IID

Q86W10_Q8N118.6 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	MET	A	10	L	H	LEU	V	26
R	H	PRO	A	13	L	H	PHE	V	18
R	H	PRO	A	13	L	H	LEU	V	22
R	H	PHE	A	14	L	H	PHE	V	18
R	H	PHE	A	14	L	H	LEU	V	22
R	H	LEU	A	16	L	H	LEU	V	22
R	H	LEU	A	16	L	H	GLY	V	25
R	H	LEU	A	16	L	H	LEU	V	26
R	H	LEU	A	16	L	H	ALA	V	29
R	H	LEU	A	17	L	H	PHE	V	18
R	H	LEU	A	17	L	H	CYS	V	21
R	H	LEU	A	17	L	H	LEU	V	22
R	H	LEU	A	17	L	H	GLY	V	25
R	H	LEU	A	19	L	H	GLY	V	25
R	H	LEU	A	19	L	H	GLN	V	28
R	H	LEU	A	20	L	H	PHE	V	20
R	H	LEU	A	20	L	H	CYS	V	21
R	H	LEU	A	20	L	H	ALA	V	23
R	H	LEU	A	20	L	H	LEU	V	24
R	H	LEU	A	20	L	H	GLY	V	25
R	H	LEU	A	20	L	H	GLN	V	28
R	H	MET	A	22	L	-	SER	V	234
R	H	MET	A	22	L	H	ILE	V	236
R	H	SER	A	23	L	H	GLN	V	28
R	H	LEU	A	24	L	H	LEU	V	24
R	H	LEU	A	25	L	H	ILE	V	236
R	H	LEU	A	26	L	H	LYS	V	115
R	H	VAL	A	29	L	H	ASP	V	235
R	H	TYR	A	33	L	H	GLN	V	114
R	H	TYR	A	33	L	-	LYS	V	123
R	H	ARG	A	37	L	H	GLN	V	114
R	H	ARG	A	37	L	-	LYS	V	123
R	H	ARG	A	37	L	-	ALA	V	127
R	H	ARG	A	37	L	-	LEU	V	128
R	H	ARG	A	37	L	-	ASP	V	129
R	H	ILE	A	40	L	H	LYS	V	132
R	H	ILE	A	40	L	H	ILE	V	304
R	H	ARG	A	41	L	-	ASP	V	129
R	H	ARG	A	41	L	H	LYS	V	132
R	-	LEU	A	43	L	-	SER	V	302
R	-	HIS	A	44	L	H	LYS	V	132
R	-	HIS	A	44	L	H	GLN	V	135
R	-	HIS	A	44	L	-	SER	V	299
R	-	HIS	A	44	L	-	SER	V	300
R	-	HIS	A	44	L	-	SER	V	302
R	-	LEU	A	45	L	-	SER	V	297
R	-	LEU	A	45	L	-	SER	V	299
R	-	PHE	A	46	L	-	SER	V	302
R	-	PRO	A	47	L	-	SER	V	300
R	-	PRO	A	47	L	-	SER	V	302
R	-	PRO	A	47	L	H	ASP	V	303
R	-	ALA	A	48	L	-	SER	V	302
R	-	ALA	A	48	L	H	ASP	V	303
R	-	PRO	A	49	L	H	ASP	V	303
R	-	PRO	A	49	L	H	ILE	V	304
R	H	TRP	A	5	L	H	TYR	V	33
R	H	TRP	A	5	L	-	TRP	V	53
R	H	TRP	A	5	L	-	PHE	V	87
R	-	PRO	A	50	L	H	ASP	V	259
R	-	PRO	A	50	L	H	GLN	V	263
R	-	PRO	A	50	L	H	ASP	V	303
R	-	ALA	A	51	L	H	ILE	V	304
R	-	HIS	A	52	L	H	ARG	V	252
R	-	TRP	A	53	L	-	PRO	V	119
R	-	TRP	A	53	L	H	GLN	V	248
R	-	TRP	A	53	L	H	ASN	V	255
R	H	LEU	A	6	L	H	TYR	V	33
R	H	LYS	A	75	L	H	GLN	V	263
R	H	LYS	A	75	L	H	LYS	V	266
R	-	TYR	A	76	L	H	LYS	V	266
R	-	TYR	A	76	L	H	ASP	V	303
R	S	TRP	A	83	L	H	ILE	V	304
R	H	LEU	A	9	L	H	ALA	V	29

- 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

Q86W10_Q8N118.6 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	TRP	A	5	L	-	HZ3	TRP	V	53
R	H	CG	TRP	A	5	L	-	HZ3	TRP	V	53
R	H	CD2	TRP	A	5	L	-	HZ3	TRP	V	53
R	H	CE2	TRP	A	5	L	H	HD2	TYR	V	33
R	H	CE2	TRP	A	5	L	H	HE2	TYR	V	33
R	H	CE3	TRP	A	5	L	-	HZ3	TRP	V	53
R	H	NE1	TRP	A	5	L	H	HE2	TYR	V	33
R	H	CH2	TRP	A	5	L	H	HD2	TYR	V	33
