IID

P14207_P55008.1 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	LEU	A	10	L	H	GLU	V	126
R	H	LEU	A	10	L	H	GLU	V	130
R	H	LEU	A	11	L	H	LYS	V	127
R	S	GLN	A	112	L	H	ARG	V	108
R	S	GLN	A	113	L	-	ASP	V	34
R	S	GLN	A	113	L	-	LYS	V	36
R	-	ASN	A	115	L	H	GLN	V	30
R	-	ASN	A	115	L	H	ASP	V	33
R	H	LEU	A	12	L	H	LYS	V	46
R	-	LEU	A	124	L	-	SER	V	95
R	-	ASP	A	125	L	-	SER	V	95
R	H	VAL	A	13	L	-	ASP	V	42
R	H	VAL	A	13	L	H	LYS	V	46
R	H	CYS	A	14	L	H	MET	V	123
R	H	CYS	A	14	L	H	LYS	V	127
R	H	CYS	A	14	L	H	LYS	V	46
R	H	ALA	A	16	L	-	ASP	V	40
R	H	ALA	A	16	L	H	LYS	V	46
R	H	THR	A	17	L	H	MET	V	110
R	H	THR	A	17	L	H	LEU	V	111
R	H	THR	A	17	L	-	GLY	V	112
R	H	THR	A	17	L	H	LYS	V	119
R	H	THR	A	17	L	H	MET	V	123
R	H	THR	A	17	L	-	ASP	V	40
R	H	THR	A	17	L	H	LYS	V	46
R	H	THR	A	17	L	H	PHE	V	50
R	H	MET	A	18	L	H	MET	V	110
R	H	MET	A	18	L	-	GLY	V	112
R	H	MET	A	18	L	-	LYS	V	113
R	H	MET	A	18	L	-	ARG	V	114
R	H	MET	A	18	L	H	LYS	V	119
R	-	HIS	A	189	L	-	GLY	V	96
R	H	CYS	A	19	L	-	LYS	V	113
R	-	SER	A	20	L	H	LEU	V	111
R	-	SER	A	20	L	-	LYS	V	113
R	-	SER	A	20	L	-	LYS	V	36
R	-	SER	A	20	L	-	TYR	V	37
R	-	SER	A	20	L	-	ASP	V	40
R	-	ALA	A	21	L	H	LEU	V	111
R	-	ALA	A	21	L	-	GLY	V	112
R	-	ALA	A	21	L	-	LYS	V	113
R	-	ALA	A	21	L	-	LYS	V	36
R	-	GLN	A	22	L	-	PRO	V	35
R	-	GLN	A	22	L	-	LYS	V	36
R	H	MET	A	227	L	-	ARG	V	114
R	-	ASP	A	23	L	-	LYS	V	113
R	H	MET	A	234	L	-	ARG	V	114
R	H	MET	A	234	L	-	SER	V	115
R	H	MET	A	234	L	-	ALA	V	116
R	H	THR	A	238	L	-	SER	V	115
R	H	LEU	A	241	L	H	MET	V	120
R	H	LEU	A	241	L	H	TYR	V	124
R	H	LEU	A	241	L	H	LYS	V	127
R	H	LEU	A	245	L	H	LYS	V	127
R	H	MET	A	248	L	H	LYS	V	131
R	H	TRP	A	252	L	H	LYS	V	131
R	H	TRP	A	3	L	H	GLU	V	130
R	H	TRP	A	3	L	H	LYS	V	131
R	H	TRP	A	3	L	-	LYS	V	133
R	H	TRP	A	3	L	-	PRO	V	134
R	-	MET	A	6	L	H	GLU	V	130
R	H	PRO	A	7	L	H	GLU	V	130

- 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

P14207_P55008.1 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	CD1	TRP	A	3	L	H	O	GLU	V	130
R	H	CE2	TRP	A	3	L	H	O	GLU	V	130
R	H	CE3	TRP	A	3	L	-	HD2	PRO	V	134
R	H	NE1	TRP	A	3	L	H	O	GLU	V	130
R	H	CH2	TRP	A	3	L	-	HA	LYS	V	133
R	H	CH2	TRP	A	3	L	-	HG2	LYS	V	133
R	H	CH2	TRP	A	3	L	-	HD2	PRO	V	134
R	H	CH2	TRP	A	3	L	-	HD3	PRO	V	134
R	H	CZ2	TRP	A	3	L	H	O	GLU	V	130
R	H	CZ2	TRP	A	3	L	H	HA	LYS	V	131
R	H	CZ2	TRP	A	3	L	-	HA	LYS	V	133
R	H	CZ3	TRP	A	3	L	-	HA	LYS	V	133
R	H	CZ3	TRP	A	3	L	-	CD	PRO	V	134
R	H	CZ3	TRP	A	3	L	-	HD2	PRO	V	134
R	H	CZ3	TRP	A	3	L	-	HD3	PRO	V	134
R	-	C	MET	A	6	L	H	CD	GLU	V	130
R	-	C	MET	A	6	L	H	OE1	GLU	V	130
R	-	CB	MET	A	6	L	H	HG3	GLU	V	130
