IID

P17038_Q96RE9.1 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	-	CYS	A	14	L	-	PRO	V	576
R	H	GLU	A	16	L	-	PRO	V	576
R	H	GLU	A	16	L	-	TYR	V	577
R	H	GLU	A	16	L	-	GLN	V	578
R	H	GLU	A	17	L	-	ARG	V	575
R	H	GLU	A	17	L	-	PRO	V	576
R	H	CYS	A	20	L	-	GLN	V	578
R	-	GLU	A	457	L	-	GLU	V	553
R	-	GLU	A	457	L	-	CYS	V	554
R	-	GLU	A	457	L	-	HIS	V	571
R	-	VAL	A	458	L	-	GLU	V	553
R	-	VAL	A	458	L	-	HIS	V	571
R	-	VAL	A	47	L	-	LYS	V	463
R	-	VAL	A	47	L	-	GLY	V	471
R	-	VAL	A	47	L	-	THR	V	473
R	-	HIS	A	476	L	-	HIS	V	571
R	-	HIS	A	476	L	-	THR	V	572
R	-	HIS	A	476	L	-	GLY	V	573
R	-	THR	A	477	L	-	GLY	V	573
R	-	THR	A	477	L	-	ARG	V	575
R	-	GLU	A	479	L	-	ARG	V	575
R	-	SER	A	48	L	-	GLY	V	471
R	-	SER	A	48	L	-	LYS	V	472
R	-	SER	A	48	L	-	THR	V	473
R	-	LYS	A	49	L	-	CYS	V	470
R	-	LYS	A	49	L	-	GLY	V	471
R	-	LYS	A	49	L	-	LYS	V	472
R	-	PRO	A	50	L	-	LYS	V	472
R	H	ASP	A	51	L	-	CYS	V	470
R	H	ASP	A	51	L	-	LYS	V	472
R	H	ASP	A	51	L	-	HIS	V	487
R	H	THR	A	54	L	-	CYS	V	470
R	-	ARG	A	68	L	H	THR	V	486
R	-	ARG	A	68	L	-	CYS	V	503
R	-	GLU	A	70	L	H	ARG	V	569
R	-	GLU	A	70	L	-	TYR	V	577
R	-	MET	A	71	L	H	SER	V	562
R	-	VAL	A	72	L	-	GLN	V	560
R	-	VAL	A	72	L	H	SER	V	562
R	-	ALA	A	73	L	-	GLN	V	560
R	-	ALA	A	73	L	H	SER	V	562
R	-	ALA	A	73	L	H	ASP	V	563
R	-	MET	A	78	L	H	VAL	V	594
R	-	CYS	A	79	L	H	ARG	V	597
R	-	SER	A	80	L	H	ARG	V	597
R	-	HIS	A	81	L	H	ARG	V	597
R	-	PHE	A	82	L	H	ARG	V	597
R	-	PHE	A	82	L	-	VAL	V	601
R	-	THR	A	83	L	H	ARG	V	597
R	-	GLN	A	84	L	-	THR	V	600
R	-	ASP	A	85	L	-	THR	V	600
R	-	ASP	A	85	L	-	VAL	V	601
R	-	PHE	A	86	L	-	THR	V	600
R	-	TRP	A	87	L	-	ILE	V	581
R	-	TRP	A	87	L	-	HIS	V	599
R	-	TRP	A	87	L	-	THR	V	600
R	-	TRP	A	87	L	-	VAL	V	602
R	-	TRP	A	87	L	-	LYS	V	603
R	-	PRO	A	88	L	-	LYS	V	603

- 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

P17038_Q96RE9.1 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	-	CB	CYS	A	14	L	-	CA	PRO	V	576
R	-	CB	CYS	A	14	L	-	CB	PRO	V	576
R	-	CB	CYS	A	14	L	-	O	PRO	V	576
R	-	CB	CYS	A	14	L	-	HA	PRO	V	576
R	-	CB	CYS	A	14	L	-	HB2	PRO	V	576
R	-	CB	CYS	A	14	L	-	HB3	PRO	V	576
R	-	SG	CYS	A	14	L	-	CA	PRO	V	576
