IID

Q96A28_Q3KPI0.1 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	-	ARG	A	10	L	H	VAL	V	248
R	-	GLU	A	11	L	H	PHE	V	244
R	-	CYS	A	12	L	H	PHE	V	244
R	-	ILE	A	13	L	H	PHE	V	244
R	-	TRP	A	15	L	H	LEU	V	236
R	-	TRP	A	15	L	H	LEU	V	237
R	-	TRP	A	15	L	H	GLY	V	240
R	-	TRP	A	15	L	H	LEU	V	241
R	-	GLN	A	16	L	H	LEU	V	237
R	-	GLY	A	17	L	H	LEU	V	237
R	-	LEU	A	18	L	H	PHE	V	234
R	-	LEU	A	18	L	H	LEU	V	237
R	-	ASN	A	180	L	-	MET	V	1
R	-	ASN	A	180	L	-	CYS	V	2
R	-	ASN	A	180	L	-	PHE	V	4
R	-	ASN	A	181	L	-	PHE	V	4
R	-	ASN	A	181	L	H	LEU	V	8
R	-	LEU	A	19	L	H	PHE	V	234
R	-	LEU	A	20	L	H	PHE	V	234
R	-	ALA	A	209	L	-	MET	V	1
R	S	GLY	A	210	L	-	CYS	V	2
R	S	GLU	A	211	L	-	CYS	V	2
R	S	GLU	A	211	L	H	PRO	V	5
R	-	ALA	A	22	L	-	GLU	V	228
R	-	LEU	A	24	L	-	TYR	V	225
R	-	LEU	A	24	L	-	GLU	V	228
R	-	THR	A	32	L	-	GLY	V	192
R	-	THR	A	32	L	-	ASP	V	193
R	-	THR	A	32	L	-	SER	V	194
R	-	THR	A	32	L	-	ALA	V	195
R	-	THR	A	33	L	-	GLY	V	192
R	-	THR	A	33	L	-	ASP	V	193
R	-	THR	A	33	L	-	SER	V	194
R	-	ALA	A	34	L	-	SER	V	194
R	-	TRP	A	35	L	-	GLY	V	192
R	-	TRP	A	35	L	-	ASP	V	193
R	S	PHE	A	37	L	S	THR	V	187
R	S	PHE	A	37	L	S	SER	V	188
R	S	PHE	A	37	L	-	LEU	V	196
R	S	ALA	A	39	L	S	HIS	V	180
R	S	SER	A	40	L	S	LEU	V	185
R	S	SER	A	40	L	S	SER	V	186
R	S	ALA	A	41	L	S	HIS	V	180
R	S	ALA	A	41	L	S	GLU	V	181
R	-	PHE	A	43	L	S	SER	V	151
R	-	PHE	A	43	L	S	SER	V	153
R	-	PHE	A	43	L	S	VAL	V	184
R	-	PHE	A	43	L	S	LEU	V	185
R	-	PHE	A	43	L	S	SER	V	186
R	-	PHE	A	43	L	S	THR	V	187
R	-	GLU	A	44	L	S	GLU	V	143
R	-	GLU	A	44	L	S	SER	V	186
R	S	HIS	A	52	L	S	PHE	V	179
R	S	SER	A	54	L	S	THR	V	178
R	S	SER	A	54	L	S	PHE	V	179
R	S	SER	A	54	L	S	HIS	V	180
R	S	VAL	A	56	L	S	THR	V	178
R	S	VAL	A	56	L	-	LEU	V	196
R	-	TYR	A	57	L	-	GLY	V	173
R	-	TYR	A	57	L	-	ASP	V	174
R	-	TYR	A	57	L	-	SER	V	175
R	-	TYR	A	57	L	-	THR	V	176
R	-	TYR	A	57	L	-	SER	V	194
R	-	TYR	A	57	L	-	LEU	V	196
R	-	PRO	A	8	L	H	MET	V	252
R	-	PRO	A	8	L	H	TRP	V	255
