IID

Q96EX2_Q969T4.1 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	-	MET	A	1	L	-	GLN	V	6
R	H	ALA	A	152	L	-	ARG	V	132
R	H	LEU	A	156	L	H	ARG	V	204
R	H	LEU	A	156	L	H	TYR	V	205
R	H	VAL	A	159	L	S	PHE	V	111
R	H	TRP	A	162	L	S	PHE	V	111
R	H	TRP	A	162	L	S	ARG	V	94
R	H	LEU	A	163	L	S	VAL	V	109
R	H	LEU	A	163	L	-	THR	V	207
R	-	THR	A	21	L	H	ARG	V	196
R	H	PHE	A	256	L	-	PRO	V	79
R	H	PHE	A	256	L	-	ASN	V	80
R	H	LEU	A	260	L	-	PRO	V	101
R	H	TYR	A	320	L	-	PRO	V	79
R	-	ASN	A	328	L	-	ALA	V	156
R	-	ASN	A	328	L	H	LYS	V	161
R	H	SER	A	329	L	H	LYS	V	161
R	H	PHE	A	331	L	H	ILE	V	148
R	H	PHE	A	331	L	-	ASN	V	152
R	H	LEU	A	332	L	H	ILE	V	148
R	H	LEU	A	332	L	-	LEU	V	157
R	H	LEU	A	332	L	H	LYS	V	161
R	H	LEU	A	332	L	H	SER	V	165
R	H	VAL	A	335	L	H	ASP	V	147
R	H	VAL	A	335	L	H	ILE	V	148
R	H	LEU	A	336	L	H	SER	V	165
R	H	LEU	A	336	L	H	SER	V	168
R	H	LEU	A	339	L	-	LEU	V	146
R	H	LEU	A	339	L	-	ASP	V	172
R	H	LEU	A	339	L	-	ASN	V	174
R	H	TYR	A	340	L	-	ASP	V	172
R	H	CYS	A	343	L	-	ASP	V	172
R	H	CYS	A	343	L	-	CYS	V	173
R	H	CYS	A	343	L	H	TYR	V	187
R	H	LYS	A	344	L	-	ASP	V	172
R	H	PHE	A	346	L	-	PRO	V	175
R	H	PHE	A	346	L	H	TYR	V	187
R	H	PHE	A	346	L	H	LEU	V	188
R	H	ASP	A	347	L	H	ARG	V	191
R	H	PHE	A	4	L	-	GLN	V	6
R	-	HIS	A	440	L	-	GLY	V	102
R	-	PHE	A	441	L	-	GLY	V	102
R	-	VAL	A	443	L	-	PRO	V	101
R	-	VAL	A	443	L	-	GLY	V	102
R	-	TYR	A	444	L	-	GLY	V	102
R	-	TYR	A	444	L	-	SER	V	103
R	-	TYR	A	444	L	H	THR	V	171
R	-	TYR	A	444	L	H	ARG	V	191
R	H	THR	A	5	L	-	ARG	V	5
R	H	THR	A	5	L	-	GLN	V	6
R	-	ASP	A	86	L	-	MET	V	1

- 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

Q96EX2_Q969T4.1 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	-	CA	MET	A	1	L	-	HE22	GLN	V	6
R	-	C	MET	A	1	L	-	HE22	GLN	V	6
R	-	CB	MET	A	1	L	-	HE22	GLN	V	6
R	-	O	MET	A	1	L	-	NE2	GLN	V	6
R	-	O	MET	A	1	L	-	HE21	GLN	V	6
R	-	O	MET	A	1	L	-	HE22	GLN	V	6
R	-	CG	MET	A	1	L	-	CD	GLN	V	6
R	-	CG	MET	A	1	L	-	NE2	GLN	V	6
R	-	CG	MET	A	1	L	-	OE1	GLN	V	6
R	-	CG	MET	A	1	L	-	HE21	GLN	V	6
