A0A077YX35_TRITR Loading...

Gonadotropin releasing hormone receptor transmem brane receptor (Rhodopsin family)

AlphaFold DB , UniProt , Accession A0A077YX35, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 380 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.6	Very low	32.8	Very low	238 Å²	238	145.7 Å²	145.7	100%	1.172	79%	0.787	S	S	*	*				0	142.3	0	-81.2	169.3	174.5	0	0	106.5
2	D	34.6	Very low	32.7	Very low	153 Å²	153	146.3 Å²	146.3	82%	0.818	78%	0.781	S	S	*	*			trans	86.6	63.8	-173.4	-50.1	-20.8	0	0	0	115.6
3	I	35.6	Very low	32.5	Very low	139 Å²	139	147.5 Å²	147.5	71%	0.713	79%	0.786	S	S	*	*				25.5	104.5	121.4	-53.9	176.1	0	0	0	115	D5	I3-D5 HydrophobicContact CG2-CB 3.84Å; I3-D5 WeakPolarHBondContact CG2-OD2 3.26Å; I3-D5 PolarHBondContact O-N 3.01Å
4	A	31.9	Very low	32.6	Very low	100 Å²	100	148.9 Å²	148.9	83%	0.826	78%	0.783	S	S	*	*			trans	-69.5	110.8	148.6	0	0	0	0	0	108
5	D	32.1	Very low	32.3	Very low	138 Å²	138	142.5 Å²	142.5	74%	0.738	77%	0.766	S	S	*	*			trans	-142.2	143.2	161.5	-97.4	-38.2	0	0	0	111	I3	I3-D5 HydrophobicContact CG2-CB 3.84Å; I3-D5 WeakPolarHBondContact CG2-OD2 3.26Å; I3-D5 PolarHBondContact O-N 3.01Å
6	E	29.3	Very low	32.2	Very low	137 Å²	137	142.5 Å²	142.5	64%	0.64	77%	0.766	S	S	*	*			trans	70.9	79.5	170.1	-82	172.6	148.5	0	0	118.3	K9	E6-K9 VanDerWaalsContact OE1-CE 3.26Å; E6-K9 WeakPolarHBondContact OE1-CE 3.38Å; E6-K9 IonicContact OE1-NZ 2.73Å; E6-K9 PolarHBondContact OE1-NZ 2.73Å
7	A	35.5	Very low	32.7	Very low	91 Å²	91	141.5 Å²	141.5	75%	0.752	77%	0.773	S	S	*	*			trans	-55.7	137.2	136.8	0	0	0	0	0	109.2	K9	A7-K9 PolarHBondContact O-N 3.36Å
8	P	34	Very low	33.3	Very low	115 Å²	115	138.1 Å²	138.1	75%	0.747	76%	0.761	S	S	*	*			trans	-63	132.6	-169.1	20.4	-29.1	0	0	0	112.3	E10	P8-E10 VanDerWaalsContact C-N 3.28Å; P8-E10 PolarHBondContact O-N 3.21Å
9	K	28.8	Very low	34.1	Very low	137 Å²	137	136.1 Å²	136.1	60%	0.596	76%	0.758	S	S	*	*			trans	-60	82.5	167.3	-69.9	170.8	175.5	146	0	110.4	E6 A7 Q11	E6-K9 VanDerWaalsContact OE1-CE 3.26Å; E6-K9 WeakPolarHBondContact OE1-CE 3.38Å; E6-K9 IonicContact OE1-NZ 2.73Å; E6-K9 PolarHBondContact OE1-NZ 2.73Å; A7-K9 PolarHBondContact O-N 3.36Å; K9-Q11 PolarHBondContact O-N 3.28Å
10	E	34.6	Very low	35.2	Very low	173 Å²	173	137.9 Å²	137.9	81%	0.808	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	1	164.8	-82.1	-170.5	152	0	0	113	P8	P8-E10 VanDerWaalsContact C-N 3.28Å; P8-E10 PolarHBondContact O-N 3.21Å
11	Q	31.7	Very low	36.2	Very low	182 Å²	182	137 Å²	137	85%	0.85	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-7.9	177.9	-79.6	-177.6	-26.2	0	0	115.1	K9	K9-Q11 PolarHBondContact O-N 3.28Å
12	E	31.6	Very low	38.1	Very low	153 Å²	153	130.2 Å²	130.2	72%	0.715	72%	0.716	S	S	*	*	S	Bend	trans	-98.1	-2.5	-179.7	-75	-172.2	162.5	0	0	115.3	F14	E12-F14 VanDerWaalsContact C-N 3.33Å
13	L	30.3	Very low	40.3	Very low	162 Å²	162	124 Å²	124	85%	0.848	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-1.1	168.6	-153.5	72.5	0	0	0	113.6
14	F	33.6	Very low	42.5	Very low	167 Å²	167	119.3 Å²	119.3	73%	0.732	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.5	30.2	169	-72.9	-80.2	0	0	0	112.1	E12 N16	E12-F14 VanDerWaalsContact C-N 3.33Å; F14-N16 PolarHBondContact O-N 2.86Å
15	G	27.9	Very low	45	Very low	52 Å²	52	117.4 Å²	117.4	54%	0.536	65%	0.646	S	S	.	*			trans	-84.8	87.2	161.4	0	0	0	0	0	110.2
16	N	31.9	Very low	47.5	Very low	143 Å²	143	117.9 Å²	117.9	77%	0.765	64%	0.643	S	S	*	*	S	Bend	trans	156.1	102.8	144.5	-80.3	-23.9	0	0	0	111	F14 S18	F14-N16 PolarHBondContact O-N 2.86Å; N16-S18 VanDerWaalsContact C-N 3.34Å; N16-S18 PolarHBondContact O-N 3.39Å
17	S	40.7	Very low	50.2	Low	126 Å²	126	116.3 Å²	116.3	88%	0.881	63%	0.631	S	S	*	*			trans	55.2	31.7	148.5	48.7	0	0	0	0	118.4	S19	S17-S19 PolarHBondContact O-N 3.46Å
18	S	43.6	Very low	52.6	Low	79 Å²	79	115.2 Å²	115.2	55%	0.552	61%	0.612	S	S	*	*			trans	-78.4	100	161.4	48.7	0	0	0	0	108.4	N16 H20	N16-S18 VanDerWaalsContact C-N 3.34Å; N16-S18 PolarHBondContact O-N 3.39Å; S18-H20 PolarHBondContact O-N 2.79Å
19	S	47.8	Very low	55.2	Low	101 Å²	101	114.3 Å²	114.3	71%	0.706	61%	0.605	S	S	*	*			trans	-35.8	115.5	161.4	52.2	0	0	0	0	108.9	S17 F21	S17-S19 PolarHBondContact O-N 3.46Å; S19-F21 VanDerWaalsContact C-N 3.34Å; S19-F21 PolarHBondContact O-N 3Å
20	H	55.5	Low	57.9	Low	172 Å²	172	110.5 Å²	110.5	80%	0.796	59%	0.589	S	S	*	*			trans	-54.8	104.2	175.5	-133.5	-69.9	0	0	0	106	S18 I22	S18-H20 PolarHBondContact O-N 2.79Å; H20-I22 WeakPolarHBondContact O-CG1 3.47Å; H20-I22 PolarHBondContact O-N 2.97Å
21	F	57.3	Low	60.5	Low	119 Å²	119	103.6 Å²	103.6	52%	0.522	56%	0.558	S	S	.	*			trans	-72.5	102.9	-176.8	-174.1	-90.9	0	0	0	106.8	S19 G23 P24 Q26	S19-F21 VanDerWaalsContact C-N 3.34Å; S19-F21 PolarHBondContact O-N 3Å; F21-G23 VanDerWaalsContact CE1-CA 3.49Å; F21-G23 PolarHBondContact O-N 3.38Å; F21-P24 VanDerWaalsContact CE1-O 3.31Å; F21-P24 WeakPolarHBondContact CE1-O 3.31Å; F21-Q26 HydrophobicContact CZ-CG 4.42Å
22	I	71.5	Confident	63.3	Low	96 Å²	96	98.7 Å²	98.7	49%	0.492	54%	0.538	S	S	.	.			trans	-77.3	-7.1	-176.8	-61.8	168.6	0	0	0	111.3	H20 Y171 T175 W176	H20-I22 WeakPolarHBondContact O-CG1 3.47Å; H20-I22 PolarHBondContact O-N 2.97Å; I22-Y171 WeakPolarHBondContact CA-OH 3.38Å; I22-Y171 PolarHBondContact O-OH 2.97Å; I22-T175 HydrophobicContact CG2-CG2 4.39Å; I22-W176 VanDerWaalsContact O-CD1 3.29Å
23	G	80.2	Confident	66.1	Low	21 Å²	21	95 Å²	95	22%	0.216	52%	0.522	C	S	.	.	S	Bend	trans	-79.8	171	-177.7	0	0	0	0	0	115.3	F21 W176	F21-G23 VanDerWaalsContact CE1-CA 3.49Å; F21-G23 PolarHBondContact O-N 3.38Å; G23-W176 PolarHBondContact O-NE1 3.2Å
24	P	82.3	Confident	68.9	Low	41 Å²	41	87.9 Å²	87.9	27%	0.266	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-61.4	155.7	172.9	28	-35	0	0	0	111.5	F21 D97 W176	F21-P24 VanDerWaalsContact CE1-O 3.31Å; F21-P24 WeakPolarHBondContact CE1-O 3.31Å; P24-D97 HydrophobicContact CB-CB 4.16Å; P24-W176 HydrophobicContact CB-CB 3.94Å; P24-W176 HydrophobicContact CB-CD2 4.28Å; P24-W176 HydrophobicContact CB-CG 4.01Å
25	P	83.9	Confident	71.8	Confident	61 Å²	61	81 Å²	81	40%	0.396	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-54.9	144.5	-179.8	20.5	-29.6	0	0	0	111.7	V96 W176	P25-V96 HydrophobicContact CG-CG1 3.96Å; P25-V96 VanDerWaalsContact O-CG1 3.26Å; P25-V96 WeakPolarHBondContact O-CG1 3.32Å; P25-W176 HydrophobicContact CG-CH2 4.44Å; P25-W176 HydrophobicContact CG-CZ3 4.43Å
26	Q	86.2	Confident	74.9	Confident	148 Å²	148	80.2 Å²	80.2	69%	0.692	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-77.2	146.4	175.7	-62.9	-172.7	-0.4	0	0	110	F21 I28	F21-Q26 HydrophobicContact CZ-CG 4.42Å; Q26-I28 PolarHBondContact O-N 3.02Å
27	R	86.1	Confident	77.8	Confident	103 Å²	103	75.8 Å²	75.8	39%	0.389	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-64.4	132.5	174.3	-76.4	-170	-75.9	-81.7	-5.6	110.5	D31 N32 L93 I94 V96	R27-D31 HydrophobicContact CB-CB 4.15Å; R27-D31 HydrophobicContact CG-CB 4.17Å; R27-N32 WeakPolarHBondContact CD-OD1 3.36Å; R27-N32 PolarHBondContact NE-OD1 3.43Å; R27-L93 VanDerWaalsContact CD-O 3.31Å; R27-L93 WeakPolarHBondContact CD-O 3.31Å; R27-L93 PolarHBondContact NH1-O 2.99Å; R27-I94 PolarHBondContact NH1-O 3.45Å; R27-V96 HydrophobicContact CG-CG2 3.5Å
28	I	86.3	Confident	80.4	Confident	68 Å²	68	69.8 Å²	69.8	35%	0.349	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-81.3	165.7	166.2	59.5	177.5	0	0	0	110.6	Q26 E30 D31 N32 N342	Q26-I28 PolarHBondContact O-N 3.02Å; I28-E30 WeakPolarHBondContact CB-OE2 3.2Å; I28-E30 HydrophobicContact CD1-CB 4.14Å; I28-E30 WeakPolarHBondContact CD1-OE2 3.48Å; I28-E30 HydrophobicContact CG1-CB 4.21Å; I28-E30 WeakPolarHBondContact CG1-OE2 3.49Å; I28-E30 PolarHBondContact O-N 3.04Å; I28-D31 HydrophobicContact CG1-CB 4.28Å; I28-D31 WeakPolarHBondContact CG1-OD2 3.47Å; I28-D31 WeakPolarHBondContact O-CB 3.26Å; I28-D31 PolarHBondContact O-N 3.41Å; I28-D31 VanDerWaalsContact O-N 3.07Å; I28-N32 PolarHBondContact O-N 3.26Å; I28-N342 HydrophobicContact CD1-CB 4.12Å
29	T	87.3	Confident	82.9	Confident	97 Å²	97	68.9 Å²	68.9	60%	0.595	37%	0.368	S	S	*	.	H	α-helix	trans	-57.4	-37.8	-179.1	-59.7	0	0	0	0	111.8	D31 N32 I33	T29-D31 VanDerWaalsContact C-N 3.3Å; T29-D31 PolarHBondContact O-N 3.04Å; T29-N32 WeakPolarHBondContact O-CB 3.43Å; T29-N32 PolarHBondContact O-N 3.1Å; T29-I33 HydrophobicContact CG2-CD1 4.28Å; T29-I33 WeakPolarHBondContact O-CG1 3.18Å; T29-I33 PolarHBondContact O-N 3.18Å; T29-I33 VanDerWaalsContact O-N 3.1Å
30	E	86.5	Confident	85.2	Confident	56 Å²	56	68.3 Å²	68.3	26%	0.262	36%	0.361	S	S	.	.	H	α-helix	trans	-62.1	-36.1	178	-61.7	74.5	-165.3	0	0	112	I28 I33 R34 A346	I28-E30 WeakPolarHBondContact CB-OE2 3.2Å; I28-E30 HydrophobicContact CD1-CB 4.14Å; I28-E30 WeakPolarHBondContact CD1-OE2 3.48Å; I28-E30 HydrophobicContact CG1-CB 4.21Å; I28-E30 WeakPolarHBondContact CG1-OE2 3.49Å; I28-E30 PolarHBondContact O-N 3.04Å; E30-I33 PolarHBondContact O-N 3.35Å; E30-R34 VanDerWaalsContact O-CB 3.3Å; E30-R34 WeakPolarHBondContact O-CB 3.38Å; E30-R34 PolarHBondContact O-N 3.46Å; E30-A346 HydrophobicContact CB-CB 4.35Å
31	D	87.9	Confident	87.1	Confident	29 Å²	29	60.8 Å²	60.8	16%	0.155	33%	0.326	C	S	.	.	H	α-helix	trans	-67.8	-38.1	176.2	-72.9	-30.1	0	0	0	111.6	R27 I28 T29 R34 L35 L93	R27-D31 HydrophobicContact CB-CB 4.15Å; R27-D31 HydrophobicContact CG-CB 4.17Å; I28-D31 HydrophobicContact CG1-CB 4.28Å; I28-D31 WeakPolarHBondContact CG1-OD2 3.47Å; I28-D31 WeakPolarHBondContact O-CB 3.26Å; I28-D31 PolarHBondContact O-N 3.41Å; I28-D31 VanDerWaalsContact O-N 3.07Å; T29-D31 VanDerWaalsContact C-N 3.3Å; T29-D31 PolarHBondContact O-N 3.04Å; D31-R34 PolarHBondContact O-N 3.35Å; D31-L35 WeakPolarHBondContact O-CB 3.39Å; D31-L35 PolarHBondContact O-N 2.84Å; D31-L93 HydrophobicContact CB-CD2 4.1Å
32	N	90.8	Very high	89	Confident	79 Å²	79	57.7 Å²	57.7	42%	0.422	31%	0.313	S	S	.	.	H	α-helix	trans	-66	-41.6	176.5	-67.3	-37.5	0	0	0	111.3	R27 I28 T29 L35 G36	R27-N32 WeakPolarHBondContact CD-OD1 3.36Å; R27-N32 PolarHBondContact NE-OD1 3.43Å; I28-N32 PolarHBondContact O-N 3.26Å; T29-N32 WeakPolarHBondContact O-CB 3.43Å; T29-N32 PolarHBondContact O-N 3.1Å; N32-L35 PolarHBondContact O-N 3.17Å; N32-G36 PolarHBondContact O-N 3.45Å
33	I	89.9	Confident	90.3	Very high	74 Å²	74	58.6 Å²	58.6	38%	0.379	32%	0.318	S	S	.	.	H	α-helix	trans	-62.8	-49.8	174.7	-64.6	169.3	0	0	0	109.9	T29 E30 L35 G36 L37 F347	T29-I33 HydrophobicContact CG2-CD1 4.28Å; T29-I33 WeakPolarHBondContact O-CG1 3.18Å; T29-I33 PolarHBondContact O-N 3.18Å; T29-I33 VanDerWaalsContact O-N 3.1Å; E30-I33 PolarHBondContact O-N 3.35Å; I33-L35 VanDerWaalsContact C-N 3.31Å; I33-L35 PolarHBondContact O-N 3.4Å; I33-G36 PolarHBondContact O-N 3.07Å; I33-L37 HydrophobicContact CG2-CD1 3.97Å; I33-L37 HydrophobicContact CG2-CG 4.38Å; I33-L37 WeakPolarHBondContact O-CB 3.35Å; I33-L37 WeakPolarHBondContact O-CG 3.48Å; I33-L37 PolarHBondContact O-N 3.25Å; I33-F347 HydrophobicContact CG2-CE1 3.78Å; I33-F347 HydrophobicContact CG2-CZ 4.13Å
34	R	90.1	Very high	91	Very high	14 Å²	14	60.3 Å²	60.3	5%	0.053	33%	0.33	C	S	.	.	H	α-helix	trans	-57.7	-43.8	177.9	-176.3	-176.7	174.9	-166.8	-11.4	111.9	E30 D31 L37 M38 L93 A346	E30-R34 VanDerWaalsContact O-CB 3.3Å; E30-R34 WeakPolarHBondContact O-CB 3.38Å; E30-R34 PolarHBondContact O-N 3.46Å; D31-R34 PolarHBondContact O-N 3.35Å; R34-L37 PolarHBondContact O-N 3.29Å; R34-M38 HydrophobicContact CG-CE 4.39Å; R34-M38 HydrophobicContact CG-SD 4.31Å; R34-M38 WeakPolarHBondContact O-CB 3.47Å; R34-M38 WeakPolarHBondContact O-CG 3.27Å; R34-M38 PolarHBondContact O-N 3.08Å; R34-L93 HydrophobicContact CB-CD1 4.49Å; R34-L93 HydrophobicContact CG-CD1 4.01Å; R34-A346 HydrophobicContact CB-CB 4.25Å
35	L	93.5	Very high	91.7	Very high	22 Å²	22	58.4 Å²	58.4	12%	0.115	32%	0.318	C	S	.	.	H	α-helix	trans	-60.8	-51	177.5	174.7	59	0	0	0	111.2	D31 N32 I33 L37 M38 I39 I90 L93 I94	D31-L35 WeakPolarHBondContact O-CB 3.39Å; D31-L35 PolarHBondContact O-N 2.84Å; N32-L35 PolarHBondContact O-N 3.17Å; I33-L35 VanDerWaalsContact C-N 3.31Å; I33-L35 PolarHBondContact O-N 3.4Å; L35-L37 VanDerWaalsContact C-N 3.35Å; L35-L37 PolarHBondContact O-N 3Å; L35-M38 PolarHBondContact O-N 3.5Å; L35-I39 HydrophobicContact CD1-CD1 3.77Å; L35-I39 HydrophobicContact CD1-CG1 4.14Å; L35-I39 HydrophobicContact CG-CD1 3.92Å; L35-I39 VanDerWaalsContact O-CG1 3.31Å; L35-I39 WeakPolarHBondContact O-CG1 3.4Å; L35-I39 PolarHBondContact O-N 3.4Å; L35-I90 HydrophobicContact CD1-CB 4.35Å; L35-I90 HydrophobicContact CD1-CG1 4.44Å; L35-I90 HydrophobicContact CD1-CG2 3.9Å; L35-L93 HydrophobicContact CB-CB 4.3Å; L35-L93 HydrophobicContact CB-CD1 4.18Å; L35-L93 HydrophobicContact CD1-CB 4.02Å; L35-I94 HydrophobicContact CD1-CD1 4.42Å; L35-I94 HydrophobicContact CD1-CG1 3.96Å; L35-I94 HydrophobicContact CD2-CG1 4Å
36	G	93.8	Very high	92.4	Very high	35 Å²	35	56.4 Å²	56.4	36%	0.361	30%	0.304	S	S	.	.	H	α-helix	trans	-57.8	-46.5	178.1	0	0	0	0	0	112.3	N32 I33 M38 I39 V40	N32-G36 PolarHBondContact O-N 3.45Å; I33-G36 PolarHBondContact O-N 3.07Å; G36-M38 PolarHBondContact O-N 3.16Å; G36-I39 PolarHBondContact O-N 3.05Å; G36-V40 WeakPolarHBondContact O-CG2 3.4Å; G36-V40 PolarHBondContact O-N 2.95Å
37	L	93.2	Very high	92.9	Very high	50 Å²	50	53.1 Å²	53.1	26%	0.262	30%	0.296	S	S	.	.	H	α-helix	trans	-61.6	-43.1	177.1	-74.2	179.4	0	0	0	112.9	I33 R34 L35 V40 L41 F347 Y350	I33-L37 HydrophobicContact CG2-CD1 3.97Å; I33-L37 HydrophobicContact CG2-CG 4.38Å; I33-L37 WeakPolarHBondContact O-CB 3.35Å; I33-L37 WeakPolarHBondContact O-CG 3.48Å; I33-L37 PolarHBondContact O-N 3.25Å; R34-L37 PolarHBondContact O-N 3.29Å; L35-L37 VanDerWaalsContact C-N 3.35Å; L35-L37 PolarHBondContact O-N 3Å; L37-V40 PolarHBondContact O-N 3.42Å; L37-L41 PolarHBondContact O-N 3.3Å; L37-L41 VanDerWaalsContact O-N 3.09Å; L37-F347 HydrophobicContact CD1-CD1 4.43Å; L37-Y350 HydrophobicContact CB-CD2 3.52Å; L37-Y350 HydrophobicContact CB-CE2 3.63Å; L37-Y350 HydrophobicContact CB-CG 4.35Å; L37-Y350 HydrophobicContact CD1-CD2 4.12Å; L37-Y350 HydrophobicContact CD1-CE2 4.34Å; L37-Y350 HydrophobicContact CD1-CG 4.18Å; L37-Y350 HydrophobicContact CD2-CD2 4.49Å; L37-Y350 HydrophobicContact CD2-CE2 3.94Å; L37-Y350 HydrophobicContact CG-CD2 4.26Å; L37-Y350 HydrophobicContact CG-CE2 4.18Å
38	M	94.7	Very high	93.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.6	-39.3	176.3	-76.4	-173.6	163.7	0	0	112.3	R34 L35 G36 L41 F42 Y85 T86 Q89 I90 L93	R34-M38 HydrophobicContact CG-CE 4.39Å; R34-M38 HydrophobicContact CG-SD 4.31Å; R34-M38 WeakPolarHBondContact O-CB 3.47Å; R34-M38 WeakPolarHBondContact O-CG 3.27Å; R34-M38 PolarHBondContact O-N 3.08Å; L35-M38 PolarHBondContact O-N 3.5Å; G36-M38 PolarHBondContact O-N 3.16Å; M38-L41 PolarHBondContact O-N 3.38Å; M38-F42 WeakPolarHBondContact O-CB 3.47Å; M38-F42 PolarHBondContact O-N 2.94Å; M38-Y85 HydrophobicContact CE-CE1 4.42Å; M38-T86 HydrophobicContact CB-CG2 4.24Å; M38-Q89 HydrophobicContact CE-CB 4.07Å; M38-Q89 HydrophobicContact CE-CG 4.29Å; M38-Q89 HydrophobicContact SD-CB 3.6Å; M38-Q89 HydrophobicContact SD-CG 4.45Å; M38-I90 HydrophobicContact CB-CD1 4.23Å; M38-I90 HydrophobicContact CB-CG1 3.8Å; M38-L93 HydrophobicContact SD-CD1 3.98Å
39	I	96.8	Very high	93.8	Very high	60 Å²	60	46.2 Å²	46.2	31%	0.308	27%	0.267	S	S	.	.	H	α-helix	trans	-61.2	-46.1	175.4	-71.4	168.1	0	0	0	110.4	L35 G36 L41 F42 L43 I90	L35-I39 HydrophobicContact CD1-CD1 3.77Å; L35-I39 HydrophobicContact CD1-CG1 4.14Å; L35-I39 HydrophobicContact CG-CD1 3.92Å; L35-I39 VanDerWaalsContact O-CG1 3.31Å; L35-I39 WeakPolarHBondContact O-CG1 3.4Å; L35-I39 PolarHBondContact O-N 3.4Å; G36-I39 PolarHBondContact O-N 3.05Å; I39-L41 PolarHBondContact O-N 3.31Å; I39-F42 PolarHBondContact O-N 3.39Å; I39-L43 HydrophobicContact CG2-CD1 3.72Å; I39-L43 HydrophobicContact CG2-CG 4.21Å; I39-L43 WeakPolarHBondContact O-CB 3.18Å; I39-L43 WeakPolarHBondContact O-CG 3.34Å; I39-L43 PolarHBondContact O-N 3.27Å; I39-I90 HydrophobicContact CG1-CD1 4.11Å; I39-I90 HydrophobicContact CG1-CG1 4.24Å; I39-I90 HydrophobicContact CG1-CG2 4.12Å
40	V	96	Very high	94.3	Very high	90 Å²	90	44.3 Å²	44.3	55%	0.545	26%	0.255	S	S	.	.	H	α-helix	trans	-59.5	-47.4	177.9	171.4	0	0	0	0	111.1	G36 L37 F42 L43 A44	G36-V40 WeakPolarHBondContact O-CG2 3.4Å; G36-V40 PolarHBondContact O-N 2.95Å; L37-V40 PolarHBondContact O-N 3.42Å; V40-F42 VanDerWaalsContact C-N 3.33Å; V40-F42 PolarHBondContact O-N 2.59Å; V40-L43 PolarHBondContact O-N 3.36Å; V40-A44 VanDerWaalsContact O-CB 3.28Å; V40-A44 WeakPolarHBondContact O-CB 3.33Å; V40-A44 PolarHBondContact O-N 3.07Å
41	L	95.4	Very high	94.7	Very high	13 Å²	13	43.2 Å²	43.2	7%	0.068	25%	0.254	C	S	.	.	H	α-helix	trans	-64.7	-37.1	177.4	-71	-179.6	0	0	0	112.8	L37 M38 I39 G45 Y350 V353 V354 V357	L37-L41 PolarHBondContact O-N 3.3Å; L37-L41 VanDerWaalsContact O-N 3.09Å; M38-L41 PolarHBondContact O-N 3.38Å; I39-L41 PolarHBondContact O-N 3.31Å; L41-G45 WeakPolarHBondContact O-CA 3.1Å; L41-G45 PolarHBondContact O-N 2.78Å; L41-Y350 HydrophobicContact CD1-CD2 3.41Å; L41-Y350 VanDerWaalsContact CD1-CD2 3.41Å; L41-Y350 HydrophobicContact CD1-CE2 3.25Å; L41-Y350 HydrophobicContact CD1-CG 4.36Å; L41-Y350 HydrophobicContact CD2-CE2 4.13Å; L41-Y350 HydrophobicContact CG-CD2 4.16Å; L41-Y350 HydrophobicContact CG-CE2 3.55Å; L41-V353 HydrophobicContact CB-CG1 4.1Å; L41-V353 HydrophobicContact CD1-CB 3.69Å; L41-V353 HydrophobicContact CD1-CG1 3.68Å; L41-V354 HydrophobicContact CD1-CG2 3.82Å; L41-V354 HydrophobicContact CD2-CG2 4.02Å; L41-V357 HydrophobicContact CB-CG2 4.44Å; L41-V357 HydrophobicContact CD2-CB 4.5Å; L41-V357 HydrophobicContact CD2-CG2 4Å
42	F	97.5	Very high	95	Very high	55 Å²	55	41.9 Å²	41.9	24%	0.241	25%	0.247	C	C	.	.	H	α-helix	trans	-65.1	-49.5	177.2	-178.6	-98.7	0	0	0	111.2	M38 I39 V40 T46 L82 L83 T86 I90	M38-F42 WeakPolarHBondContact O-CB 3.47Å; M38-F42 PolarHBondContact O-N 2.94Å; I39-F42 PolarHBondContact O-N 3.39Å; V40-F42 VanDerWaalsContact C-N 3.33Å; V40-F42 PolarHBondContact O-N 2.59Å; F42-T46 WeakPolarHBondContact O-CB 3.3Å; F42-T46 PolarHBondContact O-N 3.2Å; F42-T46 VanDerWaalsContact O-N 3.08Å; F42-T46 PolarHBondContact O-OG1 2.79Å; F42-L82 VanDerWaalsContact CD2-O 3.3Å; F42-L82 WeakPolarHBondContact CD2-O 3.3Å; F42-L82 WeakPolarHBondContact CE2-O 3.36Å; F42-L83 HydrophobicContact CE2-CD2 4.15Å; F42-L83 HydrophobicContact CZ-CD2 4.37Å; F42-T86 HydrophobicContact CB-CG2 4.17Å; F42-I90 HydrophobicContact CB-CD1 3.85Å; F42-I90 HydrophobicContact CG-CD1 4.19Å
43	L	97.5	Very high	95.3	Very high	114 Å²	114	38.5 Å²	38.5	60%	0.597	23%	0.229	S	C	*	.	H	α-helix	trans	-70	-34.9	-177.7	-67.4	179.3	0	0	0	113.1	I39 V40 P47	I39-L43 HydrophobicContact CG2-CD1 3.72Å; I39-L43 HydrophobicContact CG2-CG 4.21Å; I39-L43 WeakPolarHBondContact O-CB 3.18Å; I39-L43 WeakPolarHBondContact O-CG 3.34Å; I39-L43 PolarHBondContact O-N 3.27Å; V40-L43 PolarHBondContact O-N 3.36Å; L43-P47 WeakPolarHBondContact O-CD 3.25Å; L43-P47 WeakPolarHBondContact O-CG 3.4Å
44	A	95.9	Very high	95.5	Very high	58 Å²	58	39.6 Å²	39.6	48%	0.479	23%	0.233	S	C	.	.	H	α-helix	trans	-84.6	-44.4	176.5	0	0	0	0	0	112.3	V40 L48	V40-A44 VanDerWaalsContact O-CB 3.28Å; V40-A44 WeakPolarHBondContact O-CB 3.33Å; V40-A44 PolarHBondContact O-N 3.07Å; A44-L48 WeakPolarHBondContact O-CB 3.3Å; A44-L48 PolarHBondContact O-N 2.97Å
45	G	96.4	Very high	95.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-72.7	-36.3	-172.7	0	0	0	0	0	114	L41 N49 L82	L41-G45 WeakPolarHBondContact O-CA 3.1Å; L41-G45 PolarHBondContact O-N 2.78Å; G45-N49 WeakPolarHBondContact O-CB 3.43Å; G45-N49 PolarHBondContact O-N 2.95Å; G45-N49 PolarHBondContact O-ND2 3.48Å; G45-N49 VanDerWaalsContact O-ND2 3.09Å; G45-L82 WeakPolarHBondContact O-CD1 3.22Å
46	T	98	Very high	95.6	Very high	19 Å²	19	43 Å²	43	12%	0.117	25%	0.245	C	C	.	.	H	α-helix	trans	-67.6	-53.2	-178.4	-54.2	0	0	0	0	111.5	F42 L48 N49 V50 L83	F42-T46 WeakPolarHBondContact O-CB 3.3Å; F42-T46 PolarHBondContact O-N 3.2Å; F42-T46 VanDerWaalsContact O-N 3.08Å; F42-T46 PolarHBondContact O-OG1 2.79Å; T46-L48 VanDerWaalsContact C-N 3.28Å; T46-L48 PolarHBondContact O-N 3.39Å; T46-N49 PolarHBondContact O-N 3.44Å; T46-V50 HydrophobicContact CG2-CG2 4.29Å; T46-V50 WeakPolarHBondContact O-CB 3.23Å; T46-V50 VanDerWaalsContact O-CG2 3.27Å; T46-V50 WeakPolarHBondContact O-CG2 3.22Å; T46-V50 PolarHBondContact O-N 2.82Å; T46-L83 HydrophobicContact CG2-CD2 3.76Å
47	P	96.7	Very high	95.7	Very high	79 Å²	79	49 Å²	49	51%	0.513	26%	0.257	S	S	.	.	H	α-helix	trans	-60.5	-37	176.4	-24	36.4	0	0	0	112.8	L43 S51	L43-P47 WeakPolarHBondContact O-CD 3.25Å; L43-P47 WeakPolarHBondContact O-CG 3.4Å; P47-S51 WeakPolarHBondContact O-CB 3.17Å; P47-S51 PolarHBondContact O-N 2.6Å
48	L	95.7	Very high	95.7	Very high	26 Å²	26	54.3 Å²	54.3	14%	0.136	27%	0.274	C	S	.	.	H	α-helix	trans	-60.6	-51.1	175.7	176.6	67.4	0	0	0	111.6	A44 T46 S51 A52 V357 P360 F361 F367	A44-L48 WeakPolarHBondContact O-CB 3.3Å; A44-L48 PolarHBondContact O-N 2.97Å; T46-L48 VanDerWaalsContact C-N 3.28Å; T46-L48 PolarHBondContact O-N 3.39Å; L48-S51 PolarHBondContact O-N 3.39Å; L48-A52 WeakPolarHBondContact O-CB 3.12Å; L48-A52 PolarHBondContact O-N 2.9Å; L48-V357 HydrophobicContact CD2-CG1 4.09Å; L48-V357 WeakPolarHBondContact CD2-O 3.36Å; L48-P360 HydrophobicContact CD1-CB 4.33Å; L48-P360 HydrophobicContact CD2-CB 4.23Å; L48-P360 HydrophobicContact CD2-CG 4.24Å; L48-P360 HydrophobicContact CG-CB 4.05Å; L48-P360 HydrophobicContact CG-CG 4.14Å; L48-F361 HydrophobicContact CD1-CE1 4.45Å; L48-F361 HydrophobicContact CD1-CZ 4.19Å; L48-F361 HydrophobicContact CD2-CD2 4.01Å; L48-F361 HydrophobicContact CD2-CE1 4.39Å; L48-F361 HydrophobicContact CD2-CE2 3.23Å; L48-F361 HydrophobicContact CD2-CZ 3.46Å; L48-F361 VanDerWaalsContact CD2-CZ 3.46Å; L48-F361 HydrophobicContact CG-CZ 4.47Å; L48-F367 HydrophobicContact CD1-CE1 4.2Å; L48-F367 HydrophobicContact CD1-CE2 4.06Å; L48-F367 HydrophobicContact CD1-CZ 3.65Å
49	N	96.9	Very high	95.5	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67.7	-38.1	-179.9	-86.9	-72.3	0	0	0	112.2	G45 T46 A52 M53 N75 L79 L82 S356 P360	G45-N49 WeakPolarHBondContact O-CB 3.43Å; G45-N49 PolarHBondContact O-N 2.95Å; G45-N49 PolarHBondContact O-ND2 3.48Å; G45-N49 VanDerWaalsContact O-ND2 3.09Å; T46-N49 PolarHBondContact O-N 3.44Å; N49-A52 WeakPolarHBondContact O-CB 3.48Å; N49-A52 PolarHBondContact O-N 2.97Å; N49-M53 WeakPolarHBondContact O-CB 3.07Å; N49-M53 PolarHBondContact O-N 3.29Å; N49-N75 PolarHBondContact O-ND2 3.38Å; N49-N75 PolarHBondContact O-OD1 3Å; N49-L79 HydrophobicContact CB-CD2 3.58Å; N49-L79 HydrophobicContact CB-CG 3.97Å; N49-L82 HydrophobicContact CB-CD1 4.27Å; N49-L82 WeakPolarHBondContact ND2-CD1 3.34Å; N49-S356 PolarHBondContact ND2-O 3.45Å; N49-P360 WeakPolarHBondContact OD1-CG 3.39Å
50	V	97.3	Very high	95.4	Very high	58 Å²	58	54.7 Å²	54.7	35%	0.352	28%	0.279	S	S	.	.	H	α-helix	trans	-62.4	-45.8	173.4	171.8	0	0	0	0	110.9	T46 A52 M53 M54 L79	T46-V50 HydrophobicContact CG2-CG2 4.29Å; T46-V50 WeakPolarHBondContact O-CB 3.23Å; T46-V50 VanDerWaalsContact O-CG2 3.27Å; T46-V50 WeakPolarHBondContact O-CG2 3.22Å; T46-V50 PolarHBondContact O-N 2.82Å; V50-A52 VanDerWaalsContact C-N 3.34Å; V50-A52 PolarHBondContact O-N 3.44Å; V50-M53 WeakPolarHBondContact O-CB 3.16Å; V50-M53 PolarHBondContact O-N 2.9Å; V50-M54 HydrophobicContact CG1-CE 4.08Å; V50-M54 HydrophobicContact CG1-SD 4.47Å; V50-M54 WeakPolarHBondContact O-CG 3.25Å; V50-M54 PolarHBondContact O-N 3.25Å; V50-L79 HydrophobicContact CG2-CD2 3.77Å
51	S	95.1	Very high	95.3	Very high	32 Å²	32	57.7 Å²	57.7	22%	0.224	29%	0.292	C	S	.	.	H	α-helix	trans	-60.3	-43.3	175.1	-177.5	0	0	0	0	112	P47 L48 M54 R55	P47-S51 WeakPolarHBondContact O-CB 3.17Å; P47-S51 PolarHBondContact O-N 2.6Å; L48-S51 PolarHBondContact O-N 3.39Å; S51-M54 PolarHBondContact O-N 3.38Å; S51-R55 WeakPolarHBondContact O-CB 3.3Å; S51-R55 VanDerWaalsContact O-CG 3.26Å; S51-R55 WeakPolarHBondContact O-CG 3.27Å; S51-R55 PolarHBondContact O-N 3.32Å
52	A	94.6	Very high	95.1	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.008	32%	0.324	C	S	.	.	H	α-helix	trans	-61.1	-43.4	174.2	0	0	0	0	0	112.1	L48 N49 V50 R55 L56 N75 P360 L364	L48-A52 WeakPolarHBondContact O-CB 3.12Å; L48-A52 PolarHBondContact O-N 2.9Å; N49-A52 WeakPolarHBondContact O-CB 3.48Å; N49-A52 PolarHBondContact O-N 2.97Å; V50-A52 VanDerWaalsContact C-N 3.34Å; V50-A52 PolarHBondContact O-N 3.44Å; A52-R55 PolarHBondContact O-N 3.06Å; A52-L56 VanDerWaalsContact O-CB 3.3Å; A52-L56 WeakPolarHBondContact O-CB 3.43Å; A52-L56 PolarHBondContact O-N 3.49Å; A52-N75 VanDerWaalsContact CB-ND2 3.34Å; A52-N75 WeakPolarHBondContact CB-ND2 3.27Å; A52-P360 HydrophobicContact CB-CB 4.03Å; A52-P360 HydrophobicContact CB-CG 4.24Å; A52-L364 HydrophobicContact CB-CD1 3.59Å
53	M	95.3	Very high	94.8	Very high	9 Å²	9	62.1 Å²	62.1	4%	0.044	33%	0.331	C	S	.	.	H	α-helix	trans	-61.4	-49	175.7	-180	56.1	73.5	0	0	111.6	N49 V50 R55 L56 R57 R72 N75 I76 L79	N49-M53 WeakPolarHBondContact O-CB 3.07Å; N49-M53 PolarHBondContact O-N 3.29Å; V50-M53 WeakPolarHBondContact O-CB 3.16Å; V50-M53 PolarHBondContact O-N 2.9Å; M53-R55 VanDerWaalsContact C-N 3.35Å; M53-R55 PolarHBondContact O-N 2.95Å; M53-L56 PolarHBondContact O-N 3.41Å; M53-R57 HydrophobicContact CG-CG 4.42Å; M53-R57 WeakPolarHBondContact O-CB 2.94Å; M53-R57 WeakPolarHBondContact O-CG 3.26Å; M53-R57 PolarHBondContact O-N 3.26Å; M53-R57 HydrophobicContact SD-CG 4.01Å; M53-R72 HydrophobicContact CE-CG 4.14Å; M53-R72 HydrophobicContact SD-CG 4.05Å; M53-N75 HydrophobicContact CE-CB 3.83Å; M53-N75 WeakPolarHBondContact CE-OD1 3.43Å; M53-I76 HydrophobicContact CE-CD1 4.48Å; M53-I76 HydrophobicContact CE-CG1 3.59Å; M53-L79 HydrophobicContact CB-CD1 4.44Å; M53-L79 HydrophobicContact CE-CD1 4.43Å
54	M	95.2	Very high	94.5	Very high	96 Å²	96	60 Å²	60	47%	0.473	32%	0.323	S	S	.	.	H	α-helix	trans	-61.2	-42.2	179.1	-70	-172.1	-66.1	0	0	112.1	V50 S51 R58	V50-M54 HydrophobicContact CG1-CE 4.08Å; V50-M54 HydrophobicContact CG1-SD 4.47Å; V50-M54 WeakPolarHBondContact O-CG 3.25Å; V50-M54 PolarHBondContact O-N 3.25Å; S51-M54 PolarHBondContact O-N 3.38Å; M54-R58 WeakPolarHBondContact O-CG 3.4Å; M54-R58 PolarHBondContact O-N 3.07Å
55	R	92.8	Very high	94.3	Very high	97 Å²	97	59.8 Å²	59.8	37%	0.366	32%	0.315	S	S	.	.	H	α-helix	trans	-63.8	-44.9	175.3	-71.7	172.4	-177.1	-176	1.6	111.4	S51 A52 M53 R58 S59	S51-R55 WeakPolarHBondContact O-CB 3.3Å; S51-R55 VanDerWaalsContact O-CG 3.26Å; S51-R55 WeakPolarHBondContact O-CG 3.27Å; S51-R55 PolarHBondContact O-N 3.32Å; A52-R55 PolarHBondContact O-N 3.06Å; M53-R55 VanDerWaalsContact C-N 3.35Å; M53-R55 PolarHBondContact O-N 2.95Å; R55-R58 PolarHBondContact O-N 2.85Å; R55-S59 WeakPolarHBondContact O-CB 3.42Å; R55-S59 PolarHBondContact O-N 2.87Å
56	L	93.1	Very high	94.2	Very high	11 Å²	11	61.1 Å²	61.1	6%	0.058	32%	0.324	C	S	.	.	H	α-helix	trans	-62.9	-44.7	178.3	-177.2	59.4	0	0	0	111.3	A52 M53 S59 M60 K68 K71 R72	A52-L56 VanDerWaalsContact O-CB 3.3Å; A52-L56 WeakPolarHBondContact O-CB 3.43Å; A52-L56 PolarHBondContact O-N 3.49Å; M53-L56 PolarHBondContact O-N 3.41Å; L56-S59 PolarHBondContact O-N 2.98Å; L56-M60 HydrophobicContact CD1-CG 4.45Å; L56-M60 WeakPolarHBondContact O-CG 3.18Å; L56-M60 PolarHBondContact O-N 3.43Å; L56-K68 HydrophobicContact CD1-CB 4.04Å; L56-K68 HydrophobicContact CD1-CG 4.14Å; L56-K71 HydrophobicContact CD2-CB 3.97Å; L56-R72 VanDerWaalsContact CD2-CA 3.49Å; L56-R72 HydrophobicContact CD2-CB 3.76Å
57	R	94.7	Very high	93.8	Very high	160 Å²	160	62 Å²	62	60%	0.604	33%	0.327	S	S	*	.	H	α-helix	trans	-57.2	-48.9	175.2	-75.5	-179.5	-178.1	-168.9	0.2	111.8	M53 S59 M60 L61	M53-R57 HydrophobicContact CG-CG 4.42Å; M53-R57 WeakPolarHBondContact O-CB 2.94Å; M53-R57 WeakPolarHBondContact O-CG 3.26Å; M53-R57 PolarHBondContact O-N 3.26Å; M53-R57 HydrophobicContact SD-CG 4.01Å; R57-S59 PolarHBondContact O-N 3.03Å; R57-M60 WeakPolarHBondContact O-CA 2.97Å; R57-M60 WeakPolarHBondContact O-CB 3.37Å; R57-M60 PolarHBondContact O-N 3.49Å; R57-L61 PolarHBondContact O-N 3.44Å
