IID

Q96A58_P61225.1 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	H	LYS	V	73
R	-	MET	A	1	L	H	ASN	V	74
R	H	THR	A	157	L	-	MET	V	1
R	H	THR	A	157	L	S	ARG	V	2
R	H	GLU	A	158	L	-	MET	V	1
R	H	TYR	A	161	L	-	MET	V	1
R	H	TYR	A	161	L	S	ARG	V	2
R	H	TYR	A	161	L	S	GLU	V	3
R	H	LEU	A	27	L	-	GLN	V	169
R	H	LEU	A	27	L	S	ARG	V	2
R	H	THR	A	28	L	-	GLN	V	169
R	-	LYS	A	29	L	S	ARG	V	2
R	-	LYS	A	29	L	S	SER	V	49
R	-	THR	A	38	L	-	SER	V	178
R	-	GLU	A	40	L	-	GLU	V	174
R	-	GLU	A	40	L	-	GLY	V	175
R	-	GLU	A	40	L	-	CYS	V	176
R	-	GLU	A	40	L	-	SER	V	178
R	S	SER	A	41	L	-	GLU	V	174
R	S	SER	A	41	L	-	GLY	V	175
R	S	SER	A	41	L	-	CYS	V	176
R	S	THR	A	42	L	-	PRO	V	170
R	S	THR	A	42	L	-	GLU	V	174
R	S	TYR	A	43	L	-	PRO	V	170
R	S	TYR	A	43	L	-	GLY	V	172
R	S	ARG	A	44	L	-	ALA	V	168
R	S	ARG	A	44	L	-	PRO	V	170
R	S	HIS	A	45	L	-	ALA	V	168
R	S	HIS	A	45	L	S	ARG	V	2
R	S	GLN	A	46	L	-	TYR	V	106
R	S	GLN	A	46	L	-	ALA	V	168
R	S	GLN	A	46	L	S	ARG	V	2
R	S	GLN	A	46	L	-	GLN	V	76
R	S	ALA	A	47	L	S	ARG	V	2
R	S	ALA	A	47	L	S	GLU	V	3
R	S	ALA	A	47	L	-	GLN	V	76
R	S	THR	A	48	L	S	ARG	V	2
R	S	THR	A	48	L	S	GLU	V	3
R	S	THR	A	48	L	S	TYR	V	4
R	S	THR	A	48	L	S	LYS	V	5
R	S	THR	A	48	L	-	GLN	V	76
R	S	ILE	A	49	L	S	GLU	V	3
R	-	ASP	A	50	L	S	GLU	V	3
R	-	ASP	A	51	L	S	GLU	V	3
R	-	ASP	A	51	L	S	ARG	V	41
R	-	ASP	A	51	L	S	LYS	V	5
R	-	ASP	A	51	L	S	GLU	V	54
R	S	GLU	A	52	L	S	LYS	V	5
R	S	VAL	A	53	L	S	LYS	V	5
R	S	VAL	A	53	L	-	GLN	V	76
R	-	ASP	A	66	L	-	VAL	V	181
R	H	GLN	A	69	L	-	SER	V	178

- 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

Q96A58_P61225.1 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	MET	A	1	L	H	NZ	LYS	V	73
R	-	N	MET	A	1	L	H	HZ1	LYS	V	73
R	-	N	MET	A	1	L	H	HZ2	LYS	V	73
R	-	N	MET	A	1	L	H	HZ3	LYS	V	73
R	-	CA	MET	A	1	L	H	NZ	LYS	V	73
R	-	CA	MET	A	1	L	H	HZ1	LYS	V	73
R	-	CA	MET	A	1	L	H	HZ2	LYS	V	73
R	-	C	MET	A	1	L	H	HZ1	LYS	V	73
R	-	CB	MET	A	1	L	H	CE	LYS	V	73
R	-	CB	MET	A	1	L	H	NZ	LYS	V	73
R	-	CB	MET	A	1	L	H	HE2	LYS	V	73
