IID

Q15617_Q8NH56.1 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	S	GLU	A	100	L	H	TRP	V	50
R	S	GLU	A	100	L	H	LEU	V	51
R	S	GLU	A	100	L	-	SER	V	52
R	S	GLU	A	100	L	H	SER	V	53
R	S	GLU	A	100	L	-	HIS	V	56
R	S	ILE	A	101	L	-	HIS	V	56
R	S	ASN	A	102	L	H	ASN	V	138
R	S	ASN	A	102	L	-	HIS	V	56
R	S	ASN	A	102	L	H	TYR	V	61
R	H	ASN	A	104	L	H	ASN	V	138
R	H	ALA	A	105	L	H	ASN	V	138
R	H	ALA	A	105	L	H	TYR	V	61
R	H	ALA	A	108	L	H	LYS	V	139
R	H	PHE	A	111	L	H	LYS	V	139
R	H	PHE	A	112	L	H	LYS	V	139
R	H	PHE	A	112	L	H	PHE	V	142
R	H	PHE	A	112	L	H	SER	V	143
R	-	PRO	A	18	L	H	SER	V	53
R	-	PRO	A	18	L	-	HIS	V	56
R	S	SER	A	19	L	H	SER	V	53
R	S	SER	A	19	L	-	HIS	V	56
R	H	PHE	A	316	L	H	GLY	V	161
R	H	PHE	A	316	L	H	CYS	V	162
R	H	PHE	A	316	L	H	PHE	V	164
R	H	PHE	A	316	L	H	ARG	V	165
R	H	PHE	A	317	L	H	PHE	V	164
R	-	GLY	A	319	L	H	ARG	V	165
R	-	LYS	A	321	L	-	GLN	V	167
R	-	LYS	A	321	L	-	ASN	V	6
R	H	LEU	A	47	L	H	TYR	V	102
R	H	LEU	A	47	L	H	LEU	V	153
R	H	LEU	A	51	L	H	TYR	V	102
R	H	LEU	A	51	L	H	LEU	V	153
R	H	LEU	A	51	L	H	VAL	V	154
R	H	LEU	A	51	L	H	SER	V	157
R	H	TYR	A	55	L	H	SER	V	157
R	H	TYR	A	55	L	H	VAL	V	158
R	H	TYR	A	55	L	H	GLY	V	161
R	H	TYR	A	55	L	H	CYS	V	162
R	H	TYR	A	55	L	H	ARG	V	165
R	H	TYR	A	59	L	H	VAL	V	158
R	H	TYR	A	59	L	H	ARG	V	165
R	H	TYR	A	59	L	H	LEU	V	198
R	H	LEU	A	81	L	H	LEU	V	146
R	H	LEU	A	81	L	H	ILE	V	150
R	H	THR	A	84	L	H	LEU	V	146
R	H	THR	A	85	L	H	PHE	V	142
R	H	THR	A	85	L	H	LEU	V	146
R	H	ASN	A	89	L	H	TRP	V	50
R	H	CYS	A	92	L	H	TRP	V	50
R	H	CYS	A	92	L	H	PHE	V	68
R	H	ILE	A	93	L	H	TRP	V	50
R	H	PHE	A	96	L	H	LEU	V	43
R	H	PHE	A	96	L	H	THR	V	47
R	H	PHE	A	96	L	H	PHE	V	71
R	-	SER	A	97	L	H	LEU	V	51
R	-	LEU	A	98	L	H	THR	V	46
R	-	LEU	A	98	L	H	THR	V	47
R	-	LEU	A	98	L	H	TRP	V	50
R	-	LEU	A	98	L	H	LEU	V	51
R	-	LYS	A	99	L	H	TRP	V	50
R	-	LYS	A	99	L	H	LEU	V	51

- 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

Q15617_Q8NH56.1 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	18	L	H	HB3	SER	V	53
R	-	C	PRO	A	18	L	H	HB2	SER	V	53
R	-	C	PRO	A	18	L	H	HB3	SER	V	53
R	-	CB	PRO	A	18	L	H	CB	SER	V	53
R	-	CB	PRO	A	18	L	H	OG	SER	V	53
R	-	CB	PRO	A	18	L	H	HB2	SER	V	53
R	-	CB	PRO	A	18	L	H	HB3	SER	V	53
R	-	CB	PRO	A	18	L	H	HG	SER	V	53
R	-	O	PRO	A	18	L	H	HB3	SER	V	53
R	-	O	PRO	A	18	L	-	ND1	HIS	V	56
R	-	CG	PRO	A	18	L	H	CB	SER	V	53
R	-	CG	PRO	A	18	L	H	OG	SER	V	53
R	-	CG	PRO	A	18	L	H	HB2	SER	V	53
R	-	CG	PRO	A	18	L	H	HB3	SER	V	53
R	-	CG	PRO	A	18	L	H	HG	SER	V	53
R	S	N	SER	A	19	L	H	HB2	SER	V	53
R	S	N	SER	A	19	L	H	HB3	SER	V	53
R	S	CA	SER	A	19	L	H	HB2	SER	V	53
R	S	CA	SER	A	19	L	-	HE1	HIS	V	56
R	S	CB	SER	A	19	L	H	CB	SER	V	53
R	S	CB	SER	A	19	L	H	HA	SER	V	53
R	S	CB	SER	A	19	L	H	HB2	SER	V	53
R	S	CB	SER	A	19	L	H	HB3	SER	V	53
R	S	CB	SER	A	19	L	-	ND1	HIS	V	56
R	S	CB	SER	A	19	L	-	CE1	HIS	V	56
R	S	CB	SER	A	19	L	-	HE1	HIS	V	56
R	S	OG	SER	A	19	L	H	CA	SER	V	53
R	S	OG	SER	A	19	L	H	CB	SER	V	53
