IID

P60673_P35080.1 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	-	MET	V	1
R	-	MET	A	1	L	-	GLN	V	135
R	-	MET	A	1	L	-	GLY	V	2
R	-	MET	A	1	L	H	TRP	V	4
R	H	ASN	A	10	L	H	ARG	V	13
R	-	CYS	A	13	L	H	ARG	V	13
R	-	ALA	A	2	L	-	GLN	V	135
R	-	ALA	A	2	L	-	GLY	V	2
R	-	ALA	A	2	L	-	ASP	V	3
R	-	ALA	A	2	L	H	TYR	V	7
R	-	ALA	A	28	L	H	MET	V	134
R	-	GLY	A	3	L	H	LEU	V	132
R	-	GLY	A	3	L	-	GLN	V	135
R	-	GLY	A	3	L	H	TYR	V	7
R	-	TYR	A	30	L	H	ARG	V	130
R	-	TYR	A	30	L	H	ARG	V	133
R	-	TYR	A	30	L	H	MET	V	134
R	S	VAL	A	31	L	H	GLU	V	127
R	S	VAL	A	31	L	H	ARG	V	130
R	S	TRP	A	32	L	H	GLU	V	127
R	S	TRP	A	32	L	H	ARG	V	130
R	S	TRP	A	32	L	H	GLY	V	131
R	S	TRP	A	32	L	H	MET	V	134
R	S	ALA	A	33	L	H	GLU	V	127
R	S	ALA	A	34	L	H	GLU	V	127
R	-	THR	A	35	L	H	GLU	V	127
R	-	ALA	A	36	L	H	THR	V	124
R	-	ALA	A	36	L	H	GLU	V	127
R	-	ALA	A	36	L	-	ASP	V	14
R	-	ALA	A	36	L	-	ARG	V	16
R	-	GLY	A	37	L	-	ARG	V	16
R	H	TRP	A	4	L	H	GLY	V	131
R	H	TRP	A	4	L	H	MET	V	134
R	H	TRP	A	4	L	-	GLN	V	135
R	H	TRP	A	4	L	H	TYR	V	7
R	H	GLN	A	41	L	H	LYS	V	123
R	H	GLN	A	41	L	H	GLU	V	127
R	H	GLN	A	41	L	H	ARG	V	130
R	H	GLN	A	5	L	H	ALA	V	10
R	H	GLN	A	5	L	H	VAL	V	11
R	H	GLN	A	5	L	H	LEU	V	128
R	H	GLN	A	5	L	H	TYR	V	7
R	H	SER	A	6	L	H	VAL	V	6
R	H	SER	A	6	L	H	TYR	V	7
R	H	ASP	A	9	L	H	ALA	V	10
R	H	ASP	A	9	L	H	VAL	V	11
R	H	ASP	A	9	L	H	ARG	V	13

- 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

P60673_P35080.1 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	-	CA	MET	V	1
R	-	N	MET	A	1	L	-	C	MET	V	1
R	-	N	MET	A	1	L	-	CB	MET	V	1
R	-	N	MET	A	1	L	-	O	MET	V	1
R	-	N	MET	A	1	L	-	HA	MET	V	1
R	-	N	MET	A	1	L	-	HB3	MET	V	1
R	-	N	MET	A	1	L	-	HG3	MET	V	1
R	-	N	MET	A	1	L	-	N	GLY	V	2
R	-	N	MET	A	1	L	-	CA	GLY	V	2
R	-	N	MET	A	1	L	-	C	GLY	V	2
R	-	N	MET	A	1	L	-	O	GLY	V	2
R	-	N	MET	A	1	L	-	H	GLY	V	2
R	-	N	MET	A	1	L	-	HA2	GLY	V	2
R	-	N	MET	A	1	L	-	HA3	GLY	V	2
R	-	CA	MET	A	1	L	-	CA	MET	V	1
R	-	CA	MET	A	1	L	-	C	MET	V	1
R	-	CA	MET	A	1	L	-	O	MET	V	1
R	-	CA	MET	A	1	L	-	HA	MET	V	1
R	-	CA	MET	A	1	L	-	N	GLY	V	2
R	-	CA	MET	A	1	L	-	CA	GLY	V	2
R	-	CA	MET	A	1	L	-	C	GLY	V	2
R	-	CA	MET	A	1	L	-	O	GLY	V	2
R	-	CA	MET	A	1	L	-	H	GLY	V	2
R	-	CA	MET	A	1	L	-	HA2	GLY	V	2
R	-	CA	MET	A	1	L	-	HA3	GLY	V	2
