IID

Q96A58_P10114.17 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	VAL	A	24	L	-	LYS	V	150
R	H	LEU	A	27	L	H	THR	V	25
R	H	LEU	A	27	L	-	GLY	V	26
R	H	LEU	A	27	L	-	THR	V	27
R	H	THR	A	28	L	-	LYS	V	150
R	H	THR	A	28	L	-	GLY	V	26
R	-	ARG	A	30	L	-	SER	V	149
R	-	ILE	A	32	L	-	LYS	V	150
R	-	TYR	A	35	L	-	LYS	V	150
R	-	TYR	A	35	L	H	ASP	V	154
R	-	ASP	A	36	L	H	ARG	V	162
R	-	THR	A	38	L	S	GLU	V	45
R	-	THR	A	38	L	-	ASP	V	47
R	-	THR	A	38	L	-	SER	V	48
R	-	LEU	A	39	L	H	GLU	V	155
R	-	LEU	A	39	L	H	ALA	V	158
R	-	LEU	A	39	L	H	ARG	V	162
R	-	LEU	A	39	L	S	GLU	V	45
R	-	LEU	A	39	L	S	VAL	V	46
R	-	LEU	A	39	L	-	ASP	V	47
R	-	GLU	A	40	L	S	ILE	V	44
R	-	GLU	A	40	L	S	GLU	V	45
R	-	GLU	A	40	L	S	PRO	V	50
R	S	SER	A	41	L	H	PHE	V	23
R	S	SER	A	41	L	S	LYS	V	42
R	S	SER	A	41	L	S	GLU	V	43
R	S	SER	A	41	L	S	ILE	V	44
R	S	SER	A	41	L	S	GLU	V	45
R	S	THR	A	42	L	H	VAL	V	24
R	S	THR	A	42	L	S	LYS	V	42
R	S	THR	A	42	L	S	GLU	V	43
R	S	THR	A	42	L	S	ILE	V	44
R	S	TYR	A	43	L	-	LYS	V	150
R	S	TYR	A	43	L	H	ASP	V	154
R	S	TYR	A	43	L	H	PHE	V	23
R	S	TYR	A	43	L	H	VAL	V	24
R	S	TYR	A	43	L	H	THR	V	25
R	S	TYR	A	43	L	S	LYS	V	42
R	S	ARG	A	44	L	H	VAL	V	24
R	S	ARG	A	44	L	H	THR	V	25
R	S	ARG	A	44	L	S	TYR	V	40
R	S	ARG	A	44	L	S	ARG	V	41
R	S	HIS	A	45	L	H	THR	V	25
R	S	HIS	A	45	L	-	THR	V	27
R	S	LEU	A	59	L	S	GLU	V	43
R	-	ALA	A	62	L	S	GLU	V	45
R	-	GLU	A	65	L	S	GLU	V	45
R	H	GLN	A	69	L	S	GLU	V	45
R	H	GLN	A	69	L	-	SER	V	48
R	H	GLN	A	69	L	S	PRO	V	50
R	H	HIS	A	73	L	-	MET	V	1
R	H	HIS	A	73	L	S	PRO	V	50
R	H	TRP	A	76	L	S	GLU	V	43

- 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_P10114.17 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	CB	VAL	A	24	L	-	HZ2	LYS	V	150
R	H	CG1	VAL	A	24	L	-	HD3	LYS	V	150
R	H	CG1	VAL	A	24	L	-	HZ2	LYS	V	150
R	H	CG2	VAL	A	24	L	-	NZ	LYS	V	150
R	H	CG2	VAL	A	24	L	-	HZ1	LYS	V	150
R	H	CG2	VAL	A	24	L	-	HZ2	LYS	V	150
R	H	CG2	VAL	A	24	L	-	HZ3	LYS	V	150
R	H	C	LEU	A	27	L	-	O	GLY	V	26
R	H	CB	LEU	A	27	L	-	CA	GLY	V	26
R	H	CB	LEU	A	27	L	-	O	GLY	V	26
R	H	CB	LEU	A	27	L	-	HA3	GLY	V	26
R	H	O	LEU	A	27	L	-	O	GLY	V	26
R	H	O	LEU	A	27	L	-	HG22	THR	V	27
R	H	CG	LEU	A	27	L	-	HA3	GLY	V	26
R	H	CD1	LEU	A	27	L	H	O	THR	V	25
R	H	CD1	LEU	A	27	L	-	CA	GLY	V	26
R	H	CD1	LEU	A	27	L	-	HA3	GLY	V	26