R	-	CG	MET	A	1	L	-	HE22	GLN	V	6
R	-	SD	MET	A	1	L	-	OE1	GLN	V	6
R	-	SD	MET	A	1	L	-	HE22	GLN	V	6
R	H	CB	PHE	A	4	L	-	NE2	GLN	V	6
R	H	CB	PHE	A	4	L	-	HE21	GLN	V	6
R	H	CG	PHE	A	4	L	-	HE21	GLN	V	6
R	H	N	THR	A	5	L	-	HE21	GLN	V	6
R	H	CG2	THR	A	5	L	-	HH12	ARG	V	5
R	H	CG2	THR	A	5	L	-	HH22	ARG	V	5
R	H	OG1	THR	A	5	L	-	NE2	GLN	V	6
R	H	OG1	THR	A	5	L	-	HE21	GLN	V	6
R	H	OG1	THR	A	5	L	-	HE22	GLN	V	6
R	-	CA	THR	A	21	L	H	HD2	ARG	V	196
R	-	CB	THR	A	21	L	H	HD2	ARG	V	196
R	-	CG2	THR	A	21	L	H	CD	ARG	V	196
R	-	CG2	THR	A	21	L	H	HG2	ARG	V	196
R	-	CG2	THR	A	21	L	H	HD2	ARG	V	196
R	-	CG2	THR	A	21	L	H	HD3	ARG	V	196
R	-	CG	ASP	A	86	L	-	HE1	MET	V	1
R	-	OD1	ASP	A	86	L	-	CE	MET	V	1
R	-	OD1	ASP	A	86	L	-	HE1	MET	V	1
R	-	OD1	ASP	A	86	L	-	HE2	MET	V	1
R	H	N	ALA	A	152	L	-	NH2	ARG	V	132
R	H	N	ALA	A	152	L	-	HH21	ARG	V	132
R	H	N	ALA	A	152	L	-	HH22	ARG	V	132
R	H	CA	ALA	A	152	L	-	NH2	ARG	V	132
R	H	CA	ALA	A	152	L	-	CZ	ARG	V	132
R	H	CA	ALA	A	152	L	-	HH21	ARG	V	132
R	H	CA	ALA	A	152	L	-	HH22	ARG	V	132
R	H	CB	ALA	A	152	L	-	NE	ARG	V	132
R	H	CB	ALA	A	152	L	-	NH1	ARG	V	132
R	H	CB	ALA	A	152	L	-	NH2	ARG	V	132
R	H	CB	ALA	A	152	L	-	CZ	ARG	V	132
R	H	CB	ALA	A	152	L	-	HE	ARG	V	132
R	H	CB	ALA	A	152	L	-	HH11	ARG	V	132
R	H	CB	ALA	A	152	L	-	HH12	ARG	V	132
R	H	CB	ALA	A	152	L	-	HH21	ARG	V	132
R	H	CB	ALA	A	152	L	-	HH22	ARG	V	132
R	H	CD1	LEU	A	156	L	H	O	ARG	V	204
R	H	CD1	LEU	A	156	L	H	CA	TYR	V	205
R	H	CD1	LEU	A	156	L	H	O	TYR	V	205
R	H	CD1	LEU	A	156	L	H	HA	TYR	V	205
R	H	CD1	LEU	A	156	L	H	HD1	TYR	V	205
R	H	CD2	LEU	A	156	L	H	O	ARG	V	204
R	H	CD2	LEU	A	156	L	H	HD1	TYR	V	205
R	H	CA	VAL	A	159	L	S	HE2	PHE	V	111
R	H	CB	VAL	A	159	L	S	HD2	PHE	V	111
R	H	CB	VAL	A	159	L	S	HE2	PHE	V	111
R	H	O	VAL	A	159	L	S	HE2	PHE	V	111
R	H	CG1	VAL	A	159	L	S	CD2	PHE	V	111
R	H	CG1	VAL	A	159	L	S	CE2	PHE	V	111
R	H	CG1	VAL	A	159	L	S	HD2	PHE	V	111
R	H	CG1	VAL	A	159	L	S	HE2	PHE	V	111
R	H	CG2	VAL	A	159	L	S	CD2	PHE	V	111
R	H	CG2	VAL	A	159	L	S	HD2	PHE	V	111
R	H	CG2	VAL	A	159	L	S	HE2	PHE	V	111
