IID

P58181_Q8NGD4.1 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	H	TYR	A	102	L	H	GLY	V	96
R	H	PHE	A	103	L	H	ASN	V	75
R	H	PHE	A	103	L	-	PHE	V	76
R	H	PHE	A	107	L	H	PRO	V	79
R	H	PHE	A	107	L	H	VAL	V	83
R	H	MET	A	142	L	-	GLU	V	88
R	H	VAL	A	145	L	-	ILE	V	87
R	H	ILE	A	146	L	-	ILE	V	87
R	H	ILE	A	146	L	-	GLU	V	88
R	H	ILE	A	146	L	-	ARG	V	89
R	H	TRP	A	149	L	H	VAL	V	83
R	H	TRP	A	149	L	-	ILE	V	87
R	H	ILE	A	150	L	S	THR	V	91
R	H	ILE	A	153	L	H	LYS	V	80
R	H	ILE	A	153	L	S	THR	V	91
R	H	ILE	A	153	L	S	ILE	V	92
R	H	ILE	A	153	L	S	SER	V	93
R	H	THR	A	157	L	S	SER	V	93
R	H	THR	A	157	L	H	GLU	V	95
R	H	THR	A	157	L	H	GLY	V	96
R	H	VAL	A	158	L	H	GLU	V	95
R	H	THR	A	161	L	H	GLU	V	95
R	H	VAL	A	25	L	H	PHE	V	51
R	H	PHE	A	28	L	H	VAL	V	47
R	H	PHE	A	28	L	H	PHE	V	51
R	H	LEU	A	32	L	H	VAL	V	43
R	H	LEU	A	32	L	H	VAL	V	47
R	H	VAL	A	33	L	H	HIS	V	305
R	H	TYR	A	35	L	H	VAL	V	39
R	H	TYR	A	35	L	H	LEU	V	40
R	H	TYR	A	35	L	H	VAL	V	43
R	H	VAL	A	36	L	H	LEU	V	40
R	H	LEU	A	39	L	H	VAL	V	36
R	H	LEU	A	39	L	H	LEU	V	40
R	H	THR	A	46	L	H	PHE	V	28
R	H	SER	A	50	L	H	LEU	V	25
R	H	SER	A	50	L	H	PHE	V	28
R	H	SER	A	50	L	H	PHE	V	86
R	H	LEU	A	64	L	H	PHE	V	86
R	H	ASN	A	65	L	H	PHE	V	86
R	H	VAL	A	68	L	H	PHE	V	28
R	H	VAL	A	68	L	H	VAL	V	83
R	H	VAL	A	68	L	H	PHE	V	86
R	H	VAL	A	71	L	H	TYR	V	35
R	H	SER	A	72	L	H	PRO	V	79
R	H	ALA	A	75	L	H	TYR	V	35
R	H	ALA	A	75	L	H	VAL	V	39
R	H	ALA	A	75	L	H	ASN	V	75
R	H	VAL	A	76	L	H	ASN	V	75
R	H	PRO	A	79	L	H	VAL	V	39
R	H	PRO	A	79	L	H	VAL	V	43
R	H	PRO	A	79	L	H	ILE	V	71
R	H	GLU	A	80	L	H	PHE	V	68
R	H	LEU	A	82	L	H	VAL	V	43
R	H	VAL	A	83	L	H	ILE	V	46
R	H	VAL	A	83	L	H	PHE	V	68
R	H	SER	A	86	L	H	ILE	V	46
R	H	SER	A	86	L	H	VAL	V	47
R	H	SER	A	86	L	H	SER	V	50
R	-	THR	A	87	L	H	SER	V	50
R	S	ILE	A	92	L	H	PHE	V	68
R	S	SER	A	93	L	H	PHE	V	107
R	S	SER	A	93	L	H	TRP	V	149
R	H	VAL	A	95	L	H	PHE	V	102
R	H	VAL	A	95	L	H	VAL	V	103
R	H	VAL	A	95	L	H	SER	V	106
R	H	VAL	A	95	L	H	VAL	V	153
R	H	GLY	A	96	L	H	PHE	V	107
R	H	PHE	A	98	L	H	ALA	V	99
R	H	ALA	A	99	L	H	VAL	V	103

- 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_Q8NGD4.1 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	H	CA	VAL	A	25	L	H	CE1	PHE	V	51
R	H	CA	VAL	A	25	L	H	HE1	PHE	V	51
R	H	CA	VAL	A	25	L	H	HZ	PHE	V	51
R	H	C	VAL	A	25	L	H	HZ	PHE	V	51
R	H	CB	VAL	A	25	L	H	CE1	PHE	V	51
R	H	CB	VAL	A	25	L	H	HE1	PHE	V	51
R	H	O	VAL	A	25	L	H	HZ	PHE	V	51
R	H	CG1	VAL	A	25	L	H	CE1	PHE	V	51
R	H	CG1	VAL	A	25	L	H	HD1	PHE	V	51
R	H	CG1	VAL	A	25	L	H	HE1	PHE	V	51
