IID

A4D1Z8_Q6DKI2.1 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	S	SER	A	117	L	S	VAL	V	3
R	S	SER	A	117	L	S	LYS	V	6
R	S	LEU	A	118	L	-	ALA	V	2
R	-	ILE	A	192	L	-	GLU	V	92
R	-	GLN	A	194	L	S	GLN	V	105
R	-	GLN	A	194	L	S	PRO	V	107
R	-	GLN	A	194	L	S	HIS	V	93
R	-	THR	A	195	L	S	PRO	V	107
R	-	THR	A	195	L	-	GLN	V	70
R	-	THR	A	195	L	S	HIS	V	93
R	-	VAL	A	196	L	S	GLN	V	105
R	-	VAL	A	196	L	-	GLN	V	70
R	-	ILE	A	197	L	-	GLN	V	70
R	-	HIS	A	198	L	-	VAL	V	71
R	-	HIS	A	198	L	-	SER	V	72
R	-	HIS	A	198	L	-	SER	V	73
R	-	THR	A	199	L	S	THR	V	55
R	-	THR	A	199	L	-	VAL	V	71
R	-	THR	A	199	L	-	SER	V	72
R	-	THR	A	199	L	-	SER	V	73
R	-	VAL	A	200	L	-	SER	V	53
R	-	VAL	A	200	L	S	THR	V	55
R	-	VAL	A	200	L	-	VAL	V	71
R	-	GLN	A	201	L	-	SER	V	53
R	-	GLN	A	201	L	-	ALA	V	54
R	-	GLN	A	201	L	S	THR	V	55
R	-	SER	A	202	L	-	SER	V	53
R	-	ALA	A	203	L	-	SER	V	52
R	-	ALA	A	203	L	-	SER	V	53
R	-	GLN	A	206	L	-	GLY	V	28
R	-	PHE	A	208	L	-	SER	V	27
R	-	PHE	A	208	L	-	GLU	V	29
R	-	SER	A	209	L	-	ARG	V	31
R	-	ALA	A	213	L	-	MET	V	1
R	-	PRO	A	216	L	S	VAL	V	3
R	-	MET	A	218	L	S	LYS	V	6
R	-	LEU	A	249	L	-	ALA	V	10
R	-	PRO	A	250	L	S	TRP	V	17
R	S	GLN	A	350	L	S	PHE	V	8
R	-	GLY	A	69	L	S	CYS	V	126
R	-	GLY	A	70	L	S	CYS	V	126
R	-	MET	A	89	L	S	CYS	V	126
R	-	HIS	A	90	L	S	CYS	V	126
R	-	HIS	A	90	L	S	LEU	V	127
R	-	HIS	A	90	L	S	GLN	V	4
R	-	MET	A	91	L	S	CYS	V	126
R	-	MET	A	91	L	S	LEU	V	127

- 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

A4D1Z8_Q6DKI2.1 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	-	O	GLY	A	69	L	S	HG	CYS	V	126
R	-	O	GLY	A	70	L	S	SG	CYS	V	126
R	-	O	GLY	A	70	L	S	HG	CYS	V	126
R	-	CA	MET	A	89	L	S	HB2	CYS	V	126
R	-	C	MET	A	89	L	S	CB	CYS	V	126
R	-	C	MET	A	89	L	S	SG	CYS	V	126
R	-	C	MET	A	89	L	S	HA	CYS	V	126
R	-	C	MET	A	89	L	S	HB2	CYS	V	126
R	-	C	MET	A	89	L	S	HG	CYS	V	126
R	-	CB	MET	A	89	L	S	HB2	CYS	V	126
R	-	O	MET	A	89	L	S	CA	CYS	V	126
R	-	O	MET	A	89	L	S	CB	CYS	V	126
R	-	O	MET	A	89	L	S	SG	CYS	V	126
R	-	O	MET	A	89	L	S	HA	CYS	V	126
R	-	O	MET	A	89	L	S	HB2	CYS	V	126
R	-	O	MET	A	89	L	S	HB3	CYS	V	126
R	-	O	MET	A	89	L	S	HG	CYS	V	126
