IID

P58181_Q8NGX1.1 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	-	VAL	A	10	L	H	PHE	V	37
R	H	TYR	A	102	L	H	ARG	V	313
R	H	PHE	A	103	L	H	ARG	V	313
R	S	GLU	A	11	L	H	PHE	V	37
R	S	GLU	A	11	L	H	VAL	V	91
R	S	ILE	A	13	L	H	VAL	V	88
R	H	TRP	A	149	L	H	GLN	V	316
R	H	ILE	A	153	L	H	GLN	V	316
R	H	ILE	A	153	L	-	GLU	V	317
R	H	PRO	A	21	L	H	ILE	V	104
R	H	GLN	A	24	L	H	ILE	V	104
R	H	VAL	A	25	L	H	ILE	V	104
R	H	VAL	A	25	L	H	PHE	V	107
R	H	PHE	A	28	L	H	PHE	V	108
R	H	PHE	A	28	L	H	TRP	V	154
R	H	PHE	A	28	L	H	MET	V	158
R	H	PHE	A	28	L	H	MET	V	77
R	H	TRP	A	305	L	H	ARG	V	144
R	H	LYS	A	308	L	-	ASN	V	142
R	H	LYS	A	308	L	H	GLN	V	143
R	H	LYS	A	308	L	H	ARG	V	144
R	H	VAL	A	309	L	H	ARG	V	144
R	H	LEU	A	311	L	H	LEU	V	139
R	H	HIS	A	312	L	H	LEU	V	139
R	H	HIS	A	312	L	-	ASN	V	142
R	H	LEU	A	32	L	H	LEU	V	73
R	H	TYR	A	35	L	H	ILE	V	51
R	H	TYR	A	35	L	H	LEU	V	73
R	H	LEU	A	39	L	H	HIS	V	55
R	H	MET	A	40	L	H	GLN	V	147
R	H	VAL	A	71	L	H	HIS	V	55
R	H	SER	A	72	L	H	LEU	V	52
R	H	SER	A	72	L	H	SER	V	56
R	H	ALA	A	75	L	H	ILE	V	51
R	H	ALA	A	75	L	H	LEU	V	52
R	H	VAL	A	76	L	H	LEU	V	52
R	H	PRO	A	79	L	H	ILE	V	51
R	H	PRO	A	79	L	H	LEU	V	73
R	H	PRO	A	79	L	H	LEU	V	76
R	H	LEU	A	82	L	H	LEU	V	73
R	H	LEU	A	82	L	H	MET	V	77
R	H	VAL	A	83	L	H	LEU	V	76
R	H	VAL	A	83	L	H	MET	V	77
R	H	VAL	A	83	L	H	CYS	V	80
R	H	LEU	A	85	L	H	PHE	V	108
R	H	SER	A	86	L	H	ILE	V	104
R	H	SER	A	86	L	H	GLN	V	105
R	H	SER	A	86	L	H	PHE	V	108
R	H	SER	A	86	L	H	MET	V	77
R	H	SER	A	86	L	H	VAL	V	81
R	-	THR	A	87	L	H	CYS	V	80
R	-	THR	A	87	L	H	VAL	V	81
R	-	GLU	A	88	L	H	SER	V	100
R	-	GLU	A	88	L	H	GLY	V	101
R	-	GLU	A	88	L	H	CYS	V	102
R	-	GLU	A	88	L	H	LYS	V	85
R	-	GLU	A	88	L	-	ILE	V	97
R	-	GLU	A	88	L	-	SER	V	98
R	-	LYS	A	89	L	H	CYS	V	80
R	-	LYS	A	89	L	H	PRO	V	84
R	-	LYS	A	89	L	H	LYS	V	85
R	-	LYS	A	89	L	H	VAL	V	88
R	S	THR	A	90	L	H	CYS	V	80
R	S	THR	A	90	L	H	PRO	V	84
R	S	MET	A	91	L	H	PHE	V	40
R	S	MET	A	91	L	H	LEU	V	44
R	S	MET	A	91	L	H	PRO	V	84
R	S	MET	A	91	L	H	VAL	V	88
R	S	SER	A	93	L	H	LEU	V	41

- 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

P58181_Q8NGX1.1 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	-	C	VAL	A	10	L	H	HZ	PHE	V	37
R	-	CB	VAL	A	10	L	H	HE1	PHE	V	37
R	-	CB	VAL	A	10	L	H	HZ	PHE	V	37
R	-	O	VAL	A	10	L	H	CZ	PHE	V	37
R	-	O	VAL	A	10	L	H	HZ	PHE	V	37
R	-	CG2	VAL	A	10	L	H	HE1	PHE	V	37
R	-	CG2	VAL	A	10	L	H	HZ	PHE	V	37
R	S	N	GLU	A	11	L	H	HZ	PHE	V	37
R	S	CA	GLU	A	11	L	H	HZ	PHE	V	37
R	S	CB	GLU	A	11	L	H	HE2	PHE	V	37
R	S	CB	GLU	A	11	L	H	HZ	PHE	V	37
R	S	CD	GLU	A	11	L	H	CE2	PHE	V	37
R	S	CD	GLU	A	11	L	H	HE2	PHE	V	37
R	S	OE1	GLU	A	11	L	H	HG22	VAL	V	91
R	S	OE2	GLU	A	11	L	H	CD2	PHE	V	37
R	S	OE2	GLU	A	11	L	H	CE2	PHE	V	37
R	S	OE2	GLU	A	11	L	H	CZ	PHE	V	37
R	S	OE2	GLU	A	11	L	H	HD2	PHE	V	37
R	S	OE2	GLU	A	11	L	H	HE2	PHE	V	37