R	S	OG	SER	A	19	L	H	OG	SER	V	53
R	S	OG	SER	A	19	L	H	H	SER	V	53
R	S	OG	SER	A	19	L	H	HA	SER	V	53
R	S	OG	SER	A	19	L	H	HB2	SER	V	53
R	S	OG	SER	A	19	L	H	HB3	SER	V	53
R	S	OG	SER	A	19	L	H	HG	SER	V	53
R	S	OG	SER	A	19	L	-	CE1	HIS	V	56
R	S	OG	SER	A	19	L	-	HE1	HIS	V	56
R	H	CG	LEU	A	47	L	H	OH	TYR	V	102
R	H	CG	LEU	A	47	L	H	HD22	LEU	V	153
R	H	CD1	LEU	A	47	L	H	CD1	LEU	V	153
R	H	CD1	LEU	A	47	L	H	CD2	LEU	V	153
R	H	CD1	LEU	A	47	L	H	HD12	LEU	V	153
R	H	CD1	LEU	A	47	L	H	HD22	LEU	V	153
R	H	CD1	LEU	A	47	L	H	HD23	LEU	V	153
R	H	CD2	LEU	A	47	L	H	OH	TYR	V	102
R	H	CD2	LEU	A	47	L	H	HE1	TYR	V	102
R	H	CD2	LEU	A	47	L	H	CD2	LEU	V	153
R	H	CD2	LEU	A	47	L	H	HD22	LEU	V	153
R	H	CD2	LEU	A	47	L	H	HD23	LEU	V	153
R	H	C	LEU	A	51	L	H	HB3	SER	V	157
R	H	CB	LEU	A	51	L	H	CB	SER	V	157
R	H	CB	LEU	A	51	L	H	OG	SER	V	157
R	H	CB	LEU	A	51	L	H	HB3	SER	V	157
R	H	CB	LEU	A	51	L	H	HG	SER	V	157
R	H	O	LEU	A	51	L	H	HB3	SER	V	157
R	H	CG	LEU	A	51	L	H	OH	TYR	V	102
R	H	CG	LEU	A	51	L	H	HH	TYR	V	102
R	H	CG	LEU	A	51	L	H	HB2	LEU	V	153
R	H	CG	LEU	A	51	L	H	OG	SER	V	157
R	H	CG	LEU	A	51	L	H	HG	SER	V	157
R	H	CD1	LEU	A	51	L	H	OH	TYR	V	102
R	H	CD1	LEU	A	51	L	H	CZ	TYR	V	102
R	H	CD1	LEU	A	51	L	H	HE2	TYR	V	102
R	H	CD1	LEU	A	51	L	H	HH	TYR	V	102
R	H	CD1	LEU	A	51	L	H	O	LEU	V	153
R	H	CD1	LEU	A	51	L	H	CD2	LEU	V	153
R	H	CD1	LEU	A	51	L	H	HB2	LEU	V	153
R	H	CD1	LEU	A	51	L	H	HD21	LEU	V	153
R	H	CD1	LEU	A	51	L	H	HD22	LEU	V	153
R	H	CD1	LEU	A	51	L	H	OG	SER	V	157
R	H	CD1	LEU	A	51	L	H	HG	SER	V	157
R	H	CD2	LEU	A	51	L	H	CB	LEU	V	153
R	H	CD2	LEU	A	51	L	H	O	LEU	V	153
R	H	CD2	LEU	A	51	L	H	HB2	LEU	V	153
R	H	CD2	LEU	A	51	L	H	HA	VAL	V	154
R	H	CD2	LEU	A	51	L	H	OG	SER	V	157
R	H	CD2	LEU	A	51	L	H	HG	SER	V	157
R	H	CG	TYR	A	55	L	H	HA	VAL	V	158
R	H	CG	TYR	A	55	L	H	HG22	VAL	V	158
R	H	CG	TYR	A	55	L	H	HA3	GLY	V	161
R	H	CD1	TYR	A	55	L	H	HA3	GLY	V	161
R	H	CD2	TYR	A	55	L	H	O	SER	V	157
R	H	CD2	TYR	A	55	L	H	N	VAL	V	158
R	H	CD2	TYR	A	55	L	H	CA	VAL	V	158
R	H	CD2	TYR	A	55	L	H	CB	VAL	V	158
R	H	CD2	TYR	A	55	L	H	CG1	VAL	V	158
R	H	CD2	TYR	A	55	L	H	CG2	VAL	V	158
R	H	CD2	TYR	A	55	L	H	HA	VAL	V	158
R	H	CD2	TYR	A	55	L	H	HG12	VAL	V	158
R	H	CD2	TYR	A	55	L	H	HG21	VAL	V	158
R	H	CD2	TYR	A	55	L	H	HG22	VAL	V	158
R	H	CD2	TYR	A	55	L	H	HA3	GLY	V	161
R	H	CE1	TYR	A	55	L	H	HA3	GLY	V	161
R	H	CE1	TYR	A	55	L	H	HH21	ARG	V	165
R	H	CE2	TYR	A	55	L	H	CA	VAL	V	158
R	H	CE2	TYR	A	55	L	H	C	VAL	V	158
R	H	CE2	TYR	A	55	L	H	CB	VAL	V	158
R	H	CE2	TYR	A	55	L	H	O	VAL	V	158
R	H	CE2	TYR	A	55	L	H	CG1	VAL	V	158
R	H	CE2	TYR	A	55	L	H	CG2	VAL	V	158
R	H	CE2	TYR	A	55	L	H	HA	VAL	V	158
R	H	CE2	TYR	A	55	L	H	HG11	VAL	V	158
R	H	CE2	TYR	A	55	L	H	HG12	VAL	V	158
R	H	CE2	TYR	A	55	L	H	HG22	VAL	V	158
R	H	CE2	TYR	A	55	L	H	HA3	GLY	V	161
R	H	CE2	TYR	A	55	L	H	HG	CYS	V	162
R	H	OH	TYR	A	55	L	H	O	VAL	V	158
R	H	OH	TYR	A	55	L	H	C	GLY	V	161
R	H	OH	TYR	A	55	L	H	O	GLY	V	161
R	H	OH	TYR	A	55	L	H	HA3	GLY	V	161