R	H	CG1	VAL	A	25	L	H	HZ	PHE	V	51
R	H	CG2	VAL	A	25	L	H	CE1	PHE	V	51
R	H	CG2	VAL	A	25	L	H	HE1	PHE	V	51
R	H	CB	PHE	A	28	L	H	CE2	PHE	V	51
R	H	CB	PHE	A	28	L	H	CZ	PHE	V	51
R	H	CB	PHE	A	28	L	H	HE2	PHE	V	51
R	H	CB	PHE	A	28	L	H	HZ	PHE	V	51
R	H	CG	PHE	A	28	L	H	HG12	VAL	V	47
R	H	CG	PHE	A	28	L	H	HG23	VAL	V	47
R	H	CG	PHE	A	28	L	H	CE2	PHE	V	51
R	H	CG	PHE	A	28	L	H	CZ	PHE	V	51
R	H	CG	PHE	A	28	L	H	HE2	PHE	V	51
R	H	CG	PHE	A	28	L	H	HZ	PHE	V	51
R	H	CD1	PHE	A	28	L	H	CG1	VAL	V	47
R	H	CD1	PHE	A	28	L	H	HG12	VAL	V	47
R	H	CD1	PHE	A	28	L	H	HG13	VAL	V	47
R	H	CD1	PHE	A	28	L	H	HG23	VAL	V	47
R	H	CD1	PHE	A	28	L	H	CD2	PHE	V	51
R	H	CD1	PHE	A	28	L	H	CE2	PHE	V	51
R	H	CD1	PHE	A	28	L	H	CZ	PHE	V	51
R	H	CD1	PHE	A	28	L	H	HE2	PHE	V	51
R	H	CD1	PHE	A	28	L	H	HZ	PHE	V	51
R	H	CD2	PHE	A	28	L	H	CG2	VAL	V	47
R	H	CD2	PHE	A	28	L	H	HG12	VAL	V	47
R	H	CD2	PHE	A	28	L	H	HG23	VAL	V	47
R	H	CD2	PHE	A	28	L	H	CE2	PHE	V	51
R	H	CD2	PHE	A	28	L	H	CZ	PHE	V	51
R	H	CD2	PHE	A	28	L	H	HE2	PHE	V	51
R	H	CD2	PHE	A	28	L	H	HZ	PHE	V	51
R	H	CE1	PHE	A	28	L	H	CB	VAL	V	47
R	H	CE1	PHE	A	28	L	H	CG1	VAL	V	47
R	H	CE1	PHE	A	28	L	H	CG2	VAL	V	47
R	H	CE1	PHE	A	28	L	H	HG11	VAL	V	47
R	H	CE1	PHE	A	28	L	H	HG12	VAL	V	47
R	H	CE1	PHE	A	28	L	H	HG13	VAL	V	47
R	H	CE1	PHE	A	28	L	H	HG22	VAL	V	47
R	H	CE1	PHE	A	28	L	H	HG23	VAL	V	47
R	H	CE1	PHE	A	28	L	H	CD2	PHE	V	51
R	H	CE1	PHE	A	28	L	H	CE2	PHE	V	51
R	H	CE1	PHE	A	28	L	H	HD2	PHE	V	51
R	H	CE1	PHE	A	28	L	H	HE2	PHE	V	51
R	H	CE2	PHE	A	28	L	H	CA	VAL	V	47
R	H	CE2	PHE	A	28	L	H	CB	VAL	V	47
R	H	CE2	PHE	A	28	L	H	CG1	VAL	V	47
R	H	CE2	PHE	A	28	L	H	CG2	VAL	V	47
R	H	CE2	PHE	A	28	L	H	HA	VAL	V	47
R	H	CE2	PHE	A	28	L	H	HG12	VAL	V	47
R	H	CE2	PHE	A	28	L	H	HG13	VAL	V	47
R	H	CE2	PHE	A	28	L	H	HG21	VAL	V	47
R	H	CE2	PHE	A	28	L	H	HG22	VAL	V	47
R	H	CE2	PHE	A	28	L	H	HG23	VAL	V	47
R	H	CE2	PHE	A	28	L	H	CE2	PHE	V	51
R	H	CE2	PHE	A	28	L	H	HE2	PHE	V	51
R	H	CZ	PHE	A	28	L	H	CA	VAL	V	47
R	H	CZ	PHE	A	28	L	H	CB	VAL	V	47
R	H	CZ	PHE	A	28	L	H	CG1	VAL	V	47
R	H	CZ	PHE	A	28	L	H	CG2	VAL	V	47
R	H	CZ	PHE	A	28	L	H	HA	VAL	V	47
R	H	CZ	PHE	A	28	L	H	HB	VAL	V	47
R	H	CZ	PHE	A	28	L	H	HG11	VAL	V	47
R	H	CZ	PHE	A	28	L	H	HG12	VAL	V	47
R	H	CZ	PHE	A	28	L	H	HG13	VAL	V	47
R	H	CZ	PHE	A	28	L	H	HG21	VAL	V	47
R	H	CZ	PHE	A	28	L	H	HG22	VAL	V	47
R	H	CZ	PHE	A	28	L	H	HG23	VAL	V	47
R	H	CZ	PHE	A	28	L	H	CE2	PHE	V	51
R	H	CZ	PHE	A	28	L	H	HD2	PHE	V	51
R	H	CZ	PHE	A	28	L	H	HE2	PHE	V	51
R	H	CD1	LEU	A	32	L	H	HG11	VAL	V	43
R	H	CD1	LEU	A	32	L	H	HG13	VAL	V	43
