IID

O95803_Q969S8.1 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	PHE	A	11	L	-	TRP	V	18
R	H	PHE	A	11	L	-	ASP	V	19
R	H	PHE	A	11	L	-	ASP	V	20
R	H	PHE	A	11	L	H	GLN	V	84
R	H	GLN	A	12	L	-	PRO	V	21
R	H	VAL	A	15	L	-	ASP	V	20
R	H	ILE	A	16	L	-	ARG	V	377
R	H	ALA	A	19	L	-	ARG	V	377
R	H	THR	A	20	L	-	ARG	V	377
R	H	CYS	A	22	L	H	GLY	V	88
R	H	CYS	A	22	L	H	GLN	V	89
R	H	MET	A	23	L	-	PRO	V	204
R	H	MET	A	23	L	-	PHE	V	205
R	H	MET	A	23	L	-	ASP	V	91
R	H	VAL	A	24	L	-	GLY	V	376
R	H	ILE	A	26	L	-	ASP	V	91
R	H	ILE	A	27	L	-	GLY	V	376
R	H	ILE	A	27	L	-	ARG	V	377
R	-	LYS	A	316	L	-	SER	V	56
R	-	LYS	A	316	L	H	GLU	V	58
R	-	GLU	A	317	L	H	LYS	V	160
R	-	GLY	A	318	L	H	GLN	V	159
R	-	GLY	A	318	L	H	LYS	V	160
R	-	THR	A	319	L	H	GLN	V	159
R	-	THR	A	319	L	H	GLU	V	58
R	-	HIS	A	482	L	H	GLU	V	58
R	-	HIS	A	482	L	H	PRO	V	66
R	-	ILE	A	484	L	H	GLN	V	159
R	-	PHE	A	485	L	H	GLN	V	159
R	-	PHE	A	485	L	H	LEU	V	62
R	H	LYS	A	487	L	-	ASP	V	185
R	H	GLU	A	488	L	-	ARG	V	138
R	H	GLU	A	488	L	H	GLY	V	61
R	H	GLU	A	488	L	H	LEU	V	62
R	H	GLU	A	488	L	-	VAL	V	63
R	-	TYR	A	489	L	-	ARG	V	138
R	-	PRO	A	490	L	-	ARG	V	138
R	-	PRO	A	490	L	H	PRO	V	66
R	-	PRO	A	490	L	H	GLU	V	67
R	-	GLY	A	491	L	-	ARG	V	138
R	-	GLY	A	492	L	-	ARG	V	138
R	-	ASN	A	526	L	H	GLN	V	159
R	H	HIS	A	8	L	-	ASP	V	19
R	H	HIS	A	8	L	-	PRO	V	21

- 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

O95803_Q969S8.1 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	ND1	HIS	A	8	L	-	OD2	ASP	V	19
R	H	CE1	HIS	A	8	L	-	CB	ASP	V	19
R	H	CE1	HIS	A	8	L	-	CG	ASP	V	19
R	H	CE1	HIS	A	8	L	-	OD2	ASP	V	19
R	H	CE1	HIS	A	8	L	-	HB3	ASP	V	19
R	H	NE2	HIS	A	8	L	-	HB3	ASP	V	19
R	H	NE2	HIS	A	8	L	-	HG2	PRO	V	21
R	H	CG	PHE	A	11	L	-	O	ASP	V	19
R	H	CG	PHE	A	11	L	-	HB2	ASP	V	19
R	H	CD1	PHE	A	11	L	-	C	ASP	V	19
R	H	CD1	PHE	A	11	L	-	CB	ASP	V	19
R	H	CD1	PHE	A	11	L	-	O	ASP	V	19