R	-	SG	CYS	A	14	L	-	C	PRO	V	576
R	-	SG	CYS	A	14	L	-	CB	PRO	V	576
R	-	SG	CYS	A	14	L	-	O	PRO	V	576
R	-	SG	CYS	A	14	L	-	HA	PRO	V	576
R	-	SG	CYS	A	14	L	-	HB3	PRO	V	576
R	H	CA	GLU	A	16	L	-	OE1	GLN	V	578
R	H	CA	GLU	A	16	L	-	HB3	GLN	V	578
R	H	C	GLU	A	16	L	-	OE1	GLN	V	578
R	H	CB	GLU	A	16	L	-	N	GLN	V	578
R	H	CB	GLU	A	16	L	-	CB	GLN	V	578
R	H	CB	GLU	A	16	L	-	OE1	GLN	V	578
R	H	CB	GLU	A	16	L	-	H	GLN	V	578
R	H	CB	GLU	A	16	L	-	HB2	GLN	V	578
R	H	CB	GLU	A	16	L	-	HB3	GLN	V	578
R	H	O	GLU	A	16	L	-	OE1	GLN	V	578
R	H	CG	GLU	A	16	L	-	N	GLN	V	578
R	H	CG	GLU	A	16	L	-	CA	GLN	V	578
R	H	CG	GLU	A	16	L	-	CB	GLN	V	578
R	H	CG	GLU	A	16	L	-	O	GLN	V	578
R	H	CG	GLU	A	16	L	-	H	GLN	V	578
R	H	CG	GLU	A	16	L	-	HB2	GLN	V	578
R	H	CG	GLU	A	16	L	-	HB3	GLN	V	578
R	H	CD	GLU	A	16	L	-	O	PRO	V	576
R	H	CD	GLU	A	16	L	-	HA	TYR	V	577
R	H	CD	GLU	A	16	L	-	N	GLN	V	578
R	H	CD	GLU	A	16	L	-	H	GLN	V	578
R	H	CD	GLU	A	16	L	-	HB3	GLN	V	578
R	H	OE1	GLU	A	16	L	-	HA	TYR	V	577
R	H	OE1	GLU	A	16	L	-	H	GLN	V	578
R	H	OE2	GLU	A	16	L	-	C	PRO	V	576
R	H	OE2	GLU	A	16	L	-	O	PRO	V	576
R	H	OE2	GLU	A	16	L	-	HA	TYR	V	577
R	H	OE2	GLU	A	16	L	-	H	GLN	V	578
R	H	CG	GLU	A	17	L	-	HA	PRO	V	576
R	H	CD	GLU	A	17	L	-	HA	PRO	V	576
R	H	OE1	GLU	A	17	L	-	H	ARG	V	575
R	H	OE1	GLU	A	17	L	-	HA	PRO	V	576
R	H	OE2	GLU	A	17	L	-	HA	PRO	V	576
R	H	SG	CYS	A	20	L	-	NE2	GLN	V	578
R	H	SG	CYS	A	20	L	-	OE1	GLN	V	578
R	H	SG	CYS	A	20	L	-	HE22	GLN	V	578
R	-	C	VAL	A	47	L	-	OG1	THR	V	473
R	-	C	VAL	A	47	L	-	HG22	THR	V	473
R	-	CB	VAL	A	47	L	-	HD3	LYS	V	463
R	-	CB	VAL	A	47	L	-	OG1	THR	V	473
R	-	CB	VAL	A	47	L	-	HG1	THR	V	473
R	-	O	VAL	A	47	L	-	O	GLY	V	471
R	-	O	VAL	A	47	L	-	CB	THR	V	473
R	-	O	VAL	A	47	L	-	CG2	THR	V	473
R	-	O	VAL	A	47	L	-	OG1	THR	V	473
R	-	O	VAL	A	47	L	-	H	THR	V	473
R	-	O	VAL	A	47	L	-	HG21	THR	V	473
R	-	O	VAL	A	47	L	-	HG22	THR	V	473
R	-	CG1	VAL	A	47	L	-	HB2	LYS	V	463
R	-	CG1	VAL	A	47	L	-	HD3	LYS	V	463
R	-	CG1	VAL	A	47	L	-	CB	THR	V	473
R	-	CG1	VAL	A	47	L	-	OG1	THR	V	473
R	-	CG1	VAL	A	47	L	-	HG1	THR	V	473
R	-	CG1	VAL	A	47	L	-	HG21	THR	V	473
R	-	N	SER	A	48	L	-	HA	LYS	V	472
R	-	N	SER	A	48	L	-	H	THR	V	473
R	-	CA	SER	A	48	L	-	C	GLY	V	471