R	H	OH	TYR	A	55	L	H	N	CYS	V	162
R	H	OH	TYR	A	55	L	H	CA	CYS	V	162
R	H	OH	TYR	A	55	L	H	CB	CYS	V	162
R	H	OH	TYR	A	55	L	H	SG	CYS	V	162
R	H	OH	TYR	A	55	L	H	H	CYS	V	162
R	H	OH	TYR	A	55	L	H	HA	CYS	V	162
R	H	OH	TYR	A	55	L	H	HG	CYS	V	162
R	H	CZ	TYR	A	55	L	H	O	VAL	V	158
R	H	CZ	TYR	A	55	L	H	HA	VAL	V	158
R	H	CZ	TYR	A	55	L	H	HG12	VAL	V	158
R	H	CZ	TYR	A	55	L	H	C	GLY	V	161
R	H	CZ	TYR	A	55	L	H	HA3	GLY	V	161
R	H	CZ	TYR	A	55	L	H	N	CYS	V	162
R	H	CZ	TYR	A	55	L	H	SG	CYS	V	162
R	H	CZ	TYR	A	55	L	H	H	CYS	V	162
R	H	CZ	TYR	A	55	L	H	HG	CYS	V	162
R	H	CB	TYR	A	59	L	H	HH22	ARG	V	165
R	H	CD2	TYR	A	59	L	H	HG12	VAL	V	158
R	H	CE1	TYR	A	59	L	H	HG12	VAL	V	158
R	H	CE2	TYR	A	59	L	H	CG1	VAL	V	158
R	H	CE2	TYR	A	59	L	H	HG12	VAL	V	158
R	H	CE2	TYR	A	59	L	H	HG13	VAL	V	158
R	H	CE2	TYR	A	59	L	H	HG22	VAL	V	158
R	H	OH	TYR	A	59	L	H	CG1	VAL	V	158
R	H	OH	TYR	A	59	L	H	HG11	VAL	V	158
R	H	OH	TYR	A	59	L	H	HG12	VAL	V	158
R	H	OH	TYR	A	59	L	H	HG13	VAL	V	158
R	H	OH	TYR	A	59	L	H	CD1	LEU	V	198
R	H	OH	TYR	A	59	L	H	HD11	LEU	V	198
R	H	OH	TYR	A	59	L	H	HD13	LEU	V	198
R	H	CZ	TYR	A	59	L	H	CG1	VAL	V	158
R	H	CZ	TYR	A	59	L	H	HG11	VAL	V	158
R	H	CZ	TYR	A	59	L	H	HG12	VAL	V	158
R	H	CZ	TYR	A	59	L	H	HG13	VAL	V	158
R	H	CZ	TYR	A	59	L	H	HD11	LEU	V	198
R	H	CB	LEU	A	81	L	H	HD22	LEU	V	146
R	H	CG	LEU	A	81	L	H	HD22	LEU	V	146
R	H	CG	LEU	A	81	L	H	HD11	ILE	V	150
R	H	CG	LEU	A	81	L	H	HD13	ILE	V	150
R	H	CD2	LEU	A	81	L	H	CD2	LEU	V	146
R	H	CD2	LEU	A	81	L	H	HG	LEU	V	146
R	H	CD2	LEU	A	81	L	H	HD12	LEU	V	146
R	H	CD2	LEU	A	81	L	H	HD22	LEU	V	146
R	H	CD2	LEU	A	81	L	H	CD1	ILE	V	150
R	H	CD2	LEU	A	81	L	H	HD11	ILE	V	150
R	H	CD2	LEU	A	81	L	H	HD12	ILE	V	150
R	H	CD2	LEU	A	81	L	H	HD13	ILE	V	150
R	H	CB	THR	A	84	L	H	HD12	LEU	V	146
R	H	CG2	THR	A	84	L	H	CD1	LEU	V	146
R	H	CG2	THR	A	84	L	H	HD11	LEU	V	146
R	H	CG2	THR	A	84	L	H	HD12	LEU	V	146
R	H	CG2	THR	A	84	L	H	HD13	LEU	V	146
R	H	CA	THR	A	85	L	H	HZ	PHE	V	142
R	H	CB	THR	A	85	L	H	HZ	PHE	V	142
R	H	CG2	THR	A	85	L	H	CZ	PHE	V	142
R	H	CG2	THR	A	85	L	H	HZ	PHE	V	142
R	H	OG1	THR	A	85	L	H	CZ	PHE	V	142
R	H	OG1	THR	A	85	L	H	HE1	PHE	V	142
R	H	OG1	THR	A	85	L	H	HZ	PHE	V	142
R	H	OG1	THR	A	85	L	H	HD13	LEU	V	146
R	H	OG1	THR	A	85	L	H	HD23	LEU	V	146
R	H	N	ASN	A	89	L	H	HH2	TRP	V	50
R	H	CA	ASN	A	89	L	H	CH2	TRP	V	50
R	H	CA	ASN	A	89	L	H	HH2	TRP	V	50
R	H	CA	ASN	A	89	L	H	HZ3	TRP	V	50
R	H	C	ASN	A	89	L	H	HH2	TRP	V	50
R	H	CB	ASN	A	89	L	H	HH2	TRP	V	50
R	H	O	ASN	A	89	L	H	HH2	TRP	V	50
R	H	O	ASN	A	89	L	H	HZ3	TRP	V	50
R	H	CG	ASN	A	89	L	H	CH2	TRP	V	50
R	H	CG	ASN	A	89	L	H	HH2	TRP	V	50
R	H	OD1	ASN	A	89	L	H	CH2	TRP	V	50
R	H	OD1	ASN	A	89	L	H	CZ2	TRP	V	50
R	H	OD1	ASN	A	89	L	H	CZ3	TRP	V	50
R	H	OD1	ASN	A	89	L	H	HH2	TRP	V	50
R	H	OD1	ASN	A	89	L	H	HZ2	TRP	V	50
R	H	OD1	ASN	A	89	L	H	HZ3	TRP	V	50
R	H	CB	CYS	A	92	L	H	CH2	TRP	V	50
R	H	CB	CYS	A	92	L	H	CZ3	TRP	V	50
R	H	CB	CYS	A	92	L	H	HH2	TRP	V	50
R	H	CB	CYS	A	92	L	H	HZ3	TRP	V	50