R	H	CD2	TRP	A	162	L	S	HZ	PHE	V	111
R	H	CE3	TRP	A	162	L	S	CE1	PHE	V	111
R	H	CE3	TRP	A	162	L	S	CE2	PHE	V	111
R	H	CE3	TRP	A	162	L	S	CZ	PHE	V	111
R	H	CE3	TRP	A	162	L	S	HE1	PHE	V	111
R	H	CE3	TRP	A	162	L	S	HZ	PHE	V	111
R	H	NE1	TRP	A	162	L	S	HH11	ARG	V	94
R	H	CH2	TRP	A	162	L	S	CE1	PHE	V	111
R	H	CH2	TRP	A	162	L	S	CZ	PHE	V	111
R	H	CH2	TRP	A	162	L	S	HE1	PHE	V	111
R	H	CH2	TRP	A	162	L	S	HZ	PHE	V	111
R	H	CZ2	TRP	A	162	L	S	HE1	PHE	V	111
R	H	CZ3	TRP	A	162	L	S	CE1	PHE	V	111
R	H	CZ3	TRP	A	162	L	S	CZ	PHE	V	111
R	H	CZ3	TRP	A	162	L	S	HE1	PHE	V	111
R	H	CZ3	TRP	A	162	L	S	HZ	PHE	V	111
R	H	CD1	LEU	A	163	L	S	HG13	VAL	V	109
R	H	CD1	LEU	A	163	L	S	HG22	VAL	V	109
R	H	CD2	LEU	A	163	L	-	OXT	THR	V	207
R	H	CB	PHE	A	256	L	-	CG	PRO	V	79
R	H	CB	PHE	A	256	L	-	HB3	PRO	V	79
R	H	CB	PHE	A	256	L	-	HG2	PRO	V	79
R	H	CB	PHE	A	256	L	-	HG3	PRO	V	79
R	H	CG	PHE	A	256	L	-	CB	PRO	V	79
R	H	CG	PHE	A	256	L	-	CG	PRO	V	79
R	H	CG	PHE	A	256	L	-	HB2	PRO	V	79
R	H	CG	PHE	A	256	L	-	HB3	PRO	V	79
R	H	CG	PHE	A	256	L	-	HG2	PRO	V	79
R	H	CG	PHE	A	256	L	-	HG3	PRO	V	79
R	H	CD1	PHE	A	256	L	-	CB	PRO	V	79
R	H	CD1	PHE	A	256	L	-	CG	PRO	V	79
R	H	CD1	PHE	A	256	L	-	HB2	PRO	V	79
R	H	CD1	PHE	A	256	L	-	HB3	PRO	V	79
R	H	CD1	PHE	A	256	L	-	HG2	PRO	V	79
R	H	CD1	PHE	A	256	L	-	HG3	PRO	V	79
R	H	CD2	PHE	A	256	L	-	CB	PRO	V	79
R	H	CD2	PHE	A	256	L	-	CG	PRO	V	79
R	H	CD2	PHE	A	256	L	-	HB2	PRO	V	79
R	H	CD2	PHE	A	256	L	-	HB3	PRO	V	79
R	H	CD2	PHE	A	256	L	-	HG2	PRO	V	79
R	H	CE1	PHE	A	256	L	-	CB	PRO	V	79
R	H	CE1	PHE	A	256	L	-	HB2	PRO	V	79
R	H	CE1	PHE	A	256	L	-	HB3	PRO	V	79
R	H	CE1	PHE	A	256	L	-	ND2	ASN	V	80
R	H	CE1	PHE	A	256	L	-	HD22	ASN	V	80
R	H	CE2	PHE	A	256	L	-	CB	PRO	V	79
R	H	CE2	PHE	A	256	L	-	HB2	PRO	V	79
R	H	CE2	PHE	A	256	L	-	HB3	PRO	V	79
R	H	CE2	PHE	A	256	L	-	HG2	PRO	V	79
R	H	CZ	PHE	A	256	L	-	CB	PRO	V	79
R	H	CZ	PHE	A	256	L	-	HB2	PRO	V	79
R	H	CZ	PHE	A	256	L	-	HB3	PRO	V	79
R	H	CZ	PHE	A	256	L	-	ND2	ASN	V	80
R	H	CZ	PHE	A	256	L	-	HD21	ASN	V	80
R	H	CZ	PHE	A	256	L	-	HD22	ASN	V	80