R	S	OE2	GLU	A	11	L	H	HZ	PHE	V	37
R	S	CD1	ILE	A	13	L	H	HG22	VAL	V	88
R	S	CD1	ILE	A	13	L	H	HG23	VAL	V	88
R	H	CA	PRO	A	21	L	H	HD11	ILE	V	104
R	H	C	PRO	A	21	L	H	HD11	ILE	V	104
R	H	CB	PRO	A	21	L	H	CD1	ILE	V	104
R	H	CB	PRO	A	21	L	H	HD11	ILE	V	104
R	H	CB	PRO	A	21	L	H	HD12	ILE	V	104
R	H	CB	PRO	A	21	L	H	HD13	ILE	V	104
R	H	O	PRO	A	21	L	H	CD1	ILE	V	104
R	H	O	PRO	A	21	L	H	HD11	ILE	V	104
R	H	O	PRO	A	21	L	H	HD13	ILE	V	104
R	H	OE1	GLN	A	24	L	H	CD1	ILE	V	104
R	H	OE1	GLN	A	24	L	H	HG22	ILE	V	104
R	H	OE1	GLN	A	24	L	H	HD13	ILE	V	104
R	H	CG1	VAL	A	25	L	H	CE1	PHE	V	107
R	H	CG1	VAL	A	25	L	H	HE1	PHE	V	107
R	H	CG2	VAL	A	25	L	H	HG12	ILE	V	104
R	H	CB	PHE	A	28	L	H	CZ	PHE	V	108
R	H	CB	PHE	A	28	L	H	HE1	PHE	V	108
R	H	CB	PHE	A	28	L	H	HZ	PHE	V	108
R	H	CG	PHE	A	28	L	H	CE1	PHE	V	108
R	H	CG	PHE	A	28	L	H	CZ	PHE	V	108
R	H	CG	PHE	A	28	L	H	HE1	PHE	V	108
R	H	CG	PHE	A	28	L	H	HZ	PHE	V	108
R	H	CD1	PHE	A	28	L	H	CE1	PHE	V	108
R	H	CD1	PHE	A	28	L	H	HE1	PHE	V	108
R	H	CD1	PHE	A	28	L	H	HZ	PHE	V	108
R	H	CD1	PHE	A	28	L	H	HE1	MET	V	158
R	H	CD2	PHE	A	28	L	H	CE1	PHE	V	108
R	H	CD2	PHE	A	28	L	H	CZ	PHE	V	108
R	H	CD2	PHE	A	28	L	H	HE1	PHE	V	108
R	H	CD2	PHE	A	28	L	H	HZ	PHE	V	108
R	H	CE1	PHE	A	28	L	H	CE1	PHE	V	108
R	H	CE1	PHE	A	28	L	H	HE1	PHE	V	108
R	H	CE1	PHE	A	28	L	H	HZ3	TRP	V	154
R	H	CE1	PHE	A	28	L	H	CE	MET	V	158
R	H	CE1	PHE	A	28	L	H	HE1	MET	V	158
R	H	CE1	PHE	A	28	L	H	HE2	MET	V	158
R	H	CE2	PHE	A	28	L	H	SD	MET	V	77
R	H	CE2	PHE	A	28	L	H	CE1	PHE	V	108
R	H	CE2	PHE	A	28	L	H	HE1	PHE	V	108
R	H	CE2	PHE	A	28	L	H	HZ	PHE	V	108
R	H	CZ	PHE	A	28	L	H	SD	MET	V	77
R	H	CZ	PHE	A	28	L	H	CE1	PHE	V	108
R	H	CZ	PHE	A	28	L	H	HD1	PHE	V	108
R	H	CZ	PHE	A	28	L	H	HE1	PHE	V	108
R	H	CZ	PHE	A	28	L	H	HH2	TRP	V	154
R	H	CD1	LEU	A	32	L	H	HD22	LEU	V	73
R	H	CE1	TYR	A	35	L	H	HD23	LEU	V	73
R	H	OH	TYR	A	35	L	H	CG2	ILE	V	51
R	H	OH	TYR	A	35	L	H	HG21	ILE	V	51
R	H	OH	TYR	A	35	L	H	HG22	ILE	V	51
R	H	OH	TYR	A	35	L	H	HG23	ILE	V	51
R	H	CG	LEU	A	39	L	H	HD2	HIS	V	55
R	H	CD1	LEU	A	39	L	H	CD2	HIS	V	55
R	H	CD1	LEU	A	39	L	H	NE2	HIS	V	55
R	H	CD1	LEU	A	39	L	H	HD2	HIS	V	55
R	H	CD2	LEU	A	39	L	H	CD2	HIS	V	55
R	H	CD2	LEU	A	39	L	H	HD2	HIS	V	55
R	H	CB	MET	A	40	L	H	NE2	GLN	V	147
R	H	CB	MET	A	40	L	H	HE21	GLN	V	147
R	H	CB	MET	A	40	L	H	HE22	GLN	V	147
R	H	CG	MET	A	40	L	H	NE2	GLN	V	147
R	H	CG	MET	A	40	L	H	HE21	GLN	V	147
R	H	CG	MET	A	40	L	H	HE22	GLN	V	147
R	H	SD	MET	A	40	L	H	CD	GLN	V	147
R	H	SD	MET	A	40	L	H	NE2	GLN	V	147
R	H	SD	MET	A	40	L	H	OE1	GLN	V	147
R	H	SD	MET	A	40	L	H	HE21	GLN	V	147
R	H	SD	MET	A	40	L	H	HE22	GLN	V	147
R	H	CE	MET	A	40	L	H	CD	GLN	V	147
R	H	CE	MET	A	40	L	H	NE2	GLN	V	147
R	H	CE	MET	A	40	L	H	OE1	GLN	V	147
R	H	CE	MET	A	40	L	H	HE21	GLN	V	147
R	H	CE	MET	A	40	L	H	HE22	GLN	V	147
R	H	CG1	VAL	A	71	L	H	CB	HIS	V	55
R	H	CG1	VAL	A	71	L	H	HB2	HIS	V	55