R	H	CD1	PHE	A	11	L	-	HB2	ASP	V	19
R	H	CD1	PHE	A	11	L	-	HB3	ASP	V	19
R	H	CE1	PHE	A	11	L	-	HD1	TRP	V	18
R	H	CE1	PHE	A	11	L	-	N	ASP	V	19
R	H	CE1	PHE	A	11	L	-	CA	ASP	V	19
R	H	CE1	PHE	A	11	L	-	C	ASP	V	19
R	H	CE1	PHE	A	11	L	-	CB	ASP	V	19
R	H	CE1	PHE	A	11	L	-	O	ASP	V	19
R	H	CE1	PHE	A	11	L	-	H	ASP	V	19
R	H	CE1	PHE	A	11	L	-	HB2	ASP	V	19
R	H	CE1	PHE	A	11	L	-	HB3	ASP	V	19
R	H	CE1	PHE	A	11	L	-	N	ASP	V	20
R	H	CE1	PHE	A	11	L	-	HA	ASP	V	20
R	H	CE2	PHE	A	11	L	-	O	ASP	V	19
R	H	CE2	PHE	A	11	L	H	NE2	GLN	V	84
R	H	CE2	PHE	A	11	L	H	HE21	GLN	V	84
R	H	CE2	PHE	A	11	L	H	HE22	GLN	V	84
R	H	CZ	PHE	A	11	L	-	HB2	TRP	V	18
R	H	CZ	PHE	A	11	L	-	HD1	TRP	V	18
R	H	CZ	PHE	A	11	L	-	N	ASP	V	19
R	H	CZ	PHE	A	11	L	-	C	ASP	V	19
R	H	CZ	PHE	A	11	L	-	O	ASP	V	19
R	H	CZ	PHE	A	11	L	-	H	ASP	V	19
R	H	CZ	PHE	A	11	L	-	HB2	ASP	V	19
R	H	CZ	PHE	A	11	L	H	NE2	GLN	V	84
R	H	CZ	PHE	A	11	L	H	HE21	GLN	V	84
R	H	CZ	PHE	A	11	L	H	HE22	GLN	V	84
R	H	CB	GLN	A	12	L	-	HG3	PRO	V	21
R	H	CG	GLN	A	12	L	-	CG	PRO	V	21
R	H	CG	GLN	A	12	L	-	CD	PRO	V	21
R	H	CG	GLN	A	12	L	-	HG2	PRO	V	21
R	H	CG	GLN	A	12	L	-	HG3	PRO	V	21
R	H	CG	GLN	A	12	L	-	HD2	PRO	V	21
R	H	CG	GLN	A	12	L	-	HD3	PRO	V	21
R	H	CD	GLN	A	12	L	-	CG	PRO	V	21
R	H	CD	GLN	A	12	L	-	HG2	PRO	V	21
R	H	CD	GLN	A	12	L	-	HG3	PRO	V	21
R	H	NE2	GLN	A	12	L	-	CB	PRO	V	21
R	H	NE2	GLN	A	12	L	-	CG	PRO	V	21
R	H	NE2	GLN	A	12	L	-	CD	PRO	V	21
R	H	NE2	GLN	A	12	L	-	HB2	PRO	V	21
R	H	NE2	GLN	A	12	L	-	HB3	PRO	V	21
R	H	NE2	GLN	A	12	L	-	HG2	PRO	V	21
R	H	NE2	GLN	A	12	L	-	HG3	PRO	V	21
R	H	OE1	GLN	A	12	L	-	HG3	PRO	V	21
R	H	CG1	VAL	A	15	L	-	CG	ASP	V	20
R	H	CG1	VAL	A	15	L	-	OD1	ASP	V	20
R	H	CA	ILE	A	16	L	-	NH1	ARG	V	377
R	H	CA	ILE	A	16	L	-	HH12	ARG	V	377
R	H	C	ILE	A	16	L	-	NH1	ARG	V	377
R	H	C	ILE	A	16	L	-	HH11	ARG	V	377
R	H	C	ILE	A	16	L	-	HH12	ARG	V	377
R	H	CB	ILE	A	16	L	-	HH12	ARG	V	377