R	-	C	MET	A	1	L	-	C	MET	V	1
R	-	C	MET	A	1	L	-	N	GLY	V	2
R	-	C	MET	A	1	L	-	CA	GLY	V	2
R	-	C	MET	A	1	L	-	C	GLY	V	2
R	-	C	MET	A	1	L	-	O	GLY	V	2
R	-	C	MET	A	1	L	-	H	GLY	V	2
R	-	C	MET	A	1	L	-	HA2	GLY	V	2
R	-	C	MET	A	1	L	-	HA3	GLY	V	2
R	-	CB	MET	A	1	L	-	CA	MET	V	1
R	-	CB	MET	A	1	L	-	C	MET	V	1
R	-	CB	MET	A	1	L	-	HA	MET	V	1
R	-	CB	MET	A	1	L	-	N	GLY	V	2
R	-	CB	MET	A	1	L	-	CA	GLY	V	2
R	-	CB	MET	A	1	L	-	H	GLY	V	2
R	-	CB	MET	A	1	L	-	HA3	GLY	V	2
R	-	CB	MET	A	1	L	-	OE1	GLN	V	135
R	-	O	MET	A	1	L	-	N	GLY	V	2
R	-	O	MET	A	1	L	-	CA	GLY	V	2
R	-	O	MET	A	1	L	-	C	GLY	V	2
R	-	O	MET	A	1	L	-	O	GLY	V	2
R	-	O	MET	A	1	L	-	H	GLY	V	2
R	-	O	MET	A	1	L	-	HA3	GLY	V	2
R	-	O	MET	A	1	L	H	CH2	TRP	V	4
R	-	O	MET	A	1	L	H	CZ3	TRP	V	4
R	-	O	MET	A	1	L	-	OE1	GLN	V	135
R	-	CG	MET	A	1	L	-	HA	MET	V	1
R	-	CG	MET	A	1	L	-	N	GLY	V	2
R	-	CG	MET	A	1	L	-	H	GLY	V	2
R	-	CG	MET	A	1	L	-	HA3	GLY	V	2
R	-	CG	MET	A	1	L	-	CD	GLN	V	135
R	-	CG	MET	A	1	L	-	OE1	GLN	V	135
R	-	CG	MET	A	1	L	-	HB3	GLN	V	135
R	-	SD	MET	A	1	L	-	CB	GLN	V	135
R	-	SD	MET	A	1	L	-	O	GLN	V	135
R	-	SD	MET	A	1	L	-	CG	GLN	V	135
R	-	SD	MET	A	1	L	-	CD	GLN	V	135
R	-	SD	MET	A	1	L	-	OE1	GLN	V	135
R	-	SD	MET	A	1	L	-	HB3	GLN	V	135
R	-	SD	MET	A	1	L	-	HG3	GLN	V	135
R	-	CE	MET	A	1	L	-	HB3	GLN	V	135
R	-	CE	MET	A	1	L	-	HG3	GLN	V	135
R	-	N	ALA	A	2	L	-	N	GLY	V	2
R	-	N	ALA	A	2	L	-	CA	GLY	V	2
R	-	N	ALA	A	2	L	-	C	GLY	V	2
R	-	N	ALA	A	2	L	-	O	GLY	V	2
R	-	N	ALA	A	2	L	-	H	GLY	V	2
R	-	N	ALA	A	2	L	-	HA2	GLY	V	2
R	-	N	ALA	A	2	L	-	HA3	GLY	V	2
R	-	N	ALA	A	2	L	-	N	ASP	V	3
R	-	N	ALA	A	2	L	-	H	ASP	V	3
R	-	CA	ALA	A	2	L	-	CA	GLY	V	2
R	-	CA	ALA	A	2	L	-	C	GLY	V	2
R	-	CA	ALA	A	2	L	-	HA2	GLY	V	2
R	-	CA	ALA	A	2	L	-	HA3	GLY	V	2
R	-	CA	ALA	A	2	L	-	H	ASP	V	3
R	-	CA	ALA	A	2	L	H	HB3	TYR	V	7
R	-	C	ALA	A	2	L	-	HA3	GLY	V	2
R	-	C	ALA	A	2	L	H	HD2	TYR	V	7
R	-	C	ALA	A	2	L	-	NE2	GLN	V	135
R	-	C	ALA	A	2	L	-	OE1	GLN	V	135
R	-	C	ALA	A	2	L	-	HE22	GLN	V	135
R	-	CB	ALA	A	2	L	-	CA	GLY	V	2
R	-	CB	ALA	A	2	L	-	HA2	GLY	V	2
R	-	CB	ALA	A	2	L	-	HA3	GLY	V	2
R	-	CB	ALA	A	2	L	-	N	ASP	V	3
R	-	CB	ALA	A	2	L	-	H	ASP	V	3
R	-	CB	ALA	A	2	L	H	HB3	TYR	V	7
R	-	O	ALA	A	2	L	-	HA3	GLY	V	2
R	-	O	ALA	A	2	L	-	CD	GLN	V	135
R	-	O	ALA	A	2	L	-	NE2	GLN	V	135