R	-	N	HIS	A	90	L	S	SG	CYS	V	126
R	-	N	HIS	A	90	L	S	HA	CYS	V	126
R	-	N	HIS	A	90	L	S	HB2	CYS	V	126
R	-	N	HIS	A	90	L	S	HG	CYS	V	126
R	-	CA	HIS	A	90	L	S	CA	CYS	V	126
R	-	CA	HIS	A	90	L	S	CB	CYS	V	126
R	-	CA	HIS	A	90	L	S	SG	CYS	V	126
R	-	CA	HIS	A	90	L	S	HA	CYS	V	126
R	-	CA	HIS	A	90	L	S	HB2	CYS	V	126
R	-	CA	HIS	A	90	L	S	HG	CYS	V	126
R	-	CB	HIS	A	90	L	S	HE22	GLN	V	4
R	-	CB	HIS	A	90	L	S	CA	CYS	V	126
R	-	CB	HIS	A	90	L	S	HA	CYS	V	126
R	-	CB	HIS	A	90	L	S	H	LEU	V	127
R	-	CG	HIS	A	90	L	S	CD	GLN	V	4
R	-	CG	HIS	A	90	L	S	OE1	GLN	V	4
R	-	CG	HIS	A	90	L	S	HE22	GLN	V	4
R	-	CG	HIS	A	90	L	S	HA	CYS	V	126
R	-	CG	HIS	A	90	L	S	N	LEU	V	127
R	-	CG	HIS	A	90	L	S	H	LEU	V	127
R	-	CD2	HIS	A	90	L	S	CD	GLN	V	4
R	-	CD2	HIS	A	90	L	S	NE2	GLN	V	4
R	-	CD2	HIS	A	90	L	S	OE1	GLN	V	4
R	-	CD2	HIS	A	90	L	S	HB3	GLN	V	4
R	-	CD2	HIS	A	90	L	S	HE22	GLN	V	4
R	-	CD2	HIS	A	90	L	S	H	LEU	V	127
R	-	ND1	HIS	A	90	L	S	OE1	GLN	V	4
R	-	ND1	HIS	A	90	L	S	CA	CYS	V	126
R	-	ND1	HIS	A	90	L	S	C	CYS	V	126
R	-	ND1	HIS	A	90	L	S	HA	CYS	V	126
R	-	ND1	HIS	A	90	L	S	N	LEU	V	127
R	-	ND1	HIS	A	90	L	S	CA	LEU	V	127
R	-	ND1	HIS	A	90	L	S	C	LEU	V	127
R	-	ND1	HIS	A	90	L	S	CB	LEU	V	127
R	-	ND1	HIS	A	90	L	S	O	LEU	V	127
R	-	ND1	HIS	A	90	L	S	H	LEU	V	127
R	-	ND1	HIS	A	90	L	S	HB2	LEU	V	127
R	-	ND1	HIS	A	90	L	S	HG	LEU	V	127
R	-	CE1	HIS	A	90	L	S	CD	GLN	V	4
R	-	CE1	HIS	A	90	L	S	OE1	GLN	V	4
R	-	CE1	HIS	A	90	L	S	HB3	GLN	V	4
R	-	CE1	HIS	A	90	L	S	N	LEU	V	127
R	-	CE1	HIS	A	90	L	S	CA	LEU	V	127
R	-	CE1	HIS	A	90	L	S	C	LEU	V	127
R	-	CE1	HIS	A	90	L	S	CB	LEU	V	127
R	-	CE1	HIS	A	90	L	S	O	LEU	V	127
R	-	CE1	HIS	A	90	L	S	CG	LEU	V	127
R	-	CE1	HIS	A	90	L	S	H	LEU	V	127
R	-	CE1	HIS	A	90	L	S	HB2	LEU	V	127
R	-	CE1	HIS	A	90	L	S	HG	LEU	V	127
R	-	CE1	HIS	A	90	L	S	HD11	LEU	V	127
R	-	NE2	HIS	A	90	L	S	CB	GLN	V	4
R	-	NE2	HIS	A	90	L	S	CG	GLN	V	4
R	-	NE2	HIS	A	90	L	S	CD	GLN	V	4
R	-	NE2	HIS	A	90	L	S	OE1	GLN	V	4
R	-	NE2	HIS	A	90	L	S	HB3	GLN	V	4
R	-	NE2	HIS	A	90	L	S	H	LEU	V	127
R	-	NE2	HIS	A	90	L	S	HB2	LEU	V	127
R	-	N	MET	A	91	L	S	SG	CYS	V	126
R	-	O	MET	A	91	L	S	O	LEU	V	127
R	S	CB	SER	A	117	L	S	O	VAL	V	3