R	-	HIS	A	9	L	H	TRP	V	255

- 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

Q96A28_Q3KPI0.1 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	-	CA	PRO	A	8	L	H	HE1	MET	V	252
R	-	C	PRO	A	8	L	H	HE1	MET	V	252
R	-	C	PRO	A	8	L	H	HZ3	TRP	V	255
R	-	O	PRO	A	8	L	H	CH2	TRP	V	255
R	-	O	PRO	A	8	L	H	CZ3	TRP	V	255
R	-	O	PRO	A	8	L	H	HH2	TRP	V	255
R	-	O	PRO	A	8	L	H	HZ3	TRP	V	255
R	-	N	HIS	A	9	L	H	HZ3	TRP	V	255
R	-	CA	HIS	A	9	L	H	HZ3	TRP	V	255
R	-	C	HIS	A	9	L	H	HZ3	TRP	V	255
R	-	O	HIS	A	9	L	H	CE3	TRP	V	255
R	-	O	HIS	A	9	L	H	CH2	TRP	V	255
R	-	O	HIS	A	9	L	H	CZ3	TRP	V	255
R	-	O	HIS	A	9	L	H	HH2	TRP	V	255
R	-	O	HIS	A	9	L	H	HZ3	TRP	V	255
R	-	O	ARG	A	10	L	H	HG22	VAL	V	248
R	-	C	GLU	A	11	L	H	HZ	PHE	V	244
R	-	O	GLU	A	11	L	H	CZ	PHE	V	244
R	-	O	GLU	A	11	L	H	HZ	PHE	V	244
R	-	CA	CYS	A	12	L	H	HZ	PHE	V	244
R	-	C	CYS	A	12	L	H	HZ	PHE	V	244
R	-	N	ILE	A	13	L	H	CE2	PHE	V	244
R	-	N	ILE	A	13	L	H	CZ	PHE	V	244
R	-	N	ILE	A	13	L	H	HE2	PHE	V	244
R	-	N	ILE	A	13	L	H	HZ	PHE	V	244
R	-	CB	ILE	A	13	L	H	CE2	PHE	V	244
R	-	CB	ILE	A	13	L	H	HE2	PHE	V	244
R	-	CG1	ILE	A	13	L	H	HE2	PHE	V	244
R	-	CD1	ILE	A	13	L	H	HE2	PHE	V	244
R	-	CB	TRP	A	15	L	H	HD11	LEU	V	241
R	-	CD2	TRP	A	15	L	H	HD21	LEU	V	237
R	-	CD2	TRP	A	15	L	H	HA3	GLY	V	240
R	-	CE3	TRP	A	15	L	H	CA	LEU	V	237
R	-	CE3	TRP	A	15	L	H	CD2	LEU	V	237
R	-	CE3	TRP	A	15	L	H	HA	LEU	V	237
R	-	CE3	TRP	A	15	L	H	HD21	LEU	V	237
R	-	CE3	TRP	A	15	L	H	HD22	LEU	V	237
R	-	CE3	TRP	A	15	L	H	HD23	LEU	V	237
R	-	CE3	TRP	A	15	L	H	HA3	GLY	V	240
R	-	CH2	TRP	A	15	L	H	HD21	LEU	V	237
R	-	CH2	TRP	A	15	L	H	HA3	GLY	V	240
R	-	CZ2	TRP	A	15	L	H	HA3	GLY	V	240
R	-	CZ3	TRP	A	15	L	H	O	LEU	V	236
R	-	CZ3	TRP	A	15	L	H	CA	LEU	V	237
R	-	CZ3	TRP	A	15	L	H	CD2	LEU	V	237
R	-	CZ3	TRP	A	15	L	H	HA	LEU	V	237
R	-	CZ3	TRP	A	15	L	H	HD21	LEU	V	237
R	-	CZ3	TRP	A	15	L	H	HA3	GLY	V	240
R	-	C	GLN	A	16	L	H	HD12	LEU	V	237
R	-	C	GLN	A	16	L	H	HD23	LEU	V	237