R	-	O	ALA	A	2	L	-	OE1	GLN	V	135
R	-	O	ALA	A	2	L	-	HE21	GLN	V	135
R	-	O	ALA	A	2	L	-	HE22	GLN	V	135
R	-	N	GLY	A	3	L	H	CD2	TYR	V	7
R	-	N	GLY	A	3	L	H	CE2	TYR	V	7
R	-	N	GLY	A	3	L	H	HB3	TYR	V	7
R	-	N	GLY	A	3	L	H	HD2	TYR	V	7
R	-	N	GLY	A	3	L	H	HE2	TYR	V	7
R	-	N	GLY	A	3	L	-	CD	GLN	V	135
R	-	N	GLY	A	3	L	-	NE2	GLN	V	135
R	-	N	GLY	A	3	L	-	OE1	GLN	V	135
R	-	N	GLY	A	3	L	-	HE22	GLN	V	135
R	-	CA	GLY	A	3	L	H	CD2	TYR	V	7
R	-	CA	GLY	A	3	L	H	CE2	TYR	V	7
R	-	CA	GLY	A	3	L	H	HD2	TYR	V	7
R	-	CA	GLY	A	3	L	H	HE2	TYR	V	7
R	-	CA	GLY	A	3	L	H	HD21	LEU	V	132
R	-	CA	GLY	A	3	L	-	CD	GLN	V	135
R	-	CA	GLY	A	3	L	-	NE2	GLN	V	135
R	-	CA	GLY	A	3	L	-	OE1	GLN	V	135
R	-	CA	GLY	A	3	L	-	HE21	GLN	V	135
R	-	CA	GLY	A	3	L	-	HE22	GLN	V	135
R	-	C	GLY	A	3	L	H	HD2	TYR	V	7
R	-	C	GLY	A	3	L	H	HE2	TYR	V	7
R	-	C	GLY	A	3	L	-	CD	GLN	V	135
R	-	C	GLY	A	3	L	-	NE2	GLN	V	135
R	-	C	GLY	A	3	L	-	HE21	GLN	V	135
R	-	C	GLY	A	3	L	-	HE22	GLN	V	135
R	-	O	GLY	A	3	L	H	HD2	TYR	V	7
R	-	O	GLY	A	3	L	H	HE2	TYR	V	7
R	-	O	GLY	A	3	L	-	NE2	GLN	V	135
R	-	O	GLY	A	3	L	-	HE22	GLN	V	135
R	H	N	TRP	A	4	L	H	HE2	TYR	V	7
R	H	N	TRP	A	4	L	H	HA2	GLY	V	131
R	H	N	TRP	A	4	L	-	CD	GLN	V	135
R	H	N	TRP	A	4	L	-	NE2	GLN	V	135
R	H	N	TRP	A	4	L	-	HE21	GLN	V	135
R	H	N	TRP	A	4	L	-	HE22	GLN	V	135
R	H	CA	TRP	A	4	L	-	NE2	GLN	V	135
R	H	CA	TRP	A	4	L	-	HE21	GLN	V	135
R	H	CA	TRP	A	4	L	-	HE22	GLN	V	135
R	H	CB	TRP	A	4	L	H	CA	GLY	V	131
R	H	CB	TRP	A	4	L	H	HA2	GLY	V	131
R	H	CB	TRP	A	4	L	H	HA3	GLY	V	131
R	H	CB	TRP	A	4	L	-	HE21	GLN	V	135
R	H	CG	TRP	A	4	L	H	CA	GLY	V	131
R	H	CG	TRP	A	4	L	H	HA2	GLY	V	131
R	H	CG	TRP	A	4	L	H	HA3	GLY	V	131
R	H	CG	TRP	A	4	L	-	NE2	GLN	V	135
R	H	CG	TRP	A	4	L	-	HE21	GLN	V	135
R	H	CD1	TRP	A	4	L	H	CA	GLY	V	131
R	H	CD1	TRP	A	4	L	H	C	GLY	V	131
R	H	CD1	TRP	A	4	L	H	O	GLY	V	131
R	H	CD1	TRP	A	4	L	H	HA2	GLY	V	131
R	H	CD1	TRP	A	4	L	H	HA3	GLY	V	131
R	H	CD1	TRP	A	4	L	H	CB	MET	V	134
R	H	CD1	TRP	A	4	L	H	HB2	MET	V	134
R	H	CD1	TRP	A	4	L	-	NE2	GLN	V	135
R	H	CD1	TRP	A	4	L	-	HG2	GLN	V	135
R	H	CD1	TRP	A	4	L	-	HE21	GLN	V	135
R	H	CD2	TRP	A	4	L	-	HE21	GLN	V	135
R	H	CE2	TRP	A	4	L	H	HB2	MET	V	134
R	H	CE2	TRP	A	4	L	H	HB3	MET	V	134
R	H	CE2	TRP	A	4	L	-	HG2	GLN	V	135
R	H	CE2	TRP	A	4	L	-	HE21	GLN	V	135
R	H	NE1	TRP	A	4	L	H	O	GLY	V	131
