IID

O15303_Q401N2.1 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	678	L	-	LYS	V	199
R	H	GLY	A	682	L	-	LYS	V	199
R	H	GLY	A	682	L	S	VAL	V	203
R	-	LYS	A	683	L	S	VAL	V	203
R	-	LYS	A	683	L	S	LYS	V	227
R	-	LYS	A	683	L	-	THR	V	229
R	-	ARG	A	684	L	S	VAL	V	203
R	-	ARG	A	684	L	S	LYS	V	227
R	-	ARG	A	684	L	-	THR	V	229
R	-	ARG	A	684	L	H	LEU	V	231
R	-	SER	A	685	L	-	LYS	V	199
R	-	SER	A	685	L	-	THR	V	229
R	-	SER	A	685	L	H	LEU	V	231
R	-	VAL	A	686	L	-	LYS	V	199
R	-	VAL	A	686	L	-	ARG	V	200
R	-	VAL	A	686	L	-	THR	V	229
R	-	THR	A	687	L	H	LEU	V	231
R	-	PRO	A	688	L	-	LYS	V	199
R	-	PRO	A	776	L	-	ASN	V	193
R	-	PRO	A	776	L	-	GLU	V	194
R	-	PRO	A	776	L	-	ILE	V	195
R	-	GLU	A	777	L	S	VAL	V	192
R	-	GLU	A	777	L	-	ASN	V	193
R	-	GLU	A	777	L	-	GLU	V	194
R	-	THR	A	778	L	-	GLU	V	194
R	-	THR	A	778	L	-	ILE	V	195
R	-	THR	A	778	L	-	VAL	V	196
R	-	ARG	A	856	L	-	ARG	V	131
R	-	ARG	A	856	L	-	ASP	V	132
R	-	ARG	A	856	L	S	ALA	V	150
R	-	ARG	A	856	L	S	MET	V	84
R	-	SER	A	857	L	-	ARG	V	131
R	-	LEU	A	858	L	S	ASN	V	70
R	-	LEU	A	858	L	-	PHE	V	72
R	-	LEU	A	858	L	S	SER	V	83
R	-	LEU	A	858	L	S	MET	V	84
R	-	ALA	A	860	L	S	TRP	V	127
R	-	ALA	A	860	L	S	ASP	V	129
R	-	ALA	A	860	L	-	ARG	V	131
R	-	ALA	A	860	L	S	ALA	V	152
R	-	ALA	A	860	L	-	PHE	V	72
R	-	THR	A	861	L	S	TRP	V	127
R	-	THR	A	861	L	S	ALA	V	152
R	-	THR	A	861	L	S	THR	V	153
R	-	THR	A	861	L	S	GLU	V	154
R	-	THR	A	861	L	-	PHE	V	72
R	-	THR	A	861	L	S	SER	V	82
R	-	SER	A	862	L	S	GLU	V	154
R	-	THR	A	863	L	S	TRP	V	127
R	-	VAL	A	864	L	S	LEU	V	126
R	-	VAL	A	864	L	S	TRP	V	127
R	-	VAL	A	864	L	S	GLU	V	154
R	-	ALA	A	865	L	S	LEU	V	126
R	-	ALA	A	865	L	S	TRP	V	127
R	-	ALA	A	866	L	S	LEU	V	126
R	-	ALA	A	873	L	-	THR	V	181
R	-	ALA	A	873	L	-	LEU	V	216
R	-	GLU	A	874	L	-	THR	V	181
R	-	GLU	A	874	L	-	LEU	V	216
R	-	GLU	A	874	L	-	ARG	V	409
R	-	ALA	A	875	L	-	THR	V	181
R	-	ALA	A	875	L	-	ALA	V	182
R	-	ALA	A	875	L	-	MET	V	183
R	-	ALA	A	875	L	-	LEU	V	216
R	-	HIS	A	876	L	-	THR	V	181
R	-	HIS	A	876	L	-	ALA	V	182
R	-	HIS	A	876	L	-	MET	V	183
R	-	HIS	A	876	L	-	GLN	V	215
R	-	HIS	A	876	L	-	LEU	V	216
R	-	LYS	A	877	L	-	GLN	V	214

- 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

O15303_Q401N2.1 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	O	ILE	A	678	L	-	HE3	LYS	V	199
R	H	CG2	ILE	A	678	L	-	HZ1	LYS	V	199
R	H	CA	GLY	A	682	L	-	HG3	LYS	V	199
R	H	CA	GLY	A	682	L	-	HE3	LYS	V	199
R	H	C	GLY	A	682	L	S	HG12	VAL	V	203
R	H	C	GLY	A	682	L	S	HG23	VAL	V	203
R	H	O	GLY	A	682	L	S	CB	VAL	V	203
R	H	O	GLY	A	682	L	S	CG1	VAL	V	203
R	H	O	GLY	A	682	L	S	CG2	VAL	V	203
R	H	O	GLY	A	682	L	S	HG12	VAL	V	203
R	H	O	GLY	A	682	L	S	HG13	VAL	V	203