R	H	CD2	LEU	A	27	L	H	O	THR	V	25
R	H	CD2	LEU	A	27	L	-	HA3	GLY	V	26
R	H	CG2	THR	A	28	L	-	O	GLY	V	26
R	H	CG2	THR	A	28	L	-	CD	LYS	V	150
R	H	CG2	THR	A	28	L	-	HD2	LYS	V	150
R	H	CG2	THR	A	28	L	-	HD3	LYS	V	150
R	-	NH1	ARG	A	30	L	-	HA	SER	V	149
R	-	NH1	ARG	A	30	L	-	HB2	SER	V	149
R	-	NH1	ARG	A	30	L	-	HB3	SER	V	149
R	-	CD1	ILE	A	32	L	-	HB3	LYS	V	150
R	-	CD1	ILE	A	32	L	-	HD3	LYS	V	150
R	-	CE2	TYR	A	35	L	-	HZ2	LYS	V	150
R	-	CE2	TYR	A	35	L	H	OD2	ASP	V	154
R	-	OH	TYR	A	35	L	-	NZ	LYS	V	150
R	-	OH	TYR	A	35	L	-	HZ1	LYS	V	150
R	-	OH	TYR	A	35	L	-	HZ2	LYS	V	150
R	-	OH	TYR	A	35	L	-	HZ3	LYS	V	150
R	-	OH	TYR	A	35	L	H	CG	ASP	V	154
R	-	OH	TYR	A	35	L	H	OD2	ASP	V	154
R	-	CZ	TYR	A	35	L	-	HZ1	LYS	V	150
R	-	CZ	TYR	A	35	L	-	HZ2	LYS	V	150
R	-	CZ	TYR	A	35	L	H	OD2	ASP	V	154
R	-	OD2	ASP	A	36	L	H	NH2	ARG	V	162
R	-	OD2	ASP	A	36	L	H	HH21	ARG	V	162
R	-	OD2	ASP	A	36	L	H	HH22	ARG	V	162
R	-	CB	THR	A	38	L	-	HA	ASP	V	47
R	-	O	THR	A	38	L	S	O	GLU	V	45
R	-	O	THR	A	38	L	S	CG	GLU	V	45
R	-	O	THR	A	38	L	S	OE1	GLU	V	45
R	-	O	THR	A	38	L	S	HB3	GLU	V	45
R	-	O	THR	A	38	L	S	HG3	GLU	V	45
R	-	O	THR	A	38	L	-	H	ASP	V	47
R	-	O	THR	A	38	L	-	H	SER	V	48
R	-	O	THR	A	38	L	-	HA	SER	V	48
R	-	OG1	THR	A	38	L	-	H	ASP	V	47
R	-	OG1	THR	A	38	L	-	HA	ASP	V	47
R	-	CA	LEU	A	39	L	S	O	GLU	V	45
R	-	CA	LEU	A	39	L	S	HB3	GLU	V	45
R	-	C	LEU	A	39	L	S	O	GLU	V	45
R	-	C	LEU	A	39	L	S	HB3	GLU	V	45
R	-	CB	LEU	A	39	L	S	O	GLU	V	45
R	-	O	LEU	A	39	L	S	HB3	GLU	V	45
R	-	CG	LEU	A	39	L	H	HB1	ALA	V	158
R	-	CG	LEU	A	39	L	H	HB2	ALA	V	158
R	-	CD1	LEU	A	39	L	H	HA	GLU	V	155
R	-	CD1	LEU	A	39	L	H	CB	ALA	V	158
R	-	CD1	LEU	A	39	L	H	HB1	ALA	V	158
R	-	CD1	LEU	A	39	L	H	HB2	ALA	V	158
R	-	CD1	LEU	A	39	L	H	HB3	ALA	V	158
R	-	CD1	LEU	A	39	L	H	HH22	ARG	V	162
R	-	CD2	LEU	A	39	L	S	O	GLU	V	45
R	-	CD2	LEU	A	39	L	S	CA	VAL	V	46
R	-	CD2	LEU	A	39	L	S	HA	VAL	V	46
R	-	CD2	LEU	A	39	L	S	HG12	VAL	V	46
R	-	CD2	LEU	A	39	L	S	HG23	VAL	V	46
R	-	CD2	LEU	A	39	L	-	H	ASP	V	47
R	-	CD2	LEU	A	39	L	H	CB	ALA	V	158
R	-	CD2	LEU	A	39	L	H	HB1	ALA	V	158
R	-	CD2	LEU	A	39	L	H	HB2	ALA	V	158
R	-	CD2	LEU	A	39	L	H	HB3	ALA	V	158
R	-	CD2	LEU	A	39	L	H	NH2	ARG	V	162
R	-	CD2	LEU	A	39	L	H	HH21	ARG	V	162
R	-	CD2	LEU	A	39	L	H	HH22	ARG	V	162
R	-	N	GLU	A	40	L	S	N	GLU	V	45