R	H	CG1	VAL	A	71	L	H	HD2	HIS	V	55
R	H	O	SER	A	72	L	H	HD21	LEU	V	52
R	H	O	SER	A	72	L	H	HD22	LEU	V	52
R	H	O	SER	A	72	L	H	HD23	LEU	V	52
R	H	OG	SER	A	72	L	H	OG	SER	V	56
R	H	CA	ALA	A	75	L	H	HD21	LEU	V	52
R	H	CA	ALA	A	75	L	H	HD22	LEU	V	52
R	H	C	ALA	A	75	L	H	CD2	LEU	V	52
R	H	C	ALA	A	75	L	H	HD21	LEU	V	52
R	H	C	ALA	A	75	L	H	HD22	LEU	V	52
R	H	CB	ALA	A	75	L	H	HG21	ILE	V	51
R	H	CB	ALA	A	75	L	H	CD2	LEU	V	52
R	H	CB	ALA	A	75	L	H	HA	LEU	V	52
R	H	CB	ALA	A	75	L	H	HD21	LEU	V	52
R	H	CB	ALA	A	75	L	H	HD22	LEU	V	52
R	H	CB	ALA	A	75	L	H	HD23	LEU	V	52
R	H	O	ALA	A	75	L	H	CD2	LEU	V	52
R	H	O	ALA	A	75	L	H	HG	LEU	V	52
R	H	O	ALA	A	75	L	H	HD21	LEU	V	52
R	H	O	ALA	A	75	L	H	HD22	LEU	V	52
R	H	N	VAL	A	76	L	H	CD2	LEU	V	52
R	H	N	VAL	A	76	L	H	HD21	LEU	V	52
R	H	N	VAL	A	76	L	H	HD22	LEU	V	52
R	H	CA	VAL	A	76	L	H	HD22	LEU	V	52
R	H	CB	VAL	A	76	L	H	HD22	LEU	V	52
R	H	CG2	VAL	A	76	L	H	CD2	LEU	V	52
R	H	CG2	VAL	A	76	L	H	HD13	LEU	V	52
R	H	CG2	VAL	A	76	L	H	HD22	LEU	V	52
R	H	CG2	VAL	A	76	L	H	HD23	LEU	V	52
R	H	CA	PRO	A	79	L	H	HD12	LEU	V	73
R	H	CA	PRO	A	79	L	H	HD13	LEU	V	73
R	H	CB	PRO	A	79	L	H	HD11	LEU	V	73
R	H	CB	PRO	A	79	L	H	HD12	LEU	V	73
R	H	CB	PRO	A	79	L	H	HD11	LEU	V	76
R	H	CB	PRO	A	79	L	H	HD12	LEU	V	76
R	H	CG	PRO	A	79	L	H	HG23	ILE	V	51
R	H	CG	PRO	A	79	L	H	HD13	ILE	V	51
R	H	CG	PRO	A	79	L	H	HD12	LEU	V	73
R	H	C	LEU	A	82	L	H	HG2	MET	V	77
R	H	O	LEU	A	82	L	H	HG2	MET	V	77
R	H	CD1	LEU	A	82	L	H	HD13	LEU	V	73
R	H	CD1	LEU	A	82	L	H	HD22	LEU	V	73
R	H	N	VAL	A	83	L	H	HG2	MET	V	77
R	H	CA	VAL	A	83	L	H	HA	MET	V	77
R	H	CA	VAL	A	83	L	H	HG2	MET	V	77
R	H	CA	VAL	A	83	L	H	CB	CYS	V	80
R	H	CA	VAL	A	83	L	H	HB2	CYS	V	80
R	H	CA	VAL	A	83	L	H	HB3	CYS	V	80
R	H	C	VAL	A	83	L	H	HB2	CYS	V	80
R	H	C	VAL	A	83	L	H	HB3	CYS	V	80
R	H	CB	VAL	A	83	L	H	HA	MET	V	77
R	H	CB	VAL	A	83	L	H	CB	CYS	V	80
R	H	CB	VAL	A	83	L	H	SG	CYS	V	80
R	H	CB	VAL	A	83	L	H	HB2	CYS	V	80
R	H	CB	VAL	A	83	L	H	HB3	CYS	V	80
R	H	CB	VAL	A	83	L	H	HG	CYS	V	80
R	H	O	VAL	A	83	L	H	CB	CYS	V	80
R	H	O	VAL	A	83	L	H	HB2	CYS	V	80
R	H	O	VAL	A	83	L	H	HB3	CYS	V	80
R	H	CG1	VAL	A	83	L	H	O	LEU	V	76
R	H	CG1	VAL	A	83	L	H	HA	MET	V	77
R	H	CG1	VAL	A	83	L	H	N	CYS	V	80
R	H	CG1	VAL	A	83	L	H	CA	CYS	V	80
R	H	CG1	VAL	A	83	L	H	C	CYS	V	80
R	H	CG1	VAL	A	83	L	H	CB	CYS	V	80
R	H	CG1	VAL	A	83	L	H	SG	CYS	V	80
R	H	CG1	VAL	A	83	L	H	H	CYS	V	80
R	H	CG1	VAL	A	83	L	H	HA	CYS	V	80
R	H	CG1	VAL	A	83	L	H	HB2	CYS	V	80
R	H	CG1	VAL	A	83	L	H	HB3	CYS	V	80
R	H	CG1	VAL	A	83	L	H	HG	CYS	V	80
R	H	CG2	VAL	A	83	L	H	C	LEU	V	76
R	H	CG2	VAL	A	83	L	H	O	LEU	V	76
R	H	CG2	VAL	A	83	L	H	HB3	LEU	V	76
R	H	CG2	VAL	A	83	L	H	N	MET	V	77
R	H	CG2	VAL	A	83	L	H	CA	MET	V	77
R	H	CG2	VAL	A	83	L	H	HA	MET	V	77
R	H	CG2	VAL	A	83	L	H	HG2	MET	V	77
R	H	CG2	VAL	A	83	L	H	HG3	MET	V	77
R	H	CG2	VAL	A	83	L	H	CB	CYS	V	80
R	H	CG2	VAL	A	83	L	H	SG	CYS	V	80
