IID

A8MVA2_A8MVA2.1 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	-	HIS	A	122	L	-	THR	V	31
R	-	THR	A	125	L	H	THR	V	22
R	-	THR	A	125	L	-	GLN	V	25
R	-	THR	A	125	L	-	THR	V	27
R	-	VAL	A	126	L	H	THR	V	22
R	-	VAL	A	126	L	-	CYS	V	23
R	-	VAL	A	126	L	-	GLN	V	25
R	-	VAL	A	126	L	-	PRO	V	26
R	-	VAL	A	126	L	-	THR	V	27
R	-	CYS	A	127	L	-	PRO	V	26
R	-	CYS	A	127	L	-	ILE	V	28
R	-	CYS	A	127	L	-	VAL	V	29
R	-	LEU	A	128	L	-	CYS	V	23
R	-	LEU	A	128	L	-	TRP	V	24
R	-	LEU	A	128	L	-	PRO	V	26
R	-	LEU	A	128	L	-	ILE	V	28
R	-	PRO	A	129	L	-	ILE	V	28
R	-	CYS	A	13	L	-	HIS	V	53
R	-	GLY	A	130	L	-	ILE	V	28
R	-	CYS	A	131	L	-	ILE	V	28
R	H	THR	A	21	L	-	THR	V	125
R	H	THR	A	22	L	-	THR	V	125
R	H	THR	A	22	L	-	VAL	V	126
R	-	CYS	A	23	L	-	VAL	V	126
R	-	CYS	A	23	L	-	LEU	V	128
R	-	TRP	A	24	L	-	LEU	V	128
R	-	GLN	A	25	L	-	THR	V	125
R	-	GLN	A	25	L	-	VAL	V	126
R	-	GLN	A	25	L	-	LEU	V	128
R	-	PRO	A	26	L	-	VAL	V	126
R	-	PRO	A	26	L	-	LEU	V	128
R	-	THR	A	27	L	-	THR	V	125
R	-	THR	A	27	L	-	VAL	V	126
R	-	THR	A	27	L	-	CYS	V	127
R	-	THR	A	27	L	-	LEU	V	128
R	-	ILE	A	28	L	-	CYS	V	127
R	-	ILE	A	28	L	-	LEU	V	128
R	-	ILE	A	28	L	-	PRO	V	129
R	-	ILE	A	28	L	-	GLY	V	130
R	-	ILE	A	28	L	-	CYS	V	131
R	-	VAL	A	29	L	-	CYS	V	127
R	-	THR	A	31	L	-	HIS	V	122
R	-	THR	A	35	L	-	PRO	V	123
R	-	CYS	A	37	L	-	THR	V	60
R	-	CYS	A	38	L	-	CYS	V	62
R	-	GLN	A	39	L	-	THR	V	60
R	-	GLN	A	39	L	-	CYS	V	62
R	-	GLN	A	39	L	-	ARG	V	63
R	-	PRO	A	40	L	-	THR	V	60
R	-	SER	A	41	L	-	CYS	V	62
R	-	CYS	A	42	L	-	CYS	V	57
R	-	CYS	A	42	L	-	GLN	V	58
R	-	CYS	A	42	L	-	ASN	V	59
R	-	CYS	A	42	L	-	THR	V	60
R	-	CYS	A	42	L	-	CYS	V	61
R	-	CYS	A	42	L	-	CYS	V	62
R	-	SER	A	46	L	-	CYS	V	67
R	-	GLN	A	49	L	-	CYS	V	66
R	-	HIS	A	53	L	-	CYS	V	13
R	-	PRO	A	54	L	-	CYS	V	48
R	-	CYS	A	57	L	-	CYS	V	42
R	-	CYS	A	57	L	-	CYS	V	48
R	-	ASN	A	59	L	-	CYS	V	42
R	-	THR	A	60	L	-	CYS	V	37
R	-	THR	A	60	L	-	CYS	V	42
R	-	CYS	A	61	L	-	CYS	V	37
R	-	CYS	A	61	L	-	CYS	V	42
R	-	CYS	A	62	L	-	CYS	V	38