R	-	N	GLU	A	40	L	S	CA	GLU	V	45
R	-	N	GLU	A	40	L	S	C	GLU	V	45
R	-	N	GLU	A	40	L	S	CB	GLU	V	45
R	-	N	GLU	A	40	L	S	O	GLU	V	45
R	-	N	GLU	A	40	L	S	CG	GLU	V	45
R	-	N	GLU	A	40	L	S	H	GLU	V	45
R	-	N	GLU	A	40	L	S	HB2	GLU	V	45
R	-	N	GLU	A	40	L	S	HB3	GLU	V	45
R	-	N	GLU	A	40	L	S	HG3	GLU	V	45
R	-	CA	GLU	A	40	L	S	N	GLU	V	45
R	-	CA	GLU	A	40	L	S	CA	GLU	V	45
R	-	CA	GLU	A	40	L	S	CB	GLU	V	45
R	-	CA	GLU	A	40	L	S	O	GLU	V	45
R	-	CA	GLU	A	40	L	S	OE2	GLU	V	45
R	-	CA	GLU	A	40	L	S	H	GLU	V	45
R	-	CA	GLU	A	40	L	S	HB2	GLU	V	45
R	-	CA	GLU	A	40	L	S	HB3	GLU	V	45
R	-	C	GLU	A	40	L	S	CA	ILE	V	44
R	-	C	GLU	A	40	L	S	C	ILE	V	44
R	-	C	GLU	A	40	L	S	HA	ILE	V	44
R	-	C	GLU	A	40	L	S	HG13	ILE	V	44
R	-	C	GLU	A	40	L	S	N	GLU	V	45
R	-	C	GLU	A	40	L	S	CA	GLU	V	45
R	-	C	GLU	A	40	L	S	CB	GLU	V	45
R	-	C	GLU	A	40	L	S	O	GLU	V	45
R	-	C	GLU	A	40	L	S	H	GLU	V	45
R	-	C	GLU	A	40	L	S	HB2	GLU	V	45
R	-	C	GLU	A	40	L	S	HB3	GLU	V	45
R	-	CB	GLU	A	40	L	S	N	GLU	V	45
R	-	CB	GLU	A	40	L	S	CA	GLU	V	45
R	-	CB	GLU	A	40	L	S	CB	GLU	V	45
R	-	CB	GLU	A	40	L	S	CG	GLU	V	45
R	-	CB	GLU	A	40	L	S	CD	GLU	V	45
R	-	CB	GLU	A	40	L	S	OE2	GLU	V	45
R	-	CB	GLU	A	40	L	S	H	GLU	V	45
R	-	CB	GLU	A	40	L	S	HA	GLU	V	45
R	-	CB	GLU	A	40	L	S	HB2	GLU	V	45
R	-	CB	GLU	A	40	L	S	HB3	GLU	V	45
R	-	CB	GLU	A	40	L	S	HG2	GLU	V	45
R	-	CB	GLU	A	40	L	S	HG3	GLU	V	45
R	-	O	GLU	A	40	L	S	CA	ILE	V	44
R	-	O	GLU	A	40	L	S	C	ILE	V	44
R	-	O	GLU	A	40	L	S	CB	ILE	V	44
R	-	O	GLU	A	40	L	S	CG1	ILE	V	44
R	-	O	GLU	A	40	L	S	HA	ILE	V	44
R	-	O	GLU	A	40	L	S	HG12	ILE	V	44
R	-	O	GLU	A	40	L	S	HG13	ILE	V	44
R	-	O	GLU	A	40	L	S	N	GLU	V	45
R	-	O	GLU	A	40	L	S	CA	GLU	V	45
R	-	O	GLU	A	40	L	S	C	GLU	V	45
R	-	O	GLU	A	40	L	S	CB	GLU	V	45
R	-	O	GLU	A	40	L	S	O	GLU	V	45
R	-	O	GLU	A	40	L	S	H	GLU	V	45
R	-	O	GLU	A	40	L	S	HB2	GLU	V	45
R	-	O	GLU	A	40	L	S	HB3	GLU	V	45
R	-	CG	GLU	A	40	L	S	N	GLU	V	45
R	-	CG	GLU	A	40	L	S	CA	GLU	V	45
R	-	CG	GLU	A	40	L	S	CB	GLU	V	45
R	-	CG	GLU	A	40	L	S	OE2	GLU	V	45
R	-	CG	GLU	A	40	L	S	H	GLU	V	45
R	-	CG	GLU	A	40	L	S	HB2	GLU	V	45
R	-	CG	GLU	A	40	L	S	HB3	GLU	V	45
R	-	CD	GLU	A	40	L	S	CB	GLU	V	45
R	-	CD	GLU	A	40	L	S	CD	GLU	V	45
R	-	CD	GLU	A	40	L	S	OE2	GLU	V	45
R	-	CD	GLU	A	40	L	S	HB2	GLU	V	45
R	-	CD	GLU	A	40	L	S	HB3	GLU	V	45
R	-	CD	GLU	A	40	L	S	HB3	PRO	V	50