R	-	CA	SER	A	48	L	-	O	GLY	V	471
R	-	CA	SER	A	48	L	-	N	LYS	V	472
R	-	CA	SER	A	48	L	-	CA	LYS	V	472
R	-	CA	SER	A	48	L	-	HA	LYS	V	472
R	-	CA	SER	A	48	L	-	HG2	LYS	V	472
R	-	CA	SER	A	48	L	-	H	THR	V	473
R	-	CA	SER	A	48	L	-	HG22	THR	V	473
R	-	C	SER	A	48	L	-	O	GLY	V	471
R	-	C	SER	A	48	L	-	HA	LYS	V	472
R	-	C	SER	A	48	L	-	HG2	LYS	V	472
R	-	CB	SER	A	48	L	-	C	GLY	V	471
R	-	CB	SER	A	48	L	-	O	GLY	V	471
R	-	CB	SER	A	48	L	-	N	LYS	V	472
R	-	CB	SER	A	48	L	-	CA	LYS	V	472
R	-	CB	SER	A	48	L	-	C	LYS	V	472
R	-	CB	SER	A	48	L	-	CB	LYS	V	472
R	-	CB	SER	A	48	L	-	CG	LYS	V	472
R	-	CB	SER	A	48	L	-	HA	LYS	V	472
R	-	CB	SER	A	48	L	-	HB3	LYS	V	472
R	-	CB	SER	A	48	L	-	HG2	LYS	V	472
R	-	CB	SER	A	48	L	-	HG3	LYS	V	472
R	-	CB	SER	A	48	L	-	N	THR	V	473
R	-	CB	SER	A	48	L	-	H	THR	V	473
R	-	OG	SER	A	48	L	-	CA	LYS	V	472
R	-	OG	SER	A	48	L	-	CG	LYS	V	472
R	-	OG	SER	A	48	L	-	HA	LYS	V	472
R	-	OG	SER	A	48	L	-	HB3	LYS	V	472
R	-	OG	SER	A	48	L	-	HG2	LYS	V	472
R	-	OG	SER	A	48	L	-	H	THR	V	473
R	-	N	LYS	A	49	L	-	O	CYS	V	470
R	-	N	LYS	A	49	L	-	CA	GLY	V	471
R	-	N	LYS	A	49	L	-	C	GLY	V	471
R	-	N	LYS	A	49	L	-	O	GLY	V	471
R	-	N	LYS	A	49	L	-	HA3	GLY	V	471
R	-	N	LYS	A	49	L	-	N	LYS	V	472
R	-	N	LYS	A	49	L	-	HA	LYS	V	472
R	-	N	LYS	A	49	L	-	HG3	LYS	V	472
R	-	CA	LYS	A	49	L	-	O	CYS	V	470
R	-	CA	LYS	A	49	L	-	HA3	GLY	V	471
R	-	C	LYS	A	49	L	-	O	CYS	V	470
R	-	C	LYS	A	49	L	-	HG3	LYS	V	472
R	-	C	LYS	A	49	L	-	HE3	LYS	V	472
R	-	CB	LYS	A	49	L	-	C	CYS	V	470
R	-	CB	LYS	A	49	L	-	O	CYS	V	470
R	-	CB	LYS	A	49	L	-	CA	GLY	V	471
R	-	CB	LYS	A	49	L	-	HA3	GLY	V	471
R	-	O	LYS	A	49	L	-	C	CYS	V	470
R	-	O	LYS	A	49	L	-	O	CYS	V	470
R	-	O	LYS	A	49	L	-	HB2	CYS	V	470
R	-	O	LYS	A	49	L	-	CG	LYS	V	472
R	-	O	LYS	A	49	L	-	CE	LYS	V	472
R	-	O	LYS	A	49	L	-	HG2	LYS	V	472
R	-	O	LYS	A	49	L	-	HG3	LYS	V	472
R	-	O	LYS	A	49	L	-	HE2	LYS	V	472
R	-	O	LYS	A	49	L	-	HE3	LYS	V	472
R	-	CG	LYS	A	49	L	-	O	CYS	V	470
R	-	CA	PRO	A	50	L	-	HE3	LYS	V	472
R	-	C	PRO	A	50	L	-	HE3	LYS	V	472
R	H	N	ASP	A	51	L	-	HE3	LYS	V	472
R	H	N	ASP	A	51	L	-	HZ1	LYS	V	472
R	H	CB	ASP	A	51	L	-	HZ1	LYS	V	472
R	H	CG	ASP	A	51	L	-	NZ	LYS	V	472
R	H	CG	ASP	A	51	L	-	HE3	LYS	V	472