R	H	CD2	LEU	A	32	L	H	HG13	VAL	V	47
R	H	CG2	VAL	A	33	L	H	HE2	HIS	V	305
R	H	CD1	TYR	A	35	L	H	CD2	LEU	V	40
R	H	CD1	TYR	A	35	L	H	HD21	LEU	V	40
R	H	CD1	TYR	A	35	L	H	HD22	LEU	V	40
R	H	CD1	TYR	A	35	L	H	HD23	LEU	V	40
R	H	CE1	TYR	A	35	L	H	HG11	VAL	V	39
R	H	CE1	TYR	A	35	L	H	CD2	LEU	V	40
R	H	CE1	TYR	A	35	L	H	HD21	LEU	V	40
R	H	CE1	TYR	A	35	L	H	HD22	LEU	V	40
R	H	CE1	TYR	A	35	L	H	HD23	LEU	V	40
R	H	CE1	TYR	A	35	L	H	HG23	VAL	V	43
R	H	OH	TYR	A	35	L	H	CB	VAL	V	39
R	H	OH	TYR	A	35	L	H	CG1	VAL	V	39
R	H	OH	TYR	A	35	L	H	HB	VAL	V	39
R	H	OH	TYR	A	35	L	H	HG11	VAL	V	39
R	H	OH	TYR	A	35	L	H	HG12	VAL	V	39
R	H	OH	TYR	A	35	L	H	HG13	VAL	V	39
R	H	OH	TYR	A	35	L	H	HD21	LEU	V	40
R	H	CZ	TYR	A	35	L	H	HG11	VAL	V	39
R	H	CZ	TYR	A	35	L	H	HG12	VAL	V	39
R	H	CZ	TYR	A	35	L	H	CD2	LEU	V	40
R	H	CZ	TYR	A	35	L	H	HD21	LEU	V	40
R	H	CZ	TYR	A	35	L	H	HD23	LEU	V	40
R	H	CG2	VAL	A	36	L	H	HD22	LEU	V	40
R	H	CG	LEU	A	39	L	H	HD23	LEU	V	40
R	H	CD1	LEU	A	39	L	H	HG12	VAL	V	36
R	H	CD1	LEU	A	39	L	H	HG22	VAL	V	36
R	H	CD1	LEU	A	39	L	H	CG	LEU	V	40
R	H	CD1	LEU	A	39	L	H	CD2	LEU	V	40
R	H	CD1	LEU	A	39	L	H	HG	LEU	V	40
R	H	CD1	LEU	A	39	L	H	HD13	LEU	V	40
R	H	CD1	LEU	A	39	L	H	HD23	LEU	V	40
R	H	CD2	LEU	A	39	L	H	HG22	VAL	V	36
R	H	CB	THR	A	46	L	H	HE1	PHE	V	28
R	H	CB	THR	A	46	L	H	HZ	PHE	V	28
R	H	CG2	THR	A	46	L	H	CE1	PHE	V	28
R	H	CG2	THR	A	46	L	H	CZ	PHE	V	28
R	H	CG2	THR	A	46	L	H	HE1	PHE	V	28
R	H	CG2	THR	A	46	L	H	HZ	PHE	V	28
R	H	OG1	THR	A	46	L	H	HZ	PHE	V	28
R	H	CB	SER	A	50	L	H	HD23	LEU	V	25
R	H	O	SER	A	50	L	H	HD12	LEU	V	25
R	H	OG	SER	A	50	L	H	HD23	LEU	V	25
R	H	OG	SER	A	50	L	H	HE1	PHE	V	28
R	H	OG	SER	A	50	L	H	HE1	PHE	V	86
R	H	OG	SER	A	50	L	H	HZ	PHE	V	86
R	H	CD2	LEU	A	64	L	H	CD1	PHE	V	86
R	H	CD2	LEU	A	64	L	H	CE1	PHE	V	86
R	H	CD2	LEU	A	64	L	H	CZ	PHE	V	86
R	H	CD2	LEU	A	64	L	H	HD1	PHE	V	86
R	H	CD2	LEU	A	64	L	H	HE1	PHE	V	86
R	H	OD1	ASN	A	65	L	H	HB2	PHE	V	86
R	H	CB	VAL	A	68	L	H	HG22	VAL	V	83
R	H	CG1	VAL	A	68	L	H	CG2	VAL	V	83
R	H	CG1	VAL	A	68	L	H	HA	VAL	V	83
R	H	CG1	VAL	A	68	L	H	HG21	VAL	V	83
R	H	CG1	VAL	A	68	L	H	HG22	VAL	V	83
R	H	CG2	VAL	A	68	L	H	HE2	PHE	V	28
R	H	CG2	VAL	A	68	L	H	HZ	PHE	V	28
R	H	CG2	VAL	A	68	L	H	HE2	PHE	V	86
R	H	O	VAL	A	71	L	H	HE1	TYR	V	35
R	H	CG1	VAL	A	71	L	H	HE1	TYR	V	35
R	H	CA	SER	A	72	L	H	HB3	PRO	V	79
R	H	CB	SER	A	72	L	H	CB	PRO	V	79
R	H	CB	SER	A	72	L	H	HB3	PRO	V	79
R	H	OG	SER	A	72	L	H	CB	PRO	V	79
R	H	OG	SER	A	72	L	H	HA	PRO	V	79
R	H	OG	SER	A	72	L	H	HB3	PRO	V	79
R	H	CA	ALA	A	75	L	H	OH	TYR	V	35