R	-	CD	GLU	A	40	L	S	HG3	PRO	V	50
R	-	OE1	GLU	A	40	L	S	CB	GLU	V	45
R	-	OE1	GLU	A	40	L	S	OE2	GLU	V	45
R	-	OE1	GLU	A	40	L	S	HB2	GLU	V	45
R	-	OE1	GLU	A	40	L	S	CB	PRO	V	50
R	-	OE1	GLU	A	40	L	S	HA	PRO	V	50
R	-	OE1	GLU	A	40	L	S	HB3	PRO	V	50
R	-	OE1	GLU	A	40	L	S	HG3	PRO	V	50
R	-	OE2	GLU	A	40	L	S	CB	GLU	V	45
R	-	OE2	GLU	A	40	L	S	CD	GLU	V	45
R	-	OE2	GLU	A	40	L	S	OE2	GLU	V	45
R	-	OE2	GLU	A	40	L	S	HB2	GLU	V	45
R	-	OE2	GLU	A	40	L	S	HG3	PRO	V	50
R	S	N	SER	A	41	L	S	HA	ILE	V	44
R	S	N	SER	A	41	L	S	H	GLU	V	45
R	S	CA	SER	A	41	L	S	CE	LYS	V	42
R	S	CA	SER	A	41	L	S	HE2	LYS	V	42
R	S	CA	SER	A	41	L	S	HE3	LYS	V	42
R	S	CA	SER	A	41	L	S	O	GLU	V	43
R	S	CA	SER	A	41	L	S	HA	ILE	V	44
R	S	CA	SER	A	41	L	S	HG13	ILE	V	44
R	S	CA	SER	A	41	L	S	H	GLU	V	45
R	S	C	SER	A	41	L	S	CE	LYS	V	42
R	S	C	SER	A	41	L	S	HE2	LYS	V	42
R	S	C	SER	A	41	L	S	HE3	LYS	V	42
R	S	C	SER	A	41	L	S	HZ3	LYS	V	42
R	S	C	SER	A	41	L	S	O	GLU	V	43
R	S	C	SER	A	41	L	S	HA	ILE	V	44
R	S	CB	SER	A	41	L	S	CE	LYS	V	42
R	S	CB	SER	A	41	L	S	NZ	LYS	V	42
R	S	CB	SER	A	41	L	S	HE2	LYS	V	42
R	S	CB	SER	A	41	L	S	HE3	LYS	V	42
R	S	CB	SER	A	41	L	S	HZ2	LYS	V	42
R	S	CB	SER	A	41	L	S	HZ3	LYS	V	42
R	S	CB	SER	A	41	L	S	HG13	ILE	V	44
R	S	O	SER	A	41	L	S	HE3	LYS	V	42
R	S	OG	SER	A	41	L	H	HE2	PHE	V	23
R	S	OG	SER	A	41	L	S	HE2	LYS	V	42
R	S	OG	SER	A	41	L	S	HZ2	LYS	V	42
R	S	OG	SER	A	41	L	S	HZ3	LYS	V	42
R	S	OG	SER	A	41	L	S	HG13	ILE	V	44
R	S	N	THR	A	42	L	S	CG	LYS	V	42
R	S	N	THR	A	42	L	S	CD	LYS	V	42
R	S	N	THR	A	42	L	S	CE	LYS	V	42
R	S	N	THR	A	42	L	S	NZ	LYS	V	42
R	S	N	THR	A	42	L	S	HG2	LYS	V	42
R	S	N	THR	A	42	L	S	HG3	LYS	V	42
R	S	N	THR	A	42	L	S	HE2	LYS	V	42
R	S	N	THR	A	42	L	S	HE3	LYS	V	42
R	S	N	THR	A	42	L	S	HZ3	LYS	V	42
R	S	N	THR	A	42	L	S	C	GLU	V	43
R	S	N	THR	A	42	L	S	O	GLU	V	43
R	S	N	THR	A	42	L	S	HA	ILE	V	44
R	S	CA	THR	A	42	L	S	CG	LYS	V	42
R	S	CA	THR	A	42	L	S	CD	LYS	V	42
R	S	CA	THR	A	42	L	S	CE	LYS	V	42
R	S	CA	THR	A	42	L	S	HG2	LYS	V	42
R	S	CA	THR	A	42	L	S	HG3	LYS	V	42
R	S	CA	THR	A	42	L	S	HD3	LYS	V	42
R	S	CA	THR	A	42	L	S	HE2	LYS	V	42
R	S	CA	THR	A	42	L	S	HE3	LYS	V	42
R	S	CA	THR	A	42	L	S	O	GLU	V	43
R	S	CA	THR	A	42	L	S	HB2	GLU	V	43
R	S	C	THR	A	42	L	S	CG	LYS	V	42
R	S	C	THR	A	42	L	S	CD	LYS	V	42
R	S	C	THR	A	42	L	S	CE	LYS	V	42
R	S	C	THR	A	42	L	S	NZ	LYS	V	42