R	H	CH2	TRP	A	5	L	-	HE1	PHE	V	87
R	H	CH2	TRP	A	5	L	-	HZ	PHE	V	87
R	H	CZ2	TRP	A	5	L	H	CD2	TYR	V	33
R	H	CZ2	TRP	A	5	L	H	CE2	TYR	V	33
R	H	CZ2	TRP	A	5	L	H	HD2	TYR	V	33
R	H	CZ2	TRP	A	5	L	H	HE2	TYR	V	33
R	H	CZ3	TRP	A	5	L	-	HZ	PHE	V	87
R	H	CD1	LEU	A	6	L	H	CD2	TYR	V	33
R	H	CD1	LEU	A	6	L	H	CE2	TYR	V	33
R	H	CD1	LEU	A	6	L	H	CZ	TYR	V	33
R	H	CD1	LEU	A	6	L	H	HD2	TYR	V	33
R	H	CD1	LEU	A	6	L	H	HE2	TYR	V	33
R	H	CD1	LEU	A	6	L	H	HH	TYR	V	33
R	H	CD2	LEU	A	6	L	H	HD2	TYR	V	33
R	H	CD2	LEU	A	9	L	H	HB1	ALA	V	29
R	H	SD	MET	A	10	L	H	HD12	LEU	V	26
R	H	CE	MET	A	10	L	H	HD12	LEU	V	26
R	H	CA	PRO	A	13	L	H	CD2	LEU	V	22
R	H	CA	PRO	A	13	L	H	HD22	LEU	V	22
R	H	CA	PRO	A	13	L	H	HD23	LEU	V	22
R	H	C	PRO	A	13	L	H	CD2	LEU	V	22
R	H	C	PRO	A	13	L	H	HD21	LEU	V	22
R	H	C	PRO	A	13	L	H	HD22	LEU	V	22
R	H	C	PRO	A	13	L	H	HD23	LEU	V	22
R	H	CB	PRO	A	13	L	H	HZ	PHE	V	18
R	H	CB	PRO	A	13	L	H	CD1	LEU	V	22
R	H	CB	PRO	A	13	L	H	CD2	LEU	V	22
R	H	CB	PRO	A	13	L	H	HD11	LEU	V	22
R	H	CB	PRO	A	13	L	H	HD12	LEU	V	22
R	H	CB	PRO	A	13	L	H	HD22	LEU	V	22
R	H	CB	PRO	A	13	L	H	HD23	LEU	V	22
R	H	O	PRO	A	13	L	H	CD2	LEU	V	22
R	H	O	PRO	A	13	L	H	HD21	LEU	V	22
R	H	O	PRO	A	13	L	H	HD22	LEU	V	22
R	H	O	PRO	A	13	L	H	HD23	LEU	V	22
R	H	N	PHE	A	14	L	H	HD22	LEU	V	22
R	H	CD1	PHE	A	14	L	H	HE2	PHE	V	18
R	H	CE1	PHE	A	14	L	H	HE2	PHE	V	18
R	H	CE1	PHE	A	14	L	H	HZ	PHE	V	18
R	H	CA	LEU	A	16	L	H	HA3	GLY	V	25
R	H	C	LEU	A	16	L	H	HD21	LEU	V	22
R	H	C	LEU	A	16	L	H	CA	GLY	V	25
R	H	C	LEU	A	16	L	H	HA3	GLY	V	25
R	H	CB	LEU	A	16	L	H	HD23	LEU	V	22
R	H	CB	LEU	A	16	L	H	HA3	GLY	V	25
R	H	O	LEU	A	16	L	H	CA	GLY	V	25
R	H	O	LEU	A	16	L	H	C	GLY	V	25
R	H	O	LEU	A	16	L	H	O	GLY	V	25
R	H	O	LEU	A	16	L	H	HA2	GLY	V	25
R	H	O	LEU	A	16	L	H	HA3	GLY	V	25
R	H	CD1	LEU	A	16	L	H	HB3	LEU	V	26
R	H	CD1	LEU	A	16	L	H	HD13	LEU	V	26
R	H	CD2	LEU	A	16	L	H	HA	LEU	V	26
R	H	CD2	LEU	A	16	L	H	HD11	LEU	V	26
R	H	CD2	LEU	A	16	L	H	CB	ALA	V	29
R	H	CD2	LEU	A	16	L	H	HB1	ALA	V	29
R	H	CD2	LEU	A	16	L	H	HB2	ALA	V	29
R	H	CD2	LEU	A	16	L	H	HB3	ALA	V	29
R	H	N	LEU	A	17	L	H	CD2	LEU	V	22
R	H	N	LEU	A	17	L	H	HA	LEU	V	22
R	H	N	LEU	A	17	L	H	HD21	LEU	V	22
R	H	N	LEU	A	17	L	H	HA3	GLY	V	25
R	H	CA	LEU	A	17	L	H	HA	LEU	V	22
R	H	CA	LEU	A	17	L	H	HD21	LEU	V	22
R	H	CA	LEU	A	17	L	H	HA3	GLY	V	25
R	H	CB	LEU	A	17	L	H	HB3	CYS	V	21
R	H	CB	LEU	A	17	L	H	CD2	LEU	V	22
R	H	CB	LEU	A	17	L	H	HA	LEU	V	22
R	H	CB	LEU	A	17	L	H	HD21	LEU	V	22
R	H	CB	LEU	A	17	L	H	HD22	LEU	V	22
R	H	CG	LEU	A	17	L	H	CB	CYS	V	21
R	H	CG	LEU	A	17	L	H	HB2	CYS	V	21
R	H	CG	LEU	A	17	L	H	HB3	CYS	V	21