R	H	SG	CYS	A	92	L	H	HE2	PHE	V	68
R	H	CG1	ILE	A	93	L	H	HZ3	TRP	V	50
R	H	O	PHE	A	96	L	H	HG23	THR	V	47
R	H	CG	PHE	A	96	L	H	HD23	LEU	V	43
R	H	CD1	PHE	A	96	L	H	HD12	LEU	V	43
R	H	CD1	PHE	A	96	L	H	HD23	LEU	V	43
R	H	CD2	PHE	A	96	L	H	HD23	LEU	V	43
R	H	CE1	PHE	A	96	L	H	CD1	LEU	V	43
R	H	CE1	PHE	A	96	L	H	CD2	LEU	V	43
R	H	CE1	PHE	A	96	L	H	HD12	LEU	V	43
R	H	CE1	PHE	A	96	L	H	HD13	LEU	V	43
R	H	CE1	PHE	A	96	L	H	HD22	LEU	V	43
R	H	CE1	PHE	A	96	L	H	HD23	LEU	V	43
R	H	CE2	PHE	A	96	L	H	HD22	LEU	V	43
R	H	CE2	PHE	A	96	L	H	HD23	LEU	V	43
R	H	CE2	PHE	A	96	L	H	HE1	PHE	V	71
R	H	CZ	PHE	A	96	L	H	CD2	LEU	V	43
R	H	CZ	PHE	A	96	L	H	HD12	LEU	V	43
R	H	CZ	PHE	A	96	L	H	HD13	LEU	V	43
R	H	CZ	PHE	A	96	L	H	HD22	LEU	V	43
R	H	CZ	PHE	A	96	L	H	HD23	LEU	V	43
R	H	CZ	PHE	A	96	L	H	HE1	PHE	V	71
R	H	CZ	PHE	A	96	L	H	HZ	PHE	V	71
R	-	C	SER	A	97	L	H	HD22	LEU	V	51
R	-	O	SER	A	97	L	H	CD2	LEU	V	51
R	-	O	SER	A	97	L	H	HD13	LEU	V	51
R	-	O	SER	A	97	L	H	HD22	LEU	V	51
R	-	CA	LEU	A	98	L	H	HG23	THR	V	47
R	-	CA	LEU	A	98	L	H	HE3	TRP	V	50
R	-	CA	LEU	A	98	L	H	HD22	LEU	V	51
R	-	C	LEU	A	98	L	H	CE3	TRP	V	50
R	-	C	LEU	A	98	L	H	HB3	TRP	V	50
R	-	C	LEU	A	98	L	H	HE3	TRP	V	50
R	-	C	LEU	A	98	L	H	HZ3	TRP	V	50
R	-	C	LEU	A	98	L	H	HD22	LEU	V	51
R	-	CB	LEU	A	98	L	H	HA	THR	V	47
R	-	CB	LEU	A	98	L	H	HG23	THR	V	47
R	-	CB	LEU	A	98	L	H	CD2	TRP	V	50
R	-	CB	LEU	A	98	L	H	CE3	TRP	V	50
R	-	CB	LEU	A	98	L	H	HB2	TRP	V	50
R	-	CB	LEU	A	98	L	H	HB3	TRP	V	50
R	-	CB	LEU	A	98	L	H	HE3	TRP	V	50
R	-	O	LEU	A	98	L	H	CE3	TRP	V	50
R	-	O	LEU	A	98	L	H	CZ3	TRP	V	50
R	-	O	LEU	A	98	L	H	HE3	TRP	V	50
R	-	O	LEU	A	98	L	H	HZ3	TRP	V	50
R	-	CG	LEU	A	98	L	H	CA	THR	V	47
R	-	CG	LEU	A	98	L	H	CB	THR	V	47
R	-	CG	LEU	A	98	L	H	CG2	THR	V	47
R	-	CG	LEU	A	98	L	H	OG1	THR	V	47
R	-	CG	LEU	A	98	L	H	HA	THR	V	47
R	-	CG	LEU	A	98	L	H	HG1	THR	V	47
R	-	CG	LEU	A	98	L	H	HG23	THR	V	47
R	-	CG	LEU	A	98	L	H	HB2	TRP	V	50
R	-	CD1	LEU	A	98	L	H	CG2	THR	V	46
R	-	CD1	LEU	A	98	L	H	HB	THR	V	46
R	-	CD1	LEU	A	98	L	H	HG21	THR	V	46
R	-	CD1	LEU	A	98	L	H	HG23	THR	V	46
R	-	CD1	LEU	A	98	L	H	N	THR	V	47
R	-	CD1	LEU	A	98	L	H	CA	THR	V	47
R	-	CD1	LEU	A	98	L	H	OG1	THR	V	47
R	-	CD1	LEU	A	98	L	H	HA	THR	V	47
R	-	CD1	LEU	A	98	L	H	HG1	THR	V	47
R	-	CD2	LEU	A	98	L	H	N	THR	V	47
R	-	CD2	LEU	A	98	L	H	CA	THR	V	47
R	-	CD2	LEU	A	98	L	H	C	THR	V	47
R	-	CD2	LEU	A	98	L	H	CB	THR	V	47
R	-	CD2	LEU	A	98	L	H	O	THR	V	47
R	-	CD2	LEU	A	98	L	H	CG2	THR	V	47
R	-	CD2	LEU	A	98	L	H	OG1	THR	V	47
R	-	CD2	LEU	A	98	L	H	H	THR	V	47
R	-	CD2	LEU	A	98	L	H	HA	THR	V	47
R	-	CD2	LEU	A	98	L	H	HB	THR	V	47
R	-	CD2	LEU	A	98	L	H	HG1	THR	V	47
R	-	CD2	LEU	A	98	L	H	HG21	THR	V	47
R	-	CD2	LEU	A	98	L	H	HG22	THR	V	47
R	-	CD2	LEU	A	98	L	H	HG23	THR	V	47
R	-	CD2	LEU	A	98	L	H	HB2	TRP	V	50
R	-	CD2	LEU	A	98	L	H	HG	LEU	V	51
R	-	N	LYS	A	99	L	H	HE3	TRP	V	50
R	-	N	LYS	A	99	L	H	CD2	LEU	V	51
R	-	N	LYS	A	99	L	H	HD21	LEU	V	51
R	-	N	LYS	A	99	L	H	HD22	LEU	V	51