R	H	O	GLY	A	682	L	S	HG21	VAL	V	203
R	H	O	GLY	A	682	L	S	HG22	VAL	V	203
R	H	O	GLY	A	682	L	S	HG23	VAL	V	203
R	-	N	LYS	A	683	L	S	HG12	VAL	V	203
R	-	N	LYS	A	683	L	S	HG23	VAL	V	203
R	-	CA	LYS	A	683	L	S	CG1	VAL	V	203
R	-	CA	LYS	A	683	L	S	HG12	VAL	V	203
R	-	CA	LYS	A	683	L	S	HG23	VAL	V	203
R	-	C	LYS	A	683	L	S	HG12	VAL	V	203
R	-	C	LYS	A	683	L	S	HG23	VAL	V	203
R	-	C	LYS	A	683	L	S	HD3	LYS	V	227
R	-	C	LYS	A	683	L	-	HG22	THR	V	229
R	-	CB	LYS	A	683	L	S	HG12	VAL	V	203
R	-	O	LYS	A	683	L	S	HB	VAL	V	203
R	-	O	LYS	A	683	L	S	HG12	VAL	V	203
R	-	O	LYS	A	683	L	S	HG23	VAL	V	203
R	-	O	LYS	A	683	L	S	CD	LYS	V	227
R	-	O	LYS	A	683	L	S	HG3	LYS	V	227
R	-	O	LYS	A	683	L	S	HD3	LYS	V	227
R	-	O	LYS	A	683	L	S	HE2	LYS	V	227
R	-	O	LYS	A	683	L	S	HZ2	LYS	V	227
R	-	O	LYS	A	683	L	-	HA	THR	V	229
R	-	O	LYS	A	683	L	-	HG22	THR	V	229
R	-	CG	LYS	A	683	L	S	HG12	VAL	V	203
R	-	N	ARG	A	684	L	S	HG23	VAL	V	203
R	-	N	ARG	A	684	L	-	HG22	THR	V	229
R	-	CA	ARG	A	684	L	-	HA	THR	V	229
R	-	CA	ARG	A	684	L	-	HB	THR	V	229
R	-	CA	ARG	A	684	L	-	HG22	THR	V	229
R	-	C	ARG	A	684	L	-	CA	THR	V	229
R	-	C	ARG	A	684	L	-	CB	THR	V	229
R	-	C	ARG	A	684	L	-	CG2	THR	V	229
R	-	C	ARG	A	684	L	-	HA	THR	V	229
R	-	C	ARG	A	684	L	-	HB	THR	V	229
R	-	C	ARG	A	684	L	-	HG21	THR	V	229
R	-	C	ARG	A	684	L	-	HG22	THR	V	229
R	-	O	ARG	A	684	L	-	CA	THR	V	229
R	-	O	ARG	A	684	L	-	C	THR	V	229
R	-	O	ARG	A	684	L	-	CB	THR	V	229
R	-	O	ARG	A	684	L	-	O	THR	V	229
R	-	O	ARG	A	684	L	-	CG2	THR	V	229
R	-	O	ARG	A	684	L	-	OG1	THR	V	229
R	-	O	ARG	A	684	L	-	HA	THR	V	229
R	-	O	ARG	A	684	L	-	HB	THR	V	229
R	-	O	ARG	A	684	L	-	HG21	THR	V	229
R	-	O	ARG	A	684	L	-	HG22	THR	V	229
R	-	O	ARG	A	684	L	H	HB2	LEU	V	231
R	-	CG	ARG	A	684	L	S	HZ2	LYS	V	227
R	-	N	SER	A	685	L	-	CB	THR	V	229
R	-	N	SER	A	685	L	-	CG2	THR	V	229
R	-	N	SER	A	685	L	-	HB	THR	V	229
R	-	N	SER	A	685	L	-	HG21	THR	V	229
R	-	N	SER	A	685	L	-	HG22	THR	V	229
R	-	CA	SER	A	685	L	-	CG2	THR	V	229
R	-	CA	SER	A	685	L	-	HB	THR	V	229
R	-	CA	SER	A	685	L	-	HG21	THR	V	229
R	-	CA	SER	A	685	L	-	HG22	THR	V	229
R	-	C	SER	A	685	L	-	HG21	THR	V	229
R	-	CB	SER	A	685	L	H	HD22	LEU	V	231
R	-	O	SER	A	685	L	-	HG3	LYS	V	199
R	-	OG	SER	A	685	L	H	CD2	LEU	V	231
R	-	OG	SER	A	685	L	H	HD21	LEU	V	231
R	-	OG	SER	A	685	L	H	HD22	LEU	V	231
R	-	OG	SER	A	685	L	H	HD23	LEU	V	231
R	-	N	VAL	A	686	L	-	HB3	LYS	V	199
R	-	N	VAL	A	686	L	-	HG21	THR	V	229
R	-	CA	VAL	A	686	L	-	CB	LYS	V	199
R	-	CA	VAL	A	686	L	-	HB3	LYS	V	199
R	-	CA	VAL	A	686	L	-	HD3	LYS	V	199
R	-	C	VAL	A	686	L	-	HB3	LYS	V	199
R	-	C	VAL	A	686	L	-	HD3	LYS	V	199
R	-	CB	VAL	A	686	L	-	C	LYS	V	199
R	-	CB	VAL	A	686	L	-	CB	LYS	V	199