R	H	CG	LEU	A	17	L	H	HD21	LEU	V	22
R	H	CD1	LEU	A	17	L	H	CA	CYS	V	21
R	H	CD1	LEU	A	17	L	H	C	CYS	V	21
R	H	CD1	LEU	A	17	L	H	CB	CYS	V	21
R	H	CD1	LEU	A	17	L	H	O	CYS	V	21
R	H	CD1	LEU	A	17	L	H	SG	CYS	V	21
R	H	CD1	LEU	A	17	L	H	HA	CYS	V	21
R	H	CD1	LEU	A	17	L	H	HB2	CYS	V	21
R	H	CD1	LEU	A	17	L	H	HB3	CYS	V	21
R	H	CD1	LEU	A	17	L	H	N	LEU	V	22
R	H	CD1	LEU	A	17	L	H	H	LEU	V	22
R	H	CD1	LEU	A	17	L	H	HA	LEU	V	22
R	H	CD1	LEU	A	17	L	H	HG	LEU	V	22
R	H	CD1	LEU	A	17	L	H	HD21	LEU	V	22
R	H	CD2	LEU	A	17	L	H	CD2	PHE	V	18
R	H	CD2	LEU	A	17	L	H	CE2	PHE	V	18
R	H	CD2	LEU	A	17	L	H	HD2	PHE	V	18
R	H	CD2	LEU	A	17	L	H	HE2	PHE	V	18
R	H	CD2	LEU	A	17	L	H	HB2	CYS	V	21
R	H	CD2	LEU	A	17	L	H	HB3	CYS	V	21
R	H	C	LEU	A	19	L	H	HA2	GLY	V	25
R	H	O	LEU	A	19	L	H	HG2	GLN	V	28
R	H	N	LEU	A	20	L	H	CA	GLY	V	25
R	H	N	LEU	A	20	L	H	HA2	GLY	V	25
R	H	N	LEU	A	20	L	H	HA3	GLY	V	25
R	H	CA	LEU	A	20	L	H	N	GLY	V	25
R	H	CA	LEU	A	20	L	H	CA	GLY	V	25
R	H	CA	LEU	A	20	L	H	HA2	GLY	V	25
R	H	CA	LEU	A	20	L	H	HA3	GLY	V	25
R	H	CA	LEU	A	20	L	H	HB3	GLN	V	28
R	H	C	LEU	A	20	L	H	HA2	GLY	V	25
R	H	CB	LEU	A	20	L	H	O	CYS	V	21
R	H	CB	LEU	A	20	L	H	C	LEU	V	24
R	H	CB	LEU	A	20	L	H	CB	LEU	V	24
R	H	CB	LEU	A	20	L	H	O	LEU	V	24
R	H	CB	LEU	A	20	L	H	HB2	LEU	V	24
R	H	CB	LEU	A	20	L	H	HB3	LEU	V	24
R	H	CB	LEU	A	20	L	H	N	GLY	V	25
R	H	CB	LEU	A	20	L	H	CA	GLY	V	25
R	H	CB	LEU	A	20	L	H	C	GLY	V	25
R	H	CB	LEU	A	20	L	H	H	GLY	V	25
R	H	CB	LEU	A	20	L	H	HA2	GLY	V	25
R	H	CB	LEU	A	20	L	H	HA3	GLY	V	25
R	H	CG	LEU	A	20	L	H	O	CYS	V	21
R	H	CG	LEU	A	20	L	H	N	LEU	V	24
R	H	CG	LEU	A	20	L	H	CA	LEU	V	24
R	H	CG	LEU	A	20	L	H	C	LEU	V	24
R	H	CG	LEU	A	20	L	H	CB	LEU	V	24
R	H	CG	LEU	A	20	L	H	O	LEU	V	24
R	H	CG	LEU	A	20	L	H	CG	LEU	V	24
R	H	CG	LEU	A	20	L	H	HA	LEU	V	24
R	H	CG	LEU	A	20	L	H	HB2	LEU	V	24
R	H	CG	LEU	A	20	L	H	HB3	LEU	V	24
R	H	CG	LEU	A	20	L	H	N	GLY	V	25
R	H	CG	LEU	A	20	L	H	CA	GLY	V	25
R	H	CG	LEU	A	20	L	H	H	GLY	V	25
R	H	CG	LEU	A	20	L	H	HA2	GLY	V	25
R	H	CG	LEU	A	20	L	H	HA3	GLY	V	25
R	H	CD1	LEU	A	20	L	H	N	LEU	V	24
R	H	CD1	LEU	A	20	L	H	CA	LEU	V	24
R	H	CD1	LEU	A	20	L	H	C	LEU	V	24
R	H	CD1	LEU	A	20	L	H	CB	LEU	V	24
R	H	CD1	LEU	A	20	L	H	O	LEU	V	24
R	H	CD1	LEU	A	20	L	H	CG	LEU	V	24
R	H	CD1	LEU	A	20	L	H	HA	LEU	V	24
R	H	CD1	LEU	A	20	L	H	HB2	LEU	V	24
R	H	CD1	LEU	A	20	L	H	HB3	LEU	V	24
R	H	CD1	LEU	A	20	L	H	HD22	LEU	V	24
R	H	CD1	LEU	A	20	L	H	N	GLY	V	25
R	H	CD1	LEU	A	20	L	H	CA	GLY	V	25
R	H	CD1	LEU	A	20	L	H	H	GLY	V	25
R	H	CD1	LEU	A	20	L	H	HA2	GLY	V	25
R	H	CD1	LEU	A	20	L	H	H	GLN	V	28