R	H	NE1	TRP	A	4	L	H	HA3	GLY	V	131
R	H	NE1	TRP	A	4	L	H	CB	MET	V	134
R	H	NE1	TRP	A	4	L	H	HB2	MET	V	134
R	H	NE1	TRP	A	4	L	H	HB3	MET	V	134
R	H	NE1	TRP	A	4	L	H	HG3	MET	V	134
R	H	NE1	TRP	A	4	L	-	CG	GLN	V	135
R	H	NE1	TRP	A	4	L	-	HG2	GLN	V	135
R	H	NE1	TRP	A	4	L	-	HG3	GLN	V	135
R	H	NE1	TRP	A	4	L	-	HE21	GLN	V	135
R	H	N	GLN	A	5	L	H	HE2	TYR	V	7
R	H	CA	GLN	A	5	L	H	HE2	TYR	V	7
R	H	CB	GLN	A	5	L	H	CE2	TYR	V	7
R	H	CB	GLN	A	5	L	H	HE2	TYR	V	7
R	H	CB	GLN	A	5	L	H	CD2	LEU	V	128
R	H	CB	GLN	A	5	L	H	HD21	LEU	V	128
R	H	CB	GLN	A	5	L	H	HD22	LEU	V	128
R	H	CB	GLN	A	5	L	H	HD23	LEU	V	128
R	H	O	GLN	A	5	L	H	HB1	ALA	V	10
R	H	CG	GLN	A	5	L	H	HB1	ALA	V	10
R	H	CG	GLN	A	5	L	H	HG21	VAL	V	11
R	H	CG	GLN	A	5	L	H	HG23	VAL	V	11
R	H	CG	GLN	A	5	L	H	CD2	LEU	V	128
R	H	CG	GLN	A	5	L	H	HD21	LEU	V	128
R	H	CG	GLN	A	5	L	H	HD22	LEU	V	128
R	H	CG	GLN	A	5	L	H	HD23	LEU	V	128
R	H	CD	GLN	A	5	L	H	CD2	LEU	V	128
R	H	CD	GLN	A	5	L	H	HD21	LEU	V	128
R	H	CD	GLN	A	5	L	H	HD22	LEU	V	128
R	H	CD	GLN	A	5	L	H	HD23	LEU	V	128
R	H	NE2	GLN	A	5	L	H	HD23	LEU	V	128
R	H	OE1	GLN	A	5	L	H	CD2	LEU	V	128
R	H	OE1	GLN	A	5	L	H	HD21	LEU	V	128
R	H	OE1	GLN	A	5	L	H	HD22	LEU	V	128
R	H	OE1	GLN	A	5	L	H	HD23	LEU	V	128
R	H	N	SER	A	6	L	H	HD2	TYR	V	7
R	H	CB	SER	A	6	L	H	HG11	VAL	V	6
R	H	CA	ASP	A	9	L	H	HB1	ALA	V	10
R	H	CA	ASP	A	9	L	H	NH1	ARG	V	13
R	H	CA	ASP	A	9	L	H	HH11	ARG	V	13
R	H	CA	ASP	A	9	L	H	HH12	ARG	V	13
R	H	C	ASP	A	9	L	H	NH1	ARG	V	13
R	H	C	ASP	A	9	L	H	HH11	ARG	V	13
R	H	C	ASP	A	9	L	H	HH12	ARG	V	13
R	H	CB	ASP	A	9	L	H	CB	ALA	V	10
R	H	CB	ASP	A	9	L	H	HA	ALA	V	10
R	H	CB	ASP	A	9	L	H	HB1	ALA	V	10
R	H	CB	ASP	A	9	L	H	HB2	ALA	V	10
R	H	CB	ASP	A	9	L	H	NH1	ARG	V	13
R	H	CB	ASP	A	9	L	H	HD2	ARG	V	13
R	H	CB	ASP	A	9	L	H	HH11	ARG	V	13
R	H	CB	ASP	A	9	L	H	HH12	ARG	V	13
R	H	O	ASP	A	9	L	H	NH1	ARG	V	13
R	H	O	ASP	A	9	L	H	HH11	ARG	V	13
R	H	O	ASP	A	9	L	H	HH12	ARG	V	13
R	H	CG	ASP	A	9	L	H	CA	ALA	V	10
R	H	CG	ASP	A	9	L	H	C	ALA	V	10
R	H	CG	ASP	A	9	L	H	CB	ALA	V	10
R	H	CG	ASP	A	9	L	H	O	ALA	V	10
R	H	CG	ASP	A	9	L	H	HA	ALA	V	10
R	H	CG	ASP	A	9	L	H	HB1	ALA	V	10
R	H	CG	ASP	A	9	L	H	HB2	ALA	V	10
R	H	CG	ASP	A	9	L	H	HB3	ALA	V	10
R	H	CG	ASP	A	9	L	H	HD2	ARG	V	13
R	H	OD1	ASP	A	9	L	H	CA	ALA	V	10
R	H	OD1	ASP	A	9	L	H	C	ALA	V	10
