IID

A1L453_P48740.1 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	-	MET	A	1	L	-	LYS	V	193
R	-	MET	A	1	L	-	ASN	V	236
R	-	MET	A	1	L	-	ALA	V	237
R	-	MET	A	1	L	-	PRO	V	272
R	-	MET	A	1	L	-	LEU	V	273
R	-	LEU	A	10	L	-	GLU	V	57
R	-	LEU	A	10	L	-	GLY	V	58
R	-	GLU	A	105	L	H	PRO	V	311
R	-	CYS	A	11	L	-	GLU	V	57
R	-	PHE	A	12	L	-	GLU	V	57
R	-	SER	A	13	L	-	GLU	V	57
R	-	LEU	A	14	L	-	ARG	V	53
R	-	LEU	A	14	L	-	SER	V	55
R	-	SER	A	15	L	-	GLU	V	164
R	-	SER	A	15	L	-	SER	V	55
R	-	LYS	A	16	L	-	GLU	V	164
R	-	LYS	A	16	L	-	SER	V	48
R	-	LYS	A	16	L	-	VAL	V	49
R	-	LYS	A	16	L	-	ALA	V	50
R	-	ALA	A	17	L	-	SER	V	163
R	-	SER	A	18	L	-	HIS	V	126
R	-	SER	A	18	L	-	SER	V	163
R	-	SER	A	18	L	-	GLU	V	164
R	-	ALA	A	19	L	-	VAL	V	161
R	-	ARG	A	2	L	-	ASN	V	236
R	-	ARG	A	2	L	-	ALA	V	237
R	-	ARG	A	2	L	-	LYS	V	238
R	S	HIS	A	20	L	-	HIS	V	126
R	S	THR	A	21	L	-	ASN	V	125
R	S	VAL	A	22	L	-	ASN	V	125
R	S	GLU	A	23	L	-	ALA	V	123
R	S	GLU	A	23	L	-	GLY	V	124
R	S	GLU	A	23	L	-	ASN	V	125
R	S	GLU	A	23	L	-	THR	V	127
R	S	GLU	A	23	L	S	GLN	V	128
R	-	ASN	A	25	L	-	ALA	V	123
R	-	TRP	A	3	L	-	ASN	V	236
R	-	TRP	A	3	L	-	LYS	V	238
R	-	LEU	A	5	L	-	LEU	V	61
R	-	LEU	A	6	L	-	ILE	V	60
R	-	LEU	A	6	L	-	LEU	V	61
R	-	LEU	A	6	L	-	VAL	V	64
R	-	TYR	A	7	L	-	LYS	V	59
R	-	TYR	A	7	L	-	ILE	V	60
R	-	TYR	A	7	L	-	LEU	V	61
R	-	TYR	A	8	L	-	LYS	V	59
R	-	TYR	A	8	L	-	ILE	V	60
R	-	GLU	A	83	L	S	TRP	V	129
R	-	GLU	A	83	L	-	PRO	V	301
R	-	ASP	A	84	L	-	PRO	V	301
R	-	ASP	A	84	L	-	ALA	V	302
R	-	ASP	A	84	L	-	ALA	V	304
R	-	GLN	A	85	L	-	ALA	V	304
R	-	GLN	A	85	L	-	PRO	V	307
R	S	VAL	A	86	L	-	PRO	V	303
R	S	VAL	A	86	L	-	ALA	V	304
R	S	VAL	A	86	L	-	LEU	V	305
R	S	VAL	A	86	L	-	SER	V	306
R	S	VAL	A	86	L	-	PRO	V	307
R	S	LEU	A	87	L	-	ALA	V	304
R	S	LEU	A	87	L	-	SER	V	306
R	S	LEU	A	87	L	-	PRO	V	307
R	S	ALA	A	88	L	-	SER	V	306
R	S	ALA	A	88	L	-	PRO	V	307
R	S	THR	A	89	L	-	SER	V	306
R	-	ALA	A	9	L	-	GLY	V	58
R	-	ALA	A	9	L	-	LYS	V	59

- 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

A1L453_P48740.1 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	-	N	MET	A	1	L	-	CE	LYS	V	193
R	-	N	MET	A	1	L	-	NZ	LYS	V	193
R	-	N	MET	A	1	L	-	HE2	LYS	V	193
R	-	N	MET	A	1	L	-	HE3	LYS	V	193
R	-	N	MET	A	1	L	-	HZ2	LYS	V	193
R	-	N	MET	A	1	L	-	HZ3	LYS	V	193
R	-	N	MET	A	1	L	-	CB	ALA	V	237
R	-	N	MET	A	1	L	-	HB1	ALA	V	237
R	-	N	MET	A	1	L	-	HB2	ALA	V	237