R	-	O	MET	A	6	L	H	CD	GLU	V	130
R	-	O	MET	A	6	L	H	OE1	GLU	V	130
R	-	CG	MET	A	6	L	H	OE1	GLU	V	130
R	-	CG	MET	A	6	L	H	HG3	GLU	V	130
R	H	N	PRO	A	7	L	H	CD	GLU	V	130
R	H	N	PRO	A	7	L	H	OE1	GLU	V	130
R	H	N	PRO	A	7	L	H	OE2	GLU	V	130
R	H	CA	PRO	A	7	L	H	CD	GLU	V	130
R	H	CA	PRO	A	7	L	H	OE1	GLU	V	130
R	H	CA	PRO	A	7	L	H	OE2	GLU	V	130
R	H	CB	PRO	A	7	L	H	OE2	GLU	V	130
R	H	CG	PRO	A	7	L	H	OE2	GLU	V	130
R	H	CB	LEU	A	10	L	H	CD	GLU	V	130
R	H	CB	LEU	A	10	L	H	OE1	GLU	V	130
R	H	CG	LEU	A	10	L	H	CD	GLU	V	130
R	H	CG	LEU	A	10	L	H	OE1	GLU	V	130
R	H	CD1	LEU	A	10	L	H	HB3	GLU	V	126
R	H	CD1	LEU	A	10	L	H	CG	GLU	V	130
R	H	CD1	LEU	A	10	L	H	CD	GLU	V	130
R	H	CD1	LEU	A	10	L	H	OE1	GLU	V	130
R	H	CD1	LEU	A	10	L	H	OE2	GLU	V	130
R	H	CD1	LEU	A	10	L	H	HG2	GLU	V	130
R	H	CD1	LEU	A	10	L	H	HG3	GLU	V	130
R	H	CD2	LEU	A	10	L	H	OE2	GLU	V	126
R	H	CD2	LEU	A	10	L	H	HB3	GLU	V	126
R	H	CD2	LEU	A	10	L	H	OE1	GLU	V	130
R	H	CD1	LEU	A	11	L	H	HZ1	LYS	V	127
R	H	O	LEU	A	12	L	H	HZ2	LYS	V	46
R	H	CA	VAL	A	13	L	H	CE	LYS	V	46
R	H	CA	VAL	A	13	L	H	NZ	LYS	V	46
R	H	CA	VAL	A	13	L	H	HE2	LYS	V	46
R	H	CA	VAL	A	13	L	H	HE3	LYS	V	46
R	H	CA	VAL	A	13	L	H	HZ2	LYS	V	46
R	H	C	VAL	A	13	L	H	CE	LYS	V	46
R	H	C	VAL	A	13	L	H	NZ	LYS	V	46
R	H	C	VAL	A	13	L	H	HE2	LYS	V	46
R	H	C	VAL	A	13	L	H	HE3	LYS	V	46
R	H	C	VAL	A	13	L	H	HZ2	LYS	V	46
R	H	CB	VAL	A	13	L	H	CE	LYS	V	46
R	H	CB	VAL	A	13	L	H	HG2	LYS	V	46
R	H	CB	VAL	A	13	L	H	HE2	LYS	V	46
R	H	CB	VAL	A	13	L	H	HE3	LYS	V	46
R	H	O	VAL	A	13	L	H	CE	LYS	V	46
R	H	O	VAL	A	13	L	H	NZ	LYS	V	46
R	H	O	VAL	A	13	L	H	HE2	LYS	V	46
R	H	O	VAL	A	13	L	H	HE3	LYS	V	46
R	H	O	VAL	A	13	L	H	HZ2	LYS	V	46
R	H	O	VAL	A	13	L	H	HZ3	LYS	V	46
R	H	CG1	VAL	A	13	L	H	CG	LYS	V	46
R	H	CG1	VAL	A	13	L	H	CD	LYS	V	46
R	H	CG1	VAL	A	13	L	H	CE	LYS	V	46
R	H	CG1	VAL	A	13	L	H	HG2	LYS	V	46
R	H	CG1	VAL	A	13	L	H	HG3	LYS	V	46
R	H	CG1	VAL	A	13	L	H	HD3	LYS	V	46
R	H	CG1	VAL	A	13	L	H	HE2	LYS	V	46
R	H	CG1	VAL	A	13	L	H	HE3	LYS	V	46
R	H	CG2	VAL	A	13	L	-	HB3	ASP	V	42
R	H	CG2	VAL	A	13	L	H	CE	LYS	V	46
R	H	CG2	VAL	A	13	L	H	HG2	LYS	V	46
R	H	CG2	VAL	A	13	L	H	HG3	LYS	V	46
R	H	CG2	VAL	A	13	L	H	HE2	LYS	V	46
R	H	CG2	VAL	A	13	L	H	HE3	LYS	V	46
R	H	N	CYS	A	14	L	H	HE2	LYS	V	46
R	H	CA	CYS	A	14	L	H	HE1	MET	V	123
R	H	SG	CYS	A	14	L	H	SD	MET	V	123
R	H	SG	CYS	A	14	L	H	HB2	MET	V	123
R	H	SG	CYS	A	14	L	H	HE1	MET	V	123
R	H	SG	CYS	A	14	L	H	HE3	LYS	V	127
R	H	N	ALA	A	16	L	H	HZ2	LYS	V	46
R	H	N	ALA	A	16	L	H	HZ3	LYS	V	46
R	H	CA	ALA	A	16	L	-	OD2	ASP	V	40
R	H	CA	ALA	A	16	L	H	NZ	LYS	V	46
R	H	CA	ALA	A	16	L	H	HZ1	LYS	V	46
R	H	CA	ALA	A	16	L	H	HZ2	LYS	V	46