R	H	O	ILE	A	16	L	-	NH1	ARG	V	377
R	H	O	ILE	A	16	L	-	HH11	ARG	V	377
R	H	O	ILE	A	16	L	-	HH12	ARG	V	377
R	H	CG1	ILE	A	16	L	-	HH12	ARG	V	377
R	H	CG2	ILE	A	16	L	-	NH1	ARG	V	377
R	H	CG2	ILE	A	16	L	-	HH11	ARG	V	377
R	H	CG2	ILE	A	16	L	-	HH12	ARG	V	377
R	H	C	ALA	A	19	L	-	HH11	ARG	V	377
R	H	CB	ALA	A	19	L	-	NH1	ARG	V	377
R	H	CB	ALA	A	19	L	-	HH11	ARG	V	377
R	H	CB	ALA	A	19	L	-	HH12	ARG	V	377
R	H	N	THR	A	20	L	-	NH1	ARG	V	377
R	H	N	THR	A	20	L	-	HD3	ARG	V	377
R	H	N	THR	A	20	L	-	HH11	ARG	V	377
R	H	N	THR	A	20	L	-	HH12	ARG	V	377
R	H	CA	THR	A	20	L	-	HD3	ARG	V	377
R	H	CA	THR	A	20	L	-	HH11	ARG	V	377
R	H	CB	THR	A	20	L	-	CD	ARG	V	377
R	H	CB	THR	A	20	L	-	HD2	ARG	V	377
R	H	CB	THR	A	20	L	-	HD3	ARG	V	377
R	H	CB	THR	A	20	L	-	HH11	ARG	V	377
R	H	CG2	THR	A	20	L	-	CB	ARG	V	377
R	H	CG2	THR	A	20	L	-	CG	ARG	V	377
R	H	CG2	THR	A	20	L	-	CD	ARG	V	377
R	H	CG2	THR	A	20	L	-	NE	ARG	V	377
R	H	CG2	THR	A	20	L	-	NH1	ARG	V	377
R	H	CG2	THR	A	20	L	-	CZ	ARG	V	377
R	H	CG2	THR	A	20	L	-	HB2	ARG	V	377
R	H	CG2	THR	A	20	L	-	HB3	ARG	V	377
R	H	CG2	THR	A	20	L	-	HD2	ARG	V	377
R	H	CG2	THR	A	20	L	-	HD3	ARG	V	377
R	H	CG2	THR	A	20	L	-	HH11	ARG	V	377
R	H	CG2	THR	A	20	L	-	HH12	ARG	V	377
R	H	OG1	THR	A	20	L	-	HH11	ARG	V	377
R	H	SG	CYS	A	22	L	H	C	GLY	V	88
R	H	SG	CYS	A	22	L	H	O	GLY	V	88
R	H	SG	CYS	A	22	L	H	HA	GLN	V	89
R	H	CG	MET	A	23	L	-	OD1	ASP	V	91
R	H	SD	MET	A	23	L	-	CG	ASP	V	91
R	H	SD	MET	A	23	L	-	OD1	ASP	V	91
R	H	SD	MET	A	23	L	-	OD2	ASP	V	91
R	H	SD	MET	A	23	L	-	HB2	ASP	V	91
R	H	CE	MET	A	23	L	-	O	PRO	V	204
R	H	CE	MET	A	23	L	-	CD2	PHE	V	205
R	H	CE	MET	A	23	L	-	HB3	PHE	V	205
R	H	CE	MET	A	23	L	-	HD2	PHE	V	205
R	H	CG2	VAL	A	24	L	-	HA3	GLY	V	376
R	H	CD1	ILE	A	26	L	-	HB2	ASP	V	91
R	H	CD1	ILE	A	27	L	-	CA	GLY	V	376
R	H	CD1	ILE	A	27	L	-	HA2	GLY	V	376
R	H	CD1	ILE	A	27	L	-	HA3	GLY	V	376