R	-	N	MET	A	1	L	-	HB3	ALA	V	237
R	-	N	MET	A	1	L	-	CG	PRO	V	272
R	-	N	MET	A	1	L	-	HG3	PRO	V	272
R	-	CA	MET	A	1	L	-	HZ3	LYS	V	193
R	-	CA	MET	A	1	L	-	CB	ALA	V	237
R	-	CA	MET	A	1	L	-	HB1	ALA	V	237
R	-	CA	MET	A	1	L	-	HB2	ALA	V	237
R	-	CA	MET	A	1	L	-	HB3	ALA	V	237
R	-	CA	MET	A	1	L	-	HG3	PRO	V	272
R	-	C	MET	A	1	L	-	C	ASN	V	236
R	-	C	MET	A	1	L	-	O	ASN	V	236
R	-	C	MET	A	1	L	-	N	ALA	V	237
R	-	C	MET	A	1	L	-	CA	ALA	V	237
R	-	C	MET	A	1	L	-	CB	ALA	V	237
R	-	C	MET	A	1	L	-	HB1	ALA	V	237
R	-	C	MET	A	1	L	-	HB2	ALA	V	237
R	-	C	MET	A	1	L	-	HB3	ALA	V	237
R	-	CB	MET	A	1	L	-	HZ3	LYS	V	193
R	-	CB	MET	A	1	L	-	CA	ALA	V	237
R	-	CB	MET	A	1	L	-	CB	ALA	V	237
R	-	CB	MET	A	1	L	-	HA	ALA	V	237
R	-	CB	MET	A	1	L	-	HB1	ALA	V	237
R	-	CB	MET	A	1	L	-	HB2	ALA	V	237
R	-	CB	MET	A	1	L	-	HB3	ALA	V	237
R	-	CB	MET	A	1	L	-	HG2	PRO	V	272
R	-	CB	MET	A	1	L	-	HG3	PRO	V	272
R	-	O	MET	A	1	L	-	C	ASN	V	236
R	-	O	MET	A	1	L	-	O	ASN	V	236
R	-	O	MET	A	1	L	-	N	ALA	V	237
R	-	O	MET	A	1	L	-	CA	ALA	V	237
R	-	O	MET	A	1	L	-	C	ALA	V	237
R	-	O	MET	A	1	L	-	CB	ALA	V	237
R	-	O	MET	A	1	L	-	O	ALA	V	237
R	-	O	MET	A	1	L	-	H	ALA	V	237
R	-	O	MET	A	1	L	-	HA	ALA	V	237
R	-	O	MET	A	1	L	-	HB1	ALA	V	237
R	-	O	MET	A	1	L	-	HB2	ALA	V	237
R	-	O	MET	A	1	L	-	HB3	ALA	V	237
R	-	CG	MET	A	1	L	-	HZ3	LYS	V	193
R	-	CG	MET	A	1	L	-	CB	ALA	V	237
R	-	CG	MET	A	1	L	-	HB1	ALA	V	237
R	-	CG	MET	A	1	L	-	HB2	ALA	V	237
R	-	CG	MET	A	1	L	-	HB3	ALA	V	237
R	-	CG	MET	A	1	L	-	HG2	PRO	V	272
R	-	SD	MET	A	1	L	-	HB3	ALA	V	237
R	-	SD	MET	A	1	L	-	HG2	PRO	V	272
R	-	SD	MET	A	1	L	-	HD22	LEU	V	273
R	-	N	ARG	A	2	L	-	O	ASN	V	236
R	-	N	ARG	A	2	L	-	CB	ALA	V	237
R	-	N	ARG	A	2	L	-	HB1	ALA	V	237
R	-	N	ARG	A	2	L	-	HB2	ALA	V	237
R	-	CA	ARG	A	2	L	-	O	ASN	V	236
R	-	CA	ARG	A	2	L	-	HA	ASN	V	236
R	-	CA	ARG	A	2	L	-	HB1	ALA	V	237
R	-	C	ARG	A	2	L	-	CA	ASN	V	236
R	-	C	ARG	A	2	L	-	C	ASN	V	236
R	-	C	ARG	A	2	L	-	CB	ASN	V	236
R	-	C	ARG	A	2	L	-	O	ASN	V	236
R	-	C	ARG	A	2	L	-	HA	ASN	V	236
R	-	C	ARG	A	2	L	-	HB3	ASN	V	236
R	-	C	ARG	A	2	L	-	HB1	ALA	V	237
R	-	C	ARG	A	2	L	-	HE3	LYS	V	238
R	-	CB	ARG	A	2	L	-	O	ASN	V	236
R	-	CB	ARG	A	2	L	-	HA	ASN	V	236
R	-	CB	ARG	A	2	L	-	HB1	ALA	V	237
R	-	O	ARG	A	2	L	-	CA	ASN	V	236
R	-	O	ARG	A	2	L	-	C	ASN	V	236
R	-	O	ARG	A	2	L	-	CB	ASN	V	236
R	-	O	ARG	A	2	L	-	O	ASN	V	236
R	-	O	ARG	A	2	L	-	HA	ASN	V	236
R	-	O	ARG	A	2	L	-	HB2	ASN	V	236