R	H	CD1	LEU	A	260	L	-	HB3	PRO	V	101
R	H	CD1	LEU	A	260	L	-	HG2	PRO	V	101
R	H	CD2	LEU	A	260	L	-	HG2	PRO	V	101
R	H	OH	TYR	A	320	L	-	HG2	PRO	V	79
R	-	C	ASN	A	328	L	H	HZ2	LYS	V	161
R	-	CB	ASN	A	328	L	-	CB	ALA	V	156
R	-	CB	ASN	A	328	L	-	HB1	ALA	V	156
R	-	CB	ASN	A	328	L	-	HB2	ALA	V	156
R	-	CB	ASN	A	328	L	-	HB3	ALA	V	156
R	-	O	ASN	A	328	L	H	HZ2	LYS	V	161
R	-	CG	ASN	A	328	L	-	CB	ALA	V	156
R	-	CG	ASN	A	328	L	-	HB1	ALA	V	156
R	-	CG	ASN	A	328	L	-	HB2	ALA	V	156
R	-	CG	ASN	A	328	L	-	HB3	ALA	V	156
R	-	ND2	ASN	A	328	L	-	CB	ALA	V	156
R	-	ND2	ASN	A	328	L	-	HB1	ALA	V	156
R	-	ND2	ASN	A	328	L	-	HB2	ALA	V	156
R	-	ND2	ASN	A	328	L	-	HB3	ALA	V	156
R	-	OD1	ASN	A	328	L	-	HB1	ALA	V	156
R	-	OD1	ASN	A	328	L	-	HB3	ALA	V	156
R	H	N	SER	A	329	L	H	HZ2	LYS	V	161
R	H	CA	SER	A	329	L	H	HZ2	LYS	V	161
R	H	CB	SER	A	329	L	H	HZ2	LYS	V	161
R	H	CD1	PHE	A	331	L	-	HB3	ASN	V	152
R	H	CE1	PHE	A	331	L	H	HG22	ILE	V	148
R	H	CE1	PHE	A	331	L	-	CB	ASN	V	152
R	H	CE1	PHE	A	331	L	-	O	ASN	V	152
R	H	CE1	PHE	A	331	L	-	HB3	ASN	V	152
R	H	CZ	PHE	A	331	L	-	CB	ASN	V	152
R	H	CZ	PHE	A	331	L	-	CG	ASN	V	152
R	H	CZ	PHE	A	331	L	-	ND2	ASN	V	152
R	H	CZ	PHE	A	331	L	-	OD1	ASN	V	152
R	H	CZ	PHE	A	331	L	-	HB3	ASN	V	152
R	H	CB	LEU	A	332	L	-	CD2	LEU	V	157
R	H	CB	LEU	A	332	L	-	HD21	LEU	V	157
R	H	CB	LEU	A	332	L	-	HD22	LEU	V	157
R	H	CB	LEU	A	332	L	-	HD23	LEU	V	157
R	H	CB	LEU	A	332	L	H	HD3	LYS	V	161
R	H	CG	LEU	A	332	L	-	CD2	LEU	V	157
R	H	CG	LEU	A	332	L	-	HD22	LEU	V	157
R	H	CG	LEU	A	332	L	-	HD23	LEU	V	157
R	H	CG	LEU	A	332	L	H	HB3	LYS	V	161
R	H	CG	LEU	A	332	L	H	HD3	LYS	V	161
R	H	CD1	LEU	A	332	L	H	HG21	ILE	V	148
R	H	CD1	LEU	A	332	L	H	HD13	ILE	V	148
R	H	CD1	LEU	A	332	L	-	CD2	LEU	V	157
R	H	CD1	LEU	A	332	L	-	HD22	LEU	V	157
R	H	CD1	LEU	A	332	L	-	HD23	LEU	V	157
R	H	CD1	LEU	A	332	L	H	HB3	LYS	V	161
R	H	CD1	LEU	A	332	L	H	OG	SER	V	165
R	H	CD1	LEU	A	332	L	H	HG	SER	V	165
R	H	CD2	LEU	A	332	L	-	CD2	LEU	V	157
R	H	CD2	LEU	A	332	L	-	HD21	LEU	V	157
R	H	CD2	LEU	A	332	L	-	HD22	LEU	V	157