R	-	CYS	A	62	L	-	GLN	V	39
R	-	CYS	A	62	L	-	SER	V	41
R	-	ARG	A	63	L	-	GLN	V	39
R	-	CYS	A	66	L	-	CYS	V	47
R	-	CYS	A	67	L	-	SER	V	46

- 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

A8MVA2_A8MVA2.1 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	-	SG	CYS	A	13	L	-	HE1	HIS	V	53
R	H	O	THR	A	21	L	-	HG21	THR	V	125
R	H	CA	THR	A	22	L	-	HG22	THR	V	125
R	H	C	THR	A	22	L	-	HG22	THR	V	125
R	H	C	THR	A	22	L	-	HG22	VAL	V	126
R	H	CB	THR	A	22	L	-	HG22	THR	V	125
R	H	O	THR	A	22	L	-	CG2	THR	V	125
R	H	O	THR	A	22	L	-	HG22	THR	V	125
R	H	O	THR	A	22	L	-	CB	VAL	V	126
R	H	O	THR	A	22	L	-	CG2	VAL	V	126
R	H	O	THR	A	22	L	-	HB	VAL	V	126
R	H	O	THR	A	22	L	-	HG13	VAL	V	126
R	H	O	THR	A	22	L	-	HG21	VAL	V	126
R	H	O	THR	A	22	L	-	HG22	VAL	V	126
R	-	N	CYS	A	23	L	-	HG22	VAL	V	126
R	-	CA	CYS	A	23	L	-	HG13	VAL	V	126
R	-	CA	CYS	A	23	L	-	HG22	VAL	V	126
R	-	C	CYS	A	23	L	-	HG13	VAL	V	126
R	-	C	CYS	A	23	L	-	HD13	LEU	V	128
R	-	O	CYS	A	23	L	-	HG13	VAL	V	126
R	-	O	CYS	A	23	L	-	CD1	LEU	V	128
R	-	O	CYS	A	23	L	-	HD11	LEU	V	128
R	-	O	CYS	A	23	L	-	HD12	LEU	V	128
R	-	O	CYS	A	23	L	-	HD13	LEU	V	128
R	-	O	CYS	A	23	L	-	HD22	LEU	V	128
R	-	N	TRP	A	24	L	-	HD13	LEU	V	128
R	-	CA	TRP	A	24	L	-	CD1	LEU	V	128
R	-	CA	TRP	A	24	L	-	HD11	LEU	V	128
R	-	CA	TRP	A	24	L	-	HD12	LEU	V	128
R	-	CA	TRP	A	24	L	-	HD13	LEU	V	128
R	-	C	TRP	A	24	L	-	HD11	LEU	V	128
R	-	C	TRP	A	24	L	-	HD12	LEU	V	128
R	-	C	TRP	A	24	L	-	HD13	LEU	V	128
R	-	N	GLN	A	25	L	-	CD1	LEU	V	128
R	-	N	GLN	A	25	L	-	HD11	LEU	V	128
R	-	N	GLN	A	25	L	-	HD12	LEU	V	128
R	-	N	GLN	A	25	L	-	HD13	LEU	V	128
R	-	CA	GLN	A	25	L	-	HD11	LEU	V	128
R	-	C	GLN	A	25	L	-	O	VAL	V	126
R	-	C	GLN	A	25	L	-	CD1	LEU	V	128
R	-	C	GLN	A	25	L	-	HB2	LEU	V	128
R	-	C	GLN	A	25	L	-	HD11	LEU	V	128
R	-	C	GLN	A	25	L	-	HD12	LEU	V	128
R	-	CB	GLN	A	25	L	-	HB	THR	V	125
R	-	O	GLN	A	25	L	-	HB	THR	V	125
R	-	O	GLN	A	25	L	-	C	VAL	V	126
R	-	O	GLN	A	25	L	-	O	VAL	V	126
R	-	O	GLN	A	25	L	-	HB	VAL	V	126