R	-	CB	MET	A	1	L	H	HZ1	LYS	V	73
R	-	CB	MET	A	1	L	H	HZ2	LYS	V	73
R	-	O	MET	A	1	L	H	HZ1	LYS	V	73
R	-	CG	MET	A	1	L	H	CE	LYS	V	73
R	-	CG	MET	A	1	L	H	NZ	LYS	V	73
R	-	CG	MET	A	1	L	H	HE2	LYS	V	73
R	-	CG	MET	A	1	L	H	HZ1	LYS	V	73
R	-	CG	MET	A	1	L	H	HZ2	LYS	V	73
R	-	SD	MET	A	1	L	H	CD	LYS	V	73
R	-	SD	MET	A	1	L	H	CE	LYS	V	73
R	-	SD	MET	A	1	L	H	NZ	LYS	V	73
R	-	SD	MET	A	1	L	H	HG2	LYS	V	73
R	-	SD	MET	A	1	L	H	HD3	LYS	V	73
R	-	SD	MET	A	1	L	H	HE2	LYS	V	73
R	-	SD	MET	A	1	L	H	HZ2	LYS	V	73
R	-	SD	MET	A	1	L	H	OD1	ASN	V	74
R	-	CE	MET	A	1	L	H	CG	ASN	V	74
R	-	CE	MET	A	1	L	H	ND2	ASN	V	74
R	-	CE	MET	A	1	L	H	OD1	ASN	V	74
R	-	CE	MET	A	1	L	H	HD22	ASN	V	74
R	H	O	LEU	A	27	L	S	HH11	ARG	V	2
R	H	O	LEU	A	27	L	S	HH12	ARG	V	2
R	H	O	LEU	A	27	L	-	HG3	GLN	V	169
R	H	O	LEU	A	27	L	-	HE21	GLN	V	169
R	H	CA	THR	A	28	L	-	NE2	GLN	V	169
R	H	CA	THR	A	28	L	-	HE21	GLN	V	169
R	H	CB	THR	A	28	L	-	NE2	GLN	V	169
R	H	CB	THR	A	28	L	-	HE21	GLN	V	169
R	H	CB	THR	A	28	L	-	HE22	GLN	V	169
R	H	CG2	THR	A	28	L	-	CD	GLN	V	169
R	H	CG2	THR	A	28	L	-	NE2	GLN	V	169
R	H	CG2	THR	A	28	L	-	HG3	GLN	V	169
R	H	CG2	THR	A	28	L	-	HE21	GLN	V	169
R	H	CG2	THR	A	28	L	-	HE22	GLN	V	169
R	-	CA	LYS	A	29	L	S	OG	SER	V	49
R	-	CB	LYS	A	29	L	S	CB	SER	V	49
R	-	CB	LYS	A	29	L	S	OG	SER	V	49
R	-	CB	LYS	A	29	L	S	HB2	SER	V	49
R	-	CB	LYS	A	29	L	S	HB3	SER	V	49
R	-	CB	LYS	A	29	L	S	HG	SER	V	49
R	-	O	LYS	A	29	L	S	HG	SER	V	49
R	-	CG	LYS	A	29	L	S	CB	SER	V	49
R	-	CG	LYS	A	29	L	S	OG	SER	V	49
R	-	CG	LYS	A	29	L	S	HB2	SER	V	49
R	-	CG	LYS	A	29	L	S	HB3	SER	V	49
R	-	CG	LYS	A	29	L	S	HG	SER	V	49
R	-	CD	LYS	A	29	L	S	CB	SER	V	49
R	-	CD	LYS	A	29	L	S	OG	SER	V	49
R	-	CD	LYS	A	29	L	S	HB3	SER	V	49
R	-	CE	LYS	A	29	L	S	HD3	ARG	V	2
R	-	CE	LYS	A	29	L	S	HH11	ARG	V	2
R	-	CE	LYS	A	29	L	S	HB3	SER	V	49
R	-	NZ	LYS	A	29	L	S	HB2	ARG	V	2
R	-	NZ	LYS	A	29	L	S	HD2	ARG	V	2
R	-	NZ	LYS	A	29	L	S	HD3	ARG	V	2
R	-	CA	THR	A	38	L	-	HG	SER	V	178
R	-	C	THR	A	38	L	-	OG	SER	V	178
R	-	C	THR	A	38	L	-	HG	SER	V	178