R	H	CG	ASP	A	51	L	-	HZ1	LYS	V	472
R	H	CG	ASP	A	51	L	-	HZ2	LYS	V	472
R	H	CG	ASP	A	51	L	-	HE1	HIS	V	487
R	H	OD1	ASP	A	51	L	-	CB	CYS	V	470
R	H	OD1	ASP	A	51	L	-	HB2	CYS	V	470
R	H	OD1	ASP	A	51	L	-	HB3	CYS	V	470
R	H	OD1	ASP	A	51	L	-	CE	LYS	V	472
R	H	OD1	ASP	A	51	L	-	NZ	LYS	V	472
R	H	OD1	ASP	A	51	L	-	HE3	LYS	V	472
R	H	OD1	ASP	A	51	L	-	HZ1	LYS	V	472
R	H	OD1	ASP	A	51	L	-	HZ2	LYS	V	472
R	H	OD1	ASP	A	51	L	-	HE1	HIS	V	487
R	H	OD2	ASP	A	51	L	-	NZ	LYS	V	472
R	H	OD2	ASP	A	51	L	-	HZ1	LYS	V	472
R	H	OD2	ASP	A	51	L	-	HZ2	LYS	V	472
R	H	OD2	ASP	A	51	L	-	HZ3	LYS	V	472
R	H	OG1	THR	A	54	L	-	HA	CYS	V	470
R	H	OG1	THR	A	54	L	-	HB2	CYS	V	470
R	-	NH1	ARG	A	68	L	H	CG2	THR	V	486
R	-	NH1	ARG	A	68	L	H	HG22	THR	V	486
R	-	NH1	ARG	A	68	L	-	HG	CYS	V	503
R	-	NH2	ARG	A	68	L	H	CA	THR	V	486
R	-	NH2	ARG	A	68	L	H	CB	THR	V	486
R	-	NH2	ARG	A	68	L	H	CG2	THR	V	486
R	-	NH2	ARG	A	68	L	H	OG1	THR	V	486
R	-	NH2	ARG	A	68	L	H	HA	THR	V	486
R	-	NH2	ARG	A	68	L	H	HB	THR	V	486
R	-	NH2	ARG	A	68	L	H	HG21	THR	V	486
R	-	NH2	ARG	A	68	L	H	HG22	THR	V	486
R	-	NH2	ARG	A	68	L	H	HG23	THR	V	486
R	-	CZ	ARG	A	68	L	H	CG2	THR	V	486
R	-	CZ	ARG	A	68	L	H	HB	THR	V	486
R	-	CZ	ARG	A	68	L	H	HG21	THR	V	486
R	-	CZ	ARG	A	68	L	H	HG22	THR	V	486
R	-	OE1	GLU	A	70	L	H	HH22	ARG	V	569
R	-	OE1	GLU	A	70	L	-	OH	TYR	V	577
R	-	OE1	GLU	A	70	L	-	HH	TYR	V	577
R	-	O	MET	A	71	L	H	CB	SER	V	562
R	-	O	MET	A	71	L	H	HB3	SER	V	562
R	-	O	MET	A	71	L	H	HG	SER	V	562
R	-	C	VAL	A	72	L	H	HG	SER	V	562
R	-	O	VAL	A	72	L	-	OE1	GLN	V	560
R	-	O	VAL	A	72	L	H	OG	SER	V	562
R	-	O	VAL	A	72	L	H	HG	SER	V	562
R	-	N	ALA	A	73	L	H	CB	SER	V	562
R	-	N	ALA	A	73	L	H	OG	SER	V	562
R	-	N	ALA	A	73	L	H	HB2	SER	V	562
R	-	N	ALA	A	73	L	H	HG	SER	V	562
R	-	CA	ALA	A	73	L	-	OE1	GLN	V	560
R	-	CA	ALA	A	73	L	H	CB	SER	V	562
R	-	CA	ALA	A	73	L	H	OG	SER	V	562
R	-	CA	ALA	A	73	L	H	HB2	SER	V	562
R	-	CA	ALA	A	73	L	H	HG	SER	V	562
R	-	CA	ALA	A	73	L	H	OD1	ASP	V	563
R	-	C	ALA	A	73	L	H	HG	SER	V	562
R	-	C	ALA	A	73	L	H	OD1	ASP	V	563
R	-	CB	ALA	A	73	L	-	OE1	GLN	V	560
R	-	CB	ALA	A	73	L	-	HB2	GLN	V	560
R	-	CB	ALA	A	73	L	H	CA	SER	V	562
R	-	CB	ALA	A	73	L	H	C	SER	V	562