R	-	O	GLN	A	16	L	H	CD1	LEU	V	237
R	-	O	GLN	A	16	L	H	HD12	LEU	V	237
R	-	O	GLN	A	16	L	H	HD13	LEU	V	237
R	-	O	GLN	A	16	L	H	HD22	LEU	V	237
R	-	O	GLN	A	16	L	H	HD23	LEU	V	237
R	-	N	GLY	A	17	L	H	HD12	LEU	V	237
R	-	N	GLY	A	17	L	H	HD23	LEU	V	237
R	-	CA	GLY	A	17	L	H	CD1	LEU	V	237
R	-	CA	GLY	A	17	L	H	HB3	LEU	V	237
R	-	CA	GLY	A	17	L	H	HD12	LEU	V	237
R	-	CA	GLY	A	17	L	H	HD23	LEU	V	237
R	-	C	GLY	A	17	L	H	HD12	LEU	V	237
R	-	N	LEU	A	18	L	H	CD1	LEU	V	237
R	-	N	LEU	A	18	L	H	HD11	LEU	V	237
R	-	N	LEU	A	18	L	H	HD12	LEU	V	237
R	-	N	LEU	A	18	L	H	HD13	LEU	V	237
R	-	C	LEU	A	18	L	H	HD2	PHE	V	234
R	-	C	LEU	A	18	L	H	HE2	PHE	V	234
R	-	O	LEU	A	18	L	H	CD2	PHE	V	234
R	-	O	LEU	A	18	L	H	CE2	PHE	V	234
R	-	O	LEU	A	18	L	H	HD2	PHE	V	234
R	-	O	LEU	A	18	L	H	HE2	PHE	V	234
R	-	N	LEU	A	19	L	H	HE2	PHE	V	234
R	-	CA	LEU	A	19	L	H	CE2	PHE	V	234
R	-	CA	LEU	A	19	L	H	HE2	PHE	V	234
R	-	CB	LEU	A	19	L	H	HE2	PHE	V	234
R	-	CG	LEU	A	19	L	H	HE2	PHE	V	234
R	-	CD2	LEU	A	19	L	H	CE2	PHE	V	234
R	-	CD2	LEU	A	19	L	H	CZ	PHE	V	234
R	-	CD2	LEU	A	19	L	H	HE2	PHE	V	234
R	-	CD2	LEU	A	19	L	H	HZ	PHE	V	234
R	-	N	LEU	A	20	L	H	HE2	PHE	V	234
R	-	CB	ALA	A	22	L	-	OE2	GLU	V	228
R	-	CD2	LEU	A	24	L	-	HH	TYR	V	225
R	-	CD2	LEU	A	24	L	-	OE2	GLU	V	228
R	-	CA	THR	A	32	L	-	HA	SER	V	194
R	-	C	THR	A	32	L	-	HA	SER	V	194
R	-	C	THR	A	32	L	-	HB3	SER	V	194
R	-	CB	THR	A	32	L	-	C	ASP	V	193
R	-	CB	THR	A	32	L	-	O	ASP	V	193
R	-	CB	THR	A	32	L	-	N	SER	V	194
R	-	CB	THR	A	32	L	-	CA	SER	V	194
R	-	CB	THR	A	32	L	-	HA	SER	V	194
R	-	CB	THR	A	32	L	-	HB3	SER	V	194
R	-	CB	THR	A	32	L	-	N	ALA	V	195
R	-	CB	THR	A	32	L	-	H	ALA	V	195
R	-	O	THR	A	32	L	-	HA	SER	V	194
R	-	O	THR	A	32	L	-	HB3	SER	V	194
R	-	CG2	THR	A	32	L	-	C	GLY	V	192
R	-	CG2	THR	A	32	L	-	O	GLY	V	192
R	-	CG2	THR	A	32	L	-	N	ASP	V	193
R	-	CG2	THR	A	32	L	-	CA	ASP	V	193
R	-	CG2	THR	A	32	L	-	C	ASP	V	193
R	-	CG2	THR	A	32	L	-	O	ASP	V	193
R	-	CG2	THR	A	32	L	-	HA	ASP	V	193