R	-	CB	THR	A	38	L	-	HG	SER	V	178
R	-	O	THR	A	38	L	-	CB	SER	V	178
R	-	O	THR	A	38	L	-	OG	SER	V	178
R	-	O	THR	A	38	L	-	HB2	SER	V	178
R	-	O	THR	A	38	L	-	HB3	SER	V	178
R	-	O	THR	A	38	L	-	HG	SER	V	178
R	-	N	GLU	A	40	L	-	O	CYS	V	176
R	-	N	GLU	A	40	L	-	HB3	SER	V	178
R	-	CA	GLU	A	40	L	-	HB3	CYS	V	176
R	-	C	GLU	A	40	L	-	O	CYS	V	176
R	-	C	GLU	A	40	L	-	H	CYS	V	176
R	-	C	GLU	A	40	L	-	HB3	CYS	V	176
R	-	CB	GLU	A	40	L	-	O	CYS	V	176
R	-	CB	GLU	A	40	L	-	HB3	CYS	V	176
R	-	CB	GLU	A	40	L	-	HB3	SER	V	178
R	-	O	GLU	A	40	L	-	O	GLU	V	174
R	-	O	GLU	A	40	L	-	HA2	GLY	V	175
R	-	O	GLU	A	40	L	-	N	CYS	V	176
R	-	O	GLU	A	40	L	-	CA	CYS	V	176
R	-	O	GLU	A	40	L	-	C	CYS	V	176
R	-	O	GLU	A	40	L	-	CB	CYS	V	176
R	-	O	GLU	A	40	L	-	O	CYS	V	176
R	-	O	GLU	A	40	L	-	H	CYS	V	176
R	-	O	GLU	A	40	L	-	HB2	CYS	V	176
R	-	O	GLU	A	40	L	-	HB3	CYS	V	176
R	-	CG	GLU	A	40	L	-	HB3	CYS	V	176
R	-	OE1	GLU	A	40	L	-	SG	CYS	V	176
R	-	OE1	GLU	A	40	L	-	HB3	CYS	V	176
R	-	OE1	GLU	A	40	L	-	HG	CYS	V	176
R	S	N	SER	A	41	L	-	HB3	CYS	V	176
R	S	CA	SER	A	41	L	-	O	GLU	V	174
R	S	CA	SER	A	41	L	-	H	CYS	V	176
R	S	CA	SER	A	41	L	-	HB3	CYS	V	176
R	S	CB	SER	A	41	L	-	O	GLU	V	174
R	S	OG	SER	A	41	L	-	O	GLU	V	174
R	S	OG	SER	A	41	L	-	HA2	GLY	V	175
R	S	OG	SER	A	41	L	-	H	CYS	V	176
R	S	O	THR	A	42	L	-	HG2	PRO	V	170
R	S	O	THR	A	42	L	-	HB2	GLU	V	174
R	S	N	TYR	A	43	L	-	HG2	PRO	V	170
R	S	CA	TYR	A	43	L	-	CG	PRO	V	170
R	S	CA	TYR	A	43	L	-	HG2	PRO	V	170
R	S	CA	TYR	A	43	L	-	HG3	PRO	V	170
R	S	C	TYR	A	43	L	-	CG	PRO	V	170
R	S	C	TYR	A	43	L	-	HG2	PRO	V	170
R	S	CB	TYR	A	43	L	-	CG	PRO	V	170
R	S	CB	TYR	A	43	L	-	HG2	PRO	V	170
R	S	CB	TYR	A	43	L	-	HG3	PRO	V	170
R	S	O	TYR	A	43	L	-	HG2	PRO	V	170
R	S	CG	TYR	A	43	L	-	CG	PRO	V	170
R	S	CG	TYR	A	43	L	-	HG2	PRO	V	170
R	S	CG	TYR	A	43	L	-	HG3	PRO	V	170
R	S	CD1	TYR	A	43	L	-	CG	PRO	V	170
R	S	CD1	TYR	A	43	L	-	HG2	PRO	V	170
R	S	CD1	TYR	A	43	L	-	HG3	PRO	V	170
R	S	CD1	TYR	A	43	L	-	HD2	PRO	V	170
R	S	CE1	TYR	A	43	L	-	HG3	PRO	V	170
