IID

Q96M93_Q96KX2.1 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	26	L	-	ILE	V	299
R	-	PRO	A	28	L	-	ILE	V	298
R	-	PRO	A	28	L	-	ILE	V	299
R	-	ALA	A	29	L	-	ILE	V	298
R	-	THR	A	30	L	H	LEU	V	256
R	-	THR	A	30	L	-	ARG	V	257
R	-	THR	A	30	L	-	ILE	V	298
R	-	LYS	A	31	L	H	LEU	V	256
R	-	LYS	A	31	L	-	ARG	V	257
R	-	THR	A	32	L	H	LEU	V	252
R	-	THR	A	32	L	H	LEU	V	256
R	-	THR	A	32	L	-	ARG	V	257
R	-	ILE	A	33	L	H	LEU	V	252
R	-	ILE	A	33	L	-	ARG	V	257
R	-	THR	A	34	L	S	LEU	V	201
R	-	THR	A	34	L	H	LEU	V	252
R	-	THR	A	35	L	S	LEU	V	201
R	-	THR	A	35	L	H	SER	V	248
R	-	THR	A	35	L	H	LEU	V	252
R	-	PRO	A	36	L	S	LEU	V	201
R	-	THR	A	37	L	S	ALA	V	193
R	-	THR	A	37	L	S	PHE	V	195
R	-	THR	A	37	L	S	LEU	V	201
R	-	THR	A	37	L	S	ILE	V	203
R	-	GLY	A	38	L	S	ALA	V	193
R	-	TRP	A	39	L	S	ASP	V	157
R	-	TRP	A	39	L	S	HIS	V	158
R	-	TRP	A	39	L	S	ASN	V	159
R	-	TRP	A	39	L	S	TRP	V	166
R	-	TRP	A	39	L	S	ASN	V	167
R	-	TRP	A	39	L	S	GLY	V	168
R	-	TRP	A	39	L	S	LEU	V	169
R	-	TRP	A	39	L	S	TRP	V	170
R	-	TRP	A	39	L	H	GLN	V	237
R	-	TRP	A	39	L	H	LEU	V	241
R	-	SER	A	40	L	H	GLN	V	237
R	-	SER	A	41	L	H	HIS	V	132
R	-	SER	A	41	L	-	PRO	V	134
R	-	SER	A	41	L	H	GLN	V	237
R	-	GLU	A	42	L	H	HIS	V	132
R	-	GLU	A	42	L	-	PRO	V	134
R	-	GLU	A	42	L	H	GLN	V	237
R	-	SER	A	43	L	H	ASP	V	131
R	-	SER	A	43	L	H	HIS	V	132
R	-	TYR	A	44	L	H	ASP	V	131
R	-	TYR	A	44	L	H	HIS	V	132
R	-	TYR	A	44	L	H	GLU	V	230
R	-	TYR	A	44	L	H	ASN	V	234
R	-	GLY	A	45	L	H	GLU	V	230

- 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

Q96M93_Q96KX2.1 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	-	CG1	VAL	A	26	L	-	HD11	ILE	V	299
R	-	CG1	VAL	A	26	L	-	HD13	ILE	V	299
R	-	CB	PRO	A	28	L	-	HG23	ILE	V	298
R	-	CB	PRO	A	28	L	-	HG12	ILE	V	299
R	-	N	ALA	A	29	L	-	HG23	ILE	V	298
R	-	CA	ALA	A	29	L	-	HG22	ILE	V	298
R	-	CA	ALA	A	29	L	-	HG23	ILE	V	298
R	-	CB	ALA	A	29	L	-	CG2	ILE	V	298
R	-	CB	ALA	A	29	L	-	HG21	ILE	V	298
R	-	CB	ALA	A	29	L	-	HG22	ILE	V	298
R	-	CB	ALA	A	29	L	-	HG23	ILE	V	298
R	-	N	THR	A	30	L	H	O	LEU	V	256