R	H	CD1	LEU	A	20	L	H	HB2	GLN	V	28
R	H	CD1	LEU	A	20	L	H	HB3	GLN	V	28
R	H	CD2	LEU	A	20	L	H	O	PHE	V	20
R	H	CD2	LEU	A	20	L	H	CA	CYS	V	21
R	H	CD2	LEU	A	20	L	H	C	CYS	V	21
R	H	CD2	LEU	A	20	L	H	O	CYS	V	21
R	H	CD2	LEU	A	20	L	H	HA	CYS	V	21
R	H	CD2	LEU	A	20	L	H	C	ALA	V	23
R	H	CD2	LEU	A	20	L	H	N	LEU	V	24
R	H	CD2	LEU	A	20	L	H	CA	LEU	V	24
R	H	CD2	LEU	A	20	L	H	C	LEU	V	24
R	H	CD2	LEU	A	20	L	H	CB	LEU	V	24
R	H	CD2	LEU	A	20	L	H	O	LEU	V	24
R	H	CD2	LEU	A	20	L	H	CG	LEU	V	24
R	H	CD2	LEU	A	20	L	H	CD1	LEU	V	24
R	H	CD2	LEU	A	20	L	H	H	LEU	V	24
R	H	CD2	LEU	A	20	L	H	HA	LEU	V	24
R	H	CD2	LEU	A	20	L	H	HB2	LEU	V	24
R	H	CD2	LEU	A	20	L	H	HB3	LEU	V	24
R	H	CD2	LEU	A	20	L	H	HG	LEU	V	24
R	H	CD2	LEU	A	20	L	H	HD12	LEU	V	24
R	H	CD2	LEU	A	20	L	H	N	GLY	V	25
R	H	CD2	LEU	A	20	L	H	CA	GLY	V	25
R	H	CD2	LEU	A	20	L	H	H	GLY	V	25
R	H	CD2	LEU	A	20	L	H	HA2	GLY	V	25
R	H	CD2	LEU	A	20	L	H	HA3	GLY	V	25
R	H	SD	MET	A	22	L	-	HG	SER	V	234
R	H	SD	MET	A	22	L	H	HD12	ILE	V	236
R	H	CE	MET	A	22	L	-	CB	SER	V	234
R	H	CE	MET	A	22	L	-	OG	SER	V	234
R	H	CE	MET	A	22	L	-	HA	SER	V	234
R	H	CE	MET	A	22	L	-	HB2	SER	V	234
R	H	CE	MET	A	22	L	-	HG	SER	V	234
R	H	N	SER	A	23	L	H	HG2	GLN	V	28
R	H	CA	SER	A	23	L	H	HG2	GLN	V	28
R	H	CA	SER	A	23	L	H	HE21	GLN	V	28
R	H	CB	SER	A	23	L	H	CB	GLN	V	28
R	H	CB	SER	A	23	L	H	CG	GLN	V	28
R	H	CB	SER	A	23	L	H	CD	GLN	V	28
R	H	CB	SER	A	23	L	H	NE2	GLN	V	28
R	H	CB	SER	A	23	L	H	OE1	GLN	V	28
R	H	CB	SER	A	23	L	H	HB2	GLN	V	28
R	H	CB	SER	A	23	L	H	HG2	GLN	V	28
R	H	CB	SER	A	23	L	H	HG3	GLN	V	28
R	H	CB	SER	A	23	L	H	HE21	GLN	V	28
R	H	CB	SER	A	23	L	H	HE22	GLN	V	28
R	H	OG	SER	A	23	L	H	CB	GLN	V	28
R	H	OG	SER	A	23	L	H	CG	GLN	V	28
R	H	OG	SER	A	23	L	H	CD	GLN	V	28
R	H	OG	SER	A	23	L	H	NE2	GLN	V	28
R	H	OG	SER	A	23	L	H	OE1	GLN	V	28
R	H	OG	SER	A	23	L	H	HB2	GLN	V	28
R	H	OG	SER	A	23	L	H	HB3	GLN	V	28
R	H	OG	SER	A	23	L	H	HG2	GLN	V	28
R	H	OG	SER	A	23	L	H	HG3	GLN	V	28
R	H	OG	SER	A	23	L	H	HE21	GLN	V	28
R	H	CG	LEU	A	24	L	H	HD13	LEU	V	24
R	H	CD1	LEU	A	24	L	H	CD1	LEU	V	24
R	H	CD1	LEU	A	24	L	H	HB3	LEU	V	24
R	H	CD1	LEU	A	24	L	H	HD11	LEU	V	24
R	H	CD1	LEU	A	24	L	H	HD12	LEU	V	24
R	H	CD1	LEU	A	24	L	H	HD13	LEU	V	24
R	H	CD2	LEU	A	24	L	H	HD13	LEU	V	24
R	H	CD2	LEU	A	24	L	H	HD22	LEU	V	24
R	H	CG	LEU	A	25	L	H	HD11	ILE	V	236
R	H	CD1	LEU	A	25	L	H	CD1	ILE	V	236
R	H	CD1	LEU	A	25	L	H	HD11	ILE	V	236
R	H	CD1	LEU	A	25	L	H	HD12	ILE	V	236
R	H	CD2	LEU	A	25	L	H	CD1	ILE	V	236
R	H	CD2	LEU	A	25	L	H	HG12	ILE	V	236
R	H	CD2	LEU	A	25	L	H	HD11	ILE	V	236
R	H	CD2	LEU	A	25	L	H	HD12	ILE	V	236