R	S	OG	SER	A	117	L	S	HG11	VAL	V	3
R	S	OG	SER	A	117	L	S	HG3	LYS	V	6
R	S	OG	SER	A	117	L	S	HD2	LYS	V	6
R	S	OG	SER	A	117	L	S	HE3	LYS	V	6
R	S	O	LEU	A	118	L	-	HB1	ALA	V	2
R	-	O	ILE	A	192	L	-	OE2	GLU	V	92
R	-	N	GLN	A	194	L	S	HE1	HIS	V	93
R	-	N	GLN	A	194	L	S	HE2	HIS	V	93
R	-	CA	GLN	A	194	L	S	HE2	HIS	V	93
R	-	C	GLN	A	194	L	S	NE2	HIS	V	93
R	-	C	GLN	A	194	L	S	HE2	HIS	V	93
R	-	C	GLN	A	194	L	S	HE21	GLN	V	105
R	-	CB	GLN	A	194	L	S	NE2	GLN	V	105
R	-	CB	GLN	A	194	L	S	HE21	GLN	V	105
R	-	CB	GLN	A	194	L	S	HE22	GLN	V	105
R	-	O	GLN	A	194	L	S	CD2	HIS	V	93
R	-	O	GLN	A	194	L	S	CE1	HIS	V	93
R	-	O	GLN	A	194	L	S	NE2	HIS	V	93
R	-	O	GLN	A	194	L	S	HD2	HIS	V	93
R	-	O	GLN	A	194	L	S	HE1	HIS	V	93
R	-	O	GLN	A	194	L	S	HE2	HIS	V	93
R	-	O	GLN	A	194	L	S	NE2	GLN	V	105
R	-	O	GLN	A	194	L	S	HE21	GLN	V	105
R	-	O	GLN	A	194	L	S	HE22	GLN	V	105
R	-	O	GLN	A	194	L	S	HB3	PRO	V	107
R	-	OE1	GLN	A	194	L	S	HE22	GLN	V	105
R	-	N	THR	A	195	L	S	HE2	HIS	V	93
R	-	CA	THR	A	195	L	S	HG3	PRO	V	107
R	-	CB	THR	A	195	L	S	HG3	PRO	V	107
R	-	CG2	THR	A	195	L	-	NE2	GLN	V	70
R	-	CG2	THR	A	195	L	-	HE21	GLN	V	70
R	-	CG2	THR	A	195	L	-	HE22	GLN	V	70
R	-	CG2	THR	A	195	L	S	HG3	PRO	V	107
R	-	OG1	THR	A	195	L	S	HG3	PRO	V	107
R	-	CB	VAL	A	196	L	S	HB2	GLN	V	105
R	-	O	VAL	A	196	L	-	CG	GLN	V	70
R	-	O	VAL	A	196	L	-	CD	GLN	V	70
R	-	O	VAL	A	196	L	-	NE2	GLN	V	70
R	-	O	VAL	A	196	L	-	OE1	GLN	V	70
R	-	O	VAL	A	196	L	-	HB3	GLN	V	70
R	-	O	VAL	A	196	L	-	HG2	GLN	V	70
R	-	O	VAL	A	196	L	-	HE22	GLN	V	70
R	-	O	VAL	A	196	L	S	O	GLN	V	105
R	-	CG2	VAL	A	196	L	S	HB2	GLN	V	105
R	-	CG1	ILE	A	197	L	-	HG2	GLN	V	70
R	-	N	HIS	A	198	L	-	O	VAL	V	71
R	-	N	HIS	A	198	L	-	H	VAL	V	71
R	-	CA	HIS	A	198	L	-	O	VAL	V	71
R	-	CA	HIS	A	198	L	-	HB2	SER	V	73
R	-	C	HIS	A	198	L	-	C	VAL	V	71
R	-	C	HIS	A	198	L	-	O	VAL	V	71
R	-	C	HIS	A	198	L	-	H	VAL	V	71
R	-	C	HIS	A	198	L	-	HB	VAL	V	71
R	-	CB	HIS	A	198	L	-	O	VAL	V	71
R	-	CB	HIS	A	198	L	-	N	SER	V	73
R	-	CB	HIS	A	198	L	-	CB	SER	V	73
R	-	CB	HIS	A	198	L	-	H	SER	V	73
R	-	CB	HIS	A	198	L	-	HB2	SER	V	73
R	-	O	HIS	A	198	L	-	N	VAL	V	71
R	-	O	HIS	A	198	L	-	CA	VAL	V	71
R	-	O	HIS	A	198	L	-	C	VAL	V	71