R	-	CG2	THR	A	32	L	-	N	SER	V	194
R	-	CG2	THR	A	32	L	-	CA	SER	V	194
R	-	CG2	THR	A	32	L	-	C	SER	V	194
R	-	CG2	THR	A	32	L	-	CB	SER	V	194
R	-	CG2	THR	A	32	L	-	H	SER	V	194
R	-	CG2	THR	A	32	L	-	HA	SER	V	194
R	-	CG2	THR	A	32	L	-	HB3	SER	V	194
R	-	CG2	THR	A	32	L	-	N	ALA	V	195
R	-	CG2	THR	A	32	L	-	H	ALA	V	195
R	-	OG1	THR	A	32	L	-	O	ASP	V	193
R	-	OG1	THR	A	32	L	-	CA	SER	V	194
R	-	OG1	THR	A	32	L	-	HA	SER	V	194
R	-	OG1	THR	A	32	L	-	N	ALA	V	195
R	-	OG1	THR	A	32	L	-	H	ALA	V	195
R	-	N	THR	A	33	L	-	O	GLY	V	192
R	-	C	THR	A	33	L	-	HB3	SER	V	194
R	-	O	THR	A	33	L	-	O	GLY	V	192
R	-	O	THR	A	33	L	-	HA	ASP	V	193
R	-	O	THR	A	33	L	-	N	SER	V	194
R	-	O	THR	A	33	L	-	H	SER	V	194
R	-	O	THR	A	33	L	-	HB3	SER	V	194
R	-	N	ALA	A	34	L	-	HB3	SER	V	194
R	-	CA	ALA	A	34	L	-	H	SER	V	194
R	-	CA	ALA	A	34	L	-	HB3	SER	V	194
R	-	CB	ALA	A	34	L	-	HB3	SER	V	194
R	-	CB	ALA	A	34	L	-	HG	SER	V	194
R	-	CG	TRP	A	35	L	-	OD1	ASP	V	193
R	-	CD1	TRP	A	35	L	-	C	GLY	V	192
R	-	CD1	TRP	A	35	L	-	O	GLY	V	192
R	-	CD1	TRP	A	35	L	-	OD1	ASP	V	193
R	-	CD1	TRP	A	35	L	-	HA	ASP	V	193
R	-	NE1	TRP	A	35	L	-	C	GLY	V	192
R	-	NE1	TRP	A	35	L	-	O	GLY	V	192
R	-	NE1	TRP	A	35	L	-	HA3	GLY	V	192
R	-	NE1	TRP	A	35	L	-	HA	ASP	V	193
R	S	CD1	PHE	A	37	L	-	HD13	LEU	V	196
R	S	CE1	PHE	A	37	L	S	OG1	THR	V	187
R	S	CE1	PHE	A	37	L	-	HD11	LEU	V	196
R	S	CE1	PHE	A	37	L	-	HD12	LEU	V	196
R	S	CE1	PHE	A	37	L	-	HD13	LEU	V	196
R	S	CE2	PHE	A	37	L	S	H	SER	V	188
R	S	CZ	PHE	A	37	L	S	OG1	THR	V	187
R	S	CZ	PHE	A	37	L	S	HA	THR	V	187
R	S	CZ	PHE	A	37	L	S	HG1	THR	V	187
R	S	CZ	PHE	A	37	L	S	H	SER	V	188
R	S	CB	ALA	A	39	L	S	CE1	HIS	V	180
R	S	CB	ALA	A	39	L	S	HE1	HIS	V	180
R	S	O	ALA	A	39	L	S	HE1	HIS	V	180
R	S	O	SER	A	40	L	S	HD11	LEU	V	185
R	S	O	SER	A	40	L	S	O	SER	V	186
R	S	O	SER	A	40	L	S	H	SER	V	186
R	S	O	SER	A	40	L	S	HB2	SER	V	186
R	S	OG	SER	A	40	L	S	HB2	SER	V	186
R	S	CA	ALA	A	41	L	S	HB3	HIS	V	180
R	S	CB	ALA	A	41	L	S	CB	HIS	V	180