R	-	O	ARG	A	2	L	-	HB3	ASN	V	236
R	-	O	ARG	A	2	L	-	N	ALA	V	237
R	-	O	ARG	A	2	L	-	CA	ALA	V	237
R	-	O	ARG	A	2	L	-	CB	ALA	V	237
R	-	O	ARG	A	2	L	-	HB1	ALA	V	237
R	-	O	ARG	A	2	L	-	HG2	LYS	V	238
R	-	O	ARG	A	2	L	-	HG3	LYS	V	238
R	-	O	ARG	A	2	L	-	HE3	LYS	V	238
R	-	N	TRP	A	3	L	-	CB	ASN	V	236
R	-	N	TRP	A	3	L	-	O	ASN	V	236
R	-	N	TRP	A	3	L	-	HB3	ASN	V	236
R	-	N	TRP	A	3	L	-	HE3	LYS	V	238
R	-	C	TRP	A	3	L	-	HE2	LYS	V	238
R	-	C	TRP	A	3	L	-	HE3	LYS	V	238
R	-	C	TRP	A	3	L	-	HZ1	LYS	V	238
R	-	O	TRP	A	3	L	-	HB3	ASN	V	236
R	-	O	TRP	A	3	L	-	CE	LYS	V	238
R	-	O	TRP	A	3	L	-	NZ	LYS	V	238
R	-	O	TRP	A	3	L	-	HE2	LYS	V	238
R	-	O	TRP	A	3	L	-	HE3	LYS	V	238
R	-	O	TRP	A	3	L	-	HZ1	LYS	V	238
R	-	O	TRP	A	3	L	-	HZ3	LYS	V	238
R	-	N	LEU	A	5	L	-	O	LEU	V	61
R	-	CA	LEU	A	5	L	-	O	LEU	V	61
R	-	C	LEU	A	5	L	-	C	LEU	V	61
R	-	C	LEU	A	5	L	-	CB	LEU	V	61
R	-	C	LEU	A	5	L	-	O	LEU	V	61
R	-	C	LEU	A	5	L	-	HB2	LEU	V	61
R	-	C	LEU	A	5	L	-	HB3	LEU	V	61
R	-	O	LEU	A	5	L	-	N	LEU	V	61
R	-	O	LEU	A	5	L	-	CA	LEU	V	61
R	-	O	LEU	A	5	L	-	C	LEU	V	61
R	-	O	LEU	A	5	L	-	CB	LEU	V	61
R	-	O	LEU	A	5	L	-	O	LEU	V	61
R	-	O	LEU	A	5	L	-	CG	LEU	V	61
R	-	O	LEU	A	5	L	-	CD1	LEU	V	61
R	-	O	LEU	A	5	L	-	H	LEU	V	61
R	-	O	LEU	A	5	L	-	HB2	LEU	V	61
R	-	O	LEU	A	5	L	-	HB3	LEU	V	61
R	-	O	LEU	A	5	L	-	HD11	LEU	V	61
R	-	O	LEU	A	5	L	-	HD12	LEU	V	61
R	-	N	LEU	A	6	L	-	O	LEU	V	61
R	-	N	LEU	A	6	L	-	HB2	LEU	V	61
R	-	CA	LEU	A	6	L	-	HG22	ILE	V	60
R	-	CA	LEU	A	6	L	-	HG23	ILE	V	60
R	-	CA	LEU	A	6	L	-	O	LEU	V	61
R	-	CA	LEU	A	6	L	-	H	LEU	V	61
R	-	CA	LEU	A	6	L	-	HB2	LEU	V	61
R	-	C	LEU	A	6	L	-	HG22	ILE	V	60
R	-	C	LEU	A	6	L	-	H	LEU	V	61
R	-	C	LEU	A	6	L	-	HB2	LEU	V	61
R	-	C	LEU	A	6	L	-	HD11	LEU	V	61
R	-	CB	LEU	A	6	L	-	HG22	ILE	V	60
R	-	O	LEU	A	6	L	-	HB2	LEU	V	61
R	-	O	LEU	A	6	L	-	HD11	LEU	V	61
R	-	CG	LEU	A	6	L	-	HG22	ILE	V	60
R	-	CG	LEU	A	6	L	-	HG13	VAL	V	64
R	-	CD1	LEU	A	6	L	-	HG13	VAL	V	64
R	-	N	TYR	A	7	L	-	CG2	ILE	V	60
R	-	N	TYR	A	7	L	-	HA	ILE	V	60
R	-	N	TYR	A	7	L	-	HG22	ILE	V	60
R	-	N	TYR	A	7	L	-	N	LEU	V	61
R	-	N	TYR	A	7	L	-	H	LEU	V	61
R	-	N	TYR	A	7	L	-	HB2	LEU	V	61
R	-	N	TYR	A	7	L	-	HD11	LEU	V	61
R	-	CA	TYR	A	7	L	-	HA	ILE	V	60
R	-	CA	TYR	A	7	L	-	HG12	ILE	V	60
R	-	CA	TYR	A	7	L	-	HG22	ILE	V	60
R	-	CA	TYR	A	7	L	-	H	LEU	V	61
R	-	C	TYR	A	7	L	-	O	LYS	V	59
R	-	C	TYR	A	7	L	-	HA	ILE	V	60
R	-	C	TYR	A	7	L	-	HG12	ILE	V	60
R	-	C	TYR	A	7	L	-	HG22	ILE	V	60
