IID

A6NCV1_A6NCV1.1 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	ALA	A	145	L	H	THR	V	85
R	H	MET	A	148	L	H	ALA	V	84
R	H	ALA	A	149	L	H	VAL	V	81
R	H	ALA	A	149	L	H	THR	V	85
R	H	LEU	A	152	L	H	PHE	V	30
R	H	LEU	A	152	L	H	VAL	V	81
R	H	LEU	A	152	L	H	ALA	V	84
R	H	PHE	A	155	L	H	PHE	V	30
R	H	PHE	A	155	L	H	MET	V	34
R	H	PRO	A	156	L	H	TYR	V	33
R	H	PRO	A	156	L	H	MET	V	34
R	H	LEU	A	159	L	H	MET	V	34
R	H	MET	A	160	L	H	ILE	V	37
R	H	MET	A	160	L	H	LEU	V	41
R	H	MET	A	160	L	H	VAL	V	69
R	H	GLN	A	163	L	H	THR	V	38
R	H	GLN	A	163	L	H	LEU	V	41
R	-	ASP	A	165	L	H	THR	V	45
R	-	ASP	A	165	L	H	LEU	V	49
R	-	THR	A	188	L	H	THR	V	45
R	-	THR	A	188	L	H	LEU	V	49
R	-	ASP	A	189	L	H	LEU	V	48
R	H	ASP	A	191	L	H	PHE	V	66
R	H	ILE	A	192	L	H	LEU	V	41
R	H	ILE	A	192	L	H	ILE	V	44
R	H	ILE	A	192	L	H	PHE	V	66
R	H	ILE	A	192	L	H	VAL	V	69
R	H	MET	A	196	L	H	TYR	V	33
R	H	MET	A	196	L	H	THR	V	73
R	-	ARG	A	2	L	H	LYS	V	305
R	H	LEU	A	203	L	H	LYS	V	78
R	H	LEU	A	203	L	H	ASP	V	94
R	H	VAL	A	207	L	H	LYS	V	78
R	H	VAL	A	207	L	H	ASP	V	94
R	H	VAL	A	210	L	S	ASN	V	9
R	H	LEU	A	214	L	S	ASN	V	9
R	-	ASN	A	3	L	H	LYS	V	305
R	-	ASN	A	3	L	H	PHE	V	309
R	-	HIS	A	4	L	H	LYS	V	305
R	-	HIS	A	4	L	H	PHE	V	309
R	-	HIS	A	4	L	H	LEU	V	49
R	-	THR	A	5	L	H	PHE	V	309
R	-	THR	A	6	L	H	PHE	V	309
R	-	THR	A	6	L	H	SER	V	310

- 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

A6NCV1_A6NCV1.1 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	-	N	ARG	A	2	L	H	HZ1	LYS	V	305
R	-	C	ARG	A	2	L	H	HZ1	LYS	V	305
R	-	O	ARG	A	2	L	H	CE	LYS	V	305
R	-	O	ARG	A	2	L	H	NZ	LYS	V	305
R	-	O	ARG	A	2	L	H	HE2	LYS	V	305
R	-	O	ARG	A	2	L	H	HZ1	LYS	V	305
R	-	O	ARG	A	2	L	H	HZ2	LYS	V	305
R	-	O	ARG	A	2	L	H	HZ3	LYS	V	305
R	-	N	ASN	A	3	L	H	HZ1	LYS	V	305
R	-	CA	ASN	A	3	L	H	HZ1	LYS	V	305
R	-	CA	ASN	A	3	L	H	HZ	PHE	V	309
R	-	C	ASN	A	3	L	H	HZ	PHE	V	309
R	-	CB	ASN	A	3	L	H	HZ	PHE	V	309
R	-	CG	ASN	A	3	L	H	HZ	PHE	V	309
R	-	OD1	ASN	A	3	L	H	HZ	PHE	V	309
R	-	N	HIS	A	4	L	H	HE2	LYS	V	305
R	-	N	HIS	A	4	L	H	HZ1	LYS	V	305
R	-	N	HIS	A	4	L	H	CE2	PHE	V	309
R	-	N	HIS	A	4	L	H	CZ	PHE	V	309
R	-	N	HIS	A	4	L	H	HZ	PHE	V	309
R	-	C	HIS	A	4	L	H	CD1	PHE	V	309