R	-	O	GLN	A	25	L	-	HG11	VAL	V	126
R	-	O	GLN	A	25	L	-	CD1	LEU	V	128
R	-	O	GLN	A	25	L	-	H	LEU	V	128
R	-	O	GLN	A	25	L	-	HB2	LEU	V	128
R	-	O	GLN	A	25	L	-	HD11	LEU	V	128
R	-	N	PRO	A	26	L	-	CB	LEU	V	128
R	-	N	PRO	A	26	L	-	CD1	LEU	V	128
R	-	N	PRO	A	26	L	-	H	LEU	V	128
R	-	N	PRO	A	26	L	-	HB2	LEU	V	128
R	-	N	PRO	A	26	L	-	HD11	LEU	V	128
R	-	N	PRO	A	26	L	-	HD12	LEU	V	128
R	-	CA	PRO	A	26	L	-	O	VAL	V	126
R	-	CA	PRO	A	26	L	-	N	LEU	V	128
R	-	CA	PRO	A	26	L	-	CA	LEU	V	128
R	-	CA	PRO	A	26	L	-	CB	LEU	V	128
R	-	CA	PRO	A	26	L	-	O	LEU	V	128
R	-	CA	PRO	A	26	L	-	CD1	LEU	V	128
R	-	CA	PRO	A	26	L	-	H	LEU	V	128
R	-	CA	PRO	A	26	L	-	HB2	LEU	V	128
R	-	CA	PRO	A	26	L	-	HB3	LEU	V	128
R	-	CA	PRO	A	26	L	-	HD11	LEU	V	128
R	-	C	PRO	A	26	L	-	O	VAL	V	126
R	-	C	PRO	A	26	L	-	H	LEU	V	128
R	-	C	PRO	A	26	L	-	HB2	LEU	V	128
R	-	CB	PRO	A	26	L	-	N	LEU	V	128
R	-	CB	PRO	A	26	L	-	CA	LEU	V	128
R	-	CB	PRO	A	26	L	-	C	LEU	V	128
R	-	CB	PRO	A	26	L	-	CB	LEU	V	128
R	-	CB	PRO	A	26	L	-	O	LEU	V	128
R	-	CB	PRO	A	26	L	-	CG	LEU	V	128
R	-	CB	PRO	A	26	L	-	H	LEU	V	128
R	-	CB	PRO	A	26	L	-	HB2	LEU	V	128
R	-	CB	PRO	A	26	L	-	HB3	LEU	V	128
R	-	CB	PRO	A	26	L	-	HD11	LEU	V	128
R	-	CB	PRO	A	26	L	-	HD12	LEU	V	128
R	-	CG	PRO	A	26	L	-	CB	LEU	V	128
R	-	CG	PRO	A	26	L	-	HB2	LEU	V	128
R	-	CG	PRO	A	26	L	-	HB3	LEU	V	128
R	-	CD	PRO	A	26	L	-	HB2	LEU	V	128
R	-	CD	PRO	A	26	L	-	HD11	LEU	V	128
R	-	CD	PRO	A	26	L	-	HD12	LEU	V	128
R	-	N	THR	A	27	L	-	O	VAL	V	126
R	-	N	THR	A	27	L	-	HA	CYS	V	127
R	-	N	THR	A	27	L	-	H	LEU	V	128
R	-	C	THR	A	27	L	-	O	THR	V	125
R	-	C	THR	A	27	L	-	O	VAL	V	126
R	-	C	THR	A	27	L	-	HA	CYS	V	127
R	-	O	THR	A	27	L	-	O	THR	V	125
R	-	O	THR	A	27	L	-	C	VAL	V	126
R	-	O	THR	A	27	L	-	O	VAL	V	126
R	-	O	THR	A	27	L	-	HA	CYS	V	127
R	-	N	ILE	A	28	L	-	CA	CYS	V	127
R	-	N	ILE	A	28	L	-	SG	CYS	V	127
R	-	N	ILE	A	28	L	-	HA	CYS	V	127
R	-	N	ILE	A	28	L	-	H	LEU	V	128
R	-	CA	ILE	A	28	L	-	CA	CYS	V	127
R	-	CA	ILE	A	28	L	-	CB	CYS	V	127