R	H	CD1	ILE	A	27	L	-	H	ARG	V	377
R	-	CD	LYS	A	316	L	H	OE2	GLU	V	58
R	-	CE	LYS	A	316	L	H	OE2	GLU	V	58
R	-	NZ	LYS	A	316	L	-	OG	SER	V	56
R	-	NZ	LYS	A	316	L	-	HB2	SER	V	56
R	-	NZ	LYS	A	316	L	-	HB3	SER	V	56
R	-	NZ	LYS	A	316	L	H	OE2	GLU	V	58
R	-	NZ	LYS	A	316	L	H	HB2	GLU	V	58
R	-	C	GLU	A	317	L	H	HA	LYS	V	160
R	-	C	GLU	A	317	L	H	HG3	LYS	V	160
R	-	CB	GLU	A	317	L	H	HG3	LYS	V	160
R	-	O	GLU	A	317	L	H	HA	LYS	V	160
R	-	O	GLU	A	317	L	H	HG3	LYS	V	160
R	-	CG	GLU	A	317	L	H	HG3	LYS	V	160
R	-	CD	GLU	A	317	L	H	HG2	LYS	V	160
R	-	CD	GLU	A	317	L	H	HG3	LYS	V	160
R	-	CD	GLU	A	317	L	H	HE3	LYS	V	160
R	-	OE1	GLU	A	317	L	H	O	LYS	V	160
R	-	OE1	GLU	A	317	L	H	CG	LYS	V	160
R	-	OE1	GLU	A	317	L	H	HG2	LYS	V	160
R	-	OE1	GLU	A	317	L	H	HG3	LYS	V	160
R	-	OE1	GLU	A	317	L	H	HE2	LYS	V	160
R	-	OE2	GLU	A	317	L	H	HG3	LYS	V	160
R	-	OE2	GLU	A	317	L	H	HE3	LYS	V	160
R	-	N	GLY	A	318	L	H	HA	LYS	V	160
R	-	CA	GLY	A	318	L	H	C	GLN	V	159
R	-	CA	GLY	A	318	L	H	O	GLN	V	159
R	-	CA	GLY	A	318	L	H	HG2	GLN	V	159
R	-	CA	GLY	A	318	L	H	HA	LYS	V	160
R	-	C	GLY	A	318	L	H	O	GLN	V	159
R	-	C	GLY	A	318	L	H	CG	GLN	V	159
R	-	C	GLY	A	318	L	H	HG2	GLN	V	159
R	-	C	GLY	A	318	L	H	HG3	GLN	V	159
R	-	O	GLY	A	318	L	H	O	GLN	V	159
R	-	O	GLY	A	318	L	H	CG	GLN	V	159
R	-	O	GLY	A	318	L	H	CD	GLN	V	159
R	-	O	GLY	A	318	L	H	NE2	GLN	V	159
R	-	O	GLY	A	318	L	H	HG2	GLN	V	159
R	-	O	GLY	A	318	L	H	HG3	GLN	V	159
R	-	O	GLY	A	318	L	H	HE21	GLN	V	159
R	-	N	THR	A	319	L	H	HG2	GLN	V	159
R	-	CG2	THR	A	319	L	H	OE1	GLU	V	58
R	-	CG2	THR	A	319	L	H	CD	GLN	V	159
R	-	CG2	THR	A	319	L	H	NE2	GLN	V	159
R	-	CG2	THR	A	319	L	H	HE21	GLN	V	159
R	-	CG2	THR	A	319	L	H	HE22	GLN	V	159
R	-	CA	HIS	A	482	L	H	HG3	GLU	V	58
R	-	CB	HIS	A	482	L	H	HA	GLU	V	58
R	-	CB	HIS	A	482	L	H	HG3	GLU	V	58
R	-	CG	HIS	A	482	L	H	HG3	PRO	V	66
R	-	CD2	HIS	A	482	L	H	CG	PRO	V	66