R	-	C	HIS	A	4	L	H	CE1	PHE	V	309
R	-	C	HIS	A	4	L	H	CE2	PHE	V	309
R	-	C	HIS	A	4	L	H	CZ	PHE	V	309
R	-	C	HIS	A	4	L	H	HE1	PHE	V	309
R	-	C	HIS	A	4	L	H	HZ	PHE	V	309
R	-	CB	HIS	A	4	L	H	HE2	LYS	V	305
R	-	O	HIS	A	4	L	H	CB	PHE	V	309
R	-	O	HIS	A	4	L	H	CG	PHE	V	309
R	-	O	HIS	A	4	L	H	CD1	PHE	V	309
R	-	O	HIS	A	4	L	H	CD2	PHE	V	309
R	-	O	HIS	A	4	L	H	CE1	PHE	V	309
R	-	O	HIS	A	4	L	H	CE2	PHE	V	309
R	-	O	HIS	A	4	L	H	CZ	PHE	V	309
R	-	O	HIS	A	4	L	H	HB3	PHE	V	309
R	-	O	HIS	A	4	L	H	HD1	PHE	V	309
R	-	O	HIS	A	4	L	H	HD2	PHE	V	309
R	-	O	HIS	A	4	L	H	HE1	PHE	V	309
R	-	O	HIS	A	4	L	H	HE2	PHE	V	309
R	-	O	HIS	A	4	L	H	HZ	PHE	V	309
R	-	CG	HIS	A	4	L	H	HE2	LYS	V	305
R	-	CG	HIS	A	4	L	H	HZ2	LYS	V	305
R	-	CD2	HIS	A	4	L	H	CE	LYS	V	305
R	-	CD2	HIS	A	4	L	H	NZ	LYS	V	305
R	-	CD2	HIS	A	4	L	H	HE2	LYS	V	305
R	-	CD2	HIS	A	4	L	H	HZ1	LYS	V	305
R	-	CD2	HIS	A	4	L	H	HZ2	LYS	V	305
R	-	ND1	HIS	A	4	L	H	HD12	LEU	V	49
R	-	CE1	HIS	A	4	L	H	CD1	LEU	V	49
R	-	CE1	HIS	A	4	L	H	HD12	LEU	V	49
R	-	CE1	HIS	A	4	L	H	HD13	LEU	V	49
R	-	CE1	HIS	A	4	L	H	HD23	LEU	V	49
R	-	NE2	HIS	A	4	L	H	HB3	LEU	V	49
R	-	NE2	HIS	A	4	L	H	HD12	LEU	V	49
R	-	NE2	HIS	A	4	L	H	HD23	LEU	V	49
R	-	NE2	HIS	A	4	L	H	HZ2	LYS	V	305
R	-	N	THR	A	5	L	H	CE1	PHE	V	309
R	-	N	THR	A	5	L	H	HE1	PHE	V	309
R	-	CA	THR	A	5	L	H	CD1	PHE	V	309
R	-	CA	THR	A	5	L	H	CE1	PHE	V	309
R	-	CA	THR	A	5	L	H	HD1	PHE	V	309
R	-	CA	THR	A	5	L	H	HE1	PHE	V	309
R	-	CB	THR	A	5	L	H	HE1	PHE	V	309
R	-	CG2	THR	A	5	L	H	HE1	PHE	V	309
R	-	N	THR	A	6	L	H	HB3	PHE	V	309
R	-	N	THR	A	6	L	H	HD1	PHE	V	309
R	-	CB	THR	A	6	L	H	HB3	PHE	V	309
R	-	CG2	THR	A	6	L	H	HB3	PHE	V	309
R	-	OG1	THR	A	6	L	H	C	PHE	V	309
R	-	OG1	THR	A	6	L	H	O	PHE	V	309
R	-	OG1	THR	A	6	L	H	HB3	PHE	V	309
R	-	OG1	THR	A	6	L	H	HD1	PHE	V	309
R	-	OG1	THR	A	6	L	H	HA	SER	V	310
R	H	CA	ALA	A	145	L	H	CG2	THR	V	85
R	H	CA	ALA	A	145	L	H	HA	THR	V	85
R	H	CA	ALA	A	145	L	H	HG22	THR	V	85
R	H	C	ALA	A	145	L	H	CG2	THR	V	85
R	H	C	ALA	A	145	L	H	HG21	THR	V	85
R	H	C	ALA	A	145	L	H	HG22	THR	V	85
R	H	CB	ALA	A	145	L	H	CA	THR	V	85
R	H	CB	ALA	A	145	L	H	CB	THR	V	85
R	H	CB	ALA	A	145	L	H	O	THR	V	85
R	H	CB	ALA	A	145	L	H	CG2	THR	V	85
R	H	CB	ALA	A	145	L	H	HA	THR	V	85