R	H	CG2	VAL	A	83	L	H	HB2	CYS	V	80
R	H	CG2	VAL	A	83	L	H	HB3	CYS	V	80
R	H	CG2	VAL	A	83	L	H	HG	CYS	V	80
R	H	C	LEU	A	85	L	H	CE2	PHE	V	108
R	H	C	LEU	A	85	L	H	CZ	PHE	V	108
R	H	C	LEU	A	85	L	H	HE2	PHE	V	108
R	H	C	LEU	A	85	L	H	HZ	PHE	V	108
R	H	O	LEU	A	85	L	H	CE2	PHE	V	108
R	H	O	LEU	A	85	L	H	CZ	PHE	V	108
R	H	O	LEU	A	85	L	H	HE2	PHE	V	108
R	H	O	LEU	A	85	L	H	HZ	PHE	V	108
R	H	N	SER	A	86	L	H	CE2	PHE	V	108
R	H	N	SER	A	86	L	H	CZ	PHE	V	108
R	H	N	SER	A	86	L	H	HE2	PHE	V	108
R	H	N	SER	A	86	L	H	HZ	PHE	V	108
R	H	CA	SER	A	86	L	H	CG2	VAL	V	81
R	H	CA	SER	A	86	L	H	HG21	VAL	V	81
R	H	CA	SER	A	86	L	H	HG22	VAL	V	81
R	H	CA	SER	A	86	L	H	HG23	VAL	V	81
R	H	CA	SER	A	86	L	H	CG	PHE	V	108
R	H	CA	SER	A	86	L	H	CD1	PHE	V	108
R	H	CA	SER	A	86	L	H	CD2	PHE	V	108
R	H	CA	SER	A	86	L	H	CE1	PHE	V	108
R	H	CA	SER	A	86	L	H	CE2	PHE	V	108
R	H	CA	SER	A	86	L	H	CZ	PHE	V	108
R	H	CA	SER	A	86	L	H	HD2	PHE	V	108
R	H	CA	SER	A	86	L	H	HE2	PHE	V	108
R	H	CA	SER	A	86	L	H	HZ	PHE	V	108
R	H	C	SER	A	86	L	H	CG2	VAL	V	81
R	H	C	SER	A	86	L	H	HA	VAL	V	81
R	H	C	SER	A	86	L	H	HG13	VAL	V	81
R	H	C	SER	A	86	L	H	HG21	VAL	V	81
R	H	C	SER	A	86	L	H	HG22	VAL	V	81
R	H	C	SER	A	86	L	H	HG23	VAL	V	81
R	H	C	SER	A	86	L	H	HG21	ILE	V	104
R	H	C	SER	A	86	L	H	CD2	PHE	V	108
R	H	C	SER	A	86	L	H	CE2	PHE	V	108
R	H	C	SER	A	86	L	H	HD2	PHE	V	108
R	H	C	SER	A	86	L	H	HE2	PHE	V	108
R	H	CB	SER	A	86	L	H	CG2	VAL	V	81
R	H	CB	SER	A	86	L	H	HG21	VAL	V	81
R	H	CB	SER	A	86	L	H	HG22	VAL	V	81
R	H	CB	SER	A	86	L	H	HG23	VAL	V	81
R	H	CB	SER	A	86	L	H	CG	PHE	V	108
R	H	CB	SER	A	86	L	H	CD1	PHE	V	108
R	H	CB	SER	A	86	L	H	CD2	PHE	V	108
R	H	CB	SER	A	86	L	H	CE1	PHE	V	108
R	H	CB	SER	A	86	L	H	CE2	PHE	V	108
R	H	CB	SER	A	86	L	H	CZ	PHE	V	108
R	H	CB	SER	A	86	L	H	HB3	PHE	V	108
R	H	CB	SER	A	86	L	H	HD1	PHE	V	108
R	H	CB	SER	A	86	L	H	HD2	PHE	V	108
R	H	CB	SER	A	86	L	H	HE1	PHE	V	108
R	H	CB	SER	A	86	L	H	HE2	PHE	V	108
R	H	CB	SER	A	86	L	H	HZ	PHE	V	108
R	H	O	SER	A	86	L	H	CB	VAL	V	81
R	H	O	SER	A	86	L	H	CG1	VAL	V	81
R	H	O	SER	A	86	L	H	CG2	VAL	V	81
R	H	O	SER	A	86	L	H	HA	VAL	V	81
R	H	O	SER	A	86	L	H	HG12	VAL	V	81
R	H	O	SER	A	86	L	H	HG13	VAL	V	81
R	H	O	SER	A	86	L	H	HG21	VAL	V	81
R	H	O	SER	A	86	L	H	HG22	VAL	V	81
R	H	O	SER	A	86	L	H	HG23	VAL	V	81
R	H	O	SER	A	86	L	H	CG2	ILE	V	104
R	H	O	SER	A	86	L	H	HG21	ILE	V	104
R	H	O	SER	A	86	L	H	HG22	ILE	V	104
R	H	O	SER	A	86	L	H	HG23	ILE	V	104
R	H	O	SER	A	86	L	H	HA	GLN	V	105
R	H	O	SER	A	86	L	H	CB	PHE	V	108
R	H	O	SER	A	86	L	H	CG	PHE	V	108
R	H	O	SER	A	86	L	H	CD2	PHE	V	108
R	H	O	SER	A	86	L	H	CE2	PHE	V	108
R	H	O	SER	A	86	L	H	HB2	PHE	V	108
R	H	O	SER	A	86	L	H	HD2	PHE	V	108
R	H	O	SER	A	86	L	H	HE2	PHE	V	108
R	H	OG	SER	A	86	L	H	O	MET	V	77
R	H	OG	SER	A	86	L	H	HA	MET	V	77
R	H	OG	SER	A	86	L	H	HB2	MET	V	77
R	H	OG	SER	A	86	L	H	HG2	MET	V	77
R	H	OG	SER	A	86	L	H	CG2	VAL	V	81