R	-	CD2	HIS	A	482	L	H	HG2	PRO	V	66
R	-	CD2	HIS	A	482	L	H	HG3	PRO	V	66
R	-	CE1	HIS	A	482	L	H	HG2	PRO	V	66
R	-	CE1	HIS	A	482	L	H	HG3	PRO	V	66
R	-	NE2	HIS	A	482	L	H	CB	PRO	V	66
R	-	NE2	HIS	A	482	L	H	CG	PRO	V	66
R	-	NE2	HIS	A	482	L	H	HB3	PRO	V	66
R	-	NE2	HIS	A	482	L	H	HG2	PRO	V	66
R	-	NE2	HIS	A	482	L	H	HG3	PRO	V	66
R	-	CG2	ILE	A	484	L	H	HE21	GLN	V	159
R	-	CD1	ILE	A	484	L	H	NE2	GLN	V	159
R	-	CD1	ILE	A	484	L	H	HE21	GLN	V	159
R	-	CD1	ILE	A	484	L	H	HE22	GLN	V	159
R	-	CE2	PHE	A	485	L	H	HD22	LEU	V	62
R	-	CE2	PHE	A	485	L	H	NE2	GLN	V	159
R	-	CE2	PHE	A	485	L	H	HB2	GLN	V	159
R	-	CE2	PHE	A	485	L	H	HG3	GLN	V	159
R	-	CE2	PHE	A	485	L	H	HE21	GLN	V	159
R	-	CZ	PHE	A	485	L	H	CG	GLN	V	159
R	-	CZ	PHE	A	485	L	H	HB2	GLN	V	159
R	-	CZ	PHE	A	485	L	H	HG3	GLN	V	159
R	-	CZ	PHE	A	485	L	H	HE21	GLN	V	159
R	H	CD	LYS	A	487	L	-	OD2	ASP	V	185
R	H	CE	LYS	A	487	L	-	OD2	ASP	V	185
R	H	NZ	LYS	A	487	L	-	O	ASP	V	185
R	H	NZ	LYS	A	487	L	-	CG	ASP	V	185
R	H	NZ	LYS	A	487	L	-	OD2	ASP	V	185
R	H	CA	GLU	A	488	L	-	HH21	ARG	V	138
R	H	C	GLU	A	488	L	-	NH2	ARG	V	138
R	H	C	GLU	A	488	L	-	HH21	ARG	V	138
R	H	C	GLU	A	488	L	-	HH22	ARG	V	138
R	H	O	GLU	A	488	L	-	NH2	ARG	V	138
R	H	O	GLU	A	488	L	-	HE	ARG	V	138
R	H	O	GLU	A	488	L	-	HH21	ARG	V	138
R	H	O	GLU	A	488	L	-	HH22	ARG	V	138
R	H	CG	GLU	A	488	L	H	O	LEU	V	62
R	H	CD	GLU	A	488	L	H	CA	LEU	V	62
R	H	CD	GLU	A	488	L	H	C	LEU	V	62
R	H	CD	GLU	A	488	L	H	O	LEU	V	62
R	H	CD	GLU	A	488	L	H	HA	LEU	V	62
R	H	CD	GLU	A	488	L	-	HA	VAL	V	63
R	H	OE1	GLU	A	488	L	H	C	LEU	V	62
R	H	OE1	GLU	A	488	L	H	O	LEU	V	62
R	H	OE1	GLU	A	488	L	H	HA	LEU	V	62
R	H	OE1	GLU	A	488	L	H	HB3	LEU	V	62
R	H	OE1	GLU	A	488	L	-	HA	VAL	V	63
R	H	OE1	GLU	A	488	L	-	HG11	VAL	V	63
R	H	OE2	GLU	A	488	L	H	O	GLY	V	61
R	H	OE2	GLU	A	488	L	H	CA	LEU	V	62
R	H	OE2	GLU	A	488	L	H	C	LEU	V	62
R	H	OE2	GLU	A	488	L	H	O	LEU	V	62