58	R	94.3	Very high	93.6	Very high	163 Å²	163	60 Å²	60	62%	0.615	31%	0.311	S	S	*	.	H	α-helix	trans	-59.3	-44.6	175.8	-74.5	-174.2	-71.1	-166.3	-3.1	112.5	M54 R55 M60 L61	M54-R58 WeakPolarHBondContact O-CG 3.4Å; M54-R58 PolarHBondContact O-N 3.07Å; R55-R58 PolarHBondContact O-N 2.85Å; R58-M60 PolarHBondContact O-N 2.86Å; R58-L61 WeakPolarHBondContact O-CB 3.45Å; R58-L61 PolarHBondContact O-N 3.1Å; R58-L61 VanDerWaalsContact O-N 3.17Å
59	S	91.2	Very high	93.6	Very high	48 Å²	48	59.5 Å²	59.5	34%	0.336	31%	0.308	S	S	.	.	H	α-helix	trans	-63.2	-26.7	175.4	149	0	0	0	0	113.1	R55 L56 R57 S63 K68	R55-S59 WeakPolarHBondContact O-CB 3.42Å; R55-S59 PolarHBondContact O-N 2.87Å; L56-S59 PolarHBondContact O-N 2.98Å; R57-S59 PolarHBondContact O-N 3.03Å; S59-S63 PolarHBondContact O-N 2.93Å; S59-K68 PolarHBondContact O-NZ 3.25Å; S59-K68 WeakPolarHBondContact OG-CE 3.3Å; S59-K68 PolarHBondContact OG-NZ 3.44Å
60	M	92.8	Very high	93.5	Very high	19 Å²	19	59.5 Å²	59.5	9%	0.094	31%	0.308	C	S	.	.	H	α-helix	trans	-78	-23.2	176.9	-72.3	-74	-102.1	0	0	113.3	L56 R57 R58 S62 S63 V64 K68 Q69	L56-M60 HydrophobicContact CD1-CG 4.45Å; L56-M60 WeakPolarHBondContact O-CG 3.18Å; L56-M60 PolarHBondContact O-N 3.43Å; R57-M60 WeakPolarHBondContact O-CA 2.97Å; R57-M60 WeakPolarHBondContact O-CB 3.37Å; R57-M60 PolarHBondContact O-N 3.49Å; R58-M60 PolarHBondContact O-N 2.86Å; M60-S62 VanDerWaalsContact C-N 3.26Å; M60-S62 PolarHBondContact O-N 3.15Å; M60-S63 PolarHBondContact O-N 3.35Å; M60-V64 HydrophobicContact CB-CG2 4.45Å; M60-V64 HydrophobicContact CE-CB 4.34Å; M60-V64 HydrophobicContact CE-CG1 3.73Å; M60-V64 HydrophobicContact CE-CG2 4.25Å; M60-V64 WeakPolarHBondContact O-CG2 3.31Å; M60-V64 HydrophobicContact SD-CB 4.26Å; M60-V64 HydrophobicContact SD-CG1 4.25Å; M60-V64 HydrophobicContact SD-CG2 4.12Å; M60-K68 HydrophobicContact CE-CB 3.8Å; M60-K68 HydrophobicContact CG-CB 4.2Å; M60-K68 HydrophobicContact CG-CD 4.19Å; M60-K68 HydrophobicContact SD-CB 3.15Å; M60-K68 WeakPolarHBondContact SD-CB 3.31Å; M60-K68 HydrophobicContact SD-CD 3.41Å; M60-K68 WeakPolarHBondContact SD-CD 3.35Å; M60-K68 HydrophobicContact SD-CG 3.92Å; M60-Q69 HydrophobicContact CE-CB 4.36Å
61	L	94.2	Very high	93.3	Very high	153 Å²	153	58.5 Å²	58.5	80%	0.801	30%	0.299	S	S	*	.	H	α-helix	trans	-61.8	-37.2	173	-63	174.2	0	0	0	111.4	R57 R58	R57-L61 PolarHBondContact O-N 3.44Å; R58-L61 WeakPolarHBondContact O-CB 3.45Å; R58-L61 PolarHBondContact O-N 3.1Å; R58-L61 VanDerWaalsContact O-N 3.17Å
62	S	91.8	Very high	93.4	Very high	108 Å²	108	61 Å²	61	76%	0.755	30%	0.303	S	S	*	.	H	α-helix	trans	-76.5	-42.3	176.8	163.3	0	0	0	0	112.9	M60	M60-S62 VanDerWaalsContact C-N 3.26Å; M60-S62 PolarHBondContact O-N 3.15Å
63	S	91	Very high	93.5	Very high	53 Å²	53	62.5 Å²	62.5	37%	0.371	31%	0.31	S	S	.	.			trans	-160.7	127.8	-178.2	49	0	0	0	0	112.2	S59 M60 K68	S59-S63 PolarHBondContact O-N 2.93Å; M60-S63 PolarHBondContact O-N 3.35Å; S63-K68 WeakPolarHBondContact O-CD 3.43Å; S63-K68 PolarHBondContact O-NZ 2.9Å; S63-K68 PolarHBondContact OG-NZ 3.24Å
64	V	92	Very high	93.5	Very high	71 Å²	71	62.1 Å²	62.1	43%	0.43	31%	0.308	S	S	.	.			trans	-96.5	106.4	176.8	177.4	0	0	0	0	109.8	M60	M60-V64 HydrophobicContact CB-CG2 4.45Å; M60-V64 HydrophobicContact CE-CB 4.34Å; M60-V64 HydrophobicContact CE-CG1 3.73Å; M60-V64 HydrophobicContact CE-CG2 4.25Å; M60-V64 WeakPolarHBondContact O-CG2 3.31Å; M60-V64 HydrophobicContact SD-CB 4.26Å; M60-V64 HydrophobicContact SD-CG1 4.25Å; M60-V64 HydrophobicContact SD-CG2 4.12Å
65	T	91.6	Very high	93.6	Very high	52 Å²	52	57.5 Å²	57.5	32%	0.319	29%	0.285	S	S	.	.			trans	-103.9	152.7	173.2	72.4	0	0	0	0	110.6	L67 K68 Q69	T65-L67 PolarHBondContact O-N 3.36Å; T65-K68 PolarHBondContact O-N 3.15Å; T65-K68 WeakPolarHBondContact OG1-CG 3.46Å; T65-K68 PolarHBondContact OG1-N 3.26Å; T65-Q69 PolarHBondContact O-N 3.46Å
66	P	93.1	Very high	93.8	Very high	29 Å²	29	55.3 Å²	55.3	19%	0.188	28%	0.28	C	S	.	.	H	α-helix	trans	-57.6	-38.2	179	-20.5	30.1	0	0	0	112.5	K68 Q69 L70 K140 T143	P66-K68 PolarHBondContact O-N 3.03Å; P66-Q69 WeakPolarHBondContact O-CB 3.37Å; P66-Q69 PolarHBondContact O-N 3.3Å; P66-L70 WeakPolarHBondContact O-CG 3.35Å; P66-L70 PolarHBondContact O-N 3.29Å; P66-K140 HydrophobicContact CG-CB 4.28Å; P66-T143 HydrophobicContact CB-CG2 3.97Å; P66-T143 WeakPolarHBondContact CB-OG1 3.29Å
67	L	90.8	Very high	94	Very high	36 Å²	36	54.8 Å²	54.8	19%	0.188	28%	0.278	C	S	.	.	H	α-helix	trans	-61	-43.2	174	178.2	63.2	0	0	0	113.1	T65 Q69 L70 K71 R130	T65-L67 PolarHBondContact O-N 3.36Å; L67-Q69 VanDerWaalsContact C-N 3.28Å; L67-Q69 PolarHBondContact O-N 2.93Å; L67-L70 PolarHBondContact O-N 2.94Å; L67-K71 HydrophobicContact CD1-CG 4.47Å; L67-K71 HydrophobicContact CG-CD 4.45Å; L67-K71 WeakPolarHBondContact O-CG 3.33Å; L67-K71 PolarHBondContact O-N 3.28Å; L67-R130 VanDerWaalsContact CD1-NH2 3.26Å
68	K	92.6	Very high	94.1	Very high	38 Å²	38	47.2 Å²	47.2	17%	0.165	25%	0.249	C	C	.	.	H	α-helix	trans	-67.6	-32.8	178.2	-70.7	176.6	-174.1	179.8	0	111	L56 S59 M60 S63 T65 P66 R72	L56-K68 HydrophobicContact CD1-CB 4.04Å; L56-K68 HydrophobicContact CD1-CG 4.14Å; S59-K68 PolarHBondContact O-NZ 3.25Å; S59-K68 WeakPolarHBondContact OG-CE 3.3Å; S59-K68 PolarHBondContact OG-NZ 3.44Å; M60-K68 HydrophobicContact CE-CB 3.8Å; M60-K68 HydrophobicContact CG-CB 4.2Å; M60-K68 HydrophobicContact CG-CD 4.19Å; M60-K68 HydrophobicContact SD-CB 3.15Å; M60-K68 WeakPolarHBondContact SD-CB 3.31Å; M60-K68 HydrophobicContact SD-CD 3.41Å; M60-K68 WeakPolarHBondContact SD-CD 3.35Å; M60-K68 HydrophobicContact SD-CG 3.92Å; S63-K68 WeakPolarHBondContact O-CD 3.43Å; S63-K68 PolarHBondContact O-NZ 2.9Å; S63-K68 PolarHBondContact OG-NZ 3.24Å; T65-K68 PolarHBondContact O-N 3.15Å; T65-K68 WeakPolarHBondContact OG1-CG 3.46Å; T65-K68 PolarHBondContact OG1-N 3.26Å; P66-K68 PolarHBondContact O-N 3.03Å; K68-R72 WeakPolarHBondContact O-CB 3.01Å; K68-R72 PolarHBondContact O-N 3.41Å
69	Q	94.7	Very high	94.3	Very high	15 Å²	15	40.7 Å²	40.7	7%	0.07	23%	0.226	C	C	.	.	H	α-helix	trans	-62.1	-49.8	172.1	-174.6	177.3	-15.3	0	0	110.8	M60 T65 P66 L67 K71 R72 H73 T144 L147	M60-Q69 HydrophobicContact CE-CB 4.36Å; T65-Q69 PolarHBondContact O-N 3.46Å; P66-Q69 WeakPolarHBondContact O-CB 3.37Å; P66-Q69 PolarHBondContact O-N 3.3Å; L67-Q69 VanDerWaalsContact C-N 3.28Å; L67-Q69 PolarHBondContact O-N 2.93Å; Q69-K71 PolarHBondContact O-N 3.49Å; Q69-R72 WeakPolarHBondContact O-CB 3.36Å; Q69-R72 PolarHBondContact O-N 2.89Å; Q69-H73 PolarHBondContact O-CD2 3.26Å; Q69-H73 VanDerWaalsContact O-CD2 3.3Å; Q69-H73 PolarHBondContact O-N 2.94Å; Q69-H73 VanDerWaalsContact O-N 3.12Å; Q69-T144 PolarHBondContact NE2-OG1 3.43Å; Q69-L147 HydrophobicContact CG-CD1 3.72Å
70	L	95.1	Very high	94.6	Very high	1 Å²	1	40 Å²	40	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-57.4	-47.5	176.7	-70.5	160.1	0	0	0	112.5	P66 L67 R72 H73 L74 C125 I126 H129 T143 L147	P66-L70 WeakPolarHBondContact O-CG 3.35Å; P66-L70 PolarHBondContact O-N 3.29Å; L67-L70 PolarHBondContact O-N 2.94Å; L70-R72 PolarHBondContact O-N 3.46Å; L70-H73 PolarHBondContact O-N 3.44Å; L70-H73 VanDerWaalsContact O-N 3.17Å; L70-L74 PolarHBondContact O-N 3.38Å; L70-C125 HydrophobicContact CD2-CB 3.54Å; L70-I126 HydrophobicContact CB-CD1 4.47Å; L70-I126 HydrophobicContact CB-CG1 3.76Å; L70-I126 HydrophobicContact CD1-CG1 4.35Å; L70-I126 HydrophobicContact CD2-CG1 4.32Å; L70-I126 HydrophobicContact CG-CG1 4.37Å; L70-H129 HydrophobicContact CD1-CB 3.52Å; L70-T143 HydrophobicContact CD1-CG2 3.85Å; L70-T143 HydrophobicContact CD2-CG2 3.93Å; L70-T143 HydrophobicContact CG-CG2 3.63Å; L70-L147 HydrophobicContact CD2-CD1 4.38Å; L70-L147 HydrophobicContact CD2-CD2 4.07Å; L70-L147 HydrophobicContact CD2-CG 4.16Å
71	K	94.4	Very high	94.9	Very high	36 Å²	36	39.1 Å²	39.1	16%	0.157	21%	0.214	C	C	.	.	H	α-helix	trans	-59.8	-32.2	176	-71.4	-179.2	-178.7	-167.6	0	112.9	L56 L67 Q69 N75 Y363	L56-K71 HydrophobicContact CD2-CB 3.97Å; L67-K71 HydrophobicContact CD1-CG 4.47Å; L67-K71 HydrophobicContact CG-CD 4.45Å; L67-K71 WeakPolarHBondContact O-CG 3.33Å; L67-K71 PolarHBondContact O-N 3.28Å; Q69-K71 PolarHBondContact O-N 3.49Å; K71-N75 WeakPolarHBondContact O-CB 3.26Å; K71-N75 PolarHBondContact O-N 2.94Å; K71-Y363 HydrophobicContact CD-CD2 4.07Å; K71-Y363 HydrophobicContact CD-CG 4.16Å; K71-Y363 HydrophobicContact CG-CG 4.38Å; K71-Y363 PolarHBondContact NZ-O 3.21Å
72	R	95.6	Very high	95.1	Very high	86 Å²	86	31.8 Å²	31.8	33%	0.325	18%	0.176	S	C	.	.	H	α-helix	trans	-67.8	-46.8	176.5	-176.7	-174.1	65.7	-173.1	1.4	110.5	M53 L56 K68 Q69 L70 L74 N75 I76	M53-R72 HydrophobicContact CE-CG 4.14Å; M53-R72 HydrophobicContact SD-CG 4.05Å; L56-R72 VanDerWaalsContact CD2-CA 3.49Å; L56-R72 HydrophobicContact CD2-CB 3.76Å; K68-R72 WeakPolarHBondContact O-CB 3.01Å; K68-R72 PolarHBondContact O-N 3.41Å; Q69-R72 WeakPolarHBondContact O-CB 3.36Å; Q69-R72 PolarHBondContact O-N 2.89Å; L70-R72 PolarHBondContact O-N 3.46Å; R72-L74 VanDerWaalsContact C-N 3.3Å; R72-L74 PolarHBondContact O-N 3.49Å; R72-N75 PolarHBondContact O-N 2.88Å; R72-I76 HydrophobicContact CG-CD1 4.17Å; R72-I76 VanDerWaalsContact O-CG1 3.27Å; R72-I76 WeakPolarHBondContact O-CG1 3.06Å; R72-I76 PolarHBondContact O-N 2.96Å
73	H	96.9	Very high	95.4	Very high	32 Å²	32	30.8 Å²	30.8	15%	0.148	16%	0.161	C	C	.	.	H	α-helix	trans	-65.9	-34.1	177.5	-74.6	-97.4	0	0	0	112	Q69 L70 I76 S77 V122 L147 W151	Q69-H73 PolarHBondContact O-CD2 3.26Å; Q69-H73 VanDerWaalsContact O-CD2 3.3Å; Q69-H73 PolarHBondContact O-N 2.94Å; Q69-H73 VanDerWaalsContact O-N 3.12Å; L70-H73 PolarHBondContact O-N 3.44Å; L70-H73 VanDerWaalsContact O-N 3.17Å; H73-I76 WeakPolarHBondContact O-CB 3.45Å; H73-I76 PolarHBondContact O-N 3.18Å; H73-S77 PolarHBondContact O-N 3.09Å; H73-S77 PolarHBondContact O-OG 3.24Å; H73-V122 HydrophobicContact CB-CG1 4.22Å; H73-V122 HydrophobicContact CB-CG2 4.09Å; H73-L147 HydrophobicContact CB-CD2 3.81Å; H73-W151 AromaticContact ND1-CE2 3.86Å; H73-W151 AromaticContact ND1-NE1 3.31Å; H73-W151 PolarHBondContact ND1-NE1 2.97Å
74	L	95.7	Very high	95.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-46.1	173.5	-175.7	63.3	0	0	0	111.6	L70 R72 I76 S77 D78 V122 I123 I126 L312 N359 Y363	L70-L74 PolarHBondContact O-N 3.38Å; R72-L74 VanDerWaalsContact C-N 3.3Å; R72-L74 PolarHBondContact O-N 3.49Å; L74-I76 VanDerWaalsContact C-N 3.3Å; L74-I76 PolarHBondContact O-N 2.93Å; L74-S77 PolarHBondContact O-N 3.1Å; L74-S77 PolarHBondContact O-OG 2.75Å; L74-D78 VanDerWaalsContact O-CG 3.24Å; L74-D78 PolarHBondContact O-N 3.48Å; L74-V122 HydrophobicContact CB-CG1 3.87Å; L74-V122 HydrophobicContact CD1-CG1 4.4Å; L74-I123 HydrophobicContact CD1-CD1 4.27Å; L74-I123 HydrophobicContact CD1-CG1 3.72Å; L74-I126 HydrophobicContact CB-CD1 4.44Å; L74-I126 HydrophobicContact CD2-CD1 3.89Å; L74-L312 HydrophobicContact CD2-CD2 4.4Å; L74-N359 HydrophobicContact CD2-CB 4.43Å; L74-Y363 HydrophobicContact CD2-CD1 4.28Å; L74-Y363 HydrophobicContact CD2-CE1 4.26Å
75	N	96.6	Very high	96	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-66	-33.5	176.4	-171.5	-62.9	0	0	0	111.9	N49 A52 M53 K71 R72 D78 L79 Y363	N49-N75 PolarHBondContact O-ND2 3.38Å; N49-N75 PolarHBondContact O-OD1 3Å; A52-N75 VanDerWaalsContact CB-ND2 3.34Å; A52-N75 WeakPolarHBondContact CB-ND2 3.27Å; M53-N75 HydrophobicContact CE-CB 3.83Å; M53-N75 WeakPolarHBondContact CE-OD1 3.43Å; K71-N75 WeakPolarHBondContact O-CB 3.26Å; K71-N75 PolarHBondContact O-N 2.94Å; R72-N75 PolarHBondContact O-N 2.88Å; N75-D78 PolarHBondContact O-N 3.35Å; N75-L79 WeakPolarHBondContact O-CB 3.25Å; N75-L79 WeakPolarHBondContact O-CG 3.45Å; N75-L79 PolarHBondContact O-N 2.89Å; N75-L79 WeakPolarHBondContact OD1-CD1 3.41Å; N75-Y363 PolarHBondContact ND2-OH 3.31Å
76	I	97.6	Very high	96.2	Very high	51 Å²	51	25.6 Å²	25.6	26%	0.262	12%	0.124	S	C	.	.	H	α-helix	trans	-60.2	-48.4	171.5	-70.6	165.9	0	0	0	110.3	M53 R72 H73 L74 D78 L79 M80 W151	M53-I76 HydrophobicContact CE-CD1 4.48Å; M53-I76 HydrophobicContact CE-CG1 3.59Å; R72-I76 HydrophobicContact CG-CD1 4.17Å; R72-I76 VanDerWaalsContact O-CG1 3.27Å; R72-I76 WeakPolarHBondContact O-CG1 3.06Å; R72-I76 PolarHBondContact O-N 2.96Å; H73-I76 WeakPolarHBondContact O-CB 3.45Å; H73-I76 PolarHBondContact O-N 3.18Å; L74-I76 VanDerWaalsContact C-N 3.3Å; L74-I76 PolarHBondContact O-N 2.93Å; I76-D78 VanDerWaalsContact C-N 3.33Å; I76-D78 PolarHBondContact O-N 2.9Å; I76-L79 PolarHBondContact O-N 3.41Å; I76-M80 HydrophobicContact CG2-CG 4.44Å; I76-M80 HydrophobicContact CG2-SD 4.09Å; I76-M80 VanDerWaalsContact O-CG 3.3Å; I76-M80 WeakPolarHBondContact O-CG 3.26Å; I76-M80 PolarHBondContact O-N 3.06Å; I76-W151 HydrophobicContact CG2-CH2 4.24Å; I76-W151 HydrophobicContact CG2-CZ2 4.28Å
77	S	97.2	Very high	96.4	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.7	-37.7	178.1	55.8	0	0	0	0	112.5	H73 L74 L79 M80 I81	H73-S77 PolarHBondContact O-N 3.09Å; H73-S77 PolarHBondContact O-OG 3.24Å; L74-S77 PolarHBondContact O-N 3.1Å; L74-S77 PolarHBondContact O-OG 2.75Å; S77-L79 PolarHBondContact O-N 3.3Å; S77-M80 WeakPolarHBondContact O-CB 3.22Å; S77-M80 PolarHBondContact O-N 3.36Å; S77-M80 VanDerWaalsContact O-N 3.16Å; S77-I81 WeakPolarHBondContact O-CG1 3.43Å; S77-I81 PolarHBondContact O-N 2.85Å
78	D	97.4	Very high	96.7	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-61.5	-43.7	174.9	-68.1	-32.2	0	0	0	111.5	L74 N75 I76 M80 I81 L82 S356 N359	L74-D78 VanDerWaalsContact O-CG 3.24Å; L74-D78 PolarHBondContact O-N 3.48Å; N75-D78 PolarHBondContact O-N 3.35Å; I76-D78 VanDerWaalsContact C-N 3.33Å; I76-D78 PolarHBondContact O-N 2.9Å; D78-M80 VanDerWaalsContact C-N 3.34Å; D78-M80 PolarHBondContact O-N 3.07Å; D78-I81 PolarHBondContact O-N 3.47Å; D78-L82 WeakPolarHBondContact O-CG 3.19Å; D78-L82 PolarHBondContact O-N 3.48Å; D78-S356 VanDerWaalsContact OD1-CA 3.26Å; D78-S356 WeakPolarHBondContact OD1-CA 3.47Å; D78-S356 VanDerWaalsContact OD1-CB 3.29Å; D78-S356 WeakPolarHBondContact OD1-CB 3.4Å; D78-S356 PolarHBondContact OD1-OG 3.29Å; D78-N359 PolarHBondContact OD1-ND2 3.08Å; D78-N359 WeakPolarHBondContact OD2-CB 3.48Å; D78-N359 PolarHBondContact OD2-ND2 2.86Å
79	L	98.2	Very high	96.8	Very high	26 Å²	26	24 Å²	24	14%	0.136	12%	0.119	C	C	.	.	H	α-helix	trans	-64.4	-37	173.4	-74.8	171.4	0	0	0	112.2	N49 V50 M53 N75 I76 S77 L82 L83	N49-L79 HydrophobicContact CB-CD2 3.58Å; N49-L79 HydrophobicContact CB-CG 3.97Å; V50-L79 HydrophobicContact CG2-CD2 3.77Å; M53-L79 HydrophobicContact CB-CD1 4.44Å; M53-L79 HydrophobicContact CE-CD1 4.43Å; N75-L79 WeakPolarHBondContact O-CB 3.25Å; N75-L79 WeakPolarHBondContact O-CG 3.45Å; N75-L79 PolarHBondContact O-N 2.89Å; N75-L79 WeakPolarHBondContact OD1-CD1 3.41Å; I76-L79 PolarHBondContact O-N 3.41Å; S77-L79 PolarHBondContact O-N 3.3Å; L79-L82 PolarHBondContact O-N 3.12Å; L79-L83 HydrophobicContact CB-CD1 4.45Å; L79-L83 WeakPolarHBondContact O-CB 3.44Å; L79-L83 VanDerWaalsContact O-CG 3.24Å; L79-L83 WeakPolarHBondContact O-CG 3.4Å; L79-L83 PolarHBondContact O-N 2.84Å
80	M	98.1	Very high	96.9	Very high	33 Å²	33	24.2 Å²	24.2	16%	0.163	12%	0.12	C	C	.	.	H	α-helix	trans	-63.8	-43	174.5	-68.9	172.3	62.6	0	0	111.4	I76 S77 D78 L82 I84 L114 C115 W151	I76-M80 HydrophobicContact CG2-CG 4.44Å; I76-M80 HydrophobicContact CG2-SD 4.09Å; I76-M80 VanDerWaalsContact O-CG 3.3Å; I76-M80 WeakPolarHBondContact O-CG 3.26Å; I76-M80 PolarHBondContact O-N 3.06Å; S77-M80 WeakPolarHBondContact O-CB 3.22Å; S77-M80 PolarHBondContact O-N 3.36Å; S77-M80 VanDerWaalsContact O-N 3.16Å; D78-M80 VanDerWaalsContact C-N 3.34Å; D78-M80 PolarHBondContact O-N 3.07Å; M80-L82 VanDerWaalsContact C-N 3.32Å; M80-L82 PolarHBondContact O-N 3.27Å; M80-I84 HydrophobicContact CB-CD1 4.31Å; M80-I84 HydrophobicContact CG-CD1 4.46Å; M80-I84 WeakPolarHBondContact O-CA 3.39Å; M80-I84 VanDerWaalsContact O-CB 3.23Å; M80-I84 WeakPolarHBondContact O-CB 3.11Å; M80-I84 PolarHBondContact O-N 3.33Å; M80-L114 HydrophobicContact CE-CD2 4.11Å; M80-L114 HydrophobicContact CE-CG 4.27Å; M80-C115 HydrophobicContact CB-CB 4.32Å; M80-C115 VanDerWaalsContact CB-SG 3.54Å; M80-W151 HydrophobicContact SD-CH2 3.96Å
81	I	98.1	Very high	97	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	15%	0.145	C	C	.	.	I	π-helix	trans	-61.6	-41.4	175.8	-69	168.2	0	0	0	110.9	S77 D78 Y85 T86 C115 F116 S356	S77-I81 WeakPolarHBondContact O-CG1 3.43Å; S77-I81 PolarHBondContact O-N 2.85Å; D78-I81 PolarHBondContact O-N 3.47Å; I81-Y85 HydrophobicContact CG2-CD1 4.32Å; I81-Y85 WeakPolarHBondContact O-CB 3.44Å; I81-Y85 PolarHBondContact O-N 3.19Å; I81-T86 PolarHBondContact O-N 3.06Å; I81-T86 PolarHBondContact O-OG1 3.43Å; I81-C115 HydrophobicContact CG1-CB 3.75Å; I81-F116 HydrophobicContact CD1-CD1 3.84Å; I81-F116 HydrophobicContact CD1-CE1 4.1Å; I81-F116 HydrophobicContact CG1-CD1 4.03Å; I81-F116 HydrophobicContact CG1-CE1 4.04Å; I81-F116 HydrophobicContact CG2-CE1 4.09Å; I81-S356 VanDerWaalsContact CD1-OG 3.26Å; I81-S356 WeakPolarHBondContact CD1-OG 3.24Å
82	L	98.1	Very high	97	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.153	C	C	.	.	I	π-helix	trans	-71.7	-48.1	178.5	-67.4	167.1	0	0	0	112.1	F42 G45 N49 D78 L79 M80 T86 S87 V353 V357	F42-L82 VanDerWaalsContact CD2-O 3.3Å; F42-L82 WeakPolarHBondContact CD2-O 3.3Å; F42-L82 WeakPolarHBondContact CE2-O 3.36Å; G45-L82 WeakPolarHBondContact O-CD1 3.22Å; N49-L82 HydrophobicContact CB-CD1 4.27Å; N49-L82 WeakPolarHBondContact ND2-CD1 3.34Å; D78-L82 WeakPolarHBondContact O-CG 3.19Å; D78-L82 PolarHBondContact O-N 3.48Å; L79-L82 PolarHBondContact O-N 3.12Å; M80-L82 VanDerWaalsContact C-N 3.32Å; M80-L82 PolarHBondContact O-N 3.27Å; L82-T86 WeakPolarHBondContact O-CB 2.99Å; L82-S87 PolarHBondContact O-N 3.18Å; L82-V353 HydrophobicContact CD2-CG1 3.97Å; L82-V357 HydrophobicContact CD2-CG2 4.08Å
83	L	98.2	Very high	96.9	Very high	87 Å²	87	26.5 Å²	26.5	46%	0.455	14%	0.138	S	C	.	.	I	π-helix	trans	-82.7	-25.4	-171.8	-65.1	175.7	0	0	0	114.5	F42 T46 L79 S87	F42-L83 HydrophobicContact CE2-CD2 4.15Å; F42-L83 HydrophobicContact CZ-CD2 4.37Å; T46-L83 HydrophobicContact CG2-CD2 3.76Å; L79-L83 HydrophobicContact CB-CD1 4.45Å; L79-L83 WeakPolarHBondContact O-CB 3.44Å; L79-L83 VanDerWaalsContact O-CG 3.24Å; L79-L83 WeakPolarHBondContact O-CG 3.4Å; L79-L83 PolarHBondContact O-N 2.84Å; L83-S87 VanDerWaalsContact C-OG 3.28Å; L83-S87 WeakPolarHBondContact O-CB 3.28Å; L83-S87 PolarHBondContact O-OG 3.13Å
84	I	98.2	Very high	96.8	Very high	54 Å²	54	29.4 Å²	29.4	28%	0.277	15%	0.154	S	C	.	.	I	π-helix	trans	-107.5	-61	-178.7	-54.8	175.7	0	0	0	110	M80 S87 S88 L108	M80-I84 HydrophobicContact CB-CD1 4.31Å; M80-I84 HydrophobicContact CG-CD1 4.46Å; M80-I84 WeakPolarHBondContact O-CA 3.39Å; M80-I84 VanDerWaalsContact O-CB 3.23Å; M80-I84 WeakPolarHBondContact O-CB 3.11Å; M80-I84 PolarHBondContact O-N 3.33Å; I84-S87 PolarHBondContact O-OG 3.41Å; I84-S88 VanDerWaalsContact O-CB 3.24Å; I84-S88 WeakPolarHBondContact O-CB 3.18Å; I84-S88 PolarHBondContact O-N 2.91Å; I84-S88 PolarHBondContact O-OG 3.43Å; I84-L108 HydrophobicContact CG2-CD1 4.18Å
85	Y	97.6	Very high	96.7	Very high	13 Å²	13	30.5 Å²	30.5	5%	0.051	16%	0.16	C	C	.	.	I	π-helix	trans	-66.5	-58	-176.9	170.7	-97.4	0	0	0	111	M38 I81 S87 S88 Q89 H112 F116 V353	M38-Y85 HydrophobicContact CE-CE1 4.42Å; I81-Y85 HydrophobicContact CG2-CD1 4.32Å; I81-Y85 WeakPolarHBondContact O-CB 3.44Å; I81-Y85 PolarHBondContact O-N 3.19Å; Y85-S87 PolarHBondContact O-N 3.42Å; Y85-S88 PolarHBondContact O-N 3.42Å; Y85-S88 PolarHBondContact O-OG 3.46Å; Y85-Q89 HydrophobicContact CD1-CG 4.45Å; Y85-Q89 HydrophobicContact CD2-CG 4.11Å; Y85-Q89 HydrophobicContact CE1-CG 4.12Å; Y85-Q89 HydrophobicContact CE2-CG 3.77Å; Y85-Q89 HydrophobicContact CG-CG 4.45Å; Y85-Q89 VanDerWaalsContact O-CG 3.24Å; Y85-Q89 WeakPolarHBondContact O-CG 3.16Å; Y85-Q89 PolarHBondContact O-N 3.18Å; Y85-H112 HydrophobicContact CD2-CB 4.23Å; Y85-H112 AromaticContact CD2-CE1 3.93Å; Y85-H112 AromaticContact CD2-CG 3.75Å; Y85-H112 AromaticContact CD2-ND1 3.66Å; Y85-F116 HydrophobicContact CD1-CE1 4.39Å; Y85-F116 AromaticContact CD1-CZ 3.68Å; Y85-F116 HydrophobicContact CD1-CZ 3.68Å; Y85-F116 AromaticContact CD2-CE2 3.67Å; Y85-F116 HydrophobicContact CD2-CE2 3.67Å; Y85-F116 AromaticContact CD2-CZ 3.58Å; Y85-F116 HydrophobicContact CD2-CZ 3.58Å; Y85-F116 AromaticContact CE1-CZ 3.81Å; Y85-F116 HydrophobicContact CE1-CZ 3.81Å; Y85-F116 AromaticContact CE2-CE2 3.81Å; Y85-F116 HydrophobicContact CE2-CE2 3.81Å; Y85-F116 AromaticContact CE2-CZ 3.7Å; Y85-F116 HydrophobicContact CE2-CZ 3.7Å; Y85-F116 HydrophobicContact CG-CE1 4.46Å; Y85-F116 HydrophobicContact CG-CE2 4.07Å; Y85-F116 AromaticContact CG-CZ 3.56Å; Y85-F116 HydrophobicContact CG-CZ 3.56Å; Y85-F116 AromaticContact CZ-CZ 3.81Å; Y85-V353 HydrophobicContact CD1-CG2 4.02Å; Y85-V353 HydrophobicContact CE1-CG2 3.66Å
86	T	97.1	Very high	96.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.165	C	C	.	.	I	π-helix	trans	-65.5	-45.3	-171.4	-48.8	0	0	0	0	111.6	M38 F42 I81 L82 S88 Q89 I90 V353	M38-T86 HydrophobicContact CB-CG2 4.24Å; F42-T86 HydrophobicContact CB-CG2 4.17Å; I81-T86 PolarHBondContact O-N 3.06Å; I81-T86 PolarHBondContact O-OG1 3.43Å; L82-T86 WeakPolarHBondContact O-CB 2.99Å; T86-S88 PolarHBondContact O-N 3.38Å; T86-Q89 PolarHBondContact O-N 3.32Å; T86-I90 HydrophobicContact CG2-CD1 4.14Å; T86-I90 VanDerWaalsContact O-CG1 3.3Å; T86-I90 WeakPolarHBondContact O-CG1 3.24Å; T86-I90 PolarHBondContact O-N 3.12Å; T86-V353 HydrophobicContact CG2-CG1 4.18Å; T86-V353 WeakPolarHBondContact OG1-CG1 3.42Å
87	S	96.9	Very high	96.3	Very high	33 Å²	33	29.9 Å²	29.9	23%	0.231	16%	0.158	C	C	.	.	H	α-helix	trans	-60.4	-44.2	177.2	67.8	0	0	0	0	112.8	L82 L83 I84 Y85 Q89 I90 V91	L82-S87 PolarHBondContact O-N 3.18Å; L83-S87 VanDerWaalsContact C-OG 3.28Å; L83-S87 WeakPolarHBondContact O-CB 3.28Å; L83-S87 PolarHBondContact O-OG 3.13Å; I84-S87 PolarHBondContact O-OG 3.41Å; Y85-S87 PolarHBondContact O-N 3.42Å; S87-Q89 PolarHBondContact O-N 3.1Å; S87-I90 WeakPolarHBondContact O-CB 3.3Å; S87-I90 PolarHBondContact O-N 2.96Å; S87-V91 WeakPolarHBondContact O-CG2 3.46Å; S87-V91 PolarHBondContact O-N 2.91Å
88	S	96.9	Very high	96.2	Very high	20 Å²	20	31.2 Å²	31.2	14%	0.14	16%	0.163	C	C	.	.	H	α-helix	trans	-70.4	-32	179.6	62.6	0	0	0	0	112.7	I84 Y85 T86 V91 W92 H112	I84-S88 VanDerWaalsContact O-CB 3.24Å; I84-S88 WeakPolarHBondContact O-CB 3.18Å; I84-S88 PolarHBondContact O-N 2.91Å; I84-S88 PolarHBondContact O-OG 3.43Å; Y85-S88 PolarHBondContact O-N 3.42Å; Y85-S88 PolarHBondContact O-OG 3.46Å; T86-S88 PolarHBondContact O-N 3.38Å; S88-V91 PolarHBondContact O-N 3.43Å; S88-W92 WeakPolarHBondContact O-CB 3.4Å; S88-W92 PolarHBondContact O-N 3.45Å; S88-H112 PolarHBondContact OG-CE1 3.22Å; S88-H112 VanDerWaalsContact OG-CE1 3.31Å; S88-H112 PolarHBondContact OG-NE2 3.43Å
89	Q	95.2	Very high	96.1	Very high	16 Å²	16	40.2 Å²	40.2	8%	0.075	20%	0.197	C	C	.	.	H	α-helix	trans	-65.1	-41.7	170.5	-66.5	-64.2	-44.6	0	0	111.3	M38 Y85 T86 S87 W92 L93	M38-Q89 HydrophobicContact CE-CB 4.07Å; M38-Q89 HydrophobicContact CE-CG 4.29Å; M38-Q89 HydrophobicContact SD-CB 3.6Å; M38-Q89 HydrophobicContact SD-CG 4.45Å; Y85-Q89 HydrophobicContact CD1-CG 4.45Å; Y85-Q89 HydrophobicContact CD2-CG 4.11Å; Y85-Q89 HydrophobicContact CE1-CG 4.12Å; Y85-Q89 HydrophobicContact CE2-CG 3.77Å; Y85-Q89 HydrophobicContact CG-CG 4.45Å; Y85-Q89 VanDerWaalsContact O-CG 3.24Å; Y85-Q89 WeakPolarHBondContact O-CG 3.16Å; Y85-Q89 PolarHBondContact O-N 3.18Å; T86-Q89 PolarHBondContact O-N 3.32Å; S87-Q89 PolarHBondContact O-N 3.1Å; Q89-W92 PolarHBondContact O-N 3.45Å; Q89-L93 WeakPolarHBondContact O-CB 3.24Å; Q89-L93 VanDerWaalsContact O-CG 3.29Å; Q89-L93 WeakPolarHBondContact O-CG 3.33Å; Q89-L93 PolarHBondContact O-N 3.08Å
90	I	96	Very high	95.9	Very high	19 Å²	19	40.9 Å²	40.9	10%	0.097	20%	0.204	C	C	.	.	H	α-helix	trans	-60	-49	174.9	-70.1	164.4	0	0	0	110.3	L35 M38 I39 F42 T86 S87 W92 L93 I94	L35-I90 HydrophobicContact CD1-CB 4.35Å; L35-I90 HydrophobicContact CD1-CG1 4.44Å; L35-I90 HydrophobicContact CD1-CG2 3.9Å; M38-I90 HydrophobicContact CB-CD1 4.23Å; M38-I90 HydrophobicContact CB-CG1 3.8Å; I39-I90 HydrophobicContact CG1-CD1 4.11Å; I39-I90 HydrophobicContact CG1-CG1 4.24Å; I39-I90 HydrophobicContact CG1-CG2 4.12Å; F42-I90 HydrophobicContact CB-CD1 3.85Å; F42-I90 HydrophobicContact CG-CD1 4.19Å; T86-I90 HydrophobicContact CG2-CD1 4.14Å; T86-I90 VanDerWaalsContact O-CG1 3.3Å; T86-I90 WeakPolarHBondContact O-CG1 3.24Å; T86-I90 PolarHBondContact O-N 3.12Å; S87-I90 WeakPolarHBondContact O-CB 3.3Å; S87-I90 PolarHBondContact O-N 2.96Å; I90-W92 VanDerWaalsContact C-N 3.35Å; I90-W92 PolarHBondContact O-N 3.14Å; I90-L93 PolarHBondContact O-N 2.88Å; I90-I94 HydrophobicContact CG2-CD1 3.73Å; I90-I94 HydrophobicContact CG2-CG1 4.49Å; I90-I94 VanDerWaalsContact O-CG1 3.3Å; I90-I94 WeakPolarHBondContact O-CG1 3.38Å; I90-I94 PolarHBondContact O-N 3.4Å
91	V	96.4	Very high	95.8	Very high	88 Å²	88	43.8 Å²	43.8	53%	0.533	22%	0.22	S	C	.	.	H	α-helix	trans	-58.7	-47.5	178	172.7	0	0	0	0	110.7	S87 S88 L93 I94 T95	S87-V91 WeakPolarHBondContact O-CG2 3.46Å; S87-V91 PolarHBondContact O-N 2.91Å; S88-V91 PolarHBondContact O-N 3.43Å; V91-L93 PolarHBondContact O-N 2.75Å; V91-I94 PolarHBondContact O-N 3.28Å; V91-T95 HydrophobicContact CG1-CG2 4.45Å; V91-T95 PolarHBondContact O-N 3.32Å; V91-T95 PolarHBondContact O-OG1 3.49Å; V91-T95 VanDerWaalsContact O-OG1 3.1Å
92	W	95.4	Very high	95.8	Very high	81 Å²	81	46 Å²	46	31%	0.307	23%	0.232	S	C	.	.	H	α-helix	trans	-63.1	-39.1	179	178.4	76.5	0	0	0	112.7	S88 Q89 I90 T95 V96	S88-W92 WeakPolarHBondContact O-CB 3.4Å; S88-W92 PolarHBondContact O-N 3.45Å; Q89-W92 PolarHBondContact O-N 3.45Å; I90-W92 VanDerWaalsContact C-N 3.35Å; I90-W92 PolarHBondContact O-N 3.14Å; W92-T95 PolarHBondContact O-OG1 2.78Å; W92-V96 VanDerWaalsContact O-CA 3.25Å; W92-V96 WeakPolarHBondContact O-CA 3.04Å; W92-V96 PolarHBondContact O-N 2.66Å
93	L	93.1	Very high	95.8	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-68.2	-33.3	175.2	-73.8	167.4	0	0	0	112.3	R27 D31 R34 L35 M38 Q89 I90 V91	R27-L93 VanDerWaalsContact CD-O 3.31Å; R27-L93 WeakPolarHBondContact CD-O 3.31Å; R27-L93 PolarHBondContact NH1-O 2.99Å; D31-L93 HydrophobicContact CB-CD2 4.1Å; R34-L93 HydrophobicContact CB-CD1 4.49Å; R34-L93 HydrophobicContact CG-CD1 4.01Å; L35-L93 HydrophobicContact CB-CB 4.3Å; L35-L93 HydrophobicContact CB-CD1 4.18Å; L35-L93 HydrophobicContact CD1-CB 4.02Å; M38-L93 HydrophobicContact SD-CD1 3.98Å; Q89-L93 WeakPolarHBondContact O-CB 3.24Å; Q89-L93 VanDerWaalsContact O-CG 3.29Å; Q89-L93 WeakPolarHBondContact O-CG 3.33Å; Q89-L93 PolarHBondContact O-N 3.08Å; I90-L93 PolarHBondContact O-N 2.88Å; V91-L93 PolarHBondContact O-N 2.75Å
94	I	94.5	Very high	95.8	Very high	94 Å²	94	50.2 Å²	50.2	48%	0.482	26%	0.259	S	S	.	.	H	α-helix	trans	-71.2	-44	176.2	-70.2	167.9	0	0	0	111.1	R27 L35 I90 V91	R27-I94 PolarHBondContact NH1-O 3.45Å; L35-I94 HydrophobicContact CD1-CD1 4.42Å; L35-I94 HydrophobicContact CD1-CG1 3.96Å; L35-I94 HydrophobicContact CD2-CG1 4Å; I90-I94 HydrophobicContact CG2-CD1 3.73Å; I90-I94 HydrophobicContact CG2-CG1 4.49Å; I90-I94 VanDerWaalsContact O-CG1 3.3Å; I90-I94 WeakPolarHBondContact O-CG1 3.38Å; I90-I94 PolarHBondContact O-N 3.4Å; V91-I94 PolarHBondContact O-N 3.28Å
95	T	93.5	Very high	95.8	Very high	23 Å²	23	47.7 Å²	47.7	14%	0.141	25%	0.246	C	C	.	.	H	α-helix	trans	-82.6	-29.1	-176.6	58.3	0	0	0	0	113.1	V91 W92 D97	V91-T95 HydrophobicContact CG1-CG2 4.45Å; V91-T95 PolarHBondContact O-N 3.32Å; V91-T95 PolarHBondContact O-OG1 3.49Å; V91-T95 VanDerWaalsContact O-OG1 3.1Å; W92-T95 PolarHBondContact O-OG1 2.78Å; T95-D97 PolarHBondContact O-N 3.46Å; T95-D97 PolarHBondContact OG1-N 2.79Å; T95-D97 PolarHBondContact OG1-O 2.99Å
96	V	92.8	Very high	95.8	Very high	16 Å²	16	49.8 Å²	49.8	10%	0.097	26%	0.256	C	S	.	.	S	Bend	trans	49.2	25.9	-167.4	-149.5	0	0	0	0	112.7	P25 R27 W92 Q178	P25-V96 HydrophobicContact CG-CG1 3.96Å; P25-V96 VanDerWaalsContact O-CG1 3.26Å; P25-V96 WeakPolarHBondContact O-CG1 3.32Å; R27-V96 HydrophobicContact CG-CG2 3.5Å; W92-V96 VanDerWaalsContact O-CA 3.25Å; W92-V96 WeakPolarHBondContact O-CA 3.04Å; W92-V96 PolarHBondContact O-N 2.66Å; V96-Q178 PolarHBondContact O-NE2 2.95Å