R	H	CB	ALA	A	145	L	H	HB	THR	V	85
R	H	CB	ALA	A	145	L	H	HG22	THR	V	85
R	H	O	ALA	A	145	L	H	CG2	THR	V	85
R	H	O	ALA	A	145	L	H	HG21	THR	V	85
R	H	O	ALA	A	145	L	H	HG22	THR	V	85
R	H	O	ALA	A	145	L	H	HG23	THR	V	85
R	H	CB	MET	A	148	L	H	HB1	ALA	V	84
R	H	CG	MET	A	148	L	H	HB1	ALA	V	84
R	H	CA	ALA	A	149	L	H	HG13	VAL	V	81
R	H	CB	ALA	A	149	L	H	HG13	VAL	V	81
R	H	CB	ALA	A	149	L	H	HG21	THR	V	85
R	H	CB	LEU	A	152	L	H	CG2	VAL	V	81
R	H	CB	LEU	A	152	L	H	HG21	VAL	V	81
R	H	CB	LEU	A	152	L	H	HG22	VAL	V	81
R	H	CB	LEU	A	152	L	H	HG23	VAL	V	81
R	H	CG	LEU	A	152	L	H	HG22	VAL	V	81
R	H	CD1	LEU	A	152	L	H	N	VAL	V	81
R	H	CD1	LEU	A	152	L	H	CA	VAL	V	81
R	H	CD1	LEU	A	152	L	H	CG2	VAL	V	81
R	H	CD1	LEU	A	152	L	H	HA	VAL	V	81
R	H	CD1	LEU	A	152	L	H	HG21	VAL	V	81
R	H	CD1	LEU	A	152	L	H	HG22	VAL	V	81
R	H	CD1	LEU	A	152	L	H	HB2	ALA	V	84
R	H	CD1	LEU	A	152	L	H	HB3	ALA	V	84
R	H	CD2	LEU	A	152	L	H	HE2	PHE	V	30
R	H	CG	PHE	A	155	L	H	HE1	MET	V	34
R	H	CD1	PHE	A	155	L	H	HE2	PHE	V	30
R	H	CD1	PHE	A	155	L	H	HZ	PHE	V	30
R	H	CD1	PHE	A	155	L	H	CE	MET	V	34
R	H	CD1	PHE	A	155	L	H	HE1	MET	V	34
R	H	CD1	PHE	A	155	L	H	HE2	MET	V	34
R	H	CD1	PHE	A	155	L	H	HE3	MET	V	34
R	H	CE1	PHE	A	155	L	H	CZ	PHE	V	30
R	H	CE1	PHE	A	155	L	H	HE2	PHE	V	30
R	H	CE1	PHE	A	155	L	H	HZ	PHE	V	30
R	H	CE1	PHE	A	155	L	H	SD	MET	V	34
R	H	CE1	PHE	A	155	L	H	CE	MET	V	34
R	H	CE1	PHE	A	155	L	H	HE1	MET	V	34
R	H	CE1	PHE	A	155	L	H	HE2	MET	V	34
R	H	CE1	PHE	A	155	L	H	HE3	MET	V	34
R	H	CZ	PHE	A	155	L	H	HZ	PHE	V	30
R	H	CZ	PHE	A	155	L	H	HE3	MET	V	34
R	H	N	PRO	A	156	L	H	HE1	MET	V	34
R	H	CA	PRO	A	156	L	H	HE1	MET	V	34
R	H	CB	PRO	A	156	L	H	HE1	TYR	V	33
R	H	CB	PRO	A	156	L	H	HE1	MET	V	34
R	H	CG	PRO	A	156	L	H	HE1	TYR	V	33
R	H	CG	PRO	A	156	L	H	CE	MET	V	34
R	H	CG	PRO	A	156	L	H	HE1	MET	V	34
R	H	CG	PRO	A	156	L	H	HE2	MET	V	34
R	H	CD	PRO	A	156	L	H	HE1	MET	V	34
R	H	CD1	LEU	A	159	L	H	SD	MET	V	34
R	H	CA	MET	A	160	L	H	HD13	LEU	V	41
R	H	CB	MET	A	160	L	H	CD1	LEU	V	41
R	H	CB	MET	A	160	L	H	HD11	LEU	V	41
R	H	CB	MET	A	160	L	H	HD12	LEU	V	41
R	H	CB	MET	A	160	L	H	HD13	LEU	V	41
R	H	CG	MET	A	160	L	H	CG2	ILE	V	37
R	H	CG	MET	A	160	L	H	HG21	ILE	V	37
R	H	CG	MET	A	160	L	H	HG22	ILE	V	37