R	H	OD1	ASP	A	9	L	H	CB	ALA	V	10
R	H	OD1	ASP	A	9	L	H	O	ALA	V	10
R	H	OD1	ASP	A	9	L	H	HA	ALA	V	10
R	H	OD1	ASP	A	9	L	H	HB1	ALA	V	10
R	H	OD1	ASP	A	9	L	H	HB2	ALA	V	10
R	H	OD1	ASP	A	9	L	H	HB3	ALA	V	10
R	H	OD1	ASP	A	9	L	H	HD2	ARG	V	13
R	H	OD2	ASP	A	9	L	H	N	ALA	V	10
R	H	OD2	ASP	A	9	L	H	CA	ALA	V	10
R	H	OD2	ASP	A	9	L	H	C	ALA	V	10
R	H	OD2	ASP	A	9	L	H	CB	ALA	V	10
R	H	OD2	ASP	A	9	L	H	O	ALA	V	10
R	H	OD2	ASP	A	9	L	H	H	ALA	V	10
R	H	OD2	ASP	A	9	L	H	HA	ALA	V	10
R	H	OD2	ASP	A	9	L	H	HB1	ALA	V	10
R	H	OD2	ASP	A	9	L	H	HB2	ALA	V	10
R	H	OD2	ASP	A	9	L	H	HB3	ALA	V	10
R	H	OD2	ASP	A	9	L	H	N	VAL	V	11
R	H	OD2	ASP	A	9	L	H	H	VAL	V	11
R	H	OD2	ASP	A	9	L	H	HD2	ARG	V	13
R	H	N	ASN	A	10	L	H	HH12	ARG	V	13
R	H	CA	ASN	A	10	L	H	HH12	ARG	V	13
R	-	CA	CYS	A	13	L	H	HH12	ARG	V	13
R	-	CB	CYS	A	13	L	H	NH1	ARG	V	13
R	-	CB	CYS	A	13	L	H	HH12	ARG	V	13
R	-	N	ALA	A	28	L	H	HE1	MET	V	134
R	-	CA	ALA	A	28	L	H	HE1	MET	V	134
R	-	CB	ALA	A	28	L	H	SD	MET	V	134
R	-	CB	ALA	A	28	L	H	CE	MET	V	134
R	-	CB	ALA	A	28	L	H	HE1	MET	V	134
R	-	CB	ALA	A	28	L	H	HE2	MET	V	134
R	-	CB	ALA	A	28	L	H	HE3	MET	V	134
R	-	O	ALA	A	28	L	H	HE3	MET	V	134
R	-	CB	TYR	A	30	L	H	HD3	ARG	V	130
R	-	CG	TYR	A	30	L	H	HG2	ARG	V	130
R	-	CG	TYR	A	30	L	H	HD3	ARG	V	130
R	-	CD2	TYR	A	30	L	H	CB	ARG	V	130
R	-	CD2	TYR	A	30	L	H	CG	ARG	V	130
R	-	CD2	TYR	A	30	L	H	CD	ARG	V	130
R	-	CD2	TYR	A	30	L	H	NE	ARG	V	130
R	-	CD2	TYR	A	30	L	H	HB3	ARG	V	130
R	-	CD2	TYR	A	30	L	H	HG2	ARG	V	130
R	-	CD2	TYR	A	30	L	H	HD3	ARG	V	130
R	-	CE1	TYR	A	30	L	H	SD	MET	V	134
R	-	CE1	TYR	A	30	L	H	HG2	MET	V	134
R	-	CE2	TYR	A	30	L	H	CA	ARG	V	130
R	-	CE2	TYR	A	30	L	H	C	ARG	V	130
R	-	CE2	TYR	A	30	L	H	CB	ARG	V	130
R	-	CE2	TYR	A	30	L	H	O	ARG	V	130
R	-	CE2	TYR	A	30	L	H	CG	ARG	V	130
R	-	CE2	TYR	A	30	L	H	CD	ARG	V	130
R	-	CE2	TYR	A	30	L	H	HA	ARG	V	130
R	-	CE2	TYR	A	30	L	H	HB2	ARG	V	130
R	-	CE2	TYR	A	30	L	H	HB3	ARG	V	130
R	-	CE2	TYR	A	30	L	H	HG2	ARG	V	130
R	-	CE2	TYR	A	30	L	H	HD3	ARG	V	130
R	-	CE2	TYR	A	30	L	H	HG2	MET	V	134
R	-	CE2	TYR	A	30	L	H	HG3	MET	V	134
R	-	OH	TYR	A	30	L	H	C	ARG	V	130
R	-	OH	TYR	A	30	L	H	O	ARG	V	130
R	-	OH	TYR	A	30	L	H	HA	ARG	V	130
R	-	OH	TYR	A	30	L	H	HB3	ARG	V	130
R	-	OH	TYR	A	30	L	H	HB2	ARG	V	133