R	H	CA	ALA	A	75	L	H	HH	TYR	V	35
R	H	CA	ALA	A	75	L	H	HG12	VAL	V	39
R	H	C	ALA	A	75	L	H	OH	TYR	V	35
R	H	C	ALA	A	75	L	H	HH	TYR	V	35
R	H	C	ALA	A	75	L	H	OD1	ASN	V	75
R	H	C	ALA	A	75	L	H	HD22	ASN	V	75
R	H	CB	ALA	A	75	L	H	CE1	TYR	V	35
R	H	CB	ALA	A	75	L	H	OH	TYR	V	35
R	H	CB	ALA	A	75	L	H	CZ	TYR	V	35
R	H	CB	ALA	A	75	L	H	HE1	TYR	V	35
R	H	CB	ALA	A	75	L	H	HH	TYR	V	35
R	H	CB	ALA	A	75	L	H	HG12	VAL	V	39
R	H	CB	ALA	A	75	L	H	HG23	VAL	V	39
R	H	CB	ALA	A	75	L	H	OD1	ASN	V	75
R	H	O	ALA	A	75	L	H	HH	TYR	V	35
R	H	O	ALA	A	75	L	H	HG12	VAL	V	39
R	H	O	ALA	A	75	L	H	CG	ASN	V	75
R	H	O	ALA	A	75	L	H	ND2	ASN	V	75
R	H	O	ALA	A	75	L	H	OD1	ASN	V	75
R	H	O	ALA	A	75	L	H	HD22	ASN	V	75
R	H	N	VAL	A	76	L	H	OD1	ASN	V	75
R	H	CG2	VAL	A	76	L	H	OD1	ASN	V	75
R	H	CA	PRO	A	79	L	H	CG2	VAL	V	43
R	H	CA	PRO	A	79	L	H	HG22	VAL	V	43
R	H	CA	PRO	A	79	L	H	HG23	VAL	V	43
R	H	CA	PRO	A	79	L	H	HD12	ILE	V	71
R	H	C	PRO	A	79	L	H	HG22	VAL	V	43
R	H	CB	PRO	A	79	L	H	HG13	VAL	V	39
R	H	CB	PRO	A	79	L	H	CG2	VAL	V	43
R	H	CB	PRO	A	79	L	H	HG21	VAL	V	43
R	H	CB	PRO	A	79	L	H	HG22	VAL	V	43
R	H	CB	PRO	A	79	L	H	HG23	VAL	V	43
R	H	CB	PRO	A	79	L	H	CG2	ILE	V	71
R	H	CB	PRO	A	79	L	H	CD1	ILE	V	71
R	H	CB	PRO	A	79	L	H	HG22	ILE	V	71
R	H	CB	PRO	A	79	L	H	HG23	ILE	V	71
R	H	CB	PRO	A	79	L	H	HD12	ILE	V	71
R	H	O	PRO	A	79	L	H	HG22	VAL	V	43
R	H	CG	PRO	A	79	L	H	CG1	VAL	V	39
R	H	CG	PRO	A	79	L	H	HG11	VAL	V	39
R	H	CG	PRO	A	79	L	H	HG12	VAL	V	39
R	H	CG	PRO	A	79	L	H	HG13	VAL	V	39
R	H	CG	PRO	A	79	L	H	CG2	VAL	V	43
R	H	CG	PRO	A	79	L	H	HG21	VAL	V	43
R	H	CG	PRO	A	79	L	H	HG22	VAL	V	43
R	H	CG	PRO	A	79	L	H	HG23	VAL	V	43
R	H	CG	PRO	A	79	L	H	HG22	ILE	V	71
R	H	CG	PRO	A	79	L	H	HG23	ILE	V	71
R	H	CG	PRO	A	79	L	H	HD12	ILE	V	71
R	H	CA	GLU	A	80	L	H	HE2	PHE	V	68
R	H	CB	GLU	A	80	L	H	HE2	PHE	V	68
R	H	CG	GLU	A	80	L	H	HE2	PHE	V	68
R	H	CD	GLU	A	80	L	H	CE2	PHE	V	68
R	H	CD	GLU	A	80	L	H	CZ	PHE	V	68
R	H	CD	GLU	A	80	L	H	HE2	PHE	V	68
R	H	CD	GLU	A	80	L	H	HZ	PHE	V	68
R	H	OE1	GLU	A	80	L	H	CE2	PHE	V	68
R	H	OE1	GLU	A	80	L	H	CZ	PHE	V	68
R	H	OE1	GLU	A	80	L	H	HE2	PHE	V	68
R	H	OE1	GLU	A	80	L	H	HZ	PHE	V	68
R	H	OE2	GLU	A	80	L	H	CD2	PHE	V	68
R	H	OE2	GLU	A	80	L	H	CE2	PHE	V	68
R	H	OE2	GLU	A	80	L	H	CZ	PHE	V	68
R	H	OE2	GLU	A	80	L	H	HD2	PHE	V	68
R	H	OE2	GLU	A	80	L	H	HE2	PHE	V	68
R	H	OE2	GLU	A	80	L	H	HZ	PHE	V	68
R	H	CB	LEU	A	82	L	H	HG12	VAL	V	43
R	H	CG	LEU	A	82	L	H	HG12	VAL	V	43
R	H	CG	LEU	A	82	L	H	HG13	VAL	V	43
R	H	CD1	LEU	A	82	L	H	CG1	VAL	V	43
R	H	CD1	LEU	A	82	L	H	HG11	VAL	V	43