R	H	OG	SER	A	86	L	H	HG21	VAL	V	81
R	H	OG	SER	A	86	L	H	HG22	VAL	V	81
R	H	OG	SER	A	86	L	H	HG23	VAL	V	81
R	-	N	THR	A	87	L	H	CG2	VAL	V	81
R	-	N	THR	A	87	L	H	HA	VAL	V	81
R	-	N	THR	A	87	L	H	HG21	VAL	V	81
R	-	N	THR	A	87	L	H	HG22	VAL	V	81
R	-	CA	THR	A	87	L	H	CA	VAL	V	81
R	-	CA	THR	A	87	L	H	CG2	VAL	V	81
R	-	CA	THR	A	87	L	H	HA	VAL	V	81
R	-	CA	THR	A	87	L	H	HG13	VAL	V	81
R	-	CA	THR	A	87	L	H	HG22	VAL	V	81
R	-	CB	THR	A	87	L	H	C	CYS	V	80
R	-	CB	THR	A	87	L	H	O	CYS	V	80
R	-	CB	THR	A	87	L	H	HB2	CYS	V	80
R	-	CB	THR	A	87	L	H	N	VAL	V	81
R	-	CB	THR	A	87	L	H	CA	VAL	V	81
R	-	CB	THR	A	87	L	H	C	VAL	V	81
R	-	CB	THR	A	87	L	H	O	VAL	V	81
R	-	CB	THR	A	87	L	H	CG2	VAL	V	81
R	-	CB	THR	A	87	L	H	HA	VAL	V	81
R	-	CB	THR	A	87	L	H	HG21	VAL	V	81
R	-	CB	THR	A	87	L	H	HG22	VAL	V	81
R	-	CG2	THR	A	87	L	H	CA	CYS	V	80
R	-	CG2	THR	A	87	L	H	C	CYS	V	80
R	-	CG2	THR	A	87	L	H	CB	CYS	V	80
R	-	CG2	THR	A	87	L	H	O	CYS	V	80
R	-	CG2	THR	A	87	L	H	HB2	CYS	V	80
R	-	CG2	THR	A	87	L	H	HB3	CYS	V	80
R	-	CG2	THR	A	87	L	H	N	VAL	V	81
R	-	CG2	THR	A	87	L	H	CA	VAL	V	81
R	-	CG2	THR	A	87	L	H	C	VAL	V	81
R	-	CG2	THR	A	87	L	H	CB	VAL	V	81
R	-	CG2	THR	A	87	L	H	O	VAL	V	81
R	-	CG2	THR	A	87	L	H	CG1	VAL	V	81
R	-	CG2	THR	A	87	L	H	CG2	VAL	V	81
R	-	CG2	THR	A	87	L	H	H	VAL	V	81
R	-	CG2	THR	A	87	L	H	HA	VAL	V	81
R	-	CG2	THR	A	87	L	H	HB	VAL	V	81
R	-	CG2	THR	A	87	L	H	HG13	VAL	V	81
R	-	CG2	THR	A	87	L	H	HG21	VAL	V	81
R	-	CG2	THR	A	87	L	H	HG22	VAL	V	81
R	-	CG2	THR	A	87	L	H	HG23	VAL	V	81
R	-	OG1	THR	A	87	L	H	C	CYS	V	80
R	-	OG1	THR	A	87	L	H	O	CYS	V	80
R	-	OG1	THR	A	87	L	H	HB2	CYS	V	80
R	-	OG1	THR	A	87	L	H	HA	VAL	V	81
R	-	CG	GLU	A	88	L	-	HD11	ILE	V	97
R	-	CG	GLU	A	88	L	H	CA	GLY	V	101
R	-	CG	GLU	A	88	L	H	C	GLY	V	101
R	-	CG	GLU	A	88	L	H	O	GLY	V	101
R	-	CG	GLU	A	88	L	H	HA2	GLY	V	101
R	-	CG	GLU	A	88	L	H	HA3	GLY	V	101
R	-	CD	GLU	A	88	L	-	CG1	ILE	V	97
R	-	CD	GLU	A	88	L	-	CD1	ILE	V	97
R	-	CD	GLU	A	88	L	-	HG12	ILE	V	97
R	-	CD	GLU	A	88	L	-	HG13	ILE	V	97
R	-	CD	GLU	A	88	L	-	HD11	ILE	V	97
R	-	CD	GLU	A	88	L	-	HD12	ILE	V	97
R	-	CD	GLU	A	88	L	H	N	GLY	V	101
R	-	CD	GLU	A	88	L	H	CA	GLY	V	101
R	-	CD	GLU	A	88	L	H	C	GLY	V	101
R	-	CD	GLU	A	88	L	H	O	GLY	V	101
R	-	CD	GLU	A	88	L	H	HA2	GLY	V	101
R	-	CD	GLU	A	88	L	H	HA3	GLY	V	101
R	-	CD	GLU	A	88	L	H	N	CYS	V	102
R	-	OE1	GLU	A	88	L	-	CG1	ILE	V	97
R	-	OE1	GLU	A	88	L	-	CD1	ILE	V	97
R	-	OE1	GLU	A	88	L	-	HG12	ILE	V	97
R	-	OE1	GLU	A	88	L	-	HG13	ILE	V	97
R	-	OE1	GLU	A	88	L	-	HD11	ILE	V	97
R	-	OE1	GLU	A	88	L	-	HD12	ILE	V	97
R	-	OE1	GLU	A	88	L	-	HD13	ILE	V	97
R	-	OE1	GLU	A	88	L	-	O	SER	V	98
R	-	OE1	GLU	A	88	L	H	C	SER	V	100
R	-	OE1	GLU	A	88	L	H	N	GLY	V	101
R	-	OE1	GLU	A	88	L	H	CA	GLY	V	101
R	-	OE1	GLU	A	88	L	H	C	GLY	V	101
R	-	OE1	GLU	A	88	L	H	O	GLY	V	101
R	-	OE1	GLU	A	88	L	H	H	GLY	V	101