R	-	CB	VAL	A	686	L	-	O	LYS	V	199
R	-	CB	VAL	A	686	L	-	HB3	LYS	V	199
R	-	CB	VAL	A	686	L	-	HA	ARG	V	200
R	-	O	VAL	A	686	L	-	CD	LYS	V	199
R	-	O	VAL	A	686	L	-	HB3	LYS	V	199
R	-	O	VAL	A	686	L	-	HD2	LYS	V	199
R	-	O	VAL	A	686	L	-	HD3	LYS	V	199
R	-	O	VAL	A	686	L	-	HZ3	LYS	V	199
R	-	CG1	VAL	A	686	L	-	CA	LYS	V	199
R	-	CG1	VAL	A	686	L	-	C	LYS	V	199
R	-	CG1	VAL	A	686	L	-	CB	LYS	V	199
R	-	CG1	VAL	A	686	L	-	O	LYS	V	199
R	-	CG1	VAL	A	686	L	-	HB2	LYS	V	199
R	-	CG1	VAL	A	686	L	-	HB3	LYS	V	199
R	-	CG1	VAL	A	686	L	-	HD3	LYS	V	199
R	-	CG1	VAL	A	686	L	-	HA	ARG	V	200
R	-	CG2	VAL	A	686	L	-	C	LYS	V	199
R	-	CG2	VAL	A	686	L	-	O	LYS	V	199
R	-	CG2	VAL	A	686	L	-	HB3	LYS	V	199
R	-	CG2	VAL	A	686	L	-	N	ARG	V	200
R	-	CG2	VAL	A	686	L	-	CA	ARG	V	200
R	-	CG2	VAL	A	686	L	-	C	ARG	V	200
R	-	CG2	VAL	A	686	L	-	O	ARG	V	200
R	-	CG2	VAL	A	686	L	-	H	ARG	V	200
R	-	CG2	VAL	A	686	L	-	HA	ARG	V	200
R	-	OG1	THR	A	687	L	H	CD2	LEU	V	231
R	-	OG1	THR	A	687	L	H	HD21	LEU	V	231
R	-	OG1	THR	A	687	L	H	HD22	LEU	V	231
R	-	OG1	THR	A	687	L	H	HD23	LEU	V	231
R	-	N	PRO	A	688	L	-	HZ3	LYS	V	199
R	-	CA	PRO	A	688	L	-	HZ3	LYS	V	199
R	-	CB	PRO	A	688	L	-	HZ3	LYS	V	199
R	-	CA	PRO	A	776	L	-	O	ASN	V	193
R	-	C	PRO	A	776	L	-	O	ASN	V	193
R	-	CB	PRO	A	776	L	-	C	ASN	V	193
R	-	CB	PRO	A	776	L	-	O	ASN	V	193
R	-	CB	PRO	A	776	L	-	HA	GLU	V	194
R	-	CB	PRO	A	776	L	-	N	ILE	V	195
R	-	CB	PRO	A	776	L	-	H	ILE	V	195
R	-	CB	PRO	A	776	L	-	HB	ILE	V	195
R	-	CG	PRO	A	776	L	-	O	ILE	V	195
R	-	CG	PRO	A	776	L	-	H	ILE	V	195
R	-	CG	PRO	A	776	L	-	HB	ILE	V	195
R	-	N	GLU	A	777	L	-	O	ASN	V	193
R	-	N	GLU	A	777	L	-	HA	GLU	V	194
R	-	N	GLU	A	777	L	-	HG2	GLU	V	194
R	-	CA	GLU	A	777	L	-	HG2	GLU	V	194
R	-	C	GLU	A	777	L	-	HG2	GLU	V	194
R	-	CB	GLU	A	777	L	-	CG	GLU	V	194
R	-	CB	GLU	A	777	L	-	OE1	GLU	V	194
R	-	CB	GLU	A	777	L	-	HG2	GLU	V	194
R	-	CB	GLU	A	777	L	-	HG3	GLU	V	194
R	-	OE2	GLU	A	777	L	S	HG12	VAL	V	192
R	-	OE2	GLU	A	777	L	-	OE1	GLU	V	194
R	-	OE2	GLU	A	777	L	-	HG3	GLU	V	194
R	-	N	THR	A	778	L	-	HA	GLU	V	194
R	-	N	THR	A	778	L	-	HG2	GLU	V	194
R	-	CA	THR	A	778	L	-	HG2	GLU	V	194
R	-	CB	THR	A	778	L	-	HA	VAL	V	196
R	-	CB	THR	A	778	L	-	HG23	VAL	V	196
R	-	CG2	THR	A	778	L	-	CA	GLU	V	194
R	-	CG2	THR	A	778	L	-	C	GLU	V	194
R	-	CG2	THR	A	778	L	-	CB	GLU	V	194
R	-	CG2	THR	A	778	L	-	CG	GLU	V	194
R	-	CG2	THR	A	778	L	-	HA	GLU	V	194
R	-	CG2	THR	A	778	L	-	HB3	GLU	V	194
R	-	CG2	THR	A	778	L	-	HG2	GLU	V	194
R	-	CG2	THR	A	778	L	-	CG2	VAL	V	196
R	-	CG2	THR	A	778	L	-	HA	VAL	V	196
R	-	CG2	THR	A	778	L	-	HG13	VAL	V	196
R	-	CG2	THR	A	778	L	-	HG21	VAL	V	196
R	-	CG2	THR	A	778	L	-	HG22	VAL	V	196
R	-	CG2	THR	A	778	L	-	HG23	VAL	V	196