R	-	O	HIS	A	198	L	-	CB	VAL	V	71
R	-	O	HIS	A	198	L	-	O	VAL	V	71
R	-	O	HIS	A	198	L	-	CG1	VAL	V	71
R	-	O	HIS	A	198	L	-	H	VAL	V	71
R	-	O	HIS	A	198	L	-	HB	VAL	V	71
R	-	O	HIS	A	198	L	-	HG11	VAL	V	71
R	-	O	HIS	A	198	L	-	N	SER	V	72
R	-	O	HIS	A	198	L	-	CA	SER	V	72
R	-	O	HIS	A	198	L	-	C	SER	V	72
R	-	O	HIS	A	198	L	-	O	SER	V	72
R	-	O	HIS	A	198	L	-	HA	SER	V	72
R	-	O	HIS	A	198	L	-	N	SER	V	73
R	-	O	HIS	A	198	L	-	H	SER	V	73
R	-	O	HIS	A	198	L	-	HA	SER	V	73
R	-	CG	HIS	A	198	L	-	CB	SER	V	73
R	-	CG	HIS	A	198	L	-	HB2	SER	V	73
R	-	CD2	HIS	A	198	L	-	HB2	SER	V	73
R	-	ND1	HIS	A	198	L	-	HB2	SER	V	73
R	-	N	THR	A	199	L	-	O	VAL	V	71
R	-	N	THR	A	199	L	-	HB	VAL	V	71
R	-	CA	THR	A	199	L	-	HB	VAL	V	71
R	-	C	THR	A	199	L	-	CG1	VAL	V	71
R	-	C	THR	A	199	L	-	HB	VAL	V	71
R	-	C	THR	A	199	L	-	HG11	VAL	V	71
R	-	C	THR	A	199	L	-	HG13	VAL	V	71
R	-	C	THR	A	199	L	-	O	SER	V	72
R	-	O	THR	A	199	L	S	HG23	THR	V	55
R	-	O	THR	A	199	L	-	CG1	VAL	V	71
R	-	O	THR	A	199	L	-	HB	VAL	V	71
R	-	O	THR	A	199	L	-	HG11	VAL	V	71
R	-	O	THR	A	199	L	-	HG13	VAL	V	71
R	-	O	THR	A	199	L	-	C	SER	V	72
R	-	O	THR	A	199	L	-	O	SER	V	72
R	-	O	THR	A	199	L	-	HA	SER	V	73
R	-	OG1	THR	A	199	L	-	HA	SER	V	73
R	-	OG1	THR	A	199	L	-	HB2	SER	V	73
R	-	N	VAL	A	200	L	-	CG1	VAL	V	71
R	-	N	VAL	A	200	L	-	HB	VAL	V	71
R	-	N	VAL	A	200	L	-	HG11	VAL	V	71
R	-	N	VAL	A	200	L	-	HG13	VAL	V	71
R	-	CA	VAL	A	200	L	S	CG2	THR	V	55
R	-	CA	VAL	A	200	L	S	HG21	THR	V	55
R	-	CA	VAL	A	200	L	-	CG1	VAL	V	71
R	-	CA	VAL	A	200	L	-	HG11	VAL	V	71
R	-	CA	VAL	A	200	L	-	HG13	VAL	V	71
R	-	C	VAL	A	200	L	S	HG21	THR	V	55
R	-	CB	VAL	A	200	L	S	HG21	THR	V	55
R	-	CB	VAL	A	200	L	-	HG13	VAL	V	71
R	-	CG1	VAL	A	200	L	-	HB2	SER	V	53
R	-	CG1	VAL	A	200	L	S	HG21	THR	V	55
R	-	CG1	VAL	A	200	L	-	HG13	VAL	V	71
R	-	CG2	VAL	A	200	L	-	HG13	VAL	V	71
R	-	CG2	VAL	A	200	L	-	HG23	VAL	V	71
R	-	N	GLN	A	201	L	S	CG2	THR	V	55
R	-	N	GLN	A	201	L	S	HG21	THR	V	55
R	-	N	GLN	A	201	L	S	HG22	THR	V	55
R	-	N	GLN	A	201	L	S	HG23	THR	V	55
R	-	C	GLN	A	201	L	-	O	SER	V	53
R	-	C	GLN	A	201	L	-	HB2	SER	V	53
R	-	C	GLN	A	201	L	S	HG22	THR	V	55