R	H	CA	ALA	A	16	L	H	HZ3	LYS	V	46
R	H	C	ALA	A	16	L	-	CG	ASP	V	40
R	H	C	ALA	A	16	L	-	OD2	ASP	V	40
R	H	C	ALA	A	16	L	H	NZ	LYS	V	46
R	H	C	ALA	A	16	L	H	HZ1	LYS	V	46
R	H	C	ALA	A	16	L	H	HZ2	LYS	V	46
R	H	C	ALA	A	16	L	H	HZ3	LYS	V	46
R	H	CB	ALA	A	16	L	-	CG	ASP	V	40
R	H	CB	ALA	A	16	L	-	OD1	ASP	V	40
R	H	CB	ALA	A	16	L	-	OD2	ASP	V	40
R	H	CB	ALA	A	16	L	H	CE	LYS	V	46
R	H	CB	ALA	A	16	L	H	NZ	LYS	V	46
R	H	CB	ALA	A	16	L	H	HE2	LYS	V	46
R	H	CB	ALA	A	16	L	H	HZ1	LYS	V	46
R	H	CB	ALA	A	16	L	H	HZ2	LYS	V	46
R	H	CB	ALA	A	16	L	H	HZ3	LYS	V	46
R	H	O	ALA	A	16	L	-	CG	ASP	V	40
R	H	O	ALA	A	16	L	-	OD2	ASP	V	40
R	H	O	ALA	A	16	L	-	HB2	ASP	V	40
R	H	O	ALA	A	16	L	H	NZ	LYS	V	46
R	H	O	ALA	A	16	L	H	HZ2	LYS	V	46
R	H	O	ALA	A	16	L	H	HZ3	LYS	V	46
R	H	N	THR	A	17	L	-	OD2	ASP	V	40
R	H	N	THR	A	17	L	H	CE	LYS	V	46
R	H	N	THR	A	17	L	H	NZ	LYS	V	46
R	H	N	THR	A	17	L	H	HE2	LYS	V	46
R	H	N	THR	A	17	L	H	HZ2	LYS	V	46
R	H	N	THR	A	17	L	H	HZ3	LYS	V	46
R	H	CA	THR	A	17	L	-	OD2	ASP	V	40
R	H	CA	THR	A	17	L	H	HD3	LYS	V	46
R	H	CA	THR	A	17	L	H	HZ3	LYS	V	46
R	H	CA	THR	A	17	L	H	O	LEU	V	111
R	H	CA	THR	A	17	L	H	HA	LEU	V	111
R	H	CA	THR	A	17	L	H	HD21	LEU	V	111
R	H	C	THR	A	17	L	H	O	MET	V	110
R	H	C	THR	A	17	L	H	CA	LEU	V	111
R	H	C	THR	A	17	L	H	C	LEU	V	111
R	H	C	THR	A	17	L	H	O	LEU	V	111
R	H	C	THR	A	17	L	H	HA	LEU	V	111
R	H	C	THR	A	17	L	H	HZ3	LYS	V	119
R	H	CB	THR	A	17	L	H	HD3	LYS	V	46
R	H	CB	THR	A	17	L	H	HE2	LYS	V	46
R	H	CB	THR	A	17	L	H	HZ3	LYS	V	46
R	H	CB	THR	A	17	L	H	HZ	PHE	V	50
R	H	CB	THR	A	17	L	H	O	MET	V	110
R	H	CB	THR	A	17	L	H	CA	LEU	V	111
R	H	CB	THR	A	17	L	H	HA	LEU	V	111
R	H	CB	THR	A	17	L	H	HD21	LEU	V	111
R	H	CB	THR	A	17	L	H	HZ3	LYS	V	119
R	H	O	THR	A	17	L	H	O	MET	V	110
R	H	O	THR	A	17	L	H	CA	LEU	V	111
R	H	O	THR	A	17	L	H	C	LEU	V	111
R	H	O	THR	A	17	L	H	O	LEU	V	111
R	H	O	THR	A	17	L	H	HA	LEU	V	111
R	H	O	THR	A	17	L	H	HB2	LEU	V	111
R	H	O	THR	A	17	L	-	N	GLY	V	112
R	H	O	THR	A	17	L	-	CA	GLY	V	112
R	H	O	THR	A	17	L	-	C	GLY	V	112
R	H	O	THR	A	17	L	-	O	GLY	V	112
R	H	O	THR	A	17	L	H	HZ1	LYS	V	119
R	H	O	THR	A	17	L	H	HZ3	LYS	V	119
R	H	CG2	THR	A	17	L	H	CG	LYS	V	46
R	H	CG2	THR	A	17	L	H	CD	LYS	V	46
R	H	CG2	THR	A	17	L	H	CE	LYS	V	46
R	H	CG2	THR	A	17	L	H	NZ	LYS	V	46
R	H	CG2	THR	A	17	L	H	HB3	LYS	V	46
R	H	CG2	THR	A	17	L	H	HG2	LYS	V	46
R	H	CG2	THR	A	17	L	H	HD2	LYS	V	46
R	H	CG2	THR	A	17	L	H	HD3	LYS	V	46
R	H	CG2	THR	A	17	L	H	HE2	LYS	V	46
R	H	CG2	THR	A	17	L	H	HZ3	LYS	V	46
R	H	CG2	THR	A	17	L	H	CE2	PHE	V	50
R	H	CG2	THR	A	17	L	H	CZ	PHE	V	50
R	H	CG2	THR	A	17	L	H	HE2	PHE	V	50
R	H	CG2	THR	A	17	L	H	HZ	PHE	V	50