R	-	CB	ALA	A	73	L	H	CB	SER	V	562
R	-	CB	ALA	A	73	L	H	OG	SER	V	562
R	-	CB	ALA	A	73	L	H	HB2	SER	V	562
R	-	CB	ALA	A	73	L	H	HB3	SER	V	562
R	-	CB	ALA	A	73	L	H	HG	SER	V	562
R	-	CB	ALA	A	73	L	H	N	ASP	V	563
R	-	CB	ALA	A	73	L	H	CG	ASP	V	563
R	-	CB	ALA	A	73	L	H	OD1	ASP	V	563
R	-	CB	ALA	A	73	L	H	H	ASP	V	563
R	-	O	ALA	A	73	L	H	OD1	ASP	V	563
R	-	CB	MET	A	78	L	H	HG23	VAL	V	594
R	-	CE	MET	A	78	L	H	HG13	VAL	V	594
R	-	CE	MET	A	78	L	H	HG23	VAL	V	594
R	-	O	CYS	A	79	L	H	HH12	ARG	V	597
R	-	N	SER	A	80	L	H	HH12	ARG	V	597
R	-	CA	SER	A	80	L	H	NH1	ARG	V	597
R	-	CA	SER	A	80	L	H	HH12	ARG	V	597
R	-	CA	SER	A	80	L	H	HH22	ARG	V	597
R	-	C	SER	A	80	L	H	HH12	ARG	V	597
R	-	CB	SER	A	80	L	H	HH12	ARG	V	597
R	-	N	HIS	A	81	L	H	NH1	ARG	V	597
R	-	N	HIS	A	81	L	H	HH11	ARG	V	597
R	-	N	HIS	A	81	L	H	HH12	ARG	V	597
R	-	CA	HIS	A	81	L	H	HH11	ARG	V	597
R	-	CA	HIS	A	81	L	H	HH12	ARG	V	597
R	-	C	HIS	A	81	L	H	NH1	ARG	V	597
R	-	C	HIS	A	81	L	H	HD3	ARG	V	597
R	-	C	HIS	A	81	L	H	HH11	ARG	V	597
R	-	C	HIS	A	81	L	H	HH12	ARG	V	597
R	-	O	HIS	A	81	L	H	HH11	ARG	V	597
R	-	N	PHE	A	82	L	H	CD	ARG	V	597
R	-	N	PHE	A	82	L	H	NH1	ARG	V	597
R	-	N	PHE	A	82	L	H	CZ	ARG	V	597
R	-	N	PHE	A	82	L	H	HD3	ARG	V	597
R	-	N	PHE	A	82	L	H	HH11	ARG	V	597
R	-	N	PHE	A	82	L	H	HH12	ARG	V	597
R	-	CA	PHE	A	82	L	H	CD	ARG	V	597
R	-	CA	PHE	A	82	L	H	NH1	ARG	V	597
R	-	CA	PHE	A	82	L	H	HB3	ARG	V	597
R	-	CA	PHE	A	82	L	H	HD2	ARG	V	597
R	-	CA	PHE	A	82	L	H	HD3	ARG	V	597
R	-	CA	PHE	A	82	L	H	HH11	ARG	V	597
R	-	C	PHE	A	82	L	H	CG	ARG	V	597
R	-	C	PHE	A	82	L	H	CD	ARG	V	597
R	-	C	PHE	A	82	L	H	NE	ARG	V	597
R	-	C	PHE	A	82	L	H	NH1	ARG	V	597
R	-	C	PHE	A	82	L	H	CZ	ARG	V	597
R	-	C	PHE	A	82	L	H	HB3	ARG	V	597
R	-	C	PHE	A	82	L	H	HG2	ARG	V	597
R	-	C	PHE	A	82	L	H	HD3	ARG	V	597
R	-	C	PHE	A	82	L	H	HH11	ARG	V	597
R	-	CB	PHE	A	82	L	H	CB	ARG	V	597
R	-	CB	PHE	A	82	L	H	CG	ARG	V	597
R	-	CB	PHE	A	82	L	H	CD	ARG	V	597
R	-	CB	PHE	A	82	L	H	NE	ARG	V	597
R	-	CB	PHE	A	82	L	H	HB2	ARG	V	597
R	-	CB	PHE	A	82	L	H	HB3	ARG	V	597
R	-	CB	PHE	A	82	L	H	HG2	ARG	V	597
R	-	CB	PHE	A	82	L	H	HD2	ARG	V	597
R	-	CB	PHE	A	82	L	H	HD3	ARG	V	597
R	-	CB	PHE	A	82	L	H	HH11	ARG	V	597