R	-	OH	TYR	A	30	L	H	N	MET	V	134
R	-	OH	TYR	A	30	L	H	CB	MET	V	134
R	-	OH	TYR	A	30	L	H	CG	MET	V	134
R	-	OH	TYR	A	30	L	H	SD	MET	V	134
R	-	OH	TYR	A	30	L	H	H	MET	V	134
R	-	OH	TYR	A	30	L	H	HG2	MET	V	134
R	-	OH	TYR	A	30	L	H	HG3	MET	V	134
R	-	CZ	TYR	A	30	L	H	O	ARG	V	130
R	-	CZ	TYR	A	30	L	H	HA	ARG	V	130
R	-	CZ	TYR	A	30	L	H	HB3	ARG	V	130
R	-	CZ	TYR	A	30	L	H	HG2	ARG	V	130
R	-	CZ	TYR	A	30	L	H	CG	MET	V	134
R	-	CZ	TYR	A	30	L	H	SD	MET	V	134
R	-	CZ	TYR	A	30	L	H	HG2	MET	V	134
R	-	CZ	TYR	A	30	L	H	HG3	MET	V	134
R	S	N	VAL	A	31	L	H	HD3	ARG	V	130
R	S	N	VAL	A	31	L	H	HH11	ARG	V	130
R	S	CA	VAL	A	31	L	H	HD3	ARG	V	130
R	S	CA	VAL	A	31	L	H	HH11	ARG	V	130
R	S	C	VAL	A	31	L	H	CD	ARG	V	130
R	S	C	VAL	A	31	L	H	HB2	ARG	V	130
R	S	C	VAL	A	31	L	H	HB3	ARG	V	130
R	S	C	VAL	A	31	L	H	HD2	ARG	V	130
R	S	C	VAL	A	31	L	H	HD3	ARG	V	130
R	S	C	VAL	A	31	L	H	HH11	ARG	V	130
R	S	CB	VAL	A	31	L	H	NH1	ARG	V	130
R	S	CB	VAL	A	31	L	H	HH11	ARG	V	130
R	S	CB	VAL	A	31	L	H	HH12	ARG	V	130
R	S	O	VAL	A	31	L	H	HA	GLU	V	127
R	S	O	VAL	A	31	L	H	CB	ARG	V	130
R	S	O	VAL	A	31	L	H	CG	ARG	V	130
R	S	O	VAL	A	31	L	H	CD	ARG	V	130
R	S	O	VAL	A	31	L	H	NE	ARG	V	130
R	S	O	VAL	A	31	L	H	NH1	ARG	V	130
R	S	O	VAL	A	31	L	H	HB2	ARG	V	130
R	S	O	VAL	A	31	L	H	HB3	ARG	V	130
R	S	O	VAL	A	31	L	H	HD2	ARG	V	130
R	S	O	VAL	A	31	L	H	HD3	ARG	V	130
R	S	O	VAL	A	31	L	H	HH11	ARG	V	130
R	S	CG1	VAL	A	31	L	H	HG2	GLU	V	127
R	S	CG1	VAL	A	31	L	H	HH11	ARG	V	130
R	S	CG2	VAL	A	31	L	H	HH11	ARG	V	130
R	S	N	TRP	A	32	L	H	HB3	ARG	V	130
R	S	CA	TRP	A	32	L	H	CB	ARG	V	130
R	S	CA	TRP	A	32	L	H	HB2	ARG	V	130
R	S	CA	TRP	A	32	L	H	HB3	ARG	V	130
R	S	CA	TRP	A	32	L	H	N	GLY	V	131
R	S	CA	TRP	A	32	L	H	HA3	GLY	V	131
R	S	C	TRP	A	32	L	H	O	GLU	V	127
R	S	C	TRP	A	32	L	H	HB2	ARG	V	130
R	S	C	TRP	A	32	L	H	HB3	ARG	V	130
R	S	C	TRP	A	32	L	H	N	GLY	V	131
R	S	C	TRP	A	32	L	H	CA	GLY	V	131
R	S	C	TRP	A	32	L	H	H	GLY	V	131
R	S	C	TRP	A	32	L	H	HA2	GLY	V	131
R	S	C	TRP	A	32	L	H	HA3	GLY	V	131
R	S	CB	TRP	A	32	L	H	HA3	GLY	V	131
R	S	CB	TRP	A	32	L	H	HG3	MET	V	134
R	S	O	TRP	A	32	L	H	O	GLU	V	127
R	S	O	TRP	A	32	L	H	C	ARG	V	130
R	S	O	TRP	A	32	L	H	CB	ARG	V	130
R	S	O	TRP	A	32	L	H	HB2	ARG	V	130
R	S	O	TRP	A	32	L	H	HB3	ARG	V	130
R	S	O	TRP	A	32	L	H	N	GLY	V	131