R	H	CG	MET	A	160	L	H	HG23	ILE	V	37
R	H	CG	MET	A	160	L	H	CD1	LEU	V	41
R	H	CG	MET	A	160	L	H	HD11	LEU	V	41
R	H	CG	MET	A	160	L	H	HD12	LEU	V	41
R	H	CG	MET	A	160	L	H	HD13	LEU	V	41
R	H	SD	MET	A	160	L	H	CG2	ILE	V	37
R	H	SD	MET	A	160	L	H	HG21	ILE	V	37
R	H	SD	MET	A	160	L	H	HG22	ILE	V	37
R	H	SD	MET	A	160	L	H	HG23	ILE	V	37
R	H	SD	MET	A	160	L	H	CD1	LEU	V	41
R	H	SD	MET	A	160	L	H	HD11	LEU	V	41
R	H	SD	MET	A	160	L	H	HD12	LEU	V	41
R	H	SD	MET	A	160	L	H	HD13	LEU	V	41
R	H	SD	MET	A	160	L	H	HD23	LEU	V	41
R	H	CE	MET	A	160	L	H	CB	ILE	V	37
R	H	CE	MET	A	160	L	H	CG1	ILE	V	37
R	H	CE	MET	A	160	L	H	CG2	ILE	V	37
R	H	CE	MET	A	160	L	H	CD1	ILE	V	37
R	H	CE	MET	A	160	L	H	HB	ILE	V	37
R	H	CE	MET	A	160	L	H	HG13	ILE	V	37
R	H	CE	MET	A	160	L	H	HG21	ILE	V	37
R	H	CE	MET	A	160	L	H	HG22	ILE	V	37
R	H	CE	MET	A	160	L	H	HG23	ILE	V	37
R	H	CE	MET	A	160	L	H	HD13	ILE	V	37
R	H	CE	MET	A	160	L	H	CD1	LEU	V	41
R	H	CE	MET	A	160	L	H	HG	LEU	V	41
R	H	CE	MET	A	160	L	H	HD11	LEU	V	41
R	H	CE	MET	A	160	L	H	HD12	LEU	V	41
R	H	CE	MET	A	160	L	H	HG13	VAL	V	69
R	H	CD	GLN	A	163	L	H	HG23	THR	V	38
R	H	NE2	GLN	A	163	L	H	CG2	THR	V	38
R	H	NE2	GLN	A	163	L	H	HG21	THR	V	38
R	H	NE2	GLN	A	163	L	H	HG23	THR	V	38
R	H	OE1	GLN	A	163	L	H	HA	THR	V	38
R	H	OE1	GLN	A	163	L	H	HG23	THR	V	38
R	H	OE1	GLN	A	163	L	H	HB2	LEU	V	41
R	H	OE1	GLN	A	163	L	H	HB3	LEU	V	41
R	-	CG	ASP	A	165	L	H	HD12	LEU	V	49
R	-	CG	ASP	A	165	L	H	HD13	LEU	V	49
R	-	OD2	ASP	A	165	L	H	HG22	THR	V	45
R	-	OD2	ASP	A	165	L	H	CD1	LEU	V	49
R	-	OD2	ASP	A	165	L	H	HD11	LEU	V	49
R	-	OD2	ASP	A	165	L	H	HD12	LEU	V	49
R	-	OD2	ASP	A	165	L	H	HD13	LEU	V	49
R	-	OD2	ASP	A	165	L	H	HD22	LEU	V	49
R	-	CG2	THR	A	188	L	H	OG1	THR	V	45
R	-	CG2	THR	A	188	L	H	HG22	THR	V	45
R	-	OG1	THR	A	188	L	H	HG22	THR	V	45
R	-	OG1	THR	A	188	L	H	HD13	LEU	V	49
R	-	N	ASP	A	189	L	H	HD12	LEU	V	48
R	-	CB	ASP	A	189	L	H	CD1	LEU	V	48
R	-	CB	ASP	A	189	L	H	HD12	LEU	V	48
R	-	CB	ASP	A	189	L	H	HD13	LEU	V	48
R	-	OD2	ASP	A	189	L	H	HD13	LEU	V	48
R	H	C	ASP	A	191	L	H	HE2	PHE	V	66
R	H	CB	ASP	A	191	L	H	HE2	PHE	V	66
R	H	N	ILE	A	192	L	H	HE2	PHE	V	66
R	H	CA	ILE	A	192	L	H	HE2	PHE	V	66
R	H	CB	ILE	A	192	L	H	HD23	LEU	V	41