R	S	CE1	TYR	A	43	L	-	HA2	GLY	V	172
R	S	N	ARG	A	44	L	-	CB	PRO	V	170
R	S	N	ARG	A	44	L	-	CG	PRO	V	170
R	S	N	ARG	A	44	L	-	CD	PRO	V	170
R	S	N	ARG	A	44	L	-	HB3	PRO	V	170
R	S	N	ARG	A	44	L	-	HG2	PRO	V	170
R	S	N	ARG	A	44	L	-	HD3	PRO	V	170
R	S	CA	ARG	A	44	L	-	HB3	PRO	V	170
R	S	CA	ARG	A	44	L	-	HG2	PRO	V	170
R	S	CA	ARG	A	44	L	-	HD3	PRO	V	170
R	S	C	ARG	A	44	L	-	O	ALA	V	168
R	S	C	ARG	A	44	L	-	HG2	PRO	V	170
R	S	C	ARG	A	44	L	-	HD3	PRO	V	170
R	S	CB	ARG	A	44	L	-	HB3	PRO	V	170
R	S	O	ARG	A	44	L	-	C	ALA	V	168
R	S	O	ARG	A	44	L	-	O	ALA	V	168
R	S	O	ARG	A	44	L	-	N	PRO	V	170
R	S	O	ARG	A	44	L	-	CG	PRO	V	170
R	S	O	ARG	A	44	L	-	CD	PRO	V	170
R	S	O	ARG	A	44	L	-	HB3	PRO	V	170
R	S	O	ARG	A	44	L	-	HG2	PRO	V	170
R	S	O	ARG	A	44	L	-	HD2	PRO	V	170
R	S	O	ARG	A	44	L	-	HD3	PRO	V	170
R	S	CA	HIS	A	45	L	-	O	ALA	V	168
R	S	CA	HIS	A	45	L	-	HB1	ALA	V	168
R	S	CG	HIS	A	45	L	-	HB1	ALA	V	168
R	S	ND1	HIS	A	45	L	S	NH1	ARG	V	2
R	S	ND1	HIS	A	45	L	S	NH2	ARG	V	2
R	S	ND1	HIS	A	45	L	S	CZ	ARG	V	2
R	S	ND1	HIS	A	45	L	S	HH12	ARG	V	2
R	S	ND1	HIS	A	45	L	S	HH21	ARG	V	2
R	S	ND1	HIS	A	45	L	S	HH22	ARG	V	2
R	S	ND1	HIS	A	45	L	-	CB	ALA	V	168
R	S	ND1	HIS	A	45	L	-	O	ALA	V	168
R	S	ND1	HIS	A	45	L	-	HB1	ALA	V	168
R	S	ND1	HIS	A	45	L	-	HB2	ALA	V	168
R	S	ND1	HIS	A	45	L	-	HB3	ALA	V	168
R	S	CE1	HIS	A	45	L	S	NE	ARG	V	2
R	S	CE1	HIS	A	45	L	S	NH1	ARG	V	2
R	S	CE1	HIS	A	45	L	S	NH2	ARG	V	2
R	S	CE1	HIS	A	45	L	S	CZ	ARG	V	2
R	S	CE1	HIS	A	45	L	S	HD2	ARG	V	2
R	S	CE1	HIS	A	45	L	S	HE	ARG	V	2
R	S	CE1	HIS	A	45	L	S	HH11	ARG	V	2
R	S	CE1	HIS	A	45	L	S	HH12	ARG	V	2
R	S	CE1	HIS	A	45	L	S	HH21	ARG	V	2
R	S	CE1	HIS	A	45	L	S	HH22	ARG	V	2
R	S	CE1	HIS	A	45	L	-	CB	ALA	V	168
R	S	CE1	HIS	A	45	L	-	HB1	ALA	V	168
R	S	CE1	HIS	A	45	L	-	HB2	ALA	V	168
R	S	NE2	HIS	A	45	L	S	CD	ARG	V	2
R	S	NE2	HIS	A	45	L	S	NE	ARG	V	2
R	S	NE2	HIS	A	45	L	S	NH1	ARG	V	2
R	S	NE2	HIS	A	45	L	S	NH2	ARG	V	2
R	S	NE2	HIS	A	45	L	S	CZ	ARG	V	2
R	S	NE2	HIS	A	45	L	S	HD2	ARG	V	2
R	S	NE2	HIS	A	45	L	S	HE	ARG	V	2