R	-	O	TYR	A	7	L	-	O	LYS	V	59
R	-	O	TYR	A	7	L	-	HA	ILE	V	60
R	-	O	TYR	A	7	L	-	HG12	ILE	V	60
R	-	N	TYR	A	8	L	-	O	LYS	V	59
R	-	N	TYR	A	8	L	-	CG1	ILE	V	60
R	-	N	TYR	A	8	L	-	HA	ILE	V	60
R	-	N	TYR	A	8	L	-	HG12	ILE	V	60
R	-	N	TYR	A	8	L	-	HG13	ILE	V	60
R	-	N	TYR	A	8	L	-	HG22	ILE	V	60
R	-	CA	TYR	A	8	L	-	O	LYS	V	59
R	-	CA	TYR	A	8	L	-	CG1	ILE	V	60
R	-	CA	TYR	A	8	L	-	HG12	ILE	V	60
R	-	CA	TYR	A	8	L	-	HG13	ILE	V	60
R	-	C	TYR	A	8	L	-	O	LYS	V	59
R	-	CB	TYR	A	8	L	-	HG12	ILE	V	60
R	-	CG	TYR	A	8	L	-	CD1	ILE	V	60
R	-	CG	TYR	A	8	L	-	HG12	ILE	V	60
R	-	CG	TYR	A	8	L	-	HD11	ILE	V	60
R	-	CD1	TYR	A	8	L	-	HD11	ILE	V	60
R	-	CD2	TYR	A	8	L	-	CG1	ILE	V	60
R	-	CD2	TYR	A	8	L	-	CD1	ILE	V	60
R	-	CD2	TYR	A	8	L	-	HG12	ILE	V	60
R	-	CD2	TYR	A	8	L	-	HD11	ILE	V	60
R	-	CD2	TYR	A	8	L	-	HD13	ILE	V	60
R	-	CE1	TYR	A	8	L	-	CD1	ILE	V	60
R	-	CE1	TYR	A	8	L	-	HD11	ILE	V	60
R	-	CE2	TYR	A	8	L	-	CD1	ILE	V	60
R	-	CE2	TYR	A	8	L	-	HG12	ILE	V	60
R	-	CE2	TYR	A	8	L	-	HD11	ILE	V	60
R	-	CE2	TYR	A	8	L	-	HD13	ILE	V	60
R	-	OH	TYR	A	8	L	-	CD1	ILE	V	60
R	-	OH	TYR	A	8	L	-	HD11	ILE	V	60
R	-	OH	TYR	A	8	L	-	HD13	ILE	V	60
R	-	CZ	TYR	A	8	L	-	CD1	ILE	V	60
R	-	CZ	TYR	A	8	L	-	HD11	ILE	V	60
R	-	CZ	TYR	A	8	L	-	HD13	ILE	V	60
R	-	N	ALA	A	9	L	-	O	LYS	V	59
R	-	N	ALA	A	9	L	-	H	LYS	V	59
R	-	N	ALA	A	9	L	-	HB3	LYS	V	59
R	-	C	ALA	A	9	L	-	HA2	GLY	V	58
R	-	C	ALA	A	9	L	-	H	LYS	V	59
R	-	O	ALA	A	9	L	-	HA2	GLY	V	58
R	-	O	ALA	A	9	L	-	H	LYS	V	59
R	-	N	LEU	A	10	L	-	HA2	GLY	V	58
R	-	CA	LEU	A	10	L	-	O	GLU	V	57
R	-	CA	LEU	A	10	L	-	HA2	GLY	V	58
R	-	N	CYS	A	11	L	-	O	GLU	V	57
R	-	N	CYS	A	11	L	-	HB2	GLU	V	57
R	-	N	CYS	A	11	L	-	HB3	GLU	V	57
R	-	CA	CYS	A	11	L	-	HB2	GLU	V	57
R	-	C	CYS	A	11	L	-	CD	GLU	V	57
R	-	C	CYS	A	11	L	-	OE2	GLU	V	57
R	-	C	CYS	A	11	L	-	HB2	GLU	V	57
R	-	O	CYS	A	11	L	-	CD	GLU	V	57
R	-	O	CYS	A	11	L	-	OE2	GLU	V	57
R	-	O	CYS	A	11	L	-	HB2	GLU	V	57
R	-	O	CYS	A	11	L	-	HB3	GLU	V	57
R	-	N	PHE	A	12	L	-	OE2	GLU	V	57
R	-	N	PHE	A	12	L	-	HB2	GLU	V	57
R	-	CA	PHE	A	12	L	-	OE2	GLU	V	57
R	-	C	PHE	A	12	L	-	CD	GLU	V	57
R	-	C	PHE	A	12	L	-	OE1	GLU	V	57
R	-	C	PHE	A	12	L	-	OE2	GLU	V	57
R	-	O	PHE	A	12	L	-	CG	GLU	V	57
R	-	O	PHE	A	12	L	-	CD	GLU	V	57
R	-	O	PHE	A	12	L	-	OE1	GLU	V	57
R	-	O	PHE	A	12	L	-	OE2	GLU	V	57
R	-	O	PHE	A	12	L	-	HG3	GLU	V	57
R	-	N	SER	A	13	L	-	OE1	GLU	V	57
R	-	O	LEU	A	14	L	-	HA	SER	V	55