R	H	CD1	LEU	A	82	L	H	HG12	VAL	V	43
R	H	CD1	LEU	A	82	L	H	HG13	VAL	V	43
R	H	N	VAL	A	83	L	H	HG22	ILE	V	46
R	H	CA	VAL	A	83	L	H	HG21	ILE	V	46
R	H	CA	VAL	A	83	L	H	HG22	ILE	V	46
R	H	CB	VAL	A	83	L	H	HG22	ILE	V	46
R	H	CB	VAL	A	83	L	H	HD13	ILE	V	46
R	H	CG1	VAL	A	83	L	H	HG22	ILE	V	46
R	H	CG1	VAL	A	83	L	H	HD13	ILE	V	46
R	H	CG2	VAL	A	83	L	H	CG2	ILE	V	46
R	H	CG2	VAL	A	83	L	H	CD1	ILE	V	46
R	H	CG2	VAL	A	83	L	H	HG21	ILE	V	46
R	H	CG2	VAL	A	83	L	H	HG22	ILE	V	46
R	H	CG2	VAL	A	83	L	H	HG23	ILE	V	46
R	H	CG2	VAL	A	83	L	H	HD11	ILE	V	46
R	H	CG2	VAL	A	83	L	H	HD12	ILE	V	46
R	H	CG2	VAL	A	83	L	H	HD13	ILE	V	46
R	H	CG2	VAL	A	83	L	H	HD2	PHE	V	68
R	H	CA	SER	A	86	L	H	CB	SER	V	50
R	H	CA	SER	A	86	L	H	OG	SER	V	50
R	H	CA	SER	A	86	L	H	HB2	SER	V	50
R	H	CA	SER	A	86	L	H	HB3	SER	V	50
R	H	C	SER	A	86	L	H	CB	SER	V	50
R	H	C	SER	A	86	L	H	OG	SER	V	50
R	H	C	SER	A	86	L	H	HB3	SER	V	50
R	H	CB	SER	A	86	L	H	HG21	ILE	V	46
R	H	CB	SER	A	86	L	H	HA	VAL	V	47
R	H	CB	SER	A	86	L	H	CB	SER	V	50
R	H	CB	SER	A	86	L	H	OG	SER	V	50
R	H	CB	SER	A	86	L	H	HB2	SER	V	50
R	H	CB	SER	A	86	L	H	HB3	SER	V	50
R	H	CB	SER	A	86	L	H	HG	SER	V	50
R	H	O	SER	A	86	L	H	CA	SER	V	50
R	H	O	SER	A	86	L	H	CB	SER	V	50
R	H	O	SER	A	86	L	H	OG	SER	V	50
R	H	O	SER	A	86	L	H	HA	SER	V	50
R	H	O	SER	A	86	L	H	HB2	SER	V	50
R	H	O	SER	A	86	L	H	HB3	SER	V	50
R	H	OG	SER	A	86	L	H	CG2	ILE	V	46
R	H	OG	SER	A	86	L	H	HG21	ILE	V	46
R	H	OG	SER	A	86	L	H	HG22	ILE	V	46
R	H	OG	SER	A	86	L	H	HG23	ILE	V	46
R	H	OG	SER	A	86	L	H	CB	SER	V	50
R	H	OG	SER	A	86	L	H	OG	SER	V	50
R	H	OG	SER	A	86	L	H	HB2	SER	V	50
R	H	OG	SER	A	86	L	H	HB3	SER	V	50
R	H	OG	SER	A	86	L	H	HG	SER	V	50
R	-	N	THR	A	87	L	H	HB3	SER	V	50
R	-	CG2	THR	A	87	L	H	OG	SER	V	50
R	S	CB	ILE	A	92	L	H	HZ	PHE	V	68
R	S	CG1	ILE	A	92	L	H	HZ	PHE	V	68
R	S	CD1	ILE	A	92	L	H	HZ	PHE	V	68
R	S	CB	SER	A	93	L	H	CD2	TRP	V	149
R	S	CB	SER	A	93	L	H	CE3	TRP	V	149
R	S	CB	SER	A	93	L	H	CH2	TRP	V	149
R	S	CB	SER	A	93	L	H	CZ3	TRP	V	149
R	S	CB	SER	A	93	L	H	HE3	TRP	V	149
R	S	CB	SER	A	93	L	H	HZ3	TRP	V	149
R	S	OG	SER	A	93	L	H	HE1	PHE	V	107
R	S	OG	SER	A	93	L	H	CE3	TRP	V	149
R	S	OG	SER	A	93	L	H	CH2	TRP	V	149
R	S	OG	SER	A	93	L	H	CZ3	TRP	V	149
R	S	OG	SER	A	93	L	H	HE3	TRP	V	149
R	S	OG	SER	A	93	L	H	HH2	TRP	V	149
R	S	OG	SER	A	93	L	H	HZ3	TRP	V	149
R	H	N	VAL	A	95	L	H	HE1	PHE	V	102
R	H	CA	VAL	A	95	L	H	CE1	PHE	V	102
R	H	CA	VAL	A	95	L	H	HE1	PHE	V	102
R	H	CA	VAL	A	95	L	H	HZ	PHE	V	102
R	H	C	VAL	A	95	L	H	HE1	PHE	V	102
R	H	C	VAL	A	95	L	H	HG22	VAL	V	103