R	-	CA	THR	A	30	L	H	O	LEU	V	256
R	-	C	THR	A	30	L	H	C	LEU	V	256
R	-	C	THR	A	30	L	H	O	LEU	V	256
R	-	C	THR	A	30	L	H	HA	LEU	V	256
R	-	CB	THR	A	30	L	H	O	LEU	V	256
R	-	O	THR	A	30	L	H	O	LEU	V	256
R	-	CG2	THR	A	30	L	-	HA	ARG	V	257
R	-	CG2	THR	A	30	L	-	HG2	ARG	V	257
R	-	OG1	THR	A	30	L	-	HG22	ILE	V	298
R	-	N	LYS	A	31	L	H	CA	LEU	V	256
R	-	N	LYS	A	31	L	H	C	LEU	V	256
R	-	N	LYS	A	31	L	H	O	LEU	V	256
R	-	N	LYS	A	31	L	H	HA	LEU	V	256
R	-	N	LYS	A	31	L	H	HB3	LEU	V	256
R	-	N	LYS	A	31	L	-	N	ARG	V	257
R	-	N	LYS	A	31	L	-	HA	ARG	V	257
R	-	N	LYS	A	31	L	-	HB2	ARG	V	257
R	-	CA	LYS	A	31	L	H	C	LEU	V	256
R	-	CA	LYS	A	31	L	H	O	LEU	V	256
R	-	CA	LYS	A	31	L	H	HB3	LEU	V	256
R	-	CA	LYS	A	31	L	-	CB	ARG	V	257
R	-	CA	LYS	A	31	L	-	HB2	ARG	V	257
R	-	C	LYS	A	31	L	H	CA	LEU	V	256
R	-	C	LYS	A	31	L	H	C	LEU	V	256
R	-	C	LYS	A	31	L	H	CB	LEU	V	256
R	-	C	LYS	A	31	L	H	O	LEU	V	256
R	-	C	LYS	A	31	L	H	CD2	LEU	V	256
R	-	C	LYS	A	31	L	H	HA	LEU	V	256
R	-	C	LYS	A	31	L	H	HB2	LEU	V	256
R	-	C	LYS	A	31	L	H	HB3	LEU	V	256
R	-	C	LYS	A	31	L	H	HD12	LEU	V	256
R	-	C	LYS	A	31	L	H	HD23	LEU	V	256
R	-	C	LYS	A	31	L	-	HB2	ARG	V	257
R	-	O	LYS	A	31	L	H	CA	LEU	V	256
R	-	O	LYS	A	31	L	H	C	LEU	V	256
R	-	O	LYS	A	31	L	H	CB	LEU	V	256
R	-	O	LYS	A	31	L	H	O	LEU	V	256
R	-	O	LYS	A	31	L	H	CG	LEU	V	256
R	-	O	LYS	A	31	L	H	CD2	LEU	V	256
R	-	O	LYS	A	31	L	H	HA	LEU	V	256
R	-	O	LYS	A	31	L	H	HB3	LEU	V	256
R	-	O	LYS	A	31	L	H	HD12	LEU	V	256
R	-	O	LYS	A	31	L	H	HD21	LEU	V	256
R	-	O	LYS	A	31	L	H	HD22	LEU	V	256
R	-	O	LYS	A	31	L	H	HD23	LEU	V	256
R	-	CG	LYS	A	31	L	-	HD2	ARG	V	257
R	-	N	THR	A	32	L	H	C	LEU	V	256
R	-	N	THR	A	32	L	H	CB	LEU	V	256
R	-	N	THR	A	32	L	H	CG	LEU	V	256
R	-	N	THR	A	32	L	H	CD1	LEU	V	256
R	-	N	THR	A	32	L	H	HB2	LEU	V	256
R	-	N	THR	A	32	L	H	HB3	LEU	V	256
R	-	N	THR	A	32	L	H	HD12	LEU	V	256
R	-	N	THR	A	32	L	H	HD23	LEU	V	256
R	-	N	THR	A	32	L	-	HB2	ARG	V	257
R	-	CA	THR	A	32	L	H	HB3	LEU	V	256
R	-	CA	THR	A	32	L	H	HD12	LEU	V	256
R	-	CA	THR	A	32	L	-	CB	ARG	V	257