97	D	93.2	Very high	95.9	Very high	22 Å²	22	53 Å²	53	12%	0.118	28%	0.275	C	S	.	.	S	Bend	trans	-153.6	137	-171.8	176.1	35.3	0	0	0	109.4	P24 T95 R99 Q177	P24-D97 HydrophobicContact CB-CB 4.16Å; T95-D97 PolarHBondContact O-N 3.46Å; T95-D97 PolarHBondContact OG1-N 2.79Å; T95-D97 PolarHBondContact OG1-O 2.99Å; D97-R99 HydrophobicContact CB-CG 4.49Å; D97-R99 PolarHBondContact O-N 2.98Å; D97-R99 VanDerWaalsContact OD2-CG 3.3Å; D97-R99 WeakPolarHBondContact OD2-CG 3.04Å; D97-R99 IonicContact OD2-NE 3.95Å; D97-Q177 PolarHBondContact OD1-N 3.31Å
98	W	95.9	Very high	96	Very high	28 Å²	28	52.8 Å²	52.8	11%	0.106	27%	0.271	C	S	.	.			trans	-85.7	90.2	174	-177.4	-97.8	0	0	0	110.5	S100 N101 M104 C105 L108 V167 Q177 C179	W98-S100 PolarHBondContact NE1-O 3.33Å; W98-S100 PolarHBondContact O-N 3.43Å; W98-S100 VanDerWaalsContact O-N 3.14Å; W98-N101 PolarHBondContact NE1-O 3.19Å; W98-M104 HydrophobicContact CZ2-CB 4.07Å; W98-M104 HydrophobicContact CZ2-CG 4.25Å; W98-C105 HydrophobicContact CZ2-CB 3.76Å; W98-C105 VanDerWaalsContact CZ2-N 3.27Å; W98-L108 HydrophobicContact CH2-CB 4.18Å; W98-L108 HydrophobicContact CH2-CD2 3.48Å; W98-L108 VanDerWaalsContact CH2-CD2 3.48Å; W98-L108 HydrophobicContact CH2-CG 4.47Å; W98-L108 HydrophobicContact CZ3-CD2 3.45Å; W98-L108 VanDerWaalsContact CZ3-CD2 3.45Å; W98-V167 HydrophobicContact CG-CG2 4.43Å; W98-Q177 HydrophobicContact CB-CG 4.36Å; W98-Q177 VanDerWaalsContact CB-O 3.31Å; W98-Q177 WeakPolarHBondContact CB-O 3.27Å; W98-Q177 PolarHBondContact N-O 2.91Å; W98-Q177 WeakPolarHBondContact O-CG 3.22Å; W98-Q177 PolarHBondContact O-NE2 3.24Å; W98-C179 HydrophobicContact CB-CB 4.35Å; W98-C179 HydrophobicContact CD2-CB 3.56Å; W98-C179 HydrophobicContact CE3-CB 3.81Å; W98-C179 HydrophobicContact CG-CB 3.78Å; W98-C179 HydrophobicContact CZ3-CB 4.42Å
99	R	93.9	Very high	96	Very high	188 Å²	188	53.6 Å²	53.6	71%	0.709	27%	0.272	S	S	*	.			trans	-76.1	3.8	-176.6	-63.6	-177	-176.3	177.3	2.5	115.7	D97	D97-R99 HydrophobicContact CB-CG 4.49Å; D97-R99 PolarHBondContact O-N 2.98Å; D97-R99 VanDerWaalsContact OD2-CG 3.3Å; D97-R99 WeakPolarHBondContact OD2-CG 3.04Å; D97-R99 IonicContact OD2-NE 3.95Å
100	S	95.7	Very high	96.2	Very high	41 Å²	41	54.3 Å²	54.3	29%	0.287	28%	0.275	S	S	.	.	S	Bend	trans	-110.4	175.1	-176.7	-166.7	0	0	0	0	111.8	W98 M104 Q177	W98-S100 PolarHBondContact NE1-O 3.33Å; W98-S100 PolarHBondContact O-N 3.43Å; W98-S100 VanDerWaalsContact O-N 3.14Å; S100-M104 WeakPolarHBondContact OG-CB 3.49Å; S100-M104 WeakPolarHBondContact OG-CG 3.35Å; S100-Q177 PolarHBondContact O-NE2 3.47Å
101	N	95.9	Very high	96.3	Very high	93 Å²	93	54.6 Å²	54.6	50%	0.497	28%	0.279	S	S	.	.			trans	-78.9	175.5	177.2	64.7	25	0	0	0	113.6	W98 S103 M104 C105	W98-N101 PolarHBondContact NE1-O 3.19Å; N101-S103 PolarHBondContact OD1-N 2.02Å; N101-M104 PolarHBondContact O-N 3.22Å; N101-M104 VanDerWaalsContact OD1-CB 3.3Å; N101-M104 WeakPolarHBondContact OD1-CB 3.5Å; N101-M104 PolarHBondContact OD1-N 3Å; N101-C105 PolarHBondContact O-N 2.83Å
102	D	97.4	Very high	96.4	Very high	48 Å²	48	51 Å²	51	26%	0.257	26%	0.256	S	S	.	.	H	α-helix	trans	-63.3	-41.7	179.6	-175.8	77.6	0	0	0	113.1	M104 C105 K106 T166 V167	D102-M104 VanDerWaalsContact C-N 3.31Å; D102-M104 PolarHBondContact O-N 3.34Å; D102-C105 WeakPolarHBondContact O-CB 3.25Å; D102-C105 PolarHBondContact O-N 3.34Å; D102-C105 VanDerWaalsContact O-N 3.12Å; D102-K106 PolarHBondContact O-N 2.89Å; D102-K106 WeakPolarHBondContact OD2-CE 3.09Å; D102-K106 IonicContact OD2-NZ 2.69Å; D102-K106 PolarHBondContact OD2-NZ 3.12Å; D102-T166 VanDerWaalsContact OD1-CA 3.22Å; D102-T166 WeakPolarHBondContact OD1-CA 3.48Å; D102-T166 PolarHBondContact OD1-OG1 2.92Å; D102-V167 HydrophobicContact CB-CB 4.39Å; D102-V167 HydrophobicContact CB-CG2 4.3Å; D102-V167 PolarHBondContact OD1-N 3.29Å
103	S	97.9	Very high	96.5	Very high	79 Å²	79	47.3 Å²	47.3	55%	0.552	24%	0.243	S	C	*	.	H	α-helix	trans	-58.9	-43.1	177.4	-52	0	0	0	0	112	N101 C105 K106 V107	N101-S103 PolarHBondContact OD1-N 2.02Å; S103-C105 VanDerWaalsContact C-N 3.33Å; S103-C105 PolarHBondContact O-N 3.12Å; S103-K106 PolarHBondContact O-N 2.81Å; S103-V107 VanDerWaalsContact O-CG2 3.31Å; S103-V107 WeakPolarHBondContact O-CG2 3.43Å; S103-V107 PolarHBondContact O-N 3.5Å
104	M	97.5	Very high	96.7	Very high	97 Å²	97	48.3 Å²	48.3	48%	0.478	25%	0.248	S	C	.	.	H	α-helix	trans	-69.2	-32.6	178.6	-161.8	64.7	70	0	0	112	W98 S100 N101 D102 L108	W98-M104 HydrophobicContact CZ2-CB 4.07Å; W98-M104 HydrophobicContact CZ2-CG 4.25Å; S100-M104 WeakPolarHBondContact OG-CB 3.49Å; S100-M104 WeakPolarHBondContact OG-CG 3.35Å; N101-M104 PolarHBondContact O-N 3.22Å; N101-M104 VanDerWaalsContact OD1-CB 3.3Å; N101-M104 WeakPolarHBondContact OD1-CB 3.5Å; N101-M104 PolarHBondContact OD1-N 3Å; D102-M104 VanDerWaalsContact C-N 3.31Å; D102-M104 PolarHBondContact O-N 3.34Å; M104-L108 WeakPolarHBondContact O-CB 3.22Å; M104-L108 PolarHBondContact O-N 3.29Å
105	C	98.4	Very high	96.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-50.1	174.4	166.2	0	0	0	0	109.8	W98 N101 D102 S103 L108 K109 V167 C179	W98-C105 HydrophobicContact CZ2-CB 3.76Å; W98-C105 VanDerWaalsContact CZ2-N 3.27Å; N101-C105 PolarHBondContact O-N 2.83Å; D102-C105 WeakPolarHBondContact O-CB 3.25Å; D102-C105 PolarHBondContact O-N 3.34Å; D102-C105 VanDerWaalsContact O-N 3.12Å; S103-C105 VanDerWaalsContact C-N 3.33Å; S103-C105 PolarHBondContact O-N 3.12Å; C105-L108 PolarHBondContact O-N 3.26Å; C105-K109 WeakPolarHBondContact O-CB 3.43Å; C105-K109 WeakPolarHBondContact O-CG 3.35Å; C105-K109 PolarHBondContact O-N 3.4Å; C105-V167 HydrophobicContact CB-CG2 3.72Å; C105-C179 VanDerWaalsContact CA-SG 3.51Å; C105-C179 HydrophobicContact CB-CB 3.75Å; C105-C179 WeakPolarHBondContact CB-SG 3.36Å; C105-C179 VanDerWaalsContact SG-CA 3.53Å; C105-C179 WeakPolarHBondContact SG-CB 3.47Å; C105-C179 CovalentContact SG-SG 2.02Å; C105-C179 PolarHBondContact SG-SG 3Å
106	K	98.5	Very high	97	Very high	57 Å²	57	43.6 Å²	43.6	25%	0.248	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-48.2	178.2	-70.6	169.1	173.2	165.3	0	112.6	D102 S103 L108 K109 F110 F162 W165	D102-K106 PolarHBondContact O-N 2.89Å; D102-K106 WeakPolarHBondContact OD2-CE 3.09Å; D102-K106 IonicContact OD2-NZ 2.69Å; D102-K106 PolarHBondContact OD2-NZ 3.12Å; S103-K106 PolarHBondContact O-N 2.81Å; K106-L108 VanDerWaalsContact C-N 3.34Å; K106-L108 PolarHBondContact O-N 3.03Å; K106-K109 PolarHBondContact O-N 2.85Å; K106-F110 VanDerWaalsContact O-CB 3.31Å; K106-F110 WeakPolarHBondContact O-CB 3.26Å; K106-F110 PolarHBondContact O-N 3.06Å; K106-F162 HydrophobicContact CB-CD1 3.82Å; K106-F162 HydrophobicContact CB-CE1 4.36Å; K106-F162 WeakPolarHBondContact CD-O 3.37Å; K106-F162 WeakPolarHBondContact CE-O 3.32Å; K106-W165 WeakPolarHBondContact CE-O 3.41Å; K106-W165 VanDerWaalsContact CG-O 3.26Å; K106-W165 WeakPolarHBondContact CG-O 3.24Å
107	V	98.5	Very high	97.2	Very high	67 Å²	67	42.9 Å²	42.9	41%	0.406	22%	0.218	S	C	.	.	H	α-helix	trans	-61.5	-41.9	178.1	170.2	0	0	0	0	111.4	S103 S111 F162	S103-V107 VanDerWaalsContact O-CG2 3.31Å; S103-V107 WeakPolarHBondContact O-CG2 3.43Å; S103-V107 PolarHBondContact O-N 3.5Å; V107-S111 WeakPolarHBondContact O-CB 3.36Å; V107-S111 PolarHBondContact O-N 3.22Å; V107-S111 PolarHBondContact O-OG 2.76Å; V107-F162 HydrophobicContact CG2-CE1 4Å
108	L	98.4	Very high	97.4	Very high	29 Å²	29	41.9 Å²	41.9	15%	0.152	21%	0.213	C	C	.	.	H	α-helix	trans	-65.1	-46	179.2	-177.7	65.6	0	0	0	111.4	I84 W98 M104 C105 K106 S111 H112	I84-L108 HydrophobicContact CG2-CD1 4.18Å; W98-L108 HydrophobicContact CH2-CB 4.18Å; W98-L108 HydrophobicContact CH2-CD2 3.48Å; W98-L108 VanDerWaalsContact CH2-CD2 3.48Å; W98-L108 HydrophobicContact CH2-CG 4.47Å; W98-L108 HydrophobicContact CZ3-CD2 3.45Å; W98-L108 VanDerWaalsContact CZ3-CD2 3.45Å; M104-L108 WeakPolarHBondContact O-CB 3.22Å; M104-L108 PolarHBondContact O-N 3.29Å; C105-L108 PolarHBondContact O-N 3.26Å; K106-L108 VanDerWaalsContact C-N 3.34Å; K106-L108 PolarHBondContact O-N 3.03Å; L108-S111 CarbonylContact O-C 3.58Å; L108-S111 WeakPolarHBondContact O-CB 3.47Å; L108-S111 PolarHBondContact O-N 3.31Å; L108-S111 VanDerWaalsContact O-N 3.14Å; L108-H112 WeakPolarHBondContact CD1-NE2 3.16Å; L108-H112 WeakPolarHBondContact CG-NE2 3.4Å; L108-H112 PolarHBondContact O-CD2 3.35Å; L108-H112 PolarHBondContact O-N 2.78Å
109	K	98.2	Very high	97.5	Very high	38 Å²	38	40.5 Å²	40.5	17%	0.165	21%	0.207	C	C	.	.	H	α-helix	trans	-68.5	-39.5	-179.4	-64.2	-72.7	-176.4	165	0	112.1	C105 K106 S111 H112 A113 W165 C179	C105-K109 WeakPolarHBondContact O-CB 3.43Å; C105-K109 WeakPolarHBondContact O-CG 3.35Å; C105-K109 PolarHBondContact O-N 3.4Å; K106-K109 PolarHBondContact O-N 2.85Å; K109-S111 VanDerWaalsContact C-N 3.3Å; K109-S111 PolarHBondContact O-N 3.35Å; K109-H112 PolarHBondContact O-N 3.04Å; K109-A113 PolarHBondContact O-N 3.17Å; K109-W165 HydrophobicContact CB-CB 4.19Å; K109-W165 HydrophobicContact CB-CD2 3.94Å; K109-W165 HydrophobicContact CB-CG 3.61Å; K109-W165 HydrophobicContact CD-CD2 3.62Å; K109-W165 HydrophobicContact CD-CE3 3.71Å; K109-W165 HydrophobicContact CD-CG 4.22Å; K109-W165 HydrophobicContact CD-CH2 4.04Å; K109-W165 HydrophobicContact CD-CZ2 3.92Å; K109-W165 HydrophobicContact CD-CZ3 3.93Å; K109-W165 VanDerWaalsContact CE-CE3 3.43Å; K109-W165 VanDerWaalsContact CE-CZ3 3.46Å; K109-W165 HydrophobicContact CG-CB 4.03Å; K109-W165 HydrophobicContact CG-CD2 3.49Å; K109-W165 VanDerWaalsContact CG-CD2 3.49Å; K109-W165 HydrophobicContact CG-CE3 3.85Å; K109-W165 HydrophobicContact CG-CG 3.55Å; K109-C179 WeakPolarHBondContact CE-SG 3.4Å
110	F	98.4	Very high	97.6	Very high	31 Å²	31	31.6 Å²	31.6	14%	0.136	17%	0.174	C	C	.	.	H	α-helix	trans	-54	-49	166.6	168.1	-95.3	0	0	0	111.1	K106 H112 A113 L114 V155 S158 L159 Q161 F162	K106-F110 VanDerWaalsContact O-CB 3.31Å; K106-F110 WeakPolarHBondContact O-CB 3.26Å; K106-F110 PolarHBondContact O-N 3.06Å; F110-H112 VanDerWaalsContact C-N 3.33Å; F110-H112 PolarHBondContact O-N 3.44Å; F110-A113 PolarHBondContact O-N 3.31Å; F110-L114 HydrophobicContact CE1-CD2 4.02Å; F110-L114 HydrophobicContact CZ-CD2 4.29Å; F110-L114 WeakPolarHBondContact O-CB 3.33Å; F110-L114 PolarHBondContact O-N 3.17Å; F110-V155 HydrophobicContact CZ-CG1 4.5Å; F110-S158 WeakPolarHBondContact CD2-O 3.3Å; F110-L159 HydrophobicContact CE2-CD2 4.34Å; F110-Q161 HydrophobicContact CB-CB 4.09Å; F110-F162 HydrophobicContact CB-CD2 4.4Å; F110-F162 HydrophobicContact CB-CE1 4.44Å; F110-F162 HydrophobicContact CB-CE2 3.87Å; F110-F162 HydrophobicContact CB-CZ 3.88Å; F110-F162 HydrophobicContact CD1-CE2 4.2Å; F110-F162 HydrophobicContact CD1-CZ 4.13Å; F110-F162 HydrophobicContact CD2-CD2 4.01Å; F110-F162 AromaticContact CD2-CE2 3.38Å; F110-F162 HydrophobicContact CD2-CE2 3.38Å; F110-F162 HydrophobicContact CD2-CZ 4.1Å; F110-F162 AromaticContact CE2-CE2 3.96Å; F110-F162 HydrophobicContact CE2-CE2 3.96Å; F110-F162 HydrophobicContact CG-CD2 4.36Å; F110-F162 AromaticContact CG-CE2 3.53Å; F110-F162 HydrophobicContact CG-CE2 3.53Å; F110-F162 AromaticContact CG-CZ 3.76Å; F110-F162 HydrophobicContact CG-CZ 3.76Å
111	S	98.4	Very high	97.6	Very high	24 Å²	24	30.4 Å²	30.4	17%	0.168	16%	0.164	C	C	.	.	H	α-helix	trans	-64.1	-38.7	-178.7	-57.2	0	0	0	0	111.7	V107 L108 K109 L114 C115	V107-S111 WeakPolarHBondContact O-CB 3.36Å; V107-S111 PolarHBondContact O-N 3.22Å; V107-S111 PolarHBondContact O-OG 2.76Å; L108-S111 CarbonylContact O-C 3.58Å; L108-S111 WeakPolarHBondContact O-CB 3.47Å; L108-S111 PolarHBondContact O-N 3.31Å; L108-S111 VanDerWaalsContact O-N 3.14Å; K109-S111 VanDerWaalsContact C-N 3.3Å; K109-S111 PolarHBondContact O-N 3.35Å; S111-L114 PolarHBondContact O-N 3.4Å; S111-C115 PolarHBondContact O-N 3.05Å; S111-C115 PolarHBondContact O-SG 3.46Å
112	H	98	Very high	97.7	Very high	13 Å²	13	26 Å²	26	6%	0.06	14%	0.141	C	C	.	.	H	α-helix	trans	-58.8	-52.4	173.8	-68.8	-174.7	0	0	0	111.3	Y85 S88 L108 K109 F110 L114 C115 F116	Y85-H112 HydrophobicContact CD2-CB 4.23Å; Y85-H112 AromaticContact CD2-CE1 3.93Å; Y85-H112 AromaticContact CD2-CG 3.75Å; Y85-H112 AromaticContact CD2-ND1 3.66Å; S88-H112 PolarHBondContact OG-CE1 3.22Å; S88-H112 VanDerWaalsContact OG-CE1 3.31Å; S88-H112 PolarHBondContact OG-NE2 3.43Å; L108-H112 WeakPolarHBondContact CD1-NE2 3.16Å; L108-H112 WeakPolarHBondContact CG-NE2 3.4Å; L108-H112 PolarHBondContact O-CD2 3.35Å; L108-H112 PolarHBondContact O-N 2.78Å; K109-H112 PolarHBondContact O-N 3.04Å; F110-H112 VanDerWaalsContact C-N 3.33Å; F110-H112 PolarHBondContact O-N 3.44Å; H112-L114 VanDerWaalsContact C-N 3.3Å; H112-L114 PolarHBondContact O-N 2.83Å; H112-C115 WeakPolarHBondContact O-CB 3.39Å; H112-C115 PolarHBondContact O-N 2.96Å; H112-F116 WeakPolarHBondContact O-CD2 3.47Å; H112-F116 PolarHBondContact O-N 3.35Å
113	A	97.7	Very high	97.5	Very high	4 Å²	4	23.9 Å²	23.9	3%	0.033	13%	0.129	C	C	.	.	H	α-helix	trans	-58.5	-43.5	177.7	0	0	0	0	0	111.4	K109 F110 C115 F116 S117 Q161	K109-A113 PolarHBondContact O-N 3.17Å; F110-A113 PolarHBondContact O-N 3.31Å; A113-C115 PolarHBondContact O-N 3.47Å; A113-F116 PolarHBondContact O-N 2.84Å; A113-S117 WeakPolarHBondContact O-CB 3.3Å; A113-S117 PolarHBondContact O-N 2.9Å; A113-S117 PolarHBondContact O-OG 2.92Å; A113-S117 VanDerWaalsContact O-OG 3.09Å; A113-Q161 HydrophobicContact CB-CG 3.58Å
114	L	98.3	Very high	97.4	Very high	22 Å²	22	21 Å²	21	12%	0.115	11%	0.109	C	C	.	.	H	α-helix	trans	-60.1	-45.7	178	-178.7	69	0	0	0	112	M80 F110 S111 H112 F116 S117 V118 A154 V155 S158	M80-L114 HydrophobicContact CE-CD2 4.11Å; M80-L114 HydrophobicContact CE-CG 4.27Å; F110-L114 HydrophobicContact CE1-CD2 4.02Å; F110-L114 HydrophobicContact CZ-CD2 4.29Å; F110-L114 WeakPolarHBondContact O-CB 3.33Å; F110-L114 PolarHBondContact O-N 3.17Å; S111-L114 PolarHBondContact O-N 3.4Å; H112-L114 VanDerWaalsContact C-N 3.3Å; H112-L114 PolarHBondContact O-N 2.83Å; L114-F116 VanDerWaalsContact C-N 3.32Å; L114-F116 PolarHBondContact O-N 2.9Å; L114-S117 PolarHBondContact O-N 2.75Å; L114-V118 HydrophobicContact CD1-CG2 3.89Å; L114-V118 HydrophobicContact CG-CG2 4.21Å; L114-V118 WeakPolarHBondContact O-CB 3.19Å; L114-V118 VanDerWaalsContact O-CG2 3.24Å; L114-V118 WeakPolarHBondContact O-CG2 3.32Å; L114-V118 PolarHBondContact O-N 3.5Å; L114-A154 HydrophobicContact CD1-CB 4.03Å; L114-V155 HydrophobicContact CD1-CG2 3.73Å; L114-S158 WeakPolarHBondContact CA-OG 3.5Å; L114-S158 PolarHBondContact N-OG 3.23Å; L114-S158 VanDerWaalsContact N-OG 3.15Å
115	C	97.8	Very high	97.3	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-54.8	-49.4	179	-67.6	0	0	0	0	111.4	M80 I81 S111 H112 A113 S119	M80-C115 HydrophobicContact CB-CB 4.32Å; M80-C115 VanDerWaalsContact CB-SG 3.54Å; I81-C115 HydrophobicContact CG1-CB 3.75Å; S111-C115 PolarHBondContact O-N 3.05Å; S111-C115 PolarHBondContact O-SG 3.46Å; H112-C115 WeakPolarHBondContact O-CB 3.39Å; H112-C115 PolarHBondContact O-N 2.96Å; A113-C115 PolarHBondContact O-N 3.47Å; C115-S119 WeakPolarHBondContact O-CB 3.23Å; C115-S119 PolarHBondContact O-N 3.1Å; C115-S119 VanDerWaalsContact O-N 3.13Å
116	F	96.9	Very high	97	Very high	18 Å²	18	17.1 Å²	17.1	8%	0.079	9%	0.09	C	C	.	.	H	α-helix	trans	-70.7	-45.4	-178.2	-64	-51.1	0	0	0	112.2	I81 Y85 H112 A113 L114 V118 S119 S120 V216 W320 I352	I81-F116 HydrophobicContact CD1-CD1 3.84Å; I81-F116 HydrophobicContact CD1-CE1 4.1Å; I81-F116 HydrophobicContact CG1-CD1 4.03Å; I81-F116 HydrophobicContact CG1-CE1 4.04Å; I81-F116 HydrophobicContact CG2-CE1 4.09Å; Y85-F116 HydrophobicContact CD1-CE1 4.39Å; Y85-F116 AromaticContact CD1-CZ 3.68Å; Y85-F116 HydrophobicContact CD1-CZ 3.68Å; Y85-F116 AromaticContact CD2-CE2 3.67Å; Y85-F116 HydrophobicContact CD2-CE2 3.67Å; Y85-F116 AromaticContact CD2-CZ 3.58Å; Y85-F116 HydrophobicContact CD2-CZ 3.58Å; Y85-F116 AromaticContact CE1-CZ 3.81Å; Y85-F116 HydrophobicContact CE1-CZ 3.81Å; Y85-F116 AromaticContact CE2-CE2 3.81Å; Y85-F116 HydrophobicContact CE2-CE2 3.81Å; Y85-F116 AromaticContact CE2-CZ 3.7Å; Y85-F116 HydrophobicContact CE2-CZ 3.7Å; Y85-F116 HydrophobicContact CG-CE1 4.46Å; Y85-F116 HydrophobicContact CG-CE2 4.07Å; Y85-F116 AromaticContact CG-CZ 3.56Å; Y85-F116 HydrophobicContact CG-CZ 3.56Å; Y85-F116 AromaticContact CZ-CZ 3.81Å; H112-F116 WeakPolarHBondContact O-CD2 3.47Å; H112-F116 PolarHBondContact O-N 3.35Å; A113-F116 PolarHBondContact O-N 2.84Å; L114-F116 VanDerWaalsContact C-N 3.32Å; L114-F116 PolarHBondContact O-N 2.9Å; F116-V118 PolarHBondContact O-N 3.45Å; F116-S119 WeakPolarHBondContact O-CB 3.46Å; F116-S119 PolarHBondContact O-N 3.37Å; F116-S120 PolarHBondContact O-N 3.05Å; F116-S120 PolarHBondContact O-OG 3.31Å; F116-V216 HydrophobicContact CB-CG1 3.76Å; F116-W320 HydrophobicContact CB-CH2 3.8Å; F116-W320 HydrophobicContact CB-CZ2 4.34Å; F116-W320 AromaticContact CD1-CH2 3.46Å; F116-W320 HydrophobicContact CD1-CH2 3.46Å; F116-W320 VanDerWaalsContact CD1-CH2 3.46Å; F116-W320 AromaticContact CD1-CZ2 3.59Å; F116-W320 HydrophobicContact CD1-CZ2 3.59Å; F116-W320 HydrophobicContact CD2-CH2 4.46Å; F116-W320 HydrophobicContact CE1-CH2 4.11Å; F116-W320 HydrophobicContact CE1-CZ2 4.2Å; F116-W320 AromaticContact CG-CH2 3.67Å; F116-W320 HydrophobicContact CG-CH2 3.67Å; F116-W320 HydrophobicContact CG-CZ2 4.21Å; F116-I352 HydrophobicContact CD1-CG2 4.2Å; F116-I352 HydrophobicContact CE1-CG2 3.58Å; F116-I352 HydrophobicContact CZ-CG2 4.18Å
117	S	97	Very high	96.6	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.014	8%	0.08	C	C	.	.	H	α-helix	trans	-61.5	-42.4	177.9	-66.7	0	0	0	0	112.4	A113 L114 N121	A113-S117 WeakPolarHBondContact O-CB 3.3Å; A113-S117 PolarHBondContact O-N 2.9Å; A113-S117 PolarHBondContact O-OG 2.92Å; A113-S117 VanDerWaalsContact O-OG 3.09Å; L114-S117 PolarHBondContact O-N 2.75Å; S117-N121 VanDerWaalsContact O-CB 3.28Å; S117-N121 WeakPolarHBondContact O-CB 3.18Å; S117-N121 PolarHBondContact O-N 2.8Å; S117-N121 PolarHBondContact O-ND2 2.57Å; S117-N121 PolarHBondContact O-OD1 2.85Å
118	V	97.8	Very high	96.3	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.1	-45	175.1	173.8	0	0	0	0	110.5	L114 F116 N121 V122 W151 A154	L114-V118 HydrophobicContact CD1-CG2 3.89Å; L114-V118 HydrophobicContact CG-CG2 4.21Å; L114-V118 WeakPolarHBondContact O-CB 3.19Å; L114-V118 VanDerWaalsContact O-CG2 3.24Å; L114-V118 WeakPolarHBondContact O-CG2 3.32Å; L114-V118 PolarHBondContact O-N 3.5Å; F116-V118 PolarHBondContact O-N 3.45Å; V118-N121 PolarHBondContact O-N 2.89Å; V118-V122 HydrophobicContact CG1-CG2 4.03Å; V118-V122 WeakPolarHBondContact O-CB 3.34Å; V118-V122 WeakPolarHBondContact O-CG2 3.34Å; V118-V122 PolarHBondContact O-N 3.44Å; V118-W151 HydrophobicContact CG1-CD2 4.2Å; V118-W151 HydrophobicContact CG1-CH2 4.07Å; V118-W151 HydrophobicContact CG1-CZ2 3.56Å; V118-W151 HydrophobicContact CG2-CD2 4.11Å; V118-W151 HydrophobicContact CG2-CE3 3.97Å; V118-W151 HydrophobicContact CG2-CH2 4.36Å; V118-W151 HydrophobicContact CG2-CZ2 4.48Å; V118-W151 HydrophobicContact CG2-CZ3 4.1Å; V118-A154 HydrophobicContact CB-CB 4.39Å; V118-A154 HydrophobicContact CG2-CB 3.52Å
119	S	96	Very high	96	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-56.5	-53.3	178.5	178.1	0	0	0	0	111.5	C115 F116 N121 V122 I123	C115-S119 WeakPolarHBondContact O-CB 3.23Å; C115-S119 PolarHBondContact O-N 3.1Å; C115-S119 VanDerWaalsContact O-N 3.13Å; F116-S119 WeakPolarHBondContact O-CB 3.46Å; F116-S119 PolarHBondContact O-N 3.37Å; S119-N121 PolarHBondContact O-N 3.35Å; S119-V122 PolarHBondContact O-N 2.9Å; S119-I123 WeakPolarHBondContact O-CG1 3.4Å; S119-I123 PolarHBondContact O-N 3.49Å; S119-I123 VanDerWaalsContact O-N 3.15Å
120	S	96.2	Very high	95.5	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61.7	-45.2	-179.8	-59.8	0	0	0	0	112.2	F116 V122 I123 V124 V216 Y316	F116-S120 PolarHBondContact O-N 3.05Å; F116-S120 PolarHBondContact O-OG 3.31Å; S120-V122 PolarHBondContact O-N 3.44Å; S120-I123 PolarHBondContact O-N 3.12Å; S120-V124 WeakPolarHBondContact O-CG2 3.46Å; S120-V124 PolarHBondContact O-N 3.06Å; S120-V124 VanDerWaalsContact O-N 3.14Å; S120-V216 VanDerWaalsContact CB-O 3.27Å; S120-V216 WeakPolarHBondContact CB-O 3.36Å; S120-V216 PolarHBondContact OG-O 2.94Å; S120-Y316 PolarHBondContact OG-OH 3.09Å; S120-Y316 VanDerWaalsContact OG-OH 3.09Å
121	N	97	Very high	95	Very high	17 Å²	17	15.9 Å²	15.9	9%	0.091	8%	0.081	C	C	.	.	H	α-helix	trans	-64.9	-38.7	-180	-68.1	-10.6	0	0	0	112.2	S117 V118 S119 I123 V124 C125 A150	S117-N121 VanDerWaalsContact O-CB 3.28Å; S117-N121 WeakPolarHBondContact O-CB 3.18Å; S117-N121 PolarHBondContact O-N 2.8Å; S117-N121 PolarHBondContact O-ND2 2.57Å; S117-N121 PolarHBondContact O-OD1 2.85Å; V118-N121 PolarHBondContact O-N 2.89Å; S119-N121 PolarHBondContact O-N 3.35Å; N121-I123 VanDerWaalsContact C-N 3.35Å; N121-I123 PolarHBondContact O-N 3.35Å; N121-V124 WeakPolarHBondContact O-CB 3.31Å; N121-V124 PolarHBondContact O-N 3.4Å; N121-C125 PolarHBondContact O-N 3.42Å; N121-C125 PolarHBondContact O-SG 3.4Å; N121-A150 HydrophobicContact CB-CB 3.71Å; N121-A150 PolarHBondContact ND2-O 3.18Å
122	V	96.6	Very high	94.6	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-67.6	-35.5	178	171.9	0	0	0	0	111.6	H73 L74 V118 S119 S120 V124 C125 I126 L147	H73-V122 HydrophobicContact CB-CG1 4.22Å; H73-V122 HydrophobicContact CB-CG2 4.09Å; L74-V122 HydrophobicContact CB-CG1 3.87Å; L74-V122 HydrophobicContact CD1-CG1 4.4Å; V118-V122 HydrophobicContact CG1-CG2 4.03Å; V118-V122 WeakPolarHBondContact O-CB 3.34Å; V118-V122 WeakPolarHBondContact O-CG2 3.34Å; V118-V122 PolarHBondContact O-N 3.44Å; S119-V122 PolarHBondContact O-N 2.9Å; S120-V122 PolarHBondContact O-N 3.44Å; V122-V124 VanDerWaalsContact C-N 3.31Å; V122-V124 PolarHBondContact O-N 2.86Å; V122-C125 WeakPolarHBondContact O-CB 3.4Å; V122-C125 PolarHBondContact O-N 3.37Å; V122-I126 HydrophobicContact CG1-CD1 4.42Å; V122-I126 WeakPolarHBondContact O-CG1 3.46Å; V122-I126 PolarHBondContact O-N 3.1Å; V122-L147 HydrophobicContact CG2-CD2 4.16Å
123	I	94.3	Very high	94	Very high	4 Å²	4	20.9 Å²	20.9	2%	0.021	11%	0.107	C	C	.	.	H	α-helix	trans	-63.4	-40.5	173.5	-62.5	171.4	0	0	0	110	L74 S119 S120 N121 C125 I126 A127 L224 Y316	L74-I123 HydrophobicContact CD1-CD1 4.27Å; L74-I123 HydrophobicContact CD1-CG1 3.72Å; S119-I123 WeakPolarHBondContact O-CG1 3.4Å; S119-I123 PolarHBondContact O-N 3.49Å; S119-I123 VanDerWaalsContact O-N 3.15Å; S120-I123 PolarHBondContact O-N 3.12Å; N121-I123 VanDerWaalsContact C-N 3.35Å; N121-I123 PolarHBondContact O-N 3.35Å; I123-C125 PolarHBondContact O-N 2.95Å; I123-I126 WeakPolarHBondContact O-CB 3.48Å; I123-I126 PolarHBondContact O-N 2.82Å; I123-I126 VanDerWaalsContact O-N 3.13Å; I123-A127 PolarHBondContact O-N 3.38Å; I123-L224 HydrophobicContact CB-CD1 4.39Å; I123-L224 HydrophobicContact CG2-CD1 3.65Å; I123-L224 HydrophobicContact CG2-CD2 3.75Å; I123-L224 HydrophobicContact CG2-CG 4.36Å; I123-Y316 HydrophobicContact CD1-CD2 3.73Å; I123-Y316 HydrophobicContact CD1-CE2 4.31Å; I123-Y316 HydrophobicContact CD1-CG 4.29Å
124	V	94.9	Very high	93.3	Very high	19 Å²	19	23.2 Å²	23.2	12%	0.115	12%	0.121	C	C	.	.	H	α-helix	trans	-60.3	-44.7	172.8	175.3	0	0	0	0	111.1	S120 N121 V122 I126 A127 I128 P220 L223 L224	S120-V124 WeakPolarHBondContact O-CG2 3.46Å; S120-V124 PolarHBondContact O-N 3.06Å; S120-V124 VanDerWaalsContact O-N 3.14Å; N121-V124 WeakPolarHBondContact O-CB 3.31Å; N121-V124 PolarHBondContact O-N 3.4Å; V122-V124 VanDerWaalsContact C-N 3.31Å; V122-V124 PolarHBondContact O-N 2.86Å; V124-I126 VanDerWaalsContact C-N 3.27Å; V124-I126 PolarHBondContact O-N 3.43Å; V124-A127 PolarHBondContact O-N 3.17Å; V124-A127 VanDerWaalsContact O-N 3.11Å; V124-I128 HydrophobicContact CG1-CD1 3.83Å; V124-I128 HydrophobicContact CG1-CG1 4.34Å; V124-I128 WeakPolarHBondContact O-CG1 3.38Å; V124-I128 PolarHBondContact O-N 3.14Å; V124-P220 HydrophobicContact CG2-CB 3.98Å; V124-L223 HydrophobicContact CG1-CD1 4.43Å; V124-L224 HydrophobicContact CB-CD2 4.49Å; V124-L224 HydrophobicContact CG2-CD2 4.09Å; V124-L224 HydrophobicContact CG2-CG 3.97Å
125	C	95.1	Very high	92.6	Very high	7 Å²	7	27.6 Å²	27.6	5%	0.047	14%	0.139	C	C	.	.	H	α-helix	trans	-58.1	-38	174.2	-64.6	0	0	0	0	112.6	L70 N121 V122 I123 H129 S146	L70-C125 HydrophobicContact CD2-CB 3.54Å; N121-C125 PolarHBondContact O-N 3.42Å; N121-C125 PolarHBondContact O-SG 3.4Å; V122-C125 WeakPolarHBondContact O-CB 3.4Å; V122-C125 PolarHBondContact O-N 3.37Å; I123-C125 PolarHBondContact O-N 2.95Å; C125-H129 VanDerWaalsContact O-CB 3.25Å; C125-H129 WeakPolarHBondContact O-CB 3.35Å; C125-H129 PolarHBondContact O-N 3.03Å; C125-S146 PolarHBondContact SG-OG 3.38Å
126	I	93	Very high	91.5	Very high	7 Å²	7	29.9 Å²	29.9	4%	0.036	16%	0.163	C	C	.	.	H	α-helix	trans	-63.1	-45	175.5	-69.5	165.8	0	0	0	110.7	L70 L74 V122 I123 V124 H129 R130 L312	L70-I126 HydrophobicContact CB-CD1 4.47Å; L70-I126 HydrophobicContact CB-CG1 3.76Å; L70-I126 HydrophobicContact CD1-CG1 4.35Å; L70-I126 HydrophobicContact CD2-CG1 4.32Å; L70-I126 HydrophobicContact CG-CG1 4.37Å; L74-I126 HydrophobicContact CB-CD1 4.44Å; L74-I126 HydrophobicContact CD2-CD1 3.89Å; V122-I126 HydrophobicContact CG1-CD1 4.42Å; V122-I126 WeakPolarHBondContact O-CG1 3.46Å; V122-I126 PolarHBondContact O-N 3.1Å; I123-I126 WeakPolarHBondContact O-CB 3.48Å; I123-I126 PolarHBondContact O-N 2.82Å; I123-I126 VanDerWaalsContact O-N 3.13Å; V124-I126 VanDerWaalsContact C-N 3.27Å; V124-I126 PolarHBondContact O-N 3.43Å; I126-H129 PolarHBondContact O-N 3.01Å; I126-R130 WeakPolarHBondContact O-CG 3.29Å; I126-R130 PolarHBondContact O-N 3.34Å; I126-R130 VanDerWaalsContact O-N 3.09Å; I126-L312 HydrophobicContact CG2-CD1 4.45Å
127	A	91	Very high	90.5	Very high	6 Å²	6	37.9 Å²	37.9	5%	0.05	20%	0.198	C	C	.	.	H	α-helix	trans	-62.6	-48.8	178	0	0	0	0	0	111.7	I123 V124 H129 R130 F131 L224 C227	I123-A127 PolarHBondContact O-N 3.38Å; V124-A127 PolarHBondContact O-N 3.17Å; V124-A127 VanDerWaalsContact O-N 3.11Å; A127-H129 VanDerWaalsContact C-N 3.34Å; A127-H129 PolarHBondContact O-N 2.86Å; A127-R130 WeakPolarHBondContact O-CB 3.43Å; A127-R130 PolarHBondContact O-N 3.42Å; A127-F131 PolarHBondContact O-N 3.3Å; A127-L224 HydrophobicContact CB-CD2 3.61Å; A127-C227 HydrophobicContact CB-CB 4.35Å
128	I	90.7	Very high	89.5	Confident	75 Å²	75	38.9 Å²	38.9	39%	0.385	20%	0.204	S	C	.	.	H	α-helix	trans	-57.8	-47.3	176.5	-66.8	170.5	0	0	0	110.5	V124 R130 F131 S132	V124-I128 HydrophobicContact CG1-CD1 3.83Å; V124-I128 HydrophobicContact CG1-CG1 4.34Å; V124-I128 WeakPolarHBondContact O-CG1 3.38Å; V124-I128 PolarHBondContact O-N 3.14Å; I128-R130 VanDerWaalsContact C-N 3.25Å; I128-R130 PolarHBondContact O-N 3.41Å; I128-F131 WeakPolarHBondContact O-CB 3.32Å; I128-F131 PolarHBondContact O-N 3.45Å; I128-F131 VanDerWaalsContact O-N 3.13Å; I128-S132 PolarHBondContact O-N 3.41Å; I128-S132 PolarHBondContact O-OG 2.89Å; I128-S132 VanDerWaalsContact O-OG 3.07Å
129	H	91.8	Very high	88.9	Confident	11 Å²	11	41.5 Å²	41.5	5%	0.051	22%	0.221	C	C	.	.	H	α-helix	trans	-56.1	-40.2	177	167.8	-80.8	0	0	0	112.1	L70 C125 I126 A127 M133 S138	L70-H129 HydrophobicContact CD1-CB 3.52Å; C125-H129 VanDerWaalsContact O-CB 3.25Å; C125-H129 WeakPolarHBondContact O-CB 3.35Å; C125-H129 PolarHBondContact O-N 3.03Å; I126-H129 PolarHBondContact O-N 3.01Å; A127-H129 VanDerWaalsContact C-N 3.34Å; A127-H129 PolarHBondContact O-N 2.86Å; H129-M133 VanDerWaalsContact O-CG 3.24Å; H129-M133 WeakPolarHBondContact O-CG 3.01Å; H129-M133 PolarHBondContact O-N 3.37Å; H129-S138 PolarHBondContact CD2-OG 3Å; H129-S138 PolarHBondContact NE2-OG 2.69Å; H129-S138 VanDerWaalsContact NE2-OG 3.13Å
130	R	89.3	Confident	88.6	Confident	33 Å²	33	47 Å²	47	13%	0.125	24%	0.244	C	C	.	.	H	α-helix	trans	-67.6	-43.1	176.5	-67.2	-52.4	-176.3	-178	3.9	112.7	L67 I126 A127 I128 S132 M133 V134 L231 C309	L67-R130 VanDerWaalsContact CD1-NH2 3.26Å; I126-R130 WeakPolarHBondContact O-CG 3.29Å; I126-R130 PolarHBondContact O-N 3.34Å; I126-R130 VanDerWaalsContact O-N 3.09Å; A127-R130 WeakPolarHBondContact O-CB 3.43Å; A127-R130 PolarHBondContact O-N 3.42Å; I128-R130 VanDerWaalsContact C-N 3.25Å; I128-R130 PolarHBondContact O-N 3.41Å; R130-S132 VanDerWaalsContact C-N 3.34Å; R130-M133 WeakPolarHBondContact O-CB 3.19Å; R130-M133 PolarHBondContact O-N 3.24Å; R130-V134 PolarHBondContact O-N 3.41Å; R130-L231 HydrophobicContact CB-CD2 3.51Å; R130-L231 HydrophobicContact CG-CD2 4.4Å; R130-C309 WeakPolarHBondContact CG-SG 3.29Å