R	H	CB	VAL	A	95	L	H	CD1	PHE	V	102
R	H	CB	VAL	A	95	L	H	CE1	PHE	V	102
R	H	CB	VAL	A	95	L	H	CZ	PHE	V	102
R	H	CB	VAL	A	95	L	H	HD1	PHE	V	102
R	H	CB	VAL	A	95	L	H	HE1	PHE	V	102
R	H	CB	VAL	A	95	L	H	HZ	PHE	V	102
R	H	CB	VAL	A	95	L	H	HG23	VAL	V	153
R	H	O	VAL	A	95	L	H	HE1	PHE	V	102
R	H	O	VAL	A	95	L	H	HG22	VAL	V	103
R	H	CG1	VAL	A	95	L	H	CG	PHE	V	102
R	H	CG1	VAL	A	95	L	H	CD1	PHE	V	102
R	H	CG1	VAL	A	95	L	H	CE1	PHE	V	102
R	H	CG1	VAL	A	95	L	H	CZ	PHE	V	102
R	H	CG1	VAL	A	95	L	H	HD1	PHE	V	102
R	H	CG1	VAL	A	95	L	H	HE1	PHE	V	102
R	H	CG1	VAL	A	95	L	H	HZ	PHE	V	102
R	H	CG1	VAL	A	95	L	H	CA	VAL	V	103
R	H	CG1	VAL	A	95	L	H	CG2	VAL	V	103
R	H	CG1	VAL	A	95	L	H	HA	VAL	V	103
R	H	CG1	VAL	A	95	L	H	HG21	VAL	V	103
R	H	CG1	VAL	A	95	L	H	HG22	VAL	V	103
R	H	CG1	VAL	A	95	L	H	OG	SER	V	106
R	H	CG1	VAL	A	95	L	H	HB2	SER	V	106
R	H	CG1	VAL	A	95	L	H	HG	SER	V	106
R	H	CG2	VAL	A	95	L	H	CD1	PHE	V	102
R	H	CG2	VAL	A	95	L	H	CE1	PHE	V	102
R	H	CG2	VAL	A	95	L	H	CE2	PHE	V	102
R	H	CG2	VAL	A	95	L	H	CZ	PHE	V	102
R	H	CG2	VAL	A	95	L	H	HD1	PHE	V	102
R	H	CG2	VAL	A	95	L	H	HE1	PHE	V	102
R	H	CG2	VAL	A	95	L	H	HE2	PHE	V	102
R	H	CG2	VAL	A	95	L	H	HZ	PHE	V	102
R	H	CG2	VAL	A	95	L	H	OG	SER	V	106
R	H	CG2	VAL	A	95	L	H	HG	SER	V	106
R	H	CG2	VAL	A	95	L	H	HG12	VAL	V	153
R	H	CG2	VAL	A	95	L	H	HG23	VAL	V	153
R	H	N	GLY	A	96	L	H	HZ	PHE	V	107
R	H	CA	GLY	A	96	L	H	CZ	PHE	V	107
R	H	CA	GLY	A	96	L	H	HZ	PHE	V	107
R	H	CD1	PHE	A	98	L	H	HB1	ALA	V	99
R	H	CE1	PHE	A	98	L	H	CB	ALA	V	99
R	H	CE1	PHE	A	98	L	H	HA	ALA	V	99
R	H	CE1	PHE	A	98	L	H	HB1	ALA	V	99
R	H	CE1	PHE	A	98	L	H	HB3	ALA	V	99
R	H	CZ	PHE	A	98	L	H	HB1	ALA	V	99
R	H	CZ	PHE	A	98	L	H	HB3	ALA	V	99
R	H	CA	ALA	A	99	L	H	HG23	VAL	V	103
R	H	CB	ALA	A	99	L	H	CG2	VAL	V	103
R	H	CB	ALA	A	99	L	H	HG12	VAL	V	103
R	H	CB	ALA	A	99	L	H	HG13	VAL	V	103
R	H	CB	ALA	A	99	L	H	HG22	VAL	V	103
R	H	CB	ALA	A	99	L	H	HG23	VAL	V	103
R	H	CE2	TYR	A	102	L	H	HA2	GLY	V	96
R	H	OH	TYR	A	102	L	H	CA	GLY	V	96
R	H	OH	TYR	A	102	L	H	HA2	GLY	V	96
R	H	OH	TYR	A	102	L	H	HA3	GLY	V	96
R	H	CZ	TYR	A	102	L	H	HA2	GLY	V	96
R	H	CZ	TYR	A	102	L	H	HA3	GLY	V	96
R	H	CE2	PHE	A	103	L	H	O	ASN	V	75
R	H	CE2	PHE	A	103	L	-	O	PHE	V	76
R	H	CE2	PHE	A	103	L	-	HA	PHE	V	76
R	H	CZ	PHE	A	103	L	H	O	ASN	V	75
R	H	CZ	PHE	A	103	L	-	C	PHE	V	76
R	H	CZ	PHE	A	103	L	-	O	PHE	V	76
R	H	CZ	PHE	A	103	L	-	HA	PHE	V	76
R	H	CE1	PHE	A	107	L	H	HB2	PRO	V	79
R	H	CE1	PHE	A	107	L	H	HB3	PRO	V	79
R	H	CE1	PHE	A	107	L	H	HG23	VAL	V	83
R	H	CE2	PHE	A	107	L	H	HB2	PRO	V	79
R	H	CE2	PHE	A	107	L	H	HB3	PRO	V	79