R	-	CD1	LEU	A	14	L	-	HD3	ARG	V	53
R	-	CD1	LEU	A	14	L	-	HH11	ARG	V	53
R	-	CB	SER	A	15	L	-	OE1	GLU	V	164
R	-	OG	SER	A	15	L	-	HB2	SER	V	55
R	-	OG	SER	A	15	L	-	OE1	GLU	V	164
R	-	O	LYS	A	16	L	-	HG2	GLU	V	164
R	-	O	LYS	A	16	L	-	HG3	GLU	V	164
R	-	CD	LYS	A	16	L	-	HA	VAL	V	49
R	-	CD	LYS	A	16	L	-	HG12	VAL	V	49
R	-	CD	LYS	A	16	L	-	HG23	VAL	V	49
R	-	CE	LYS	A	16	L	-	O	SER	V	48
R	-	CE	LYS	A	16	L	-	HA	VAL	V	49
R	-	CE	LYS	A	16	L	-	HG23	VAL	V	49
R	-	NZ	LYS	A	16	L	-	C	SER	V	48
R	-	NZ	LYS	A	16	L	-	O	SER	V	48
R	-	NZ	LYS	A	16	L	-	N	VAL	V	49
R	-	NZ	LYS	A	16	L	-	CA	VAL	V	49
R	-	NZ	LYS	A	16	L	-	CG2	VAL	V	49
R	-	NZ	LYS	A	16	L	-	HA	VAL	V	49
R	-	NZ	LYS	A	16	L	-	HG12	VAL	V	49
R	-	NZ	LYS	A	16	L	-	HG21	VAL	V	49
R	-	NZ	LYS	A	16	L	-	HG23	VAL	V	49
R	-	NZ	LYS	A	16	L	-	H	ALA	V	50
R	-	O	ALA	A	17	L	-	HA	SER	V	163
R	-	CA	SER	A	18	L	-	HA	SER	V	163
R	-	CA	SER	A	18	L	-	HB3	SER	V	163
R	-	CB	SER	A	18	L	-	HB3	SER	V	163
R	-	CB	SER	A	18	L	-	H	GLU	V	164
R	-	CB	SER	A	18	L	-	HG2	GLU	V	164
R	-	OG	SER	A	18	L	-	HE1	HIS	V	126
R	-	OG	SER	A	18	L	-	CB	SER	V	163
R	-	OG	SER	A	18	L	-	HA	SER	V	163
R	-	OG	SER	A	18	L	-	HB2	SER	V	163
R	-	OG	SER	A	18	L	-	HB3	SER	V	163
R	-	OG	SER	A	18	L	-	H	GLU	V	164
R	-	CB	ALA	A	19	L	-	HG12	VAL	V	161
R	S	ND1	HIS	A	20	L	-	HE1	HIS	V	126
R	S	CE1	HIS	A	20	L	-	HE1	HIS	V	126
R	S	C	THR	A	21	L	-	O	ASN	V	125
R	S	O	THR	A	21	L	-	CA	ASN	V	125
R	S	O	THR	A	21	L	-	C	ASN	V	125
R	S	O	THR	A	21	L	-	CB	ASN	V	125
R	S	O	THR	A	21	L	-	O	ASN	V	125
R	S	O	THR	A	21	L	-	HA	ASN	V	125
R	S	O	THR	A	21	L	-	HB3	ASN	V	125
R	S	CA	VAL	A	22	L	-	HA	ASN	V	125
R	S	N	GLU	A	23	L	-	HA	ASN	V	125
R	S	CG	GLU	A	23	L	-	O	GLY	V	124
R	S	CG	GLU	A	23	L	-	O	THR	V	127
R	S	CG	GLU	A	23	L	-	HB	THR	V	127
R	S	CD	GLU	A	23	L	-	HB1	ALA	V	123
R	S	CD	GLU	A	23	L	-	O	GLY	V	124
R	S	CD	GLU	A	23	L	-	CA	THR	V	127
R	S	CD	GLU	A	23	L	-	C	THR	V	127
R	S	CD	GLU	A	23	L	-	CB	THR	V	127
R	S	CD	GLU	A	23	L	-	O	THR	V	127
R	S	CD	GLU	A	23	L	-	H	THR	V	127
R	S	CD	GLU	A	23	L	-	HB	THR	V	127
R	S	CD	GLU	A	23	L	-	HG23	THR	V	127
R	S	OE1	GLU	A	23	L	-	HB1	ALA	V	123
R	S	OE1	GLU	A	23	L	-	O	GLY	V	124
R	S	OE1	GLU	A	23	L	-	N	THR	V	127
R	S	OE1	GLU	A	23	L	-	CA	THR	V	127
R	S	OE1	GLU	A	23	L	-	C	THR	V	127
R	S	OE1	GLU	A	23	L	-	CB	THR	V	127
R	S	OE1	GLU	A	23	L	-	O	THR	V	127
R	S	OE1	GLU	A	23	L	-	CG2	THR	V	127
R	S	OE1	GLU	A	23	L	-	H	THR	V	127
R	S	OE1	GLU	A	23	L	-	HB	THR	V	127