R	-	CA	THR	A	32	L	-	HB2	ARG	V	257
R	-	CA	THR	A	32	L	-	HB3	ARG	V	257
R	-	C	THR	A	32	L	H	HD23	LEU	V	252
R	-	C	THR	A	32	L	H	HB2	LEU	V	256
R	-	C	THR	A	32	L	H	HB3	LEU	V	256
R	-	C	THR	A	32	L	H	HD11	LEU	V	256
R	-	C	THR	A	32	L	H	HD12	LEU	V	256
R	-	C	THR	A	32	L	-	HB3	ARG	V	257
R	-	O	THR	A	32	L	H	CD2	LEU	V	252
R	-	O	THR	A	32	L	H	HA	LEU	V	252
R	-	O	THR	A	32	L	H	HD21	LEU	V	252
R	-	O	THR	A	32	L	H	HD23	LEU	V	252
R	-	O	THR	A	32	L	H	CB	LEU	V	256
R	-	O	THR	A	32	L	H	CD1	LEU	V	256
R	-	O	THR	A	32	L	H	HB2	LEU	V	256
R	-	O	THR	A	32	L	H	HB3	LEU	V	256
R	-	O	THR	A	32	L	H	HD11	LEU	V	256
R	-	O	THR	A	32	L	H	HD12	LEU	V	256
R	-	O	THR	A	32	L	H	HD13	LEU	V	256
R	-	CG2	THR	A	32	L	-	HH11	ARG	V	257
R	-	N	ILE	A	33	L	-	HB3	ARG	V	257
R	-	CA	ILE	A	33	L	H	HB3	LEU	V	252
R	-	CA	ILE	A	33	L	H	HD23	LEU	V	252
R	-	C	ILE	A	33	L	H	HD12	LEU	V	252
R	-	C	ILE	A	33	L	H	HD23	LEU	V	252
R	-	CG1	ILE	A	33	L	-	HB3	ARG	V	257
R	-	CG1	ILE	A	33	L	-	HD3	ARG	V	257
R	-	CD1	ILE	A	33	L	-	HB3	ARG	V	257
R	-	CD1	ILE	A	33	L	-	HD3	ARG	V	257
R	-	N	THR	A	34	L	H	CD1	LEU	V	252
R	-	N	THR	A	34	L	H	CD2	LEU	V	252
R	-	N	THR	A	34	L	H	HB3	LEU	V	252
R	-	N	THR	A	34	L	H	HD12	LEU	V	252
R	-	N	THR	A	34	L	H	HD13	LEU	V	252
R	-	N	THR	A	34	L	H	HD23	LEU	V	252
R	-	CA	THR	A	34	L	H	HD12	LEU	V	252
R	-	CA	THR	A	34	L	H	HD23	LEU	V	252
R	-	C	THR	A	34	L	H	CD1	LEU	V	252
R	-	C	THR	A	34	L	H	HD11	LEU	V	252
R	-	C	THR	A	34	L	H	HD12	LEU	V	252
R	-	C	THR	A	34	L	H	HD13	LEU	V	252
R	-	CB	THR	A	34	L	S	HD13	LEU	V	201
R	-	O	THR	A	34	L	H	CG	LEU	V	252
R	-	O	THR	A	34	L	H	CD1	LEU	V	252
R	-	O	THR	A	34	L	H	CD2	LEU	V	252
R	-	O	THR	A	34	L	H	HD11	LEU	V	252
R	-	O	THR	A	34	L	H	HD12	LEU	V	252
R	-	O	THR	A	34	L	H	HD13	LEU	V	252
R	-	O	THR	A	34	L	H	HD22	LEU	V	252
R	-	O	THR	A	34	L	H	HD23	LEU	V	252
R	-	N	THR	A	35	L	H	CD1	LEU	V	252
R	-	N	THR	A	35	L	H	HD11	LEU	V	252
R	-	N	THR	A	35	L	H	HD12	LEU	V	252
R	-	N	THR	A	35	L	H	HD13	LEU	V	252
R	-	CA	THR	A	35	L	H	HD12	LEU	V	252
R	-	C	THR	A	35	L	S	HD22	LEU	V	201
R	-	C	THR	A	35	L	S	HD23	LEU	V	201