R	H	CG2	THR	A	17	L	H	O	MET	V	110
R	H	CG2	THR	A	17	L	H	CD2	LEU	V	111
R	H	CG2	THR	A	17	L	H	HA	LEU	V	111
R	H	CG2	THR	A	17	L	H	HD21	LEU	V	111
R	H	CG2	THR	A	17	L	H	HD22	LEU	V	111
R	H	OG1	THR	A	17	L	H	HE2	LYS	V	46
R	H	OG1	THR	A	17	L	H	HZ	PHE	V	50
R	H	OG1	THR	A	17	L	H	O	MET	V	110
R	H	OG1	THR	A	17	L	H	HE1	MET	V	123
R	H	OG1	THR	A	17	L	H	HE3	MET	V	123
R	H	N	MET	A	18	L	H	HZ1	LYS	V	119
R	H	CA	MET	A	18	L	-	O	GLY	V	112
R	H	CA	MET	A	18	L	-	CA	LYS	V	113
R	H	CA	MET	A	18	L	-	HA	LYS	V	113
R	H	CA	MET	A	18	L	-	HG2	LYS	V	113
R	H	CA	MET	A	18	L	H	HZ1	LYS	V	119
R	H	C	MET	A	18	L	-	CA	LYS	V	113
R	H	C	MET	A	18	L	-	CB	LYS	V	113
R	H	C	MET	A	18	L	-	CG	LYS	V	113
R	H	C	MET	A	18	L	-	HA	LYS	V	113
R	H	C	MET	A	18	L	-	HG2	LYS	V	113
R	H	C	MET	A	18	L	-	HG3	LYS	V	113
R	H	C	MET	A	18	L	-	HE2	LYS	V	113
R	H	CB	MET	A	18	L	-	HA	LYS	V	113
R	H	CB	MET	A	18	L	-	HG2	LYS	V	113
R	H	CB	MET	A	18	L	H	HZ1	LYS	V	119
R	H	O	MET	A	18	L	-	C	GLY	V	112
R	H	O	MET	A	18	L	-	N	LYS	V	113
R	H	O	MET	A	18	L	-	CA	LYS	V	113
R	H	O	MET	A	18	L	-	CB	LYS	V	113
R	H	O	MET	A	18	L	-	CG	LYS	V	113
R	H	O	MET	A	18	L	-	CD	LYS	V	113
R	H	O	MET	A	18	L	-	CE	LYS	V	113
R	H	O	MET	A	18	L	-	H	LYS	V	113
R	H	O	MET	A	18	L	-	HA	LYS	V	113
R	H	O	MET	A	18	L	-	HB2	LYS	V	113
R	H	O	MET	A	18	L	-	HB3	LYS	V	113
R	H	O	MET	A	18	L	-	HG2	LYS	V	113
R	H	O	MET	A	18	L	-	HG3	LYS	V	113
R	H	O	MET	A	18	L	-	HD2	LYS	V	113
R	H	O	MET	A	18	L	-	HE2	LYS	V	113
R	H	O	MET	A	18	L	-	HE3	LYS	V	113
R	H	CG	MET	A	18	L	-	HA	LYS	V	113
R	H	CG	MET	A	18	L	H	NZ	LYS	V	119
R	H	CG	MET	A	18	L	H	HE2	LYS	V	119
R	H	CG	MET	A	18	L	H	HZ1	LYS	V	119
R	H	SD	MET	A	18	L	-	O	GLY	V	112
R	H	SD	MET	A	18	L	-	C	LYS	V	113
R	H	SD	MET	A	18	L	-	O	LYS	V	113
R	H	SD	MET	A	18	L	-	HA	LYS	V	113
R	H	SD	MET	A	18	L	H	CE	LYS	V	119
R	H	SD	MET	A	18	L	H	NZ	LYS	V	119
R	H	SD	MET	A	18	L	H	HD3	LYS	V	119
R	H	SD	MET	A	18	L	H	HE2	LYS	V	119
R	H	SD	MET	A	18	L	H	HZ1	LYS	V	119
R	H	SD	MET	A	18	L	H	HZ2	LYS	V	119
R	H	SD	MET	A	18	L	H	HZ3	LYS	V	119
R	H	CE	MET	A	18	L	H	O	MET	V	110
R	H	CE	MET	A	18	L	-	C	GLY	V	112
R	H	CE	MET	A	18	L	-	O	GLY	V	112
R	H	CE	MET	A	18	L	-	HA	LYS	V	113
R	H	CE	MET	A	18	L	-	O	ARG	V	114
R	H	CE	MET	A	18	L	H	CD	LYS	V	119
R	H	CE	MET	A	18	L	H	CE	LYS	V	119
R	H	CE	MET	A	18	L	H	NZ	LYS	V	119
R	H	CE	MET	A	18	L	H	HD2	LYS	V	119
R	H	CE	MET	A	18	L	H	HD3	LYS	V	119
R	H	CE	MET	A	18	L	H	HE2	LYS	V	119
R	H	CE	MET	A	18	L	H	HE3	LYS	V	119
R	H	CE	MET	A	18	L	H	HZ1	LYS	V	119
R	H	CE	MET	A	18	L	H	HZ2	LYS	V	119
R	H	CE	MET	A	18	L	H	HZ3	LYS	V	119
R	H	N	CYS	A	19	L	-	CG	LYS	V	113
R	H	N	CYS	A	19	L	-	HG2	LYS	V	113