R	-	CA	ILE	A	28	L	-	SG	CYS	V	127
R	-	CA	ILE	A	28	L	-	HA	CYS	V	127
R	-	CA	ILE	A	28	L	-	HB3	CYS	V	127
R	-	CA	ILE	A	28	L	-	HG	CYS	V	127
R	-	C	ILE	A	28	L	-	SG	CYS	V	127
R	-	CB	ILE	A	28	L	-	SG	CYS	V	127
R	-	CB	ILE	A	28	L	-	HA	CYS	V	127
R	-	CB	ILE	A	28	L	-	HB3	CYS	V	127
R	-	CB	ILE	A	28	L	-	HB2	CYS	V	131
R	-	CG1	ILE	A	28	L	-	CA	CYS	V	127
R	-	CG1	ILE	A	28	L	-	CB	CYS	V	127
R	-	CG1	ILE	A	28	L	-	SG	CYS	V	127
R	-	CG1	ILE	A	28	L	-	HA	CYS	V	127
R	-	CG1	ILE	A	28	L	-	HB3	CYS	V	127
R	-	CG1	ILE	A	28	L	-	O	LEU	V	128
R	-	CG1	ILE	A	28	L	-	HA	PRO	V	129
R	-	CG2	ILE	A	28	L	-	HB2	CYS	V	131
R	-	CD1	ILE	A	28	L	-	HB3	CYS	V	127
R	-	CD1	ILE	A	28	L	-	O	LEU	V	128
R	-	CD1	ILE	A	28	L	-	CA	PRO	V	129
R	-	CD1	ILE	A	28	L	-	HA	PRO	V	129
R	-	CD1	ILE	A	28	L	-	N	GLY	V	130
R	-	CD1	ILE	A	28	L	-	H	GLY	V	130
R	-	CD1	ILE	A	28	L	-	N	CYS	V	131
R	-	CD1	ILE	A	28	L	-	H	CYS	V	131
R	-	CD1	ILE	A	28	L	-	HB2	CYS	V	131
R	-	N	VAL	A	29	L	-	SG	CYS	V	127
R	-	N	VAL	A	29	L	-	HG	CYS	V	127
R	-	CG1	VAL	A	29	L	-	HG	CYS	V	127
R	-	CB	THR	A	31	L	-	ND1	HIS	V	122
R	-	CG2	THR	A	31	L	-	CG	HIS	V	122
R	-	CG2	THR	A	31	L	-	ND1	HIS	V	122
R	-	CG2	THR	A	31	L	-	CE1	HIS	V	122
R	-	CG2	THR	A	31	L	-	NE2	HIS	V	122
R	-	CG2	THR	A	31	L	-	HE1	HIS	V	122
R	-	OG1	THR	A	31	L	-	CG	HIS	V	122
R	-	OG1	THR	A	31	L	-	ND1	HIS	V	122
R	-	OG1	THR	A	31	L	-	CE1	HIS	V	122
R	-	OG1	THR	A	31	L	-	HB3	HIS	V	122
R	-	OG1	THR	A	35	L	-	HB3	PRO	V	123
R	-	O	CYS	A	37	L	-	CB	THR	V	60
R	-	O	CYS	A	37	L	-	HB	THR	V	60
R	-	N	CYS	A	38	L	-	HG	CYS	V	62
R	-	CA	CYS	A	38	L	-	HG	CYS	V	62
R	-	C	CYS	A	38	L	-	SG	CYS	V	62
R	-	C	CYS	A	38	L	-	HG	CYS	V	62
R	-	O	CYS	A	38	L	-	SG	CYS	V	62
R	-	O	CYS	A	38	L	-	HG	CYS	V	62
R	-	N	GLN	A	39	L	-	SG	CYS	V	62
R	-	N	GLN	A	39	L	-	HG	CYS	V	62
R	-	CA	GLN	A	39	L	-	SG	CYS	V	62
R	-	CA	GLN	A	39	L	-	HG	CYS	V	62
R	-	C	GLN	A	39	L	-	HA	THR	V	60
R	-	C	GLN	A	39	L	-	HG23	THR	V	60
R	-	C	GLN	A	39	L	-	SG	CYS	V	62
R	-	C	GLN	A	39	L	-	HG	CYS	V	62
R	-	CB	GLN	A	39	L	-	SG	CYS	V	62