R	-	CB	THR	A	35	L	H	HD11	LEU	V	252
R	-	O	THR	A	35	L	S	CD2	LEU	V	201
R	-	O	THR	A	35	L	S	HD23	LEU	V	201
R	-	CG2	THR	A	35	L	H	CA	SER	V	248
R	-	CG2	THR	A	35	L	H	CB	SER	V	248
R	-	CG2	THR	A	35	L	H	OG	SER	V	248
R	-	CG2	THR	A	35	L	H	HA	SER	V	248
R	-	CG2	THR	A	35	L	H	HB2	SER	V	248
R	-	CG2	THR	A	35	L	H	HG	SER	V	248
R	-	CG2	THR	A	35	L	H	CD1	LEU	V	252
R	-	CG2	THR	A	35	L	H	HD11	LEU	V	252
R	-	CG2	THR	A	35	L	H	HD12	LEU	V	252
R	-	N	PRO	A	36	L	S	HD22	LEU	V	201
R	-	N	PRO	A	36	L	S	HD23	LEU	V	201
R	-	CA	PRO	A	36	L	S	HD22	LEU	V	201
R	-	C	PRO	A	36	L	S	HD21	LEU	V	201
R	-	C	PRO	A	36	L	S	HD22	LEU	V	201
R	-	O	PRO	A	36	L	S	HD21	LEU	V	201
R	-	N	THR	A	37	L	S	HD21	LEU	V	201
R	-	N	THR	A	37	L	S	HD22	LEU	V	201
R	-	N	THR	A	37	L	S	CD1	ILE	V	203
R	-	N	THR	A	37	L	S	HD11	ILE	V	203
R	-	N	THR	A	37	L	S	HD13	ILE	V	203
R	-	CA	THR	A	37	L	S	HD13	ILE	V	203
R	-	C	THR	A	37	L	S	HD13	ILE	V	203
R	-	CB	THR	A	37	L	S	HB2	PHE	V	195
R	-	O	THR	A	37	L	S	CB	ALA	V	193
R	-	O	THR	A	37	L	S	HB1	ALA	V	193
R	-	O	THR	A	37	L	S	HB2	ALA	V	193
R	-	O	THR	A	37	L	S	HB3	ALA	V	193
R	-	O	THR	A	37	L	S	CD1	ILE	V	203
R	-	O	THR	A	37	L	S	HD11	ILE	V	203
R	-	O	THR	A	37	L	S	HD12	ILE	V	203
R	-	O	THR	A	37	L	S	HD13	ILE	V	203
R	-	CG2	THR	A	37	L	S	HD2	PHE	V	195
R	-	OG1	THR	A	37	L	S	CB	PHE	V	195
R	-	OG1	THR	A	37	L	S	CG	PHE	V	195
R	-	OG1	THR	A	37	L	S	CD2	PHE	V	195
R	-	OG1	THR	A	37	L	S	HB2	PHE	V	195
R	-	OG1	THR	A	37	L	S	HB3	PHE	V	195
R	-	OG1	THR	A	37	L	S	HD2	PHE	V	195
R	-	OG1	THR	A	37	L	S	HD21	LEU	V	201
R	-	O	GLY	A	38	L	S	HB2	ALA	V	193
R	-	O	TRP	A	39	L	H	HE21	GLN	V	237
R	-	O	TRP	A	39	L	H	HD23	LEU	V	241
R	-	CG	TRP	A	39	L	S	HZ3	TRP	V	166
R	-	CG	TRP	A	39	L	S	HA2	GLY	V	168
R	-	CD1	TRP	A	39	L	S	CH2	TRP	V	166
R	-	CD1	TRP	A	39	L	S	CZ3	TRP	V	166
R	-	CD1	TRP	A	39	L	S	HH2	TRP	V	166
R	-	CD1	TRP	A	39	L	S	HZ3	TRP	V	166
R	-	CD1	TRP	A	39	L	S	HA2	GLY	V	168
R	-	CD2	TRP	A	39	L	S	HZ3	TRP	V	166
R	-	CD2	TRP	A	39	L	S	CA	GLY	V	168
R	-	CD2	TRP	A	39	L	S	C	GLY	V	168
R	-	CD2	TRP	A	39	L	S	HA2	GLY	V	168