R	-	C	LYS	A	99	L	H	HE3	TRP	V	50
R	-	C	LYS	A	99	L	H	HD21	LEU	V	51
R	S	N	GLU	A	100	L	H	O	TRP	V	50
R	S	N	GLU	A	100	L	H	HB3	TRP	V	50
R	S	N	GLU	A	100	L	H	HE3	TRP	V	50
R	S	N	GLU	A	100	L	H	CD2	LEU	V	51
R	S	N	GLU	A	100	L	H	HA	LEU	V	51
R	S	N	GLU	A	100	L	H	HD21	LEU	V	51
R	S	CA	GLU	A	100	L	H	C	TRP	V	50
R	S	CA	GLU	A	100	L	H	O	TRP	V	50
R	S	CA	GLU	A	100	L	H	HB3	TRP	V	50
R	S	CA	GLU	A	100	L	H	HA	LEU	V	51
R	S	CA	GLU	A	100	L	H	HD21	LEU	V	51
R	S	C	GLU	A	100	L	H	O	TRP	V	50
R	S	C	GLU	A	100	L	H	HB3	TRP	V	50
R	S	C	GLU	A	100	L	-	HE1	HIS	V	56
R	S	CB	GLU	A	100	L	H	CA	TRP	V	50
R	S	CB	GLU	A	100	L	H	C	TRP	V	50
R	S	CB	GLU	A	100	L	H	O	TRP	V	50
R	S	CB	GLU	A	100	L	H	HA	TRP	V	50
R	S	CB	GLU	A	100	L	H	HB3	TRP	V	50
R	S	CB	GLU	A	100	L	H	N	LEU	V	51
R	S	CB	GLU	A	100	L	H	CA	LEU	V	51
R	S	CB	GLU	A	100	L	H	C	LEU	V	51
R	S	CB	GLU	A	100	L	H	HA	LEU	V	51
R	S	CB	GLU	A	100	L	H	HD21	LEU	V	51
R	S	CB	GLU	A	100	L	-	HE1	HIS	V	56
R	S	CB	GLU	A	100	L	-	HE2	HIS	V	56
R	S	O	GLU	A	100	L	H	CA	TRP	V	50
R	S	O	GLU	A	100	L	H	C	TRP	V	50
R	S	O	GLU	A	100	L	H	CB	TRP	V	50
R	S	O	GLU	A	100	L	H	O	TRP	V	50
R	S	O	GLU	A	100	L	H	CG	TRP	V	50
R	S	O	GLU	A	100	L	H	CD2	TRP	V	50
R	S	O	GLU	A	100	L	H	CE3	TRP	V	50
R	S	O	GLU	A	100	L	H	HA	TRP	V	50
R	S	O	GLU	A	100	L	H	HB3	TRP	V	50
R	S	O	GLU	A	100	L	H	HE3	TRP	V	50
R	S	CG	GLU	A	100	L	H	C	TRP	V	50
R	S	CG	GLU	A	100	L	H	O	TRP	V	50
R	S	CG	GLU	A	100	L	H	N	LEU	V	51
R	S	CG	GLU	A	100	L	H	CA	LEU	V	51
R	S	CG	GLU	A	100	L	H	C	LEU	V	51
R	S	CG	GLU	A	100	L	H	O	LEU	V	51
R	S	CG	GLU	A	100	L	H	HA	LEU	V	51
R	S	CG	GLU	A	100	L	-	CE1	HIS	V	56
R	S	CG	GLU	A	100	L	-	NE2	HIS	V	56
R	S	CG	GLU	A	100	L	-	HE1	HIS	V	56
R	S	CG	GLU	A	100	L	-	HE2	HIS	V	56
R	S	CD	GLU	A	100	L	H	C	TRP	V	50
R	S	CD	GLU	A	100	L	H	O	TRP	V	50
R	S	CD	GLU	A	100	L	H	N	LEU	V	51
R	S	CD	GLU	A	100	L	H	CA	LEU	V	51
R	S	CD	GLU	A	100	L	H	C	LEU	V	51
R	S	CD	GLU	A	100	L	H	O	LEU	V	51
R	S	CD	GLU	A	100	L	H	HA	LEU	V	51
R	S	CD	GLU	A	100	L	-	N	SER	V	52
R	S	CD	GLU	A	100	L	-	CA	SER	V	52
R	S	CD	GLU	A	100	L	-	C	SER	V	52
R	S	CD	GLU	A	100	L	-	H	SER	V	52
R	S	CD	GLU	A	100	L	-	HA	SER	V	52
R	S	CD	GLU	A	100	L	H	N	SER	V	53
R	S	CD	GLU	A	100	L	H	H	SER	V	53
R	S	CD	GLU	A	100	L	H	HA	SER	V	53
R	S	CD	GLU	A	100	L	H	HB2	SER	V	53
R	S	CD	GLU	A	100	L	-	CE1	HIS	V	56
R	S	CD	GLU	A	100	L	-	NE2	HIS	V	56
R	S	CD	GLU	A	100	L	-	HE1	HIS	V	56
R	S	CD	GLU	A	100	L	-	HE2	HIS	V	56
R	S	OE1	GLU	A	100	L	H	O	TRP	V	50
R	S	OE1	GLU	A	100	L	H	C	LEU	V	51
R	S	OE1	GLU	A	100	L	H	O	LEU	V	51
R	S	OE1	GLU	A	100	L	H	HA	LEU	V	51
R	S	OE1	GLU	A	100	L	-	N	SER	V	52
R	S	OE1	GLU	A	100	L	-	CA	SER	V	52
R	S	OE1	GLU	A	100	L	-	C	SER	V	52
R	S	OE1	GLU	A	100	L	-	O	SER	V	52
R	S	OE1	GLU	A	100	L	-	HA	SER	V	52
R	S	OE1	GLU	A	100	L	H	N	SER	V	53
R	S	OE1	GLU	A	100	L	H	CA	SER	V	53
R	S	OE1	GLU	A	100	L	H	CB	SER	V	53
R	S	OE1	GLU	A	100	L	H	H	SER	V	53
R	S	OE1	GLU	A	100	L	H	HA	SER	V	53
R	S	OE1	GLU	A	100	L	H	HB2	SER	V	53