R	-	O	GLN	A	201	L	-	CA	SER	V	53
R	-	O	GLN	A	201	L	-	C	SER	V	53
R	-	O	GLN	A	201	L	-	O	SER	V	53
R	-	O	GLN	A	201	L	-	HA	SER	V	53
R	-	O	GLN	A	201	L	-	HB2	SER	V	53
R	-	O	GLN	A	201	L	-	N	ALA	V	54
R	-	O	GLN	A	201	L	-	O	ALA	V	54
R	-	O	GLN	A	201	L	-	HB2	ALA	V	54
R	-	O	GLN	A	201	L	S	CG2	THR	V	55
R	-	O	GLN	A	201	L	S	HG22	THR	V	55
R	-	N	SER	A	202	L	-	O	SER	V	53
R	-	N	SER	A	202	L	-	HB2	SER	V	53
R	-	CA	SER	A	202	L	-	O	SER	V	53
R	-	CA	SER	A	202	L	-	HA	SER	V	53
R	-	CA	SER	A	202	L	-	HB2	SER	V	53
R	-	C	SER	A	202	L	-	HA	SER	V	53
R	-	N	ALA	A	203	L	-	O	SER	V	52
R	-	N	ALA	A	203	L	-	HA	SER	V	53
R	-	C	ALA	A	203	L	-	O	SER	V	52
R	-	O	ALA	A	203	L	-	C	SER	V	52
R	-	O	ALA	A	203	L	-	O	SER	V	52
R	-	O	ALA	A	203	L	-	HA	SER	V	52
R	-	O	ALA	A	203	L	-	HA	SER	V	53
R	-	OE1	GLN	A	206	L	-	H	GLY	V	28
R	-	CB	PHE	A	208	L	-	CD	GLU	V	29
R	-	CB	PHE	A	208	L	-	OE1	GLU	V	29
R	-	O	PHE	A	208	L	-	OE1	GLU	V	29
R	-	CD2	PHE	A	208	L	-	HB2	SER	V	27
R	-	CE2	PHE	A	208	L	-	HB2	SER	V	27
R	-	C	SER	A	209	L	-	HH22	ARG	V	31
R	-	O	SER	A	209	L	-	NH2	ARG	V	31
R	-	O	SER	A	209	L	-	HH22	ARG	V	31
R	-	CB	ALA	A	213	L	-	H2	MET	V	1
R	-	CB	ALA	A	213	L	-	H3	MET	V	1
R	-	CB	PRO	A	216	L	S	CG2	VAL	V	3
R	-	CB	PRO	A	216	L	S	HG21	VAL	V	3
R	-	CB	PRO	A	216	L	S	HG22	VAL	V	3
R	-	CG	PRO	A	216	L	S	HG21	VAL	V	3
R	-	CG	MET	A	218	L	S	NZ	LYS	V	6
R	-	CG	MET	A	218	L	S	HZ1	LYS	V	6
R	-	CG	MET	A	218	L	S	HZ2	LYS	V	6
R	-	CG	MET	A	218	L	S	HZ3	LYS	V	6
R	-	SD	MET	A	218	L	S	NZ	LYS	V	6
R	-	SD	MET	A	218	L	S	HZ1	LYS	V	6
R	-	SD	MET	A	218	L	S	HZ3	LYS	V	6
R	-	CD1	LEU	A	249	L	-	HB2	ALA	V	10
R	-	CD2	LEU	A	249	L	-	H	ALA	V	10
R	-	CD2	LEU	A	249	L	-	HB2	ALA	V	10
R	-	CD2	LEU	A	249	L	-	HB3	ALA	V	10
R	-	CB	PRO	A	250	L	S	HH2	TRP	V	17
R	-	CG	PRO	A	250	L	S	HH2	TRP	V	17
R	S	CD	GLN	A	350	L	S	CD1	PHE	V	8
R	S	CD	GLN	A	350	L	S	HD1	PHE	V	8
R	S	NE2	GLN	A	350	L	S	HD1	PHE	V	8
R	S	OE1	GLN	A	350	L	S	CG	PHE	V	8
R	S	OE1	GLN	A	350	L	S	CD1	PHE	V	8
R	S	OE1	GLN	A	350	L	S	CE1	PHE	V	8
R	S	OE1	GLN	A	350	L	S	HB3	PHE	V	8
R	S	OE1	GLN	A	350	L	S	HD1	PHE	V	8
R	S	OE1	GLN	A	350	L	S	HE1	PHE	V	8

- 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