131	F	87.4	Confident	88.4	Confident	71 Å²	71	56.4 Å²	56.4	31%	0.311	28%	0.28	S	S	.	.	H	α-helix	trans	-58.5	-47.8	174.2	-171.7	-89	0	0	0	110.7	A127 I128 M133 V134 F135 R230	A127-F131 PolarHBondContact O-N 3.3Å; I128-F131 WeakPolarHBondContact O-CB 3.32Å; I128-F131 PolarHBondContact O-N 3.45Å; I128-F131 VanDerWaalsContact O-N 3.13Å; F131-M133 VanDerWaalsContact C-N 3.28Å; F131-M133 PolarHBondContact O-N 3.43Å; F131-V134 PolarHBondContact O-N 2.99Å; F131-F135 AromaticContact CD1-CD2 3.79Å; F131-F135 HydrophobicContact CD1-CD2 3.79Å; F131-F135 HydrophobicContact CD1-CE2 4.36Å; F131-F135 AromaticContact CD2-CD2 3.9Å; F131-F135 HydrophobicContact CD2-CD2 3.9Å; F131-F135 AromaticContact CD2-CE2 3.65Å; F131-F135 HydrophobicContact CD2-CE2 3.65Å; F131-F135 HydrophobicContact CE1-CB 4.49Å; F131-F135 AromaticContact CE1-CD2 3.51Å; F131-F135 HydrophobicContact CE1-CD2 3.51Å; F131-F135 AromaticContact CE1-CE2 3.99Å; F131-F135 HydrophobicContact CE1-CE2 3.99Å; F131-F135 HydrophobicContact CE1-CG 4.18Å; F131-F135 AromaticContact CE2-CD2 3.64Å; F131-F135 HydrophobicContact CE2-CD2 3.64Å; F131-F135 AromaticContact CE2-CE2 3.21Å; F131-F135 HydrophobicContact CE2-CE2 3.21Å; F131-F135 HydrophobicContact CE2-CZ 4.07Å; F131-F135 AromaticContact CG-CD2 3.97Å; F131-F135 HydrophobicContact CG-CD2 3.97Å; F131-F135 HydrophobicContact CG-CE2 4.2Å; F131-F135 AromaticContact CZ-CD2 3.42Å; F131-F135 HydrophobicContact CZ-CD2 3.42Å; F131-F135 VanDerWaalsContact CZ-CD2 3.42Å; F131-F135 AromaticContact CZ-CE2 3.39Å; F131-F135 HydrophobicContact CZ-CE2 3.39Å; F131-F135 HydrophobicContact CZ-CG 4.23Å; F131-F135 HydrophobicContact CZ-CZ 4.14Å; F131-F135 WeakPolarHBondContact O-CD2 3.48Å; F131-F135 PolarHBondContact O-N 3.34Å; F131-F135 VanDerWaalsContact O-N 3.13Å; F131-R230 HydrophobicContact CE2-CB 4.06Å
132	S	89.1	Confident	88.1	Confident	33 Å²	33	59.7 Å²	59.7	23%	0.231	30%	0.296	C	S	.	.	H	α-helix	trans	-64.2	-26.7	177.6	-56.9	0	0	0	0	114.3	I128 R130 V134 G136	I128-S132 PolarHBondContact O-N 3.41Å; I128-S132 PolarHBondContact O-OG 2.89Å; I128-S132 VanDerWaalsContact O-OG 3.07Å; R130-S132 VanDerWaalsContact C-N 3.34Å; S132-V134 VanDerWaalsContact C-N 3.27Å; S132-G136 CarbonylContact O-C 3.5Å; S132-G136 WeakPolarHBondContact O-CA 3.31Å; S132-G136 PolarHBondContact O-N 2.88Å; S132-G136 VanDerWaalsContact O-N 3.1Å
133	M	85.8	Confident	88	Confident	109 Å²	109	59.9 Å²	59.9	54%	0.537	30%	0.298	S	S	.	.	H	α-helix	trans	-70.4	-22.2	174	-77	-74.9	-54.1	0	0	113	H129 R130 F131 S138	H129-M133 VanDerWaalsContact O-CG 3.24Å; H129-M133 WeakPolarHBondContact O-CG 3.01Å; H129-M133 PolarHBondContact O-N 3.37Å; R130-M133 WeakPolarHBondContact O-CB 3.19Å; R130-M133 PolarHBondContact O-N 3.24Å; F131-M133 VanDerWaalsContact C-N 3.28Å; F131-M133 PolarHBondContact O-N 3.43Å; M133-S138 VanDerWaalsContact SD-CB 3.56Å
134	V	83.1	Confident	88.1	Confident	54 Å²	54	61.7 Å²	61.7	33%	0.327	31%	0.309	S	S	.	.	H	α-helix	trans	-92	-46.3	179.2	175.6	0	0	0	0	110.9	R130 F131 S132 L231 V234 V235	R130-V134 PolarHBondContact O-N 3.41Å; F131-V134 PolarHBondContact O-N 2.99Å; S132-V134 VanDerWaalsContact C-N 3.27Å; V134-L231 HydrophobicContact CB-CD1 4.32Å; V134-L231 HydrophobicContact CG2-CD1 3.54Å; V134-V234 HydrophobicContact CG1-CG1 3.85Å; V134-V235 HydrophobicContact CG1-CG2 4.32Å; V134-V235 HydrophobicContact CG2-CG2 3.76Å
135	F	82.9	Confident	88.1	Confident	113 Å²	113	65.2 Å²	65.2	50%	0.496	33%	0.326	S	S	.	.	H	α-helix	trans	-94.9	-10.4	-172.1	-66.2	-77.7	0	0	0	115.1	F131 V234	F131-F135 AromaticContact CD1-CD2 3.79Å; F131-F135 HydrophobicContact CD1-CD2 3.79Å; F131-F135 HydrophobicContact CD1-CE2 4.36Å; F131-F135 AromaticContact CD2-CD2 3.9Å; F131-F135 HydrophobicContact CD2-CD2 3.9Å; F131-F135 AromaticContact CD2-CE2 3.65Å; F131-F135 HydrophobicContact CD2-CE2 3.65Å; F131-F135 HydrophobicContact CE1-CB 4.49Å; F131-F135 AromaticContact CE1-CD2 3.51Å; F131-F135 HydrophobicContact CE1-CD2 3.51Å; F131-F135 AromaticContact CE1-CE2 3.99Å; F131-F135 HydrophobicContact CE1-CE2 3.99Å; F131-F135 HydrophobicContact CE1-CG 4.18Å; F131-F135 AromaticContact CE2-CD2 3.64Å; F131-F135 HydrophobicContact CE2-CD2 3.64Å; F131-F135 AromaticContact CE2-CE2 3.21Å; F131-F135 HydrophobicContact CE2-CE2 3.21Å; F131-F135 HydrophobicContact CE2-CZ 4.07Å; F131-F135 AromaticContact CG-CD2 3.97Å; F131-F135 HydrophobicContact CG-CD2 3.97Å; F131-F135 HydrophobicContact CG-CE2 4.2Å; F131-F135 AromaticContact CZ-CD2 3.42Å; F131-F135 HydrophobicContact CZ-CD2 3.42Å; F131-F135 VanDerWaalsContact CZ-CD2 3.42Å; F131-F135 AromaticContact CZ-CE2 3.39Å; F131-F135 HydrophobicContact CZ-CE2 3.39Å; F131-F135 HydrophobicContact CZ-CG 4.23Å; F131-F135 HydrophobicContact CZ-CZ 4.14Å; F131-F135 WeakPolarHBondContact O-CD2 3.48Å; F131-F135 PolarHBondContact O-N 3.34Å; F131-F135 VanDerWaalsContact O-N 3.13Å; F135-V234 HydrophobicContact CE1-CG1 4.14Å; F135-V234 HydrophobicContact CE1-CG2 4.23Å; F135-V234 HydrophobicContact CE2-CG2 4.45Å; F135-V234 HydrophobicContact CZ-CB 3.96Å; F135-V234 HydrophobicContact CZ-CG1 3.78Å; F135-V234 HydrophobicContact CZ-CG2 3.51Å
136	G	75.9	Confident	88.2	Confident	49 Å²	49	66.2 Å²	66.2	51%	0.505	33%	0.334	S	S	.	.	S	Bend	trans	-162.3	-152.6	-173.1	0	0	0	0	0	113.7	S132	S132-G136 CarbonylContact O-C 3.5Å; S132-G136 WeakPolarHBondContact O-CA 3.31Å; S132-G136 PolarHBondContact O-N 2.88Å; S132-G136 VanDerWaalsContact O-N 3.1Å
137	K	74.8	Confident	88.4	Confident	186 Å²	186	66.1 Å²	66.1	81%	0.809	33%	0.333	S	S	*	.			trans	-103.9	93.3	178.6	-66.2	-179.5	-178.2	175.6	0	109.4	T139 I142	K137-T139 HydrophobicContact CB-CG2 4.4Å; K137-T139 PolarHBondContact O-N 2.75Å; K137-I142 WeakPolarHBondContact O-CD1 3.32Å
138	S	77.3	Confident	88.7	Confident	22 Å²	22	74.3 Å²	74.3	15%	0.154	36%	0.363	C	S	.	.			trans	-67.7	115.5	163.8	178.5	0	0	0	0	109.4	H129 M133	H129-S138 PolarHBondContact CD2-OG 3Å; H129-S138 PolarHBondContact NE2-OG 2.69Å; H129-S138 VanDerWaalsContact NE2-OG 3.13Å; M133-S138 VanDerWaalsContact SD-CB 3.56Å
139	T	85	Confident	89.1	Confident	56 Å²	56	75 Å²	75	34%	0.344	37%	0.37	S	S	.	.			trans	-115.4	159.6	178.2	66.9	0	0	0	0	111.1	K137 R141 I142 T143	K137-T139 HydrophobicContact CB-CG2 4.4Å; K137-T139 PolarHBondContact O-N 2.75Å; T139-R141 PolarHBondContact O-N 3.08Å; T139-I142 PolarHBondContact O-N 2.91Å; T139-I142 WeakPolarHBondContact OG1-CG1 3.26Å; T139-I142 PolarHBondContact OG1-N 3.25Å; T139-T143 PolarHBondContact O-N 3.22Å; T139-T143 PolarHBondContact O-OG1 3.22Å; T139-T143 VanDerWaalsContact O-OG1 3.07Å
140	K	88.8	Confident	89.4	Confident	114 Å²	114	74.8 Å²	74.8	50%	0.496	37%	0.37	S	S	.	.	H	α-helix	trans	-56.8	-35.6	171.8	-173.1	-178.8	175.3	-173.2	0	111.7	P66 T144	P66-K140 HydrophobicContact CG-CB 4.28Å; K140-T144 WeakPolarHBondContact O-CB 3.21Å; K140-T144 PolarHBondContact O-N 3.15Å; K140-T144 PolarHBondContact O-OG1 3.32Å
141	R	91.7	Very high	89.8	Confident	198 Å²	198	76.2 Å²	76.2	75%	0.747	38%	0.376	S	S	*	.	H	α-helix	trans	-63.3	-53.6	177.2	-175.8	177.9	179.3	179.9	0.1	111.4	T139 T143 T144 I145	T139-R141 PolarHBondContact O-N 3.08Å; R141-T143 VanDerWaalsContact C-N 3.31Å; R141-T143 PolarHBondContact O-N 3.49Å; R141-T144 PolarHBondContact O-N 3.06Å; R141-T144 VanDerWaalsContact O-N 3.14Å; R141-I145 HydrophobicContact CG-CD1 4.08Å; R141-I145 WeakPolarHBondContact O-CG1 3.13Å; R141-I145 PolarHBondContact O-N 3.14Å
142	I	92.3	Very high	90.3	Very high	86 Å²	86	77.2 Å²	77.2	44%	0.441	39%	0.388	S	S	.	.	H	α-helix	trans	-60.2	-43.1	179.7	-67.2	166.6	0	0	0	110.9	K137 T139 T144 I145 S146	K137-I142 WeakPolarHBondContact O-CD1 3.32Å; T139-I142 PolarHBondContact O-N 2.91Å; T139-I142 WeakPolarHBondContact OG1-CG1 3.26Å; T139-I142 PolarHBondContact OG1-N 3.25Å; I142-T144 VanDerWaalsContact C-N 3.31Å; I142-T144 PolarHBondContact O-N 3.4Å; I142-I145 PolarHBondContact O-N 3.42Å; I142-S146 WeakPolarHBondContact O-CB 3.31Å; I142-S146 PolarHBondContact O-N 3.49Å
143	T	94.4	Very high	90.8	Very high	5 Å²	5	79.9 Å²	79.9	3%	0.031	40%	0.399	C	S	.	.	H	α-helix	trans	-62.8	-39.2	177.6	-60.3	0	0	0	0	112.1	P66 L70 T139 R141 S146 L147	P66-T143 HydrophobicContact CB-CG2 3.97Å; P66-T143 WeakPolarHBondContact CB-OG1 3.29Å; L70-T143 HydrophobicContact CD1-CG2 3.85Å; L70-T143 HydrophobicContact CD2-CG2 3.93Å; L70-T143 HydrophobicContact CG-CG2 3.63Å; T139-T143 PolarHBondContact O-N 3.22Å; T139-T143 PolarHBondContact O-OG1 3.22Å; T139-T143 VanDerWaalsContact O-OG1 3.07Å; R141-T143 VanDerWaalsContact C-N 3.31Å; R141-T143 PolarHBondContact O-N 3.49Å; T143-S146 PolarHBondContact O-N 3.47Å; T143-L147 HydrophobicContact CG2-CD1 4.32Å; T143-L147 WeakPolarHBondContact O-CG 3.49Å; T143-L147 PolarHBondContact O-N 3.11Å
144	T	95.7	Very high	91.4	Very high	42 Å²	42	74.7 Å²	74.7	26%	0.258	37%	0.373	S	S	.	.	H	α-helix	trans	-67.4	-41.9	177.3	-59	0	0	0	0	111.4	Q69 K140 R141 I142 L147 W148	Q69-T144 PolarHBondContact NE2-OG1 3.43Å; K140-T144 WeakPolarHBondContact O-CB 3.21Å; K140-T144 PolarHBondContact O-N 3.15Å; K140-T144 PolarHBondContact O-OG1 3.32Å; R141-T144 PolarHBondContact O-N 3.06Å; R141-T144 VanDerWaalsContact O-N 3.14Å; I142-T144 VanDerWaalsContact C-N 3.31Å; I142-T144 PolarHBondContact O-N 3.4Å; T144-L147 PolarHBondContact O-N 2.93Å; T144-W148 PolarHBondContact O-N 3.33Å
145	I	95.8	Very high	92.1	Very high	92 Å²	92	74.8 Å²	74.8	47%	0.472	37%	0.374	S	S	.	.	H	α-helix	trans	-62.1	-47.1	174.9	-66.3	166.7	0	0	0	110.6	R141 I142 L147 W148 V149	R141-I145 HydrophobicContact CG-CD1 4.08Å; R141-I145 WeakPolarHBondContact O-CG1 3.13Å; R141-I145 PolarHBondContact O-N 3.14Å; I142-I145 PolarHBondContact O-N 3.42Å; I145-L147 VanDerWaalsContact C-N 3.26Å; I145-L147 PolarHBondContact O-N 3.49Å; I145-W148 PolarHBondContact O-N 2.84Å; I145-W148 VanDerWaalsContact O-N 3.1Å; I145-V149 WeakPolarHBondContact O-CG2 3.26Å; I145-V149 PolarHBondContact O-N 3.05Å
146	S	95.9	Very high	92.8	Very high	29 Å²	29	71.9 Å²	71.9	20%	0.203	37%	0.371	C	S	.	.	H	α-helix	trans	-58.2	-39.1	178	-177.5	0	0	0	0	112.1	C125 I142 T143 V149 A150	C125-S146 PolarHBondContact SG-OG 3.38Å; I142-S146 WeakPolarHBondContact O-CB 3.31Å; I142-S146 PolarHBondContact O-N 3.49Å; T143-S146 PolarHBondContact O-N 3.47Å; S146-V149 PolarHBondContact O-N 3.34Å; S146-A150 WeakPolarHBondContact O-CB 3.29Å; S146-A150 PolarHBondContact O-N 2.86Å
147	L	97.9	Very high	93.8	Very high	5 Å²	5	70.4 Å²	70.4	3%	0.026	35%	0.352	C	S	.	.	H	α-helix	trans	-66	-42.3	174.3	-78.2	166.8	0	0	0	112.6	Q69 L70 H73 V122 T143 T144 I145 V149 A150 W151	Q69-L147 HydrophobicContact CG-CD1 3.72Å; L70-L147 HydrophobicContact CD2-CD1 4.38Å; L70-L147 HydrophobicContact CD2-CD2 4.07Å; L70-L147 HydrophobicContact CD2-CG 4.16Å; H73-L147 HydrophobicContact CB-CD2 3.81Å; V122-L147 HydrophobicContact CG2-CD2 4.16Å; T143-L147 HydrophobicContact CG2-CD1 4.32Å; T143-L147 WeakPolarHBondContact O-CG 3.49Å; T143-L147 PolarHBondContact O-N 3.11Å; T144-L147 PolarHBondContact O-N 2.93Å; I145-L147 VanDerWaalsContact C-N 3.26Å; I145-L147 PolarHBondContact O-N 3.49Å; L147-V149 VanDerWaalsContact C-N 3.34Å; L147-V149 PolarHBondContact O-N 3.43Å; L147-A150 PolarHBondContact O-N 2.8Å; L147-W151 PolarHBondContact O-N 3.03Å
148	W	97.9	Very high	94.9	Very high	178 Å²	178	61.6 Å²	61.6	67%	0.674	31%	0.314	S	S	*	.	H	α-helix	trans	-60	-45.4	174.6	-79.1	116	0	0	0	111.8	T144 I145 A150 W151 T152	T144-W148 PolarHBondContact O-N 3.33Å; I145-W148 PolarHBondContact O-N 2.84Å; I145-W148 VanDerWaalsContact O-N 3.1Å; W148-A150 VanDerWaalsContact C-N 3.33Å; W148-A150 PolarHBondContact O-N 3.47Å; W148-W151 PolarHBondContact O-N 3.47Å; W148-T152 WeakPolarHBondContact O-CB 3.5Å; W148-T152 PolarHBondContact O-N 2.93Å; W148-T152 PolarHBondContact O-OG1 3.37Å
149	V	98	Very high	95.9	Very high	89 Å²	89	64.9 Å²	64.9	54%	0.539	33%	0.329	S	S	.	.	H	α-helix	trans	-58.3	-46.2	175	173.8	0	0	0	0	111.1	I145 S146 L147 W151 T152 L153	I145-V149 WeakPolarHBondContact O-CG2 3.26Å; I145-V149 PolarHBondContact O-N 3.05Å; S146-V149 PolarHBondContact O-N 3.34Å; L147-V149 VanDerWaalsContact C-N 3.34Å; L147-V149 PolarHBondContact O-N 3.43Å; V149-W151 PolarHBondContact O-N 3.36Å; V149-T152 PolarHBondContact O-N 3.33Å; V149-L153 VanDerWaalsContact O-CB 3.24Å; V149-L153 WeakPolarHBondContact O-CB 3.44Å; V149-L153 PolarHBondContact O-N 2.81Å
150	A	98	Very high	96.5	Very high	6 Å²	6	64.3 Å²	64.3	5%	0.05	33%	0.327	C	S	.	.	H	α-helix	trans	-59.6	-42.4	179	0	0	0	0	0	113.3	N121 S146 L147 W148 A154	N121-A150 HydrophobicContact CB-CB 3.71Å; N121-A150 PolarHBondContact ND2-O 3.18Å; S146-A150 WeakPolarHBondContact O-CB 3.29Å; S146-A150 PolarHBondContact O-N 2.86Å; L147-A150 PolarHBondContact O-N 2.8Å; W148-A150 VanDerWaalsContact C-N 3.33Å; W148-A150 PolarHBondContact O-N 3.47Å; A150-A154 WeakPolarHBondContact O-CB 3.23Å; A150-A154 PolarHBondContact O-N 3.01Å
151	W	98.5	Very high	96.9	Very high	63 Å²	63	59.2 Å²	59.2	24%	0.239	31%	0.305	C	S	.	.	H	α-helix	trans	-72.1	-44.4	178.3	-82.8	74.7	0	0	0	112	H73 I76 M80 V118 L147 W148 V149 L153 A154 V155	H73-W151 AromaticContact ND1-CE2 3.86Å; H73-W151 AromaticContact ND1-NE1 3.31Å; H73-W151 PolarHBondContact ND1-NE1 2.97Å; I76-W151 HydrophobicContact CG2-CH2 4.24Å; I76-W151 HydrophobicContact CG2-CZ2 4.28Å; M80-W151 HydrophobicContact SD-CH2 3.96Å; V118-W151 HydrophobicContact CG1-CD2 4.2Å; V118-W151 HydrophobicContact CG1-CH2 4.07Å; V118-W151 HydrophobicContact CG1-CZ2 3.56Å; V118-W151 HydrophobicContact CG2-CD2 4.11Å; V118-W151 HydrophobicContact CG2-CE3 3.97Å; V118-W151 HydrophobicContact CG2-CH2 4.36Å; V118-W151 HydrophobicContact CG2-CZ2 4.48Å; V118-W151 HydrophobicContact CG2-CZ3 4.1Å; L147-W151 PolarHBondContact O-N 3.03Å; W148-W151 PolarHBondContact O-N 3.47Å; V149-W151 PolarHBondContact O-N 3.36Å; W151-L153 VanDerWaalsContact C-N 3.33Å; W151-L153 PolarHBondContact O-N 3.29Å; W151-A154 PolarHBondContact O-N 3.34Å; W151-V155 WeakPolarHBondContact O-CG2 3.22Å; W151-V155 PolarHBondContact O-N 3.34Å
152	T	98.5	Very high	97.2	Very high	93 Å²	93	53.6 Å²	53.6	57%	0.571	29%	0.286	S	S	*	.	H	α-helix	trans	-60.9	-43.4	176.3	-58.9	0	0	0	0	111.2	W148 V149 A154 V155 A156	W148-T152 WeakPolarHBondContact O-CB 3.5Å; W148-T152 PolarHBondContact O-N 2.93Å; W148-T152 PolarHBondContact O-OG1 3.37Å; V149-T152 PolarHBondContact O-N 3.33Å; T152-A154 VanDerWaalsContact C-N 3.35Å; T152-A154 PolarHBondContact O-N 2.95Å; T152-V155 PolarHBondContact O-N 3.08Å; T152-A156 WeakPolarHBondContact O-CB 3.08Å; T152-A156 PolarHBondContact O-N 3.38Å
153	L	97.8	Very high	97.4	Very high	88 Å²	88	53 Å²	53	46%	0.461	29%	0.294	S	S	.	.	H	α-helix	trans	-63	-41.3	175.6	-178.4	62.5	0	0	0	111.6	V149 W151 A156 T157	V149-L153 VanDerWaalsContact O-CB 3.24Å; V149-L153 WeakPolarHBondContact O-CB 3.44Å; V149-L153 PolarHBondContact O-N 2.81Å; W151-L153 VanDerWaalsContact C-N 3.33Å; W151-L153 PolarHBondContact O-N 3.29Å; L153-A156 PolarHBondContact O-N 2.89Å; L153-T157 HydrophobicContact CD1-CG2 3.96Å; L153-T157 HydrophobicContact CG-CG2 4.38Å; L153-T157 WeakPolarHBondContact O-CB 3.5Å; L153-T157 VanDerWaalsContact O-CG2 3.32Å; L153-T157 WeakPolarHBondContact O-CG2 3.09Å; L153-T157 PolarHBondContact O-N 3.49Å; L153-T157 PolarHBondContact O-OG1 2.82Å
154	A	98.3	Very high	97.5	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.2	-40.8	177.3	0	0	0	0	0	112.2	L114 V118 A150 W151 T152 T157 S158	L114-A154 HydrophobicContact CD1-CB 4.03Å; V118-A154 HydrophobicContact CB-CB 4.39Å; V118-A154 HydrophobicContact CG2-CB 3.52Å; A150-A154 WeakPolarHBondContact O-CB 3.23Å; A150-A154 PolarHBondContact O-N 3.01Å; W151-A154 PolarHBondContact O-N 3.34Å; T152-A154 VanDerWaalsContact C-N 3.35Å; T152-A154 PolarHBondContact O-N 2.95Å; A154-T157 PolarHBondContact O-OG1 2.86Å; A154-S158 VanDerWaalsContact O-CB 3.25Å; A154-S158 WeakPolarHBondContact O-CB 2.99Å; A154-S158 PolarHBondContact O-N 3.13Å; A154-S158 VanDerWaalsContact O-N 3.13Å; A154-S158 PolarHBondContact O-OG 3.25Å
155	V	98.5	Very high	97.6	Very high	56 Å²	56	54 Å²	54	34%	0.339	29%	0.293	S	S	.	.	H	α-helix	trans	-63.9	-52.4	174	172.2	0	0	0	0	110.3	F110 L114 W151 T152 T157 S158 L159	F110-V155 HydrophobicContact CZ-CG1 4.5Å; L114-V155 HydrophobicContact CD1-CG2 3.73Å; W151-V155 WeakPolarHBondContact O-CG2 3.22Å; W151-V155 PolarHBondContact O-N 3.34Å; T152-V155 PolarHBondContact O-N 3.08Å; V155-T157 VanDerWaalsContact C-N 3.33Å; V155-T157 PolarHBondContact O-N 2.86Å; V155-S158 CarbonylContact O-C 3.16Å; V155-S158 PolarHBondContact O-N 3.31Å; V155-L159 WeakPolarHBondContact O-CG 3.34Å; V155-L159 PolarHBondContact O-N 2.9Å
156	A	98.2	Very high	97.6	Very high	53 Å²	53	51.3 Å²	51.3	44%	0.438	28%	0.281	S	S	.	.	H	α-helix	trans	-57.3	-44.9	-177.3	0	0	0	0	0	112.4	T152 L153 S158 L159	T152-A156 WeakPolarHBondContact O-CB 3.08Å; T152-A156 PolarHBondContact O-N 3.38Å; L153-A156 PolarHBondContact O-N 2.89Å; A156-S158 VanDerWaalsContact C-N 3.27Å; A156-S158 PolarHBondContact O-N 3.06Å; A156-L159 PolarHBondContact O-N 3.37Å
157	T	96.9	Very high	97.7	Very high	18 Å²	18	51.3 Å²	51.3	11%	0.11	28%	0.28	C	S	.	.	H	α-helix	trans	-71.3	-20	177.3	53	0	0	0	0	113.7	L153 A154 V155 Y211 I215	L153-T157 HydrophobicContact CD1-CG2 3.96Å; L153-T157 HydrophobicContact CG-CG2 4.38Å; L153-T157 WeakPolarHBondContact O-CB 3.5Å; L153-T157 VanDerWaalsContact O-CG2 3.32Å; L153-T157 WeakPolarHBondContact O-CG2 3.09Å; L153-T157 PolarHBondContact O-N 3.49Å; L153-T157 PolarHBondContact O-OG1 2.82Å; A154-T157 PolarHBondContact O-OG1 2.86Å; V155-T157 VanDerWaalsContact C-N 3.33Å; V155-T157 PolarHBondContact O-N 2.86Å; T157-Y211 PolarHBondContact O-OH 3.49Å; T157-I215 HydrophobicContact CG2-CD1 4.23Å; T157-I215 HydrophobicContact CG2-CG2 4.38Å
158	S	97.9	Very high	97.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-90.5	-18.6	176.4	-55.4	0	0	0	0	113.2	F110 L114 A154 V155 A156 P160 Q161	F110-S158 WeakPolarHBondContact CD2-O 3.3Å; L114-S158 WeakPolarHBondContact CA-OG 3.5Å; L114-S158 PolarHBondContact N-OG 3.23Å; L114-S158 VanDerWaalsContact N-OG 3.15Å; A154-S158 VanDerWaalsContact O-CB 3.25Å; A154-S158 WeakPolarHBondContact O-CB 2.99Å; A154-S158 PolarHBondContact O-N 3.13Å; A154-S158 VanDerWaalsContact O-N 3.13Å; A154-S158 PolarHBondContact O-OG 3.25Å; V155-S158 CarbonylContact O-C 3.16Å; V155-S158 PolarHBondContact O-N 3.31Å; A156-S158 VanDerWaalsContact C-N 3.27Å; A156-S158 PolarHBondContact O-N 3.06Å; S158-P160 VanDerWaalsContact C-N 3.33Å; S158-Q161 WeakPolarHBondContact O-CB 3.4Å; S158-Q161 WeakPolarHBondContact O-CG 3.48Å; S158-Q161 PolarHBondContact O-N 2.92Å; S158-Q161 VanDerWaalsContact O-N 3.07Å
159	L	97.9	Very high	97.3	Very high	92 Å²	92	50.8 Å²	50.8	48%	0.482	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-38.5	179.9	-75.6	173	0	0	0	114.9	F110 V155 A156 Q161 F162	F110-L159 HydrophobicContact CE2-CD2 4.34Å; V155-L159 WeakPolarHBondContact O-CG 3.34Å; V155-L159 PolarHBondContact O-N 2.9Å; A156-L159 PolarHBondContact O-N 3.37Å; L159-Q161 PolarHBondContact O-N 3.33Å; L159-F162 HydrophobicContact CD2-CD2 4.46Å; L159-F162 HydrophobicContact CD2-CE2 4.45Å; L159-F162 WeakPolarHBondContact O-CD2 3.48Å; L159-F162 PolarHBondContact O-N 2.95Å; L159-F162 VanDerWaalsContact O-N 3.14Å
160	P	97	Very high	96.8	Very high	44 Å²	44	47.5 Å²	47.5	29%	0.286	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-19.9	177.7	-27.9	36.9	0	0	0	114.8	S158 F162 A163 V164 Y208	S158-P160 VanDerWaalsContact C-N 3.33Å; P160-F162 PolarHBondContact O-N 3.21Å; P160-F162 VanDerWaalsContact O-N 3.16Å; P160-A163 PolarHBondContact O-N 3.04Å; P160-V164 WeakPolarHBondContact O-CG2 3.49Å; P160-V164 PolarHBondContact O-N 3.2Å; P160-V164 VanDerWaalsContact O-N 3.14Å; P160-Y208 HydrophobicContact CB-CE2 3.9Å
161	Q	97.3	Very high	96.2	Very high	7 Å²	7	50.6 Å²	50.6	3%	0.033	27%	0.269	C	S	.	.	H	α-helix	trans	-59.1	-27.4	177.5	-57.9	-42.2	-49.2	0	0	112.7	F110 A113 S158 L159 A163 W165 Y208	F110-Q161 HydrophobicContact CB-CB 4.09Å; A113-Q161 HydrophobicContact CB-CG 3.58Å; S158-Q161 WeakPolarHBondContact O-CB 3.4Å; S158-Q161 WeakPolarHBondContact O-CG 3.48Å; S158-Q161 PolarHBondContact O-N 2.92Å; S158-Q161 VanDerWaalsContact O-N 3.07Å; L159-Q161 PolarHBondContact O-N 3.33Å; Q161-A163 VanDerWaalsContact C-N 3.3Å; Q161-A163 PolarHBondContact O-N 3.05Å; Q161-W165 PolarHBondContact O-N 3.44Å; Q161-W165 VanDerWaalsContact OE1-CD1 3.29Å; Q161-Y208 VanDerWaalsContact CD-OH 3.31Å; Q161-Y208 PolarHBondContact NE2-OH 2.8Å; Q161-Y208 PolarHBondContact OE1-OH 3.26Å
162	F	98.2	Very high	95.5	Very high	80 Å²	80	56.9 Å²	56.9	35%	0.351	30%	0.301	S	S	.	.	H	α-helix	trans	-67.9	-27.4	177	-74.3	-73.9	0	0	0	113.8	K106 V107 F110 L159 P160	K106-F162 HydrophobicContact CB-CD1 3.82Å; K106-F162 HydrophobicContact CB-CE1 4.36Å; K106-F162 WeakPolarHBondContact CD-O 3.37Å; K106-F162 WeakPolarHBondContact CE-O 3.32Å; V107-F162 HydrophobicContact CG2-CE1 4Å; F110-F162 HydrophobicContact CB-CD2 4.4Å; F110-F162 HydrophobicContact CB-CE1 4.44Å; F110-F162 HydrophobicContact CB-CE2 3.87Å; F110-F162 HydrophobicContact CB-CZ 3.88Å; F110-F162 HydrophobicContact CD1-CE2 4.2Å; F110-F162 HydrophobicContact CD1-CZ 4.13Å; F110-F162 HydrophobicContact CD2-CD2 4.01Å; F110-F162 AromaticContact CD2-CE2 3.38Å; F110-F162 HydrophobicContact CD2-CE2 3.38Å; F110-F162 HydrophobicContact CD2-CZ 4.1Å; F110-F162 AromaticContact CE2-CE2 3.96Å; F110-F162 HydrophobicContact CE2-CE2 3.96Å; F110-F162 HydrophobicContact CG-CD2 4.36Å; F110-F162 AromaticContact CG-CE2 3.53Å; F110-F162 HydrophobicContact CG-CE2 3.53Å; F110-F162 AromaticContact CG-CZ 3.76Å; F110-F162 HydrophobicContact CG-CZ 3.76Å; L159-F162 HydrophobicContact CD2-CD2 4.46Å; L159-F162 HydrophobicContact CD2-CE2 4.45Å; L159-F162 WeakPolarHBondContact O-CD2 3.48Å; L159-F162 PolarHBondContact O-N 2.95Å; L159-F162 VanDerWaalsContact O-N 3.14Å; P160-F162 PolarHBondContact O-N 3.21Å; P160-F162 VanDerWaalsContact O-N 3.16Å
163	A	96.4	Very high	95	Very high	74 Å²	74	58 Å²	58	61%	0.612	31%	0.308	S	S	*	.	H	α-helix	trans	-93.7	-26.6	179.2	0	0	0	0	0	112.5	P160 Q161	P160-A163 PolarHBondContact O-N 3.04Å; Q161-A163 VanDerWaalsContact C-N 3.3Å; Q161-A163 PolarHBondContact O-N 3.05Å
164	V	96.6	Very high	94.5	Very high	9 Å²	9	54.3 Å²	54.3	6%	0.055	29%	0.29	C	S	.	.	H	α-helix	trans	-86.8	-29.4	-172	163	0	0	0	0	113.8	P160 S181 I182 W183 Y208	P160-V164 WeakPolarHBondContact O-CG2 3.49Å; P160-V164 PolarHBondContact O-N 3.2Å; P160-V164 VanDerWaalsContact O-N 3.14Å; V164-S181 CarbonylContact O-C 3.58Å; V164-S181 VanDerWaalsContact O-CA 3.25Å; V164-S181 WeakPolarHBondContact O-CA 3.24Å; V164-I182 PolarHBondContact O-N 2.91Å; V164-W183 HydrophobicContact CB-CH2 4.41Å; V164-W183 HydrophobicContact CB-CZ3 4.1Å; V164-W183 HydrophobicContact CG1-CE3 4.13Å; V164-W183 HydrophobicContact CG1-CH2 4.13Å; V164-W183 HydrophobicContact CG1-CZ3 3.37Å; V164-W183 HydrophobicContact CG2-CH2 3.55Å; V164-W183 HydrophobicContact CG2-CZ3 3.72Å; V164-Y208 HydrophobicContact CB-CE1 4.28Å; V164-Y208 HydrophobicContact CG1-CD1 4.23Å; V164-Y208 HydrophobicContact CG1-CE1 3.75Å; V164-Y208 HydrophobicContact CG2-CD1 4.43Å; V164-Y208 HydrophobicContact CG2-CD2 4.13Å; V164-Y208 HydrophobicContact CG2-CE1 3.99Å; V164-Y208 HydrophobicContact CG2-CE2 3.65Å; V164-Y208 HydrophobicContact CG2-CG 4.48Å
165	W	97.9	Very high	94.1	Very high	57 Å²	57	59.5 Å²	59.5	22%	0.216	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	141.8	-175.4	-66.3	89.4	0	0	0	112.1	K106 K109 Q161 V180	K106-W165 WeakPolarHBondContact CE-O 3.41Å; K106-W165 VanDerWaalsContact CG-O 3.26Å; K106-W165 WeakPolarHBondContact CG-O 3.24Å; K109-W165 HydrophobicContact CB-CB 4.19Å; K109-W165 HydrophobicContact CB-CD2 3.94Å; K109-W165 HydrophobicContact CB-CG 3.61Å; K109-W165 HydrophobicContact CD-CD2 3.62Å; K109-W165 HydrophobicContact CD-CE3 3.71Å; K109-W165 HydrophobicContact CD-CG 4.22Å; K109-W165 HydrophobicContact CD-CH2 4.04Å; K109-W165 HydrophobicContact CD-CZ2 3.92Å; K109-W165 HydrophobicContact CD-CZ3 3.93Å; K109-W165 VanDerWaalsContact CE-CE3 3.43Å; K109-W165 VanDerWaalsContact CE-CZ3 3.46Å; K109-W165 HydrophobicContact CG-CB 4.03Å; K109-W165 HydrophobicContact CG-CD2 3.49Å; K109-W165 VanDerWaalsContact CG-CD2 3.49Å; K109-W165 HydrophobicContact CG-CE3 3.85Å; K109-W165 HydrophobicContact CG-CG 3.55Å; Q161-W165 PolarHBondContact O-N 3.44Å; Q161-W165 VanDerWaalsContact OE1-CD1 3.29Å; W165-V180 WeakPolarHBondContact CA-O 3.48Å
166	T	97	Very high	93.8	Very high	36 Å²	36	58.9 Å²	58.9	22%	0.221	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	161.9	177.4	-167.6	0	0	0	0	111.4	D102 V180 I182	D102-T166 VanDerWaalsContact OD1-CA 3.22Å; D102-T166 WeakPolarHBondContact OD1-CA 3.48Å; D102-T166 PolarHBondContact OD1-OG1 2.92Å; T166-V180 PolarHBondContact N-O 2.98Å; T166-V180 PolarHBondContact O-N 2.72Å; T166-V180 VanDerWaalsContact O-O 3.05Å; T166-I182 HydrophobicContact CG2-CG2 4.03Å
167	V	97.5	Very high	93.7	Very high	30 Å²	30	57.9 Å²	57.9	18%	0.182	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	127.1	170.9	173.1	0	0	0	0	109.9	W98 D102 C105 Q177 Q178	W98-V167 HydrophobicContact CG-CG2 4.43Å; D102-V167 HydrophobicContact CB-CB 4.39Å; D102-V167 HydrophobicContact CB-CG2 4.3Å; D102-V167 PolarHBondContact OD1-N 3.29Å; C105-V167 HydrophobicContact CB-CG2 3.72Å; V167-Q177 HydrophobicContact CG1-CB 3.81Å; V167-Q177 HydrophobicContact CG1-CG 3.68Å; V167-Q178 CarbonylContact C-O 3.6Å; V167-Q178 WeakPolarHBondContact CA-O 3.41Å
168	Y	95	Very high	93.6	Very high	34 Å²	34	58.1 Å²	58.1	13%	0.133	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	140.8	-178.7	-178.5	-103.1	0	0	0	111.5	P170 Q177 Q178 V180 A185 Y188 D189	Y168-P170 HydrophobicContact CE1-CB 4.48Å; Y168-Q177 CarbonylContact O-C 3.58Å; Y168-Q177 WeakPolarHBondContact O-CA 3.2Å; Y168-Q177 WeakPolarHBondContact O-CB 3.44Å; Y168-Q178 PolarHBondContact N-O 2.92Å; Y168-Q178 PolarHBondContact O-N 3.39Å; Y168-V180 VanDerWaalsContact CB-CG2 3.43Å; Y168-V180 HydrophobicContact CG-CG2 4.29Å; Y168-A185 HydrophobicContact CD2-CB 3.5Å; Y168-A185 HydrophobicContact CE2-CB 4Å; Y168-A185 HydrophobicContact CG-CB 3.89Å; Y168-Y188 AromaticContact CE1-CD1 3.79Å; Y168-Y188 HydrophobicContact CE1-CD1 3.79Å; Y168-Y188 HydrophobicContact CE1-CE1 4.31Å; Y168-Y188 HydrophobicContact CE1-CG 4.19Å; Y168-Y188 AromaticContact CZ-CD1 3.87Å; Y168-Y188 WeakPolarHBondContact OH-CD1 3.3Å; Y168-D189 PolarHBondContact OH-OD1 3.43Å
169	R	92.5	Very high	93.6	Very high	137 Å²	137	58.7 Å²	58.7	52%	0.517	30%	0.303	S	S	.	.			trans	-114.2	131.5	170.7	-71.2	-177.8	-166.1	150.3	4.3	108.9	Y171 A174 Q177	R169-Y171 VanDerWaalsContact C-N 3.28Å; R169-Y171 PolarHBondContact O-N 3.49Å; R169-A174 HydrophobicContact CB-CB 4.44Å; R169-Q177 HydrophobicContact CG-CB 3.65Å
170	P	87.3	Confident	93.5	Very high	20 Å²	20	55.1 Å²	55.1	13%	0.13	29%	0.285	C	S	.	.	S	Bend	trans	-67.9	-24.8	-176.7	28.1	-36.6	0	0	0	114.2	Y168 A174 W176 Y188	Y168-P170 HydrophobicContact CE1-CB 4.48Å; P170-A174 HydrophobicContact CG-CB 4.02Å; P170-W176 HydrophobicContact CG-CD2 4.46Å; P170-W176 HydrophobicContact CG-CH2 3.79Å; P170-W176 HydrophobicContact CG-CZ2 3.55Å; P170-W176 HydrophobicContact CG-CZ3 4.34Å; P170-Y188 HydrophobicContact CB-CE1 3.89Å
171	Y	85.1	Confident	93.4	Very high	72 Å²	72	54.1 Å²	54.1	28%	0.282	28%	0.279	S	S	.	.	S	Bend	trans	-152.2	157.7	175.6	50.4	-89.4	0	0	0	109.7	I22 R169 T173 A174	I22-Y171 WeakPolarHBondContact CA-OH 3.38Å; I22-Y171 PolarHBondContact O-OH 2.97Å; R169-Y171 VanDerWaalsContact C-N 3.28Å; R169-Y171 PolarHBondContact O-N 3.49Å; Y171-T173 VanDerWaalsContact C-N 3.26Å; Y171-T173 WeakPolarHBondContact CD2-OG1 3.23Å; Y171-T173 VanDerWaalsContact CE2-C 3.49Å; Y171-T173 PolarHBondContact O-N 3.32Å; Y171-A174 HydrophobicContact CD1-CB 4.08Å; Y171-A174 HydrophobicContact CD2-CB 3.63Å; Y171-A174 HydrophobicContact CE1-CB 3.9Å; Y171-A174 HydrophobicContact CE2-CB 3.47Å; Y171-A174 VanDerWaalsContact CE2-CB 3.47Å; Y171-A174 HydrophobicContact CG-CB 3.93Å; Y171-A174 WeakPolarHBondContact O-CB 3.44Å; Y171-A174 PolarHBondContact O-N 2.91Å