R	S	C	THR	A	42	L	S	HG2	LYS	V	42
R	S	C	THR	A	42	L	S	HG3	LYS	V	42
R	S	C	THR	A	42	L	S	HD2	LYS	V	42
R	S	C	THR	A	42	L	S	HD3	LYS	V	42
R	S	C	THR	A	42	L	S	HE2	LYS	V	42
R	S	C	THR	A	42	L	S	HE3	LYS	V	42
R	S	C	THR	A	42	L	S	HZ1	LYS	V	42
R	S	C	THR	A	42	L	S	HZ3	LYS	V	42
R	S	CB	THR	A	42	L	S	CG	LYS	V	42
R	S	CB	THR	A	42	L	S	CE	LYS	V	42
R	S	CB	THR	A	42	L	S	HA	LYS	V	42
R	S	CB	THR	A	42	L	S	HG2	LYS	V	42
R	S	CB	THR	A	42	L	S	HG3	LYS	V	42
R	S	CB	THR	A	42	L	S	HE2	LYS	V	42
R	S	CB	THR	A	42	L	S	HE3	LYS	V	42
R	S	CB	THR	A	42	L	S	N	GLU	V	43
R	S	CB	THR	A	42	L	S	CA	GLU	V	43
R	S	CB	THR	A	42	L	S	C	GLU	V	43
R	S	CB	THR	A	42	L	S	CB	GLU	V	43
R	S	CB	THR	A	42	L	S	O	GLU	V	43
R	S	CB	THR	A	42	L	S	H	GLU	V	43
R	S	CB	THR	A	42	L	S	HB2	GLU	V	43
R	S	O	THR	A	42	L	H	O	VAL	V	24
R	S	O	THR	A	42	L	H	HA	VAL	V	24
R	S	O	THR	A	42	L	S	CB	LYS	V	42
R	S	O	THR	A	42	L	S	CG	LYS	V	42
R	S	O	THR	A	42	L	S	CD	LYS	V	42
R	S	O	THR	A	42	L	S	CE	LYS	V	42
R	S	O	THR	A	42	L	S	NZ	LYS	V	42
R	S	O	THR	A	42	L	S	HB3	LYS	V	42
R	S	O	THR	A	42	L	S	HG2	LYS	V	42
R	S	O	THR	A	42	L	S	HG3	LYS	V	42
R	S	O	THR	A	42	L	S	HD2	LYS	V	42
R	S	O	THR	A	42	L	S	HD3	LYS	V	42
R	S	O	THR	A	42	L	S	HE2	LYS	V	42
R	S	O	THR	A	42	L	S	HE3	LYS	V	42
R	S	O	THR	A	42	L	S	HZ1	LYS	V	42
R	S	O	THR	A	42	L	S	HZ2	LYS	V	42
R	S	O	THR	A	42	L	S	HZ3	LYS	V	42
R	S	CG2	THR	A	42	L	S	HA	LYS	V	42
R	S	CG2	THR	A	42	L	S	HG3	LYS	V	42
R	S	CG2	THR	A	42	L	S	H	GLU	V	43
R	S	CG2	THR	A	42	L	S	HB2	GLU	V	43
R	S	OG1	THR	A	42	L	S	HG3	LYS	V	42
R	S	OG1	THR	A	42	L	S	N	GLU	V	43
R	S	OG1	THR	A	42	L	S	CA	GLU	V	43
R	S	OG1	THR	A	42	L	S	C	GLU	V	43
R	S	OG1	THR	A	42	L	S	CB	GLU	V	43
R	S	OG1	THR	A	42	L	S	O	GLU	V	43
R	S	OG1	THR	A	42	L	S	CG	GLU	V	43
R	S	OG1	THR	A	42	L	S	OE2	GLU	V	43
R	S	OG1	THR	A	42	L	S	H	GLU	V	43
R	S	OG1	THR	A	42	L	S	HB2	GLU	V	43
R	S	OG1	THR	A	42	L	S	HB3	GLU	V	43
R	S	OG1	THR	A	42	L	S	HG3	GLU	V	43
R	S	N	TYR	A	43	L	H	O	VAL	V	24
R	S	N	TYR	A	43	L	S	CD	LYS	V	42
R	S	N	TYR	A	43	L	S	CE	LYS	V	42
R	S	N	TYR	A	43	L	S	HG3	LYS	V	42
R	S	N	TYR	A	43	L	S	HD3	LYS	V	42
R	S	N	TYR	A	43	L	S	HE3	LYS	V	42
R	S	N	TYR	A	43	L	S	HZ3	LYS	V	42
R	S	CA	TYR	A	43	L	H	C	VAL	V	24
R	S	CA	TYR	A	43	L	H	O	VAL	V	24
R	S	CA	TYR	A	43	L	H	HA	THR	V	25
R	S	CA	TYR	A	43	L	S	CE	LYS	V	42
R	S	CA	TYR	A	43	L	S	HD3	LYS	V	42