R	S	NE2	HIS	A	45	L	S	HH11	ARG	V	2
R	S	NE2	HIS	A	45	L	S	HH12	ARG	V	2
R	S	NE2	HIS	A	45	L	S	HH21	ARG	V	2
R	S	NE2	HIS	A	45	L	S	HH22	ARG	V	2
R	S	N	GLN	A	46	L	-	HB1	ALA	V	168
R	S	C	GLN	A	46	L	S	HH21	ARG	V	2
R	S	C	GLN	A	46	L	-	HE21	GLN	V	76
R	S	C	GLN	A	46	L	-	HE22	GLN	V	76
R	S	CB	GLN	A	46	L	-	HE21	GLN	V	76
R	S	O	GLN	A	46	L	S	NE	ARG	V	2
R	S	O	GLN	A	46	L	S	NH2	ARG	V	2
R	S	O	GLN	A	46	L	S	CZ	ARG	V	2
R	S	O	GLN	A	46	L	S	HE	ARG	V	2
R	S	O	GLN	A	46	L	S	HH21	ARG	V	2
R	S	O	GLN	A	46	L	S	HH22	ARG	V	2
R	S	O	GLN	A	46	L	-	HE21	GLN	V	76
R	S	O	GLN	A	46	L	-	HE22	GLN	V	76
R	S	O	GLN	A	46	L	-	HB1	ALA	V	168
R	S	O	GLN	A	46	L	-	HB3	ALA	V	168
R	S	CD	GLN	A	46	L	-	HH	TYR	V	106
R	S	NE2	GLN	A	46	L	-	OH	TYR	V	106
R	S	NE2	GLN	A	46	L	-	HH	TYR	V	106
R	S	OE1	GLN	A	46	L	-	HE21	GLN	V	76
R	S	OE1	GLN	A	46	L	-	HH	TYR	V	106
R	S	N	ALA	A	47	L	-	HE22	GLN	V	76
R	S	CA	ALA	A	47	L	S	HG3	ARG	V	2
R	S	CA	ALA	A	47	L	S	HE	ARG	V	2
R	S	CA	ALA	A	47	L	-	HE22	GLN	V	76
R	S	C	ALA	A	47	L	S	O	GLU	V	3
R	S	C	ALA	A	47	L	-	HE22	GLN	V	76
R	S	CB	ALA	A	47	L	S	HG3	ARG	V	2
R	S	CB	ALA	A	47	L	S	HE	ARG	V	2
R	S	O	ALA	A	47	L	-	HE22	GLN	V	76
R	S	N	THR	A	48	L	S	C	GLU	V	3
R	S	N	THR	A	48	L	S	O	GLU	V	3
R	S	N	THR	A	48	L	S	H	GLU	V	3
R	S	N	THR	A	48	L	S	HB2	GLU	V	3
R	S	N	THR	A	48	L	-	HE22	GLN	V	76
R	S	CA	THR	A	48	L	S	CA	GLU	V	3
R	S	CA	THR	A	48	L	S	C	GLU	V	3
R	S	CA	THR	A	48	L	S	CB	GLU	V	3
R	S	CA	THR	A	48	L	S	O	GLU	V	3
R	S	CA	THR	A	48	L	S	H	GLU	V	3
R	S	CA	THR	A	48	L	S	HB2	GLU	V	3
R	S	CA	THR	A	48	L	S	HB3	GLU	V	3
R	S	C	THR	A	48	L	S	N	GLU	V	3
R	S	C	THR	A	48	L	S	CB	GLU	V	3
R	S	C	THR	A	48	L	S	CG	GLU	V	3
R	S	C	THR	A	48	L	S	CD	GLU	V	3
R	S	C	THR	A	48	L	S	OE2	GLU	V	3
R	S	C	THR	A	48	L	S	H	GLU	V	3
R	S	C	THR	A	48	L	S	HB2	GLU	V	3
R	S	C	THR	A	48	L	S	HB3	GLU	V	3
R	S	C	THR	A	48	L	S	HG3	GLU	V	3
R	S	CB	THR	A	48	L	S	N	GLU	V	3
R	S	CB	THR	A	48	L	S	CA	GLU	V	3
R	S	CB	THR	A	48	L	S	C	GLU	V	3
R	S	CB	THR	A	48	L	S	CB	GLU	V	3
R	S	CB	THR	A	48	L	S	O	GLU	V	3
R	S	CB	THR	A	48	L	S	CG	GLU	V	3