R	S	CB	ALA	A	41	L	S	ND1	HIS	V	180
R	S	CB	ALA	A	41	L	S	HA	HIS	V	180
R	S	CB	ALA	A	41	L	S	HB3	HIS	V	180
R	S	CB	ALA	A	41	L	S	O	GLU	V	181
R	S	CB	ALA	A	41	L	S	H	GLU	V	181
R	-	N	PHE	A	43	L	S	OG	SER	V	186
R	-	N	PHE	A	43	L	S	H	SER	V	186
R	-	N	PHE	A	43	L	S	HB2	SER	V	186
R	-	N	PHE	A	43	L	S	HG	SER	V	186
R	-	CA	PHE	A	43	L	S	N	SER	V	186
R	-	CA	PHE	A	43	L	S	CB	SER	V	186
R	-	CA	PHE	A	43	L	S	OG	SER	V	186
R	-	CA	PHE	A	43	L	S	H	SER	V	186
R	-	CA	PHE	A	43	L	S	HB2	SER	V	186
R	-	CA	PHE	A	43	L	S	HB3	SER	V	186
R	-	CA	PHE	A	43	L	S	HG	SER	V	186
R	-	C	PHE	A	43	L	S	CB	SER	V	186
R	-	C	PHE	A	43	L	S	OG	SER	V	186
R	-	C	PHE	A	43	L	S	HB2	SER	V	186
R	-	C	PHE	A	43	L	S	HG	SER	V	186
R	-	CB	PHE	A	43	L	S	HG11	VAL	V	184
R	-	CB	PHE	A	43	L	S	C	LEU	V	185
R	-	CB	PHE	A	43	L	S	N	SER	V	186
R	-	CB	PHE	A	43	L	S	CA	SER	V	186
R	-	CB	PHE	A	43	L	S	C	SER	V	186
R	-	CB	PHE	A	43	L	S	CB	SER	V	186
R	-	CB	PHE	A	43	L	S	OG	SER	V	186
R	-	CB	PHE	A	43	L	S	H	SER	V	186
R	-	CB	PHE	A	43	L	S	HA	SER	V	186
R	-	CB	PHE	A	43	L	S	HB2	SER	V	186
R	-	CB	PHE	A	43	L	S	HB3	SER	V	186
R	-	CB	PHE	A	43	L	S	HG	SER	V	186
R	-	O	PHE	A	43	L	S	OG	SER	V	186
R	-	O	PHE	A	43	L	S	HB2	SER	V	186
R	-	O	PHE	A	43	L	S	HG	SER	V	186
R	-	CG	PHE	A	43	L	S	N	SER	V	186
R	-	CG	PHE	A	43	L	S	CA	SER	V	186
R	-	CG	PHE	A	43	L	S	C	SER	V	186
R	-	CG	PHE	A	43	L	S	CB	SER	V	186
R	-	CG	PHE	A	43	L	S	OG	SER	V	186
R	-	CG	PHE	A	43	L	S	H	SER	V	186
R	-	CG	PHE	A	43	L	S	HA	SER	V	186
R	-	CG	PHE	A	43	L	S	HB2	SER	V	186
R	-	CG	PHE	A	43	L	S	HB3	SER	V	186
R	-	CG	PHE	A	43	L	S	HG	SER	V	186
R	-	CD1	PHE	A	43	L	S	HB3	SER	V	153
R	-	CD1	PHE	A	43	L	S	CA	SER	V	186
R	-	CD1	PHE	A	43	L	S	CB	SER	V	186
R	-	CD1	PHE	A	43	L	S	OG	SER	V	186
R	-	CD1	PHE	A	43	L	S	HA	SER	V	186
R	-	CD1	PHE	A	43	L	S	HB2	SER	V	186
R	-	CD1	PHE	A	43	L	S	HB3	SER	V	186
R	-	CD1	PHE	A	43	L	S	HG	SER	V	186
R	-	CD2	PHE	A	43	L	S	N	SER	V	186
R	-	CD2	PHE	A	43	L	S	CA	SER	V	186
R	-	CD2	PHE	A	43	L	S	C	SER	V	186