R	-	CB	GLN	A	39	L	-	HG	CYS	V	62
R	-	O	GLN	A	39	L	-	CA	THR	V	60
R	-	O	GLN	A	39	L	-	CG2	THR	V	60
R	-	O	GLN	A	39	L	-	HA	THR	V	60
R	-	O	GLN	A	39	L	-	HG23	THR	V	60
R	-	O	GLN	A	39	L	-	SG	CYS	V	62
R	-	O	GLN	A	39	L	-	H	CYS	V	62
R	-	CG	GLN	A	39	L	-	SG	CYS	V	62
R	-	CG	GLN	A	39	L	-	HG	CYS	V	62
R	-	CD	GLN	A	39	L	-	HE	ARG	V	63
R	-	OE1	GLN	A	39	L	-	SG	CYS	V	62
R	-	OE1	GLN	A	39	L	-	CG	ARG	V	63
R	-	OE1	GLN	A	39	L	-	CD	ARG	V	63
R	-	OE1	GLN	A	39	L	-	NE	ARG	V	63
R	-	OE1	GLN	A	39	L	-	HG3	ARG	V	63
R	-	OE1	GLN	A	39	L	-	HD2	ARG	V	63
R	-	OE1	GLN	A	39	L	-	HE	ARG	V	63
R	-	OE1	GLN	A	39	L	-	HH21	ARG	V	63
R	-	N	PRO	A	40	L	-	HG23	THR	V	60
R	-	CA	SER	A	41	L	-	H	CYS	V	62
R	-	C	SER	A	41	L	-	H	CYS	V	62
R	-	CB	SER	A	41	L	-	H	CYS	V	62
R	-	CB	SER	A	41	L	-	HA	CYS	V	62
R	-	O	SER	A	41	L	-	H	CYS	V	62
R	-	N	CYS	A	42	L	-	H	CYS	V	62
R	-	CB	CYS	A	42	L	-	O	CYS	V	57
R	-	CB	CYS	A	42	L	-	HA	GLN	V	58
R	-	CB	CYS	A	42	L	-	H	ASN	V	59
R	-	CB	CYS	A	42	L	-	N	THR	V	60
R	-	CB	CYS	A	42	L	-	H	THR	V	60
R	-	CB	CYS	A	42	L	-	H	CYS	V	61
R	-	O	CYS	A	42	L	-	O	CYS	V	57
R	-	SG	CYS	A	42	L	-	C	ASN	V	59
R	-	SG	CYS	A	42	L	-	O	ASN	V	59
R	-	SG	CYS	A	42	L	-	H	ASN	V	59
R	-	SG	CYS	A	42	L	-	N	THR	V	60
R	-	SG	CYS	A	42	L	-	CA	THR	V	60
R	-	SG	CYS	A	42	L	-	C	THR	V	60
R	-	SG	CYS	A	42	L	-	H	THR	V	60
R	-	SG	CYS	A	42	L	-	HA	THR	V	60
R	-	SG	CYS	A	42	L	-	N	CYS	V	61
R	-	SG	CYS	A	42	L	-	C	CYS	V	61
R	-	SG	CYS	A	42	L	-	O	CYS	V	61
R	-	SG	CYS	A	42	L	-	H	CYS	V	61
R	-	C	SER	A	46	L	-	HG	CYS	V	67
R	-	CB	SER	A	46	L	-	HG	CYS	V	67
R	-	O	SER	A	46	L	-	SG	CYS	V	67
R	-	O	SER	A	46	L	-	HG	CYS	V	67
R	-	OG	SER	A	46	L	-	HG	CYS	V	67
R	-	O	GLN	A	49	L	-	HG	CYS	V	66
R	-	CE1	HIS	A	53	L	-	HG	CYS	V	13
R	-	CB	PRO	A	54	L	-	HG	CYS	V	48
R	-	C	CYS	A	57	L	-	HB2	CYS	V	42
R	-	O	CYS	A	57	L	-	O	CYS	V	42
R	-	O	CYS	A	57	L	-	HB2	CYS	V	42
R	-	SG	CYS	A	57	L	-	HG	CYS	V	48
R	-	N	ASN	A	59	L	-	HG	CYS	V	42
R	-	CA	ASN	A	59	L	-	HG	CYS	V	42
R	-	C	ASN	A	59	L	-	SG	CYS	V	42
R	-	C	ASN	A	59	L	-	HB3	CYS	V	42