172	E	84.9	Confident	93.3	Very high	195 Å²	195	57.1 Å²	57.1	91%	0.911	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-33.3	-173.1	-65.9	-174.9	172.6	0	0	113.2	A174	E172-A174 VanDerWaalsContact C-N 3.31Å
173	T	86.5	Confident	93	Very high	117 Å²	117	55 Å²	55	72%	0.718	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	5.6	178.5	56.6	0	0	0	0	113.7	Y171 T175	Y171-T173 VanDerWaalsContact C-N 3.26Å; Y171-T173 WeakPolarHBondContact CD2-OG1 3.23Å; Y171-T173 VanDerWaalsContact CE2-C 3.49Å; Y171-T173 PolarHBondContact O-N 3.32Å; T173-T175 PolarHBondContact O-N 3.5Å
174	A	88.2	Confident	92.8	Very high	10 Å²	10	56.9 Å²	56.9	8%	0.083	28%	0.279	C	S	.	.			trans	-68.8	128.8	-177.1	0	0	0	0	0	111.3	R169 P170 Y171 E172 W176	R169-A174 HydrophobicContact CB-CB 4.44Å; P170-A174 HydrophobicContact CG-CB 4.02Å; Y171-A174 HydrophobicContact CD1-CB 4.08Å; Y171-A174 HydrophobicContact CD2-CB 3.63Å; Y171-A174 HydrophobicContact CE1-CB 3.9Å; Y171-A174 HydrophobicContact CE2-CB 3.47Å; Y171-A174 VanDerWaalsContact CE2-CB 3.47Å; Y171-A174 HydrophobicContact CG-CB 3.93Å; Y171-A174 WeakPolarHBondContact O-CB 3.44Å; Y171-A174 PolarHBondContact O-N 2.91Å; E172-A174 VanDerWaalsContact C-N 3.31Å; A174-W176 PolarHBondContact O-N 3.16Å
175	T	89.1	Confident	92.5	Very high	109 Å²	109	57 Å²	57	67%	0.669	28%	0.281	S	S	*	.	S	Bend	trans	-83.7	1.3	176.1	62.1	0	0	0	0	113.1	I22 T173	I22-T175 HydrophobicContact CG2-CG2 4.39Å; T173-T175 PolarHBondContact O-N 3.5Å
176	W	93.1	Very high	92.1	Very high	43 Å²	43	60.8 Å²	60.8	16%	0.163	30%	0.296	C	S	.	.			trans	-133.5	158.9	-177.5	64.6	-86.8	0	0	0	110.8	I22 G23 P24 P25 P170 A174 Q178	I22-W176 VanDerWaalsContact O-CD1 3.29Å; G23-W176 PolarHBondContact O-NE1 3.2Å; P24-W176 HydrophobicContact CB-CB 3.94Å; P24-W176 HydrophobicContact CB-CD2 4.28Å; P24-W176 HydrophobicContact CB-CG 4.01Å; P25-W176 HydrophobicContact CG-CH2 4.44Å; P25-W176 HydrophobicContact CG-CZ3 4.43Å; P170-W176 HydrophobicContact CG-CD2 4.46Å; P170-W176 HydrophobicContact CG-CH2 3.79Å; P170-W176 HydrophobicContact CG-CZ2 3.55Å; P170-W176 HydrophobicContact CG-CZ3 4.34Å; A174-W176 PolarHBondContact O-N 3.16Å; W176-Q178 HydrophobicContact CE3-CG 4.03Å; W176-Q178 HydrophobicContact CZ3-CG 3.64Å
177	Q	95.2	Very high	91.6	Very high	31 Å²	31	61 Å²	61	15%	0.145	29%	0.294	C	S	.	.			trans	-149.6	162.3	-175.9	65.8	-163.9	-9.6	0	0	111	D97 W98 S100 V167 Y168 R169	D97-Q177 PolarHBondContact OD1-N 3.31Å; W98-Q177 HydrophobicContact CB-CG 4.36Å; W98-Q177 VanDerWaalsContact CB-O 3.31Å; W98-Q177 WeakPolarHBondContact CB-O 3.27Å; W98-Q177 PolarHBondContact N-O 2.91Å; W98-Q177 WeakPolarHBondContact O-CG 3.22Å; W98-Q177 PolarHBondContact O-NE2 3.24Å; S100-Q177 PolarHBondContact O-NE2 3.47Å; V167-Q177 HydrophobicContact CG1-CB 3.81Å; V167-Q177 HydrophobicContact CG1-CG 3.68Å; Y168-Q177 CarbonylContact O-C 3.58Å; Y168-Q177 WeakPolarHBondContact O-CA 3.2Å; Y168-Q177 WeakPolarHBondContact O-CB 3.44Å; R169-Q177 HydrophobicContact CG-CB 3.65Å
178	Q	95.6	Very high	91	Very high	24 Å²	24	63.7 Å²	63.7	11%	0.112	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	143.8	-179.2	-65.7	-65.8	-24.7	0	0	111.7	V96 V167 Y168 W176 V180	V96-Q178 PolarHBondContact O-NE2 2.95Å; V167-Q178 CarbonylContact C-O 3.6Å; V167-Q178 WeakPolarHBondContact CA-O 3.41Å; Y168-Q178 PolarHBondContact N-O 2.92Å; Y168-Q178 PolarHBondContact O-N 3.39Å; W176-Q178 HydrophobicContact CE3-CG 4.03Å; W176-Q178 HydrophobicContact CZ3-CG 3.64Å; Q178-V180 HydrophobicContact CB-CG1 3.63Å; Q178-V180 PolarHBondContact O-N 3.36Å
179	C	97.2	Very high	90.5	Very high	11 Å²	11	64.9 Å²	64.9	7%	0.074	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	95.9	171	174.7	0	0	0	0	109.2	W98 C105 K109	W98-C179 HydrophobicContact CB-CB 4.35Å; W98-C179 HydrophobicContact CD2-CB 3.56Å; W98-C179 HydrophobicContact CE3-CB 3.81Å; W98-C179 HydrophobicContact CG-CB 3.78Å; W98-C179 HydrophobicContact CZ3-CB 4.42Å; C105-C179 VanDerWaalsContact CA-SG 3.51Å; C105-C179 HydrophobicContact CB-CB 3.75Å; C105-C179 WeakPolarHBondContact CB-SG 3.36Å; C105-C179 VanDerWaalsContact SG-CA 3.53Å; C105-C179 WeakPolarHBondContact SG-CB 3.47Å; C105-C179 CovalentContact SG-SG 2.02Å; C105-C179 PolarHBondContact SG-SG 3Å; K109-C179 WeakPolarHBondContact CE-SG 3.4Å
180	V	95.9	Very high	90.2	Very high	17 Å²	17	59.5 Å²	59.5	10%	0.103	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	168.7	-170.9	-60.7	0	0	0	0	111.3	W165 T166 Y168 Q178 F184 A185	W165-V180 WeakPolarHBondContact CA-O 3.48Å; T166-V180 PolarHBondContact N-O 2.98Å; T166-V180 PolarHBondContact O-N 2.72Å; T166-V180 VanDerWaalsContact O-O 3.05Å; Y168-V180 VanDerWaalsContact CB-CG2 3.43Å; Y168-V180 HydrophobicContact CG-CG2 4.29Å; Q178-V180 HydrophobicContact CB-CG1 3.63Å; Q178-V180 PolarHBondContact O-N 3.36Å; V180-F184 HydrophobicContact CB-CB 4.21Å; V180-F184 HydrophobicContact CB-CD1 3.67Å; V180-F184 HydrophobicContact CB-CE1 4.47Å; V180-F184 HydrophobicContact CB-CG 4.22Å; V180-F184 HydrophobicContact CG1-CD1 3.64Å; V180-F184 HydrophobicContact CG1-CE1 3.94Å; V180-F184 HydrophobicContact CG1-CG 4.45Å; V180-F184 HydrophobicContact CG2-CD1 3.98Å; V180-A185 HydrophobicContact CG2-CB 4.27Å
181	S	95.5	Very high	89.9	Confident	23 Å²	23	67.1 Å²	67.1	16%	0.161	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	152.5	169.9	66.5	0	0	0	0	110.6	V164 W183 F184 A185	V164-S181 CarbonylContact O-C 3.58Å; V164-S181 VanDerWaalsContact O-CA 3.25Å; V164-S181 WeakPolarHBondContact O-CA 3.24Å; S181-W183 PolarHBondContact O-N 2.93Å; S181-W183 VanDerWaalsContact O-N 3.17Å; S181-F184 WeakPolarHBondContact O-CB 3.3Å; S181-F184 PolarHBondContact O-N 3.46Å; S181-F184 PolarHBondContact OG-N 3.07Å; S181-A185 PolarHBondContact O-N 2.94Å; S181-A185 VanDerWaalsContact O-N 3.12Å
182	I	94.5	Very high	89.7	Confident	71 Å²	71	67.5 Å²	67.5	36%	0.364	33%	0.327	S	S	.	.	H	α-helix	trans	-55.5	-32.5	175.3	57	168.8	0	0	0	112.4	V164 T166 R186	V164-I182 PolarHBondContact O-N 2.91Å; T166-I182 HydrophobicContact CG2-CG2 4.03Å; I182-R186 WeakPolarHBondContact O-CB 3.41Å; I182-R186 PolarHBondContact O-N 3.18Å
183	W	93.1	Very high	89.5	Confident	36 Å²	36	66.4 Å²	66.4	14%	0.136	32%	0.315	C	S	.	.	H	α-helix	trans	-69.9	-41.2	177.7	-61.5	-78.5	0	0	0	111.9	V164 S181 A185 R186 E187 P201 S204 Y208	V164-W183 HydrophobicContact CB-CH2 4.41Å; V164-W183 HydrophobicContact CB-CZ3 4.1Å; V164-W183 HydrophobicContact CG1-CE3 4.13Å; V164-W183 HydrophobicContact CG1-CH2 4.13Å; V164-W183 HydrophobicContact CG1-CZ3 3.37Å; V164-W183 HydrophobicContact CG2-CH2 3.55Å; V164-W183 HydrophobicContact CG2-CZ3 3.72Å; S181-W183 PolarHBondContact O-N 2.93Å; S181-W183 VanDerWaalsContact O-N 3.17Å; W183-A185 VanDerWaalsContact C-N 3.35Å; W183-R186 PolarHBondContact O-N 2.88Å; W183-E187 VanDerWaalsContact O-CB 3.22Å; W183-E187 WeakPolarHBondContact O-CB 3.16Å; W183-E187 PolarHBondContact O-N 3.29Å; W183-P201 VanDerWaalsContact CD1-O 3.29Å; W183-S204 VanDerWaalsContact CD1-OG 3.25Å; W183-S204 PolarHBondContact NE1-OG 2.82Å; W183-Y208 AromaticContact CH2-CD1 3.96Å; W183-Y208 HydrophobicContact CH2-CD1 3.96Å; W183-Y208 AromaticContact CH2-CD2 3.92Å; W183-Y208 HydrophobicContact CH2-CD2 3.92Å; W183-Y208 AromaticContact CH2-CG 3.51Å; W183-Y208 HydrophobicContact CH2-CG 3.51Å; W183-Y208 AromaticContact CZ3-CD1 3.68Å; W183-Y208 HydrophobicContact CZ3-CD1 3.68Å; W183-Y208 HydrophobicContact CZ3-CD2 4.47Å; W183-Y208 HydrophobicContact CZ3-CE1 4.35Å; W183-Y208 AromaticContact CZ3-CG 3.74Å; W183-Y208 HydrophobicContact CZ3-CG 3.74Å
184	F	91.1	Very high	88.8	Confident	112 Å²	112	68.1 Å²	68.1	49%	0.491	32%	0.319	S	S	.	.	H	α-helix	trans	-63.8	-41.5	176.1	-178.9	-87.4	0	0	0	111.6	V180 S181 E187 Y188	V180-F184 HydrophobicContact CB-CB 4.21Å; V180-F184 HydrophobicContact CB-CD1 3.67Å; V180-F184 HydrophobicContact CB-CE1 4.47Å; V180-F184 HydrophobicContact CB-CG 4.22Å; V180-F184 HydrophobicContact CG1-CD1 3.64Å; V180-F184 HydrophobicContact CG1-CE1 3.94Å; V180-F184 HydrophobicContact CG1-CG 4.45Å; V180-F184 HydrophobicContact CG2-CD1 3.98Å; S181-F184 WeakPolarHBondContact O-CB 3.3Å; S181-F184 PolarHBondContact O-N 3.46Å; S181-F184 PolarHBondContact OG-N 3.07Å; F184-E187 PolarHBondContact O-N 3.4Å; F184-Y188 WeakPolarHBondContact O-CB 3.45Å; F184-Y188 PolarHBondContact O-N 2.99Å; F184-Y188 VanDerWaalsContact O-N 3.07Å
185	A	91	Very high	87.7	Confident	11 Å²	11	74.4 Å²	74.4	9%	0.091	35%	0.345	C	S	.	.	H	α-helix	trans	-59.7	-48.1	174.3	0	0	0	0	0	111.6	Y168 V180 S181 W183 Y188 D189	Y168-A185 HydrophobicContact CD2-CB 3.5Å; Y168-A185 HydrophobicContact CE2-CB 4Å; Y168-A185 HydrophobicContact CG-CB 3.89Å; V180-A185 HydrophobicContact CG2-CB 4.27Å; S181-A185 PolarHBondContact O-N 2.94Å; S181-A185 VanDerWaalsContact O-N 3.12Å; W183-A185 VanDerWaalsContact C-N 3.35Å; A185-Y188 PolarHBondContact O-N 3.32Å; A185-D189 PolarHBondContact O-N 3.02Å
186	R	88.5	Confident	86.6	Confident	138 Å²	138	76.4 Å²	76.4	52%	0.521	36%	0.357	S	S	.	.	H	α-helix	trans	-64.8	-40.8	179.5	-174.5	173.9	-178.2	-176.2	1.1	113	I182 W183 D189 I190 P201	I182-R186 WeakPolarHBondContact O-CB 3.41Å; I182-R186 PolarHBondContact O-N 3.18Å; W183-R186 PolarHBondContact O-N 2.88Å; R186-D189 PolarHBondContact O-N 2.89Å; R186-I190 HydrophobicContact CG-CD1 3.89Å; R186-I190 WeakPolarHBondContact O-CD1 3.3Å; R186-I190 VanDerWaalsContact O-CG1 3.25Å; R186-I190 WeakPolarHBondContact O-CG1 3.5Å; R186-I190 PolarHBondContact O-N 3.33Å; R186-P201 HydrophobicContact CG-CB 4.48Å
187	E	86.1	Confident	85.4	Confident	39 Å²	39	78.3 Å²	78.3	18%	0.182	38%	0.377	C	S	.	.	H	α-helix	trans	-57.2	-49.6	175	172.7	58.8	-147.6	0	0	111.2	W183 F184 D189 I190 R191 L198	W183-E187 VanDerWaalsContact O-CB 3.22Å; W183-E187 WeakPolarHBondContact O-CB 3.16Å; W183-E187 PolarHBondContact O-N 3.29Å; F184-E187 PolarHBondContact O-N 3.4Å; E187-D189 PolarHBondContact O-N 2.89Å; E187-I190 PolarHBondContact O-N 3.28Å; E187-R191 WeakPolarHBondContact O-CB 3.38Å; E187-R191 PolarHBondContact O-N 3.13Å; E187-R191 IonicContact OE1-NE 3.79Å; E187-R191 IonicContact OE1-NH2 3.85Å; E187-L198 VanDerWaalsContact CD-CD1 3.41Å; E187-L198 WeakPolarHBondContact OE1-CD1 3.35Å; E187-L198 WeakPolarHBondContact OE1-CD2 3.43Å; E187-L198 WeakPolarHBondContact OE2-CD1 3.46Å; E187-L198 VanDerWaalsContact OE2-CD2 3.27Å; E187-L198 WeakPolarHBondContact OE2-CD2 3.49Å; E187-L198 WeakPolarHBondContact OE2-CG 3.41Å
188	Y	85.3	Confident	84.1	Confident	88 Å²	88	79.6 Å²	79.6	35%	0.345	39%	0.385	S	S	.	.	H	α-helix	trans	-63.8	-42.4	179.9	-170.1	-85	0	0	0	112	Y168 P170 F184 A185 I190 R191 T192	Y168-Y188 AromaticContact CE1-CD1 3.79Å; Y168-Y188 HydrophobicContact CE1-CD1 3.79Å; Y168-Y188 HydrophobicContact CE1-CE1 4.31Å; Y168-Y188 HydrophobicContact CE1-CG 4.19Å; Y168-Y188 AromaticContact CZ-CD1 3.87Å; Y168-Y188 WeakPolarHBondContact OH-CD1 3.3Å; P170-Y188 HydrophobicContact CB-CE1 3.89Å; F184-Y188 WeakPolarHBondContact O-CB 3.45Å; F184-Y188 PolarHBondContact O-N 2.99Å; F184-Y188 VanDerWaalsContact O-N 3.07Å; A185-Y188 PolarHBondContact O-N 3.32Å; Y188-I190 VanDerWaalsContact C-N 3.33Å; Y188-I190 PolarHBondContact O-N 3.39Å; Y188-R191 PolarHBondContact O-N 3.44Å; Y188-T192 HydrophobicContact CD1-CG2 3.94Å; Y188-T192 HydrophobicContact CE1-CG2 3.61Å; Y188-T192 WeakPolarHBondContact O-CG2 3.35Å; Y188-T192 PolarHBondContact O-N 3.09Å; Y188-T192 PolarHBondContact O-OG1 3.39Å
189	D	85.7	Confident	82.8	Confident	59 Å²	59	81.5 Å²	81.5	32%	0.316	40%	0.404	S	S	.	.	H	α-helix	trans	-62.7	-36.4	175.6	-74.9	-20.1	0	0	0	112.8	Y168 A185 R186 E187 T192 R193	Y168-D189 PolarHBondContact OH-OD1 3.43Å; A185-D189 PolarHBondContact O-N 3.02Å; R186-D189 PolarHBondContact O-N 2.89Å; E187-D189 PolarHBondContact O-N 2.89Å; D189-T192 WeakPolarHBondContact CA-OG1 3.35Å; D189-T192 PolarHBondContact O-OG1 3.15Å; D189-R193 WeakPolarHBondContact O-CB 3.49Å; D189-R193 VanDerWaalsContact O-CG 3.27Å; D189-R193 WeakPolarHBondContact O-CG 3.35Å; D189-R193 PolarHBondContact O-N 2.65Å
190	I	84.6	Confident	81.6	Confident	23 Å²	23	87.3 Å²	87.3	12%	0.118	43%	0.43	C	S	.	.	H	α-helix	trans	-70.6	-45.7	178	-71.4	166.2	0	0	0	110.5	R186 E187 Y188 R193 N194 K195 L198 P201	R186-I190 HydrophobicContact CG-CD1 3.89Å; R186-I190 WeakPolarHBondContact O-CD1 3.3Å; R186-I190 VanDerWaalsContact O-CG1 3.25Å; R186-I190 WeakPolarHBondContact O-CG1 3.5Å; R186-I190 PolarHBondContact O-N 3.33Å; E187-I190 PolarHBondContact O-N 3.28Å; Y188-I190 VanDerWaalsContact C-N 3.33Å; Y188-I190 PolarHBondContact O-N 3.39Å; I190-R193 PolarHBondContact O-N 3.07Å; I190-N194 PolarHBondContact O-N 3.06Å; I190-K195 HydrophobicContact CG2-CB 4.12Å; I190-K195 WeakPolarHBondContact CG2-O 3.4Å; I190-K195 PolarHBondContact O-N 3.16Å; I190-L198 HydrophobicContact CB-CD1 4.07Å; I190-L198 HydrophobicContact CD1-CD1 4.46Å; I190-L198 HydrophobicContact CG2-CD1 3.55Å; I190-P201 HydrophobicContact CD1-CG 4.03Å
191	R	82.2	Confident	80.7	Confident	181 Å²	181	86.7 Å²	86.7	68%	0.683	43%	0.427	S	S	*	.	H	α-helix	trans	-63.6	-41.8	-179.5	-172.7	-179.5	-75.5	-131.2	-1.2	111.9	E187 Y188 R193 N194	E187-R191 WeakPolarHBondContact O-CB 3.38Å; E187-R191 PolarHBondContact O-N 3.13Å; E187-R191 IonicContact OE1-NE 3.79Å; E187-R191 IonicContact OE1-NH2 3.85Å; Y188-R191 PolarHBondContact O-N 3.44Å; R191-R193 VanDerWaalsContact C-N 3.35Å; R191-N194 PolarHBondContact O-N 3.26Å
192	T	80.8	Confident	80	Confident	79 Å²	79	89.5 Å²	89.5	49%	0.485	44%	0.439	S	S	.	.	H	α-helix	trans	-70.6	-27.2	177.9	49.6	0	0	0	0	113.6	Y188 D189	Y188-T192 HydrophobicContact CD1-CG2 3.94Å; Y188-T192 HydrophobicContact CE1-CG2 3.61Å; Y188-T192 WeakPolarHBondContact O-CG2 3.35Å; Y188-T192 PolarHBondContact O-N 3.09Å; Y188-T192 PolarHBondContact O-OG1 3.39Å; D189-T192 WeakPolarHBondContact CA-OG1 3.35Å; D189-T192 PolarHBondContact O-OG1 3.15Å
193	R	80.2	Confident	79.6	Confident	173 Å²	173	91 Å²	91	65%	0.653	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	14.1	178.6	-65.2	-177	-168.5	-169.6	6.4	114.1	D189 I190 R191 K195	D189-R193 WeakPolarHBondContact O-CB 3.49Å; D189-R193 VanDerWaalsContact O-CG 3.27Å; D189-R193 WeakPolarHBondContact O-CG 3.35Å; D189-R193 PolarHBondContact O-N 2.65Å; I190-R193 PolarHBondContact O-N 3.07Å; R191-R193 VanDerWaalsContact C-N 3.35Å; R193-K195 HydrophobicContact CB-CG 4.49Å; R193-K195 PolarHBondContact O-N 3Å; R193-K195 VanDerWaalsContact O-N 3.16Å
194	N	71.8	Confident	79.5	Confident	152 Å²	152	91.4 Å²	91.4	81%	0.813	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	39.1	-178.1	-73	-8.9	0	0	0	113.9	I190 R191	I190-N194 PolarHBondContact O-N 3.06Å; R191-N194 PolarHBondContact O-N 3.26Å
195	K	65.9	Low	79.4	Confident	143 Å²	143	87.6 Å²	87.6	62%	0.622	45%	0.447	S	S	*	.			trans	-95.6	138.5	177.2	-72.4	-172.1	-180	-174.6	0	111.4	I190 R193	I190-K195 HydrophobicContact CG2-CB 4.12Å; I190-K195 WeakPolarHBondContact CG2-O 3.4Å; I190-K195 PolarHBondContact O-N 3.16Å; R193-K195 HydrophobicContact CB-CG 4.49Å; R193-K195 PolarHBondContact O-N 3Å; R193-K195 VanDerWaalsContact O-N 3.16Å
196	T	66.4	Low	79.4	Confident	151 Å²	151	89.3 Å²	89.3	93%	0.926	46%	0.457	S	S	*	.	S	Bend	trans	-85.8	-10.1	-166.5	40	0	0	0	0	116.6
197	S	65.9	Low	79.6	Confident	82 Å²	82	85.6 Å²	85.6	57%	0.573	46%	0.455	S	S	*	.			trans	-106.5	96.6	-176	174.3	0	0	0	0	112.4
198	L	69.8	Low	80	Confident	59 Å²	59	85.4 Å²	85.4	31%	0.309	45%	0.453	S	S	.	.			trans	-100.1	-5.4	178	-146.6	70.8	0	0	0	113.9	E187 I190 E200 P201 L202	E187-L198 VanDerWaalsContact CD-CD1 3.41Å; E187-L198 WeakPolarHBondContact OE1-CD1 3.35Å; E187-L198 WeakPolarHBondContact OE1-CD2 3.43Å; E187-L198 WeakPolarHBondContact OE2-CD1 3.46Å; E187-L198 VanDerWaalsContact OE2-CD2 3.27Å; E187-L198 WeakPolarHBondContact OE2-CD2 3.49Å; E187-L198 WeakPolarHBondContact OE2-CG 3.41Å; I190-L198 HydrophobicContact CB-CD1 4.07Å; I190-L198 HydrophobicContact CD1-CD1 4.46Å; I190-L198 HydrophobicContact CG2-CD1 3.55Å; L198-E200 PolarHBondContact O-N 2.93Å; L198-P201 WeakPolarHBondContact O-CD 3.26Å; L198-P201 VanDerWaalsContact O-CG 3.26Å; L198-P201 WeakPolarHBondContact O-CG 2.92Å; L198-L202 PolarHBondContact O-N 3.39Å
199	A	67.8	Low	80.3	Confident	63 Å²	63	83 Å²	83	52%	0.521	45%	0.449	S	S	.	.	H	α-helix	trans	-64	-45.1	-168.2	0	0	0	0	0	112.9	L202 V203	A199-L202 PolarHBondContact O-N 3.17Å; A199-V203 WeakPolarHBondContact O-CG2 3.21Å; A199-V203 PolarHBondContact O-N 3.14Å; A199-V203 VanDerWaalsContact O-N 3.12Å
200	E	71	Confident	80.8	Confident	133 Å²	133	82.4 Å²	82.4	62%	0.621	45%	0.447	S	S	*	.	H	α-helix	trans	-60	-51.3	-178.4	-74	-64.5	139.6	0	0	114.7	L198 L202 S204	L198-E200 PolarHBondContact O-N 2.93Å; E200-L202 VanDerWaalsContact C-N 3.27Å; E200-L202 PolarHBondContact O-N 2.91Å; E200-S204 PolarHBondContact O-N 3.29Å; E200-S204 PolarHBondContact O-OG 3.09Å
201	P	77.4	Confident	81.2	Confident	4 Å²	4	85.1 Å²	85.1	3%	0.026	46%	0.457	C	S	.	.	H	α-helix	trans	-63.9	-32.8	177.3	22.9	-32.3	0	0	0	112.6	W183 R186 I190 L198 S204 S205	W183-P201 VanDerWaalsContact CD1-O 3.29Å; R186-P201 HydrophobicContact CG-CB 4.48Å; I190-P201 HydrophobicContact CD1-CG 4.03Å; L198-P201 WeakPolarHBondContact O-CD 3.26Å; L198-P201 VanDerWaalsContact O-CG 3.26Å; L198-P201 WeakPolarHBondContact O-CG 2.92Å; P201-S204 PolarHBondContact O-OG 3.3Å; P201-S205 WeakPolarHBondContact O-CB 3.46Å; P201-S205 PolarHBondContact O-N 2.71Å; P201-S205 VanDerWaalsContact O-N 3.1Å
202	L	81.6	Confident	81.8	Confident	82 Å²	82	78.8 Å²	78.8	43%	0.429	44%	0.435	S	S	.	.	H	α-helix	trans	-70.4	-46.9	-178	-174.6	62.4	0	0	0	112.6	L198 A199 E200 S204 S205 T206	L198-L202 PolarHBondContact O-N 3.39Å; A199-L202 PolarHBondContact O-N 3.17Å; E200-L202 VanDerWaalsContact C-N 3.27Å; E200-L202 PolarHBondContact O-N 2.91Å; L202-S204 PolarHBondContact O-N 3.46Å; L202-S205 PolarHBondContact O-N 3.28Å; L202-T206 VanDerWaalsContact O-CB 3.3Å; L202-T206 WeakPolarHBondContact O-CB 3.33Å; L202-T206 PolarHBondContact O-N 3.4Å; L202-T206 PolarHBondContact O-OG1 3.49Å
203	V	86.3	Confident	82.4	Confident	103 Å²	103	75.6 Å²	75.6	62%	0.624	42%	0.415	S	S	*	.	H	α-helix	trans	-61.8	-47.8	-178.7	173.6	0	0	0	0	110.9	A199 T206 A207	A199-V203 WeakPolarHBondContact O-CG2 3.21Å; A199-V203 PolarHBondContact O-N 3.14Å; A199-V203 VanDerWaalsContact O-N 3.12Å; V203-T206 PolarHBondContact O-N 3.04Å; V203-A207 WeakPolarHBondContact O-CB 3.46Å; V203-A207 PolarHBondContact O-N 2.84Å
204	S	89.2	Confident	83.1	Confident	45 Å²	45	70.7 Å²	70.7	32%	0.315	40%	0.402	S	S	.	.	H	α-helix	trans	-67.7	-39.5	-178.9	52.9	0	0	0	0	112.8	W183 E200 P201 L202 Y208	W183-S204 VanDerWaalsContact CD1-OG 3.25Å; W183-S204 PolarHBondContact NE1-OG 2.82Å; E200-S204 PolarHBondContact O-N 3.29Å; E200-S204 PolarHBondContact O-OG 3.09Å; P201-S204 PolarHBondContact O-OG 3.3Å; L202-S204 PolarHBondContact O-N 3.46Å; S204-Y208 WeakPolarHBondContact O-CB 3.25Å; S204-Y208 PolarHBondContact O-N 3.14Å; S204-Y208 VanDerWaalsContact O-N 3.08Å
205	S	90.6	Very high	84.2	Confident	31 Å²	31	64.8 Å²	64.8	22%	0.217	37%	0.37	C	S	.	.	H	α-helix	trans	-61.8	-43.3	173	-173.8	0	0	0	0	112.3	P201 L202 Y208 S209	P201-S205 WeakPolarHBondContact O-CB 3.46Å; P201-S205 PolarHBondContact O-N 2.71Å; P201-S205 VanDerWaalsContact O-N 3.1Å; L202-S205 PolarHBondContact O-N 3.28Å; S205-Y208 PolarHBondContact O-N 3.06Å; S205-S209 WeakPolarHBondContact O-CB 3.37Å; S205-S209 PolarHBondContact O-N 2.99Å; S205-S209 PolarHBondContact O-OG 3.37Å
206	T	90.6	Very high	85.4	Confident	48 Å²	48	58.1 Å²	58.1	29%	0.294	34%	0.341	S	S	.	.	H	α-helix	trans	-66.7	-47.7	179.7	-58.3	0	0	0	0	110.8	L202 V203 Y208 S209 V210 L331	L202-T206 VanDerWaalsContact O-CB 3.3Å; L202-T206 WeakPolarHBondContact O-CB 3.33Å; L202-T206 PolarHBondContact O-N 3.4Å; L202-T206 PolarHBondContact O-OG1 3.49Å; V203-T206 PolarHBondContact O-N 3.04Å; T206-Y208 VanDerWaalsContact C-N 3.29Å; T206-Y208 PolarHBondContact O-N 3.05Å; T206-S209 PolarHBondContact O-N 3.38Å; T206-S209 VanDerWaalsContact O-N 3.13Å; T206-V210 HydrophobicContact CG2-CG2 4.42Å; T206-V210 WeakPolarHBondContact O-CG2 3.34Å; T206-V210 PolarHBondContact O-N 3.34Å; T206-L331 HydrophobicContact CG2-CD2 3.49Å; T206-L331 VanDerWaalsContact CG2-CD2 3.49Å
207	A	92.3	Very high	86.8	Confident	59 Å²	59	51.1 Å²	51.1	49%	0.488	30%	0.298	S	S	.	.	H	α-helix	trans	-57.4	-42.8	177.3	0	0	0	0	0	111.9	V203 V210 Y211	V203-A207 WeakPolarHBondContact O-CB 3.46Å; V203-A207 PolarHBondContact O-N 2.84Å; A207-V210 PolarHBondContact O-N 3.11Å; A207-Y211 PolarHBondContact O-N 2.86Å
208	Y	94.4	Very high	88.2	Confident	36 Å²	36	51 Å²	51	14%	0.141	29%	0.285	C	S	.	.	H	α-helix	trans	-66.2	-41.5	176	-175.2	-95.9	0	0	0	112.8	P160 Q161 V164 W183 S204 S205 T206 Y211 H212	P160-Y208 HydrophobicContact CB-CE2 3.9Å; Q161-Y208 VanDerWaalsContact CD-OH 3.31Å; Q161-Y208 PolarHBondContact NE2-OH 2.8Å; Q161-Y208 PolarHBondContact OE1-OH 3.26Å; V164-Y208 HydrophobicContact CB-CE1 4.28Å; V164-Y208 HydrophobicContact CG1-CD1 4.23Å; V164-Y208 HydrophobicContact CG1-CE1 3.75Å; V164-Y208 HydrophobicContact CG2-CD1 4.43Å; V164-Y208 HydrophobicContact CG2-CD2 4.13Å; V164-Y208 HydrophobicContact CG2-CE1 3.99Å; V164-Y208 HydrophobicContact CG2-CE2 3.65Å; V164-Y208 HydrophobicContact CG2-CG 4.48Å; W183-Y208 AromaticContact CH2-CD1 3.96Å; W183-Y208 HydrophobicContact CH2-CD1 3.96Å; W183-Y208 AromaticContact CH2-CD2 3.92Å; W183-Y208 HydrophobicContact CH2-CD2 3.92Å; W183-Y208 AromaticContact CH2-CG 3.51Å; W183-Y208 HydrophobicContact CH2-CG 3.51Å; W183-Y208 AromaticContact CZ3-CD1 3.68Å; W183-Y208 HydrophobicContact CZ3-CD1 3.68Å; W183-Y208 HydrophobicContact CZ3-CD2 4.47Å; W183-Y208 HydrophobicContact CZ3-CE1 4.35Å; W183-Y208 AromaticContact CZ3-CG 3.74Å; W183-Y208 HydrophobicContact CZ3-CG 3.74Å; S204-Y208 WeakPolarHBondContact O-CB 3.25Å; S204-Y208 PolarHBondContact O-N 3.14Å; S204-Y208 VanDerWaalsContact O-N 3.08Å; S205-Y208 PolarHBondContact O-N 3.06Å; T206-Y208 VanDerWaalsContact C-N 3.29Å; T206-Y208 PolarHBondContact O-N 3.05Å; Y208-Y211 HydrophobicContact CD2-CD1 4.27Å; Y208-Y211 HydrophobicContact CE2-CD1 4.14Å; Y208-Y211 HydrophobicContact CE2-CE1 4.34Å; Y208-Y211 WeakPolarHBondContact O-CB 3.2Å; Y208-Y211 PolarHBondContact O-N 3.07Å; Y208-H212 WeakPolarHBondContact O-CB 3.35Å; Y208-H212 PolarHBondContact O-N 3.2Å
209	S	92.7	Very high	89.5	Confident	38 Å²	38	52.3 Å²	52.3	27%	0.266	29%	0.291	S	S	.	.	H	α-helix	trans	-63.9	-41.6	177.7	-60.1	0	0	0	0	111.5	S205 T206 H212 V213	S205-S209 WeakPolarHBondContact O-CB 3.37Å; S205-S209 PolarHBondContact O-N 2.99Å; S205-S209 PolarHBondContact O-OG 3.37Å; T206-S209 PolarHBondContact O-N 3.38Å; T206-S209 VanDerWaalsContact O-N 3.13Å; S209-H212 PolarHBondContact O-N 2.99Å; S209-V213 WeakPolarHBondContact O-CG2 3.23Å; S209-V213 PolarHBondContact O-N 2.91Å
210	V	94.5	Very high	90.8	Very high	45 Å²	45	49.5 Å²	49.5	27%	0.273	27%	0.268	S	S	.	.	H	α-helix	trans	-60.5	-49.4	172.9	170.8	0	0	0	0	110.8	T206 A207 H212 V213 L214 F327 L331	T206-V210 HydrophobicContact CG2-CG2 4.42Å; T206-V210 WeakPolarHBondContact O-CG2 3.34Å; T206-V210 PolarHBondContact O-N 3.34Å; A207-V210 PolarHBondContact O-N 3.11Å; V210-H212 VanDerWaalsContact C-N 3.3Å; V210-H212 PolarHBondContact O-N 2.73Å; V210-V213 VanDerWaalsContact O-CG2 3.24Å; V210-V213 WeakPolarHBondContact O-CG2 3.27Å; V210-V213 PolarHBondContact O-N 3.46Å; V210-L214 HydrophobicContact CG1-CD1 3.85Å; V210-L214 HydrophobicContact CG1-CG 4.27Å; V210-L214 WeakPolarHBondContact O-CB 3.47Å; V210-L214 VanDerWaalsContact O-CG 3.23Å; V210-L214 WeakPolarHBondContact O-CG 3.4Å; V210-L214 PolarHBondContact O-N 3.42Å; V210-F327 HydrophobicContact CG2-CE1 4.08Å; V210-F327 HydrophobicContact CG2-CZ 4.15Å; V210-L331 HydrophobicContact CG2-CD1 3.89Å
211	Y	94.4	Very high	91.9	Very high	80 Å²	80	43.6 Å²	43.6	31%	0.314	24%	0.242	S	C	.	.	H	α-helix	trans	-51.1	-51.3	173.8	158.6	-100.2	0	0	0	111.2	T157 A207 Y208 V213 L214 I215	T157-Y211 PolarHBondContact O-OH 3.49Å; A207-Y211 PolarHBondContact O-N 2.86Å; Y208-Y211 HydrophobicContact CD2-CD1 4.27Å; Y208-Y211 HydrophobicContact CE2-CD1 4.14Å; Y208-Y211 HydrophobicContact CE2-CE1 4.34Å; Y208-Y211 WeakPolarHBondContact O-CB 3.2Å; Y208-Y211 PolarHBondContact O-N 3.07Å; Y211-V213 PolarHBondContact O-N 2.9Å; Y211-L214 WeakPolarHBondContact O-CB 3.36Å; Y211-L214 PolarHBondContact O-N 3.44Å; Y211-I215 HydrophobicContact CD2-CG2 4.08Å; Y211-I215 HydrophobicContact CE1-CD1 3.79Å; Y211-I215 HydrophobicContact CE2-CD1 4.37Å; Y211-I215 HydrophobicContact CE2-CG2 3.67Å; Y211-I215 WeakPolarHBondContact O-CG1 3.36Å; Y211-I215 PolarHBondContact O-N 3.2Å
212	H	94.1	Very high	92.8	Very high	49 Å²	49	45.8 Å²	45.8	23%	0.227	26%	0.26	C	S	.	.	H	α-helix	trans	-63	-43.4	-175.7	-174.6	-88.5	0	0	0	112.7	Y208 S209 V210 L214 I215 V216	Y208-H212 WeakPolarHBondContact O-CB 3.35Å; Y208-H212 PolarHBondContact O-N 3.2Å; S209-H212 PolarHBondContact O-N 2.99Å; V210-H212 VanDerWaalsContact C-N 3.3Å; V210-H212 PolarHBondContact O-N 2.73Å; H212-L214 VanDerWaalsContact C-N 3.33Å; H212-L214 PolarHBondContact O-N 2.89Å; H212-I215 WeakPolarHBondContact O-CG1 3.48Å; H212-V216 WeakPolarHBondContact O-CB 3.18Å; H212-V216 WeakPolarHBondContact O-CG2 3.38Å; H212-V216 PolarHBondContact O-N 3.45Å; H212-V216 VanDerWaalsContact O-N 3.11Å
213	V	94	Very high	93.3	Very high	11 Å²	11	46.1 Å²	46.1	7%	0.067	26%	0.262	C	S	.	.	H	α-helix	trans	-69.9	-30.5	177	-62.2	0	0	0	0	112.5	S209 V210 Y211 F217 W218 N324 F327	S209-V213 WeakPolarHBondContact O-CG2 3.23Å; S209-V213 PolarHBondContact O-N 2.91Å; V210-V213 VanDerWaalsContact O-CG2 3.24Å; V210-V213 WeakPolarHBondContact O-CG2 3.27Å; V210-V213 PolarHBondContact O-N 3.46Å; Y211-V213 PolarHBondContact O-N 2.9Å; V213-F217 PolarHBondContact O-N 3.32Å; V213-W218 PolarHBondContact O-N 3.01Å; V213-N324 WeakPolarHBondContact CB-OD1 3.41Å; V213-N324 WeakPolarHBondContact CG1-OD1 3.44Å; V213-F327 HydrophobicContact CG1-CD1 4.05Å; V213-F327 HydrophobicContact CG1-CE1 4.27Å; V213-F327 HydrophobicContact CG1-CG 4.45Å; V213-F327 HydrophobicContact CG2-CD1 3.91Å; V213-F327 HydrophobicContact CG2-CE1 3.71Å
214	L	95.2	Very high	93.6	Very high	71 Å²	71	41.3 Å²	41.3	37%	0.372	23%	0.233	S	C	.	.	I	π-helix	trans	-64.8	-48.9	175.5	-73.5	174.3	0	0	0	111.5	V210 Y211 H212 W218 I219	V210-L214 HydrophobicContact CG1-CD1 3.85Å; V210-L214 HydrophobicContact CG1-CG 4.27Å; V210-L214 WeakPolarHBondContact O-CB 3.47Å; V210-L214 VanDerWaalsContact O-CG 3.23Å; V210-L214 WeakPolarHBondContact O-CG 3.4Å; V210-L214 PolarHBondContact O-N 3.42Å; Y211-L214 WeakPolarHBondContact O-CB 3.36Å; Y211-L214 PolarHBondContact O-N 3.44Å; H212-L214 VanDerWaalsContact C-N 3.33Å; H212-L214 PolarHBondContact O-N 2.89Å; L214-W218 HydrophobicContact CD2-CB 3.85Å; L214-W218 HydrophobicContact CD2-CG 4.24Å; L214-W218 PolarHBondContact O-N 3.32Å; L214-I219 HydrophobicContact CB-CD1 4.31Å; L214-I219 WeakPolarHBondContact O-CB 3.4Å; L214-I219 WeakPolarHBondContact O-CG1 3.43Å; L214-I219 PolarHBondContact O-N 3.43Å
215	I	94	Very high	93.8	Very high	27 Å²	27	41.8 Å²	41.8	14%	0.138	23%	0.234	C	C	.	.	I	π-helix	trans	-70	-38.5	-178.1	57.4	160.9	0	0	0	112.7	T157 Y211 H212 P220	T157-I215 HydrophobicContact CG2-CD1 4.23Å; T157-I215 HydrophobicContact CG2-CG2 4.38Å; Y211-I215 HydrophobicContact CD2-CG2 4.08Å; Y211-I215 HydrophobicContact CE1-CD1 3.79Å; Y211-I215 HydrophobicContact CE2-CD1 4.37Å; Y211-I215 HydrophobicContact CE2-CG2 3.67Å; Y211-I215 WeakPolarHBondContact O-CG1 3.36Å; Y211-I215 PolarHBondContact O-N 3.2Å; H212-I215 WeakPolarHBondContact O-CG1 3.48Å; I215-P220 WeakPolarHBondContact O-CD 3.49Å; I215-P220 WeakPolarHBondContact O-CG 3.34Å
216	V	92.2	Very high	93.8	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.024	25%	0.25	C	C	.	.	I	π-helix	trans	-81.8	-36.6	-174.5	173.7	0	0	0	0	111.2	F116 S120 H212 Y316 W320	F116-V216 HydrophobicContact CB-CG1 3.76Å; S120-V216 VanDerWaalsContact CB-O 3.27Å; S120-V216 WeakPolarHBondContact CB-O 3.36Å; S120-V216 PolarHBondContact OG-O 2.94Å; H212-V216 WeakPolarHBondContact O-CB 3.18Å; H212-V216 WeakPolarHBondContact O-CG2 3.38Å; H212-V216 PolarHBondContact O-N 3.45Å; H212-V216 VanDerWaalsContact O-N 3.11Å; V216-Y316 PolarHBondContact O-OH 2.9Å; V216-Y316 VanDerWaalsContact O-OH 3.06Å; V216-W320 HydrophobicContact CG1-CE3 4.35Å; V216-W320 HydrophobicContact CG1-CH2 3.49Å; V216-W320 VanDerWaalsContact CG1-CH2 3.49Å; V216-W320 HydrophobicContact CG1-CZ2 4.46Å; V216-W320 HydrophobicContact CG1-CZ3 3.41Å; V216-W320 VanDerWaalsContact CG1-CZ3 3.41Å