R	S	OE1	GLU	A	100	L	-	ND1	HIS	V	56
R	S	OE1	GLU	A	100	L	-	CE1	HIS	V	56
R	S	OE1	GLU	A	100	L	-	NE2	HIS	V	56
R	S	OE1	GLU	A	100	L	-	HE1	HIS	V	56
R	S	OE1	GLU	A	100	L	-	HE2	HIS	V	56
R	S	OE2	GLU	A	100	L	H	C	TRP	V	50
R	S	OE2	GLU	A	100	L	H	O	TRP	V	50
R	S	OE2	GLU	A	100	L	H	N	LEU	V	51
R	S	OE2	GLU	A	100	L	H	CA	LEU	V	51
R	S	OE2	GLU	A	100	L	H	C	LEU	V	51
R	S	OE2	GLU	A	100	L	H	CB	LEU	V	51
R	S	OE2	GLU	A	100	L	H	O	LEU	V	51
R	S	OE2	GLU	A	100	L	H	H	LEU	V	51
R	S	OE2	GLU	A	100	L	H	HA	LEU	V	51
R	S	OE2	GLU	A	100	L	H	HB2	LEU	V	51
R	S	OE2	GLU	A	100	L	H	HB3	LEU	V	51
R	S	OE2	GLU	A	100	L	H	HD21	LEU	V	51
R	S	OE2	GLU	A	100	L	-	N	SER	V	52
R	S	OE2	GLU	A	100	L	-	CA	SER	V	52
R	S	OE2	GLU	A	100	L	-	C	SER	V	52
R	S	OE2	GLU	A	100	L	-	H	SER	V	52
R	S	OE2	GLU	A	100	L	-	HA	SER	V	52
R	S	OE2	GLU	A	100	L	H	N	SER	V	53
R	S	OE2	GLU	A	100	L	H	H	SER	V	53
R	S	OE2	GLU	A	100	L	-	HE2	HIS	V	56
R	S	N	ILE	A	101	L	-	HE1	HIS	V	56
R	S	CA	ILE	A	101	L	-	HE1	HIS	V	56
R	S	C	ILE	A	101	L	-	ND1	HIS	V	56
R	S	C	ILE	A	101	L	-	CE1	HIS	V	56
R	S	C	ILE	A	101	L	-	HE1	HIS	V	56
R	S	O	ILE	A	101	L	-	CE1	HIS	V	56
R	S	O	ILE	A	101	L	-	HE1	HIS	V	56
R	S	N	ASN	A	102	L	-	ND1	HIS	V	56
R	S	N	ASN	A	102	L	-	CE1	HIS	V	56
R	S	N	ASN	A	102	L	-	HE1	HIS	V	56
R	S	N	ASN	A	102	L	H	OH	TYR	V	61
R	S	N	ASN	A	102	L	H	HH	TYR	V	61
R	S	CA	ASN	A	102	L	-	CG	HIS	V	56
R	S	CA	ASN	A	102	L	-	ND1	HIS	V	56
R	S	CA	ASN	A	102	L	-	CE1	HIS	V	56
R	S	CA	ASN	A	102	L	-	HB3	HIS	V	56
R	S	CA	ASN	A	102	L	-	HE1	HIS	V	56
R	S	CA	ASN	A	102	L	H	OH	TYR	V	61
R	S	CA	ASN	A	102	L	H	HH	TYR	V	61
R	S	C	ASN	A	102	L	H	HH	TYR	V	61
R	S	CB	ASN	A	102	L	-	CB	HIS	V	56
R	S	CB	ASN	A	102	L	-	CG	HIS	V	56
R	S	CB	ASN	A	102	L	-	ND1	HIS	V	56
R	S	CB	ASN	A	102	L	-	CE1	HIS	V	56
R	S	CB	ASN	A	102	L	-	HB3	HIS	V	56
R	S	CB	ASN	A	102	L	H	OH	TYR	V	61
R	S	CB	ASN	A	102	L	H	CZ	TYR	V	61
R	S	CB	ASN	A	102	L	H	HE2	TYR	V	61
R	S	CB	ASN	A	102	L	H	HH	TYR	V	61
R	S	CG	ASN	A	102	L	-	CB	HIS	V	56
R	S	CG	ASN	A	102	L	-	CG	HIS	V	56
R	S	CG	ASN	A	102	L	-	ND1	HIS	V	56
R	S	CG	ASN	A	102	L	-	HB2	HIS	V	56
R	S	CG	ASN	A	102	L	-	HB3	HIS	V	56
R	S	CG	ASN	A	102	L	H	OH	TYR	V	61
R	S	CG	ASN	A	102	L	H	CZ	TYR	V	61
R	S	CG	ASN	A	102	L	H	HE2	TYR	V	61
R	S	CG	ASN	A	102	L	H	HH	TYR	V	61
R	S	CG	ASN	A	102	L	H	ND2	ASN	V	138
R	S	CG	ASN	A	102	L	H	HD21	ASN	V	138
R	S	CG	ASN	A	102	L	H	HD22	ASN	V	138
R	S	ND2	ASN	A	102	L	-	CA	HIS	V	56
R	S	ND2	ASN	A	102	L	-	C	HIS	V	56
R	S	ND2	ASN	A	102	L	-	CB	HIS	V	56
R	S	ND2	ASN	A	102	L	-	O	HIS	V	56
R	S	ND2	ASN	A	102	L	-	CG	HIS	V	56
R	S	ND2	ASN	A	102	L	-	ND1	HIS	V	56
R	S	ND2	ASN	A	102	L	-	HB2	HIS	V	56
R	S	ND2	ASN	A	102	L	-	HB3	HIS	V	56
R	S	ND2	ASN	A	102	L	H	OH	TYR	V	61
R	S	ND2	ASN	A	102	L	H	HE2	TYR	V	61
R	S	ND2	ASN	A	102	L	H	HH	TYR	V	61
R	S	ND2	ASN	A	102	L	H	ND2	ASN	V	138
R	S	ND2	ASN	A	102	L	H	HD21	ASN	V	138
R	S	ND2	ASN	A	102	L	H	HD22	ASN	V	138
R	S	OD1	ASN	A	102	L	-	HB3	HIS	V	56