R	S	OE1	GLU	A	23	L	-	HG23	THR	V	127
R	S	OE1	GLU	A	23	L	S	N	GLN	V	128
R	S	OE1	GLU	A	23	L	S	CA	GLN	V	128
R	S	OE1	GLU	A	23	L	S	HA	GLN	V	128
R	S	OE2	GLU	A	23	L	-	CA	ALA	V	123
R	S	OE2	GLU	A	23	L	-	CB	ALA	V	123
R	S	OE2	GLU	A	23	L	-	HB1	ALA	V	123
R	S	OE2	GLU	A	23	L	-	HB2	ALA	V	123
R	S	OE2	GLU	A	23	L	-	HB3	ALA	V	123
R	S	OE2	GLU	A	23	L	-	O	GLY	V	124
R	S	OE2	GLU	A	23	L	-	CB	THR	V	127
R	S	OE2	GLU	A	23	L	-	O	THR	V	127
R	S	OE2	GLU	A	23	L	-	CG2	THR	V	127
R	S	OE2	GLU	A	23	L	-	HB	THR	V	127
R	S	OE2	GLU	A	23	L	-	HG21	THR	V	127
R	S	OE2	GLU	A	23	L	-	HG23	THR	V	127
R	-	ND2	ASN	A	25	L	-	CB	ALA	V	123
R	-	ND2	ASN	A	25	L	-	HB3	ALA	V	123
R	-	O	GLU	A	83	L	-	CG	PRO	V	301
R	-	O	GLU	A	83	L	-	HB2	PRO	V	301
R	-	O	GLU	A	83	L	-	HG2	PRO	V	301
R	-	CG	GLU	A	83	L	S	HZ3	TRP	V	129
R	-	CD	GLU	A	83	L	S	CZ3	TRP	V	129
R	-	CD	GLU	A	83	L	S	HH2	TRP	V	129
R	-	CD	GLU	A	83	L	S	HZ3	TRP	V	129
R	-	OE1	GLU	A	83	L	S	CE3	TRP	V	129
R	-	OE1	GLU	A	83	L	S	CH2	TRP	V	129
R	-	OE1	GLU	A	83	L	S	CZ3	TRP	V	129
R	-	OE1	GLU	A	83	L	S	HE3	TRP	V	129
R	-	OE1	GLU	A	83	L	S	HH2	TRP	V	129
R	-	OE1	GLU	A	83	L	S	HZ3	TRP	V	129
R	-	OE2	GLU	A	83	L	S	HH2	TRP	V	129
R	-	OE2	GLU	A	83	L	S	HZ3	TRP	V	129
R	-	CA	ASP	A	84	L	-	HB2	PRO	V	301
R	-	CA	ASP	A	84	L	-	HB3	PRO	V	301
R	-	CA	ASP	A	84	L	-	HB3	ALA	V	304
R	-	C	ASP	A	84	L	-	N	ALA	V	304
R	-	C	ASP	A	84	L	-	CA	ALA	V	304
R	-	C	ASP	A	84	L	-	CB	ALA	V	304
R	-	C	ASP	A	84	L	-	H	ALA	V	304
R	-	C	ASP	A	84	L	-	HA	ALA	V	304
R	-	C	ASP	A	84	L	-	HB1	ALA	V	304
R	-	C	ASP	A	84	L	-	HB2	ALA	V	304
R	-	C	ASP	A	84	L	-	HB3	ALA	V	304
R	-	CB	ASP	A	84	L	-	HB3	PRO	V	301
R	-	O	ASP	A	84	L	-	O	ALA	V	302
R	-	O	ASP	A	84	L	-	N	ALA	V	304
R	-	O	ASP	A	84	L	-	CA	ALA	V	304
R	-	O	ASP	A	84	L	-	CB	ALA	V	304
R	-	O	ASP	A	84	L	-	H	ALA	V	304
R	-	O	ASP	A	84	L	-	HA	ALA	V	304
R	-	O	ASP	A	84	L	-	HB1	ALA	V	304
R	-	O	ASP	A	84	L	-	HB2	ALA	V	304
R	-	O	ASP	A	84	L	-	HB3	ALA	V	304
R	-	N	GLN	A	85	L	-	CA	ALA	V	304
R	-	N	GLN	A	85	L	-	CB	ALA	V	304
R	-	N	GLN	A	85	L	-	H	ALA	V	304
R	-	N	GLN	A	85	L	-	HA	ALA	V	304
R	-	N	GLN	A	85	L	-	HB1	ALA	V	304
R	-	N	GLN	A	85	L	-	HB2	ALA	V	304
R	-	N	GLN	A	85	L	-	HB3	ALA	V	304
R	-	CA	GLN	A	85	L	-	N	ALA	V	304
R	-	CA	GLN	A	85	L	-	CA	ALA	V	304
R	-	CA	GLN	A	85	L	-	CB	ALA	V	304
R	-	CA	GLN	A	85	L	-	H	ALA	V	304
R	-	CA	GLN	A	85	L	-	HA	ALA	V	304
R	-	CA	GLN	A	85	L	-	HB1	ALA	V	304