217	F	95.1	Very high	93.7	Very high	3 Å²	3	44.1 Å²	44.1	1%	0.013	24%	0.242	C	C	.	.	I	π-helix	trans	-121.4	-63	-172.9	176.1	-110.8	0	0	0	114.4	V213 P220 A221 Y316 W320 L321 N324	V213-F217 PolarHBondContact O-N 3.32Å; F217-P220 WeakPolarHBondContact O-CD 3.35Å; F217-A221 HydrophobicContact CD2-CB 4.38Å; F217-A221 HydrophobicContact CE2-CB 4.04Å; F217-A221 HydrophobicContact CZ-CB 4.15Å; F217-A221 WeakPolarHBondContact O-CB 3.34Å; F217-A221 PolarHBondContact O-N 3.3Å; F217-Y316 WeakPolarHBondContact CA-OH 3.38Å; F217-Y316 AromaticContact CD2-CE1 3.78Å; F217-Y316 HydrophobicContact CD2-CE1 3.78Å; F217-Y316 AromaticContact CD2-CZ 3.83Å; F217-Y316 HydrophobicContact CE2-CD1 4.37Å; F217-Y316 AromaticContact CE2-CE1 3.84Å; F217-Y316 HydrophobicContact CE2-CE1 3.84Å; F217-W320 HydrophobicContact CB-CE3 4.23Å; F217-W320 HydrophobicContact CD2-CB 3.33Å; F217-W320 HydrophobicContact CD2-CD2 4.43Å; F217-W320 HydrophobicContact CD2-CE3 4.48Å; F217-W320 HydrophobicContact CD2-CG 4.01Å; F217-W320 HydrophobicContact CE2-CB 3.39Å; F217-W320 HydrophobicContact CE2-CG 4.4Å; F217-W320 HydrophobicContact CG-CB 4.18Å; F217-W320 HydrophobicContact CZ-CB 4.28Å; F217-L321 HydrophobicContact CE1-CB 4.47Å; F217-L321 HydrophobicContact CE1-CD1 3.89Å; F217-L321 HydrophobicContact CZ-CB 3.9Å; F217-L321 HydrophobicContact CZ-CD1 3.99Å; F217-N324 HydrophobicContact CD1-CB 3.65Å; F217-N324 VanDerWaalsContact CD1-CG 3.48Å; F217-N324 HydrophobicContact CE1-CB 3.97Å; F217-N324 HydrophobicContact CG-CB 4.43Å; F217-N324 WeakPolarHBondContact CG-ND2 3.46Å
218	W	95.9	Very high	93.5	Very high	79 Å²	79	42 Å²	42	30%	0.299	22%	0.222	S	C	.	.	I	π-helix	trans	-67.7	-44	-164.3	-70.4	100.3	0	0	0	114	V213 L214 A221 A222 L321 N324 L328	V213-W218 PolarHBondContact O-N 3.01Å; L214-W218 HydrophobicContact CD2-CB 3.85Å; L214-W218 HydrophobicContact CD2-CG 4.24Å; L214-W218 PolarHBondContact O-N 3.32Å; W218-A221 PolarHBondContact O-N 2.88Å; W218-A222 WeakPolarHBondContact O-CB 3.43Å; W218-A222 PolarHBondContact O-N 3Å; W218-L321 HydrophobicContact CH2-CD1 3.75Å; W218-L321 HydrophobicContact CZ2-CD1 4.21Å; W218-L321 HydrophobicContact CZ3-CD1 4.38Å; W218-N324 HydrophobicContact CZ2-CB 4.3Å; W218-L328 HydrophobicContact CH2-CD1 4.03Å; W218-L328 HydrophobicContact CZ2-CD1 3.34Å; W218-L328 HydrophobicContact CZ2-CG 4.28Å
219	I	95.6	Very high	93.2	Very high	88 Å²	88	45.2 Å²	45.2	45%	0.451	24%	0.241	S	C	.	.	H	α-helix	trans	-63.7	-51.7	176.7	-66.9	169.8	0	0	0	110.2	L214 A221 A222 L223	L214-I219 HydrophobicContact CB-CD1 4.31Å; L214-I219 WeakPolarHBondContact O-CB 3.4Å; L214-I219 WeakPolarHBondContact O-CG1 3.43Å; L214-I219 PolarHBondContact O-N 3.43Å; I219-A221 VanDerWaalsContact C-N 3.33Å; I219-A221 PolarHBondContact O-N 3.41Å; I219-A222 PolarHBondContact O-N 3.34Å; I219-L223 HydrophobicContact CG2-CD1 4.09Å; I219-L223 WeakPolarHBondContact O-CG 3.37Å; I219-L223 PolarHBondContact O-N 2.76Å
220	P	95.7	Very high	93.1	Very high	4 Å²	4	50.7 Å²	50.7	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-55.1	-44.6	172.4	-27.9	34.7	0	0	0	113.4	V124 I215 F217 A222 L223 L224	V124-P220 HydrophobicContact CG2-CB 3.98Å; I215-P220 WeakPolarHBondContact O-CD 3.49Å; I215-P220 WeakPolarHBondContact O-CG 3.34Å; F217-P220 WeakPolarHBondContact O-CD 3.35Å; P220-A222 PolarHBondContact O-N 3.21Å; P220-L223 PolarHBondContact O-N 3.37Å; P220-L224 WeakPolarHBondContact O-CB 3.46Å; P220-L224 WeakPolarHBondContact O-CG 3.31Å; P220-L224 PolarHBondContact O-N 2.85Å
221	A	95.2	Very high	92.7	Very high	9 Å²	9	48.8 Å²	48.8	7%	0.074	24%	0.244	C	C	.	.	H	α-helix	trans	-62.2	-42.4	-179.9	0	0	0	0	0	112.2	F217 W218 I219 L224 T225 Y316	F217-A221 HydrophobicContact CD2-CB 4.38Å; F217-A221 HydrophobicContact CE2-CB 4.04Å; F217-A221 HydrophobicContact CZ-CB 4.15Å; F217-A221 WeakPolarHBondContact O-CB 3.34Å; F217-A221 PolarHBondContact O-N 3.3Å; W218-A221 PolarHBondContact O-N 2.88Å; I219-A221 VanDerWaalsContact C-N 3.33Å; I219-A221 PolarHBondContact O-N 3.41Å; A221-L224 PolarHBondContact O-N 2.91Å; A221-T225 VanDerWaalsContact O-CB 3.31Å; A221-T225 WeakPolarHBondContact O-CB 3.35Å; A221-T225 PolarHBondContact O-N 3.33Å; A221-T225 PolarHBondContact O-OG1 2.97Å; A221-Y316 HydrophobicContact CB-CE1 4.15Å
222	A	94.4	Very high	92.4	Very high	49 Å²	49	46.4 Å²	46.4	41%	0.405	24%	0.241	S	C	.	.	H	α-helix	trans	-63.5	-47.8	176	0	0	0	0	0	111.5	W218 I219 P220 L224 T225 I226	W218-A222 WeakPolarHBondContact O-CB 3.43Å; W218-A222 PolarHBondContact O-N 3Å; I219-A222 PolarHBondContact O-N 3.34Å; P220-A222 PolarHBondContact O-N 3.21Å; A222-L224 VanDerWaalsContact C-N 3.34Å; A222-L224 PolarHBondContact O-N 3.21Å; A222-T225 PolarHBondContact O-N 3.43Å; A222-I226 VanDerWaalsContact O-CG1 3.31Å; A222-I226 WeakPolarHBondContact O-CG1 3.16Å; A222-I226 PolarHBondContact O-N 3.21Å
223	L	93.6	Very high	92.1	Very high	90 Å²	90	49 Å²	49	47%	0.471	25%	0.254	S	S	.	.	H	α-helix	trans	-59.7	-43.8	176.8	-69.3	174.7	0	0	0	111.9	V124 I219 P220 C227	V124-L223 HydrophobicContact CG1-CD1 4.43Å; I219-L223 HydrophobicContact CG2-CD1 4.09Å; I219-L223 WeakPolarHBondContact O-CG 3.37Å; I219-L223 PolarHBondContact O-N 2.76Å; P220-L223 PolarHBondContact O-N 3.37Å; L223-C227 WeakPolarHBondContact O-CB 3.44Å; L223-C227 PolarHBondContact O-N 2.91Å
224	L	93.1	Very high	91.8	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-61.8	-47.7	176.8	-73.4	172.7	0	0	0	111.8	I123 V124 A127 P220 A221 A222 Y228 Y316	I123-L224 HydrophobicContact CB-CD1 4.39Å; I123-L224 HydrophobicContact CG2-CD1 3.65Å; I123-L224 HydrophobicContact CG2-CD2 3.75Å; I123-L224 HydrophobicContact CG2-CG 4.36Å; V124-L224 HydrophobicContact CB-CD2 4.49Å; V124-L224 HydrophobicContact CG2-CD2 4.09Å; V124-L224 HydrophobicContact CG2-CG 3.97Å; A127-L224 HydrophobicContact CB-CD2 3.61Å; P220-L224 WeakPolarHBondContact O-CB 3.46Å; P220-L224 WeakPolarHBondContact O-CG 3.31Å; P220-L224 PolarHBondContact O-N 2.85Å; A221-L224 PolarHBondContact O-N 2.91Å; A222-L224 VanDerWaalsContact C-N 3.34Å; A222-L224 PolarHBondContact O-N 3.21Å; L224-Y228 WeakPolarHBondContact O-CB 3.26Å; L224-Y228 PolarHBondContact O-N 3Å; L224-Y316 HydrophobicContact CD1-CD1 3.94Å; L224-Y316 HydrophobicContact CD1-CE1 4Å
225	T	91.6	Very high	91.3	Very high	55 Å²	55	48 Å²	48	34%	0.337	25%	0.251	S	S	.	.	H	α-helix	trans	-62.1	-50.6	-178.9	-58.1	0	0	0	0	110.3	A221 A222 Y228 L229	A221-T225 VanDerWaalsContact O-CB 3.31Å; A221-T225 WeakPolarHBondContact O-CB 3.35Å; A221-T225 PolarHBondContact O-N 3.33Å; A221-T225 PolarHBondContact O-OG1 2.97Å; A222-T225 PolarHBondContact O-N 3.43Å; T225-Y228 PolarHBondContact O-N 2.8Å; T225-L229 HydrophobicContact CG2-CD1 3.69Å; T225-L229 HydrophobicContact CG2-CG 4.22Å; T225-L229 VanDerWaalsContact O-CB 3.3Å; T225-L229 WeakPolarHBondContact O-CB 3.37Å; T225-L229 WeakPolarHBondContact O-CG 3.37Å; T225-L229 PolarHBondContact O-N 3.45Å
226	I	90.8	Very high	90.9	Very high	107 Å²	107	50 Å²	50	55%	0.549	27%	0.267	S	S	.	.	H	α-helix	trans	-61.3	-50	179.1	-66.6	166.9	0	0	0	111	A222 Y228 R230	A222-I226 VanDerWaalsContact O-CG1 3.31Å; A222-I226 WeakPolarHBondContact O-CG1 3.16Å; A222-I226 PolarHBondContact O-N 3.21Å; I226-Y228 VanDerWaalsContact C-N 3.3Å; I226-Y228 PolarHBondContact O-N 3.42Å; I226-R230 VanDerWaalsContact O-CG 3.25Å; I226-R230 WeakPolarHBondContact O-CG 3.4Å; I226-R230 PolarHBondContact O-N 3.35Å
227	C	89.9	Confident	90.5	Very high	21 Å²	21	57 Å²	57	14%	0.142	30%	0.298	C	S	.	.	H	α-helix	trans	-59.6	-43	-178.5	-177.2	0	0	0	0	111.4	A127 L223 L231	A127-C227 HydrophobicContact CB-CB 4.35Å; L223-C227 WeakPolarHBondContact O-CB 3.44Å; L223-C227 PolarHBondContact O-N 2.91Å; C227-L231 WeakPolarHBondContact O-CB 3.39Å; C227-L231 PolarHBondContact O-N 3.16Å
228	Y	87.2	Confident	89.9	Confident	15 Å²	15	60.2 Å²	60.2	6%	0.059	31%	0.312	C	S	.	.	H	α-helix	trans	-81.1	-36	-174.5	-166	-94.6	0	0	0	113.7	L224 T225 I226 R230 L231 A232 I306 C309 L310 I313	L224-Y228 WeakPolarHBondContact O-CB 3.26Å; L224-Y228 PolarHBondContact O-N 3Å; T225-Y228 PolarHBondContact O-N 2.8Å; I226-Y228 VanDerWaalsContact C-N 3.3Å; I226-Y228 PolarHBondContact O-N 3.42Å; Y228-R230 VanDerWaalsContact C-N 3.27Å; Y228-R230 PolarHBondContact O-N 2.88Å; Y228-L231 HydrophobicContact CD2-CD2 3.94Å; Y228-L231 HydrophobicContact CE2-CD2 3.99Å; Y228-L231 PolarHBondContact O-N 3.13Å; Y228-A232 HydrophobicContact CD1-CB 4.46Å; Y228-A232 HydrophobicContact CE1-CB 4.16Å; Y228-A232 VanDerWaalsContact O-CB 3.29Å; Y228-A232 WeakPolarHBondContact O-CB 3.41Å; Y228-A232 PolarHBondContact O-N 2.98Å; Y228-I306 WeakPolarHBondContact OH-CG2 3.46Å; Y228-I306 PolarHBondContact OH-O 2.99Å; Y228-C309 HydrophobicContact CD2-CB 4.08Å; Y228-C309 HydrophobicContact CE2-CB 3.46Å; Y228-C309 VanDerWaalsContact CE2-CB 3.46Å; Y228-L310 HydrophobicContact CD1-CD1 4.37Å; Y228-L310 HydrophobicContact CE1-CB 3.98Å; Y228-L310 HydrophobicContact CE1-CD1 3.75Å; Y228-L310 HydrophobicContact CE1-CG 4.43Å; Y228-L310 WeakPolarHBondContact OH-CB 3.41Å; Y228-L310 PolarHBondContact OH-N 3.43Å; Y228-I313 HydrophobicContact CD1-CD1 3.88Å; Y228-I313 HydrophobicContact CD2-CD1 3.55Å; Y228-I313 HydrophobicContact CE2-CD1 4.33Å; Y228-I313 HydrophobicContact CG-CD1 3.27Å
229	L	88.4	Confident	89.1	Confident	103 Å²	103	58.4 Å²	58.4	54%	0.539	31%	0.308	S	S	.	.	H	α-helix	trans	-57.2	-45.8	171.3	-74.1	173.1	0	0	0	110.2	T225 A232 M233	T225-L229 HydrophobicContact CG2-CD1 3.69Å; T225-L229 HydrophobicContact CG2-CG 4.22Å; T225-L229 VanDerWaalsContact O-CB 3.3Å; T225-L229 WeakPolarHBondContact O-CB 3.37Å; T225-L229 WeakPolarHBondContact O-CG 3.37Å; T225-L229 PolarHBondContact O-N 3.45Å; L229-A232 PolarHBondContact O-N 3.41Å; L229-M233 WeakPolarHBondContact O-CE 3.3Å; L229-M233 VanDerWaalsContact O-CG 3.31Å; L229-M233 WeakPolarHBondContact O-CG 3.44Å; L229-M233 PolarHBondContact O-N 2.9Å
230	R	89.5	Confident	88.2	Confident	153 Å²	153	61.2 Å²	61.2	58%	0.577	31%	0.314	S	S	*	.	H	α-helix	trans	-61.7	-46.2	175.5	-65.9	-70.1	-176.2	-162.9	0.7	112.1	F131 I226 Y228 M233 V234	F131-R230 HydrophobicContact CE2-CB 4.06Å; I226-R230 VanDerWaalsContact O-CG 3.25Å; I226-R230 WeakPolarHBondContact O-CG 3.4Å; I226-R230 PolarHBondContact O-N 3.35Å; Y228-R230 VanDerWaalsContact C-N 3.27Å; Y228-R230 PolarHBondContact O-N 2.88Å; R230-M233 HydrophobicContact CG-CE 4.49Å; R230-M233 PolarHBondContact O-N 3.43Å; R230-V234 WeakPolarHBondContact O-CG2 3.34Å; R230-V234 PolarHBondContact O-N 2.93Å; R230-V234 VanDerWaalsContact O-N 3.13Å
231	L	88	Confident	87.3	Confident	4 Å²	4	63.8 Å²	63.8	2%	0.021	33%	0.332	C	S	.	.	H	α-helix	trans	-60.3	-45.7	177.2	176.7	64.2	0	0	0	112.4	R130 V134 C227 Y228 V234 V235	R130-L231 HydrophobicContact CB-CD2 3.51Å; R130-L231 HydrophobicContact CG-CD2 4.4Å; V134-L231 HydrophobicContact CB-CD1 4.32Å; V134-L231 HydrophobicContact CG2-CD1 3.54Å; C227-L231 WeakPolarHBondContact O-CB 3.39Å; C227-L231 PolarHBondContact O-N 3.16Å; Y228-L231 HydrophobicContact CD2-CD2 3.94Å; Y228-L231 HydrophobicContact CE2-CD2 3.99Å; Y228-L231 PolarHBondContact O-N 3.13Å; L231-V234 PolarHBondContact O-N 2.98Å; L231-V235 HydrophobicContact CD1-CG2 3.89Å; L231-V235 WeakPolarHBondContact O-CG2 3.27Å; L231-V235 PolarHBondContact O-N 3.41Å
232	A	87.7	Confident	86.4	Confident	31 Å²	31	65.7 Å²	65.7	26%	0.256	34%	0.339	S	S	.	.	H	α-helix	trans	-65	-42.5	-178.8	0	0	0	0	0	111.6	Y228 L229 S236	Y228-A232 HydrophobicContact CD1-CB 4.46Å; Y228-A232 HydrophobicContact CE1-CB 4.16Å; Y228-A232 VanDerWaalsContact O-CB 3.29Å; Y228-A232 WeakPolarHBondContact O-CB 3.41Å; Y228-A232 PolarHBondContact O-N 2.98Å; L229-A232 PolarHBondContact O-N 3.41Å; A232-S236 WeakPolarHBondContact O-CB 3.5Å; A232-S236 PolarHBondContact O-N 3.47Å; A232-S236 PolarHBondContact O-OG 2.68Å
233	M	87.7	Confident	85.4	Confident	103 Å²	103	66.1 Å²	66.1	51%	0.507	34%	0.338	S	S	.	.	H	α-helix	trans	-61.7	-44.4	176	-72.9	-173.9	-68.7	0	0	112.3	L229 R230 S236 K237	L229-M233 WeakPolarHBondContact O-CE 3.3Å; L229-M233 VanDerWaalsContact O-CG 3.31Å; L229-M233 WeakPolarHBondContact O-CG 3.44Å; L229-M233 PolarHBondContact O-N 2.9Å; R230-M233 HydrophobicContact CG-CE 4.49Å; R230-M233 PolarHBondContact O-N 3.43Å; M233-S236 PolarHBondContact O-OG 3.42Å; M233-K237 PolarHBondContact O-N 3.33Å
234	V	86.3	Confident	84.5	Confident	55 Å²	55	66.2 Å²	66.2	33%	0.333	34%	0.336	S	S	.	.	H	α-helix	trans	-69.8	-45.1	-177.6	170.6	0	0	0	0	111.9	V134 F135 R230 L231 K237 E238	V134-V234 HydrophobicContact CG1-CG1 3.85Å; F135-V234 HydrophobicContact CE1-CG1 4.14Å; F135-V234 HydrophobicContact CE1-CG2 4.23Å; F135-V234 HydrophobicContact CE2-CG2 4.45Å; F135-V234 HydrophobicContact CZ-CB 3.96Å; F135-V234 HydrophobicContact CZ-CG1 3.78Å; F135-V234 HydrophobicContact CZ-CG2 3.51Å; R230-V234 WeakPolarHBondContact O-CG2 3.34Å; R230-V234 PolarHBondContact O-N 2.93Å; R230-V234 VanDerWaalsContact O-N 3.13Å; L231-V234 PolarHBondContact O-N 2.98Å; V234-K237 PolarHBondContact O-N 3.17Å; V234-E238 PolarHBondContact O-N 3.49Å
235	V	85.1	Confident	83.4	Confident	5 Å²	5	69.7 Å²	69.7	3%	0.03	36%	0.36	C	S	.	.	H	α-helix	trans	-77.4	-29	-177.1	-177.6	0	0	0	0	112.2	V134 L231 K237 E238 I239 K302 I306	V134-V235 HydrophobicContact CG1-CG2 4.32Å; V134-V235 HydrophobicContact CG2-CG2 3.76Å; L231-V235 HydrophobicContact CD1-CG2 3.89Å; L231-V235 WeakPolarHBondContact O-CG2 3.27Å; L231-V235 PolarHBondContact O-N 3.41Å; V235-K237 VanDerWaalsContact C-N 3.31Å; V235-K237 PolarHBondContact O-N 3.35Å; V235-E238 PolarHBondContact O-N 3.43Å; V235-I239 HydrophobicContact CG1-CD1 3.7Å; V235-I239 HydrophobicContact CG1-CG1 3.93Å; V235-I239 WeakPolarHBondContact O-CB 3.21Å; V235-I239 VanDerWaalsContact O-CG1 3.26Å; V235-I239 WeakPolarHBondContact O-CG1 3.34Å; V235-I239 PolarHBondContact O-N 3.13Å; V235-K302 HydrophobicContact CG1-CB 4.5Å; V235-I306 HydrophobicContact CB-CD1 3.33Å; V235-I306 HydrophobicContact CG1-CD1 3.17Å; V235-I306 HydrophobicContact CG1-CG1 4.48Å; V235-I306 HydrophobicContact CG2-CD1 3.9Å
236	S	85.4	Confident	82.5	Confident	69 Å²	69	68.7 Å²	68.7	48%	0.483	35%	0.354	S	S	.	.	H	α-helix	trans	-61.7	-41.4	171.5	54.2	0	0	0	0	111.4	A232 M233 Y240	A232-S236 WeakPolarHBondContact O-CB 3.5Å; A232-S236 PolarHBondContact O-N 3.47Å; A232-S236 PolarHBondContact O-OG 2.68Å; M233-S236 PolarHBondContact O-OG 3.42Å; S236-Y240 WeakPolarHBondContact O-CB 3.39Å; S236-Y240 PolarHBondContact O-N 2.94Å
237	K	85.3	Confident	81.5	Confident	153 Å²	153	70.9 Å²	70.9	67%	0.665	36%	0.359	S	S	*	.	H	α-helix	trans	-61.1	-46	171.9	-173.3	179.1	179.9	179.6	0	112.1	M233 V234 V235 Y240 C241	M233-K237 PolarHBondContact O-N 3.33Å; V234-K237 PolarHBondContact O-N 3.17Å; V235-K237 VanDerWaalsContact C-N 3.31Å; V235-K237 PolarHBondContact O-N 3.35Å; K237-Y240 PolarHBondContact O-N 3.15Å; K237-C241 PolarHBondContact O-N 3.5Å; K237-C241 VanDerWaalsContact O-N 3.09Å; K237-C241 PolarHBondContact O-SG 3Å; K237-C241 VanDerWaalsContact O-SG 3.37Å
238	E	81.8	Confident	80.5	Confident	69 Å²	69	76.4 Å²	76.4	32%	0.322	38%	0.383	S	S	.	.	H	α-helix	trans	-63.7	-44.3	179.3	-168.2	-176.1	-176.9	0	0	112.4	V234 V235 Y240 C241 E242 K302	V234-E238 PolarHBondContact O-N 3.49Å; V235-E238 PolarHBondContact O-N 3.43Å; E238-Y240 VanDerWaalsContact C-N 3.28Å; E238-Y240 PolarHBondContact O-N 3.14Å; E238-C241 PolarHBondContact O-N 3.43Å; E238-E242 PolarHBondContact O-N 3.28Å; E238-K302 VanDerWaalsContact CD-NZ 3.27Å; E238-K302 IonicContact OE1-NZ 3.68Å; E238-K302 PolarHBondContact OE1-NZ 3.05Å; E238-K302 IonicContact OE2-NZ 2.73Å
239	I	79.1	Confident	79.6	Confident	42 Å²	42	77.8 Å²	77.8	22%	0.215	40%	0.395	C	S	.	.	H	α-helix	trans	-63.2	-37.3	176.9	-70.3	170.9	0	0	0	110.7	V235 C243 M299 R303	V235-I239 HydrophobicContact CG1-CD1 3.7Å; V235-I239 HydrophobicContact CG1-CG1 3.93Å; V235-I239 WeakPolarHBondContact O-CB 3.21Å; V235-I239 VanDerWaalsContact O-CG1 3.26Å; V235-I239 WeakPolarHBondContact O-CG1 3.34Å; V235-I239 PolarHBondContact O-N 3.13Å; I239-C243 WeakPolarHBondContact O-CB 3.24Å; I239-C243 PolarHBondContact O-N 3.48Å; I239-C243 VanDerWaalsContact O-N 3.15Å; I239-C243 PolarHBondContact O-SG 3.43Å; I239-M299 HydrophobicContact CB-CE 4.34Å; I239-M299 HydrophobicContact CB-SD 4.39Å; I239-M299 HydrophobicContact CG1-SD 3.99Å; I239-M299 HydrophobicContact CG2-CE 4.07Å; I239-M299 HydrophobicContact CG2-SD 4.45Å; I239-M299 WeakPolarHBondContact O-CE 3.39Å; I239-R303 HydrophobicContact CD1-CB 4.37Å
240	Y	77.4	Confident	78.5	Confident	147 Å²	147	79.1 Å²	79.1	58%	0.576	40%	0.398	S	S	*	.	H	α-helix	trans	-64	-50.2	177.1	-177.7	-90	0	0	0	111.2	S236 K237 E238 C243 E244	S236-Y240 WeakPolarHBondContact O-CB 3.39Å; S236-Y240 PolarHBondContact O-N 2.94Å; K237-Y240 PolarHBondContact O-N 3.15Å; E238-Y240 VanDerWaalsContact C-N 3.28Å; E238-Y240 PolarHBondContact O-N 3.14Å; Y240-C243 WeakPolarHBondContact O-CB 3.39Å; Y240-C243 PolarHBondContact O-N 3.36Å; Y240-E244 HydrophobicContact CE1-CG 4.13Å; Y240-E244 WeakPolarHBondContact CE1-OE1 3.47Å; Y240-E244 PolarHBondContact O-N 2.85Å; Y240-E244 VanDerWaalsContact O-N 3.15Å; Y240-E244 PolarHBondContact OH-OE1 3.22Å
241	C	76.4	Confident	77.1	Confident	58 Å²	58	75.7 Å²	75.7	39%	0.392	40%	0.398	S	S	.	.	H	α-helix	trans	-63.4	-44.6	179.9	-65	0	0	0	0	113.1	K237 E238 C243 E244 C245	K237-C241 PolarHBondContact O-N 3.5Å; K237-C241 VanDerWaalsContact O-N 3.09Å; K237-C241 PolarHBondContact O-SG 3Å; K237-C241 VanDerWaalsContact O-SG 3.37Å; E238-C241 PolarHBondContact O-N 3.43Å; C241-C243 VanDerWaalsContact C-N 3.29Å; C241-C243 PolarHBondContact O-N 2.7Å; C241-E244 PolarHBondContact O-N 3.38Å; C241-C245 PolarHBondContact O-N 2.93Å; C241-C245 VanDerWaalsContact O-N 3.08Å; C241-C245 PolarHBondContact O-SG 2.62Å; C241-C245 VanDerWaalsContact O-SG 3.33Å
242	E	75.8	Confident	75.4	Confident	49 Å²	49	80.2 Å²	80.2	23%	0.229	43%	0.426	C	S	.	.	H	α-helix	trans	-64	-34.3	177.3	-80.3	-174.8	-143.6	0	0	111.5	E238 C245 V246 M299 K302	E238-E242 PolarHBondContact O-N 3.28Å; E242-C245 PolarHBondContact O-N 3.36Å; E242-V246 WeakPolarHBondContact O-CG2 3.44Å; E242-V246 PolarHBondContact O-N 3.47Å; E242-V246 VanDerWaalsContact O-N 3.17Å; E242-M299 HydrophobicContact CB-CE 3.19Å; E242-M299 HydrophobicContact CB-SD 3.95Å; E242-M299 VanDerWaalsContact CD-SD 3.58Å; E242-M299 HydrophobicContact CG-CE 4.2Å; E242-M299 HydrophobicContact CG-SD 4.37Å; E242-M299 WeakPolarHBondContact OE2-CG 3.18Å; E242-K302 IonicContact OE1-NZ 2.64Å; E242-K302 PolarHBondContact OE1-NZ 2.98Å
243	C	74	Confident	73.3	Confident	58 Å²	58	83.5 Å²	83.5	39%	0.392	45%	0.445	S	S	.	.	H	α-helix	trans	-65.1	-36.7	174.1	-72.1	0	0	0	0	112.6	I239 Y240 C241 K247	I239-C243 WeakPolarHBondContact O-CB 3.24Å; I239-C243 PolarHBondContact O-N 3.48Å; I239-C243 VanDerWaalsContact O-N 3.15Å; I239-C243 PolarHBondContact O-SG 3.43Å; Y240-C243 WeakPolarHBondContact O-CB 3.39Å; Y240-C243 PolarHBondContact O-N 3.36Å; C241-C243 VanDerWaalsContact C-N 3.29Å; C241-C243 PolarHBondContact O-N 2.7Å; C243-K247 WeakPolarHBondContact O-CG 3.35Å; C243-K247 PolarHBondContact O-N 2.95Å
244	E	73.9	Confident	71.5	Confident	91 Å²	91	86.5 Å²	86.5	43%	0.425	46%	0.462	S	S	.	.	H	α-helix	trans	-67	-43.9	175	-72.7	-174.4	155.6	0	0	111.7	Y240 C241 V246 K247 Q248	Y240-E244 HydrophobicContact CE1-CG 4.13Å; Y240-E244 WeakPolarHBondContact CE1-OE1 3.47Å; Y240-E244 PolarHBondContact O-N 2.85Å; Y240-E244 VanDerWaalsContact O-N 3.15Å; Y240-E244 PolarHBondContact OH-OE1 3.22Å; C241-E244 PolarHBondContact O-N 3.38Å; E244-V246 VanDerWaalsContact C-N 3.3Å; E244-V246 PolarHBondContact O-N 3.34Å; E244-K247 WeakPolarHBondContact O-CB 3.42Å; E244-K247 PolarHBondContact O-N 2.86Å; E244-K247 VanDerWaalsContact O-N 3.12Å; E244-Q248 PolarHBondContact O-N 2.94Å
245	C	71	Confident	69.6	Low	76 Å²	76	90.1 Å²	90.1	51%	0.514	48%	0.484	S	S	.	.	H	α-helix	trans	-59.7	-38.8	176.9	-62.9	0	0	0	0	112.7	C241 E242 Q248 S249	C241-C245 PolarHBondContact O-N 2.93Å; C241-C245 VanDerWaalsContact O-N 3.08Å; C241-C245 PolarHBondContact O-SG 2.62Å; C241-C245 VanDerWaalsContact O-SG 3.33Å; E242-C245 PolarHBondContact O-N 3.36Å; C245-Q248 PolarHBondContact O-N 3.39Å; C245-S249 PolarHBondContact O-N 3.02Å; C245-S249 VanDerWaalsContact O-N 3.11Å
246	V	71.3	Confident	67.6	Low	34 Å²	34	96.4 Å²	96.4	21%	0.206	52%	0.518	C	S	.	.	H	α-helix	trans	-68.1	-35.2	176.9	173	0	0	0	0	112	E242 E244 Q248 S249 Q250	E242-V246 WeakPolarHBondContact O-CG2 3.44Å; E242-V246 PolarHBondContact O-N 3.47Å; E242-V246 VanDerWaalsContact O-N 3.17Å; E244-V246 VanDerWaalsContact C-N 3.3Å; E244-V246 PolarHBondContact O-N 3.34Å; V246-Q248 VanDerWaalsContact C-N 3.35Å; V246-S249 PolarHBondContact O-OG 3.04Å; V246-S249 VanDerWaalsContact O-OG 3.07Å; V246-Q250 WeakPolarHBondContact O-CG 3.28Å; V246-Q250 PolarHBondContact O-N 3.46Å
247	K	70.6	Confident	65.5	Low	152 Å²	152	96.6 Å²	96.6	66%	0.661	53%	0.53	S	S	*	.	H	α-helix	trans	-66.4	-41.2	173.7	-72	176.3	-178.8	-179.5	0	110.9	C243 E244 Q250 S251	C243-K247 WeakPolarHBondContact O-CG 3.35Å; C243-K247 PolarHBondContact O-N 2.95Å; E244-K247 WeakPolarHBondContact O-CB 3.42Å; E244-K247 PolarHBondContact O-N 2.86Å; E244-K247 VanDerWaalsContact O-N 3.12Å; K247-Q250 PolarHBondContact O-N 3.4Å; K247-S251 PolarHBondContact O-N 2.99Å; K247-S251 VanDerWaalsContact O-N 3.15Å; K247-S251 PolarHBondContact O-OG 2.88Å
248	Q	69.2	Low	63.2	Low	138 Å²	138	96.4 Å²	96.4	65%	0.645	54%	0.537	S	S	*	.	H	α-helix	trans	-65.1	-40.9	-178.4	-162.8	173.8	11.2	0	0	112.5	E244 C245 V246 Q250 S251 T252	E244-Q248 PolarHBondContact O-N 2.94Å; C245-Q248 PolarHBondContact O-N 3.39Å; V246-Q248 VanDerWaalsContact C-N 3.35Å; Q248-Q250 VanDerWaalsContact C-N 3.34Å; Q248-Q250 PolarHBondContact O-N 3.24Å; Q248-S251 WeakPolarHBondContact CA-OG 3.49Å; Q248-S251 PolarHBondContact O-N 2.83Å; Q248-S251 PolarHBondContact O-OG 3.3Å; Q248-T252 PolarHBondContact O-N 2.91Å; Q248-T252 PolarHBondContact O-OG1 3.43Å
249	S	67.3	Low	61	Low	44 Å²	44	101.4 Å²	101.4	31%	0.308	56%	0.562	S	S	.	*	H	α-helix	trans	-66.1	-33.5	177.2	60	0	0	0	0	113.4	C245 V246 T252	C245-S249 PolarHBondContact O-N 3.02Å; C245-S249 VanDerWaalsContact O-N 3.11Å; V246-S249 PolarHBondContact O-OG 3.04Å; V246-S249 VanDerWaalsContact O-OG 3.07Å; S249-T252 PolarHBondContact O-OG1 2.93Å
250	Q	65.1	Low	59	Low	130 Å²	130	104.1 Å²	104.1	61%	0.607	59%	0.585	S	S	*	*	H	α-helix	trans	-73.1	-29	175.9	-69.6	177.9	13.9	0	0	113.2	V246 K247 Q248	V246-Q250 WeakPolarHBondContact O-CG 3.28Å; V246-Q250 PolarHBondContact O-N 3.46Å; K247-Q250 PolarHBondContact O-N 3.4Å; Q248-Q250 VanDerWaalsContact C-N 3.34Å; Q248-Q250 PolarHBondContact O-N 3.24Å
251	S	60.9	Low	57	Low	81 Å²	81	102.4 Å²	102.4	57%	0.566	59%	0.594	S	S	*	*	H	α-helix	trans	-79.8	-13.7	-179	53.8	0	0	0	0	114.6	K247 Q248 P253	K247-S251 PolarHBondContact O-N 2.99Å; K247-S251 VanDerWaalsContact O-N 3.15Å; K247-S251 PolarHBondContact O-OG 2.88Å; Q248-S251 WeakPolarHBondContact CA-OG 3.49Å; Q248-S251 PolarHBondContact O-N 2.83Å; Q248-S251 PolarHBondContact O-OG 3.3Å; S251-P253 WeakPolarHBondContact O-CD 3.32Å; S251-P253 VanDerWaalsContact O-N 3.12Å
252	T	52.5	Low	55	Low	100 Å²	100	105 Å²	105	61%	0.613	61%	0.608	S	S	*	*	S	Bend	trans	-65.8	108.4	173.4	-1.9	0	0	0	0	109	Q248 S249 L254	Q248-T252 PolarHBondContact O-N 2.91Å; Q248-T252 PolarHBondContact O-OG1 3.43Å; S249-T252 PolarHBondContact O-OG1 2.93Å; T252-L254 PolarHBondContact O-N 3.04Å
253	P	44.1	Very low	53.1	Low	100 Å²	100	109.4 Å²	109.4	65%	0.649	63%	0.634	S	S	*	*			trans	-63.8	137.4	175.5	-12.3	28.9	0	0	0	107.1	S251 T255	S251-P253 WeakPolarHBondContact O-CD 3.32Å; S251-P253 VanDerWaalsContact O-N 3.12Å; P253-T255 PolarHBondContact O-N 3.25Å
254	L	49.5	Very low	51.2	Low	165 Å²	165	115.2 Å²	115.2	86%	0.864	66%	0.655	S	S	*	*			trans	-54.6	96.9	152.7	-76.8	156.8	0	0	0	104.8	T252 N256	T252-L254 PolarHBondContact O-N 3.04Å; L254-N256 VanDerWaalsContact C-N 3.28Å; L254-N256 PolarHBondContact O-N 3.12Å
255	T	45.6	Very low	49.2	Very low	132 Å²	132	119 Å²	119	81%	0.81	67%	0.673	S	S	*	*			trans	-58.7	105.7	172.4	-13.4	0	0	0	0	104	P253 G257	P253-T255 PolarHBondContact O-N 3.25Å; T255-G257 VanDerWaalsContact C-N 3.31Å; T255-G257 PolarHBondContact O-N 3.17Å
256	N	42.3	Very low	47.5	Very low	137 Å²	137	121 Å²	121	73%	0.733	68%	0.682	S	S	*	*			trans	-47.3	108.3	166.6	-84.7	-17.5	0	0	0	104.6	L254 N258	L254-N256 VanDerWaalsContact C-N 3.28Å; L254-N256 PolarHBondContact O-N 3.12Å; N256-N258 PolarHBondContact O-N 3.48Å
257	G	41.4	Very low	45.8	Very low	72 Å²	72	125.5 Å²	125.5	74%	0.742	71%	0.71	S	S	*	*			trans	-59.4	93	162.8	0	0	0	0	0	104.7	T255 M259	T255-G257 VanDerWaalsContact C-N 3.31Å; T255-G257 PolarHBondContact O-N 3.17Å; G257-M259 PolarHBondContact O-N 3.06Å
258	N	37.5	Very low	44.7	Very low	149 Å²	149	124.5 Å²	124.5	80%	0.797	72%	0.722	S	S	*	*			trans	-59.3	88.4	152.5	-80.8	2.5	0	0	0	103.6	N256 S260	N256-N258 PolarHBondContact O-N 3.48Å; N258-S260 PolarHBondContact O-N 3.42Å
259	M	36.6	Very low	43.5	Very low	175 Å²	175	120.4 Å²	120.4	86%	0.862	72%	0.716	S	S	*	*			trans	-62.7	88.8	164.3	-170.6	95.3	75.3	0	0	104	G257 S261	G257-M259 PolarHBondContact O-N 3.06Å; M259-S261 PolarHBondContact O-N 3.25Å
260	S	35.8	Very low	42.3	Very low	98 Å²	98	127.5 Å²	127.5	69%	0.685	74%	0.736	S	S	*	*			trans	-57	106.9	167.9	47.8	0	0	0	0	106.3	N258 T262	N258-S260 PolarHBondContact O-N 3.42Å; S260-T262 PolarHBondContact O-N 3.3Å; S260-T262 VanDerWaalsContact O-N 3.1Å
261	S	37	Very low	41.2	Very low	112 Å²	112	132.1 Å²	132.1	78%	0.783	75%	0.748	S	S	*	*			trans	-69.4	93.8	-179.3	43.8	0	0	0	0	110.3	M259	M259-S261 PolarHBondContact O-N 3.25Å
262	T	33.8	Very low	40.4	Very low	111 Å²	111	134.7 Å²	134.7	68%	0.681	76%	0.755	S	S	*	*			trans	-167.6	105.9	160.3	26.4	0	0	0	0	102.8	S260	S260-T262 PolarHBondContact O-N 3.3Å; S260-T262 VanDerWaalsContact O-N 3.1Å
263	D	35.8	Very low	39.9	Very low	143 Å²	143	134.9 Å²	134.9	77%	0.765	75%	0.752	S	S	*	*				-147.1	144.7	55.3	-75.2	-44.7	0	0	0	113.6	H265	D263-H265 PolarHBondContact O-N 3.31Å
264	Q	33.1	Very low	39.8	Very low	180 Å²	180	133.3 Å²	133.3	84%	0.841	74%	0.743	S	S	*	*			trans	-68.4	115.6	162.2	-63.6	172.4	-13.5	0	0	108.4
265	H	32.2	Very low	39.2	Very low	171 Å²	171	135.3 Å²	135.3	79%	0.792	74%	0.739	S	S	*	*				167.7	156.1	128.7	-106.2	-102.1	0	0	0	111.1	D263	D263-H265 PolarHBondContact O-N 3.31Å
266	V	35.9	Very low	39.1	Very low	118 Å²	118	133.6 Å²	133.6	72%	0.715	72%	0.724	S	S	*	*			trans	92.2	90.6	173	-160.2	0	0	0	0	116.1
267	T	35.5	Very low	39.4	Very low	128 Å²	128	132.1 Å²	132.1	79%	0.785	72%	0.715	S	S	*	*			trans	-31.7	149.3	159	41.6	0	0	0	0	119.6	G269	T267-G269 PolarHBondContact O-N 3Å
268	S	48.1	Very low	39.5	Very low	130 Å²	130	132.3 Å²	132.3	91%	0.909	71%	0.705	S	S	*	*	S	Bend	trans	76.7	-0.9	149.6	-149.4	0	0	0	0	122.3
269	G	43.6	Very low	39.9	Very low	52 Å²	52	131.8 Å²	131.8	54%	0.536	70%	0.696	S	S	.	*	S	Bend	trans	-96.7	-13	171.3	0	0	0	0	0	116.3	T267 R271	T267-G269 PolarHBondContact O-N 3Å; G269-R271 PolarHBondContact O-N 3.36Å
270	R	41.3	Very low	40.7	Very low	193 Å²	193	127 Å²	127	73%	0.728	68%	0.679	S	S	*	*	H	α-helix	trans	-76.7	-17.9	-162.4	-76.9	-175.6	177.5	-172.1	-0.1	116.8	S274	R270-S274 WeakPolarHBondContact O-CB 3.37Å; R270-S274 PolarHBondContact O-N 3.31Å; R270-S274 VanDerWaalsContact O-N 3.12Å; R270-S274 PolarHBondContact O-OG 2.97Å
271	R	41.7	Very low	41.5	Very low	228 Å²	228	126.1 Å²	126.1	86%	0.86	67%	0.673	S	S	*	*	H	α-helix	trans	-72.7	-29.9	-178.4	-72.5	-171.7	-161.1	166.6	6.6	113.4	G269 S274	G269-R271 PolarHBondContact O-N 3.36Å; R271-S274 PolarHBondContact O-OG 3.04Å
272	L	44.4	Very low	42.5	Very low	135 Å²	135	124.6 Å²	124.6	71%	0.707	66%	0.663	S	S	*	*	H	α-helix	trans	-81.6	-39.4	178.1	-127.8	134.9	0	0	0	111.1	R275 I276	L272-R275 PolarHBondContact O-N 3.49Å; L272-I276 HydrophobicContact CD2-CD1 4.09Å; L272-I276 WeakPolarHBondContact O-CG1 3.4Å; L272-I276 PolarHBondContact O-N 3.42Å