R	H	N	CYS	A	19	L	-	HG3	LYS	V	113
R	H	N	CYS	A	19	L	-	HE2	LYS	V	113
R	H	CA	CYS	A	19	L	-	CG	LYS	V	113
R	H	CA	CYS	A	19	L	-	CE	LYS	V	113
R	H	CA	CYS	A	19	L	-	HG2	LYS	V	113
R	H	CA	CYS	A	19	L	-	HG3	LYS	V	113
R	H	CA	CYS	A	19	L	-	HE2	LYS	V	113
R	H	CA	CYS	A	19	L	-	HE3	LYS	V	113
R	H	C	CYS	A	19	L	-	CE	LYS	V	113
R	H	C	CYS	A	19	L	-	HG2	LYS	V	113
R	H	C	CYS	A	19	L	-	HG3	LYS	V	113
R	H	C	CYS	A	19	L	-	HE2	LYS	V	113
R	H	C	CYS	A	19	L	-	HE3	LYS	V	113
R	H	CB	CYS	A	19	L	-	HE2	LYS	V	113
R	H	O	CYS	A	19	L	-	CE	LYS	V	113
R	H	O	CYS	A	19	L	-	NZ	LYS	V	113
R	H	O	CYS	A	19	L	-	HE2	LYS	V	113
R	H	O	CYS	A	19	L	-	HE3	LYS	V	113
R	H	O	CYS	A	19	L	-	HZ1	LYS	V	113
R	H	SG	CYS	A	19	L	-	HE2	LYS	V	113
R	-	N	SER	A	20	L	H	O	LEU	V	111
R	-	N	SER	A	20	L	-	HG3	LYS	V	113
R	-	N	SER	A	20	L	-	HE2	LYS	V	113
R	-	N	SER	A	20	L	-	HE3	LYS	V	113
R	-	CA	SER	A	20	L	-	HD1	TYR	V	37
R	-	CA	SER	A	20	L	H	O	LEU	V	111
R	-	C	SER	A	20	L	-	HD1	TYR	V	37
R	-	C	SER	A	20	L	-	HE1	TYR	V	37
R	-	C	SER	A	20	L	H	O	LEU	V	111
R	-	CB	SER	A	20	L	-	CD1	TYR	V	37
R	-	CB	SER	A	20	L	-	HA	TYR	V	37
R	-	CB	SER	A	20	L	-	HD1	TYR	V	37
R	-	CB	SER	A	20	L	-	CB	ASP	V	40
R	-	CB	SER	A	20	L	-	OD2	ASP	V	40
R	-	CB	SER	A	20	L	-	HB2	ASP	V	40
R	-	CB	SER	A	20	L	H	O	LEU	V	111
R	-	CB	SER	A	20	L	H	HB2	LEU	V	111
R	-	O	SER	A	20	L	-	C	LYS	V	36
R	-	O	SER	A	20	L	-	O	LYS	V	36
R	-	O	SER	A	20	L	-	CG	LYS	V	36
R	-	O	SER	A	20	L	-	HG2	LYS	V	36
R	-	O	SER	A	20	L	-	HE2	LYS	V	36
R	-	O	SER	A	20	L	-	CD1	TYR	V	37
R	-	O	SER	A	20	L	-	CE1	TYR	V	37
R	-	O	SER	A	20	L	-	HA	TYR	V	37
R	-	O	SER	A	20	L	-	HD1	TYR	V	37
R	-	O	SER	A	20	L	-	HE1	TYR	V	37
R	-	OG	SER	A	20	L	-	HA	TYR	V	37
R	-	OG	SER	A	20	L	-	HD1	TYR	V	37
R	-	OG	SER	A	20	L	-	CA	ASP	V	40
R	-	OG	SER	A	20	L	-	CB	ASP	V	40
R	-	OG	SER	A	20	L	-	CG	ASP	V	40
R	-	OG	SER	A	20	L	-	OD2	ASP	V	40
R	-	OG	SER	A	20	L	-	HA	ASP	V	40
R	-	OG	SER	A	20	L	-	HB2	ASP	V	40
R	-	OG	SER	A	20	L	-	HB3	ASP	V	40
R	-	N	ALA	A	21	L	H	O	LEU	V	111
R	-	N	ALA	A	21	L	-	HA2	GLY	V	112
R	-	N	ALA	A	21	L	-	H	LYS	V	113
R	-	N	ALA	A	21	L	-	HG3	LYS	V	113
R	-	N	ALA	A	21	L	-	HE3	LYS	V	113
R	-	CA	ALA	A	21	L	-	HE2	LYS	V	36
R	-	CA	ALA	A	21	L	-	HA2	GLY	V	112
R	-	CA	ALA	A	21	L	-	H	LYS	V	113
R	-	CA	ALA	A	21	L	-	HG3	LYS	V	113
R	-	CA	ALA	A	21	L	-	HE3	LYS	V	113
R	-	C	ALA	A	21	L	-	HG3	LYS	V	113
R	-	C	ALA	A	21	L	-	HE3	LYS	V	113
R	-	CB	ALA	A	21	L	-	CA	GLY	V	112
R	-	CB	ALA	A	21	L	-	C	GLY	V	112
R	-	CB	ALA	A	21	L	-	HA2	GLY	V	112
R	-	CB	ALA	A	21	L	-	HA3	GLY	V	112
R	-	CB	ALA	A	21	L	-	N	LYS	V	113
R	-	CB	ALA	A	21	L	-	CG	LYS	V	113
R	-	CB	ALA	A	21	L	-	H	LYS	V	113