R	-	CA	GLN	A	85	L	-	HB2	ALA	V	304
R	-	CA	GLN	A	85	L	-	HB3	ALA	V	304
R	-	C	GLN	A	85	L	-	N	ALA	V	304
R	-	C	GLN	A	85	L	-	CA	ALA	V	304
R	-	C	GLN	A	85	L	-	CB	ALA	V	304
R	-	C	GLN	A	85	L	-	H	ALA	V	304
R	-	C	GLN	A	85	L	-	HA	ALA	V	304
R	-	C	GLN	A	85	L	-	HB1	ALA	V	304
R	-	C	GLN	A	85	L	-	HB2	ALA	V	304
R	-	C	GLN	A	85	L	-	HB3	ALA	V	304
R	-	CB	GLN	A	85	L	-	CA	ALA	V	304
R	-	CB	GLN	A	85	L	-	CB	ALA	V	304
R	-	CB	GLN	A	85	L	-	HA	ALA	V	304
R	-	CB	GLN	A	85	L	-	HB1	ALA	V	304
R	-	CB	GLN	A	85	L	-	HB2	ALA	V	304
R	-	CB	GLN	A	85	L	-	HB3	ALA	V	304
R	-	O	GLN	A	85	L	-	CB	ALA	V	304
R	-	O	GLN	A	85	L	-	HB1	ALA	V	304
R	-	O	GLN	A	85	L	-	HB2	ALA	V	304
R	-	O	GLN	A	85	L	-	HB3	ALA	V	304
R	-	CG	GLN	A	85	L	-	CA	ALA	V	304
R	-	CG	GLN	A	85	L	-	CB	ALA	V	304
R	-	CG	GLN	A	85	L	-	HA	ALA	V	304
R	-	CG	GLN	A	85	L	-	HB1	ALA	V	304
R	-	CG	GLN	A	85	L	-	HB2	ALA	V	304
R	-	CG	GLN	A	85	L	-	HB3	ALA	V	304
R	-	CD	GLN	A	85	L	-	HB1	ALA	V	304
R	-	CD	GLN	A	85	L	-	HD2	PRO	V	307
R	-	NE2	GLN	A	85	L	-	HB1	ALA	V	304
R	-	NE2	GLN	A	85	L	-	CD	PRO	V	307
R	-	NE2	GLN	A	85	L	-	HG3	PRO	V	307
R	-	NE2	GLN	A	85	L	-	HD2	PRO	V	307
R	S	N	VAL	A	86	L	-	N	ALA	V	304
R	S	N	VAL	A	86	L	-	CA	ALA	V	304
R	S	N	VAL	A	86	L	-	C	ALA	V	304
R	S	N	VAL	A	86	L	-	CB	ALA	V	304
R	S	N	VAL	A	86	L	-	O	ALA	V	304
R	S	N	VAL	A	86	L	-	H	ALA	V	304
R	S	N	VAL	A	86	L	-	HA	ALA	V	304
R	S	N	VAL	A	86	L	-	HB1	ALA	V	304
R	S	N	VAL	A	86	L	-	HB2	ALA	V	304
R	S	N	VAL	A	86	L	-	HB3	ALA	V	304
R	S	CA	VAL	A	86	L	-	CA	ALA	V	304
R	S	CA	VAL	A	86	L	-	C	ALA	V	304
R	S	CA	VAL	A	86	L	-	CB	ALA	V	304
R	S	CA	VAL	A	86	L	-	O	ALA	V	304
R	S	CA	VAL	A	86	L	-	HB1	ALA	V	304
R	S	CA	VAL	A	86	L	-	HB2	ALA	V	304
R	S	CA	VAL	A	86	L	-	HB3	ALA	V	304
R	S	CA	VAL	A	86	L	-	OG	SER	V	306
R	S	CA	VAL	A	86	L	-	HA	SER	V	306
R	S	C	VAL	A	86	L	-	CB	ALA	V	304
R	S	C	VAL	A	86	L	-	O	ALA	V	304
R	S	C	VAL	A	86	L	-	HB1	ALA	V	304
R	S	C	VAL	A	86	L	-	HB2	ALA	V	304
R	S	C	VAL	A	86	L	-	CA	SER	V	306
R	S	C	VAL	A	86	L	-	OG	SER	V	306
R	S	C	VAL	A	86	L	-	HA	SER	V	306
R	S	C	VAL	A	86	L	-	HD3	PRO	V	307
R	S	CB	VAL	A	86	L	-	C	ALA	V	304
R	S	CB	VAL	A	86	L	-	CB	ALA	V	304
R	S	CB	VAL	A	86	L	-	O	ALA	V	304
R	S	CB	VAL	A	86	L	-	HB2	ALA	V	304
R	S	CB	VAL	A	86	L	-	N	SER	V	306
R	S	CB	VAL	A	86	L	-	OG	SER	V	306
R	S	CB	VAL	A	86	L	-	H	SER	V	306
R	S	CB	VAL	A	86	L	-	HA	SER	V	306
R	S	CB	VAL	A	86	L	-	HG	SER	V	306
R	S	O	VAL	A	86	L	-	C	ALA	V	304