R	-	CD2	TRP	A	39	L	S	HA3	GLY	V	168
R	-	CD2	TRP	A	39	L	S	N	LEU	V	169
R	-	CD2	TRP	A	39	L	S	H	LEU	V	169
R	-	CE2	TRP	A	39	L	S	H	ASN	V	159
R	-	CE2	TRP	A	39	L	S	HB3	ASN	V	159
R	-	CE2	TRP	A	39	L	S	CZ3	TRP	V	166
R	-	CE2	TRP	A	39	L	S	HE3	TRP	V	166
R	-	CE2	TRP	A	39	L	S	HZ3	TRP	V	166
R	-	CE2	TRP	A	39	L	S	N	GLY	V	168
R	-	CE2	TRP	A	39	L	S	CA	GLY	V	168
R	-	CE2	TRP	A	39	L	S	C	GLY	V	168
R	-	CE2	TRP	A	39	L	S	O	GLY	V	168
R	-	CE2	TRP	A	39	L	S	H	GLY	V	168
R	-	CE2	TRP	A	39	L	S	HA2	GLY	V	168
R	-	CE2	TRP	A	39	L	S	HA3	GLY	V	168
R	-	CE2	TRP	A	39	L	S	N	LEU	V	169
R	-	CE2	TRP	A	39	L	S	H	LEU	V	169
R	-	CE3	TRP	A	39	L	S	CA	GLY	V	168
R	-	CE3	TRP	A	39	L	S	C	GLY	V	168
R	-	CE3	TRP	A	39	L	S	O	GLY	V	168
R	-	CE3	TRP	A	39	L	S	HA2	GLY	V	168
R	-	CE3	TRP	A	39	L	S	N	LEU	V	169
R	-	CE3	TRP	A	39	L	S	CA	LEU	V	169
R	-	CE3	TRP	A	39	L	S	C	LEU	V	169
R	-	CE3	TRP	A	39	L	S	H	LEU	V	169
R	-	CE3	TRP	A	39	L	S	HA	LEU	V	169
R	-	CE3	TRP	A	39	L	S	N	TRP	V	170
R	-	CE3	TRP	A	39	L	S	H	TRP	V	170
R	-	CE3	TRP	A	39	L	S	HB2	TRP	V	170
R	-	NE1	TRP	A	39	L	S	CE3	TRP	V	166
R	-	NE1	TRP	A	39	L	S	CH2	TRP	V	166
R	-	NE1	TRP	A	39	L	S	CZ3	TRP	V	166
R	-	NE1	TRP	A	39	L	S	HE3	TRP	V	166
R	-	NE1	TRP	A	39	L	S	HH2	TRP	V	166
R	-	NE1	TRP	A	39	L	S	HZ3	TRP	V	166
R	-	NE1	TRP	A	39	L	S	N	GLY	V	168
R	-	NE1	TRP	A	39	L	S	CA	GLY	V	168
R	-	NE1	TRP	A	39	L	S	HA2	GLY	V	168
R	-	NE1	TRP	A	39	L	S	HA3	GLY	V	168
R	-	CH2	TRP	A	39	L	S	CA	HIS	V	158
R	-	CH2	TRP	A	39	L	S	HA	HIS	V	158
R	-	CH2	TRP	A	39	L	S	HB2	HIS	V	158
R	-	CH2	TRP	A	39	L	S	N	ASN	V	159
R	-	CH2	TRP	A	39	L	S	H	ASN	V	159
R	-	CH2	TRP	A	39	L	S	HZ3	TRP	V	166
R	-	CH2	TRP	A	39	L	S	N	GLY	V	168
R	-	CH2	TRP	A	39	L	S	CA	GLY	V	168
R	-	CH2	TRP	A	39	L	S	C	GLY	V	168
R	-	CH2	TRP	A	39	L	S	O	GLY	V	168
R	-	CH2	TRP	A	39	L	S	H	GLY	V	168
R	-	CH2	TRP	A	39	L	S	HA2	GLY	V	168
R	-	CH2	TRP	A	39	L	S	HA3	GLY	V	168
R	-	CH2	TRP	A	39	L	S	N	LEU	V	169
R	-	CH2	TRP	A	39	L	S	CA	LEU	V	169
R	-	CH2	TRP	A	39	L	S	C	LEU	V	169
R	-	CH2	TRP	A	39	L	S	H	LEU	V	169
R	-	CH2	TRP	A	39	L	S	HA	LEU	V	169