R	H	CG	LEU	A	26	L	H	HZ2	LYS	V	115
R	H	CD1	LEU	A	26	L	H	CE	LYS	V	115
R	H	CD1	LEU	A	26	L	H	NZ	LYS	V	115
R	H	CD1	LEU	A	26	L	H	HE3	LYS	V	115
R	H	CD1	LEU	A	26	L	H	HZ1	LYS	V	115
R	H	CD1	LEU	A	26	L	H	HZ2	LYS	V	115
R	H	CD1	LEU	A	26	L	H	HZ3	LYS	V	115
R	H	CD2	LEU	A	26	L	H	HZ2	LYS	V	115
R	H	CG1	VAL	A	29	L	H	OD2	ASP	V	235
R	H	CG	TYR	A	33	L	-	HZ1	LYS	V	123
R	H	CD1	TYR	A	33	L	-	HZ1	LYS	V	123
R	H	CD2	TYR	A	33	L	-	HE3	LYS	V	123
R	H	CD2	TYR	A	33	L	-	HZ1	LYS	V	123
R	H	CE1	TYR	A	33	L	-	CE	LYS	V	123
R	H	CE1	TYR	A	33	L	-	NZ	LYS	V	123
R	H	CE1	TYR	A	33	L	-	HE2	LYS	V	123
R	H	CE1	TYR	A	33	L	-	HE3	LYS	V	123
R	H	CE1	TYR	A	33	L	-	HZ1	LYS	V	123
R	H	CE1	TYR	A	33	L	-	HZ2	LYS	V	123
R	H	CE1	TYR	A	33	L	-	HZ3	LYS	V	123
R	H	CE2	TYR	A	33	L	-	CE	LYS	V	123
R	H	CE2	TYR	A	33	L	-	NZ	LYS	V	123
R	H	CE2	TYR	A	33	L	-	HE2	LYS	V	123
R	H	CE2	TYR	A	33	L	-	HE3	LYS	V	123
R	H	CE2	TYR	A	33	L	-	HZ1	LYS	V	123
R	H	CE2	TYR	A	33	L	-	HZ2	LYS	V	123
R	H	OH	TYR	A	33	L	H	OE1	GLN	V	114
R	H	OH	TYR	A	33	L	H	HB3	GLN	V	114
R	H	OH	TYR	A	33	L	-	CD	LYS	V	123
R	H	OH	TYR	A	33	L	-	CE	LYS	V	123
R	H	OH	TYR	A	33	L	-	NZ	LYS	V	123
R	H	OH	TYR	A	33	L	-	HG3	LYS	V	123
R	H	OH	TYR	A	33	L	-	HE2	LYS	V	123
R	H	OH	TYR	A	33	L	-	HE3	LYS	V	123
R	H	OH	TYR	A	33	L	-	HZ1	LYS	V	123
R	H	OH	TYR	A	33	L	-	HZ2	LYS	V	123
R	H	OH	TYR	A	33	L	-	HZ3	LYS	V	123
R	H	CZ	TYR	A	33	L	-	CE	LYS	V	123
R	H	CZ	TYR	A	33	L	-	NZ	LYS	V	123
R	H	CZ	TYR	A	33	L	-	HE2	LYS	V	123
R	H	CZ	TYR	A	33	L	-	HE3	LYS	V	123
R	H	CZ	TYR	A	33	L	-	HZ1	LYS	V	123
R	H	CZ	TYR	A	33	L	-	HZ2	LYS	V	123
R	H	CZ	TYR	A	33	L	-	HZ3	LYS	V	123
R	H	CA	ARG	A	37	L	-	HZ2	LYS	V	123
R	H	CB	ARG	A	37	L	-	NZ	LYS	V	123
R	H	CB	ARG	A	37	L	-	HZ1	LYS	V	123
R	H	CB	ARG	A	37	L	-	HZ2	LYS	V	123
R	H	CB	ARG	A	37	L	-	HZ3	LYS	V	123
R	H	CG	ARG	A	37	L	-	CD	LYS	V	123
R	H	CG	ARG	A	37	L	-	CE	LYS	V	123
R	H	CG	ARG	A	37	L	-	NZ	LYS	V	123
R	H	CG	ARG	A	37	L	-	HD2	LYS	V	123
R	H	CG	ARG	A	37	L	-	HD3	LYS	V	123
R	H	CG	ARG	A	37	L	-	HE2	LYS	V	123
R	H	CG	ARG	A	37	L	-	HE3	LYS	V	123
R	H	CG	ARG	A	37	L	-	HZ1	LYS	V	123
R	H	CG	ARG	A	37	L	-	HZ2	LYS	V	123
R	H	CG	ARG	A	37	L	-	HZ3	LYS	V	123
R	H	CD	ARG	A	37	L	-	CD	LYS	V	123
R	H	CD	ARG	A	37	L	-	CE	LYS	V	123
R	H	CD	ARG	A	37	L	-	NZ	LYS	V	123
R	H	CD	ARG	A	37	L	-	HD2	LYS	V	123
R	H	CD	ARG	A	37	L	-	HD3	LYS	V	123
R	H	CD	ARG	A	37	L	-	HE2	LYS	V	123
R	H	CD	ARG	A	37	L	-	HE3	LYS	V	123
R	H	CD	ARG	A	37	L	-	HZ1	LYS	V	123
R	H	CD	ARG	A	37	L	-	HZ2	LYS	V	123
R	H	CD	ARG	A	37	L	-	HZ3	LYS	V	123
R	H	NE	ARG	A	37	L	-	CD	LYS	V	123