R	-	OG1	THR	A	778	L	-	HA	GLU	V	194
R	-	OG1	THR	A	778	L	-	O	ILE	V	195
R	-	OG1	THR	A	778	L	-	HA	VAL	V	196
R	-	OG1	THR	A	778	L	-	HG23	VAL	V	196
R	-	CB	ARG	A	856	L	S	HE1	MET	V	84
R	-	CG	ARG	A	856	L	S	HE1	MET	V	84
R	-	CD	ARG	A	856	L	S	CE	MET	V	84
R	-	CD	ARG	A	856	L	S	HE1	MET	V	84
R	-	CD	ARG	A	856	L	S	HE3	MET	V	84
R	-	NE	ARG	A	856	L	S	HE1	MET	V	84
R	-	NE	ARG	A	856	L	-	HB2	ARG	V	131
R	-	NE	ARG	A	856	L	-	HE	ARG	V	131
R	-	NH1	ARG	A	856	L	-	CB	ARG	V	131
R	-	NH1	ARG	A	856	L	-	HB2	ARG	V	131
R	-	NH1	ARG	A	856	L	-	HB3	ARG	V	131
R	-	NH1	ARG	A	856	L	S	CB	ALA	V	150
R	-	NH1	ARG	A	856	L	S	HB1	ALA	V	150
R	-	NH1	ARG	A	856	L	S	HB2	ALA	V	150
R	-	NH1	ARG	A	856	L	S	HB3	ALA	V	150
R	-	NH2	ARG	A	856	L	-	C	ARG	V	131
R	-	NH2	ARG	A	856	L	-	CB	ARG	V	131
R	-	NH2	ARG	A	856	L	-	O	ARG	V	131
R	-	NH2	ARG	A	856	L	-	HB2	ARG	V	131
R	-	NH2	ARG	A	856	L	-	HB3	ARG	V	131
R	-	NH2	ARG	A	856	L	-	HB2	ASP	V	132
R	-	CZ	ARG	A	856	L	-	CB	ARG	V	131
R	-	CZ	ARG	A	856	L	-	HB2	ARG	V	131
R	-	CZ	ARG	A	856	L	-	HB3	ARG	V	131
R	-	O	SER	A	857	L	-	NH2	ARG	V	131
R	-	O	SER	A	857	L	-	HH21	ARG	V	131
R	-	O	SER	A	857	L	-	HH22	ARG	V	131
R	-	CB	LEU	A	858	L	S	ND2	ASN	V	70
R	-	CB	LEU	A	858	L	S	HB3	ASN	V	70
R	-	CB	LEU	A	858	L	S	HD21	ASN	V	70
R	-	CB	LEU	A	858	L	S	HD22	ASN	V	70
R	-	CB	LEU	A	858	L	-	CB	PHE	V	72
R	-	CB	LEU	A	858	L	-	CG	PHE	V	72
R	-	CB	LEU	A	858	L	-	CD1	PHE	V	72
R	-	CB	LEU	A	858	L	-	HB2	PHE	V	72
R	-	CB	LEU	A	858	L	-	HB3	PHE	V	72
R	-	CB	LEU	A	858	L	-	HD1	PHE	V	72
R	-	CB	LEU	A	858	L	S	HB2	MET	V	84
R	-	O	LEU	A	858	L	-	CB	PHE	V	72
R	-	O	LEU	A	858	L	-	CG	PHE	V	72
R	-	O	LEU	A	858	L	-	CD1	PHE	V	72
R	-	O	LEU	A	858	L	-	CD2	PHE	V	72
R	-	O	LEU	A	858	L	-	CE1	PHE	V	72
R	-	O	LEU	A	858	L	-	CE2	PHE	V	72
R	-	O	LEU	A	858	L	-	CZ	PHE	V	72
R	-	O	LEU	A	858	L	-	HB2	PHE	V	72
R	-	O	LEU	A	858	L	-	HB3	PHE	V	72
R	-	O	LEU	A	858	L	-	HD2	PHE	V	72
R	-	O	LEU	A	858	L	-	HE2	PHE	V	72
R	-	CG	LEU	A	858	L	S	CB	ASN	V	70
R	-	CG	LEU	A	858	L	S	ND2	ASN	V	70
R	-	CG	LEU	A	858	L	S	HB3	ASN	V	70
R	-	CG	LEU	A	858	L	S	HD21	ASN	V	70
R	-	CG	LEU	A	858	L	-	CG	PHE	V	72
R	-	CG	LEU	A	858	L	-	CD1	PHE	V	72
R	-	CG	LEU	A	858	L	-	CE1	PHE	V	72
R	-	CG	LEU	A	858	L	-	HB3	PHE	V	72
R	-	CG	LEU	A	858	L	-	HD1	PHE	V	72
R	-	CG	LEU	A	858	L	-	HE1	PHE	V	72
R	-	CG	LEU	A	858	L	S	CB	MET	V	84
R	-	CG	LEU	A	858	L	S	SD	MET	V	84
R	-	CG	LEU	A	858	L	S	HB2	MET	V	84
R	-	CG	LEU	A	858	L	S	HB3	MET	V	84
R	-	CD1	LEU	A	858	L	S	CA	ASN	V	70
R	-	CD1	LEU	A	858	L	S	CB	ASN	V	70
R	-	CD1	LEU	A	858	L	S	O	ASN	V	70
R	-	CD1	LEU	A	858	L	S	CG	ASN	V	70
R	-	CD1	LEU	A	858	L	S	ND2	ASN	V	70
R	-	CD1	LEU	A	858	L	S	HB2	ASN	V	70
R	-	CD1	LEU	A	858	L	S	HB3	ASN	V	70