R	S	OD1	ASN	A	102	L	H	OH	TYR	V	61
R	S	OD1	ASN	A	102	L	H	HH	TYR	V	61
R	S	OD1	ASN	A	102	L	H	CG	ASN	V	138
R	S	OD1	ASN	A	102	L	H	ND2	ASN	V	138
R	S	OD1	ASN	A	102	L	H	HD21	ASN	V	138
R	S	OD1	ASN	A	102	L	H	HD22	ASN	V	138
R	H	N	ASN	A	104	L	H	ND2	ASN	V	138
R	H	N	ASN	A	104	L	H	HD21	ASN	V	138
R	H	CA	ASN	A	104	L	H	ND2	ASN	V	138
R	H	CA	ASN	A	104	L	H	HB2	ASN	V	138
R	H	CA	ASN	A	104	L	H	HB3	ASN	V	138
R	H	CA	ASN	A	104	L	H	HD21	ASN	V	138
R	H	C	ASN	A	104	L	H	HB2	ASN	V	138
R	H	C	ASN	A	104	L	H	HB3	ASN	V	138
R	H	C	ASN	A	104	L	H	HD21	ASN	V	138
R	H	CB	ASN	A	104	L	H	CB	ASN	V	138
R	H	CB	ASN	A	104	L	H	CG	ASN	V	138
R	H	CB	ASN	A	104	L	H	ND2	ASN	V	138
R	H	CB	ASN	A	104	L	H	HB2	ASN	V	138
R	H	CB	ASN	A	104	L	H	HB3	ASN	V	138
R	H	CB	ASN	A	104	L	H	HD21	ASN	V	138
R	H	CB	ASN	A	104	L	H	HD22	ASN	V	138
R	H	CG	ASN	A	104	L	H	ND2	ASN	V	138
R	H	CG	ASN	A	104	L	H	HB2	ASN	V	138
R	H	CG	ASN	A	104	L	H	HD21	ASN	V	138
R	H	CG	ASN	A	104	L	H	HD22	ASN	V	138
R	H	ND2	ASN	A	104	L	H	CG	ASN	V	138
R	H	ND2	ASN	A	104	L	H	ND2	ASN	V	138
R	H	ND2	ASN	A	104	L	H	HB2	ASN	V	138
R	H	ND2	ASN	A	104	L	H	HD21	ASN	V	138
R	H	ND2	ASN	A	104	L	H	HD22	ASN	V	138
R	H	OD1	ASN	A	104	L	H	HD21	ASN	V	138
R	H	N	ALA	A	105	L	H	HB2	ASN	V	138
R	H	N	ALA	A	105	L	H	HB3	ASN	V	138
R	H	N	ALA	A	105	L	H	HD21	ASN	V	138
R	H	CA	ALA	A	105	L	H	HB3	ASN	V	138
R	H	CB	ALA	A	105	L	H	CE1	TYR	V	61
R	H	CB	ALA	A	105	L	H	OH	TYR	V	61
R	H	CB	ALA	A	105	L	H	CZ	TYR	V	61
R	H	CB	ALA	A	105	L	H	HE1	TYR	V	61
R	H	CB	ALA	A	105	L	H	HB3	ASN	V	138
R	H	CA	ALA	A	108	L	H	HG3	LYS	V	139
R	H	CB	ALA	A	108	L	H	HA	LYS	V	139
R	H	CB	ALA	A	108	L	H	HB2	LYS	V	139
R	H	CB	ALA	A	108	L	H	HG3	LYS	V	139
R	H	CD1	PHE	A	111	L	H	HE3	LYS	V	139
R	H	CD1	PHE	A	111	L	H	HZ1	LYS	V	139
R	H	CE1	PHE	A	111	L	H	NZ	LYS	V	139
R	H	CE1	PHE	A	111	L	H	HE3	LYS	V	139
R	H	CE1	PHE	A	111	L	H	HZ1	LYS	V	139
R	H	CE2	PHE	A	111	L	H	HZ1	LYS	V	139
R	H	CZ	PHE	A	111	L	H	HZ1	LYS	V	139
R	H	CB	PHE	A	112	L	H	HE1	PHE	V	142
R	H	CG	PHE	A	112	L	H	HE1	PHE	V	142
R	H	CD2	PHE	A	112	L	H	CD1	PHE	V	142
R	H	CD2	PHE	A	112	L	H	CE1	PHE	V	142
R	H	CD2	PHE	A	112	L	H	HD1	PHE	V	142
R	H	CD2	PHE	A	112	L	H	HE1	PHE	V	142
R	H	CE2	PHE	A	112	L	H	HG3	LYS	V	139
R	H	CE2	PHE	A	112	L	H	HE3	LYS	V	139
R	H	CE2	PHE	A	112	L	H	CD1	PHE	V	142
R	H	CE2	PHE	A	112	L	H	CE1	PHE	V	142
R	H	CE2	PHE	A	112	L	H	HD1	PHE	V	142
R	H	CE2	PHE	A	112	L	H	HE1	PHE	V	142
R	H	CE2	PHE	A	112	L	H	HG	SER	V	143
R	H	CZ	PHE	A	112	L	H	HE3	LYS	V	139
R	H	CZ	PHE	A	112	L	H	HD1	PHE	V	142
R	H	CZ	PHE	A	112	L	H	HE1	PHE	V	142
R	H	CZ	PHE	A	112	L	H	OG	SER	V	143
R	H	CZ	PHE	A	112	L	H	HG	SER	V	143
R	H	CA	PHE	A	316	L	H	HG2	ARG	V	165
R	H	C	PHE	A	316	L	H	HG2	ARG	V	165
R	H	O	PHE	A	316	L	H	O	PHE	V	164
R	H	O	PHE	A	316	L	H	HA	ARG	V	165
R	H	O	PHE	A	316	L	H	HG2	ARG	V	165
R	H	CG	PHE	A	316	L	H	HB2	PHE	V	164
R	H	CG	PHE	A	316	L	H	HG2	ARG	V	165
R	H	CG	PHE	A	316	L	H	HE	ARG	V	165
R	H	CD1	PHE	A	316	L	H	CB	PHE	V	164