R	-	CB	ALA	A	21	L	-	HB2	LYS	V	113
R	-	CB	ALA	A	21	L	-	HG3	LYS	V	113
R	-	O	ALA	A	21	L	-	CG	LYS	V	113
R	-	O	ALA	A	21	L	-	CD	LYS	V	113
R	-	O	ALA	A	21	L	-	CE	LYS	V	113
R	-	O	ALA	A	21	L	-	NZ	LYS	V	113
R	-	O	ALA	A	21	L	-	HG3	LYS	V	113
R	-	O	ALA	A	21	L	-	HD3	LYS	V	113
R	-	O	ALA	A	21	L	-	HE3	LYS	V	113
R	-	O	ALA	A	21	L	-	HZ3	LYS	V	113
R	-	N	GLN	A	22	L	-	HG2	LYS	V	36
R	-	N	GLN	A	22	L	-	HG3	LYS	V	36
R	-	N	GLN	A	22	L	-	HE2	LYS	V	36
R	-	N	GLN	A	22	L	-	HE3	LYS	V	36
R	-	CA	GLN	A	22	L	-	HG3	LYS	V	36
R	-	CB	GLN	A	22	L	-	O	LYS	V	36
R	-	CB	GLN	A	22	L	-	CG	LYS	V	36
R	-	CB	GLN	A	22	L	-	HA	LYS	V	36
R	-	CB	GLN	A	22	L	-	HG2	LYS	V	36
R	-	CB	GLN	A	22	L	-	HG3	LYS	V	36
R	-	O	GLN	A	22	L	-	HG3	LYS	V	36
R	-	O	GLN	A	22	L	-	HE3	LYS	V	36
R	-	CG	GLN	A	22	L	-	HA	LYS	V	36
R	-	CD	GLN	A	22	L	-	HA	LYS	V	36
R	-	OE1	GLN	A	22	L	-	O	PRO	V	35
R	-	OE1	GLN	A	22	L	-	CA	LYS	V	36
R	-	OE1	GLN	A	22	L	-	C	LYS	V	36
R	-	OE1	GLN	A	22	L	-	O	LYS	V	36
R	-	OE1	GLN	A	22	L	-	HA	LYS	V	36
R	-	CB	ASP	A	23	L	-	HD3	LYS	V	113
R	S	OE1	GLN	A	112	L	H	HD3	ARG	V	108
R	S	N	GLN	A	113	L	-	HD2	LYS	V	36
R	S	N	GLN	A	113	L	-	HZ3	LYS	V	36
R	S	CA	GLN	A	113	L	-	HD2	LYS	V	36
R	S	CB	GLN	A	113	L	-	OD1	ASP	V	34
R	S	CB	GLN	A	113	L	-	CB	LYS	V	36
R	S	CB	GLN	A	113	L	-	CD	LYS	V	36
R	S	CB	GLN	A	113	L	-	HB2	LYS	V	36
R	S	CB	GLN	A	113	L	-	HD2	LYS	V	36
R	S	CB	GLN	A	113	L	-	HD3	LYS	V	36
R	S	CG	GLN	A	113	L	-	CB	LYS	V	36
R	S	CG	GLN	A	113	L	-	CG	LYS	V	36
R	S	CG	GLN	A	113	L	-	CD	LYS	V	36
R	S	CG	GLN	A	113	L	-	HB2	LYS	V	36
R	S	CG	GLN	A	113	L	-	HG3	LYS	V	36
R	S	CG	GLN	A	113	L	-	HD2	LYS	V	36
R	S	CD	GLN	A	113	L	-	HB2	LYS	V	36
R	-	ND2	ASN	A	115	L	H	O	GLN	V	30
R	-	ND2	ASN	A	115	L	H	HA	GLN	V	30
R	-	ND2	ASN	A	115	L	H	CB	ASP	V	33
R	-	ND2	ASN	A	115	L	H	HB2	ASP	V	33
R	-	ND2	ASN	A	115	L	H	HB3	ASP	V	33
R	-	CD1	LEU	A	124	L	-	CB	SER	V	95
R	-	CD1	LEU	A	124	L	-	HB2	SER	V	95
R	-	OD1	ASP	A	125	L	-	O	SER	V	95
R	-	OD2	ASP	A	125	L	-	C	SER	V	95
R	-	OD2	ASP	A	125	L	-	O	SER	V	95
R	-	OD2	ASP	A	125	L	-	HA	SER	V	95
R	-	CG	HIS	A	189	L	-	HA2	GLY	V	96
R	-	CD2	HIS	A	189	L	-	HA2	GLY	V	96
R	-	ND1	HIS	A	189	L	-	HA2	GLY	V	96
R	-	CE1	HIS	A	189	L	-	HA2	GLY	V	96
R	-	NE2	HIS	A	189	L	-	HA2	GLY	V	96
R	H	CB	MET	A	227	L	-	NH2	ARG	V	114
R	H	CB	MET	A	227	L	-	HH21	ARG	V	114
R	H	CB	MET	A	227	L	-	HH22	ARG	V	114
R	H	CG	MET	A	227	L	-	NH2	ARG	V	114
R	H	CG	MET	A	227	L	-	HH21	ARG	V	114
R	H	CG	MET	A	227	L	-	HH22	ARG	V	114
R	H	SD	MET	A	227	L	-	NH2	ARG	V	114
R	H	SD	MET	A	227	L	-	HH22	ARG	V	114
R	H	CE	MET	A	227	L	-	NH2	ARG	V	114
R	H	CE	MET	A	227	L	-	CZ	ARG	V	114