273	L	42	Very low	44	Very low	104 Å²	104	122.8 Å²	122.8	55%	0.545	65%	0.649	S	S	.	*	H	α-helix	trans	-67.6	-36.8	179.2	-122.8	147.7	0	0	0	112.9	R275 I276 I277	L273-R275 PolarHBondContact O-N 2.9Å; L273-I276 PolarHBondContact O-N 3.45Å; L273-I277 HydrophobicContact CD2-CD1 3.69Å; L273-I277 HydrophobicContact CD2-CG1 4.13Å; L273-I277 WeakPolarHBondContact O-CD1 3.48Å; L273-I277 VanDerWaalsContact O-CG1 3.24Å; L273-I277 WeakPolarHBondContact O-CG1 3.32Å; L273-I277 PolarHBondContact O-N 3.36Å
274	S	42.6	Very low	45.6	Very low	67 Å²	67	119.3 Å²	119.3	47%	0.469	64%	0.636	S	S	.	*	H	α-helix	trans	-66.8	-31.9	176.1	51.4	0	0	0	0	113.8	R270 R271 S278	R270-S274 WeakPolarHBondContact O-CB 3.37Å; R270-S274 PolarHBondContact O-N 3.31Å; R270-S274 VanDerWaalsContact O-N 3.12Å; R270-S274 PolarHBondContact O-OG 2.97Å; R271-S274 PolarHBondContact O-OG 3.04Å; S274-S278 PolarHBondContact O-N 3Å; S274-S278 PolarHBondContact O-OG 3.42Å
275	R	37.8	Very low	47.6	Very low	206 Å²	206	111.9 Å²	111.9	78%	0.777	61%	0.607	S	S	*	*	H	α-helix	trans	-72.7	-33.6	171.2	-79.3	-175.3	176.8	174.7	-0.6	112.7	L272 L273 S278 F279	L272-R275 PolarHBondContact O-N 3.49Å; L273-R275 PolarHBondContact O-N 2.9Å; R275-S278 PolarHBondContact O-OG 2.92Å; R275-F279 WeakPolarHBondContact O-CB 2.98Å; R275-F279 PolarHBondContact O-N 3.45Å
276	I	43.6	Very low	49.8	Very low	97 Å²	97	112.6 Å²	112.6	50%	0.497	60%	0.603	S	S	.	*	H	α-helix	trans	-71.1	-40.5	176.6	-65.2	165.5	0	0	0	111	L272 L273 F279 S280	L272-I276 HydrophobicContact CD2-CD1 4.09Å; L272-I276 WeakPolarHBondContact O-CG1 3.4Å; L272-I276 PolarHBondContact O-N 3.42Å; L273-I276 PolarHBondContact O-N 3.45Å; I276-F279 PolarHBondContact O-N 3.18Å; I276-S280 PolarHBondContact O-N 3.09Å; I276-S280 VanDerWaalsContact O-N 3.13Å; I276-S280 PolarHBondContact O-OG 3.2Å
277	I	47.4	Very low	51.9	Low	106 Å²	106	114.6 Å²	114.6	54%	0.544	60%	0.603	S	S	.	*	H	α-helix	trans	-67.3	-41.2	-179.9	-66.4	163.6	0	0	0	111.6	L273 F279 S280 S281	L273-I277 HydrophobicContact CD2-CD1 3.69Å; L273-I277 HydrophobicContact CD2-CG1 4.13Å; L273-I277 WeakPolarHBondContact O-CD1 3.48Å; L273-I277 VanDerWaalsContact O-CG1 3.24Å; L273-I277 WeakPolarHBondContact O-CG1 3.32Å; L273-I277 PolarHBondContact O-N 3.36Å; I277-F279 VanDerWaalsContact C-N 3.35Å; I277-F279 PolarHBondContact O-N 3.39Å; I277-S280 PolarHBondContact O-N 3.44Å; I277-S281 PolarHBondContact O-N 2.91Å
278	S	43.5	Very low	54	Low	75 Å²	75	113 Å²	113	52%	0.524	59%	0.586	S	S	.	*	H	α-helix	trans	-69.6	-30	177.6	42.3	0	0	0	0	113	S274 R275 S282	S274-S278 PolarHBondContact O-N 3Å; S274-S278 PolarHBondContact O-OG 3.42Å; R275-S278 PolarHBondContact O-OG 2.92Å; S278-S282 PolarHBondContact O-N 2.97Å
279	F	46.7	Very low	55.5	Low	139 Å²	139	114 Å²	114	61%	0.61	57%	0.574	S	S	*	*	H	α-helix	trans	-70.2	-39.7	173.1	-168.5	-102.9	0	0	0	112.8	R275 I276 I277 S282 N283	R275-F279 WeakPolarHBondContact O-CB 2.98Å; R275-F279 PolarHBondContact O-N 3.45Å; I276-F279 PolarHBondContact O-N 3.18Å; I277-F279 VanDerWaalsContact C-N 3.35Å; I277-F279 PolarHBondContact O-N 3.39Å; F279-S282 PolarHBondContact O-N 3.3Å; F279-N283 WeakPolarHBondContact CE1-ND2 3.34Å; F279-N283 PolarHBondContact O-N 3.05Å
280	S	52	Low	57.3	Low	73 Å²	73	114 Å²	114	51%	0.51	57%	0.569	S	S	.	*	H	α-helix	trans	-66.4	-38.6	179.2	-75.3	0	0	0	0	113.6	I276 I277 N283 S284	I276-S280 PolarHBondContact O-N 3.09Å; I276-S280 VanDerWaalsContact O-N 3.13Å; I276-S280 PolarHBondContact O-OG 3.2Å; I277-S280 PolarHBondContact O-N 3.44Å; S280-N283 PolarHBondContact O-N 3.49Å; S280-S284 PolarHBondContact O-N 3.3Å
281	S	53.8	Low	59.3	Low	80 Å²	80	107.3 Å²	107.3	56%	0.559	55%	0.552	S	S	*	*	H	α-helix	trans	-68.1	-35.7	178	-171.8	0	0	0	0	112.6	I277 N283 S284 G285	I277-S281 PolarHBondContact O-N 2.91Å; S281-N283 VanDerWaalsContact C-N 3.34Å; S281-N283 PolarHBondContact O-N 3.24Å; S281-S284 PolarHBondContact O-OG 3.21Å; S281-G285 PolarHBondContact O-N 3.13Å
282	S	57.5	Low	61.2	Low	81 Å²	81	98.5 Å²	98.5	57%	0.566	52%	0.521	S	S	*	.	H	α-helix	trans	-68.3	-33.6	174.1	-174.8	0	0	0	0	112.6	S278 F279 R286	S278-S282 PolarHBondContact O-N 2.97Å; F279-S282 PolarHBondContact O-N 3.3Å; S282-R286 WeakPolarHBondContact O-CB 3.33Å; S282-R286 PolarHBondContact O-N 2.95Å
283	N	66.2	Low	62.9	Low	72 Å²	72	100.6 Å²	100.6	39%	0.385	52%	0.52	S	S	.	.	H	α-helix	trans	-75.2	-38.8	179	-83.3	-15.5	0	0	0	112.6	F279 S280 S281 R286 F287	F279-N283 WeakPolarHBondContact CE1-ND2 3.34Å; F279-N283 PolarHBondContact O-N 3.05Å; S280-N283 PolarHBondContact O-N 3.49Å; S281-N283 VanDerWaalsContact C-N 3.34Å; S281-N283 PolarHBondContact O-N 3.24Å; N283-R286 PolarHBondContact O-N 2.95Å; N283-F287 WeakPolarHBondContact O-CB 3.14Å; N283-F287 PolarHBondContact O-N 3.37Å
284	S	69.6	Low	64.7	Low	70 Å²	70	101.6 Å²	101.6	49%	0.49	52%	0.522	S	S	.	.	H	α-helix	trans	-61.8	-47.8	176	61.6	0	0	0	0	111.1	S280 S281 R286 F287 E288	S280-S284 PolarHBondContact O-N 3.3Å; S281-S284 PolarHBondContact O-OG 3.21Å; S284-R286 VanDerWaalsContact C-N 3.3Å; S284-R286 PolarHBondContact O-N 2.87Å; S284-F287 PolarHBondContact O-N 2.9Å; S284-E288 WeakPolarHBondContact O-CB 3.17Å; S284-E288 PolarHBondContact O-N 3.09Å
285	G	74	Confident	66.7	Low	24 Å²	24	101.8 Å²	101.8	25%	0.247	52%	0.515	C	S	.	.	H	α-helix	trans	-63.6	-32.8	176.7	0	0	0	0	0	113.4	S281 K289	S281-G285 PolarHBondContact O-N 3.13Å; G285-K289 WeakPolarHBondContact O-CB 3.3Å; G285-K289 WeakPolarHBondContact O-CG 3.36Å; G285-K289 PolarHBondContact O-N 2.93Å; G285-K289 VanDerWaalsContact O-N 3.08Å
286	R	78.4	Confident	68.8	Low	187 Å²	187	96 Å²	96	71%	0.706	51%	0.505	S	S	*	.	H	α-helix	trans	-71	-42.3	174.7	-172	177.9	-177.8	-179.6	1.4	112	S282 N283 S284 A290	S282-R286 WeakPolarHBondContact O-CB 3.33Å; S282-R286 PolarHBondContact O-N 2.95Å; N283-R286 PolarHBondContact O-N 2.95Å; S284-R286 VanDerWaalsContact C-N 3.3Å; S284-R286 PolarHBondContact O-N 2.87Å; R286-A290 WeakPolarHBondContact O-CB 3.17Å; R286-A290 PolarHBondContact O-N 3.4Å
287	F	80.2	Confident	70.6	Confident	159 Å²	159	94.3 Å²	94.3	70%	0.697	50%	0.499	S	S	*	.	H	α-helix	trans	-64.9	-43.2	176.9	-176.4	-98.1	0	0	0	111.4	N283 S284 A290 S291	N283-F287 WeakPolarHBondContact O-CB 3.14Å; N283-F287 PolarHBondContact O-N 3.37Å; S284-F287 PolarHBondContact O-N 2.9Å; F287-A290 PolarHBondContact O-N 2.97Å; F287-S291 WeakPolarHBondContact O-CB 3.31Å; F287-S291 PolarHBondContact O-N 3.42Å
288	E	80.4	Confident	72.2	Confident	94 Å²	94	91.1 Å²	91.1	44%	0.439	49%	0.485	S	S	.	.	H	α-helix	trans	-61.8	-49.9	176.4	-172.7	-178.8	177.8	0	0	111.8	S284 A290 S291 I292	S284-E288 WeakPolarHBondContact O-CB 3.17Å; S284-E288 PolarHBondContact O-N 3.09Å; E288-A290 VanDerWaalsContact C-N 3.25Å; E288-A290 PolarHBondContact O-N 3.07Å; E288-S291 WeakPolarHBondContact O-CB 3.46Å; E288-S291 PolarHBondContact O-N 2.79Å; E288-S291 VanDerWaalsContact O-N 3.13Å; E288-I292 HydrophobicContact CG-CD1 4Å; E288-I292 WeakPolarHBondContact O-CG1 3.32Å; E288-I292 PolarHBondContact O-N 3.04Å
289	K	79.5	Confident	74	Confident	153 Å²	153	88.8 Å²	88.8	67%	0.665	47%	0.466	S	S	*	.	H	α-helix	trans	-57.8	-38	174.5	-74.4	174	-176	178.5	0	112.2	G285 R293	G285-K289 WeakPolarHBondContact O-CB 3.3Å; G285-K289 WeakPolarHBondContact O-CG 3.36Å; G285-K289 PolarHBondContact O-N 2.93Å; G285-K289 VanDerWaalsContact O-N 3.08Å; K289-R293 VanDerWaalsContact O-CB 3.31Å; K289-R293 WeakPolarHBondContact O-CB 3.43Å; K289-R293 PolarHBondContact O-N 3.4Å; K289-R293 VanDerWaalsContact O-N 3.08Å
290	A	81.6	Confident	75.6	Confident	52 Å²	52	89.7 Å²	89.7	43%	0.43	47%	0.465	S	S	.	.	H	α-helix	trans	-68.6	-41.2	176.6	0	0	0	0	0	112.2	R286 F287 E288 R293 H294	R286-A290 WeakPolarHBondContact O-CB 3.17Å; R286-A290 PolarHBondContact O-N 3.4Å; F287-A290 PolarHBondContact O-N 2.97Å; E288-A290 VanDerWaalsContact C-N 3.25Å; E288-A290 PolarHBondContact O-N 3.07Å; A290-R293 PolarHBondContact O-N 3.11Å; A290-H294 WeakPolarHBondContact O-CB 3.47Å; A290-H294 PolarHBondContact O-N 3.03Å
291	S	83.2	Confident	77	Confident	51 Å²	51	94.6 Å²	94.6	36%	0.357	47%	0.473	S	S	.	.	H	α-helix	trans	-62.5	-49.5	176	-176.3	0	0	0	0	111.9	F287 E288 R293 H294 Q295	F287-S291 WeakPolarHBondContact O-CB 3.31Å; F287-S291 PolarHBondContact O-N 3.42Å; E288-S291 WeakPolarHBondContact O-CB 3.46Å; E288-S291 PolarHBondContact O-N 2.79Å; E288-S291 VanDerWaalsContact O-N 3.13Å; S291-R293 VanDerWaalsContact C-N 3.31Å; S291-R293 PolarHBondContact O-N 3.43Å; S291-H294 WeakPolarHBondContact O-CB 3.17Å; S291-H294 PolarHBondContact O-N 3.42Å; S291-H294 VanDerWaalsContact O-N 3.08Å; S291-Q295 PolarHBondContact O-N 2.95Å
292	I	81	Confident	78.3	Confident	43 Å²	43	93.4 Å²	93.4	22%	0.221	46%	0.457	C	S	.	.	H	α-helix	trans	-59.1	-43.6	176.7	-66.5	168.6	0	0	0	110.5	E288 H294 Q295 C296	E288-I292 HydrophobicContact CG-CD1 4Å; E288-I292 WeakPolarHBondContact O-CG1 3.32Å; E288-I292 PolarHBondContact O-N 3.04Å; I292-H294 VanDerWaalsContact C-N 3.34Å; I292-H294 PolarHBondContact O-N 3.37Å; I292-Q295 PolarHBondContact O-N 2.95Å; I292-C296 WeakPolarHBondContact O-CB 3.33Å; I292-C296 PolarHBondContact O-N 2.73Å
293	R	79	Confident	79.5	Confident	179 Å²	179	96.7 Å²	96.7	68%	0.675	46%	0.457	S	S	*	.	H	α-helix	trans	-61	-43.5	175.9	-173.6	-175.8	-64.2	163.7	-0.7	111.3	K289 A290 S291 C296 V297	K289-R293 VanDerWaalsContact O-CB 3.31Å; K289-R293 WeakPolarHBondContact O-CB 3.43Å; K289-R293 PolarHBondContact O-N 3.4Å; K289-R293 VanDerWaalsContact O-N 3.08Å; A290-R293 PolarHBondContact O-N 3.11Å; S291-R293 VanDerWaalsContact C-N 3.31Å; S291-R293 PolarHBondContact O-N 3.43Å; R293-C296 PolarHBondContact O-N 3.23Å; R293-V297 WeakPolarHBondContact O-CB 3.4Å; R293-V297 VanDerWaalsContact O-CG2 3.27Å; R293-V297 WeakPolarHBondContact O-CG2 3.44Å; R293-V297 PolarHBondContact O-N 2.94Å
294	H	81.8	Confident	80.3	Confident	126 Å²	126	95.6 Å²	95.6	58%	0.583	45%	0.451	S	S	*	.	H	α-helix	trans	-62.5	-43.3	177.9	-179.5	-90	0	0	0	112.1	A290 S291 I292 V297 T298	A290-H294 WeakPolarHBondContact O-CB 3.47Å; A290-H294 PolarHBondContact O-N 3.03Å; S291-H294 WeakPolarHBondContact O-CB 3.17Å; S291-H294 PolarHBondContact O-N 3.42Å; S291-H294 VanDerWaalsContact O-N 3.08Å; I292-H294 VanDerWaalsContact C-N 3.34Å; I292-H294 PolarHBondContact O-N 3.37Å; H294-V297 PolarHBondContact O-N 3.31Å; H294-T298 WeakPolarHBondContact O-CB 3.48Å; H294-T298 PolarHBondContact O-N 3.13Å; H294-T298 PolarHBondContact O-OG1 3.27Å
295	Q	82.8	Confident	80.9	Confident	71 Å²	71	93.3 Å²	93.3	33%	0.332	44%	0.437	S	S	.	.	H	α-helix	trans	-61.1	-50	174.7	-73.1	174.4	-24.1	0	0	111.4	S291 I292 V297 T298 M299	S291-Q295 PolarHBondContact O-N 2.95Å; I292-Q295 PolarHBondContact O-N 2.95Å; Q295-V297 VanDerWaalsContact C-N 3.31Å; Q295-V297 PolarHBondContact O-N 3.49Å; Q295-T298 PolarHBondContact O-N 3.2Å; Q295-T298 VanDerWaalsContact O-N 3.09Å; Q295-M299 WeakPolarHBondContact O-CB 3.35Å; Q295-M299 VanDerWaalsContact O-CG 3.25Å; Q295-M299 WeakPolarHBondContact O-CG 3.33Å; Q295-M299 PolarHBondContact O-N 3.17Å
296	C	82.3	Confident	81.4	Confident	85 Å²	85	93.8 Å²	93.8	57%	0.574	43%	0.433	S	S	*	.	H	α-helix	trans	-58	-42.3	178.1	-174.7	0	0	0	0	112.3	I292 R293 R300	I292-C296 WeakPolarHBondContact O-CB 3.33Å; I292-C296 PolarHBondContact O-N 2.73Å; R293-C296 PolarHBondContact O-N 3.23Å; C296-R300 WeakPolarHBondContact O-CB 3.46Å; C296-R300 PolarHBondContact O-N 3.02Å
297	V	80.9	Confident	81.7	Confident	60 Å²	60	88.6 Å²	88.6	36%	0.364	42%	0.417	S	S	.	.	H	α-helix	trans	-64.6	-42.5	176	169.8	0	0	0	0	111.4	R293 H294 Q295 R300 R301	R293-V297 WeakPolarHBondContact O-CB 3.4Å; R293-V297 VanDerWaalsContact O-CG2 3.27Å; R293-V297 WeakPolarHBondContact O-CG2 3.44Å; R293-V297 PolarHBondContact O-N 2.94Å; H294-V297 PolarHBondContact O-N 3.31Å; Q295-V297 VanDerWaalsContact C-N 3.31Å; Q295-V297 PolarHBondContact O-N 3.49Å; V297-R300 PolarHBondContact O-N 3.03Å; V297-R301 VanDerWaalsContact O-CG 3.29Å; V297-R301 WeakPolarHBondContact O-CG 3.4Å; V297-R301 PolarHBondContact O-N 3.06Å
298	T	82.4	Confident	82	Confident	40 Å²	40	81.9 Å²	81.9	25%	0.245	39%	0.389	C	S	.	.	H	α-helix	trans	-64.4	-45.5	179	-61.3	0	0	0	0	111.2	H294 Q295 R300 R301 K302	H294-T298 WeakPolarHBondContact O-CB 3.48Å; H294-T298 PolarHBondContact O-N 3.13Å; H294-T298 PolarHBondContact O-OG1 3.27Å; Q295-T298 PolarHBondContact O-N 3.2Å; Q295-T298 VanDerWaalsContact O-N 3.09Å; T298-R300 PolarHBondContact O-N 3.04Å; T298-R301 WeakPolarHBondContact O-CB 3.4Å; T298-R301 PolarHBondContact O-N 3.44Å; T298-R301 VanDerWaalsContact O-N 3.11Å; T298-K302 PolarHBondContact O-N 2.69Å
299	M	80.1	Confident	82.2	Confident	25 Å²	25	77.7 Å²	77.7	12%	0.123	37%	0.37	C	S	.	.	H	α-helix	trans	-59.3	-46.2	174.6	-74.4	-75.5	-109.3	0	0	112.5	I239 E242 Q295 R301 K302 R303	I239-M299 HydrophobicContact CB-CE 4.34Å; I239-M299 HydrophobicContact CB-SD 4.39Å; I239-M299 HydrophobicContact CG1-SD 3.99Å; I239-M299 HydrophobicContact CG2-CE 4.07Å; I239-M299 HydrophobicContact CG2-SD 4.45Å; I239-M299 WeakPolarHBondContact O-CE 3.39Å; E242-M299 HydrophobicContact CB-CE 3.19Å; E242-M299 HydrophobicContact CB-SD 3.95Å; E242-M299 VanDerWaalsContact CD-SD 3.58Å; E242-M299 HydrophobicContact CG-CE 4.2Å; E242-M299 HydrophobicContact CG-SD 4.37Å; E242-M299 WeakPolarHBondContact OE2-CG 3.18Å; Q295-M299 WeakPolarHBondContact O-CB 3.35Å; Q295-M299 VanDerWaalsContact O-CG 3.25Å; Q295-M299 WeakPolarHBondContact O-CG 3.33Å; Q295-M299 PolarHBondContact O-N 3.17Å; M299-R301 VanDerWaalsContact C-N 3.27Å; M299-R301 PolarHBondContact O-N 2.86Å; M299-K302 PolarHBondContact O-N 3.2Å; M299-R303 WeakPolarHBondContact O-CB 3.39Å; M299-R303 PolarHBondContact O-N 3.21Å
300	R	80.1	Confident	82.7	Confident	158 Å²	158	74.2 Å²	74.2	60%	0.596	36%	0.358	S	S	*	.	H	α-helix	trans	-60.2	-38.4	175	-173.3	175.8	-177.9	-179.2	1.2	111.6	C296 V297 T298 N304	C296-R300 WeakPolarHBondContact O-CB 3.46Å; C296-R300 PolarHBondContact O-N 3.02Å; V297-R300 PolarHBondContact O-N 3.03Å; T298-R300 PolarHBondContact O-N 3.04Å; R300-N304 WeakPolarHBondContact O-CB 3.5Å; R300-N304 PolarHBondContact O-N 3.43Å; R300-N304 PolarHBondContact O-ND2 3.26Å
301	R	81.6	Confident	83.1	Confident	177 Å²	177	74.9 Å²	74.9	67%	0.668	35%	0.354	S	S	*	.	H	α-helix	trans	-66.9	-45.3	175.9	-72.4	170.8	-179.8	-177.9	1.9	111.9	V297 T298 M299 N304 A305	V297-R301 VanDerWaalsContact O-CG 3.29Å; V297-R301 WeakPolarHBondContact O-CG 3.4Å; V297-R301 PolarHBondContact O-N 3.06Å; T298-R301 WeakPolarHBondContact O-CB 3.4Å; T298-R301 PolarHBondContact O-N 3.44Å; T298-R301 VanDerWaalsContact O-N 3.11Å; M299-R301 VanDerWaalsContact C-N 3.27Å; M299-R301 PolarHBondContact O-N 2.86Å; R301-N304 PolarHBondContact O-N 2.95Å; R301-A305 WeakPolarHBondContact O-CB 3.41Å; R301-A305 PolarHBondContact O-N 3.04Å
302	K	82	Confident	83.4	Confident	55 Å²	55	72.8 Å²	72.8	24%	0.239	34%	0.339	C	S	.	.	H	α-helix	trans	-57.9	-52.5	175	-70.6	-178.4	-177.1	177.8	0	110.8	V235 E238 E242 T298 M299 N304 A305 I306	V235-K302 HydrophobicContact CG1-CB 4.5Å; E238-K302 VanDerWaalsContact CD-NZ 3.27Å; E238-K302 IonicContact OE1-NZ 3.68Å; E238-K302 PolarHBondContact OE1-NZ 3.05Å; E238-K302 IonicContact OE2-NZ 2.73Å; E242-K302 IonicContact OE1-NZ 2.64Å; E242-K302 PolarHBondContact OE1-NZ 2.98Å; T298-K302 PolarHBondContact O-N 2.69Å; M299-K302 PolarHBondContact O-N 3.2Å; K302-N304 PolarHBondContact O-N 3.03Å; K302-A305 WeakPolarHBondContact O-CB 3.41Å; K302-A305 PolarHBondContact O-N 3.46Å; K302-I306 PolarHBondContact O-N 2.8Å; K302-I306 VanDerWaalsContact O-N 3.09Å
303	R	82.2	Confident	83.8	Confident	150 Å²	150	71.4 Å²	71.4	57%	0.566	33%	0.332	S	S	*	.	H	α-helix	trans	-57.7	-45.9	176.6	-173.7	178.7	70.7	-170.3	3.9	112.6	I239 M299 A305 I306 H307	I239-R303 HydrophobicContact CD1-CB 4.37Å; M299-R303 WeakPolarHBondContact O-CB 3.39Å; M299-R303 PolarHBondContact O-N 3.21Å; R303-A305 VanDerWaalsContact C-N 3.32Å; R303-A305 PolarHBondContact O-N 3.29Å; R303-I306 PolarHBondContact O-N 3.48Å; R303-H307 WeakPolarHBondContact O-CB 3.24Å; R303-H307 PolarHBondContact O-N 3.34Å
304	N	84	Confident	84.4	Confident	48 Å²	48	66.8 Å²	66.8	26%	0.257	32%	0.323	S	S	.	.	H	α-helix	trans	-66.2	-35.1	179.3	-76.9	-13	0	0	0	112.6	R300 R301 K302 T308 R368	R300-N304 WeakPolarHBondContact O-CB 3.5Å; R300-N304 PolarHBondContact O-N 3.43Å; R300-N304 PolarHBondContact O-ND2 3.26Å; R301-N304 PolarHBondContact O-N 2.95Å; K302-N304 PolarHBondContact O-N 3.03Å; N304-T308 WeakPolarHBondContact O-CB 3.45Å; N304-T308 PolarHBondContact O-N 3.03Å; N304-T308 PolarHBondContact O-OG1 3.48Å; N304-R368 PolarHBondContact OD1-NH2 3.04Å
305	A	81.7	Confident	84.9	Confident	23 Å²	23	61.4 Å²	61.4	19%	0.19	30%	0.301	C	S	.	.	H	α-helix	trans	-64.3	-45.3	176	0	0	0	0	0	111.3	R301 K302 R303 T308 C309	R301-A305 WeakPolarHBondContact O-CB 3.41Å; R301-A305 PolarHBondContact O-N 3.04Å; K302-A305 WeakPolarHBondContact O-CB 3.41Å; K302-A305 PolarHBondContact O-N 3.46Å; R303-A305 VanDerWaalsContact C-N 3.32Å; R303-A305 PolarHBondContact O-N 3.29Å; A305-T308 PolarHBondContact O-N 3.31Å; A305-C309 PolarHBondContact O-N 3.48Å; A305-C309 VanDerWaalsContact O-N 3.13Å
306	I	83.8	Confident	85.4	Confident	33 Å²	33	58 Å²	58	17%	0.169	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-56.9	174.6	-73.8	173.9	0	0	0	110.1	Y228 V235 K302 R303 T308 C309 L310	Y228-I306 WeakPolarHBondContact OH-CG2 3.46Å; Y228-I306 PolarHBondContact OH-O 2.99Å; V235-I306 HydrophobicContact CB-CD1 3.33Å; V235-I306 HydrophobicContact CG1-CD1 3.17Å; V235-I306 HydrophobicContact CG1-CG1 4.48Å; V235-I306 HydrophobicContact CG2-CD1 3.9Å; K302-I306 PolarHBondContact O-N 2.8Å; K302-I306 VanDerWaalsContact O-N 3.09Å; R303-I306 PolarHBondContact O-N 3.48Å; I306-T308 PolarHBondContact O-N 3.05Å; I306-C309 CarbonylContact O-C 3.59Å; I306-C309 WeakPolarHBondContact O-CA 3.41Å; I306-C309 PolarHBondContact O-N 2.98Å; I306-L310 PolarHBondContact O-N 3.02Å
307	H	85.9	Confident	86	Confident	78 Å²	78	56.5 Å²	56.5	36%	0.361	27%	0.27	S	S	.	.	H	α-helix	trans	-53.2	-42.3	-180	-177.5	-73.3	0	0	0	112.6	R303 C309 L310 L311 R368	R303-H307 WeakPolarHBondContact O-CB 3.24Å; R303-H307 PolarHBondContact O-N 3.34Å; H307-C309 VanDerWaalsContact C-N 3.34Å; H307-C309 PolarHBondContact O-N 3.45Å; H307-L310 PolarHBondContact O-N 3.1Å; H307-L311 VanDerWaalsContact CE1-CD1 3.4Å; H307-L311 WeakPolarHBondContact CE1-CD1 3.41Å; H307-L311 WeakPolarHBondContact O-CG 3.42Å; H307-L311 PolarHBondContact O-N 3.26Å; H307-R368 PolarHBondContact ND1-NH2 2.73Å
308	T	85.6	Confident	86.6	Confident	18 Å²	18	60.4 Å²	60.4	11%	0.11	28%	0.283	C	S	.	.	H	α-helix	trans	-63.1	-41.5	177.7	-53.3	0	0	0	0	111.5	N304 A305 I306 L312 I362	N304-T308 WeakPolarHBondContact O-CB 3.45Å; N304-T308 PolarHBondContact O-N 3.03Å; N304-T308 PolarHBondContact O-OG1 3.48Å; A305-T308 PolarHBondContact O-N 3.31Å; I306-T308 PolarHBondContact O-N 3.05Å; T308-L312 WeakPolarHBondContact O-CG 3.42Å; T308-L312 PolarHBondContact O-N 3.31Å; T308-L312 VanDerWaalsContact O-N 3.17Å; T308-I362 HydrophobicContact CG2-CG2 3.86Å; T308-I362 WeakPolarHBondContact O-CG2 3.47Å
309	C	85.6	Confident	87.2	Confident	6 Å²	6	58.8 Å²	58.8	4%	0.041	27%	0.273	C	S	.	.	H	α-helix	trans	-72	-36.6	178.2	-74.6	0	0	0	0	112.8	R130 Y228 A305 I306 H307 L311 L312 I313	R130-C309 WeakPolarHBondContact CG-SG 3.29Å; Y228-C309 HydrophobicContact CD2-CB 4.08Å; Y228-C309 HydrophobicContact CE2-CB 3.46Å; Y228-C309 VanDerWaalsContact CE2-CB 3.46Å; A305-C309 PolarHBondContact O-N 3.48Å; A305-C309 VanDerWaalsContact O-N 3.13Å; I306-C309 CarbonylContact O-C 3.59Å; I306-C309 WeakPolarHBondContact O-CA 3.41Å; I306-C309 PolarHBondContact O-N 2.98Å; H307-C309 VanDerWaalsContact C-N 3.34Å; H307-C309 PolarHBondContact O-N 3.45Å; C309-L311 VanDerWaalsContact C-N 3.33Å; C309-L311 PolarHBondContact O-N 2.99Å; C309-L312 PolarHBondContact O-N 2.99Å; C309-I313 WeakPolarHBondContact O-CG1 3.21Å; C309-I313 PolarHBondContact O-N 2.94Å
310	L	88.5	Confident	87.9	Confident	81 Å²	81	58.1 Å²	58.1	42%	0.424	27%	0.269	S	S	.	.	H	α-helix	trans	-59.2	-47.8	172.8	-177.5	63.1	0	0	0	110.3	Y228 I306 H307 L312 I313 V314	Y228-L310 HydrophobicContact CD1-CD1 4.37Å; Y228-L310 HydrophobicContact CE1-CB 3.98Å; Y228-L310 HydrophobicContact CE1-CD1 3.75Å; Y228-L310 HydrophobicContact CE1-CG 4.43Å; Y228-L310 WeakPolarHBondContact OH-CB 3.41Å; Y228-L310 PolarHBondContact OH-N 3.43Å; I306-L310 PolarHBondContact O-N 3.02Å; H307-L310 PolarHBondContact O-N 3.1Å; L310-L312 VanDerWaalsContact C-N 3.32Å; L310-L312 PolarHBondContact O-N 3.34Å; L310-I313 PolarHBondContact O-N 3.09Å; L310-I313 VanDerWaalsContact O-N 3.14Å; L310-V314 HydrophobicContact CD1-CG2 4.1Å; L310-V314 HydrophobicContact CG-CG2 4.2Å; L310-V314 WeakPolarHBondContact O-CB 3.31Å; L310-V314 WeakPolarHBondContact O-CG2 3.37Å; L310-V314 PolarHBondContact O-N 3.42Å
311	L	90.8	Very high	88.6	Confident	65 Å²	65	53.7 Å²	53.7	34%	0.34	26%	0.257	S	S	.	.	H	α-helix	trans	-59.7	-41	178.4	-74.2	-178.8	0	0	0	112.5	H307 C309 I313 A315 I362	H307-L311 VanDerWaalsContact CE1-CD1 3.4Å; H307-L311 WeakPolarHBondContact CE1-CD1 3.41Å; H307-L311 WeakPolarHBondContact O-CG 3.42Å; H307-L311 PolarHBondContact O-N 3.26Å; C309-L311 VanDerWaalsContact C-N 3.33Å; C309-L311 PolarHBondContact O-N 2.99Å; L311-I313 VanDerWaalsContact C-N 3.34Å; L311-A315 VanDerWaalsContact O-CB 3.23Å; L311-A315 WeakPolarHBondContact O-CB 3.42Å; L311-A315 PolarHBondContact O-N 3.43Å; L311-I362 HydrophobicContact CB-CD1 4.17Å; L311-I362 HydrophobicContact CB-CG1 4.15Å; L311-I362 HydrophobicContact CB-CG2 3.63Å; L311-I362 HydrophobicContact CD1-CG2 4.17Å
312	L	88.8	Confident	89.2	Confident	8 Å²	8	47.3 Å²	47.3	4%	0.042	24%	0.239	C	C	.	.	H	α-helix	trans	-62.1	-42.3	175.5	-72	174	0	0	0	111.7	L74 I126 T308 C309 L310 Y316 N359 I362	L74-L312 HydrophobicContact CD2-CD2 4.4Å; I126-L312 HydrophobicContact CG2-CD1 4.45Å; T308-L312 WeakPolarHBondContact O-CG 3.42Å; T308-L312 PolarHBondContact O-N 3.31Å; T308-L312 VanDerWaalsContact O-N 3.17Å; C309-L312 PolarHBondContact O-N 2.99Å; L310-L312 VanDerWaalsContact C-N 3.32Å; L310-L312 PolarHBondContact O-N 3.34Å; L312-Y316 VanDerWaalsContact O-CB 3.23Å; L312-Y316 WeakPolarHBondContact O-CB 3.1Å; L312-Y316 PolarHBondContact O-N 3.11Å; L312-N359 WeakPolarHBondContact CD2-OD1 3.39Å; L312-I362 HydrophobicContact CD2-CB 4.09Å; L312-I362 HydrophobicContact CD2-CD1 3.93Å; L312-I362 HydrophobicContact CD2-CG2 3.87Å; L312-I362 HydrophobicContact CG-CG2 3.81Å
313	I	89	Confident	89.8	Confident	14 Å²	14	46.9 Å²	46.9	7%	0.072	24%	0.236	C	C	.	.	H	α-helix	trans	-68.7	-45.8	179.9	-67.1	165.7	0	0	0	110.8	Y228 C309 L310 L311 Y316 I317	Y228-I313 HydrophobicContact CD1-CD1 3.88Å; Y228-I313 HydrophobicContact CD2-CD1 3.55Å; Y228-I313 HydrophobicContact CE2-CD1 4.33Å; Y228-I313 HydrophobicContact CG-CD1 3.27Å; C309-I313 WeakPolarHBondContact O-CG1 3.21Å; C309-I313 PolarHBondContact O-N 2.94Å; L310-I313 PolarHBondContact O-N 3.09Å; L310-I313 VanDerWaalsContact O-N 3.14Å; L311-I313 VanDerWaalsContact C-N 3.34Å; I313-Y316 PolarHBondContact O-N 2.93Å; I313-I317 HydrophobicContact CG2-CD1 3.7Å; I313-I317 HydrophobicContact CG2-CG1 4.32Å; I313-I317 WeakPolarHBondContact O-CB 3.35Å; I313-I317 WeakPolarHBondContact O-CG1 3.39Å; I313-I317 PolarHBondContact O-N 3.25Å
314	V	92	Very high	90.3	Very high	81 Å²	81	39.9 Å²	39.9	49%	0.491	21%	0.21	S	C	.	.	H	α-helix	trans	-61.1	-46.9	177.7	170.7	0	0	0	0	110.2	L310 Y316 I317 F318	L310-V314 HydrophobicContact CD1-CG2 4.1Å; L310-V314 HydrophobicContact CG-CG2 4.2Å; L310-V314 WeakPolarHBondContact O-CB 3.31Å; L310-V314 WeakPolarHBondContact O-CG2 3.37Å; L310-V314 PolarHBondContact O-N 3.42Å; V314-Y316 PolarHBondContact O-N 3.48Å; V314-I317 PolarHBondContact O-N 3.13Å; V314-F318 WeakPolarHBondContact O-CB 3.15Å; V314-F318 PolarHBondContact O-N 2.93Å
315	A	93	Very high	90.8	Very high	13 Å²	13	39.7 Å²	39.7	11%	0.107	22%	0.215	C	C	.	.	H	α-helix	trans	-60.3	-45	176.3	0	0	0	0	0	111.7	L311 F318 C319 T358 I362	L311-A315 VanDerWaalsContact O-CB 3.23Å; L311-A315 WeakPolarHBondContact O-CB 3.42Å; L311-A315 PolarHBondContact O-N 3.43Å; A315-F318 PolarHBondContact O-N 2.91Å; A315-C319 VanDerWaalsContact O-CB 3.22Å; A315-C319 WeakPolarHBondContact O-CB 3.37Å; A315-C319 PolarHBondContact O-N 2.89Å; A315-C319 PolarHBondContact O-SG 3.13Å; A315-T358 HydrophobicContact CB-CG2 4.29Å; A315-I362 HydrophobicContact CB-CD1 3.91Å
316	Y	93.3	Very high	91.3	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.7	-52	178	177.3	-101.5	0	0	0	112.2	S120 I123 V216 F217 A221 L224 L312 I313 V314 C319 W320	S120-Y316 PolarHBondContact OG-OH 3.09Å; S120-Y316 VanDerWaalsContact OG-OH 3.09Å; I123-Y316 HydrophobicContact CD1-CD2 3.73Å; I123-Y316 HydrophobicContact CD1-CE2 4.31Å; I123-Y316 HydrophobicContact CD1-CG 4.29Å; V216-Y316 PolarHBondContact O-OH 2.9Å; V216-Y316 VanDerWaalsContact O-OH 3.06Å; F217-Y316 WeakPolarHBondContact CA-OH 3.38Å; F217-Y316 AromaticContact CD2-CE1 3.78Å; F217-Y316 HydrophobicContact CD2-CE1 3.78Å; F217-Y316 AromaticContact CD2-CZ 3.83Å; F217-Y316 HydrophobicContact CE2-CD1 4.37Å; F217-Y316 AromaticContact CE2-CE1 3.84Å; F217-Y316 HydrophobicContact CE2-CE1 3.84Å; A221-Y316 HydrophobicContact CB-CE1 4.15Å; L224-Y316 HydrophobicContact CD1-CD1 3.94Å; L224-Y316 HydrophobicContact CD1-CE1 4Å; L312-Y316 VanDerWaalsContact O-CB 3.23Å; L312-Y316 WeakPolarHBondContact O-CB 3.1Å; L312-Y316 PolarHBondContact O-N 3.11Å; I313-Y316 PolarHBondContact O-N 2.93Å; V314-Y316 PolarHBondContact O-N 3.48Å; Y316-C319 PolarHBondContact O-N 2.91Å; Y316-W320 AromaticContact CD2-CD1 3.7Å; Y316-W320 HydrophobicContact CD2-CG 4.44Å; Y316-W320 AromaticContact CD2-NE1 3.92Å; Y316-W320 AromaticContact CE2-CD1 3.8Å; Y316-W320 HydrophobicContact CE2-CD2 4.49Å; Y316-W320 HydrophobicContact CE2-CG 4.21Å; Y316-W320 AromaticContact CE2-NE1 3.84Å; Y316-W320 WeakPolarHBondContact O-CB 3.25Å; Y316-W320 VanDerWaalsContact O-CD1 3.29Å; Y316-W320 PolarHBondContact O-N 3.48Å
317	I	93.7	Very high	91.7	Very high	53 Å²	53	39.7 Å²	39.7	27%	0.272	21%	0.209	S	C	.	.	H	α-helix	trans	-62.6	-47.7	178.8	-66.6	173.7	0	0	0	110	I313 V314 C319 W320 L321	I313-I317 HydrophobicContact CG2-CD1 3.7Å; I313-I317 HydrophobicContact CG2-CG1 4.32Å; I313-I317 WeakPolarHBondContact O-CB 3.35Å; I313-I317 WeakPolarHBondContact O-CG1 3.39Å; I313-I317 PolarHBondContact O-N 3.25Å; V314-I317 PolarHBondContact O-N 3.13Å; I317-C319 VanDerWaalsContact C-N 3.3Å; I317-C319 PolarHBondContact O-N 2.81Å; I317-W320 PolarHBondContact O-N 3.25Å; I317-L321 HydrophobicContact CG2-CB 4.1Å; I317-L321 HydrophobicContact CG2-CD2 3.98Å; I317-L321 WeakPolarHBondContact O-CA 3.41Å; I317-L321 WeakPolarHBondContact O-CB 3.49Å; I317-L321 PolarHBondContact O-N 2.85Å
318	F	94	Very high	92	Very high	143 Å²	143	39 Å²	39	63%	0.627	21%	0.208	S	C	*	.	H	α-helix	trans	-61.5	-38.1	-178.4	-176.3	-96.5	0	0	0	112.8	V314 A315 P322	V314-F318 WeakPolarHBondContact O-CB 3.15Å; V314-F318 PolarHBondContact O-N 2.93Å; A315-F318 PolarHBondContact O-N 2.91Å; F318-P322 WeakPolarHBondContact O-CD 3.38Å; F318-P322 VanDerWaalsContact O-CG 3.32Å; F318-P322 WeakPolarHBondContact O-CG 3.15Å
319	C	94.7	Very high	92.4	Very high	6 Å²	6	44.4 Å²	44.4	4%	0.041	23%	0.226	C	C	.	.	H	α-helix	trans	-79.1	-31.5	-178.6	-68.8	0	0	0	0	113.5	A315 Y316 I317 L351 N355	A315-C319 VanDerWaalsContact O-CB 3.22Å; A315-C319 WeakPolarHBondContact O-CB 3.37Å; A315-C319 PolarHBondContact O-N 2.89Å; A315-C319 PolarHBondContact O-SG 3.13Å; Y316-C319 PolarHBondContact O-N 2.91Å; I317-C319 VanDerWaalsContact C-N 3.3Å; I317-C319 PolarHBondContact O-N 2.81Å; C319-L351 VanDerWaalsContact CB-O 3.26Å; C319-L351 WeakPolarHBondContact CB-O 3.37Å; C319-L351 WeakPolarHBondContact O-CB 3.34Å; C319-N355 HydrophobicContact CB-CB 3.69Å