R	S	O	TRP	A	32	L	H	CA	GLY	V	131
R	S	O	TRP	A	32	L	H	H	GLY	V	131
R	S	O	TRP	A	32	L	H	HA2	GLY	V	131
R	S	O	TRP	A	32	L	H	HA3	GLY	V	131
R	S	CG	TRP	A	32	L	H	CG	MET	V	134
R	S	CG	TRP	A	32	L	H	HG3	MET	V	134
R	S	CG	TRP	A	32	L	H	HE3	MET	V	134
R	S	CD1	TRP	A	32	L	H	CG	MET	V	134
R	S	CD1	TRP	A	32	L	H	HG2	MET	V	134
R	S	CD1	TRP	A	32	L	H	HG3	MET	V	134
R	S	CD1	TRP	A	32	L	H	HE3	MET	V	134
R	S	CD2	TRP	A	32	L	H	CG	MET	V	134
R	S	CD2	TRP	A	32	L	H	CE	MET	V	134
R	S	CD2	TRP	A	32	L	H	HB3	MET	V	134
R	S	CD2	TRP	A	32	L	H	HG3	MET	V	134
R	S	CD2	TRP	A	32	L	H	HE2	MET	V	134
R	S	CD2	TRP	A	32	L	H	HE3	MET	V	134
R	S	CE2	TRP	A	32	L	H	CG	MET	V	134
R	S	CE2	TRP	A	32	L	H	SD	MET	V	134
R	S	CE2	TRP	A	32	L	H	CE	MET	V	134
R	S	CE2	TRP	A	32	L	H	HG3	MET	V	134
R	S	CE2	TRP	A	32	L	H	HE1	MET	V	134
R	S	CE2	TRP	A	32	L	H	HE2	MET	V	134
R	S	CE2	TRP	A	32	L	H	HE3	MET	V	134
R	S	CE3	TRP	A	32	L	H	HG3	MET	V	134
R	S	CE3	TRP	A	32	L	H	HE3	MET	V	134
R	S	NE1	TRP	A	32	L	H	CG	MET	V	134
R	S	NE1	TRP	A	32	L	H	SD	MET	V	134
R	S	NE1	TRP	A	32	L	H	CE	MET	V	134
R	S	NE1	TRP	A	32	L	H	HG2	MET	V	134
R	S	NE1	TRP	A	32	L	H	HG3	MET	V	134
R	S	NE1	TRP	A	32	L	H	HE1	MET	V	134
R	S	NE1	TRP	A	32	L	H	HE3	MET	V	134
R	S	CH2	TRP	A	32	L	H	CE	MET	V	134
R	S	CH2	TRP	A	32	L	H	HE1	MET	V	134
R	S	CH2	TRP	A	32	L	H	HE2	MET	V	134
R	S	CH2	TRP	A	32	L	H	HE3	MET	V	134
R	S	CZ2	TRP	A	32	L	H	SD	MET	V	134
R	S	CZ2	TRP	A	32	L	H	CE	MET	V	134
R	S	CZ2	TRP	A	32	L	H	HG3	MET	V	134
R	S	CZ2	TRP	A	32	L	H	HE1	MET	V	134
R	S	CZ2	TRP	A	32	L	H	HE2	MET	V	134
R	S	CZ2	TRP	A	32	L	H	HE3	MET	V	134
R	S	CZ3	TRP	A	32	L	H	HE2	MET	V	134
R	S	CZ3	TRP	A	32	L	H	HE3	MET	V	134
R	S	CA	ALA	A	33	L	H	O	GLU	V	127
R	S	CA	ALA	A	33	L	H	HB3	GLU	V	127
R	S	C	ALA	A	33	L	H	HB3	GLU	V	127
R	S	N	ALA	A	34	L	H	HB3	GLU	V	127
R	S	C	ALA	A	34	L	H	OE2	GLU	V	127
R	S	CB	ALA	A	34	L	H	CD	GLU	V	127
R	S	CB	ALA	A	34	L	H	OE2	GLU	V	127
R	S	O	ALA	A	34	L	H	OE2	GLU	V	127
R	S	O	ALA	A	34	L	H	HB3	GLU	V	127
R	-	C	THR	A	35	L	H	OE2	GLU	V	127
R	-	O	THR	A	35	L	H	OE2	GLU	V	127
R	-	N	ALA	A	36	L	-	HH22	ARG	V	16
R	-	N	ALA	A	36	L	H	OE2	GLU	V	127
R	-	CA	ALA	A	36	L	-	NH2	ARG	V	16
R	-	CA	ALA	A	36	L	-	HH21	ARG	V	16
R	-	CA	ALA	A	36	L	-	HH22	ARG	V	16
R	-	CA	ALA	A	36	L	H	HG23	THR	V	124