R	-	OE1	GLU	A	88	L	H	HA2	GLY	V	101
R	-	OE1	GLU	A	88	L	H	HA3	GLY	V	101
R	-	OE1	GLU	A	88	L	H	N	CYS	V	102
R	-	OE1	GLU	A	88	L	H	CA	CYS	V	102
R	-	OE1	GLU	A	88	L	H	H	CYS	V	102
R	-	OE1	GLU	A	88	L	H	HA	CYS	V	102
R	-	OE2	GLU	A	88	L	H	HG2	LYS	V	85
R	-	OE2	GLU	A	88	L	H	HE2	LYS	V	85
R	-	OE2	GLU	A	88	L	-	CB	ILE	V	97
R	-	OE2	GLU	A	88	L	-	CG1	ILE	V	97
R	-	OE2	GLU	A	88	L	-	CD1	ILE	V	97
R	-	OE2	GLU	A	88	L	-	HA	ILE	V	97
R	-	OE2	GLU	A	88	L	-	HB	ILE	V	97
R	-	OE2	GLU	A	88	L	-	HG12	ILE	V	97
R	-	OE2	GLU	A	88	L	-	HG13	ILE	V	97
R	-	OE2	GLU	A	88	L	-	HD11	ILE	V	97
R	-	OE2	GLU	A	88	L	-	HD12	ILE	V	97
R	-	OE2	GLU	A	88	L	-	H	SER	V	98
R	-	OE2	GLU	A	88	L	H	CA	GLY	V	101
R	-	OE2	GLU	A	88	L	H	C	GLY	V	101
R	-	OE2	GLU	A	88	L	H	HA2	GLY	V	101
R	-	OE2	GLU	A	88	L	H	HA3	GLY	V	101
R	-	CA	LYS	A	89	L	H	HB2	PRO	V	84
R	-	C	LYS	A	89	L	H	CB	PRO	V	84
R	-	C	LYS	A	89	L	H	HB2	PRO	V	84
R	-	C	LYS	A	89	L	H	HB3	PRO	V	84
R	-	C	LYS	A	89	L	H	HG3	PRO	V	84
R	-	CB	LYS	A	89	L	H	HB2	PRO	V	84
R	-	CB	LYS	A	89	L	H	HG23	VAL	V	88
R	-	O	LYS	A	89	L	H	O	CYS	V	80
R	-	O	LYS	A	89	L	H	CA	PRO	V	84
R	-	O	LYS	A	89	L	H	C	PRO	V	84
R	-	O	LYS	A	89	L	H	CB	PRO	V	84
R	-	O	LYS	A	89	L	H	CG	PRO	V	84
R	-	O	LYS	A	89	L	H	HB2	PRO	V	84
R	-	O	LYS	A	89	L	H	HB3	PRO	V	84
R	-	O	LYS	A	89	L	H	HG2	PRO	V	84
R	-	O	LYS	A	89	L	H	HG3	PRO	V	84
R	-	O	LYS	A	89	L	H	HD3	PRO	V	84
R	-	O	LYS	A	89	L	H	N	LYS	V	85
R	-	O	LYS	A	89	L	H	H	LYS	V	85
R	-	CD	LYS	A	89	L	H	HD3	LYS	V	85
R	-	CD	LYS	A	89	L	H	CG1	VAL	V	88
R	-	CD	LYS	A	89	L	H	HB	VAL	V	88
R	-	CD	LYS	A	89	L	H	HG12	VAL	V	88
R	-	CD	LYS	A	89	L	H	HG23	VAL	V	88
R	-	CE	LYS	A	89	L	H	HZ3	LYS	V	85
R	-	CE	LYS	A	89	L	H	HG12	VAL	V	88
R	-	NZ	LYS	A	89	L	H	HZ3	LYS	V	85
R	-	NZ	LYS	A	89	L	H	CG1	VAL	V	88
R	-	NZ	LYS	A	89	L	H	HG11	VAL	V	88
R	-	NZ	LYS	A	89	L	H	HG12	VAL	V	88
R	S	N	THR	A	90	L	H	HB2	PRO	V	84
R	S	N	THR	A	90	L	H	HB3	PRO	V	84
R	S	N	THR	A	90	L	H	HG3	PRO	V	84
R	S	CA	THR	A	90	L	H	CB	PRO	V	84
R	S	CA	THR	A	90	L	H	CG	PRO	V	84
R	S	CA	THR	A	90	L	H	HB2	PRO	V	84
R	S	CA	THR	A	90	L	H	HB3	PRO	V	84
R	S	CA	THR	A	90	L	H	HG3	PRO	V	84
R	S	C	THR	A	90	L	H	HB3	PRO	V	84
R	S	C	THR	A	90	L	H	HG2	PRO	V	84
R	S	C	THR	A	90	L	H	HG3	PRO	V	84
R	S	CB	THR	A	90	L	H	HG3	PRO	V	84
R	S	CG2	THR	A	90	L	H	SG	CYS	V	80
R	S	CG2	THR	A	90	L	H	HB2	CYS	V	80
R	S	OG1	THR	A	90	L	H	HB2	CYS	V	80
R	S	N	MET	A	91	L	H	HZ	PHE	V	40
R	S	N	MET	A	91	L	H	CB	PRO	V	84
R	S	N	MET	A	91	L	H	CG	PRO	V	84
R	S	N	MET	A	91	L	H	HB3	PRO	V	84
R	S	N	MET	A	91	L	H	HG2	PRO	V	84
R	S	N	MET	A	91	L	H	HG3	PRO	V	84
R	S	CA	MET	A	91	L	H	HE1	PHE	V	40
R	S	CA	MET	A	91	L	H	HB3	PRO	V	84
R	S	CA	MET	A	91	L	H	HG2	PRO	V	84
R	S	C	MET	A	91	L	H	HE1	PHE	V	40
R	S	C	MET	A	91	L	H	HZ	PHE	V	40
R	S	CB	MET	A	91	L	H	HE1	PHE	V	40
R	S	CB	MET	A	91	L	H	HZ	PHE	V	40
R	S	CB	MET	A	91	L	H	HA	PRO	V	84
R	S	CB	MET	A	91	L	H	HB3	PRO	V	84