R	H	CE	MET	A	227	L	-	HH21	ARG	V	114
R	H	CE	MET	A	227	L	-	HH22	ARG	V	114
R	H	CB	MET	A	234	L	-	HA	ARG	V	114
R	H	CB	MET	A	234	L	-	H	SER	V	115
R	H	CB	MET	A	234	L	-	HB2	SER	V	115
R	H	O	MET	A	234	L	-	HG	SER	V	115
R	H	CG	MET	A	234	L	-	HA	ARG	V	114
R	H	CG	MET	A	234	L	-	N	SER	V	115
R	H	CG	MET	A	234	L	-	H	SER	V	115
R	H	CG	MET	A	234	L	-	HB2	SER	V	115
R	H	SD	MET	A	234	L	-	C	ARG	V	114
R	H	SD	MET	A	234	L	-	HA	ARG	V	114
R	H	SD	MET	A	234	L	-	N	SER	V	115
R	H	SD	MET	A	234	L	-	CA	SER	V	115
R	H	SD	MET	A	234	L	-	C	SER	V	115
R	H	SD	MET	A	234	L	-	CB	SER	V	115
R	H	SD	MET	A	234	L	-	O	SER	V	115
R	H	SD	MET	A	234	L	-	OG	SER	V	115
R	H	SD	MET	A	234	L	-	H	SER	V	115
R	H	SD	MET	A	234	L	-	HA	SER	V	115
R	H	SD	MET	A	234	L	-	HB2	SER	V	115
R	H	SD	MET	A	234	L	-	HB3	SER	V	115
R	H	SD	MET	A	234	L	-	HG	SER	V	115
R	H	CE	MET	A	234	L	-	CA	ARG	V	114
R	H	CE	MET	A	234	L	-	C	ARG	V	114
R	H	CE	MET	A	234	L	-	CB	ARG	V	114
R	H	CE	MET	A	234	L	-	O	ARG	V	114
R	H	CE	MET	A	234	L	-	HA	ARG	V	114
R	H	CE	MET	A	234	L	-	HB2	ARG	V	114
R	H	CE	MET	A	234	L	-	HB3	ARG	V	114
R	H	CE	MET	A	234	L	-	N	SER	V	115
R	H	CE	MET	A	234	L	-	CA	SER	V	115
R	H	CE	MET	A	234	L	-	C	SER	V	115
R	H	CE	MET	A	234	L	-	CB	SER	V	115
R	H	CE	MET	A	234	L	-	O	SER	V	115
R	H	CE	MET	A	234	L	-	OG	SER	V	115
R	H	CE	MET	A	234	L	-	H	SER	V	115
R	H	CE	MET	A	234	L	-	HA	SER	V	115
R	H	CE	MET	A	234	L	-	HB2	SER	V	115
R	H	CE	MET	A	234	L	-	HB3	SER	V	115
R	H	CE	MET	A	234	L	-	N	ALA	V	116
R	H	CE	MET	A	234	L	-	H	ALA	V	116
R	H	CG2	THR	A	238	L	-	OG	SER	V	115
R	H	CG2	THR	A	238	L	-	HG	SER	V	115
R	H	CB	LEU	A	241	L	H	HE1	MET	V	120
R	H	CB	LEU	A	241	L	H	HH	TYR	V	124
R	H	CG	LEU	A	241	L	H	CE	MET	V	120
R	H	CG	LEU	A	241	L	H	HE1	MET	V	120
R	H	CG	LEU	A	241	L	H	HE2	MET	V	120
R	H	CG	LEU	A	241	L	H	HE3	MET	V	120
R	H	CG	LEU	A	241	L	H	OH	TYR	V	124
R	H	CG	LEU	A	241	L	H	CZ	TYR	V	124
R	H	CG	LEU	A	241	L	H	HH	TYR	V	124
R	H	CD1	LEU	A	241	L	H	CE	MET	V	120
R	H	CD1	LEU	A	241	L	H	HE1	MET	V	120
R	H	CD1	LEU	A	241	L	H	HE2	MET	V	120
R	H	CD1	LEU	A	241	L	H	HE3	MET	V	120
R	H	CD1	LEU	A	241	L	H	CE2	TYR	V	124
R	H	CD1	LEU	A	241	L	H	OH	TYR	V	124
R	H	CD1	LEU	A	241	L	H	CZ	TYR	V	124
R	H	CD1	LEU	A	241	L	H	HE2	TYR	V	124
R	H	CD1	LEU	A	241	L	H	HH	TYR	V	124
R	H	CD2	LEU	A	241	L	H	CE	MET	V	120
R	H	CD2	LEU	A	241	L	H	HE1	MET	V	120
R	H	CD2	LEU	A	241	L	H	HE2	MET	V	120
R	H	CD2	LEU	A	241	L	H	CE1	TYR	V	124
R	H	CD2	LEU	A	241	L	H	CE2	TYR	V	124
R	H	CD2	LEU	A	241	L	H	OH	TYR	V	124
R	H	CD2	LEU	A	241	L	H	CZ	TYR	V	124
R	H	CD2	LEU	A	241	L	H	HH	TYR	V	124
R	H	CD2	LEU	A	241	L	H	HZ3	LYS	V	127
R	H	CB	LEU	A	245	L	H	NZ	LYS	V	127