R	H	CD2	LEU	A	332	L	-	HD23	LEU	V	157
R	H	CD2	LEU	A	332	L	H	CB	LYS	V	161
R	H	CD2	LEU	A	332	L	H	CG	LYS	V	161
R	H	CD2	LEU	A	332	L	H	CD	LYS	V	161
R	H	CD2	LEU	A	332	L	H	HA	LYS	V	161
R	H	CD2	LEU	A	332	L	H	HB2	LYS	V	161
R	H	CD2	LEU	A	332	L	H	HB3	LYS	V	161
R	H	CD2	LEU	A	332	L	H	HG2	LYS	V	161
R	H	CD2	LEU	A	332	L	H	HD2	LYS	V	161
R	H	CD2	LEU	A	332	L	H	HD3	LYS	V	161
R	H	CD2	LEU	A	332	L	H	HE2	LYS	V	161
R	H	CG1	VAL	A	335	L	H	CG	ASP	V	147
R	H	CG1	VAL	A	335	L	H	OD1	ASP	V	147
R	H	CG1	VAL	A	335	L	H	OD2	ASP	V	147
R	H	CG1	VAL	A	335	L	H	HG23	ILE	V	148
R	H	CG2	VAL	A	335	L	H	OD2	ASP	V	147
R	H	O	LEU	A	336	L	H	HG	SER	V	168
R	H	CG	LEU	A	336	L	H	HA	SER	V	165
R	H	CD2	LEU	A	336	L	H	CA	SER	V	165
R	H	CD2	LEU	A	336	L	H	CB	SER	V	165
R	H	CD2	LEU	A	336	L	H	OG	SER	V	165
R	H	CD2	LEU	A	336	L	H	HA	SER	V	165
R	H	CD2	LEU	A	336	L	H	HB3	SER	V	165
R	H	CD2	LEU	A	336	L	H	CB	SER	V	168
R	H	CD2	LEU	A	336	L	H	HB2	SER	V	168
R	H	CD2	LEU	A	336	L	H	HB3	SER	V	168
R	H	CD2	LEU	A	336	L	H	HG	SER	V	168
R	H	O	LEU	A	339	L	-	CB	ASP	V	172
R	H	O	LEU	A	339	L	-	HB2	ASP	V	172
R	H	O	LEU	A	339	L	-	HB3	ASP	V	172
R	H	CD1	LEU	A	339	L	-	HD11	LEU	V	146
R	H	CD1	LEU	A	339	L	-	HD13	LEU	V	146
R	H	CD2	LEU	A	339	L	-	HB2	ASN	V	174
R	H	CD2	LEU	A	339	L	-	HD21	ASN	V	174
R	H	CA	TYR	A	340	L	-	HB2	ASP	V	172
R	H	O	TYR	A	340	L	-	HB3	ASP	V	172
R	H	CD2	TYR	A	340	L	-	CG	ASP	V	172
R	H	CD2	TYR	A	340	L	-	OD2	ASP	V	172
R	H	CE2	TYR	A	340	L	-	OD2	ASP	V	172
R	H	N	CYS	A	343	L	-	HB3	ASP	V	172
R	H	CA	CYS	A	343	L	-	CB	ASP	V	172
R	H	CA	CYS	A	343	L	-	OD1	ASP	V	172
R	H	CA	CYS	A	343	L	-	HA	ASP	V	172
R	H	CA	CYS	A	343	L	-	HB3	ASP	V	172
R	H	C	CYS	A	343	L	-	OD1	ASP	V	172
R	H	C	CYS	A	343	L	-	HB3	ASP	V	172
R	H	CB	CYS	A	343	L	-	CA	ASP	V	172
R	H	CB	CYS	A	343	L	-	C	ASP	V	172
R	H	CB	CYS	A	343	L	-	CB	ASP	V	172
R	H	CB	CYS	A	343	L	-	O	ASP	V	172
R	H	CB	CYS	A	343	L	-	CG	ASP	V	172
R	H	CB	CYS	A	343	L	-	OD1	ASP	V	172
R	H	CB	CYS	A	343	L	-	OD2	ASP	V	172
R	H	CB	CYS	A	343	L	-	HA	ASP	V	172
R	H	CB	CYS	A	343	L	-	HB2	ASP	V	172