R	H	NE	ARG	A	37	L	-	CE	LYS	V	123
R	H	NE	ARG	A	37	L	-	NZ	LYS	V	123
R	H	NE	ARG	A	37	L	-	HD2	LYS	V	123
R	H	NE	ARG	A	37	L	-	HD3	LYS	V	123
R	H	NE	ARG	A	37	L	-	HE2	LYS	V	123
R	H	NE	ARG	A	37	L	-	HE3	LYS	V	123
R	H	NE	ARG	A	37	L	-	HZ1	LYS	V	123
R	H	NE	ARG	A	37	L	-	HZ2	LYS	V	123
R	H	NE	ARG	A	37	L	-	HZ3	LYS	V	123
R	H	NH1	ARG	A	37	L	H	OE1	GLN	V	114
R	H	NH1	ARG	A	37	L	-	CE	LYS	V	123
R	H	NH1	ARG	A	37	L	-	NZ	LYS	V	123
R	H	NH1	ARG	A	37	L	-	HD3	LYS	V	123
R	H	NH1	ARG	A	37	L	-	HE2	LYS	V	123
R	H	NH1	ARG	A	37	L	-	HZ1	LYS	V	123
R	H	NH1	ARG	A	37	L	-	HZ2	LYS	V	123
R	H	NH1	ARG	A	37	L	-	HZ3	LYS	V	123
R	H	NH2	ARG	A	37	L	H	HE22	GLN	V	114
R	H	NH2	ARG	A	37	L	-	CD	LYS	V	123
R	H	NH2	ARG	A	37	L	-	CE	LYS	V	123
R	H	NH2	ARG	A	37	L	-	NZ	LYS	V	123
R	H	NH2	ARG	A	37	L	-	HD3	LYS	V	123
R	H	NH2	ARG	A	37	L	-	HE2	LYS	V	123
R	H	NH2	ARG	A	37	L	-	HZ3	LYS	V	123
R	H	NH2	ARG	A	37	L	-	O	ALA	V	127
R	H	NH2	ARG	A	37	L	-	HA	LEU	V	128
R	H	NH2	ARG	A	37	L	-	HD21	LEU	V	128
R	H	NH2	ARG	A	37	L	-	H	ASP	V	129
R	H	CZ	ARG	A	37	L	-	CD	LYS	V	123
R	H	CZ	ARG	A	37	L	-	CE	LYS	V	123
R	H	CZ	ARG	A	37	L	-	NZ	LYS	V	123
R	H	CZ	ARG	A	37	L	-	HD3	LYS	V	123
R	H	CZ	ARG	A	37	L	-	HE2	LYS	V	123
R	H	CZ	ARG	A	37	L	-	HZ1	LYS	V	123
R	H	CZ	ARG	A	37	L	-	HZ2	LYS	V	123
R	H	CZ	ARG	A	37	L	-	HZ3	LYS	V	123
R	H	C	ILE	A	40	L	H	HZ2	LYS	V	132
R	H	C	ILE	A	40	L	H	HZ3	LYS	V	132
R	H	CB	ILE	A	40	L	H	HZ2	LYS	V	132
R	H	O	ILE	A	40	L	H	NZ	LYS	V	132
R	H	O	ILE	A	40	L	H	HZ2	LYS	V	132
R	H	O	ILE	A	40	L	H	HZ3	LYS	V	132
R	H	CG1	ILE	A	40	L	H	HG22	ILE	V	304
R	H	CG1	ILE	A	40	L	H	HD13	ILE	V	304
R	H	CG2	ILE	A	40	L	H	NZ	LYS	V	132
R	H	CG2	ILE	A	40	L	H	HZ1	LYS	V	132
R	H	CG2	ILE	A	40	L	H	HZ2	LYS	V	132
R	H	CG2	ILE	A	40	L	H	HZ3	LYS	V	132
R	H	CG2	ILE	A	40	L	H	HG22	ILE	V	304
R	H	CD1	ILE	A	40	L	H	HG22	ILE	V	304
R	H	CD1	ILE	A	40	L	H	HD13	ILE	V	304
R	H	N	ARG	A	41	L	H	HZ2	LYS	V	132
R	H	N	ARG	A	41	L	H	HZ3	LYS	V	132
R	H	CA	ARG	A	41	L	H	HD2	LYS	V	132
R	H	CA	ARG	A	41	L	H	HZ2	LYS	V	132
R	H	CA	ARG	A	41	L	H	HZ3	LYS	V	132
R	H	CB	ARG	A	41	L	H	HD2	LYS	V	132
R	H	CG	ARG	A	41	L	H	CD	LYS	V	132
R	H	CG	ARG	A	41	L	H	HB2	LYS	V	132
R	H	CG	ARG	A	41	L	H	HD2	LYS	V	132
R	H	CG	ARG	A	41	L	H	HD3	LYS	V	132
R	H	CG	ARG	A	41	L	H	HZ2	LYS	V	132
R	H	CD	ARG	A	41	L	H	HB2	LYS	V	132
R	H	CD	ARG	A	41	L	H	HD2	LYS	V	132
R	H	CD	ARG	A	41	L	H	HD3	LYS	V	132
R	H	NE	ARG	A	41	L	H	HB2	LYS	V	132
R	H	NE	ARG	A	41	L	H	HB3	LYS	V	132
R	H	NE	ARG	A	41	L	H	HD3	LYS	V	132
R	H	NH2	ARG	A	41	L	-	O	ASP	V	129
R	H	NH2	ARG	A	41	L	-	H	ASP	V	129