R	S	O	VAL	A	86	L	-	CB	ALA	V	304
R	S	O	VAL	A	86	L	-	O	ALA	V	304
R	S	O	VAL	A	86	L	-	HB1	ALA	V	304
R	S	O	VAL	A	86	L	-	HB2	ALA	V	304
R	S	O	VAL	A	86	L	-	C	LEU	V	305
R	S	O	VAL	A	86	L	-	O	LEU	V	305
R	S	O	VAL	A	86	L	-	N	SER	V	306
R	S	O	VAL	A	86	L	-	CA	SER	V	306
R	S	O	VAL	A	86	L	-	C	SER	V	306
R	S	O	VAL	A	86	L	-	CB	SER	V	306
R	S	O	VAL	A	86	L	-	OG	SER	V	306
R	S	O	VAL	A	86	L	-	H	SER	V	306
R	S	O	VAL	A	86	L	-	HA	SER	V	306
R	S	O	VAL	A	86	L	-	HB3	SER	V	306
R	S	O	VAL	A	86	L	-	N	PRO	V	307
R	S	O	VAL	A	86	L	-	CD	PRO	V	307
R	S	O	VAL	A	86	L	-	HD2	PRO	V	307
R	S	O	VAL	A	86	L	-	HD3	PRO	V	307
R	S	CG1	VAL	A	86	L	-	O	ALA	V	304
R	S	CG1	VAL	A	86	L	-	CB	SER	V	306
R	S	CG1	VAL	A	86	L	-	OG	SER	V	306
R	S	CG1	VAL	A	86	L	-	HG	SER	V	306
R	S	CG2	VAL	A	86	L	-	HB2	PRO	V	303
R	S	CG2	VAL	A	86	L	-	N	ALA	V	304
R	S	CG2	VAL	A	86	L	-	C	ALA	V	304
R	S	CG2	VAL	A	86	L	-	O	ALA	V	304
R	S	CG2	VAL	A	86	L	-	H	ALA	V	304
R	S	CG2	VAL	A	86	L	-	HB2	ALA	V	304
R	S	N	LEU	A	87	L	-	HB2	ALA	V	304
R	S	N	LEU	A	87	L	-	HA	SER	V	306
R	S	N	LEU	A	87	L	-	HD3	PRO	V	307
R	S	CA	LEU	A	87	L	-	HA	SER	V	306
R	S	CA	LEU	A	87	L	-	CD	PRO	V	307
R	S	CA	LEU	A	87	L	-	HD3	PRO	V	307
R	S	C	LEU	A	87	L	-	HA	SER	V	306
R	S	C	LEU	A	87	L	-	HB3	SER	V	306
R	S	C	LEU	A	87	L	-	CD	PRO	V	307
R	S	C	LEU	A	87	L	-	HD3	PRO	V	307
R	S	O	LEU	A	87	L	-	CB	SER	V	306
R	S	O	LEU	A	87	L	-	HA	SER	V	306
R	S	O	LEU	A	87	L	-	HB3	SER	V	306
R	S	O	LEU	A	87	L	-	N	PRO	V	307
R	S	O	LEU	A	87	L	-	CG	PRO	V	307
R	S	O	LEU	A	87	L	-	CD	PRO	V	307
R	S	O	LEU	A	87	L	-	HG2	PRO	V	307
R	S	O	LEU	A	87	L	-	HD2	PRO	V	307
R	S	O	LEU	A	87	L	-	HD3	PRO	V	307
R	S	N	ALA	A	88	L	-	OG	SER	V	306
R	S	N	ALA	A	88	L	-	HB3	SER	V	306
R	S	N	ALA	A	88	L	-	HG	SER	V	306
R	S	N	ALA	A	88	L	-	HD3	PRO	V	307
R	S	CA	ALA	A	88	L	-	OG	SER	V	306
R	S	CA	ALA	A	88	L	-	HB3	SER	V	306
R	S	CA	ALA	A	88	L	-	HG	SER	V	306
R	S	C	ALA	A	88	L	-	OG	SER	V	306
R	S	C	ALA	A	88	L	-	HB3	SER	V	306
R	S	C	ALA	A	88	L	-	HG	SER	V	306
R	S	O	ALA	A	88	L	-	HG	SER	V	306
R	S	N	THR	A	89	L	-	HG	SER	V	306
R	S	CB	THR	A	89	L	-	HG	SER	V	306
R	S	OG1	THR	A	89	L	-	OG	SER	V	306
R	S	OG1	THR	A	89	L	-	HG	SER	V	306
R	-	CG	GLU	A	105	L	H	HB3	PRO	V	311
R	-	CG	GLU	A	105	L	H	HG3	PRO	V	311
R	-	CD	GLU	A	105	L	H	HB3	PRO	V	311
R	-	CD	GLU	A	105	L	H	HG3	PRO	V	311
R	-	OE1	GLU	A	105	L	H	HB3	PRO	V	311

- 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