R	-	CH2	TRP	A	39	L	S	H	TRP	V	170
R	-	CZ2	TRP	A	39	L	S	N	ASN	V	159
R	-	CZ2	TRP	A	39	L	S	O	ASN	V	159
R	-	CZ2	TRP	A	39	L	S	H	ASN	V	159
R	-	CZ2	TRP	A	39	L	S	HB3	ASN	V	159
R	-	CZ2	TRP	A	39	L	S	CZ3	TRP	V	166
R	-	CZ2	TRP	A	39	L	S	HE3	TRP	V	166
R	-	CZ2	TRP	A	39	L	S	HZ3	TRP	V	166
R	-	CZ2	TRP	A	39	L	S	C	ASN	V	167
R	-	CZ2	TRP	A	39	L	S	O	ASN	V	167
R	-	CZ2	TRP	A	39	L	S	N	GLY	V	168
R	-	CZ2	TRP	A	39	L	S	CA	GLY	V	168
R	-	CZ2	TRP	A	39	L	S	C	GLY	V	168
R	-	CZ2	TRP	A	39	L	S	O	GLY	V	168
R	-	CZ2	TRP	A	39	L	S	H	GLY	V	168
R	-	CZ2	TRP	A	39	L	S	HA2	GLY	V	168
R	-	CZ2	TRP	A	39	L	S	HA3	GLY	V	168
R	-	CZ2	TRP	A	39	L	S	N	LEU	V	169
R	-	CZ2	TRP	A	39	L	S	CA	LEU	V	169
R	-	CZ2	TRP	A	39	L	S	H	LEU	V	169
R	-	CZ2	TRP	A	39	L	S	HA	LEU	V	169
R	-	CZ3	TRP	A	39	L	S	O	ASP	V	157
R	-	CZ3	TRP	A	39	L	S	CA	HIS	V	158
R	-	CZ3	TRP	A	39	L	S	HA	HIS	V	158
R	-	CZ3	TRP	A	39	L	S	H	ASN	V	159
R	-	CZ3	TRP	A	39	L	S	CA	GLY	V	168
R	-	CZ3	TRP	A	39	L	S	C	GLY	V	168
R	-	CZ3	TRP	A	39	L	S	O	GLY	V	168
R	-	CZ3	TRP	A	39	L	S	HA2	GLY	V	168
R	-	CZ3	TRP	A	39	L	S	HA3	GLY	V	168
R	-	CZ3	TRP	A	39	L	S	N	LEU	V	169
R	-	CZ3	TRP	A	39	L	S	CA	LEU	V	169
R	-	CZ3	TRP	A	39	L	S	C	LEU	V	169
R	-	CZ3	TRP	A	39	L	S	O	LEU	V	169
R	-	CZ3	TRP	A	39	L	S	H	LEU	V	169
R	-	CZ3	TRP	A	39	L	S	HA	LEU	V	169
R	-	CZ3	TRP	A	39	L	S	N	TRP	V	170
R	-	CZ3	TRP	A	39	L	S	H	TRP	V	170
R	-	CZ3	TRP	A	39	L	S	HB2	TRP	V	170
R	-	C	SER	A	40	L	H	HE21	GLN	V	237
R	-	C	SER	A	40	L	H	HE22	GLN	V	237
R	-	N	SER	A	41	L	H	NE2	GLN	V	237
R	-	N	SER	A	41	L	H	HE21	GLN	V	237
R	-	N	SER	A	41	L	H	HE22	GLN	V	237
R	-	CA	SER	A	41	L	H	HE22	GLN	V	237
R	-	C	SER	A	41	L	H	NE2	GLN	V	237
R	-	C	SER	A	41	L	H	HE22	GLN	V	237
R	-	CB	SER	A	41	L	-	HG3	PRO	V	134
R	-	CB	SER	A	41	L	-	HD3	PRO	V	134
R	-	O	SER	A	41	L	H	O	HIS	V	132
R	-	O	SER	A	41	L	H	NE2	GLN	V	237
R	-	O	SER	A	41	L	H	OE1	GLN	V	237
R	-	O	SER	A	41	L	H	HE22	GLN	V	237
R	-	OG	SER	A	41	L	-	HG2	PRO	V	134
R	-	N	GLU	A	42	L	H	HE22	GLN	V	237
R	-	CA	GLU	A	42	L	H	HA	HIS	V	132
R	-	C	GLU	A	42	L	H	CD2	HIS	V	132