R	-	CD1	LEU	A	858	L	S	HD21	ASN	V	70
R	-	CD1	LEU	A	858	L	-	CD1	PHE	V	72
R	-	CD1	LEU	A	858	L	-	HB3	PHE	V	72
R	-	CD1	LEU	A	858	L	-	HD1	PHE	V	72
R	-	CD1	LEU	A	858	L	S	CB	MET	V	84
R	-	CD1	LEU	A	858	L	S	CG	MET	V	84
R	-	CD1	LEU	A	858	L	S	SD	MET	V	84
R	-	CD1	LEU	A	858	L	S	H	MET	V	84
R	-	CD1	LEU	A	858	L	S	HB2	MET	V	84
R	-	CD1	LEU	A	858	L	S	HB3	MET	V	84
R	-	CD2	LEU	A	858	L	S	HB3	ASN	V	70
R	-	CD2	LEU	A	858	L	-	CB	PHE	V	72
R	-	CD2	LEU	A	858	L	-	CG	PHE	V	72
R	-	CD2	LEU	A	858	L	-	CD1	PHE	V	72
R	-	CD2	LEU	A	858	L	-	CD2	PHE	V	72
R	-	CD2	LEU	A	858	L	-	CE1	PHE	V	72
R	-	CD2	LEU	A	858	L	-	CZ	PHE	V	72
R	-	CD2	LEU	A	858	L	-	H	PHE	V	72
R	-	CD2	LEU	A	858	L	-	HB3	PHE	V	72
R	-	CD2	LEU	A	858	L	-	HD1	PHE	V	72
R	-	CD2	LEU	A	858	L	-	HE1	PHE	V	72
R	-	CD2	LEU	A	858	L	S	C	SER	V	83
R	-	CD2	LEU	A	858	L	S	HA	SER	V	83
R	-	CD2	LEU	A	858	L	S	N	MET	V	84
R	-	CD2	LEU	A	858	L	S	CB	MET	V	84
R	-	CD2	LEU	A	858	L	S	H	MET	V	84
R	-	CD2	LEU	A	858	L	S	HB2	MET	V	84
R	-	CD2	LEU	A	858	L	S	HB3	MET	V	84
R	-	CA	ALA	A	860	L	S	HH2	TRP	V	127
R	-	CA	ALA	A	860	L	-	HH12	ARG	V	131
R	-	C	ALA	A	860	L	-	HZ	PHE	V	72
R	-	C	ALA	A	860	L	S	CH2	TRP	V	127
R	-	C	ALA	A	860	L	S	CZ3	TRP	V	127
R	-	C	ALA	A	860	L	S	HH2	TRP	V	127
R	-	C	ALA	A	860	L	S	HZ3	TRP	V	127
R	-	C	ALA	A	860	L	S	HB1	ALA	V	152
R	-	CB	ALA	A	860	L	S	HH2	TRP	V	127
R	-	CB	ALA	A	860	L	S	OD2	ASP	V	129
R	-	CB	ALA	A	860	L	-	NH1	ARG	V	131
R	-	CB	ALA	A	860	L	-	CZ	ARG	V	131
R	-	CB	ALA	A	860	L	-	HH11	ARG	V	131
R	-	CB	ALA	A	860	L	-	HH12	ARG	V	131
R	-	CB	ALA	A	860	L	-	HH22	ARG	V	131
R	-	O	ALA	A	860	L	-	HZ	PHE	V	72
R	-	O	ALA	A	860	L	S	CH2	TRP	V	127
R	-	O	ALA	A	860	L	S	CZ3	TRP	V	127
R	-	O	ALA	A	860	L	S	HH2	TRP	V	127
R	-	O	ALA	A	860	L	S	HZ3	TRP	V	127
R	-	O	ALA	A	860	L	S	HB2	ASP	V	129
R	-	O	ALA	A	860	L	S	CB	ALA	V	152
R	-	O	ALA	A	860	L	S	HB1	ALA	V	152
R	-	O	ALA	A	860	L	S	HB2	ALA	V	152
R	-	O	ALA	A	860	L	S	HB3	ALA	V	152
R	-	N	THR	A	861	L	-	CE2	PHE	V	72
R	-	N	THR	A	861	L	-	CZ	PHE	V	72
R	-	N	THR	A	861	L	-	HE2	PHE	V	72
R	-	N	THR	A	861	L	-	HZ	PHE	V	72
R	-	N	THR	A	861	L	S	HZ3	TRP	V	127
R	-	CA	THR	A	861	L	-	CZ	PHE	V	72
R	-	CA	THR	A	861	L	-	HE2	PHE	V	72
R	-	CA	THR	A	861	L	-	HZ	PHE	V	72
R	-	CA	THR	A	861	L	S	HB3	SER	V	82
R	-	CA	THR	A	861	L	S	CZ3	TRP	V	127
R	-	CA	THR	A	861	L	S	HZ3	TRP	V	127
R	-	C	THR	A	861	L	-	HE2	PHE	V	72
R	-	C	THR	A	861	L	S	HG	SER	V	82
R	-	CB	THR	A	861	L	-	CE1	PHE	V	72
R	-	CB	THR	A	861	L	-	CE2	PHE	V	72
R	-	CB	THR	A	861	L	-	CZ	PHE	V	72
R	-	CB	THR	A	861	L	-	HE2	PHE	V	72
R	-	CB	THR	A	861	L	-	HZ	PHE	V	72
R	-	CB	THR	A	861	L	S	CB	SER	V	82
R	-	CB	THR	A	861	L	S	OG	SER	V	82
R	-	CB	THR	A	861	L	S	HB2	SER	V	82