R	-	C	ASN	A	59	L	-	HG	CYS	V	42
R	-	O	ASN	A	59	L	-	HG	CYS	V	42
R	-	N	THR	A	60	L	-	CB	CYS	V	42
R	-	N	THR	A	60	L	-	SG	CYS	V	42
R	-	N	THR	A	60	L	-	HB3	CYS	V	42
R	-	N	THR	A	60	L	-	HG	CYS	V	42
R	-	CA	THR	A	60	L	-	SG	CYS	V	42
R	-	CA	THR	A	60	L	-	HG	CYS	V	42
R	-	C	THR	A	60	L	-	SG	CYS	V	42
R	-	C	THR	A	60	L	-	HG	CYS	V	42
R	-	O	THR	A	60	L	-	HB3	CYS	V	37
R	-	N	CYS	A	61	L	-	SG	CYS	V	42
R	-	N	CYS	A	61	L	-	HG	CYS	V	42
R	-	CA	CYS	A	61	L	-	SG	CYS	V	42
R	-	CA	CYS	A	61	L	-	HG	CYS	V	42
R	-	C	CYS	A	61	L	-	SG	CYS	V	42
R	-	O	CYS	A	61	L	-	SG	CYS	V	42
R	-	O	CYS	A	61	L	-	HG	CYS	V	42
R	-	SG	CYS	A	61	L	-	HA	CYS	V	37
R	-	SG	CYS	A	61	L	-	HB3	CYS	V	37
R	-	N	CYS	A	62	L	-	HB2	SER	V	41
R	-	CA	CYS	A	62	L	-	HB2	GLN	V	39
R	-	CA	CYS	A	62	L	-	HB2	SER	V	41
R	-	CB	CYS	A	62	L	-	O	CYS	V	38
R	-	CB	CYS	A	62	L	-	N	GLN	V	39
R	-	CB	CYS	A	62	L	-	CB	GLN	V	39
R	-	CB	CYS	A	62	L	-	H	GLN	V	39
R	-	CB	CYS	A	62	L	-	HB2	GLN	V	39
R	-	SG	CYS	A	62	L	-	C	CYS	V	38
R	-	SG	CYS	A	62	L	-	O	CYS	V	38
R	-	SG	CYS	A	62	L	-	N	GLN	V	39
R	-	SG	CYS	A	62	L	-	CA	GLN	V	39
R	-	SG	CYS	A	62	L	-	C	GLN	V	39
R	-	SG	CYS	A	62	L	-	CB	GLN	V	39
R	-	SG	CYS	A	62	L	-	O	GLN	V	39
R	-	SG	CYS	A	62	L	-	CG	GLN	V	39
R	-	SG	CYS	A	62	L	-	H	GLN	V	39
R	-	SG	CYS	A	62	L	-	HA	GLN	V	39
R	-	SG	CYS	A	62	L	-	HB2	GLN	V	39
R	-	SG	CYS	A	62	L	-	HB3	GLN	V	39
R	-	SG	CYS	A	62	L	-	HG3	GLN	V	39
R	-	SG	CYS	A	62	L	-	H	SER	V	41
R	-	SG	CYS	A	62	L	-	HB2	SER	V	41
R	-	CG	ARG	A	63	L	-	OE1	GLN	V	39
R	-	CD	ARG	A	63	L	-	OE1	GLN	V	39
R	-	NE	ARG	A	63	L	-	OE1	GLN	V	39
R	-	CZ	ARG	A	63	L	-	OE1	GLN	V	39
R	-	SG	CYS	A	66	L	-	HA	CYS	V	47
R	-	SG	CYS	A	67	L	-	O	SER	V	46
R	-	SG	CYS	A	67	L	-	HB2	SER	V	46
R	-	SG	CYS	A	67	L	-	HB3	SER	V	46
R	-	CB	HIS	A	122	L	-	OG1	THR	V	31
R	-	CB	HIS	A	122	L	-	HG21	THR	V	31
R	-	CG	HIS	A	122	L	-	CB	THR	V	31
R	-	CG	HIS	A	122	L	-	CG2	THR	V	31
R	-	CG	HIS	A	122	L	-	OG1	THR	V	31
R	-	CG	HIS	A	122	L	-	HB	THR	V	31
R	-	CG	HIS	A	122	L	-	HG1	THR	V	31