R	S	CB	THR	A	48	L	S	OE2	GLU	V	3
R	S	CB	THR	A	48	L	S	H	GLU	V	3
R	S	CB	THR	A	48	L	S	HB2	GLU	V	3
R	S	CB	THR	A	48	L	S	HB3	GLU	V	3
R	S	CB	THR	A	48	L	S	N	TYR	V	4
R	S	CB	THR	A	48	L	S	HG3	LYS	V	5
R	S	CB	THR	A	48	L	S	HE2	LYS	V	5
R	S	CB	THR	A	48	L	S	HE3	LYS	V	5
R	S	O	THR	A	48	L	S	HA	ARG	V	2
R	S	O	THR	A	48	L	S	N	GLU	V	3
R	S	O	THR	A	48	L	S	CA	GLU	V	3
R	S	O	THR	A	48	L	S	CB	GLU	V	3
R	S	O	THR	A	48	L	S	O	GLU	V	3
R	S	O	THR	A	48	L	S	CG	GLU	V	3
R	S	O	THR	A	48	L	S	CD	GLU	V	3
R	S	O	THR	A	48	L	S	OE2	GLU	V	3
R	S	O	THR	A	48	L	S	H	GLU	V	3
R	S	O	THR	A	48	L	S	HB2	GLU	V	3
R	S	O	THR	A	48	L	S	HB3	GLU	V	3
R	S	O	THR	A	48	L	S	HG2	GLU	V	3
R	S	O	THR	A	48	L	S	HG3	GLU	V	3
R	S	CG2	THR	A	48	L	S	CB	GLU	V	3
R	S	CG2	THR	A	48	L	S	CG	GLU	V	3
R	S	CG2	THR	A	48	L	S	CD	GLU	V	3
R	S	CG2	THR	A	48	L	S	OE2	GLU	V	3
R	S	CG2	THR	A	48	L	S	HB2	GLU	V	3
R	S	CG2	THR	A	48	L	S	HB3	GLU	V	3
R	S	CG2	THR	A	48	L	S	CE	LYS	V	5
R	S	CG2	THR	A	48	L	S	HG3	LYS	V	5
R	S	CG2	THR	A	48	L	S	HE2	LYS	V	5
R	S	CG2	THR	A	48	L	S	HE3	LYS	V	5
R	S	CG2	THR	A	48	L	S	HZ1	LYS	V	5
R	S	OG1	THR	A	48	L	S	CA	GLU	V	3
R	S	OG1	THR	A	48	L	S	C	GLU	V	3
R	S	OG1	THR	A	48	L	S	CB	GLU	V	3
R	S	OG1	THR	A	48	L	S	O	GLU	V	3
R	S	OG1	THR	A	48	L	S	HB2	GLU	V	3
R	S	OG1	THR	A	48	L	S	HB3	GLU	V	3
R	S	OG1	THR	A	48	L	S	N	TYR	V	4
R	S	OG1	THR	A	48	L	S	CA	TYR	V	4
R	S	OG1	THR	A	48	L	S	C	TYR	V	4
R	S	OG1	THR	A	48	L	S	HA	TYR	V	4
R	S	OG1	THR	A	48	L	S	N	LYS	V	5
R	S	OG1	THR	A	48	L	S	CG	LYS	V	5
R	S	OG1	THR	A	48	L	S	CE	LYS	V	5
R	S	OG1	THR	A	48	L	S	H	LYS	V	5
R	S	OG1	THR	A	48	L	S	HG2	LYS	V	5
R	S	OG1	THR	A	48	L	S	HG3	LYS	V	5
R	S	OG1	THR	A	48	L	S	HE2	LYS	V	5
R	S	OG1	THR	A	48	L	S	HE3	LYS	V	5
R	S	OG1	THR	A	48	L	-	CD	GLN	V	76
R	S	OG1	THR	A	48	L	-	NE2	GLN	V	76
R	S	OG1	THR	A	48	L	-	OE1	GLN	V	76
R	S	OG1	THR	A	48	L	-	HE22	GLN	V	76
R	S	N	ILE	A	49	L	S	OE2	GLU	V	3
R	S	N	ILE	A	49	L	S	HB2	GLU	V	3
R	S	CA	ILE	A	49	L	S	OE2	GLU	V	3
R	S	C	ILE	A	49	L	S	OE2	GLU	V	3
R	-	N	ASP	A	50	L	S	CD	GLU	V	3
R	-	N	ASP	A	50	L	S	OE2	GLU	V	3