R	-	CD2	PHE	A	43	L	S	CB	SER	V	186
R	-	CD2	PHE	A	43	L	S	O	SER	V	186
R	-	CD2	PHE	A	43	L	S	OG	SER	V	186
R	-	CD2	PHE	A	43	L	S	H	SER	V	186
R	-	CD2	PHE	A	43	L	S	HA	SER	V	186
R	-	CD2	PHE	A	43	L	S	HB2	SER	V	186
R	-	CD2	PHE	A	43	L	S	HB3	SER	V	186
R	-	CD2	PHE	A	43	L	S	HG	SER	V	186
R	-	CD2	PHE	A	43	L	S	N	THR	V	187
R	-	CD2	PHE	A	43	L	S	H	THR	V	187
R	-	CE1	PHE	A	43	L	S	HB3	SER	V	153
R	-	CE1	PHE	A	43	L	S	CB	SER	V	186
R	-	CE1	PHE	A	43	L	S	OG	SER	V	186
R	-	CE1	PHE	A	43	L	S	HA	SER	V	186
R	-	CE1	PHE	A	43	L	S	HB2	SER	V	186
R	-	CE1	PHE	A	43	L	S	HB3	SER	V	186
R	-	CE1	PHE	A	43	L	S	HG	SER	V	186
R	-	CE2	PHE	A	43	L	S	CA	SER	V	186
R	-	CE2	PHE	A	43	L	S	C	SER	V	186
R	-	CE2	PHE	A	43	L	S	CB	SER	V	186
R	-	CE2	PHE	A	43	L	S	O	SER	V	186
R	-	CE2	PHE	A	43	L	S	OG	SER	V	186
R	-	CE2	PHE	A	43	L	S	HA	SER	V	186
R	-	CE2	PHE	A	43	L	S	HB2	SER	V	186
R	-	CE2	PHE	A	43	L	S	HB3	SER	V	186
R	-	CE2	PHE	A	43	L	S	HG	SER	V	186
R	-	CE2	PHE	A	43	L	S	N	THR	V	187
R	-	CE2	PHE	A	43	L	S	H	THR	V	187
R	-	CZ	PHE	A	43	L	S	HB3	SER	V	151
R	-	CZ	PHE	A	43	L	S	CB	SER	V	186
R	-	CZ	PHE	A	43	L	S	OG	SER	V	186
R	-	CZ	PHE	A	43	L	S	HA	SER	V	186
R	-	CZ	PHE	A	43	L	S	HB2	SER	V	186
R	-	CZ	PHE	A	43	L	S	HB3	SER	V	186
R	-	CZ	PHE	A	43	L	S	HG	SER	V	186
R	-	N	GLU	A	44	L	S	OG	SER	V	186
R	-	N	GLU	A	44	L	S	HG	SER	V	186
R	-	CG	GLU	A	44	L	S	HG	SER	V	186
R	-	OE1	GLU	A	44	L	S	OE2	GLU	V	143
R	S	NE2	HIS	A	52	L	S	O	PHE	V	179
R	S	CA	SER	A	54	L	S	HG21	THR	V	178
R	S	CA	SER	A	54	L	S	HE1	HIS	V	180
R	S	C	SER	A	54	L	S	HG21	THR	V	178
R	S	CB	SER	A	54	L	S	CG2	THR	V	178
R	S	CB	SER	A	54	L	S	HG21	THR	V	178
R	S	CB	SER	A	54	L	S	HG22	THR	V	178
R	S	CB	SER	A	54	L	S	HG23	THR	V	178
R	S	CB	SER	A	54	L	S	ND1	HIS	V	180
R	S	CB	SER	A	54	L	S	CE1	HIS	V	180
R	S	CB	SER	A	54	L	S	HE1	HIS	V	180
R	S	OG	SER	A	54	L	S	CG2	THR	V	178
R	S	OG	SER	A	54	L	S	HG21	THR	V	178
R	S	OG	SER	A	54	L	S	HG22	THR	V	178
R	S	OG	SER	A	54	L	S	HG23	THR	V	178