R	H	CZ	PHE	A	107	L	H	CB	PRO	V	79
R	H	CZ	PHE	A	107	L	H	HB2	PRO	V	79
R	H	CZ	PHE	A	107	L	H	HB3	PRO	V	79
R	H	SD	MET	A	142	L	-	HG3	GLU	V	88
R	H	CE	MET	A	142	L	-	OE1	GLU	V	88
R	H	CE	MET	A	142	L	-	HG3	GLU	V	88
R	H	CG1	VAL	A	145	L	-	HG12	ILE	V	87
R	H	CG1	ILE	A	146	L	-	HG23	ILE	V	87
R	H	CD1	ILE	A	146	L	-	HG23	ILE	V	87
R	H	CD1	ILE	A	146	L	-	HB2	GLU	V	88
R	H	CD1	ILE	A	146	L	-	H	ARG	V	89
R	H	CB	TRP	A	149	L	-	CD1	ILE	V	87
R	H	CB	TRP	A	149	L	-	HD11	ILE	V	87
R	H	CB	TRP	A	149	L	-	HD12	ILE	V	87
R	H	CG	TRP	A	149	L	H	HG12	VAL	V	83
R	H	CG	TRP	A	149	L	-	CD1	ILE	V	87
R	H	CG	TRP	A	149	L	-	HD11	ILE	V	87
R	H	CG	TRP	A	149	L	-	HD12	ILE	V	87
R	H	CG	TRP	A	149	L	-	HD13	ILE	V	87
R	H	CD1	TRP	A	149	L	H	HG12	VAL	V	83
R	H	CD1	TRP	A	149	L	H	HG13	VAL	V	83
R	H	CD1	TRP	A	149	L	-	CD1	ILE	V	87
R	H	CD1	TRP	A	149	L	-	HG12	ILE	V	87
R	H	CD1	TRP	A	149	L	-	HD11	ILE	V	87
R	H	CD1	TRP	A	149	L	-	HD12	ILE	V	87
R	H	CD2	TRP	A	149	L	H	CG1	VAL	V	83
R	H	CD2	TRP	A	149	L	H	HG11	VAL	V	83
R	H	CD2	TRP	A	149	L	H	HG12	VAL	V	83
R	H	CD2	TRP	A	149	L	H	HG13	VAL	V	83
R	H	CD2	TRP	A	149	L	-	CD1	ILE	V	87
R	H	CD2	TRP	A	149	L	-	HD12	ILE	V	87
R	H	CD2	TRP	A	149	L	-	HD13	ILE	V	87
R	H	CE2	TRP	A	149	L	H	CB	VAL	V	83
R	H	CE2	TRP	A	149	L	H	CG1	VAL	V	83
R	H	CE2	TRP	A	149	L	H	CG2	VAL	V	83
R	H	CE2	TRP	A	149	L	H	HG11	VAL	V	83
R	H	CE2	TRP	A	149	L	H	HG12	VAL	V	83
R	H	CE2	TRP	A	149	L	H	HG13	VAL	V	83
R	H	CE2	TRP	A	149	L	H	HG22	VAL	V	83
R	H	CE2	TRP	A	149	L	H	HG23	VAL	V	83
R	H	CE2	TRP	A	149	L	-	HD12	ILE	V	87
R	H	CE3	TRP	A	149	L	H	CG1	VAL	V	83
R	H	CE3	TRP	A	149	L	H	HG11	VAL	V	83
R	H	CE3	TRP	A	149	L	H	HG12	VAL	V	83
R	H	CE3	TRP	A	149	L	H	HG13	VAL	V	83
R	H	CE3	TRP	A	149	L	H	HG23	VAL	V	83
R	H	CE3	TRP	A	149	L	-	HD12	ILE	V	87
R	H	NE1	TRP	A	149	L	H	CG1	VAL	V	83
R	H	NE1	TRP	A	149	L	H	HG11	VAL	V	83
R	H	NE1	TRP	A	149	L	H	HG12	VAL	V	83
R	H	NE1	TRP	A	149	L	H	HG13	VAL	V	83
R	H	NE1	TRP	A	149	L	-	CD1	ILE	V	87
R	H	NE1	TRP	A	149	L	-	HD12	ILE	V	87
R	H	CH2	TRP	A	149	L	H	CB	VAL	V	83
R	H	CH2	TRP	A	149	L	H	CG1	VAL	V	83
R	H	CH2	TRP	A	149	L	H	CG2	VAL	V	83
R	H	CH2	TRP	A	149	L	H	HB	VAL	V	83
R	H	CH2	TRP	A	149	L	H	HG11	VAL	V	83
R	H	CH2	TRP	A	149	L	H	HG12	VAL	V	83
R	H	CH2	TRP	A	149	L	H	HG13	VAL	V	83
R	H	CH2	TRP	A	149	L	H	HG21	VAL	V	83
R	H	CH2	TRP	A	149	L	H	HG22	VAL	V	83
R	H	CH2	TRP	A	149	L	H	HG23	VAL	V	83
R	H	CZ2	TRP	A	149	L	H	CB	VAL	V	83
R	H	CZ2	TRP	A	149	L	H	CG1	VAL	V	83
R	H	CZ2	TRP	A	149	L	H	CG2	VAL	V	83
R	H	CZ2	TRP	A	149	L	H	HB	VAL	V	83