R	S	CA	TYR	A	43	L	S	HE3	LYS	V	42
R	S	CA	TYR	A	43	L	S	HZ1	LYS	V	42
R	S	C	TYR	A	43	L	H	C	VAL	V	24
R	S	C	TYR	A	43	L	H	O	VAL	V	24
R	S	C	TYR	A	43	L	H	HA	THR	V	25
R	S	CB	TYR	A	43	L	H	O	VAL	V	24
R	S	CB	TYR	A	43	L	S	HE3	LYS	V	42
R	S	O	TYR	A	43	L	H	O	VAL	V	24
R	S	CG	TYR	A	43	L	S	NZ	LYS	V	42
R	S	CG	TYR	A	43	L	S	HE3	LYS	V	42
R	S	CG	TYR	A	43	L	S	HZ1	LYS	V	42
R	S	CG	TYR	A	43	L	S	HZ3	LYS	V	42
R	S	CD1	TYR	A	43	L	H	O	PHE	V	23
R	S	CD1	TYR	A	43	L	S	NZ	LYS	V	42
R	S	CD1	TYR	A	43	L	S	HE3	LYS	V	42
R	S	CD1	TYR	A	43	L	S	HZ1	LYS	V	42
R	S	CD1	TYR	A	43	L	S	HZ2	LYS	V	42
R	S	CD1	TYR	A	43	L	S	HZ3	LYS	V	42
R	S	CD1	TYR	A	43	L	-	HZ3	LYS	V	150
R	S	CD2	TYR	A	43	L	S	HE3	LYS	V	42
R	S	CD2	TYR	A	43	L	S	HZ3	LYS	V	42
R	S	CE1	TYR	A	43	L	H	O	PHE	V	23
R	S	CE1	TYR	A	43	L	S	NZ	LYS	V	42
R	S	CE1	TYR	A	43	L	S	HZ1	LYS	V	42
R	S	CE1	TYR	A	43	L	S	HZ2	LYS	V	42
R	S	CE1	TYR	A	43	L	S	HZ3	LYS	V	42
R	S	CE1	TYR	A	43	L	-	NZ	LYS	V	150
R	S	CE1	TYR	A	43	L	-	HE2	LYS	V	150
R	S	CE1	TYR	A	43	L	-	HZ1	LYS	V	150
R	S	CE1	TYR	A	43	L	-	HZ3	LYS	V	150
R	S	CE1	TYR	A	43	L	H	OD1	ASP	V	154
R	S	CE1	TYR	A	43	L	H	OD2	ASP	V	154
R	S	CE2	TYR	A	43	L	S	HZ3	LYS	V	42
R	S	OH	TYR	A	43	L	S	HZ3	LYS	V	42
R	S	OH	TYR	A	43	L	-	HZ1	LYS	V	150
R	S	OH	TYR	A	43	L	-	HZ3	LYS	V	150
R	S	OH	TYR	A	43	L	H	CG	ASP	V	154
R	S	OH	TYR	A	43	L	H	OD1	ASP	V	154
R	S	OH	TYR	A	43	L	H	OD2	ASP	V	154
R	S	CZ	TYR	A	43	L	S	NZ	LYS	V	42
R	S	CZ	TYR	A	43	L	S	HZ3	LYS	V	42
R	S	CZ	TYR	A	43	L	-	HZ1	LYS	V	150
R	S	CZ	TYR	A	43	L	-	HZ3	LYS	V	150
R	S	N	ARG	A	44	L	H	C	VAL	V	24
R	S	N	ARG	A	44	L	H	O	VAL	V	24
R	S	N	ARG	A	44	L	H	HG11	VAL	V	24
R	S	N	ARG	A	44	L	H	N	THR	V	25
R	S	N	ARG	A	44	L	H	CA	THR	V	25
R	S	N	ARG	A	44	L	H	HA	THR	V	25
R	S	N	ARG	A	44	L	H	HG23	THR	V	25
R	S	CA	ARG	A	44	L	H	O	VAL	V	24
R	S	CA	ARG	A	44	L	H	HG11	VAL	V	24
R	S	CA	ARG	A	44	L	H	CA	THR	V	25
R	S	CA	ARG	A	44	L	H	HA	THR	V	25
R	S	CA	ARG	A	44	L	H	HG23	THR	V	25
R	S	C	ARG	A	44	L	H	O	VAL	V	24
R	S	C	ARG	A	44	L	H	CA	THR	V	25
R	S	C	ARG	A	44	L	H	C	THR	V	25
R	S	C	ARG	A	44	L	H	CB	THR	V	25
R	S	C	ARG	A	44	L	H	O	THR	V	25
R	S	C	ARG	A	44	L	H	CG2	THR	V	25
R	S	C	ARG	A	44	L	H	HA	THR	V	25
R	S	C	ARG	A	44	L	H	HB	THR	V	25
R	S	C	ARG	A	44	L	H	HG23	THR	V	25
R	S	CB	ARG	A	44	L	H	O	VAL	V	24