R	H	OE2	GLU	A	488	L	H	HA	LEU	V	62
R	H	OE2	GLU	A	488	L	H	HD21	LEU	V	62
R	-	N	TYR	A	489	L	-	NH2	ARG	V	138
R	-	N	TYR	A	489	L	-	HH21	ARG	V	138
R	-	N	TYR	A	489	L	-	HH22	ARG	V	138
R	-	CA	TYR	A	489	L	-	HH21	ARG	V	138
R	-	CA	TYR	A	489	L	-	HH22	ARG	V	138
R	-	C	TYR	A	489	L	-	NH2	ARG	V	138
R	-	C	TYR	A	489	L	-	HH21	ARG	V	138
R	-	C	TYR	A	489	L	-	HH22	ARG	V	138
R	-	O	TYR	A	489	L	-	NH1	ARG	V	138
R	-	O	TYR	A	489	L	-	NH2	ARG	V	138
R	-	O	TYR	A	489	L	-	CZ	ARG	V	138
R	-	O	TYR	A	489	L	-	HH12	ARG	V	138
R	-	O	TYR	A	489	L	-	HH21	ARG	V	138
R	-	O	TYR	A	489	L	-	HH22	ARG	V	138
R	-	N	PRO	A	490	L	-	NH2	ARG	V	138
R	-	N	PRO	A	490	L	-	HH21	ARG	V	138
R	-	N	PRO	A	490	L	-	HH22	ARG	V	138
R	-	CA	PRO	A	490	L	H	HD3	PRO	V	66
R	-	CA	PRO	A	490	L	-	NH2	ARG	V	138
R	-	CA	PRO	A	490	L	-	HH21	ARG	V	138
R	-	CA	PRO	A	490	L	-	HH22	ARG	V	138
R	-	C	PRO	A	490	L	-	HH22	ARG	V	138
R	-	CB	PRO	A	490	L	H	HG2	PRO	V	66
R	-	CB	PRO	A	490	L	H	HD3	PRO	V	66
R	-	CB	PRO	A	490	L	H	OE1	GLU	V	67
R	-	CG	PRO	A	490	L	H	CG	PRO	V	66
R	-	CG	PRO	A	490	L	H	CD	PRO	V	66
R	-	CG	PRO	A	490	L	H	HG2	PRO	V	66
R	-	CG	PRO	A	490	L	H	HD2	PRO	V	66
R	-	CG	PRO	A	490	L	H	HD3	PRO	V	66
R	-	N	GLY	A	491	L	-	NH2	ARG	V	138
R	-	N	GLY	A	491	L	-	HH12	ARG	V	138
R	-	N	GLY	A	491	L	-	HH22	ARG	V	138
R	-	CA	GLY	A	491	L	-	HH12	ARG	V	138
R	-	CA	GLY	A	491	L	-	HH22	ARG	V	138
R	-	C	GLY	A	491	L	-	HH12	ARG	V	138
R	-	C	GLY	A	491	L	-	HH22	ARG	V	138
R	-	O	GLY	A	491	L	-	HH12	ARG	V	138
R	-	N	GLY	A	492	L	-	NH1	ARG	V	138
R	-	N	GLY	A	492	L	-	NH2	ARG	V	138
R	-	N	GLY	A	492	L	-	HH12	ARG	V	138
R	-	N	GLY	A	492	L	-	HH22	ARG	V	138
R	-	CA	GLY	A	492	L	-	NH1	ARG	V	138
R	-	CA	GLY	A	492	L	-	HH12	ARG	V	138
R	-	CA	GLY	A	492	L	-	HH22	ARG	V	138
R	-	ND2	ASN	A	526	L	H	HE21	GLN	V	159
R	-	OD1	ASN	A	526	L	H	HG3	GLN	V	159

- 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