R	-	CG	HIS	A	122	L	-	HG21	THR	V	31
R	-	CD2	HIS	A	122	L	-	CG2	THR	V	31
R	-	CD2	HIS	A	122	L	-	OG1	THR	V	31
R	-	CD2	HIS	A	122	L	-	HB	THR	V	31
R	-	CD2	HIS	A	122	L	-	HG21	THR	V	31
R	-	ND1	HIS	A	122	L	-	CB	THR	V	31
R	-	ND1	HIS	A	122	L	-	CG2	THR	V	31
R	-	ND1	HIS	A	122	L	-	OG1	THR	V	31
R	-	ND1	HIS	A	122	L	-	HB	THR	V	31
R	-	ND1	HIS	A	122	L	-	HG1	THR	V	31
R	-	ND1	HIS	A	122	L	-	HG21	THR	V	31
R	-	ND1	HIS	A	122	L	-	HG23	THR	V	31
R	-	CE1	HIS	A	122	L	-	CB	THR	V	31
R	-	CE1	HIS	A	122	L	-	CG2	THR	V	31
R	-	CE1	HIS	A	122	L	-	OG1	THR	V	31
R	-	CE1	HIS	A	122	L	-	HB	THR	V	31
R	-	CE1	HIS	A	122	L	-	HG1	THR	V	31
R	-	CE1	HIS	A	122	L	-	HG21	THR	V	31
R	-	CE1	HIS	A	122	L	-	HG22	THR	V	31
R	-	CE1	HIS	A	122	L	-	HG23	THR	V	31
R	-	NE2	HIS	A	122	L	-	CG2	THR	V	31
R	-	NE2	HIS	A	122	L	-	OG1	THR	V	31
R	-	NE2	HIS	A	122	L	-	HG21	THR	V	31
R	-	NE2	HIS	A	122	L	-	HG22	THR	V	31
R	-	NE2	HIS	A	122	L	-	HG23	THR	V	31
R	-	CB	THR	A	125	L	H	O	THR	V	22
R	-	CB	THR	A	125	L	-	HB3	GLN	V	25
R	-	O	THR	A	125	L	-	O	GLN	V	25
R	-	O	THR	A	125	L	-	O	THR	V	27
R	-	O	THR	A	125	L	-	H	THR	V	27
R	-	O	THR	A	125	L	-	HB	THR	V	27
R	-	CG2	THR	A	125	L	H	CA	THR	V	22
R	-	CG2	THR	A	125	L	H	C	THR	V	22
R	-	CG2	THR	A	125	L	H	O	THR	V	22
R	-	CG2	THR	A	125	L	H	HA	THR	V	22
R	-	CG2	THR	A	125	L	H	HB	THR	V	22
R	-	CG2	THR	A	125	L	H	HG22	THR	V	22
R	-	OG1	THR	A	125	L	-	HB3	GLN	V	25
R	-	C	VAL	A	126	L	-	O	GLN	V	25
R	-	C	VAL	A	126	L	-	HA	PRO	V	26
R	-	CB	VAL	A	126	L	H	O	THR	V	22
R	-	CB	VAL	A	126	L	-	HA	CYS	V	23
R	-	O	VAL	A	126	L	-	C	GLN	V	25
R	-	O	VAL	A	126	L	-	O	GLN	V	25
R	-	O	VAL	A	126	L	-	CA	PRO	V	26
R	-	O	VAL	A	126	L	-	HA	PRO	V	26
R	-	O	VAL	A	126	L	-	N	THR	V	27
R	-	O	VAL	A	126	L	-	H	THR	V	27
R	-	CG1	VAL	A	126	L	-	O	CYS	V	23
R	-	CG1	VAL	A	126	L	-	HA	CYS	V	23
R	-	CG2	VAL	A	126	L	H	O	THR	V	22
R	-	CG2	VAL	A	126	L	-	HA	CYS	V	23
R	-	CA	CYS	A	127	L	-	HA	PRO	V	26
R	-	CA	CYS	A	127	L	-	HA	ILE	V	28
R	-	CA	CYS	A	127	L	-	HG12	ILE	V	28
R	-	CA	CYS	A	127	L	-	HG13	ILE	V	28