R	-	O	PHE	A	82	L	H	CB	ARG	V	597
R	-	O	PHE	A	82	L	H	CG	ARG	V	597
R	-	O	PHE	A	82	L	H	CD	ARG	V	597
R	-	O	PHE	A	82	L	H	NE	ARG	V	597
R	-	O	PHE	A	82	L	H	NH1	ARG	V	597
R	-	O	PHE	A	82	L	H	NH2	ARG	V	597
R	-	O	PHE	A	82	L	H	CZ	ARG	V	597
R	-	O	PHE	A	82	L	H	HB3	ARG	V	597
R	-	O	PHE	A	82	L	H	HG2	ARG	V	597
R	-	O	PHE	A	82	L	H	HG3	ARG	V	597
R	-	O	PHE	A	82	L	H	HD2	ARG	V	597
R	-	O	PHE	A	82	L	H	HD3	ARG	V	597
R	-	O	PHE	A	82	L	H	HE	ARG	V	597
R	-	O	PHE	A	82	L	H	HH11	ARG	V	597
R	-	CG	PHE	A	82	L	H	CB	ARG	V	597
R	-	CG	PHE	A	82	L	H	HB2	ARG	V	597
R	-	CG	PHE	A	82	L	H	HB3	ARG	V	597
R	-	CG	PHE	A	82	L	H	HD3	ARG	V	597
R	-	CD1	PHE	A	82	L	H	HB3	ARG	V	597
R	-	CD1	PHE	A	82	L	-	CG2	VAL	V	601
R	-	CD1	PHE	A	82	L	-	HG22	VAL	V	601
R	-	CD1	PHE	A	82	L	-	HG23	VAL	V	601
R	-	CE1	PHE	A	82	L	-	CG2	VAL	V	601
R	-	CE1	PHE	A	82	L	-	HG22	VAL	V	601
R	-	CE1	PHE	A	82	L	-	HG23	VAL	V	601
R	-	CZ	PHE	A	82	L	-	HG22	VAL	V	601
R	-	N	THR	A	83	L	H	HD3	ARG	V	597
R	-	CA	GLN	A	84	L	-	CB	THR	V	600
R	-	CA	GLN	A	84	L	-	OG1	THR	V	600
R	-	CA	GLN	A	84	L	-	HB	THR	V	600
R	-	CA	GLN	A	84	L	-	HG21	THR	V	600
R	-	C	GLN	A	84	L	-	HB	THR	V	600
R	-	CB	GLN	A	84	L	-	HG21	THR	V	600
R	-	CG	GLN	A	84	L	-	HG21	THR	V	600
R	-	N	ASP	A	85	L	-	C	THR	V	600
R	-	N	ASP	A	85	L	-	CB	THR	V	600
R	-	N	ASP	A	85	L	-	O	THR	V	600
R	-	N	ASP	A	85	L	-	OG1	THR	V	600
R	-	N	ASP	A	85	L	-	HB	THR	V	600
R	-	N	ASP	A	85	L	-	HG1	THR	V	600
R	-	CA	ASP	A	85	L	-	C	THR	V	600
R	-	CA	ASP	A	85	L	-	CB	THR	V	600
R	-	CA	ASP	A	85	L	-	O	THR	V	600
R	-	CA	ASP	A	85	L	-	HB	THR	V	600
R	-	C	ASP	A	85	L	-	CA	THR	V	600
R	-	C	ASP	A	85	L	-	C	THR	V	600
R	-	C	ASP	A	85	L	-	CB	THR	V	600
R	-	C	ASP	A	85	L	-	O	THR	V	600
R	-	C	ASP	A	85	L	-	HA	THR	V	600
R	-	C	ASP	A	85	L	-	HB	THR	V	600
R	-	C	ASP	A	85	L	-	HG23	THR	V	600
R	-	CB	ASP	A	85	L	-	C	THR	V	600
R	-	CB	ASP	A	85	L	-	O	THR	V	600
R	-	CB	ASP	A	85	L	-	HB	THR	V	600
R	-	CB	ASP	A	85	L	-	HA	VAL	V	601
R	-	O	ASP	A	85	L	-	CA	THR	V	600
R	-	O	ASP	A	85	L	-	C	THR	V	600
R	-	O	ASP	A	85	L	-	CB	THR	V	600
R	-	O	ASP	A	85	L	-	O	THR	V	600
R	-	O	ASP	A	85	L	-	CG2	THR	V	600
R	-	O	ASP	A	85	L	-	HA	THR	V	600
R	-	O	ASP	A	85	L	-	HB	THR	V	600
R	-	O	ASP	A	85	L	-	HG23	THR	V	600
