASN	V	264
R	H	NH1	ARG	A	234	L	-	CG	ASP	V	192
R	H	NH1	ARG	A	234	L	-	OD1	ASP	V	192
R	H	NH1	ARG	A	234	L	-	OD2	ASP	V	192
R	H	NH1	ARG	A	234	L	H	HB2	TYR	V	194
R	H	NH2	ARG	A	234	L	-	CB	ASP	V	192
R	H	NH2	ARG	A	234	L	-	CG	ASP	V	192
R	H	NH2	ARG	A	234	L	-	OD1	ASP	V	192
R	H	NH2	ARG	A	234	L	-	OD2	ASP	V	192
R	H	NH2	ARG	A	234	L	-	HB3	ASP	V	192
R	H	CZ	ARG	A	234	L	-	CG	ASP	V	192
R	H	CZ	ARG	A	234	L	-	OD1	ASP	V	192
R	H	CZ	ARG	A	234	L	-	OD2	ASP	V	192
R	H	CZ	ARG	A	234	L	-	HB3	ASP	V	192
R	H	CE1	PHE	A	245	L	H	HD21	LEU	V	188
R	H	CZ	PHE	A	245	L	S	HB	THR	V	174
R	H	CZ	PHE	A	245	L	H	HD22	LEU	V	188
R	H	CD1	LEU	A	246	L	S	HB2	PHE	V	172
R	H	CB	SER	A	249	L	S	OG1	THR	V	174
R	H	CB	SER	A	249	L	S	HG1	THR	V	174
R	H	OG	SER	A	249	L	S	OG1	THR	V	174
R	H	OG	SER	A	249	L	S	HB	THR	V	174
R	H	OG	SER	A	249	L	S	HG1	THR	V	174
R	H	CB	ILE	A	253	L	S	HG21	THR	V	14
R	H	CG1	ILE	A	253	L	S	HG21	THR	V	14
R	H	CG1	ILE	A	253	L	-	HD22	LEU	V	16
R	H	CG1	ILE	A	253	L	S	OG1	THR	V	174
R	H	CG1	ILE	A	253	L	S	HG21	THR	V	174
R	H	CG2	ILE	A	253	L	S	HG21	THR	V	14
R	H	CD1	ILE	A	253	L	S	HB	THR	V	14
R	H	CD1	ILE	A	253	L	S	HG21	THR	V	14
R	H	CD1	ILE	A	253	L	S	OG1	THR	V	174
R	H	CD1	ILE	A	253	L	S	HG1	THR	V	174
R	H	CD1	ILE	A	253	L	S	HG21	THR	V	174
R	H	CD1	ILE	A	253	L	S	HG22	THR	V	174
R	H	CA	LEU	A	256	L	-	HH12	ARG	V	91
R	H	C	LEU	A	256	L	-	HH12	ARG	V	91
R	H	C	LEU	A	256	L	-	HH22	ARG	V	91
R	H	CB	LEU	A	256	L	-	HB2	SER	V	19
R	H	CB	LEU	A	256	L	-	NH1	ARG	V	91
R	H	CB	LEU	A	256	L	-	HH12	ARG	V	91
R	H	CB	LEU	A	256	L	-	HH22	ARG	V	91
R	H	O	LEU	A	256	L	-	HH12	ARG	V	91
R	H	O	LEU	A	256	L	-	HH22	ARG	V	91
R	H	CG	LEU	A	256	L	-	O	SER	V	19
R	H	CG	LEU	A	256	L	-	HB2	SER	V	19
R	H	CG	LEU	A	256	L	-	HH12	ARG	V	91
R	H	CD1	LEU	A	256	L	-	HD23	LEU	V	16
R	H	CD1	LEU	A	256	L	-	CB	SER	V	19
R	H	CD1	LEU	A	256	L	-	OG	SER	V	19
R	H	CD1	LEU	A	256	L	-	HB2	SER	V	19
R	H	CD1	LEU	A	256	L	-	HG	SER	V	19
R	H	CD1	LEU	A	256	L	-	OD1	ASP	V	20
R	H	CD1	LEU	A	256	L	-	HH12	ARG	V	91
R	H	CD2	LEU	A	256	L	-	C	SER	V	19
R	H	CD2	LEU	A	256	L	-	O	SER	V	19
R	H	CD2	LEU	A	256	L	-	HB2	SER	V	19
R	H	CD2	LEU	A	256	L	-	HA	ASP	V	20
R	H	CA	MET	A	257	L	-	HB2	LYS	V	89
R	H	CA	MET	A	257	L	-	HG2	LYS	V	89
R	H	CA	MET	A	257	L	-	HD2	LYS	V	89
R	H	C	MET	A	257	L	-	CD	LYS	V	89
R	H	C	MET	A	257	L	-	CE	LYS	V	89
R	H	C	MET	A	257	L	-	HG2	LYS	V	89
R	H	C	MET	A	257	L	-	HD2	LYS	V	89
R	H	C	MET	A	257	L	-	HE2	LYS	V	89