R	S	CB	ARG	A	44	L	H	CG1	VAL	V	24
R	S	CB	ARG	A	44	L	H	HG11	VAL	V	24
R	S	CB	ARG	A	44	L	H	CG2	THR	V	25
R	S	CB	ARG	A	44	L	H	HA	THR	V	25
R	S	CB	ARG	A	44	L	H	HG23	THR	V	25
R	S	O	ARG	A	44	L	H	C	VAL	V	24
R	S	O	ARG	A	44	L	H	O	VAL	V	24
R	S	O	ARG	A	44	L	H	N	THR	V	25
R	S	O	ARG	A	44	L	H	CA	THR	V	25
R	S	O	ARG	A	44	L	H	C	THR	V	25
R	S	O	ARG	A	44	L	H	CB	THR	V	25
R	S	O	ARG	A	44	L	H	O	THR	V	25
R	S	O	ARG	A	44	L	H	CG2	THR	V	25
R	S	O	ARG	A	44	L	H	OG1	THR	V	25
R	S	O	ARG	A	44	L	H	HA	THR	V	25
R	S	O	ARG	A	44	L	H	HB	THR	V	25
R	S	O	ARG	A	44	L	H	HG21	THR	V	25
R	S	O	ARG	A	44	L	H	HG22	THR	V	25
R	S	O	ARG	A	44	L	H	HG23	THR	V	25
R	S	CG	ARG	A	44	L	H	HG11	VAL	V	24
R	S	CD	ARG	A	44	L	H	HG11	VAL	V	24
R	S	NE	ARG	A	44	L	H	CG1	VAL	V	24
R	S	NE	ARG	A	44	L	H	HG11	VAL	V	24
R	S	NE	ARG	A	44	L	H	HG12	VAL	V	24
R	S	NE	ARG	A	44	L	H	HG13	VAL	V	24
R	S	NE	ARG	A	44	L	S	O	ARG	V	41
R	S	NH1	ARG	A	44	L	S	O	ARG	V	41
R	S	NH1	ARG	A	44	L	S	H	ARG	V	41
R	S	NH2	ARG	A	44	L	H	CG1	VAL	V	24
R	S	NH2	ARG	A	44	L	H	HG12	VAL	V	24
R	S	NH2	ARG	A	44	L	H	HG13	VAL	V	24
R	S	NH2	ARG	A	44	L	S	CA	TYR	V	40
R	S	NH2	ARG	A	44	L	S	C	TYR	V	40
R	S	NH2	ARG	A	44	L	S	CB	TYR	V	40
R	S	NH2	ARG	A	44	L	S	HA	TYR	V	40
R	S	NH2	ARG	A	44	L	S	HB3	TYR	V	40
R	S	NH2	ARG	A	44	L	S	HD1	TYR	V	40
R	S	NH2	ARG	A	44	L	S	N	ARG	V	41
R	S	NH2	ARG	A	44	L	S	CA	ARG	V	41
R	S	NH2	ARG	A	44	L	S	C	ARG	V	41
R	S	NH2	ARG	A	44	L	S	O	ARG	V	41
R	S	NH2	ARG	A	44	L	S	H	ARG	V	41
R	S	NH2	ARG	A	44	L	S	HB3	ARG	V	41
R	S	CZ	ARG	A	44	L	H	CG1	VAL	V	24
R	S	CZ	ARG	A	44	L	H	HG11	VAL	V	24
R	S	CZ	ARG	A	44	L	H	HG12	VAL	V	24
R	S	CZ	ARG	A	44	L	H	HG13	VAL	V	24
R	S	CZ	ARG	A	44	L	S	HD1	TYR	V	40
R	S	CZ	ARG	A	44	L	S	O	ARG	V	41
R	S	CZ	ARG	A	44	L	S	H	ARG	V	41
R	S	N	HIS	A	45	L	H	HA	THR	V	25
R	S	N	HIS	A	45	L	H	HB	THR	V	25
R	S	N	HIS	A	45	L	H	HG23	THR	V	25
R	S	CA	HIS	A	45	L	H	O	THR	V	25
R	S	CA	HIS	A	45	L	H	HB	THR	V	25
R	S	CB	HIS	A	45	L	H	O	THR	V	25
R	S	ND1	HIS	A	45	L	H	O	THR	V	25
R	S	ND1	HIS	A	45	L	-	CG2	THR	V	27
R	S	ND1	HIS	A	45	L	-	HG21	THR	V	27
R	S	ND1	HIS	A	45	L	-	HG22	THR	V	27
R	S	ND1	HIS	A	45	L	-	HG23	THR	V	27
R	S	CE1	HIS	A	45	L	-	CG2	THR	V	27
R	S	CE1	HIS	A	45	L	-	HG21	THR	V	27
R	S	CE1	HIS	A	45	L	-	HG22	THR	V	27
R	S	CE1	HIS	A	45	L	-	HG23	THR	V	27
R	S	CD1	LEU	A	59	L	S	OE2	GLU	V	43