R	-	C	GLU	A	42	L	H	HA	HIS	V	132
R	-	C	GLU	A	42	L	H	HD2	HIS	V	132
R	-	CB	GLU	A	42	L	H	O	HIS	V	132
R	-	CB	GLU	A	42	L	H	HA	HIS	V	132
R	-	O	GLU	A	42	L	H	CA	HIS	V	132
R	-	O	GLU	A	42	L	H	CB	HIS	V	132
R	-	O	GLU	A	42	L	H	O	HIS	V	132
R	-	O	GLU	A	42	L	H	CG	HIS	V	132
R	-	O	GLU	A	42	L	H	CD2	HIS	V	132
R	-	O	GLU	A	42	L	H	HA	HIS	V	132
R	-	O	GLU	A	42	L	H	HB3	HIS	V	132
R	-	O	GLU	A	42	L	H	HD2	HIS	V	132
R	-	CD	GLU	A	42	L	-	HG2	PRO	V	134
R	-	CD	GLU	A	42	L	-	HD3	PRO	V	134
R	-	OE1	GLU	A	42	L	-	CG	PRO	V	134
R	-	OE1	GLU	A	42	L	-	HG2	PRO	V	134
R	-	OE1	GLU	A	42	L	-	HD3	PRO	V	134
R	-	OE2	GLU	A	42	L	-	HG2	PRO	V	134
R	-	OE2	GLU	A	42	L	-	HD3	PRO	V	134
R	-	N	SER	A	43	L	H	CD2	HIS	V	132
R	-	N	SER	A	43	L	H	HD2	HIS	V	132
R	-	C	SER	A	43	L	H	CD2	HIS	V	132
R	-	C	SER	A	43	L	H	NE2	HIS	V	132
R	-	C	SER	A	43	L	H	HD2	HIS	V	132
R	-	O	SER	A	43	L	H	O	ASP	V	131
R	-	O	SER	A	43	L	H	HB3	ASP	V	131
R	-	O	SER	A	43	L	H	CG	HIS	V	132
R	-	O	SER	A	43	L	H	CD2	HIS	V	132
R	-	O	SER	A	43	L	H	ND1	HIS	V	132
R	-	O	SER	A	43	L	H	CE1	HIS	V	132
R	-	O	SER	A	43	L	H	NE2	HIS	V	132
R	-	O	SER	A	43	L	H	HA	HIS	V	132
R	-	O	SER	A	43	L	H	HD2	HIS	V	132
R	-	O	SER	A	43	L	H	HE1	HIS	V	132
R	-	OG	SER	A	43	L	H	O	ASP	V	131
R	-	C	TYR	A	44	L	H	OE1	GLU	V	230
R	-	CB	TYR	A	44	L	H	HB3	ASP	V	131
R	-	CB	TYR	A	44	L	H	HE1	HIS	V	132
R	-	O	TYR	A	44	L	H	NE2	HIS	V	132
R	-	O	TYR	A	44	L	H	HE1	HIS	V	132
R	-	O	TYR	A	44	L	H	CD	GLU	V	230
R	-	O	TYR	A	44	L	H	OE1	GLU	V	230
R	-	O	TYR	A	44	L	H	HD22	ASN	V	234
R	-	CG	TYR	A	44	L	H	HB3	ASP	V	131
R	-	CD2	TYR	A	44	L	H	CA	ASP	V	131
R	-	CD2	TYR	A	44	L	H	C	ASP	V	131
R	-	CD2	TYR	A	44	L	H	CB	ASP	V	131
R	-	CD2	TYR	A	44	L	H	O	ASP	V	131
R	-	CD2	TYR	A	44	L	H	HA	ASP	V	131
R	-	CD2	TYR	A	44	L	H	HB3	ASP	V	131
R	-	CE2	TYR	A	44	L	H	C	ASP	V	131
R	-	CE2	TYR	A	44	L	H	CB	ASP	V	131
R	-	CE2	TYR	A	44	L	H	O	ASP	V	131
R	-	CE2	TYR	A	44	L	H	HA	ASP	V	131
R	-	CE2	TYR	A	44	L	H	HB3	ASP	V	131
R	-	N	GLY	A	45	L	H	OE1	GLU	V	230

- 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