R	-	CG	ASP	A	85	L	-	O	THR	V	600
R	-	CG	ASP	A	85	L	-	HA	VAL	V	601
R	-	OD2	ASP	A	85	L	-	O	THR	V	600
R	-	OD2	ASP	A	85	L	-	HA	VAL	V	601
R	-	OD2	ASP	A	85	L	-	HG12	VAL	V	601
R	-	N	PHE	A	86	L	-	HB	THR	V	600
R	-	CA	TRP	A	87	L	-	HB2	LYS	V	603
R	-	CG	TRP	A	87	L	-	O	VAL	V	602
R	-	CD1	TRP	A	87	L	-	O	HIS	V	599
R	-	CD1	TRP	A	87	L	-	HA	THR	V	600
R	-	CD2	TRP	A	87	L	-	O	VAL	V	602
R	-	CD2	TRP	A	87	L	-	HB	VAL	V	602
R	-	CE2	TRP	A	87	L	-	O	HIS	V	599
R	-	CE2	TRP	A	87	L	-	HB3	HIS	V	599
R	-	CE2	TRP	A	87	L	-	HB	VAL	V	602
R	-	NE1	TRP	A	87	L	-	C	HIS	V	599
R	-	NE1	TRP	A	87	L	-	O	HIS	V	599
R	-	NE1	TRP	A	87	L	-	HB3	HIS	V	599
R	-	NE1	TRP	A	87	L	-	HA	THR	V	600
R	-	NE1	TRP	A	87	L	-	HB	VAL	V	602
R	-	CH2	TRP	A	87	L	-	HB	VAL	V	602
R	-	CH2	TRP	A	87	L	-	HG13	VAL	V	602
R	-	CZ2	TRP	A	87	L	-	HD13	ILE	V	581
R	-	CZ2	TRP	A	87	L	-	O	HIS	V	599
R	-	CZ2	TRP	A	87	L	-	HB3	HIS	V	599
R	-	CZ2	TRP	A	87	L	-	HB	VAL	V	602
R	-	CZ3	TRP	A	87	L	-	HB	VAL	V	602
R	-	N	PRO	A	88	L	-	HB2	LYS	V	603
R	-	N	PRO	A	88	L	-	HD3	LYS	V	603
R	-	C	PRO	A	88	L	-	HD3	LYS	V	603
R	-	O	PRO	A	88	L	-	CD	LYS	V	603
R	-	O	PRO	A	88	L	-	NZ	LYS	V	603
R	-	O	PRO	A	88	L	-	HD2	LYS	V	603
R	-	O	PRO	A	88	L	-	HD3	LYS	V	603
R	-	O	PRO	A	88	L	-	HZ2	LYS	V	603
R	-	O	PRO	A	88	L	-	HZ3	LYS	V	603
R	-	CG	PRO	A	88	L	-	O	LYS	V	603
R	-	CG	PRO	A	88	L	-	HB2	LYS	V	603
R	-	CG	PRO	A	88	L	-	HB3	LYS	V	603
R	-	CD	PRO	A	88	L	-	CB	LYS	V	603
R	-	CD	PRO	A	88	L	-	O	LYS	V	603
R	-	CD	PRO	A	88	L	-	HB2	LYS	V	603
R	-	CD	PRO	A	88	L	-	HB3	LYS	V	603
R	-	CD	PRO	A	88	L	-	HD2	LYS	V	603
R	-	CD	PRO	A	88	L	-	HD3	LYS	V	603
R	-	C	GLU	A	457	L	-	O	GLU	V	553
R	-	C	GLU	A	457	L	-	HB2	GLU	V	553
R	-	CB	GLU	A	457	L	-	HB2	CYS	V	554
R	-	CB	GLU	A	457	L	-	HB3	CYS	V	554
R	-	CB	GLU	A	457	L	-	HE1	HIS	V	571
R	-	O	GLU	A	457	L	-	C	GLU	V	553
R	-	O	GLU	A	457	L	-	O	GLU	V	553
R	-	O	GLU	A	457	L	-	HB2	GLU	V	553
R	-	CG	GLU	A	457	L	-	HB2	CYS	V	554
R	-	CD	GLU	A	457	L	-	HB2	CYS	V	554
R	-	CA	VAL	A	458	L	-	HB2	GLU	V	553
R	-	CA	VAL	A	458	L	-	ND1	HIS	V	571
R	-	CA	VAL	A	458	L	-	HB3	HIS	V	571
R	-	CB	VAL	A	458	L	-	CB	HIS	V	571
R	-	CB	VAL	A	458	L	-	ND1	HIS	V	571