R	H	CZ2	TRP	A	149	L	H	HG11	VAL	V	83
R	H	CZ2	TRP	A	149	L	H	HG12	VAL	V	83
R	H	CZ2	TRP	A	149	L	H	HG13	VAL	V	83
R	H	CZ2	TRP	A	149	L	H	HG21	VAL	V	83
R	H	CZ2	TRP	A	149	L	H	HG22	VAL	V	83
R	H	CZ2	TRP	A	149	L	H	HG23	VAL	V	83
R	H	CZ3	TRP	A	149	L	H	CB	VAL	V	83
R	H	CZ3	TRP	A	149	L	H	CG1	VAL	V	83
R	H	CZ3	TRP	A	149	L	H	CG2	VAL	V	83
R	H	CZ3	TRP	A	149	L	H	HB	VAL	V	83
R	H	CZ3	TRP	A	149	L	H	HG11	VAL	V	83
R	H	CZ3	TRP	A	149	L	H	HG12	VAL	V	83
R	H	CZ3	TRP	A	149	L	H	HG13	VAL	V	83
R	H	CZ3	TRP	A	149	L	H	HG22	VAL	V	83
R	H	CZ3	TRP	A	149	L	H	HG23	VAL	V	83
R	H	CD1	ILE	A	150	L	S	HG1	THR	V	91
R	H	O	ILE	A	153	L	S	HG	SER	V	93
R	H	CG2	ILE	A	153	L	S	N	SER	V	93
R	H	CG2	ILE	A	153	L	S	CB	SER	V	93
R	H	CG2	ILE	A	153	L	S	OG	SER	V	93
R	H	CG2	ILE	A	153	L	S	H	SER	V	93
R	H	CG2	ILE	A	153	L	S	HB2	SER	V	93
R	H	CG2	ILE	A	153	L	S	HG	SER	V	93
R	H	CD1	ILE	A	153	L	H	NZ	LYS	V	80
R	H	CD1	ILE	A	153	L	H	HE2	LYS	V	80
R	H	CD1	ILE	A	153	L	H	HZ2	LYS	V	80
R	H	CD1	ILE	A	153	L	H	HZ3	LYS	V	80
R	H	CD1	ILE	A	153	L	S	O	THR	V	91
R	H	CD1	ILE	A	153	L	S	HA	ILE	V	92
R	H	CA	THR	A	157	L	H	OE2	GLU	V	95
R	H	C	THR	A	157	L	H	OE2	GLU	V	95
R	H	CB	THR	A	157	L	S	OG	SER	V	93
R	H	CB	THR	A	157	L	S	HG	SER	V	93
R	H	CB	THR	A	157	L	H	CB	GLU	V	95
R	H	CB	THR	A	157	L	H	OE2	GLU	V	95
R	H	CB	THR	A	157	L	H	HB2	GLU	V	95
R	H	CB	THR	A	157	L	H	HB3	GLU	V	95
R	H	O	THR	A	157	L	H	CD	GLU	V	95
R	H	O	THR	A	157	L	H	OE2	GLU	V	95
R	H	CG2	THR	A	157	L	S	OG	SER	V	93
R	H	CG2	THR	A	157	L	S	HG	SER	V	93
R	H	CG2	THR	A	157	L	H	CA	GLU	V	95
R	H	CG2	THR	A	157	L	H	C	GLU	V	95
R	H	CG2	THR	A	157	L	H	CB	GLU	V	95
R	H	CG2	THR	A	157	L	H	CG	GLU	V	95
R	H	CG2	THR	A	157	L	H	CD	GLU	V	95
R	H	CG2	THR	A	157	L	H	OE2	GLU	V	95
R	H	CG2	THR	A	157	L	H	H	GLU	V	95
R	H	CG2	THR	A	157	L	H	HB2	GLU	V	95
R	H	CG2	THR	A	157	L	H	HB3	GLU	V	95
R	H	CG2	THR	A	157	L	H	HG3	GLU	V	95
R	H	CG2	THR	A	157	L	H	N	GLY	V	96
R	H	CG2	THR	A	157	L	H	H	GLY	V	96
R	H	OG1	THR	A	157	L	S	CB	SER	V	93
R	H	OG1	THR	A	157	L	S	OG	SER	V	93
R	H	OG1	THR	A	157	L	S	HG	SER	V	93
R	H	OG1	THR	A	157	L	H	HB2	GLU	V	95
R	H	OG1	THR	A	157	L	H	H	GLY	V	96
R	H	N	VAL	A	158	L	H	OE2	GLU	V	95
R	H	CA	VAL	A	158	L	H	OE2	GLU	V	95
R	H	CB	THR	A	161	L	H	OE2	GLU	V	95
R	H	CG2	THR	A	161	L	H	CD	GLU	V	95
R	H	CG2	THR	A	161	L	H	OE2	GLU	V	95
R	H	CG2	THR	A	161	L	H	HB3	GLU	V	95
R	H	OG1	THR	A	161	L	H	CD	GLU	V	95
R	H	OG1	THR	A	161	L	H	OE1	GLU	V	95
R	H	OG1	THR	A	161	L	H	OE2	GLU	V	95

- 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