R	-	CB	THR	A	861	L	S	HB3	SER	V	82
R	-	CB	THR	A	861	L	S	HG	SER	V	82
R	-	CB	THR	A	861	L	S	HZ3	TRP	V	127
R	-	CB	THR	A	861	L	S	HB1	ALA	V	152
R	-	CB	THR	A	861	L	S	HB2	GLU	V	154
R	-	O	THR	A	861	L	-	CE2	PHE	V	72
R	-	O	THR	A	861	L	-	HE2	PHE	V	72
R	-	O	THR	A	861	L	S	OG	SER	V	82
R	-	O	THR	A	861	L	S	HG	SER	V	82
R	-	CG2	THR	A	861	L	-	CZ	PHE	V	72
R	-	CG2	THR	A	861	L	-	HZ	PHE	V	72
R	-	CG2	THR	A	861	L	S	CB	SER	V	82
R	-	CG2	THR	A	861	L	S	OG	SER	V	82
R	-	CG2	THR	A	861	L	S	HA	SER	V	82
R	-	CG2	THR	A	861	L	S	HB3	SER	V	82
R	-	CG2	THR	A	861	L	S	HG	SER	V	82
R	-	CG2	THR	A	861	L	S	CE3	TRP	V	127
R	-	CG2	THR	A	861	L	S	HE3	TRP	V	127
R	-	CG2	THR	A	861	L	S	HZ3	TRP	V	127
R	-	CG2	THR	A	861	L	S	C	THR	V	153
R	-	CG2	THR	A	861	L	S	O	THR	V	153
R	-	CG2	THR	A	861	L	S	N	GLU	V	154
R	-	CG2	THR	A	861	L	S	CA	GLU	V	154
R	-	CG2	THR	A	861	L	S	CB	GLU	V	154
R	-	CG2	THR	A	861	L	S	H	GLU	V	154
R	-	CG2	THR	A	861	L	S	HA	GLU	V	154
R	-	CG2	THR	A	861	L	S	HB2	GLU	V	154
R	-	CG2	THR	A	861	L	S	HB3	GLU	V	154
R	-	OG1	THR	A	861	L	-	CE1	PHE	V	72
R	-	OG1	THR	A	861	L	-	CE2	PHE	V	72
R	-	OG1	THR	A	861	L	-	CZ	PHE	V	72
R	-	OG1	THR	A	861	L	-	HE1	PHE	V	72
R	-	OG1	THR	A	861	L	-	HE2	PHE	V	72
R	-	OG1	THR	A	861	L	-	HZ	PHE	V	72
R	-	OG1	THR	A	861	L	S	CB	SER	V	82
R	-	OG1	THR	A	861	L	S	HB3	SER	V	82
R	-	OG1	THR	A	861	L	S	HZ3	TRP	V	127
R	-	OG1	THR	A	861	L	S	CB	ALA	V	152
R	-	OG1	THR	A	861	L	S	HB1	ALA	V	152
R	-	N	SER	A	862	L	S	OE2	GLU	V	154
R	-	CA	SER	A	862	L	S	OE2	GLU	V	154
R	-	CB	SER	A	862	L	S	OE2	GLU	V	154
R	-	C	THR	A	863	L	S	CB	TRP	V	127
R	-	C	THR	A	863	L	S	CG	TRP	V	127
R	-	C	THR	A	863	L	S	CD1	TRP	V	127
R	-	C	THR	A	863	L	S	HB2	TRP	V	127
R	-	C	THR	A	863	L	S	HD1	TRP	V	127
R	-	O	THR	A	863	L	S	CB	TRP	V	127
R	-	O	THR	A	863	L	S	CG	TRP	V	127
R	-	O	THR	A	863	L	S	CD1	TRP	V	127
R	-	O	THR	A	863	L	S	CD2	TRP	V	127
R	-	O	THR	A	863	L	S	CE2	TRP	V	127
R	-	O	THR	A	863	L	S	NE1	TRP	V	127
R	-	O	THR	A	863	L	S	HB2	TRP	V	127
R	-	O	THR	A	863	L	S	HD1	TRP	V	127
R	-	O	THR	A	863	L	S	HE1	TRP	V	127
R	-	N	VAL	A	864	L	S	CB	TRP	V	127
R	-	N	VAL	A	864	L	S	CG	TRP	V	127
R	-	N	VAL	A	864	L	S	CD1	TRP	V	127
R	-	N	VAL	A	864	L	S	HB2	TRP	V	127
R	-	N	VAL	A	864	L	S	HB3	TRP	V	127
R	-	N	VAL	A	864	L	S	HD1	TRP	V	127
R	-	CA	VAL	A	864	L	S	HB3	LEU	V	126
R	-	CA	VAL	A	864	L	S	HB2	TRP	V	127
R	-	C	VAL	A	864	L	S	HB2	TRP	V	127
R	-	CG1	VAL	A	864	L	S	HB3	LEU	V	126
R	-	CG2	VAL	A	864	L	S	HB3	LEU	V	126
R	-	CG2	VAL	A	864	L	S	HD12	LEU	V	126
R	-	CG2	VAL	A	864	L	S	CD	GLU	V	154
R	-	CG2	VAL	A	864	L	S	OE1	GLU	V	154
R	-	CG2	VAL	A	864	L	S	OE2	GLU	V	154
R	-	N	ALA	A	865	L	S	O	LEU	V	126
R	-	N	ALA	A	865	L	S	HB2	TRP	V	127