R	H	CB	ILE	A	192	L	H	HE2	PHE	V	66
R	H	CB	ILE	A	192	L	H	HG12	VAL	V	69
R	H	CG1	ILE	A	192	L	H	CD2	PHE	V	66
R	H	CG1	ILE	A	192	L	H	CE2	PHE	V	66
R	H	CG1	ILE	A	192	L	H	HD2	PHE	V	66
R	H	CG1	ILE	A	192	L	H	HE2	PHE	V	66
R	H	CG1	ILE	A	192	L	H	HG12	VAL	V	69
R	H	CG2	ILE	A	192	L	H	HD23	LEU	V	41
R	H	CG2	ILE	A	192	L	H	CG1	VAL	V	69
R	H	CG2	ILE	A	192	L	H	HG11	VAL	V	69
R	H	CG2	ILE	A	192	L	H	HG12	VAL	V	69
R	H	CG2	ILE	A	192	L	H	HG13	VAL	V	69
R	H	CD1	ILE	A	192	L	H	CD2	LEU	V	41
R	H	CD1	ILE	A	192	L	H	HD21	LEU	V	41
R	H	CD1	ILE	A	192	L	H	HD23	LEU	V	41
R	H	CD1	ILE	A	192	L	H	CD1	ILE	V	44
R	H	CD1	ILE	A	192	L	H	HD11	ILE	V	44
R	H	CD1	ILE	A	192	L	H	HD12	ILE	V	44
R	H	CD1	ILE	A	192	L	H	HD13	ILE	V	44
R	H	CD1	ILE	A	192	L	H	CD2	PHE	V	66
R	H	CD1	ILE	A	192	L	H	CE2	PHE	V	66
R	H	CD1	ILE	A	192	L	H	HA	PHE	V	66
R	H	CD1	ILE	A	192	L	H	HD2	PHE	V	66
R	H	CD1	ILE	A	192	L	H	HE2	PHE	V	66
R	H	CD1	ILE	A	192	L	H	CB	VAL	V	69
R	H	CD1	ILE	A	192	L	H	CG1	VAL	V	69
R	H	CD1	ILE	A	192	L	H	HB	VAL	V	69
R	H	CD1	ILE	A	192	L	H	HG11	VAL	V	69
R	H	CD1	ILE	A	192	L	H	HG12	VAL	V	69
R	H	CD1	ILE	A	192	L	H	HG22	VAL	V	69
R	H	CG	MET	A	196	L	H	CG2	THR	V	73
R	H	CG	MET	A	196	L	H	HG21	THR	V	73
R	H	CG	MET	A	196	L	H	HG22	THR	V	73
R	H	SD	MET	A	196	L	H	HH	TYR	V	33
R	H	SD	MET	A	196	L	H	HG21	THR	V	73
R	H	CE	MET	A	196	L	H	OH	TYR	V	33
R	H	CE	MET	A	196	L	H	HH	TYR	V	33
R	H	CG	LEU	A	203	L	H	HD3	LYS	V	78
R	H	CD1	LEU	A	203	L	H	HD3	LYS	V	78
R	H	CD1	LEU	A	203	L	H	CG	ASP	V	94
R	H	CD1	LEU	A	203	L	H	OD1	ASP	V	94
R	H	CD1	LEU	A	203	L	H	OD2	ASP	V	94
R	H	CD1	LEU	A	203	L	H	HB2	ASP	V	94
R	H	CD2	LEU	A	203	L	H	HB2	LYS	V	78
R	H	CD2	LEU	A	203	L	H	HD3	LYS	V	78
R	H	CG2	VAL	A	207	L	H	HZ2	LYS	V	78
R	H	CG2	VAL	A	207	L	H	OD2	ASP	V	94
R	H	CB	VAL	A	210	L	S	HD22	ASN	V	9
R	H	CG1	VAL	A	210	L	S	CG	ASN	V	9
R	H	CG1	VAL	A	210	L	S	ND2	ASN	V	9
R	H	CG1	VAL	A	210	L	S	OD1	ASN	V	9
R	H	CG1	VAL	A	210	L	S	HD21	ASN	V	9
R	H	CG1	VAL	A	210	L	S	HD22	ASN	V	9
R	H	CG2	VAL	A	210	L	S	HD22	ASN	V	9
R	H	CD1	LEU	A	214	L	S	ND2	ASN	V	9
R	H	CD1	LEU	A	214	L	S	HD21	ASN	V	9
R	H	CD1	LEU	A	214	L	S	HD22	ASN	V	9

- 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