R	H	CB	LEU	A	245	L	H	HZ2	LYS	V	127
R	H	CG	LEU	A	245	L	H	CE	LYS	V	127
R	H	CG	LEU	A	245	L	H	NZ	LYS	V	127
R	H	CG	LEU	A	245	L	H	HD3	LYS	V	127
R	H	CG	LEU	A	245	L	H	HZ1	LYS	V	127
R	H	CG	LEU	A	245	L	H	HZ2	LYS	V	127
R	H	CG	LEU	A	245	L	H	HZ3	LYS	V	127
R	H	CD1	LEU	A	245	L	H	CD	LYS	V	127
R	H	CD1	LEU	A	245	L	H	CE	LYS	V	127
R	H	CD1	LEU	A	245	L	H	NZ	LYS	V	127
R	H	CD1	LEU	A	245	L	H	HD2	LYS	V	127
R	H	CD1	LEU	A	245	L	H	HD3	LYS	V	127
R	H	CD1	LEU	A	245	L	H	HE2	LYS	V	127
R	H	CD1	LEU	A	245	L	H	HE3	LYS	V	127
R	H	CD1	LEU	A	245	L	H	HZ1	LYS	V	127
R	H	CD1	LEU	A	245	L	H	HZ2	LYS	V	127
R	H	CD1	LEU	A	245	L	H	HZ3	LYS	V	127
R	H	CD2	LEU	A	245	L	H	CD	LYS	V	127
R	H	CD2	LEU	A	245	L	H	CE	LYS	V	127
R	H	CD2	LEU	A	245	L	H	NZ	LYS	V	127
R	H	CD2	LEU	A	245	L	H	HD2	LYS	V	127
R	H	CD2	LEU	A	245	L	H	HD3	LYS	V	127
R	H	CD2	LEU	A	245	L	H	HE2	LYS	V	127
R	H	CD2	LEU	A	245	L	H	HZ1	LYS	V	127
R	H	CD2	LEU	A	245	L	H	HZ2	LYS	V	127
R	H	CD2	LEU	A	245	L	H	HZ3	LYS	V	127
R	H	CB	MET	A	248	L	H	HZ1	LYS	V	131
R	H	CE	MET	A	248	L	H	NZ	LYS	V	131
R	H	CE	MET	A	248	L	H	HZ1	LYS	V	131
R	H	CE	MET	A	248	L	H	HZ2	LYS	V	131
R	H	CE	MET	A	248	L	H	HZ3	LYS	V	131
R	H	CD1	TRP	A	252	L	H	HE3	LYS	V	131
R	H	CD2	TRP	A	252	L	H	HG2	LYS	V	131
R	H	CD2	TRP	A	252	L	H	HE3	LYS	V	131
R	H	CE2	TRP	A	252	L	H	CD	LYS	V	131
R	H	CE2	TRP	A	252	L	H	CE	LYS	V	131
R	H	CE2	TRP	A	252	L	H	HG2	LYS	V	131
R	H	CE2	TRP	A	252	L	H	HD3	LYS	V	131
R	H	CE2	TRP	A	252	L	H	HE3	LYS	V	131
R	H	CE2	TRP	A	252	L	H	HZ2	LYS	V	131
R	H	CE3	TRP	A	252	L	H	HG2	LYS	V	131
R	H	NE1	TRP	A	252	L	H	CE	LYS	V	131
R	H	NE1	TRP	A	252	L	H	NZ	LYS	V	131
R	H	NE1	TRP	A	252	L	H	HD3	LYS	V	131
R	H	NE1	TRP	A	252	L	H	HE3	LYS	V	131
R	H	NE1	TRP	A	252	L	H	HZ1	LYS	V	131
R	H	NE1	TRP	A	252	L	H	HZ2	LYS	V	131
R	H	CH2	TRP	A	252	L	H	CA	LYS	V	131
R	H	CH2	TRP	A	252	L	H	CB	LYS	V	131
R	H	CH2	TRP	A	252	L	H	CG	LYS	V	131
R	H	CH2	TRP	A	252	L	H	CD	LYS	V	131
R	H	CH2	TRP	A	252	L	H	HA	LYS	V	131
R	H	CH2	TRP	A	252	L	H	HB3	LYS	V	131
R	H	CH2	TRP	A	252	L	H	HG2	LYS	V	131
R	H	CH2	TRP	A	252	L	H	HD3	LYS	V	131
R	H	CH2	TRP	A	252	L	H	HE3	LYS	V	131
R	H	CZ2	TRP	A	252	L	H	CB	LYS	V	131
R	H	CZ2	TRP	A	252	L	H	CG	LYS	V	131
R	H	CZ2	TRP	A	252	L	H	CD	LYS	V	131
R	H	CZ2	TRP	A	252	L	H	CE	LYS	V	131
R	H	CZ2	TRP	A	252	L	H	HB3	LYS	V	131
R	H	CZ2	TRP	A	252	L	H	HG2	LYS	V	131
R	H	CZ2	TRP	A	252	L	H	HD3	LYS	V	131
R	H	CZ2	TRP	A	252	L	H	HE3	LYS	V	131
R	H	CZ2	TRP	A	252	L	H	HZ2	LYS	V	131
R	H	CZ3	TRP	A	252	L	H	HA	LYS	V	131
R	H	CZ3	TRP	A	252	L	H	HG2	LYS	V	131

- 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