R	H	NH2	ARG	A	41	L	-	HB2	ASP	V	129
R	-	O	LEU	A	43	L	-	HB3	SER	V	302
R	-	CA	HIS	A	44	L	-	HB3	SER	V	302
R	-	C	HIS	A	44	L	-	OG	SER	V	299
R	-	C	HIS	A	44	L	-	HG	SER	V	299
R	-	C	HIS	A	44	L	-	O	SER	V	300
R	-	C	HIS	A	44	L	-	HB3	SER	V	302
R	-	CB	HIS	A	44	L	H	HZ3	LYS	V	132
R	-	O	HIS	A	44	L	-	OG	SER	V	299
R	-	O	HIS	A	44	L	-	HG	SER	V	299
R	-	O	HIS	A	44	L	-	O	SER	V	300
R	-	O	HIS	A	44	L	-	N	SER	V	302
R	-	O	HIS	A	44	L	-	H	SER	V	302
R	-	O	HIS	A	44	L	-	HB3	SER	V	302
R	-	CG	HIS	A	44	L	H	HE22	GLN	V	135
R	-	CG	HIS	A	44	L	-	HG	SER	V	299
R	-	CD2	HIS	A	44	L	H	NE2	GLN	V	135
R	-	CD2	HIS	A	44	L	H	HE22	GLN	V	135
R	-	CD2	HIS	A	44	L	-	OG	SER	V	299
R	-	CD2	HIS	A	44	L	-	HG	SER	V	299
R	-	CE1	HIS	A	44	L	H	HE22	GLN	V	135
R	-	CE1	HIS	A	44	L	-	HG	SER	V	299
R	-	NE2	HIS	A	44	L	H	NE2	GLN	V	135
R	-	NE2	HIS	A	44	L	H	HE22	GLN	V	135
R	-	NE2	HIS	A	44	L	-	OG	SER	V	299
R	-	NE2	HIS	A	44	L	-	HG	SER	V	299
R	-	N	LEU	A	45	L	-	OG	SER	V	299
R	-	N	LEU	A	45	L	-	HG	SER	V	299
R	-	CA	LEU	A	45	L	-	OG	SER	V	299
R	-	CA	LEU	A	45	L	-	HG	SER	V	299
R	-	CB	LEU	A	45	L	-	OG	SER	V	299
R	-	CB	LEU	A	45	L	-	HB2	SER	V	299
R	-	CB	LEU	A	45	L	-	HG	SER	V	299
R	-	CG	LEU	A	45	L	-	CB	SER	V	299
R	-	CG	LEU	A	45	L	-	OG	SER	V	299
R	-	CG	LEU	A	45	L	-	HB2	SER	V	299
R	-	CG	LEU	A	45	L	-	HG	SER	V	299
R	-	CD1	LEU	A	45	L	-	HB2	SER	V	299
R	-	CD2	LEU	A	45	L	-	OG	SER	V	297
R	-	CD2	LEU	A	45	L	-	CA	SER	V	299
R	-	CD2	LEU	A	45	L	-	CB	SER	V	299
R	-	CD2	LEU	A	45	L	-	OG	SER	V	299
R	-	CD2	LEU	A	45	L	-	HA	SER	V	299
R	-	CD2	LEU	A	45	L	-	HB2	SER	V	299
R	-	CD2	LEU	A	45	L	-	HB3	SER	V	299
R	-	CD2	LEU	A	45	L	-	HG	SER	V	299
R	-	O	PHE	A	46	L	-	HA	SER	V	302
R	-	O	PHE	A	46	L	-	HB2	SER	V	302
R	-	O	PHE	A	46	L	-	HB3	SER	V	302
R	-	N	PRO	A	47	L	-	HA	SER	V	302
R	-	CA	PRO	A	47	L	-	HA	SER	V	302
R	-	CA	PRO	A	47	L	H	H	ASP	V	303
R	-	C	PRO	A	47	L	H	H	ASP	V	303
R	-	CB	PRO	A	47	L	-	HA	SER	V	302
R	-	CG	PRO	A	47	L	-	OG	SER	V	300
R	-	CG	PRO	A	47	L	-	HG	SER	V	300
R	-	N	ALA	A	48	L	-	HB2	SER	V	302
R	-	N	ALA	A	48	L	H	N	ASP	V	303
R	-	N	ALA	A	48	L	H	CG	ASP	V	303
R	-	N	ALA	A	48	L	H	OD2	ASP	V	303
R	-	N	ALA	A	48	L	H	H	ASP	V	303
R	-	N	ALA	A	48	L	H	HB2	ASP	V	303
R	-	CA	ALA	A	48	L	H	CG	ASP	V	303
R	-	CA	ALA	A	48	L	H	OD2	ASP	V	303
R	-	CA	ALA	A	48	L	H	H	ASP	V	303
R	-	CA	ALA	A	48	L	H	HB2	ASP	V	303
R	-	C	ALA	A	48	L	H	CB	ASP	V	303
R	-	C	ALA	A	48	L	H	CG	ASP	V	303
R	-	C	ALA	A	48	L	H	OD2	ASP	V	303
R	-	C	ALA	A	48	L	H	H	ASP	V	303
R	-	C	ALA	A	48	L	H	HB2	ASP	V	303
R	-	C	ALA	A	48	L	H	HB3	ASP	V	303
R	-	CB	ALA	A	48	L	H	HB2	ASP	V	303