R	-	N	ALA	A	865	L	S	HD1	TRP	V	127
R	-	C	ALA	A	865	L	S	O	LEU	V	126
R	-	O	ALA	A	865	L	S	O	LEU	V	126
R	-	N	ALA	A	866	L	S	O	LEU	V	126
R	-	CA	ALA	A	866	L	S	O	LEU	V	126
R	-	CB	ALA	A	866	L	S	HA	LEU	V	126
R	-	C	ALA	A	873	L	-	HD21	LEU	V	216
R	-	O	ALA	A	873	L	-	CG2	THR	V	181
R	-	O	ALA	A	873	L	-	HG22	THR	V	181
R	-	N	GLU	A	874	L	-	CD2	LEU	V	216
R	-	N	GLU	A	874	L	-	HB3	LEU	V	216
R	-	N	GLU	A	874	L	-	HD21	LEU	V	216
R	-	N	GLU	A	874	L	-	HD23	LEU	V	216
R	-	CA	GLU	A	874	L	-	CD2	LEU	V	216
R	-	CA	GLU	A	874	L	-	HB3	LEU	V	216
R	-	CA	GLU	A	874	L	-	HD21	LEU	V	216
R	-	CA	GLU	A	874	L	-	HD22	LEU	V	216
R	-	CA	GLU	A	874	L	-	HD23	LEU	V	216
R	-	C	GLU	A	874	L	-	HG22	THR	V	181
R	-	C	GLU	A	874	L	-	CD2	LEU	V	216
R	-	C	GLU	A	874	L	-	HB3	LEU	V	216
R	-	C	GLU	A	874	L	-	HG	LEU	V	216
R	-	C	GLU	A	874	L	-	HD21	LEU	V	216
R	-	CB	GLU	A	874	L	-	HD21	LEU	V	216
R	-	O	GLU	A	874	L	-	CB	THR	V	181
R	-	O	GLU	A	874	L	-	CG2	THR	V	181
R	-	O	GLU	A	874	L	-	HB	THR	V	181
R	-	O	GLU	A	874	L	-	HG21	THR	V	181
R	-	O	GLU	A	874	L	-	HG22	THR	V	181
R	-	O	GLU	A	874	L	-	HD21	LEU	V	216
R	-	CG	GLU	A	874	L	-	CD2	LEU	V	216
R	-	CG	GLU	A	874	L	-	HD21	LEU	V	216
R	-	CG	GLU	A	874	L	-	HD22	LEU	V	216
R	-	OE1	GLU	A	874	L	-	HE	ARG	V	409
R	-	OE1	GLU	A	874	L	-	HH21	ARG	V	409
R	-	N	ALA	A	875	L	-	CB	LEU	V	216
R	-	N	ALA	A	875	L	-	CG	LEU	V	216
R	-	N	ALA	A	875	L	-	CD2	LEU	V	216
R	-	N	ALA	A	875	L	-	HA	LEU	V	216
R	-	N	ALA	A	875	L	-	HB3	LEU	V	216
R	-	N	ALA	A	875	L	-	HG	LEU	V	216
R	-	N	ALA	A	875	L	-	HD21	LEU	V	216
R	-	N	ALA	A	875	L	-	HD22	LEU	V	216
R	-	CA	ALA	A	875	L	-	HG	LEU	V	216
R	-	CA	ALA	A	875	L	-	HD21	LEU	V	216
R	-	C	ALA	A	875	L	-	HB	THR	V	181
R	-	C	ALA	A	875	L	-	HB2	ALA	V	182
R	-	C	ALA	A	875	L	-	CG	MET	V	183
R	-	C	ALA	A	875	L	-	H	MET	V	183
R	-	C	ALA	A	875	L	-	HG2	MET	V	183
R	-	C	ALA	A	875	L	-	HG3	MET	V	183
R	-	O	ALA	A	875	L	-	CB	THR	V	181
R	-	O	ALA	A	875	L	-	OG1	THR	V	181
R	-	O	ALA	A	875	L	-	HB	THR	V	181
R	-	O	ALA	A	875	L	-	HG1	THR	V	181
R	-	O	ALA	A	875	L	-	HG21	THR	V	181
R	-	O	ALA	A	875	L	-	CB	MET	V	183
R	-	O	ALA	A	875	L	-	CG	MET	V	183
R	-	O	ALA	A	875	L	-	H	MET	V	183
R	-	O	ALA	A	875	L	-	HB2	MET	V	183
R	-	O	ALA	A	875	L	-	HG2	MET	V	183
R	-	O	ALA	A	875	L	-	HG3	MET	V	183
R	-	N	HIS	A	876	L	-	HB	THR	V	181
R	-	N	HIS	A	876	L	-	H	ALA	V	182
R	-	N	HIS	A	876	L	-	HB2	ALA	V	182
R	-	N	HIS	A	876	L	-	CG	MET	V	183
R	-	N	HIS	A	876	L	-	H	MET	V	183
R	-	N	HIS	A	876	L	-	HG2	MET	V	183
R	-	N	HIS	A	876	L	-	HA	LEU	V	216
R	-	N	HIS	A	876	L	-	HG	LEU	V	216
R	-	CA	HIS	A	876	L	-	HB2	ALA	V	182
R	-	CA	HIS	A	876	L	-	CG	MET	V	183
R	-	CA	HIS	A	876	L	-	SD	MET	V	183
R	-	CA	HIS	A	876	L	-	HG2	MET	V	183