R	-	CB	VAL	A	458	L	-	HA	HIS	V	571
R	-	CB	VAL	A	458	L	-	HB3	HIS	V	571
R	-	O	VAL	A	458	L	-	HB2	GLU	V	553
R	-	O	VAL	A	458	L	-	HG2	GLU	V	553
R	-	CG1	VAL	A	458	L	-	CA	HIS	V	571
R	-	CG1	VAL	A	458	L	-	C	HIS	V	571
R	-	CG1	VAL	A	458	L	-	CB	HIS	V	571
R	-	CG1	VAL	A	458	L	-	O	HIS	V	571
R	-	CG1	VAL	A	458	L	-	CG	HIS	V	571
R	-	CG1	VAL	A	458	L	-	ND1	HIS	V	571
R	-	CG1	VAL	A	458	L	-	HA	HIS	V	571
R	-	CG1	VAL	A	458	L	-	HB3	HIS	V	571
R	-	CG2	VAL	A	458	L	-	CA	HIS	V	571
R	-	CG2	VAL	A	458	L	-	CB	HIS	V	571
R	-	CG2	VAL	A	458	L	-	CG	HIS	V	571
R	-	CG2	VAL	A	458	L	-	ND1	HIS	V	571
R	-	CG2	VAL	A	458	L	-	CE1	HIS	V	571
R	-	CG2	VAL	A	458	L	-	HA	HIS	V	571
R	-	CG2	VAL	A	458	L	-	HB3	HIS	V	571
R	-	CG2	VAL	A	458	L	-	HE1	HIS	V	571
R	-	C	HIS	A	476	L	-	CA	GLY	V	573
R	-	C	HIS	A	476	L	-	HA2	GLY	V	573
R	-	C	HIS	A	476	L	-	HA3	GLY	V	573
R	-	CB	HIS	A	476	L	-	O	HIS	V	571
R	-	O	HIS	A	476	L	-	C	THR	V	572
R	-	O	HIS	A	476	L	-	O	THR	V	572
R	-	O	HIS	A	476	L	-	N	GLY	V	573
R	-	O	HIS	A	476	L	-	CA	GLY	V	573
R	-	O	HIS	A	476	L	-	C	GLY	V	573
R	-	O	HIS	A	476	L	-	H	GLY	V	573
R	-	O	HIS	A	476	L	-	HA2	GLY	V	573
R	-	O	HIS	A	476	L	-	HA3	GLY	V	573
R	-	N	THR	A	477	L	-	HA2	GLY	V	573
R	-	N	THR	A	477	L	-	HA3	GLY	V	573
R	-	CA	THR	A	477	L	-	CA	GLY	V	573
R	-	CA	THR	A	477	L	-	HA2	GLY	V	573
R	-	CA	THR	A	477	L	-	HA3	GLY	V	573
R	-	C	THR	A	477	L	-	HA2	GLY	V	573
R	-	C	THR	A	477	L	-	HA3	GLY	V	573
R	-	CB	THR	A	477	L	-	HH21	ARG	V	575
R	-	O	THR	A	477	L	-	O	GLY	V	573
R	-	O	THR	A	477	L	-	NE	ARG	V	575
R	-	O	THR	A	477	L	-	HD2	ARG	V	575
R	-	O	THR	A	477	L	-	HE	ARG	V	575
R	-	CG2	THR	A	477	L	-	HH21	ARG	V	575
R	-	CG	GLU	A	479	L	-	NH2	ARG	V	575
R	-	CG	GLU	A	479	L	-	CZ	ARG	V	575
R	-	CG	GLU	A	479	L	-	HH12	ARG	V	575
R	-	CG	GLU	A	479	L	-	HH21	ARG	V	575
R	-	CG	GLU	A	479	L	-	HH22	ARG	V	575
R	-	CD	GLU	A	479	L	-	NH2	ARG	V	575
R	-	CD	GLU	A	479	L	-	HH21	ARG	V	575
R	-	CD	GLU	A	479	L	-	HH22	ARG	V	575
R	-	OE1	GLU	A	479	L	-	NH2	ARG	V	575
R	-	OE1	GLU	A	479	L	-	CZ	ARG	V	575
R	-	OE1	GLU	A	479	L	-	HH21	ARG	V	575
R	-	OE1	GLU	A	479	L	-	HH22	ARG	V	575
R	-	OE2	GLU	A	479	L	-	HH22	ARG	V	575

- 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