R	H	CD1	PHE	A	316	L	H	HB2	PHE	V	164
R	H	CD1	PHE	A	316	L	H	HB3	PHE	V	164
R	H	CD1	PHE	A	316	L	H	HD2	PHE	V	164
R	H	CD2	PHE	A	316	L	H	O	GLY	V	161
R	H	CD2	PHE	A	316	L	H	HB2	PHE	V	164
R	H	CD2	PHE	A	316	L	H	CG	ARG	V	165
R	H	CD2	PHE	A	316	L	H	NE	ARG	V	165
R	H	CD2	PHE	A	316	L	H	NH2	ARG	V	165
R	H	CD2	PHE	A	316	L	H	CZ	ARG	V	165
R	H	CD2	PHE	A	316	L	H	HG2	ARG	V	165
R	H	CD2	PHE	A	316	L	H	HG3	ARG	V	165
R	H	CD2	PHE	A	316	L	H	HE	ARG	V	165
R	H	CD2	PHE	A	316	L	H	HH21	ARG	V	165
R	H	CE1	PHE	A	316	L	H	O	GLY	V	161
R	H	CE1	PHE	A	316	L	H	HA2	GLY	V	161
R	H	CE1	PHE	A	316	L	H	CB	PHE	V	164
R	H	CE1	PHE	A	316	L	H	CG	PHE	V	164
R	H	CE1	PHE	A	316	L	H	CD2	PHE	V	164
R	H	CE1	PHE	A	316	L	H	HB2	PHE	V	164
R	H	CE1	PHE	A	316	L	H	HB3	PHE	V	164
R	H	CE1	PHE	A	316	L	H	HD2	PHE	V	164
R	H	CE2	PHE	A	316	L	H	CA	GLY	V	161
R	H	CE2	PHE	A	316	L	H	C	GLY	V	161
R	H	CE2	PHE	A	316	L	H	O	GLY	V	161
R	H	CE2	PHE	A	316	L	H	HA2	GLY	V	161
R	H	CE2	PHE	A	316	L	H	HA	CYS	V	162
R	H	CE2	PHE	A	316	L	H	HB2	PHE	V	164
R	H	CE2	PHE	A	316	L	H	HD2	PHE	V	164
R	H	CE2	PHE	A	316	L	H	CG	ARG	V	165
R	H	CE2	PHE	A	316	L	H	NE	ARG	V	165
R	H	CE2	PHE	A	316	L	H	HG2	ARG	V	165
R	H	CE2	PHE	A	316	L	H	HG3	ARG	V	165
R	H	CE2	PHE	A	316	L	H	HE	ARG	V	165
R	H	CE2	PHE	A	316	L	H	HH21	ARG	V	165
R	H	CZ	PHE	A	316	L	H	CA	GLY	V	161
R	H	CZ	PHE	A	316	L	H	C	GLY	V	161
R	H	CZ	PHE	A	316	L	H	O	GLY	V	161
R	H	CZ	PHE	A	316	L	H	HA2	GLY	V	161
R	H	CZ	PHE	A	316	L	H	HA3	GLY	V	161
R	H	CZ	PHE	A	316	L	H	CB	PHE	V	164
R	H	CZ	PHE	A	316	L	H	CG	PHE	V	164
R	H	CZ	PHE	A	316	L	H	CD2	PHE	V	164
R	H	CZ	PHE	A	316	L	H	H	PHE	V	164
R	H	CZ	PHE	A	316	L	H	HB2	PHE	V	164
R	H	CZ	PHE	A	316	L	H	HB3	PHE	V	164
R	H	CZ	PHE	A	316	L	H	HD2	PHE	V	164
R	H	CZ	PHE	A	316	L	H	HG3	ARG	V	165
R	H	CZ	PHE	A	316	L	H	HE	ARG	V	165
R	H	CD1	PHE	A	317	L	H	HB3	PHE	V	164
R	-	CA	GLY	A	319	L	H	HA	ARG	V	165
R	-	CB	LYS	A	321	L	-	HE22	GLN	V	167
R	-	CG	LYS	A	321	L	-	HD22	ASN	V	6
R	-	CG	LYS	A	321	L	-	NE2	GLN	V	167
R	-	CG	LYS	A	321	L	-	HE21	GLN	V	167
R	-	CG	LYS	A	321	L	-	HE22	GLN	V	167
R	-	CD	LYS	A	321	L	-	ND2	ASN	V	6
R	-	CD	LYS	A	321	L	-	HD21	ASN	V	6
R	-	CD	LYS	A	321	L	-	HD22	ASN	V	6
R	-	CD	LYS	A	321	L	-	NE2	GLN	V	167
R	-	CD	LYS	A	321	L	-	HE21	GLN	V	167
R	-	CD	LYS	A	321	L	-	HE22	GLN	V	167
R	-	CE	LYS	A	321	L	-	CG	ASN	V	6
R	-	CE	LYS	A	321	L	-	ND2	ASN	V	6
R	-	CE	LYS	A	321	L	-	OD1	ASN	V	6
R	-	CE	LYS	A	321	L	-	HD21	ASN	V	6
R	-	CE	LYS	A	321	L	-	HD22	ASN	V	6
R	-	CE	LYS	A	321	L	-	NE2	GLN	V	167
R	-	CE	LYS	A	321	L	-	HE21	GLN	V	167
R	-	CE	LYS	A	321	L	-	HE22	GLN	V	167
R	-	NZ	LYS	A	321	L	-	CB	ASN	V	6
R	-	NZ	LYS	A	321	L	-	CG	ASN	V	6
R	-	NZ	LYS	A	321	L	-	ND2	ASN	V	6
R	-	NZ	LYS	A	321	L	-	OD1	ASN	V	6
R	-	NZ	LYS	A	321	L	-	HB2	ASN	V	6
R	-	NZ	LYS	A	321	L	-	HB3	ASN	V	6
R	-	NZ	LYS	A	321	L	-	HD21	ASN	V	6
R	-	NZ	LYS	A	321	L	-	HD22	ASN	V	6
R	-	NZ	LYS	A	321	L	-	HE22	GLN	V	167

- 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