R	S	CB	MET	A	91	L	H	HG2	PRO	V	84
R	S	O	MET	A	91	L	H	CE1	PHE	V	40
R	S	O	MET	A	91	L	H	CZ	PHE	V	40
R	S	O	MET	A	91	L	H	HE1	PHE	V	40
R	S	O	MET	A	91	L	H	HZ	PHE	V	40
R	S	O	MET	A	91	L	H	CD1	LEU	V	44
R	S	O	MET	A	91	L	H	HD12	LEU	V	44
R	S	O	MET	A	91	L	H	HD13	LEU	V	44
R	S	O	MET	A	91	L	H	HG2	PRO	V	84
R	S	CG	MET	A	91	L	H	CA	PRO	V	84
R	S	CG	MET	A	91	L	H	CB	PRO	V	84
R	S	CG	MET	A	91	L	H	HA	PRO	V	84
R	S	CG	MET	A	91	L	H	HB3	PRO	V	84
R	S	CG	MET	A	91	L	H	HG2	PRO	V	84
R	S	CG	MET	A	91	L	H	CG2	VAL	V	88
R	S	CG	MET	A	91	L	H	HG21	VAL	V	88
R	S	CG	MET	A	91	L	H	HG23	VAL	V	88
R	S	SD	MET	A	91	L	H	HB3	PRO	V	84
R	S	SD	MET	A	91	L	H	CG2	VAL	V	88
R	S	SD	MET	A	91	L	H	HG21	VAL	V	88
R	S	SD	MET	A	91	L	H	HG22	VAL	V	88
R	S	SD	MET	A	91	L	H	HG23	VAL	V	88
R	S	CE	MET	A	91	L	H	CG2	VAL	V	88
R	S	CE	MET	A	91	L	H	HG21	VAL	V	88
R	S	CE	MET	A	91	L	H	HG22	VAL	V	88
R	S	CE	MET	A	91	L	H	HG23	VAL	V	88
R	S	N	SER	A	93	L	H	CD2	LEU	V	41
R	S	N	SER	A	93	L	H	HD21	LEU	V	41
R	S	N	SER	A	93	L	H	HD22	LEU	V	41
R	S	N	SER	A	93	L	H	HD23	LEU	V	41
R	S	CA	SER	A	93	L	H	CD2	LEU	V	41
R	S	CA	SER	A	93	L	H	HD22	LEU	V	41
R	S	CA	SER	A	93	L	H	HD23	LEU	V	41
R	S	CB	SER	A	93	L	H	CG	LEU	V	41
R	S	CB	SER	A	93	L	H	CD1	LEU	V	41
R	S	CB	SER	A	93	L	H	CD2	LEU	V	41
R	S	CB	SER	A	93	L	H	HD11	LEU	V	41
R	S	CB	SER	A	93	L	H	HD12	LEU	V	41
R	S	CB	SER	A	93	L	H	HD21	LEU	V	41
R	S	CB	SER	A	93	L	H	HD22	LEU	V	41
R	S	CB	SER	A	93	L	H	HD23	LEU	V	41
R	S	OG	SER	A	93	L	H	CD2	LEU	V	41
R	S	OG	SER	A	93	L	H	HD12	LEU	V	41
R	S	OG	SER	A	93	L	H	HD21	LEU	V	41
R	S	OG	SER	A	93	L	H	HD22	LEU	V	41
R	S	OG	SER	A	93	L	H	HD23	LEU	V	41
R	H	CG	TYR	A	102	L	H	NH2	ARG	V	313
R	H	CG	TYR	A	102	L	H	HH21	ARG	V	313
R	H	CG	TYR	A	102	L	H	HH22	ARG	V	313
R	H	CD1	TYR	A	102	L	H	NH2	ARG	V	313
R	H	CD1	TYR	A	102	L	H	HH21	ARG	V	313
R	H	CD1	TYR	A	102	L	H	HH22	ARG	V	313
R	H	CD2	TYR	A	102	L	H	HH21	ARG	V	313
R	H	CE1	TYR	A	102	L	H	NE	ARG	V	313
R	H	CE1	TYR	A	102	L	H	NH2	ARG	V	313
R	H	CE1	TYR	A	102	L	H	CZ	ARG	V	313
R	H	CE1	TYR	A	102	L	H	HE	ARG	V	313
R	H	CE1	TYR	A	102	L	H	HH21	ARG	V	313
R	H	CE1	TYR	A	102	L	H	HH22	ARG	V	313
R	H	CE2	TYR	A	102	L	H	HH21	ARG	V	313
R	H	OH	TYR	A	102	L	H	NH2	ARG	V	313
R	H	OH	TYR	A	102	L	H	HE	ARG	V	313
R	H	OH	TYR	A	102	L	H	HH21	ARG	V	313
R	H	CZ	TYR	A	102	L	H	NH2	ARG	V	313
R	H	CZ	TYR	A	102	L	H	HE	ARG	V	313
R	H	CZ	TYR	A	102	L	H	HH21	ARG	V	313
R	H	CZ	TYR	A	102	L	H	HH22	ARG	V	313
R	H	CE2	PHE	A	103	L	H	HH12	ARG	V	313
R	H	CZ	PHE	A	103	L	H	NH1	ARG	V	313
R	H	CZ	PHE	A	103	L	H	CZ	ARG	V	313
R	H	CZ	PHE	A	103	L	H	HH11	ARG	V	313
R	H	CZ	PHE	A	103	L	H	HH12	ARG	V	313
R	H	CZ	PHE	A	103	L	H	HH22	ARG	V	313
R	H	CB	TRP	A	149	L	H	NE2	GLN	V	316
R	H	CB	TRP	A	149	L	H	HE21	GLN	V	316
R	H	CB	TRP	A	149	L	H	HE22	GLN	V	316
R	H	CG	TRP	A	149	L	H	HE21	GLN	V	316
R	H	CG	TRP	A	149	L	H	HE22	GLN	V	316