R	-	C	CYS	A	127	L	-	HA	PRO	V	26
R	-	CB	CYS	A	127	L	-	CG1	ILE	V	28
R	-	CB	CYS	A	127	L	-	HA	ILE	V	28
R	-	CB	CYS	A	127	L	-	HG12	ILE	V	28
R	-	CB	CYS	A	127	L	-	HG13	ILE	V	28
R	-	SG	CYS	A	127	L	-	CA	ILE	V	28
R	-	SG	CYS	A	127	L	-	CG1	ILE	V	28
R	-	SG	CYS	A	127	L	-	HA	ILE	V	28
R	-	SG	CYS	A	127	L	-	HG12	ILE	V	28
R	-	SG	CYS	A	127	L	-	HG13	ILE	V	28
R	-	SG	CYS	A	127	L	-	N	VAL	V	29
R	-	SG	CYS	A	127	L	-	H	VAL	V	29
R	-	N	LEU	A	128	L	-	CA	PRO	V	26
R	-	N	LEU	A	128	L	-	CB	PRO	V	26
R	-	N	LEU	A	128	L	-	HA	PRO	V	26
R	-	N	LEU	A	128	L	-	HB2	PRO	V	26
R	-	N	LEU	A	128	L	-	HB3	PRO	V	26
R	-	N	LEU	A	128	L	-	HG13	ILE	V	28
R	-	CA	LEU	A	128	L	-	CB	PRO	V	26
R	-	CA	LEU	A	128	L	-	HA	PRO	V	26
R	-	CA	LEU	A	128	L	-	HB2	PRO	V	26
R	-	CA	LEU	A	128	L	-	HB3	PRO	V	26
R	-	C	LEU	A	128	L	-	CB	PRO	V	26
R	-	C	LEU	A	128	L	-	HB2	PRO	V	26
R	-	C	LEU	A	128	L	-	HB3	PRO	V	26
R	-	C	LEU	A	128	L	-	HD11	ILE	V	28
R	-	CB	LEU	A	128	L	-	CA	PRO	V	26
R	-	CB	LEU	A	128	L	-	CB	PRO	V	26
R	-	CB	LEU	A	128	L	-	HA	PRO	V	26
R	-	CB	LEU	A	128	L	-	HB2	PRO	V	26
R	-	CB	LEU	A	128	L	-	HB3	PRO	V	26
R	-	O	LEU	A	128	L	-	CB	PRO	V	26
R	-	O	LEU	A	128	L	-	HA	PRO	V	26
R	-	O	LEU	A	128	L	-	HB2	PRO	V	26
R	-	O	LEU	A	128	L	-	HB3	PRO	V	26
R	-	O	LEU	A	128	L	-	CG1	ILE	V	28
R	-	O	LEU	A	128	L	-	CD1	ILE	V	28
R	-	O	LEU	A	128	L	-	HG13	ILE	V	28
R	-	O	LEU	A	128	L	-	HD11	ILE	V	28
R	-	CG	LEU	A	128	L	-	HB3	PRO	V	26
R	-	CD1	LEU	A	128	L	-	C	CYS	V	23
R	-	CD1	LEU	A	128	L	-	O	CYS	V	23
R	-	CD1	LEU	A	128	L	-	CA	TRP	V	24
R	-	CD1	LEU	A	128	L	-	HA	TRP	V	24
R	-	CD1	LEU	A	128	L	-	HB3	PRO	V	26
R	-	CA	PRO	A	129	L	-	HD11	ILE	V	28
R	-	N	GLY	A	130	L	-	HD11	ILE	V	28
R	-	N	CYS	A	131	L	-	HD11	ILE	V	28
R	-	N	CYS	A	131	L	-	HD12	ILE	V	28
R	-	CA	CYS	A	131	L	-	HD12	ILE	V	28
R	-	C	CYS	A	131	L	-	HD12	ILE	V	28
R	-	CB	CYS	A	131	L	-	HB	ILE	V	28
R	-	CB	CYS	A	131	L	-	HD12	ILE	V	28
R	-	O	CYS	A	131	L	-	HD12	ILE	V	28

- 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