R	-	CA	ASP	A	50	L	S	OE2	GLU	V	3
R	-	C	ASP	A	50	L	S	OE2	GLU	V	3
R	-	N	ASP	A	51	L	S	CD	GLU	V	3
R	-	N	ASP	A	51	L	S	OE2	GLU	V	3
R	-	CA	ASP	A	51	L	S	OE2	GLU	V	3
R	-	CA	ASP	A	51	L	S	HZ1	LYS	V	5
R	-	CA	ASP	A	51	L	S	OE1	GLU	V	54
R	-	C	ASP	A	51	L	S	CE	LYS	V	5
R	-	C	ASP	A	51	L	S	NZ	LYS	V	5
R	-	C	ASP	A	51	L	S	HE2	LYS	V	5
R	-	C	ASP	A	51	L	S	HE3	LYS	V	5
R	-	C	ASP	A	51	L	S	HZ1	LYS	V	5
R	-	C	ASP	A	51	L	S	HZ2	LYS	V	5
R	-	C	ASP	A	51	L	S	HZ3	LYS	V	5
R	-	CB	ASP	A	51	L	S	OE1	GLU	V	54
R	-	O	ASP	A	51	L	S	CE	LYS	V	5
R	-	O	ASP	A	51	L	S	NZ	LYS	V	5
R	-	O	ASP	A	51	L	S	HE2	LYS	V	5
R	-	O	ASP	A	51	L	S	HE3	LYS	V	5
R	-	O	ASP	A	51	L	S	HZ1	LYS	V	5
R	-	O	ASP	A	51	L	S	HZ2	LYS	V	5
R	-	O	ASP	A	51	L	S	HZ3	LYS	V	5
R	-	CG	ASP	A	51	L	S	OE1	GLU	V	54
R	-	OD1	ASP	A	51	L	S	OE2	GLU	V	3
R	-	OD1	ASP	A	51	L	S	NE	ARG	V	41
R	-	OD1	ASP	A	51	L	S	NH2	ARG	V	41
R	-	OD1	ASP	A	51	L	S	CZ	ARG	V	41
R	-	OD1	ASP	A	51	L	S	HD2	ARG	V	41
R	-	OD1	ASP	A	51	L	S	HE	ARG	V	41
R	-	OD1	ASP	A	51	L	S	HH21	ARG	V	41
R	-	OD1	ASP	A	51	L	S	CD	GLU	V	54
R	-	OD1	ASP	A	51	L	S	OE1	GLU	V	54
R	S	N	GLU	A	52	L	S	NZ	LYS	V	5
R	S	N	GLU	A	52	L	S	HZ1	LYS	V	5
R	S	CA	GLU	A	52	L	S	NZ	LYS	V	5
R	S	CA	GLU	A	52	L	S	HZ1	LYS	V	5
R	S	CA	GLU	A	52	L	S	HZ3	LYS	V	5
R	S	C	GLU	A	52	L	S	HE3	LYS	V	5
R	S	C	GLU	A	52	L	S	HZ1	LYS	V	5
R	S	N	VAL	A	53	L	S	HE3	LYS	V	5
R	S	N	VAL	A	53	L	S	HZ1	LYS	V	5
R	S	N	VAL	A	53	L	S	HZ3	LYS	V	5
R	S	CA	VAL	A	53	L	S	HE3	LYS	V	5
R	S	CG1	VAL	A	53	L	-	NE2	GLN	V	76
R	S	CG1	VAL	A	53	L	-	HE21	GLN	V	76
R	S	CG1	VAL	A	53	L	-	HE22	GLN	V	76
R	S	CG2	VAL	A	53	L	S	CD	LYS	V	5
R	S	CG2	VAL	A	53	L	S	CE	LYS	V	5
R	S	CG2	VAL	A	53	L	S	HG3	LYS	V	5
R	S	CG2	VAL	A	53	L	S	HD3	LYS	V	5
R	S	CG2	VAL	A	53	L	S	HE3	LYS	V	5
R	S	CG2	VAL	A	53	L	S	HZ3	LYS	V	5
R	S	CG2	VAL	A	53	L	-	CD	GLN	V	76
R	S	CG2	VAL	A	53	L	-	HG3	GLN	V	76
R	-	OD2	ASP	A	66	L	-	O	VAL	V	181
R	-	OD2	ASP	A	66	L	-	HB	VAL	V	181
R	H	NE2	GLN	A	69	L	-	HA	SER	V	178
R	H	OE1	GLN	A	69	L	-	HA	SER	V	178