R	S	OG	SER	A	54	L	S	O	PHE	V	179
R	S	OG	SER	A	54	L	S	ND1	HIS	V	180
R	S	OG	SER	A	54	L	S	CE1	HIS	V	180
R	S	OG	SER	A	54	L	S	HE1	HIS	V	180
R	S	CG1	VAL	A	56	L	S	HG1	THR	V	178
R	S	CG1	VAL	A	56	L	-	HD13	LEU	V	196
R	S	CG1	VAL	A	56	L	-	HD23	LEU	V	196
R	S	CG2	VAL	A	56	L	S	OG1	THR	V	178
R	S	CG2	VAL	A	56	L	S	HG21	THR	V	178
R	-	N	TYR	A	57	L	-	HG21	THR	V	176
R	-	CA	TYR	A	57	L	-	HG21	THR	V	176
R	-	C	TYR	A	57	L	-	HG21	THR	V	176
R	-	CB	TYR	A	57	L	-	HG21	THR	V	176
R	-	CG	TYR	A	57	L	-	OG1	THR	V	176
R	-	CG	TYR	A	57	L	-	HG21	THR	V	176
R	-	CG	TYR	A	57	L	-	HG	SER	V	194
R	-	CD1	TYR	A	57	L	-	CB	THR	V	176
R	-	CD1	TYR	A	57	L	-	CG2	THR	V	176
R	-	CD1	TYR	A	57	L	-	OG1	THR	V	176
R	-	CD1	TYR	A	57	L	-	HG1	THR	V	176
R	-	CD1	TYR	A	57	L	-	HG21	THR	V	176
R	-	CD1	TYR	A	57	L	-	HG23	THR	V	176
R	-	CD1	TYR	A	57	L	-	HG	SER	V	194
R	-	CD2	TYR	A	57	L	-	OG	SER	V	194
R	-	CD2	TYR	A	57	L	-	HG	SER	V	194
R	-	CD2	TYR	A	57	L	-	HD23	LEU	V	196
R	-	CE1	TYR	A	57	L	-	CA	GLY	V	173
R	-	CE1	TYR	A	57	L	-	HA3	GLY	V	173
R	-	CE1	TYR	A	57	L	-	H	ASP	V	174
R	-	CE1	TYR	A	57	L	-	H	SER	V	175
R	-	CE1	TYR	A	57	L	-	OG1	THR	V	176
R	-	CE1	TYR	A	57	L	-	H	THR	V	176
R	-	CE1	TYR	A	57	L	-	HG1	THR	V	176
R	-	CE1	TYR	A	57	L	-	HG	SER	V	194
R	-	CE1	TYR	A	57	L	-	HD23	LEU	V	196
R	-	CE2	TYR	A	57	L	-	HA3	GLY	V	173
R	-	CE2	TYR	A	57	L	-	CB	SER	V	194
R	-	CE2	TYR	A	57	L	-	OG	SER	V	194
R	-	CE2	TYR	A	57	L	-	HG	SER	V	194
R	-	CE2	TYR	A	57	L	-	CD2	LEU	V	196
R	-	CE2	TYR	A	57	L	-	HD13	LEU	V	196
R	-	CE2	TYR	A	57	L	-	HD23	LEU	V	196
R	-	OH	TYR	A	57	L	-	N	GLY	V	173
R	-	OH	TYR	A	57	L	-	CA	GLY	V	173
R	-	OH	TYR	A	57	L	-	C	GLY	V	173
R	-	OH	TYR	A	57	L	-	HA2	GLY	V	173
R	-	OH	TYR	A	57	L	-	HA3	GLY	V	173
R	-	OH	TYR	A	57	L	-	N	ASP	V	174
R	-	OH	TYR	A	57	L	-	H	ASP	V	174
R	-	OH	TYR	A	57	L	-	CB	SER	V	194
R	-	OH	TYR	A	57	L	-	OG	SER	V	194
R	-	OH	TYR	A	57	L	-	HB2	SER	V	194
R	-	OH	TYR	A	57	L	-	HG	SER	V	194
R	-	OH	TYR	A	57	L	-	CG	LEU	V	196