R	-	CA	ALA	A	36	L	H	OE2	GLU	V	127
R	-	C	ALA	A	36	L	-	NH1	ARG	V	16
R	-	C	ALA	A	36	L	-	NH2	ARG	V	16
R	-	C	ALA	A	36	L	-	CZ	ARG	V	16
R	-	C	ALA	A	36	L	-	HH12	ARG	V	16
R	-	C	ALA	A	36	L	-	HH21	ARG	V	16
R	-	C	ALA	A	36	L	-	HH22	ARG	V	16
R	-	CB	ALA	A	36	L	-	OD2	ASP	V	14
R	-	CB	ALA	A	36	L	-	NH2	ARG	V	16
R	-	CB	ALA	A	36	L	-	CZ	ARG	V	16
R	-	CB	ALA	A	36	L	-	HH21	ARG	V	16
R	-	CB	ALA	A	36	L	-	HH22	ARG	V	16
R	-	CB	ALA	A	36	L	H	CB	THR	V	124
R	-	CB	ALA	A	36	L	H	CG2	THR	V	124
R	-	CB	ALA	A	36	L	H	OG1	THR	V	124
R	-	CB	ALA	A	36	L	H	HA	THR	V	124
R	-	CB	ALA	A	36	L	H	HG1	THR	V	124
R	-	CB	ALA	A	36	L	H	HG21	THR	V	124
R	-	CB	ALA	A	36	L	H	HG23	THR	V	124
R	-	O	ALA	A	36	L	-	NH1	ARG	V	16
R	-	O	ALA	A	36	L	-	NH2	ARG	V	16
R	-	O	ALA	A	36	L	-	CZ	ARG	V	16
R	-	O	ALA	A	36	L	-	HH12	ARG	V	16
R	-	O	ALA	A	36	L	-	HH21	ARG	V	16
R	-	O	ALA	A	36	L	-	HH22	ARG	V	16
R	-	N	GLY	A	37	L	-	NH1	ARG	V	16
R	-	N	GLY	A	37	L	-	NH2	ARG	V	16
R	-	N	GLY	A	37	L	-	HH12	ARG	V	16
R	-	N	GLY	A	37	L	-	HH22	ARG	V	16
R	-	CA	GLY	A	37	L	-	NH1	ARG	V	16
R	-	CA	GLY	A	37	L	-	HH12	ARG	V	16
R	-	CA	GLY	A	37	L	-	HH22	ARG	V	16
R	-	C	GLY	A	37	L	-	HH12	ARG	V	16
R	H	CA	GLN	A	41	L	H	CD	GLU	V	127
R	H	CA	GLN	A	41	L	H	OE1	GLU	V	127
R	H	CA	GLN	A	41	L	H	HG2	GLU	V	127
R	H	C	GLN	A	41	L	H	OE1	GLU	V	127
R	H	CB	GLN	A	41	L	H	CG	GLU	V	127
R	H	CB	GLN	A	41	L	H	CD	GLU	V	127
R	H	CB	GLN	A	41	L	H	OE1	GLU	V	127
R	H	CB	GLN	A	41	L	H	OE2	GLU	V	127
R	H	CB	GLN	A	41	L	H	HG2	GLU	V	127
R	H	CB	GLN	A	41	L	H	HG3	GLU	V	127
R	H	O	GLN	A	41	L	H	HH12	ARG	V	130
R	H	CG	GLN	A	41	L	H	CD	GLU	V	127
R	H	CG	GLN	A	41	L	H	OE1	GLU	V	127
R	H	CD	GLN	A	41	L	H	HB3	LYS	V	123
R	H	CD	GLN	A	41	L	H	HD3	LYS	V	123
R	H	CD	GLN	A	41	L	H	CD	GLU	V	127
R	H	CD	GLN	A	41	L	H	OE1	GLU	V	127
R	H	NE2	GLN	A	41	L	H	CD	LYS	V	123
R	H	NE2	GLN	A	41	L	H	HB3	LYS	V	123
R	H	NE2	GLN	A	41	L	H	HD2	LYS	V	123
R	H	NE2	GLN	A	41	L	H	HD3	LYS	V	123
R	H	NE2	GLN	A	41	L	H	HZ3	LYS	V	123
R	H	NE2	GLN	A	41	L	H	OE1	GLU	V	127
R	H	OE1	GLN	A	41	L	H	CB	LYS	V	123
R	H	OE1	GLN	A	41	L	H	HB3	LYS	V	123
R	H	OE1	GLN	A	41	L	H	HD3	LYS	V	123
R	H	OE1	GLN	A	41	L	H	CD	GLU	V	127
R	H	OE1	GLN	A	41	L	H	OE1	GLU	V	127
R	H	OE1	GLN	A	41	L	H	OE2	GLU	V	127

- 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