R	H	CB	CYS	A	343	L	-	HB3	ASP	V	172
R	H	O	CYS	A	343	L	H	HH	TYR	V	187
R	H	SG	CYS	A	343	L	-	N	ASP	V	172
R	H	SG	CYS	A	343	L	-	CA	ASP	V	172
R	H	SG	CYS	A	343	L	-	C	ASP	V	172
R	H	SG	CYS	A	343	L	-	CB	ASP	V	172
R	H	SG	CYS	A	343	L	-	O	ASP	V	172
R	H	SG	CYS	A	343	L	-	CG	ASP	V	172
R	H	SG	CYS	A	343	L	-	HA	ASP	V	172
R	H	SG	CYS	A	343	L	-	HB2	ASP	V	172
R	H	SG	CYS	A	343	L	-	HB3	ASP	V	172
R	H	SG	CYS	A	343	L	-	N	CYS	V	173
R	H	SG	CYS	A	343	L	-	CA	CYS	V	173
R	H	SG	CYS	A	343	L	-	C	CYS	V	173
R	H	SG	CYS	A	343	L	-	O	CYS	V	173
R	H	SG	CYS	A	343	L	-	H	CYS	V	173
R	H	SG	CYS	A	343	L	-	HA	CYS	V	173
R	H	N	LYS	A	344	L	-	OD1	ASP	V	172
R	H	CB	PHE	A	346	L	H	HE1	TYR	V	187
R	H	CG	PHE	A	346	L	-	HG3	PRO	V	175
R	H	CG	PHE	A	346	L	H	HE1	TYR	V	187
R	H	CD1	PHE	A	346	L	H	CD2	LEU	V	188
R	H	CD1	PHE	A	346	L	H	HD21	LEU	V	188
R	H	CD1	PHE	A	346	L	H	HD22	LEU	V	188
R	H	CD1	PHE	A	346	L	H	HD23	LEU	V	188
R	H	CD2	PHE	A	346	L	-	CG	PRO	V	175
R	H	CD2	PHE	A	346	L	-	CD	PRO	V	175
R	H	CD2	PHE	A	346	L	-	HG2	PRO	V	175
R	H	CD2	PHE	A	346	L	-	HG3	PRO	V	175
R	H	CD2	PHE	A	346	L	-	HD3	PRO	V	175
R	H	CD2	PHE	A	346	L	H	HE1	TYR	V	187
R	H	CE1	PHE	A	346	L	-	HG2	PRO	V	175
R	H	CE1	PHE	A	346	L	H	CD2	LEU	V	188
R	H	CE1	PHE	A	346	L	H	HD22	LEU	V	188
R	H	CE1	PHE	A	346	L	H	HD23	LEU	V	188
R	H	CE2	PHE	A	346	L	-	CG	PRO	V	175
R	H	CE2	PHE	A	346	L	-	CD	PRO	V	175
R	H	CE2	PHE	A	346	L	-	HG2	PRO	V	175
R	H	CE2	PHE	A	346	L	-	HG3	PRO	V	175
R	H	CE2	PHE	A	346	L	-	HD3	PRO	V	175
R	H	CZ	PHE	A	346	L	-	CG	PRO	V	175
R	H	CZ	PHE	A	346	L	-	HG2	PRO	V	175
R	H	CZ	PHE	A	346	L	-	HD3	PRO	V	175
R	H	CZ	PHE	A	346	L	H	HD23	LEU	V	188
R	H	N	ASP	A	347	L	H	HH12	ARG	V	191
R	H	CA	ASP	A	347	L	H	HH12	ARG	V	191
R	H	CB	ASP	A	347	L	H	HH12	ARG	V	191
R	H	CG	ASP	A	347	L	H	HH12	ARG	V	191
R	H	OD1	ASP	A	347	L	H	HH12	ARG	V	191
R	-	CE1	HIS	A	440	L	-	O	GLY	V	102
R	-	CE1	HIS	A	440	L	-	HA2	GLY	V	102
R	-	O	PHE	A	441	L	-	CA	GLY	V	102
R	-	O	PHE	A	441	L	-	HA2	GLY	V	102
R	-	O	PHE	A	441	L	-	HA3	GLY	V	102
R	-	N	VAL	A	443	L	-	HA3	GLY	V	102