R	-	CA	HIS	A	876	L	-	HG3	MET	V	183
R	-	C	HIS	A	876	L	-	HB2	ALA	V	182
R	-	CB	HIS	A	876	L	-	HB2	ALA	V	182
R	-	CB	HIS	A	876	L	-	N	MET	V	183
R	-	CB	HIS	A	876	L	-	CB	MET	V	183
R	-	CB	HIS	A	876	L	-	CG	MET	V	183
R	-	CB	HIS	A	876	L	-	SD	MET	V	183
R	-	CB	HIS	A	876	L	-	CE	MET	V	183
R	-	CB	HIS	A	876	L	-	H	MET	V	183
R	-	CB	HIS	A	876	L	-	HA	MET	V	183
R	-	CB	HIS	A	876	L	-	HG2	MET	V	183
R	-	CB	HIS	A	876	L	-	HG3	MET	V	183
R	-	CB	HIS	A	876	L	-	HE3	MET	V	183
R	-	O	HIS	A	876	L	-	CB	ALA	V	182
R	-	O	HIS	A	876	L	-	HB1	ALA	V	182
R	-	O	HIS	A	876	L	-	HB2	ALA	V	182
R	-	O	HIS	A	876	L	-	O	GLN	V	215
R	-	O	HIS	A	876	L	-	HA	LEU	V	216
R	-	CG	HIS	A	876	L	-	CB	MET	V	183
R	-	CG	HIS	A	876	L	-	CG	MET	V	183
R	-	CG	HIS	A	876	L	-	SD	MET	V	183
R	-	CG	HIS	A	876	L	-	CE	MET	V	183
R	-	CG	HIS	A	876	L	-	HB2	MET	V	183
R	-	CG	HIS	A	876	L	-	HB3	MET	V	183
R	-	CG	HIS	A	876	L	-	HG2	MET	V	183
R	-	CG	HIS	A	876	L	-	HG3	MET	V	183
R	-	CG	HIS	A	876	L	-	HE1	MET	V	183
R	-	CG	HIS	A	876	L	-	HE2	MET	V	183
R	-	CG	HIS	A	876	L	-	HE3	MET	V	183
R	-	CD2	HIS	A	876	L	-	CB	MET	V	183
R	-	CD2	HIS	A	876	L	-	CG	MET	V	183
R	-	CD2	HIS	A	876	L	-	SD	MET	V	183
R	-	CD2	HIS	A	876	L	-	CE	MET	V	183
R	-	CD2	HIS	A	876	L	-	HB2	MET	V	183
R	-	CD2	HIS	A	876	L	-	HB3	MET	V	183
R	-	CD2	HIS	A	876	L	-	HG2	MET	V	183
R	-	CD2	HIS	A	876	L	-	HG3	MET	V	183
R	-	CD2	HIS	A	876	L	-	HE2	MET	V	183
R	-	CD2	HIS	A	876	L	-	HE3	MET	V	183
R	-	ND1	HIS	A	876	L	-	CG	MET	V	183
R	-	ND1	HIS	A	876	L	-	SD	MET	V	183
R	-	ND1	HIS	A	876	L	-	CE	MET	V	183
R	-	ND1	HIS	A	876	L	-	HG2	MET	V	183
R	-	ND1	HIS	A	876	L	-	HG3	MET	V	183
R	-	ND1	HIS	A	876	L	-	HE1	MET	V	183
R	-	ND1	HIS	A	876	L	-	HE3	MET	V	183
R	-	CE1	HIS	A	876	L	-	CG	MET	V	183
R	-	CE1	HIS	A	876	L	-	SD	MET	V	183
R	-	CE1	HIS	A	876	L	-	CE	MET	V	183
R	-	CE1	HIS	A	876	L	-	HG3	MET	V	183
R	-	CE1	HIS	A	876	L	-	HE1	MET	V	183
R	-	CE1	HIS	A	876	L	-	HE3	MET	V	183
R	-	NE2	HIS	A	876	L	-	CB	MET	V	183
R	-	NE2	HIS	A	876	L	-	CG	MET	V	183
R	-	NE2	HIS	A	876	L	-	SD	MET	V	183
R	-	NE2	HIS	A	876	L	-	CE	MET	V	183
R	-	NE2	HIS	A	876	L	-	HB3	MET	V	183
R	-	NE2	HIS	A	876	L	-	HG2	MET	V	183
R	-	NE2	HIS	A	876	L	-	HG3	MET	V	183
R	-	NE2	HIS	A	876	L	-	HE2	MET	V	183
R	-	NE2	HIS	A	876	L	-	HE3	MET	V	183
R	-	C	LYS	A	877	L	-	HA	GLN	V	214
R	-	C	LYS	A	877	L	-	HG2	GLN	V	214
R	-	O	LYS	A	877	L	-	HA	GLN	V	214
R	-	OXT	LYS	A	877	L	-	CA	GLN	V	214
R	-	OXT	LYS	A	877	L	-	CB	GLN	V	214
R	-	OXT	LYS	A	877	L	-	CG	GLN	V	214
R	-	OXT	LYS	A	877	L	-	HA	GLN	V	214
R	-	OXT	LYS	A	877	L	-	HB3	GLN	V	214
R	-	OXT	LYS	A	877	L	-	HG2	GLN	V	214
R	-	OXT	LYS	A	877	L	-	HG3	GLN	V	214

- 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