R	-	O	ALA	A	48	L	H	N	ASP	V	303
R	-	O	ALA	A	48	L	H	CA	ASP	V	303
R	-	O	ALA	A	48	L	H	CB	ASP	V	303
R	-	O	ALA	A	48	L	H	CG	ASP	V	303
R	-	O	ALA	A	48	L	H	OD1	ASP	V	303
R	-	O	ALA	A	48	L	H	OD2	ASP	V	303
R	-	O	ALA	A	48	L	H	H	ASP	V	303
R	-	O	ALA	A	48	L	H	HA	ASP	V	303
R	-	O	ALA	A	48	L	H	HB2	ASP	V	303
R	-	O	ALA	A	48	L	H	HB3	ASP	V	303
R	-	N	PRO	A	49	L	H	CG	ASP	V	303
R	-	N	PRO	A	49	L	H	OD2	ASP	V	303
R	-	N	PRO	A	49	L	H	HB2	ASP	V	303
R	-	CA	PRO	A	49	L	H	CG	ASP	V	303
R	-	CA	PRO	A	49	L	H	OD2	ASP	V	303
R	-	CA	PRO	A	49	L	H	HB2	ASP	V	303
R	-	CA	PRO	A	49	L	H	HB3	ASP	V	303
R	-	C	PRO	A	49	L	H	CB	ASP	V	303
R	-	C	PRO	A	49	L	H	CG	ASP	V	303
R	-	C	PRO	A	49	L	H	OD2	ASP	V	303
R	-	C	PRO	A	49	L	H	HB2	ASP	V	303
R	-	C	PRO	A	49	L	H	HB3	ASP	V	303
R	-	O	PRO	A	49	L	H	CB	ASP	V	303
R	-	O	PRO	A	49	L	H	OD2	ASP	V	303
R	-	O	PRO	A	49	L	H	HB2	ASP	V	303
R	-	O	PRO	A	49	L	H	HB3	ASP	V	303
R	-	O	PRO	A	49	L	H	HG13	ILE	V	304
R	-	CD	PRO	A	49	L	H	OD2	ASP	V	303
R	-	N	PRO	A	50	L	H	CB	ASP	V	303
R	-	N	PRO	A	50	L	H	HB2	ASP	V	303
R	-	N	PRO	A	50	L	H	HB3	ASP	V	303
R	-	CA	PRO	A	50	L	H	HB3	ASP	V	303
R	-	CB	PRO	A	50	L	H	OD1	ASP	V	259
R	-	CB	PRO	A	50	L	H	HB3	ASP	V	303
R	-	CG	PRO	A	50	L	H	HE21	GLN	V	263
R	-	CG	PRO	A	50	L	H	HB3	ASP	V	303
R	-	CD	PRO	A	50	L	H	HE21	GLN	V	263
R	-	CD	PRO	A	50	L	H	HB3	ASP	V	303
R	-	N	ALA	A	51	L	H	HG12	ILE	V	304
R	-	CB	ALA	A	51	L	H	HG12	ILE	V	304
R	-	CB	ALA	A	51	L	H	HD11	ILE	V	304
R	-	NE2	HIS	A	52	L	H	HG2	ARG	V	252
R	-	NE2	HIS	A	52	L	H	HE	ARG	V	252
R	-	CB	TRP	A	53	L	-	HG2	PRO	V	119
R	-	CD1	TRP	A	53	L	H	ND2	ASN	V	255
R	-	CD1	TRP	A	53	L	H	HD21	ASN	V	255
R	-	CD1	TRP	A	53	L	H	HD22	ASN	V	255
R	-	CH2	TRP	A	53	L	H	HG2	GLN	V	248
R	-	CZ2	TRP	A	53	L	H	HG2	GLN	V	248
R	H	CE	LYS	A	75	L	H	HD3	LYS	V	266
R	H	CE	LYS	A	75	L	H	HZ2	LYS	V	266
R	H	NZ	LYS	A	75	L	H	HE22	GLN	V	263
R	H	NZ	LYS	A	75	L	H	CD	LYS	V	266
R	H	NZ	LYS	A	75	L	H	NZ	LYS	V	266
R	H	NZ	LYS	A	75	L	H	HD2	LYS	V	266
R	H	NZ	LYS	A	75	L	H	HD3	LYS	V	266
R	H	NZ	LYS	A	75	L	H	HZ2	LYS	V	266
R	-	CE1	TYR	A	76	L	H	OD2	ASP	V	303
R	-	OH	TYR	A	76	L	H	HZ2	LYS	V	266
R	-	OH	TYR	A	76	L	H	CG	ASP	V	303
R	-	OH	TYR	A	76	L	H	OD1	ASP	V	303
R	-	OH	TYR	A	76	L	H	OD2	ASP	V	303
R	-	CZ	TYR	A	76	L	H	OD2	ASP	V	303
R	S	CD1	TRP	A	83	L	H	HD11	ILE	V	304
R	S	CE2	TRP	A	83	L	H	HD11	ILE	V	304
R	S	NE1	TRP	A	83	L	H	CD1	ILE	V	304
R	S	NE1	TRP	A	83	L	H	HD11	ILE	V	304
R	S	NE1	TRP	A	83	L	H	HD12	ILE	V	304
R	S	NE1	TRP	A	83	L	H	HD13	ILE	V	304

- 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