R	-	CA	VAL	A	443	L	-	HA3	GLY	V	102
R	-	CB	VAL	A	443	L	-	C	PRO	V	101
R	-	CB	VAL	A	443	L	-	O	PRO	V	101
R	-	CB	VAL	A	443	L	-	HB3	PRO	V	101
R	-	CB	VAL	A	443	L	-	N	GLY	V	102
R	-	CB	VAL	A	443	L	-	CA	GLY	V	102
R	-	CB	VAL	A	443	L	-	HA3	GLY	V	102
R	-	CG1	VAL	A	443	L	-	C	PRO	V	101
R	-	CG1	VAL	A	443	L	-	O	PRO	V	101
R	-	CG1	VAL	A	443	L	-	HB3	PRO	V	101
R	-	CG2	VAL	A	443	L	-	C	PRO	V	101
R	-	CG2	VAL	A	443	L	-	CB	PRO	V	101
R	-	CG2	VAL	A	443	L	-	O	PRO	V	101
R	-	CG2	VAL	A	443	L	-	HB2	PRO	V	101
R	-	CG2	VAL	A	443	L	-	HB3	PRO	V	101
R	-	CG2	VAL	A	443	L	-	N	GLY	V	102
R	-	CG2	VAL	A	443	L	-	CA	GLY	V	102
R	-	CG2	VAL	A	443	L	-	HA3	GLY	V	102
R	-	N	TYR	A	444	L	-	HA3	GLY	V	102
R	-	CA	TYR	A	444	L	H	HG21	THR	V	171
R	-	CB	TYR	A	444	L	H	CG2	THR	V	171
R	-	CB	TYR	A	444	L	H	HG21	THR	V	171
R	-	CB	TYR	A	444	L	H	HG22	THR	V	171
R	-	CB	TYR	A	444	L	H	HG23	THR	V	171
R	-	CG	TYR	A	444	L	H	CG2	THR	V	171
R	-	CG	TYR	A	444	L	H	HG21	THR	V	171
R	-	CG	TYR	A	444	L	H	HG22	THR	V	171
R	-	CG	TYR	A	444	L	H	HG23	THR	V	171
R	-	CD1	TYR	A	444	L	-	CA	GLY	V	102
R	-	CD1	TYR	A	444	L	-	C	GLY	V	102
R	-	CD1	TYR	A	444	L	-	O	GLY	V	102
R	-	CD1	TYR	A	444	L	-	HA3	GLY	V	102
R	-	CD1	TYR	A	444	L	-	N	SER	V	103
R	-	CD1	TYR	A	444	L	-	CA	SER	V	103
R	-	CD1	TYR	A	444	L	-	HA	SER	V	103
R	-	CD1	TYR	A	444	L	H	CG2	THR	V	171
R	-	CD1	TYR	A	444	L	H	HG22	THR	V	171
R	-	CD2	TYR	A	444	L	H	HG22	THR	V	171
R	-	CD2	TYR	A	444	L	H	HG23	THR	V	171
R	-	CE1	TYR	A	444	L	-	CA	GLY	V	102
R	-	CE1	TYR	A	444	L	-	C	GLY	V	102
R	-	CE1	TYR	A	444	L	-	O	GLY	V	102
R	-	CE1	TYR	A	444	L	-	HA3	GLY	V	102
R	-	CE1	TYR	A	444	L	-	N	SER	V	103
R	-	CE1	TYR	A	444	L	-	CA	SER	V	103
R	-	CE1	TYR	A	444	L	-	HA	SER	V	103
R	-	CE2	TYR	A	444	L	H	HH22	ARG	V	191
R	-	OH	TYR	A	444	L	-	O	GLY	V	102
R	-	OH	TYR	A	444	L	-	HA	SER	V	103
R	-	OH	TYR	A	444	L	H	HH21	ARG	V	191
R	-	OH	TYR	A	444	L	H	HH22	ARG	V	191
R	-	CZ	TYR	A	444	L	-	O	GLY	V	102
R	-	CZ	TYR	A	444	L	-	HA	SER	V	103

- 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