R	H	C	MET	A	257	L	-	HZ3	LYS	V	89
R	H	CB	MET	A	257	L	-	HB2	LYS	V	89
R	H	CB	MET	A	257	L	-	HD2	LYS	V	89
R	H	O	MET	A	257	L	-	CG	LYS	V	89
R	H	O	MET	A	257	L	-	CD	LYS	V	89
R	H	O	MET	A	257	L	-	CE	LYS	V	89
R	H	O	MET	A	257	L	-	NZ	LYS	V	89
R	H	O	MET	A	257	L	-	HB2	LYS	V	89
R	H	O	MET	A	257	L	-	HG2	LYS	V	89
R	H	O	MET	A	257	L	-	HD2	LYS	V	89
R	H	O	MET	A	257	L	-	HD3	LYS	V	89
R	H	O	MET	A	257	L	-	HE2	LYS	V	89
R	H	O	MET	A	257	L	-	HE3	LYS	V	89
R	H	O	MET	A	257	L	-	HZ1	LYS	V	89
R	H	O	MET	A	257	L	-	HZ3	LYS	V	89
R	H	CG	MET	A	257	L	-	C	LYS	V	89
R	H	CG	MET	A	257	L	-	O	LYS	V	89
R	H	CG	MET	A	257	L	-	HB2	LYS	V	89
R	H	SD	MET	A	257	L	-	O	LYS	V	89
R	H	SD	MET	A	257	L	-	HB2	LYS	V	89
R	H	CA	TYR	A	258	L	-	HZ3	LYS	V	89
R	H	O	TYR	A	258	L	-	HE2	LYS	V	89
R	H	CG2	ILE	A	259	L	H	CB	PRO	V	22
R	H	CG2	ILE	A	259	L	H	CG	PRO	V	22
R	H	CG2	ILE	A	259	L	H	HB2	PRO	V	22
R	H	CG2	ILE	A	259	L	H	HB3	PRO	V	22
R	H	CG2	ILE	A	259	L	H	HG3	PRO	V	22
R	-	N	GLY	A	260	L	-	HE2	LYS	V	89
R	-	CA	GLY	A	260	L	-	HE2	LYS	V	89
R	-	C	GLY	A	260	L	-	HE2	LYS	V	89
R	-	O	GLY	A	260	L	-	CE	LYS	V	89
R	-	O	GLY	A	260	L	-	HE2	LYS	V	89
R	-	O	GLY	A	260	L	-	HE3	LYS	V	89
R	-	C	PRO	A	261	L	-	HE3	LYS	V	89
R	-	O	PRO	A	261	L	-	O	VAL	V	87
R	-	O	PRO	A	261	L	-	HG3	LYS	V	89
R	-	O	PRO	A	261	L	-	HE3	LYS	V	89
R	-	CG	PRO	A	261	L	-	OE1	GLN	V	25
R	-	CG	PRO	A	261	L	-	O	VAL	V	87
R	-	CG	PRO	A	261	L	-	HA	VAL	V	87
R	-	CD	PRO	A	261	L	-	OE1	GLN	V	25
R	-	N	SER	A	262	L	-	HE3	LYS	V	89
R	-	CA	SER	A	262	L	-	HE3	LYS	V	89
R	-	CA	SER	A	262	L	-	HZ1	LYS	V	89
R	-	CB	SER	A	262	L	-	CE	LYS	V	89
R	-	CB	SER	A	262	L	-	NZ	LYS	V	89
R	-	CB	SER	A	262	L	-	HE2	LYS	V	89
R	-	CB	SER	A	262	L	-	HE3	LYS	V	89
R	-	CB	SER	A	262	L	-	HZ1	LYS	V	89
R	-	CB	SER	A	262	L	-	HZ2	LYS	V	89
R	-	OG	SER	A	262	L	-	HZ1	LYS	V	89
R	-	C	LYS	A	267	L	-	HZ2	LYS	V	89
R	-	CB	LYS	A	267	L	-	HZ2	LYS	V	89
R	-	O	LYS	A	267	L	-	HZ2	LYS	V	89
R	H	N	ASP	A	268	L	-	HZ2	LYS	V	89
R	H	CA	ASP	A	268	L	-	HZ2	LYS	V	89
R	H	CG	ASP	A	268	L	-	HZ1	LYS	V	89
R	H	CG	ASP	A	268	L	-	HZ2	LYS	V	89
R	H	OD1	ASP	A	268	L	-	NZ	LYS	V	89
R	H	OD1	ASP	A	268	L	-	HZ1	LYS	V	89
R	H	OD1	ASP	A	268	L	-	HZ2	LYS	V	89
R	H	OD1	ASP	A	268	L	-	HZ3	LYS	V	89
R	H	CB	VAL	A	271	L	-	HZ3	LYS	V	89
R	H	CG1	VAL	A	271	L	-	HZ3	LYS	V	89
R	H	CG2	VAL	A	271	L	-	HD2	LYS	V	89
R	H	CG2	VAL	A	271	L	-	HZ3	LYS	V	89

- 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