R	H	CG2	THR	A	157	L	-	HA	MET	V	1
R	H	CG2	THR	A	157	L	-	H1	MET	V	1
R	H	CG2	THR	A	157	L	S	N	ARG	V	2
R	H	CG2	THR	A	157	L	S	H	ARG	V	2
R	H	CG2	THR	A	157	L	S	HB2	ARG	V	2
R	H	CD	GLU	A	158	L	-	H3	MET	V	1
R	H	OE2	GLU	A	158	L	-	N	MET	V	1
R	H	OE2	GLU	A	158	L	-	H1	MET	V	1
R	H	OE2	GLU	A	158	L	-	H2	MET	V	1
R	H	OE2	GLU	A	158	L	-	H3	MET	V	1
R	H	CD2	TYR	A	161	L	-	N	MET	V	1
R	H	CD2	TYR	A	161	L	-	C	MET	V	1
R	H	CD2	TYR	A	161	L	-	O	MET	V	1
R	H	CD2	TYR	A	161	L	-	H1	MET	V	1
R	H	CD2	TYR	A	161	L	-	H2	MET	V	1
R	H	CD2	TYR	A	161	L	S	HA	ARG	V	2
R	H	CE1	TYR	A	161	L	S	HA	ARG	V	2
R	H	CE1	TYR	A	161	L	S	HG3	ARG	V	2
R	H	CE2	TYR	A	161	L	-	N	MET	V	1
R	H	CE2	TYR	A	161	L	-	C	MET	V	1
R	H	CE2	TYR	A	161	L	-	O	MET	V	1
R	H	CE2	TYR	A	161	L	-	H1	MET	V	1
R	H	CE2	TYR	A	161	L	-	H2	MET	V	1
R	H	CE2	TYR	A	161	L	S	N	ARG	V	2
R	H	CE2	TYR	A	161	L	S	CA	ARG	V	2
R	H	CE2	TYR	A	161	L	S	CB	ARG	V	2
R	H	CE2	TYR	A	161	L	S	H	ARG	V	2
R	H	CE2	TYR	A	161	L	S	HA	ARG	V	2
R	H	CE2	TYR	A	161	L	S	HB2	ARG	V	2
R	H	CE2	TYR	A	161	L	S	H	GLU	V	3
R	H	OH	TYR	A	161	L	-	C	MET	V	1
R	H	OH	TYR	A	161	L	-	O	MET	V	1
R	H	OH	TYR	A	161	L	S	N	ARG	V	2
R	H	OH	TYR	A	161	L	S	CA	ARG	V	2
R	H	OH	TYR	A	161	L	S	C	ARG	V	2
R	H	OH	TYR	A	161	L	S	CB	ARG	V	2
R	H	OH	TYR	A	161	L	S	CG	ARG	V	2
R	H	OH	TYR	A	161	L	S	CD	ARG	V	2
R	H	OH	TYR	A	161	L	S	H	ARG	V	2
R	H	OH	TYR	A	161	L	S	HA	ARG	V	2
R	H	OH	TYR	A	161	L	S	HB2	ARG	V	2
R	H	OH	TYR	A	161	L	S	HB3	ARG	V	2
R	H	OH	TYR	A	161	L	S	HG2	ARG	V	2
R	H	OH	TYR	A	161	L	S	HG3	ARG	V	2
R	H	OH	TYR	A	161	L	S	HD2	ARG	V	2
R	H	OH	TYR	A	161	L	S	N	GLU	V	3
R	H	OH	TYR	A	161	L	S	H	GLU	V	3
R	H	CZ	TYR	A	161	L	-	C	MET	V	1
R	H	CZ	TYR	A	161	L	-	O	MET	V	1
R	H	CZ	TYR	A	161	L	S	N	ARG	V	2
R	H	CZ	TYR	A	161	L	S	CA	ARG	V	2
R	H	CZ	TYR	A	161	L	S	CB	ARG	V	2
R	H	CZ	TYR	A	161	L	S	CG	ARG	V	2
R	H	CZ	TYR	A	161	L	S	HA	ARG	V	2
R	H	CZ	TYR	A	161	L	S	HB2	ARG	V	2
R	H	CZ	TYR	A	161	L	S	HG3	ARG	V	2
R	H	CZ	TYR	A	161	L	S	H	GLU	V	3

- 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