R	-	OH	TYR	A	57	L	-	CD2	LEU	V	196
R	-	OH	TYR	A	57	L	-	HA	LEU	V	196
R	-	OH	TYR	A	57	L	-	HG	LEU	V	196
R	-	OH	TYR	A	57	L	-	HD21	LEU	V	196
R	-	OH	TYR	A	57	L	-	HD22	LEU	V	196
R	-	OH	TYR	A	57	L	-	HD23	LEU	V	196
R	-	CZ	TYR	A	57	L	-	CA	GLY	V	173
R	-	CZ	TYR	A	57	L	-	HA3	GLY	V	173
R	-	CZ	TYR	A	57	L	-	H	ASP	V	174
R	-	CZ	TYR	A	57	L	-	OG1	THR	V	176
R	-	CZ	TYR	A	57	L	-	HG1	THR	V	176
R	-	CZ	TYR	A	57	L	-	CB	SER	V	194
R	-	CZ	TYR	A	57	L	-	OG	SER	V	194
R	-	CZ	TYR	A	57	L	-	HB2	SER	V	194
R	-	CZ	TYR	A	57	L	-	HG	SER	V	194
R	-	CZ	TYR	A	57	L	-	CD2	LEU	V	196
R	-	CZ	TYR	A	57	L	-	HD21	LEU	V	196
R	-	CZ	TYR	A	57	L	-	HD23	LEU	V	196
R	-	CB	ASN	A	180	L	-	O	MET	V	1
R	-	O	ASN	A	180	L	-	HB2	PHE	V	4
R	-	O	ASN	A	180	L	-	HD2	PHE	V	4
R	-	CG	ASN	A	180	L	-	O	MET	V	1
R	-	CG	ASN	A	180	L	-	HA	CYS	V	2
R	-	CG	ASN	A	180	L	-	HG	CYS	V	2
R	-	ND2	ASN	A	180	L	-	C	MET	V	1
R	-	ND2	ASN	A	180	L	-	O	MET	V	1
R	-	ND2	ASN	A	180	L	-	HB2	MET	V	1
R	-	ND2	ASN	A	180	L	-	HG	CYS	V	2
R	-	OD1	ASN	A	180	L	-	O	MET	V	1
R	-	OD1	ASN	A	180	L	-	SG	CYS	V	2
R	-	OD1	ASN	A	180	L	-	HA	CYS	V	2
R	-	OD1	ASN	A	180	L	-	HG	CYS	V	2
R	-	CB	ASN	A	181	L	-	HB2	PHE	V	4
R	-	CB	ASN	A	181	L	-	HB3	PHE	V	4
R	-	CG	ASN	A	181	L	-	HB2	PHE	V	4
R	-	CG	ASN	A	181	L	-	HB3	PHE	V	4
R	-	ND2	ASN	A	181	L	-	CA	PHE	V	4
R	-	ND2	ASN	A	181	L	-	C	PHE	V	4
R	-	ND2	ASN	A	181	L	-	CB	PHE	V	4
R	-	ND2	ASN	A	181	L	-	O	PHE	V	4
R	-	ND2	ASN	A	181	L	-	HB2	PHE	V	4
R	-	ND2	ASN	A	181	L	-	HB3	PHE	V	4
R	-	ND2	ASN	A	181	L	H	HD13	LEU	V	8
R	-	O	ALA	A	209	L	-	H3	MET	V	1
R	S	CA	GLY	A	210	L	-	SG	CYS	V	2
R	S	CA	GLY	A	210	L	-	HG	CYS	V	2
R	S	C	GLY	A	210	L	-	SG	CYS	V	2
R	S	C	GLY	A	210	L	-	HG	CYS	V	2
R	S	N	GLU	A	211	L	-	SG	CYS	V	2
R	S	N	GLU	A	211	L	-	HG	CYS	V	2
R	S	CD	GLU	A	211	L	-	HB3	CYS	V	2
R	S	OE1	GLU	A	211	L	-	HB3	CYS	V	2
R	S	OE2	GLU	A	211	L	-	HB3	CYS	V	2
R	S	OE2	GLU	A	211	L	H	HG3	PRO	V	5

- 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