R	S	CD1	LEU	A	59	L	S	HB2	GLU	V	43
R	-	N	ALA	A	62	L	S	OE2	GLU	V	45
R	-	CB	ALA	A	62	L	S	CD	GLU	V	45
R	-	CB	ALA	A	62	L	S	OE1	GLU	V	45
R	-	CB	ALA	A	62	L	S	OE2	GLU	V	45
R	-	CG	GLU	A	65	L	S	OE2	GLU	V	45
R	H	CA	GLN	A	69	L	S	HG2	PRO	V	50
R	H	CB	GLN	A	69	L	S	CG	PRO	V	50
R	H	CB	GLN	A	69	L	S	HG2	PRO	V	50
R	H	CB	GLN	A	69	L	S	HG3	PRO	V	50
R	H	CG	GLN	A	69	L	S	CB	PRO	V	50
R	H	CG	GLN	A	69	L	S	CG	PRO	V	50
R	H	CG	GLN	A	69	L	S	CD	PRO	V	50
R	H	CG	GLN	A	69	L	S	HB2	PRO	V	50
R	H	CG	GLN	A	69	L	S	HB3	PRO	V	50
R	H	CG	GLN	A	69	L	S	HG2	PRO	V	50
R	H	CG	GLN	A	69	L	S	HG3	PRO	V	50
R	H	CD	GLN	A	69	L	S	N	PRO	V	50
R	H	CD	GLN	A	69	L	S	CA	PRO	V	50
R	H	CD	GLN	A	69	L	S	CB	PRO	V	50
R	H	CD	GLN	A	69	L	S	CG	PRO	V	50
R	H	CD	GLN	A	69	L	S	CD	PRO	V	50
R	H	CD	GLN	A	69	L	S	HB2	PRO	V	50
R	H	CD	GLN	A	69	L	S	HB3	PRO	V	50
R	H	CD	GLN	A	69	L	S	HG2	PRO	V	50
R	H	CD	GLN	A	69	L	S	HG3	PRO	V	50
R	H	CD	GLN	A	69	L	S	HD2	PRO	V	50
R	H	CD	GLN	A	69	L	S	HD3	PRO	V	50
R	H	NE2	GLN	A	69	L	S	CG	GLU	V	45
R	H	NE2	GLN	A	69	L	S	CD	GLU	V	45
R	H	NE2	GLN	A	69	L	S	OE2	GLU	V	45
R	H	NE2	GLN	A	69	L	S	HB2	GLU	V	45
R	H	NE2	GLN	A	69	L	S	HG2	GLU	V	45
R	H	NE2	GLN	A	69	L	S	N	PRO	V	50
R	H	NE2	GLN	A	69	L	S	CA	PRO	V	50
R	H	NE2	GLN	A	69	L	S	CB	PRO	V	50
R	H	NE2	GLN	A	69	L	S	CG	PRO	V	50
R	H	NE2	GLN	A	69	L	S	CD	PRO	V	50
R	H	NE2	GLN	A	69	L	S	HA	PRO	V	50
R	H	NE2	GLN	A	69	L	S	HB2	PRO	V	50
R	H	NE2	GLN	A	69	L	S	HB3	PRO	V	50
R	H	NE2	GLN	A	69	L	S	HG2	PRO	V	50
R	H	NE2	GLN	A	69	L	S	HG3	PRO	V	50
R	H	NE2	GLN	A	69	L	S	HD2	PRO	V	50
R	H	NE2	GLN	A	69	L	S	HD3	PRO	V	50
R	H	OE1	GLN	A	69	L	S	HG2	GLU	V	45
R	H	OE1	GLN	A	69	L	-	O	SER	V	48
R	H	OE1	GLN	A	69	L	S	N	PRO	V	50
R	H	OE1	GLN	A	69	L	S	CB	PRO	V	50
R	H	OE1	GLN	A	69	L	S	CG	PRO	V	50
R	H	OE1	GLN	A	69	L	S	CD	PRO	V	50
R	H	OE1	GLN	A	69	L	S	HG2	PRO	V	50
R	H	OE1	GLN	A	69	L	S	HG3	PRO	V	50
R	H	OE1	GLN	A	69	L	S	HD2	PRO	V	50
R	H	OE1	GLN	A	69	L	S	HD3	PRO	V	50
R	H	ND1	HIS	A	73	L	-	HE1	MET	V	1
R	H	CE1	HIS	A	73	L	-	HE1	MET	V	1
R	H	CE1	HIS	A	73	L	-	HE2	MET	V	1
R	H	CE1	HIS	A	73	L	S	HB3	PRO	V	50
R	H	NE2	HIS	A	73	L	S	HB3	PRO	V	50
R	H	NE2	HIS	A	73	L	S	HG3	PRO	V	50
R	H	CD1	TRP	A	76	L	S	OE1	GLU	V	43
R	H	NE1	TRP	A	76	L	S	OE1	GLU	V	43

- 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