R	H	CD2	TRP	A	149	L	H	NE2	GLN	V	316
R	H	CD2	TRP	A	149	L	H	HE21	GLN	V	316
R	H	CD2	TRP	A	149	L	H	HE22	GLN	V	316
R	H	CE3	TRP	A	149	L	H	NE2	GLN	V	316
R	H	CE3	TRP	A	149	L	H	HE21	GLN	V	316
R	H	CE3	TRP	A	149	L	H	HE22	GLN	V	316
R	H	CZ3	TRP	A	149	L	H	HE22	GLN	V	316
R	H	CB	ILE	A	153	L	H	HB3	GLN	V	316
R	H	CG1	ILE	A	153	L	H	CB	GLN	V	316
R	H	CG1	ILE	A	153	L	H	CD	GLN	V	316
R	H	CG1	ILE	A	153	L	H	OE1	GLN	V	316
R	H	CG1	ILE	A	153	L	H	HB2	GLN	V	316
R	H	CG1	ILE	A	153	L	H	HB3	GLN	V	316
R	H	CG2	ILE	A	153	L	H	O	GLN	V	316
R	H	CG2	ILE	A	153	L	H	HB3	GLN	V	316
R	H	CG2	ILE	A	153	L	-	HA	GLU	V	317
R	H	CG2	ILE	A	153	L	-	HG2	GLU	V	317
R	H	CG2	ILE	A	153	L	-	HG3	GLU	V	317
R	H	CD1	ILE	A	153	L	H	CA	GLN	V	316
R	H	CD1	ILE	A	153	L	H	C	GLN	V	316
R	H	CD1	ILE	A	153	L	H	CB	GLN	V	316
R	H	CD1	ILE	A	153	L	H	O	GLN	V	316
R	H	CD1	ILE	A	153	L	H	CG	GLN	V	316
R	H	CD1	ILE	A	153	L	H	CD	GLN	V	316
R	H	CD1	ILE	A	153	L	H	NE2	GLN	V	316
R	H	CD1	ILE	A	153	L	H	OE1	GLN	V	316
R	H	CD1	ILE	A	153	L	H	HA	GLN	V	316
R	H	CD1	ILE	A	153	L	H	HB2	GLN	V	316
R	H	CD1	ILE	A	153	L	H	HB3	GLN	V	316
R	H	CD1	ILE	A	153	L	H	HG2	GLN	V	316
R	H	CD1	ILE	A	153	L	H	HG3	GLN	V	316
R	H	CD1	ILE	A	153	L	H	HE21	GLN	V	316
R	H	CD1	ILE	A	153	L	H	HE22	GLN	V	316
R	H	CA	TRP	A	305	L	H	HH22	ARG	V	144
R	H	C	TRP	A	305	L	H	HH22	ARG	V	144
R	H	CB	TRP	A	305	L	H	HH22	ARG	V	144
R	H	O	TRP	A	305	L	H	HH22	ARG	V	144
R	H	CG	TRP	A	305	L	H	NH2	ARG	V	144
R	H	CG	TRP	A	305	L	H	HH21	ARG	V	144
R	H	CG	TRP	A	305	L	H	HH22	ARG	V	144
R	H	CD1	TRP	A	305	L	H	NH1	ARG	V	144
R	H	CD1	TRP	A	305	L	H	NH2	ARG	V	144
R	H	CD1	TRP	A	305	L	H	CZ	ARG	V	144
R	H	CD1	TRP	A	305	L	H	HH12	ARG	V	144
R	H	CD1	TRP	A	305	L	H	HH21	ARG	V	144
R	H	CD1	TRP	A	305	L	H	HH22	ARG	V	144
R	H	CD2	TRP	A	305	L	H	HH22	ARG	V	144
R	H	CE2	TRP	A	305	L	H	HH22	ARG	V	144
R	H	NE1	TRP	A	305	L	H	NH1	ARG	V	144
R	H	NE1	TRP	A	305	L	H	NH2	ARG	V	144
R	H	NE1	TRP	A	305	L	H	CZ	ARG	V	144
R	H	NE1	TRP	A	305	L	H	HH12	ARG	V	144
R	H	NE1	TRP	A	305	L	H	HH21	ARG	V	144
R	H	NE1	TRP	A	305	L	H	HH22	ARG	V	144
R	H	NZ	LYS	A	308	L	-	HB2	ASN	V	142
R	H	NZ	LYS	A	308	L	H	HB3	GLN	V	143
R	H	NZ	LYS	A	308	L	H	HG3	ARG	V	144
R	H	CG2	VAL	A	309	L	H	HH12	ARG	V	144
R	H	O	LEU	A	311	L	H	CD2	LEU	V	139
R	H	O	LEU	A	311	L	H	HD22	LEU	V	139
R	H	O	LEU	A	311	L	H	HD23	LEU	V	139
R	H	CD2	LEU	A	311	L	H	HD23	LEU	V	139
R	H	CD2	HIS	A	312	L	-	HD22	ASN	V	142
R	H	ND1	HIS	A	312	L	-	HD22	ASN	V	142
R	H	CE1	HIS	A	312	L	H	O	LEU	V	139
R	H	CE1	HIS	A	312	L	H	HA	LEU	V	139
R	H	CE1	HIS	A	312	L	-	ND2	ASN	V	142
R	H	CE1	HIS	A	312	L	-	HD21	ASN	V	142
R	H	CE1	HIS	A	312	L	-	HD22	ASN	V	142
R	H	NE2	HIS	A	312	L	-	CG	ASN	V	142
R	H	NE2	HIS	A	312	L	-	ND2	ASN	V	142
R	H	NE2	HIS	A	312	L	-	HD21	ASN	V	142
R	H	NE2	HIS	A	312	L	-	HD22	ASN	V	142

- 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