320	W	95.1	Very high	92.6	Very high	10 Å²	10	44.5 Å²	44.5	4%	0.038	23%	0.229	C	C	.	.	H	α-helix	trans	-101	-35.4	-173.7	-77.9	81.7	0	0	0	114.1	F116 V216 F217 Y316 I317 Y323 N324 I352	F116-W320 HydrophobicContact CB-CH2 3.8Å; F116-W320 HydrophobicContact CB-CZ2 4.34Å; F116-W320 AromaticContact CD1-CH2 3.46Å; F116-W320 HydrophobicContact CD1-CH2 3.46Å; F116-W320 VanDerWaalsContact CD1-CH2 3.46Å; F116-W320 AromaticContact CD1-CZ2 3.59Å; F116-W320 HydrophobicContact CD1-CZ2 3.59Å; F116-W320 HydrophobicContact CD2-CH2 4.46Å; F116-W320 HydrophobicContact CE1-CH2 4.11Å; F116-W320 HydrophobicContact CE1-CZ2 4.2Å; F116-W320 AromaticContact CG-CH2 3.67Å; F116-W320 HydrophobicContact CG-CH2 3.67Å; F116-W320 HydrophobicContact CG-CZ2 4.21Å; V216-W320 HydrophobicContact CG1-CE3 4.35Å; V216-W320 HydrophobicContact CG1-CH2 3.49Å; V216-W320 VanDerWaalsContact CG1-CH2 3.49Å; V216-W320 HydrophobicContact CG1-CZ2 4.46Å; V216-W320 HydrophobicContact CG1-CZ3 3.41Å; V216-W320 VanDerWaalsContact CG1-CZ3 3.41Å; F217-W320 HydrophobicContact CB-CE3 4.23Å; F217-W320 HydrophobicContact CD2-CB 3.33Å; F217-W320 HydrophobicContact CD2-CD2 4.43Å; F217-W320 HydrophobicContact CD2-CE3 4.48Å; F217-W320 HydrophobicContact CD2-CG 4.01Å; F217-W320 HydrophobicContact CE2-CB 3.39Å; F217-W320 HydrophobicContact CE2-CG 4.4Å; F217-W320 HydrophobicContact CG-CB 4.18Å; F217-W320 HydrophobicContact CZ-CB 4.28Å; Y316-W320 AromaticContact CD2-CD1 3.7Å; Y316-W320 HydrophobicContact CD2-CG 4.44Å; Y316-W320 AromaticContact CD2-NE1 3.92Å; Y316-W320 AromaticContact CE2-CD1 3.8Å; Y316-W320 HydrophobicContact CE2-CD2 4.49Å; Y316-W320 HydrophobicContact CE2-CG 4.21Å; Y316-W320 AromaticContact CE2-NE1 3.84Å; Y316-W320 WeakPolarHBondContact O-CB 3.25Å; Y316-W320 VanDerWaalsContact O-CD1 3.29Å; Y316-W320 PolarHBondContact O-N 3.48Å; I317-W320 PolarHBondContact O-N 3.25Å; W320-Y323 PolarHBondContact O-N 3.1Å; W320-N324 PolarHBondContact O-N 3.13Å; W320-N324 PolarHBondContact O-ND2 3.25Å; W320-I352 HydrophobicContact CD2-CD1 4.5Å; W320-I352 HydrophobicContact CD2-CG1 4.1Å; W320-I352 HydrophobicContact CD2-CG2 4.29Å; W320-I352 HydrophobicContact CE3-CD1 4.06Å; W320-I352 HydrophobicContact CE3-CG1 4.16Å; W320-I352 HydrophobicContact CG-CG1 4.49Å; W320-I352 HydrophobicContact CH2-CG2 3.72Å; W320-I352 HydrophobicContact CZ2-CG2 3.43Å; W320-I352 VanDerWaalsContact CZ2-CG2 3.43Å; W320-I352 HydrophobicContact CZ3-CD1 4.05Å; W320-I352 HydrophobicContact CZ3-CG1 4.46Å; W320-I352 HydrophobicContact CZ3-CG2 4.28Å
321	L	95.3	Very high	92.6	Very high	65 Å²	65	44.4 Å²	44.4	34%	0.34	23%	0.228	S	C	.	.	H	α-helix	trans	-58.7	-42.8	-175.5	-178	63.6	0	0	0	112.5	F217 W218 I317 Y323 N324 A325	F217-L321 HydrophobicContact CE1-CB 4.47Å; F217-L321 HydrophobicContact CE1-CD1 3.89Å; F217-L321 HydrophobicContact CZ-CB 3.9Å; F217-L321 HydrophobicContact CZ-CD1 3.99Å; W218-L321 HydrophobicContact CH2-CD1 3.75Å; W218-L321 HydrophobicContact CZ2-CD1 4.21Å; W218-L321 HydrophobicContact CZ3-CD1 4.38Å; I317-L321 HydrophobicContact CG2-CB 4.1Å; I317-L321 HydrophobicContact CG2-CD2 3.98Å; I317-L321 WeakPolarHBondContact O-CA 3.41Å; I317-L321 WeakPolarHBondContact O-CB 3.49Å; I317-L321 PolarHBondContact O-N 2.85Å; L321-Y323 PolarHBondContact O-N 2.84Å; L321-N324 PolarHBondContact O-N 3.19Å; L321-N324 VanDerWaalsContact O-N 3.17Å; L321-A325 VanDerWaalsContact O-CB 3.22Å; L321-A325 WeakPolarHBondContact O-CB 3.33Å; L321-A325 PolarHBondContact O-N 3.02Å
322	P	94.9	Very high	92.6	Very high	44 Å²	44	48.2 Å²	48.2	29%	0.286	25%	0.247	S	C	.	.	H	α-helix	trans	-57.9	-44.9	-178.8	-29.4	39.6	0	0	0	113.5	F318 F326 L348 L351	F318-P322 WeakPolarHBondContact O-CD 3.38Å; F318-P322 VanDerWaalsContact O-CG 3.32Å; F318-P322 WeakPolarHBondContact O-CG 3.15Å; P322-F326 WeakPolarHBondContact O-CB 3.27Å; P322-F326 PolarHBondContact O-N 3.07Å; P322-L348 HydrophobicContact CB-CD2 3.36Å; P322-L351 HydrophobicContact CB-CD1 4.18Å; P322-L351 HydrophobicContact CG-CD1 4.12Å
323	Y	93.2	Very high	92.7	Very high	46 Å²	46	50.1 Å²	50.1	18%	0.18	26%	0.258	C	S	.	.	H	α-helix	trans	-62.7	-45.6	175.5	176.9	-98.6	0	0	0	112.1	W320 L321 F326 F327 V345 L348 R349 I352	W320-Y323 PolarHBondContact O-N 3.1Å; L321-Y323 PolarHBondContact O-N 2.84Å; Y323-F326 PolarHBondContact O-N 3.29Å; Y323-F327 PolarHBondContact O-N 3.49Å; Y323-V345 HydrophobicContact CE2-CG1 4.34Å; Y323-V345 HydrophobicContact CE2-CG2 4.48Å; Y323-L348 HydrophobicContact CD2-CB 4.1Å; Y323-R349 HydrophobicContact CD2-CG 3.94Å; Y323-R349 HydrophobicContact CE2-CG 3.73Å; Y323-R349 PolarHBondContact OH-NH2 3.15Å; Y323-I352 HydrophobicContact CD1-CD1 3.96Å; Y323-I352 HydrophobicContact CG-CD1 3.94Å
324	N	93.9	Very high	92.6	Very high	3 Å²	3	53.7 Å²	53.7	2%	0.016	27%	0.274	C	S	.	.	H	α-helix	trans	-73.2	-32.9	-176.4	-72.9	-81.8	0	0	0	112.5	V213 F217 W218 W320 L321 F327 L328	V213-N324 WeakPolarHBondContact CB-OD1 3.41Å; V213-N324 WeakPolarHBondContact CG1-OD1 3.44Å; F217-N324 HydrophobicContact CD1-CB 3.65Å; F217-N324 VanDerWaalsContact CD1-CG 3.48Å; F217-N324 HydrophobicContact CE1-CB 3.97Å; F217-N324 HydrophobicContact CG-CB 4.43Å; F217-N324 WeakPolarHBondContact CG-ND2 3.46Å; W218-N324 HydrophobicContact CZ2-CB 4.3Å; W320-N324 PolarHBondContact O-N 3.13Å; W320-N324 PolarHBondContact O-ND2 3.25Å; L321-N324 PolarHBondContact O-N 3.19Å; L321-N324 VanDerWaalsContact O-N 3.17Å; N324-F327 PolarHBondContact O-N 3.24Å; N324-L328 WeakPolarHBondContact O-CG 3.29Å; N324-L328 PolarHBondContact O-N 3.24Å
325	A	93.2	Very high	92.4	Very high	44 Å²	44	56.1 Å²	56.1	36%	0.364	28%	0.284	S	S	.	.	H	α-helix	trans	-67.6	-42.7	173.2	0	0	0	0	0	111	L321 F327 L328 W329	L321-A325 VanDerWaalsContact O-CB 3.22Å; L321-A325 WeakPolarHBondContact O-CB 3.33Å; L321-A325 PolarHBondContact O-N 3.02Å; A325-F327 VanDerWaalsContact C-N 3.31Å; A325-F327 PolarHBondContact O-N 3.38Å; A325-L328 PolarHBondContact O-N 3.15Å; A325-W329 PolarHBondContact O-N 3.15Å
326	F	93.5	Very high	92.2	Very high	30 Å²	30	57.2 Å²	57.2	13%	0.132	29%	0.291	C	S	.	.	H	α-helix	trans	-61.9	-38.3	174.3	-177.2	-106.3	0	0	0	112.2	P322 Y323 W329 G330 Y337 W340 V345 L348	P322-F326 WeakPolarHBondContact O-CB 3.27Å; P322-F326 PolarHBondContact O-N 3.07Å; Y323-F326 PolarHBondContact O-N 3.29Å; F326-W329 WeakPolarHBondContact O-CB 3.4Å; F326-W329 PolarHBondContact O-N 3.37Å; F326-G330 PolarHBondContact O-N 3.3Å; F326-Y337 HydrophobicContact CD1-CD2 4Å; F326-Y337 AromaticContact CD1-CE2 3.67Å; F326-Y337 HydrophobicContact CD1-CE2 3.67Å; F326-Y337 AromaticContact CE1-CD2 3.47Å; F326-Y337 HydrophobicContact CE1-CD2 3.47Å; F326-Y337 VanDerWaalsContact CE1-CD2 3.47Å; F326-Y337 AromaticContact CE1-CE2 3.3Å; F326-Y337 HydrophobicContact CE1-CE2 3.3Å; F326-Y337 HydrophobicContact CE2-CD2 4.28Å; F326-Y337 AromaticContact CZ-CD2 3.63Å; F326-Y337 HydrophobicContact CZ-CD2 3.63Å; F326-Y337 AromaticContact CZ-CE2 3.97Å; F326-Y337 HydrophobicContact CZ-CE2 3.97Å; F326-Y337 HydrophobicContact CZ-CG 4.44Å; F326-W340 HydrophobicContact CE2-CB 4.17Å; F326-W340 HydrophobicContact CZ-CB 4.15Å; F326-V345 HydrophobicContact CD1-CG2 4.25Å; F326-V345 HydrophobicContact CE1-CG2 3.98Å; F326-L348 HydrophobicContact CB-CD1 3.57Å; F326-L348 HydrophobicContact CD1-CD1 4.08Å; F326-L348 HydrophobicContact CG-CD1 3.8Å
327	F	91.8	Very high	92	Very high	25 Å²	25	58.9 Å²	58.9	11%	0.11	30%	0.298	C	S	.	.	H	α-helix	trans	-62.1	-46.7	172.3	171.2	-99.5	0	0	0	112.4	V210 V213 Y323 N324 A325 W329 G330 L331	V210-F327 HydrophobicContact CG2-CE1 4.08Å; V210-F327 HydrophobicContact CG2-CZ 4.15Å; V213-F327 HydrophobicContact CG1-CD1 4.05Å; V213-F327 HydrophobicContact CG1-CE1 4.27Å; V213-F327 HydrophobicContact CG1-CG 4.45Å; V213-F327 HydrophobicContact CG2-CD1 3.91Å; V213-F327 HydrophobicContact CG2-CE1 3.71Å; Y323-F327 PolarHBondContact O-N 3.49Å; N324-F327 PolarHBondContact O-N 3.24Å; A325-F327 VanDerWaalsContact C-N 3.31Å; A325-F327 PolarHBondContact O-N 3.38Å; F327-W329 VanDerWaalsContact C-N 3.29Å; F327-W329 PolarHBondContact O-N 3.09Å; F327-G330 PolarHBondContact O-N 3.01Å; F327-G330 VanDerWaalsContact O-N 3.13Å; F327-L331 HydrophobicContact CE1-CD1 4.13Å; F327-L331 HydrophobicContact CE1-CD2 4.45Å; F327-L331 HydrophobicContact CE1-CG 4.44Å; F327-L331 HydrophobicContact CZ-CD2 4.08Å; F327-L331 PolarHBondContact O-N 3.37Å
328	L	92	Very high	91.6	Very high	65 Å²	65	61.2 Å²	61.2	34%	0.34	31%	0.307	S	S	.	.	H	α-helix	trans	-63.4	-35.7	177.4	-70	-176.7	0	0	0	112.4	W218 N324 A325 G330 L331	W218-L328 HydrophobicContact CH2-CD1 4.03Å; W218-L328 HydrophobicContact CZ2-CD1 3.34Å; W218-L328 HydrophobicContact CZ2-CG 4.28Å; N324-L328 WeakPolarHBondContact O-CG 3.29Å; N324-L328 PolarHBondContact O-N 3.24Å; A325-L328 PolarHBondContact O-N 3.15Å; L328-G330 VanDerWaalsContact C-N 3.28Å; L328-G330 PolarHBondContact O-N 3.06Å; L328-L331 HydrophobicContact CD2-CD1 3.79Å; L328-L331 WeakPolarHBondContact O-CB 3.49Å; L328-L331 PolarHBondContact O-N 3.41Å; L328-L331 VanDerWaalsContact O-N 3.1Å
329	W	93.5	Very high	91.4	Very high	130 Å²	130	61.1 Å²	61.1	49%	0.492	31%	0.309	S	S	.	.	H	α-helix	trans	-57.3	-42.7	172.5	176.8	-93.6	0	0	0	111.5	A325 F326 F327 L331 I332 D333	A325-W329 PolarHBondContact O-N 3.15Å; F326-W329 WeakPolarHBondContact O-CB 3.4Å; F326-W329 PolarHBondContact O-N 3.37Å; F327-W329 VanDerWaalsContact C-N 3.29Å; F327-W329 PolarHBondContact O-N 3.09Å; W329-L331 PolarHBondContact O-N 3.45Å; W329-I332 PolarHBondContact O-N 3.42Å; W329-D333 HydrophobicContact CZ2-CB 4.22Å; W329-D333 PolarHBondContact O-N 3.44Å
330	G	90.5	Very high	91	Very high	9 Å²	9	67.6 Å²	67.6	9%	0.093	33%	0.333	C	S	.	.	H	α-helix	trans	-67.2	-11.9	176.5	0	0	0	0	0	115.9	F326 F327 L328 Y337	F326-G330 PolarHBondContact O-N 3.3Å; F327-G330 PolarHBondContact O-N 3.01Å; F327-G330 VanDerWaalsContact O-N 3.13Å; L328-G330 VanDerWaalsContact C-N 3.28Å; L328-G330 PolarHBondContact O-N 3.06Å; G330-Y337 VanDerWaalsContact CA-CB 3.4Å
331	L	89.3	Confident	90.6	Very high	78 Å²	78	69.4 Å²	69.4	41%	0.408	34%	0.341	S	S	.	.	H	α-helix	trans	-79.5	-22.9	169.3	-56.9	-178.8	0	0	0	112.4	T206 V210 F327 L328 W329	T206-L331 HydrophobicContact CG2-CD2 3.49Å; T206-L331 VanDerWaalsContact CG2-CD2 3.49Å; V210-L331 HydrophobicContact CG2-CD1 3.89Å; F327-L331 HydrophobicContact CE1-CD1 4.13Å; F327-L331 HydrophobicContact CE1-CD2 4.45Å; F327-L331 HydrophobicContact CE1-CG 4.44Å; F327-L331 HydrophobicContact CZ-CD2 4.08Å; F327-L331 PolarHBondContact O-N 3.37Å; L328-L331 HydrophobicContact CD2-CD1 3.79Å; L328-L331 WeakPolarHBondContact O-CB 3.49Å; L328-L331 PolarHBondContact O-N 3.41Å; L328-L331 VanDerWaalsContact O-N 3.1Å; W329-L331 PolarHBondContact O-N 3.45Å
332	I	90.4	Very high	90	Very high	145 Å²	145	71 Å²	71	74%	0.744	35%	0.35	S	S	*	.	H	α-helix	trans	-95.2	-47.7	-178.6	-58.3	172	0	0	0	109.9	W329	W329-I332 PolarHBondContact O-N 3.42Å
333	D	90.3	Very high	89.5	Confident	49 Å²	49	71.3 Å²	71.3	26%	0.262	35%	0.351	S	S	.	.			trans	-126.4	91.2	-178.8	-176.7	-9.7	0	0	0	109.6	W329 D335 S336 Y337	W329-D333 HydrophobicContact CZ2-CB 4.22Å; W329-D333 PolarHBondContact O-N 3.44Å; D333-D335 PolarHBondContact OD1-N 2.76Å; D333-S336 VanDerWaalsContact CG-CB 3.4Å; D333-S336 VanDerWaalsContact CG-OG 3.25Å; D333-S336 WeakPolarHBondContact OD1-CB 3.25Å; D333-S336 PolarHBondContact OD1-N 2.98Å; D333-S336 PolarHBondContact OD1-OG 3.3Å; D333-S336 WeakPolarHBondContact OD2-CB 3.43Å; D333-S336 PolarHBondContact OD2-OG 3.14Å; D333-Y337 VanDerWaalsContact O-CB 3.26Å; D333-Y337 WeakPolarHBondContact O-CB 3.47Å; D333-Y337 PolarHBondContact O-N 3.41Å; D333-Y337 VanDerWaalsContact O-N 3.15Å
334	H	86.6	Confident	89.2	Confident	89 Å²	89	70.4 Å²	70.4	41%	0.412	35%	0.352	S	S	.	.	H	α-helix	trans	-67.3	-37.5	-178.3	-177.3	-87.4	0	0	0	111.8	Y337 Q338	H334-Y337 PolarHBondContact O-N 3.38Å; H334-Q338 VanDerWaalsContact CE1-CG 3.42Å; H334-Q338 WeakPolarHBondContact CE1-CG 3.25Å; H334-Q338 PolarHBondContact CE1-NE2 3.43Å; H334-Q338 PolarHBondContact NE2-NE2 2.86Å; H334-Q338 VanDerWaalsContact NE2-NE2 3.15Å; H334-Q338 VanDerWaalsContact O-CG 3.3Å; H334-Q338 WeakPolarHBondContact O-CG 3.45Å; H334-Q338 PolarHBondContact O-N 3.08Å
335	D	88.2	Confident	88.8	Confident	131 Å²	131	70.6 Å²	70.6	70%	0.701	35%	0.353	S	S	*	.	H	α-helix	trans	-70.9	-47.3	-174.3	-64.9	-31.5	0	0	0	111.3	D333 Y337 Q338 Q339	D333-D335 PolarHBondContact OD1-N 2.76Å; D335-Y337 VanDerWaalsContact C-N 3.29Å; D335-Y337 PolarHBondContact O-N 2.97Å; D335-Q338 PolarHBondContact O-N 3.46Å; D335-Q339 PolarHBondContact O-N 3.07Å
336	S	88.9	Confident	88.2	Confident	36 Å²	36	68.8 Å²	68.8	25%	0.252	34%	0.338	S	S	.	.	H	α-helix	trans	-62.3	-39.5	172.7	-64.6	0	0	0	0	111.3	D333 Q338 Q339 W340	D333-S336 VanDerWaalsContact CG-CB 3.4Å; D333-S336 VanDerWaalsContact CG-OG 3.25Å; D333-S336 WeakPolarHBondContact OD1-CB 3.25Å; D333-S336 PolarHBondContact OD1-N 2.98Å; D333-S336 PolarHBondContact OD1-OG 3.3Å; D333-S336 WeakPolarHBondContact OD2-CB 3.43Å; D333-S336 PolarHBondContact OD2-OG 3.14Å; S336-Q338 VanDerWaalsContact C-N 3.34Å; S336-Q338 PolarHBondContact O-N 3.08Å; S336-Q339 PolarHBondContact O-N 3.04Å; S336-W340 VanDerWaalsContact O-CD1 3.23Å; S336-W340 PolarHBondContact O-N 3.32Å; S336-W340 VanDerWaalsContact O-N 3.08Å
337	Y	89.6	Confident	88	Confident	36 Å²	36	71.5 Å²	71.5	14%	0.141	35%	0.35	C	S	.	.	H	α-helix	trans	-60.3	-43.5	176.5	171.3	-92.4	0	0	0	112.1	F326 G330 D333 H334 D335 W340 H341	F326-Y337 HydrophobicContact CD1-CD2 4Å; F326-Y337 AromaticContact CD1-CE2 3.67Å; F326-Y337 HydrophobicContact CD1-CE2 3.67Å; F326-Y337 AromaticContact CE1-CD2 3.47Å; F326-Y337 HydrophobicContact CE1-CD2 3.47Å; F326-Y337 VanDerWaalsContact CE1-CD2 3.47Å; F326-Y337 AromaticContact CE1-CE2 3.3Å; F326-Y337 HydrophobicContact CE1-CE2 3.3Å; F326-Y337 HydrophobicContact CE2-CD2 4.28Å; F326-Y337 AromaticContact CZ-CD2 3.63Å; F326-Y337 HydrophobicContact CZ-CD2 3.63Å; F326-Y337 AromaticContact CZ-CE2 3.97Å; F326-Y337 HydrophobicContact CZ-CE2 3.97Å; F326-Y337 HydrophobicContact CZ-CG 4.44Å; G330-Y337 VanDerWaalsContact CA-CB 3.4Å; D333-Y337 VanDerWaalsContact O-CB 3.26Å; D333-Y337 WeakPolarHBondContact O-CB 3.47Å; D333-Y337 PolarHBondContact O-N 3.41Å; D333-Y337 VanDerWaalsContact O-N 3.15Å; H334-Y337 PolarHBondContact O-N 3.38Å; D335-Y337 VanDerWaalsContact C-N 3.29Å; D335-Y337 PolarHBondContact O-N 2.97Å; Y337-W340 CarbonylContact O-C 3.59Å; Y337-W340 PolarHBondContact O-N 3.25Å; Y337-H341 AromaticContact CE1-ND1 3.43Å; Y337-H341 WeakPolarHBondContact CE1-ND1 3.33Å; Y337-H341 AromaticContact CE2-ND1 3.99Å; Y337-H341 AromaticContact CZ-CE1 3.83Å; Y337-H341 AromaticContact CZ-ND1 3.24Å; Y337-H341 VanDerWaalsContact O-CA 3.27Å; Y337-H341 WeakPolarHBondContact O-CA 3.17Å; Y337-H341 VanDerWaalsContact O-CB 3.25Å; Y337-H341 WeakPolarHBondContact O-CB 3.39Å; Y337-H341 PolarHBondContact O-N 3.36Å; Y337-H341 PolarHBondContact OH-CE1 2.93Å; Y337-H341 PolarHBondContact OH-ND1 2.91Å; Y337-H341 VanDerWaalsContact OH-ND1 3.1Å
338	Q	85.8	Confident	87.9	Confident	101 Å²	101	71.7 Å²	71.7	47%	0.472	35%	0.352	S	S	.	.	H	α-helix	trans	-63.4	-41.9	177	-70.9	-63.3	-18.8	0	0	111.9	H334 D335 S336 W340 H341	H334-Q338 VanDerWaalsContact CE1-CG 3.42Å; H334-Q338 WeakPolarHBondContact CE1-CG 3.25Å; H334-Q338 PolarHBondContact CE1-NE2 3.43Å; H334-Q338 PolarHBondContact NE2-NE2 2.86Å; H334-Q338 VanDerWaalsContact NE2-NE2 3.15Å; H334-Q338 VanDerWaalsContact O-CG 3.3Å; H334-Q338 WeakPolarHBondContact O-CG 3.45Å; H334-Q338 PolarHBondContact O-N 3.08Å; D335-Q338 PolarHBondContact O-N 3.46Å; S336-Q338 VanDerWaalsContact C-N 3.34Å; S336-Q338 PolarHBondContact O-N 3.08Å; Q338-W340 VanDerWaalsContact C-N 3.32Å; Q338-W340 PolarHBondContact O-N 3.22Å; Q338-H341 PolarHBondContact O-N 2.94Å
339	Q	88.2	Confident	87.7	Confident	142 Å²	142	71.9 Å²	71.9	66%	0.664	35%	0.348	S	S	*	.	H	α-helix	trans	-58.8	-43.7	177.2	-174.5	-179.6	18.6	0	0	112.2	D335 S336	D335-Q339 PolarHBondContact O-N 3.07Å; S336-Q339 PolarHBondContact O-N 3.04Å
340	W	87.3	Confident	87.6	Confident	142 Å²	142	68.4 Å²	68.4	54%	0.538	34%	0.335	S	S	.	.	H	α-helix	trans	-96.4	2.4	-175.7	-66.7	97.4	0	0	0	114	F326 S336 Y337 Q338 S344	F326-W340 HydrophobicContact CE2-CB 4.17Å; F326-W340 HydrophobicContact CZ-CB 4.15Å; S336-W340 VanDerWaalsContact O-CD1 3.23Å; S336-W340 PolarHBondContact O-N 3.32Å; S336-W340 VanDerWaalsContact O-N 3.08Å; Y337-W340 CarbonylContact O-C 3.59Å; Y337-W340 PolarHBondContact O-N 3.25Å; Q338-W340 VanDerWaalsContact C-N 3.32Å; Q338-W340 PolarHBondContact O-N 3.22Å; W340-S344 WeakPolarHBondContact O-CB 3.39Å; W340-S344 PolarHBondContact O-N 3.35Å; W340-S344 PolarHBondContact O-OG 2.93Å
341	H	85.9	Confident	87.7	Confident	48 Å²	48	70 Å²	70	22%	0.222	34%	0.341	C	S	.	.	H	α-helix	trans	-58.3	-56.8	-169.3	-178.3	75.9	0	0	0	111.9	Y337 Q338 V345	Y337-H341 AromaticContact CE1-ND1 3.43Å; Y337-H341 WeakPolarHBondContact CE1-ND1 3.33Å; Y337-H341 AromaticContact CE2-ND1 3.99Å; Y337-H341 AromaticContact CZ-CE1 3.83Å; Y337-H341 AromaticContact CZ-ND1 3.24Å; Y337-H341 VanDerWaalsContact O-CA 3.27Å; Y337-H341 WeakPolarHBondContact O-CA 3.17Å; Y337-H341 VanDerWaalsContact O-CB 3.25Å; Y337-H341 WeakPolarHBondContact O-CB 3.39Å; Y337-H341 PolarHBondContact O-N 3.36Å; Y337-H341 PolarHBondContact OH-CE1 2.93Å; Y337-H341 PolarHBondContact OH-ND1 2.91Å; Y337-H341 VanDerWaalsContact OH-ND1 3.1Å; Q338-H341 PolarHBondContact O-N 2.94Å; H341-V345 WeakPolarHBondContact O-CB 3.5Å; H341-V345 VanDerWaalsContact O-CG2 3.23Å; H341-V345 WeakPolarHBondContact O-CG2 3.44Å; H341-V345 PolarHBondContact O-N 3.04Å
342	N	83	Confident	87.8	Confident	99 Å²	99	66.7 Å²	66.7	53%	0.529	32%	0.324	S	S	.	.	H	α-helix	trans	-62.2	-51.4	-172	-69.5	-24.3	0	0	0	111.3	I28 A346	I28-N342 HydrophobicContact CD1-CB 4.12Å; N342-A346 WeakPolarHBondContact O-CB 3.49Å; N342-A346 PolarHBondContact O-N 3.27Å
343	T	84.8	Confident	88.1	Confident	50 Å²	50	59.8 Å²	59.8	31%	0.307	29%	0.288	S	S	.	.	H	α-helix	trans	-61.4	-52.9	179.4	-47.5	0	0	0	0	111.1	A346 F347	T343-A346 PolarHBondContact O-N 3.1Å; T343-F347 HydrophobicContact CG2-CD2 4.21Å; T343-F347 HydrophobicContact CG2-CE2 3.85Å; T343-F347 WeakPolarHBondContact O-CD2 3.48Å; T343-F347 PolarHBondContact O-N 3.43Å
344	S	87.6	Confident	88.3	Confident	27 Å²	27	58.9 Å²	58.9	19%	0.189	29%	0.285	C	S	.	.	H	α-helix	trans	-65.4	-47.4	-175.8	-55.4	0	0	0	0	111.5	W340 A346 F347 L348	W340-S344 WeakPolarHBondContact O-CB 3.39Å; W340-S344 PolarHBondContact O-N 3.35Å; W340-S344 PolarHBondContact O-OG 2.93Å; S344-A346 VanDerWaalsContact C-N 3.28Å; S344-A346 PolarHBondContact O-N 3.07Å; S344-F347 PolarHBondContact O-N 3.17Å; S344-L348 VanDerWaalsContact O-CB 3.26Å; S344-L348 WeakPolarHBondContact O-CB 3.43Å; S344-L348 WeakPolarHBondContact O-CD1 3.36Å; S344-L348 WeakPolarHBondContact O-CG 3.26Å; S344-L348 PolarHBondContact O-N 2.73Å
345	V	85	Confident	88.7	Confident	6 Å²	6	54.7 Å²	54.7	4%	0.036	27%	0.265	C	S	.	.	H	α-helix	trans	-64.1	-34.6	-178.9	172.1	0	0	0	0	111.7	Y323 F326 H341 F347 R349	Y323-V345 HydrophobicContact CE2-CG1 4.34Å; Y323-V345 HydrophobicContact CE2-CG2 4.48Å; F326-V345 HydrophobicContact CD1-CG2 4.25Å; F326-V345 HydrophobicContact CE1-CG2 3.98Å; H341-V345 WeakPolarHBondContact O-CB 3.5Å; H341-V345 VanDerWaalsContact O-CG2 3.23Å; H341-V345 WeakPolarHBondContact O-CG2 3.44Å; H341-V345 PolarHBondContact O-N 3.04Å; V345-F347 PolarHBondContact O-N 3.45Å; V345-R349 HydrophobicContact CG1-CG 3.97Å; V345-R349 WeakPolarHBondContact O-CB 3.03Å; V345-R349 WeakPolarHBondContact O-CG 3.45Å; V345-R349 PolarHBondContact O-N 2.64Å; V345-R349 VanDerWaalsContact O-N 3.07Å
346	A	81.3	Confident	89	Confident	6 Å²	6	48.4 Å²	48.4	5%	0.05	23%	0.232	C	C	.	.	H	α-helix	trans	-58.2	-46.7	176	0	0	0	0	0	112.2	E30 R34 N342 T343 S344	E30-A346 HydrophobicContact CB-CB 4.35Å; R34-A346 HydrophobicContact CB-CB 4.25Å; N342-A346 WeakPolarHBondContact O-CB 3.49Å; N342-A346 PolarHBondContact O-N 3.27Å; T343-A346 PolarHBondContact O-N 3.1Å; S344-A346 VanDerWaalsContact C-N 3.28Å; S344-A346 PolarHBondContact O-N 3.07Å
347	F	87.2	Confident	89.3	Confident	88 Å²	88	47.5 Å²	47.5	39%	0.386	23%	0.225	S	C	.	.	H	α-helix	trans	-79.5	-37.6	178.8	-65.8	-70.7	0	0	0	113.4	I33 L37 T343 S344 V345 Y350	I33-F347 HydrophobicContact CG2-CE1 3.78Å; I33-F347 HydrophobicContact CG2-CZ 4.13Å; L37-F347 HydrophobicContact CD1-CD1 4.43Å; T343-F347 HydrophobicContact CG2-CD2 4.21Å; T343-F347 HydrophobicContact CG2-CE2 3.85Å; T343-F347 WeakPolarHBondContact O-CD2 3.48Å; T343-F347 PolarHBondContact O-N 3.43Å; S344-F347 PolarHBondContact O-N 3.17Å; V345-F347 PolarHBondContact O-N 3.45Å; F347-Y350 WeakPolarHBondContact O-CB 3.38Å; F347-Y350 PolarHBondContact O-N 3.45Å
348	L	91.6	Very high	89.4	Confident	28 Å²	28	47.7 Å²	47.7	15%	0.147	23%	0.23	C	C	.	.	H	α-helix	trans	-73.5	-35.2	-174.3	-64.7	171.5	0	0	0	112.3	P322 Y323 F326 S344 Y350 L351	P322-L348 HydrophobicContact CB-CD2 3.36Å; Y323-L348 HydrophobicContact CD2-CB 4.1Å; F326-L348 HydrophobicContact CB-CD1 3.57Å; F326-L348 HydrophobicContact CD1-CD1 4.08Å; F326-L348 HydrophobicContact CG-CD1 3.8Å; S344-L348 VanDerWaalsContact O-CB 3.26Å; S344-L348 WeakPolarHBondContact O-CB 3.43Å; S344-L348 WeakPolarHBondContact O-CD1 3.36Å; S344-L348 WeakPolarHBondContact O-CG 3.26Å; S344-L348 PolarHBondContact O-N 2.73Å; L348-Y350 VanDerWaalsContact C-N 3.26Å; L348-Y350 PolarHBondContact O-N 3.34Å; L348-L351 HydrophobicContact CD2-CD1 4.37Å; L348-L351 PolarHBondContact O-N 3.48Å
349	R	87.7	Confident	89.7	Confident	70 Å²	70	42.9 Å²	42.9	26%	0.264	21%	0.207	S	C	.	.	H	α-helix	trans	-67.6	-27.4	173.5	-74.6	-177.1	173.4	169.6	4.6	112.8	Y323 V345 L351 I352	Y323-R349 HydrophobicContact CD2-CG 3.94Å; Y323-R349 HydrophobicContact CE2-CG 3.73Å; Y323-R349 PolarHBondContact OH-NH2 3.15Å; V345-R349 HydrophobicContact CG1-CG 3.97Å; V345-R349 WeakPolarHBondContact O-CB 3.03Å; V345-R349 WeakPolarHBondContact O-CG 3.45Å; V345-R349 PolarHBondContact O-N 2.64Å; V345-R349 VanDerWaalsContact O-N 3.07Å; R349-L351 VanDerWaalsContact C-N 3.34Å; R349-I352 PolarHBondContact O-N 3.29Å
350	Y	89.9	Confident	89.9	Confident	57 Å²	57	36.1 Å²	36.1	22%	0.224	18%	0.176	C	C	.	.	H	α-helix	trans	-61.7	-43	173.4	161.6	-94.6	0	0	0	111.4	L37 L41 F347 L348 I352 V353 V354	L37-Y350 HydrophobicContact CB-CD2 3.52Å; L37-Y350 HydrophobicContact CB-CE2 3.63Å; L37-Y350 HydrophobicContact CB-CG 4.35Å; L37-Y350 HydrophobicContact CD1-CD2 4.12Å; L37-Y350 HydrophobicContact CD1-CE2 4.34Å; L37-Y350 HydrophobicContact CD1-CG 4.18Å; L37-Y350 HydrophobicContact CD2-CD2 4.49Å; L37-Y350 HydrophobicContact CD2-CE2 3.94Å; L37-Y350 HydrophobicContact CG-CD2 4.26Å; L37-Y350 HydrophobicContact CG-CE2 4.18Å; L41-Y350 HydrophobicContact CD1-CD2 3.41Å; L41-Y350 VanDerWaalsContact CD1-CD2 3.41Å; L41-Y350 HydrophobicContact CD1-CE2 3.25Å; L41-Y350 HydrophobicContact CD1-CG 4.36Å; L41-Y350 HydrophobicContact CD2-CE2 4.13Å; L41-Y350 HydrophobicContact CG-CD2 4.16Å; L41-Y350 HydrophobicContact CG-CE2 3.55Å; F347-Y350 WeakPolarHBondContact O-CB 3.38Å; F347-Y350 PolarHBondContact O-N 3.45Å; L348-Y350 VanDerWaalsContact C-N 3.26Å; L348-Y350 PolarHBondContact O-N 3.34Å; Y350-I352 VanDerWaalsContact C-N 3.26Å; Y350-I352 PolarHBondContact O-N 3.11Å; Y350-V353 PolarHBondContact O-N 3.44Å; Y350-V354 HydrophobicContact CD1-CG2 3.99Å; Y350-V354 HydrophobicContact CE1-CG2 3.5Å; Y350-V354 HydrophobicContact CE2-CG2 4.15Å; Y350-V354 HydrophobicContact CG-CG2 4.47Å; Y350-V354 WeakPolarHBondContact O-CG2 3.31Å; Y350-V354 PolarHBondContact O-N 3.34Å; Y350-V354 VanDerWaalsContact O-N 3.12Å
351	L	92.8	Very high	90	Very high	42 Å²	42	33 Å²	33	22%	0.22	17%	0.166	C	C	.	.	H	α-helix	trans	-58.4	-36.8	178.4	-66.2	177.3	0	0	0	112.8	C319 P322 L348 R349 V353 V354 N355	C319-L351 VanDerWaalsContact CB-O 3.26Å; C319-L351 WeakPolarHBondContact CB-O 3.37Å; C319-L351 WeakPolarHBondContact O-CB 3.34Å; P322-L351 HydrophobicContact CB-CD1 4.18Å; P322-L351 HydrophobicContact CG-CD1 4.12Å; L348-L351 HydrophobicContact CD2-CD1 4.37Å; L348-L351 PolarHBondContact O-N 3.48Å; R349-L351 VanDerWaalsContact C-N 3.34Å; L351-V353 VanDerWaalsContact C-N 3.26Å; L351-V353 PolarHBondContact O-N 2.8Å; L351-V354 WeakPolarHBondContact O-CB 3.21Å; L351-V354 PolarHBondContact O-N 2.99Å; L351-V354 VanDerWaalsContact O-N 3.12Å; L351-N355 PolarHBondContact O-N 3.12Å
352	I	92.5	Very high	90	Very high	8 Å²	8	31.4 Å²	31.4	4%	0.041	16%	0.159	C	C	.	.	H	α-helix	trans	-58.4	-40	176.4	-66.4	173.1	0	0	0	111.3	F116 W320 Y323 R349 Y350 N355	F116-I352 HydrophobicContact CD1-CG2 4.2Å; F116-I352 HydrophobicContact CE1-CG2 3.58Å; F116-I352 HydrophobicContact CZ-CG2 4.18Å; W320-I352 HydrophobicContact CD2-CD1 4.5Å; W320-I352 HydrophobicContact CD2-CG1 4.1Å; W320-I352 HydrophobicContact CD2-CG2 4.29Å; W320-I352 HydrophobicContact CE3-CD1 4.06Å; W320-I352 HydrophobicContact CE3-CG1 4.16Å; W320-I352 HydrophobicContact CG-CG1 4.49Å; W320-I352 HydrophobicContact CH2-CG2 3.72Å; W320-I352 HydrophobicContact CZ2-CG2 3.43Å; W320-I352 VanDerWaalsContact CZ2-CG2 3.43Å; W320-I352 HydrophobicContact CZ3-CD1 4.05Å; W320-I352 HydrophobicContact CZ3-CG1 4.46Å; W320-I352 HydrophobicContact CZ3-CG2 4.28Å; Y323-I352 HydrophobicContact CD1-CD1 3.96Å; Y323-I352 HydrophobicContact CG-CD1 3.94Å; R349-I352 PolarHBondContact O-N 3.29Å; Y350-I352 VanDerWaalsContact C-N 3.26Å; Y350-I352 PolarHBondContact O-N 3.11Å; I352-N355 VanDerWaalsContact O-CB 3.29Å; I352-N355 WeakPolarHBondContact O-CB 3.42Å; I352-N355 PolarHBondContact O-N 3.33Å
353	V	95.2	Very high	89.9	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-73.6	-35.1	177.8	-174.9	0	0	0	0	111.2	L41 L82 Y85 T86 Y350 L351 N355 S356 V357	L41-V353 HydrophobicContact CB-CG1 4.1Å; L41-V353 HydrophobicContact CD1-CB 3.69Å; L41-V353 HydrophobicContact CD1-CG1 3.68Å; L82-V353 HydrophobicContact CD2-CG1 3.97Å; Y85-V353 HydrophobicContact CD1-CG2 4.02Å; Y85-V353 HydrophobicContact CE1-CG2 3.66Å; T86-V353 HydrophobicContact CG2-CG1 4.18Å; T86-V353 WeakPolarHBondContact OG1-CG1 3.42Å; Y350-V353 PolarHBondContact O-N 3.44Å; L351-V353 VanDerWaalsContact C-N 3.26Å; L351-V353 PolarHBondContact O-N 2.8Å; V353-N355 PolarHBondContact O-N 3.33Å; V353-S356 PolarHBondContact O-N 3Å; V353-S356 VanDerWaalsContact O-N 3.08Å; V353-V357 PolarHBondContact O-N 3.34Å
354	V	95.3	Very high	89.4	Confident	31 Å²	31	25.7 Å²	25.7	19%	0.188	13%	0.126	C	C	.	.	H	α-helix	trans	-55.4	-36	174.5	175.9	0	0	0	0	111.5	L41 Y350 L351 S356 V357 T358	L41-V354 HydrophobicContact CD1-CG2 3.82Å; L41-V354 HydrophobicContact CD2-CG2 4.02Å; Y350-V354 HydrophobicContact CD1-CG2 3.99Å; Y350-V354 HydrophobicContact CE1-CG2 3.5Å; Y350-V354 HydrophobicContact CE2-CG2 4.15Å; Y350-V354 HydrophobicContact CG-CG2 4.47Å; Y350-V354 WeakPolarHBondContact O-CG2 3.31Å; Y350-V354 PolarHBondContact O-N 3.34Å; Y350-V354 VanDerWaalsContact O-N 3.12Å; L351-V354 WeakPolarHBondContact O-CB 3.21Å; L351-V354 PolarHBondContact O-N 2.99Å; L351-V354 VanDerWaalsContact O-N 3.12Å; V354-S356 VanDerWaalsContact C-N 3.3Å; V354-S356 PolarHBondContact O-N 3.24Å; V354-V357 PolarHBondContact O-N 3.18Å; V354-V357 VanDerWaalsContact O-N 3.1Å; V354-T358 WeakPolarHBondContact O-CB 3.41Å; V354-T358 PolarHBondContact O-N 2.85Å; V354-T358 PolarHBondContact O-OG1 3.28Å
355	N	94.3	Very high	88.4	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-52.4	-47.8	175.4	-173.7	50.7	0	0	0	112.2	C319 L351 I352 V353 V357 T358 N359	C319-N355 HydrophobicContact CB-CB 3.69Å; L351-N355 PolarHBondContact O-N 3.12Å; I352-N355 VanDerWaalsContact O-CB 3.29Å; I352-N355 WeakPolarHBondContact O-CB 3.42Å; I352-N355 PolarHBondContact O-N 3.33Å; V353-N355 PolarHBondContact O-N 3.33Å; N355-V357 VanDerWaalsContact C-N 3.3Å; N355-V357 PolarHBondContact O-N 3.13Å; N355-T358 PolarHBondContact O-N 3.42Å; N355-T358 VanDerWaalsContact O-N 3.15Å; N355-N359 PolarHBondContact O-N 3.08Å; N355-N359 PolarHBondContact O-OD1 3.29Å
356	S	94.9	Very high	87.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-70.3	-25.6	-179.4	-70.6	0	0	0	0	113.8	N49 D78 I81 V353 V354	N49-S356 PolarHBondContact ND2-O 3.45Å; D78-S356 VanDerWaalsContact OD1-CA 3.26Å; D78-S356 WeakPolarHBondContact OD1-CA 3.47Å; D78-S356 VanDerWaalsContact OD1-CB 3.29Å; D78-S356 WeakPolarHBondContact OD1-CB 3.4Å; D78-S356 PolarHBondContact OD1-OG 3.29Å; I81-S356 VanDerWaalsContact CD1-OG 3.26Å; I81-S356 WeakPolarHBondContact CD1-OG 3.24Å; V353-S356 PolarHBondContact O-N 3Å; V353-S356 VanDerWaalsContact O-N 3.08Å; V354-S356 VanDerWaalsContact C-N 3.3Å; V354-S356 PolarHBondContact O-N 3.24Å
357	V	94.8	Very high	85.9	Confident	17 Å²	17	38.6 Å²	38.6	10%	0.103	19%	0.188	C	C	.	.	H	α-helix	trans	-78.1	-29.4	172.4	-177.2	0	0	0	0	111.4	L41 L48 L82 V353 V354 N355 P360 F361	L41-V357 HydrophobicContact CB-CG2 4.44Å; L41-V357 HydrophobicContact CD2-CB 4.5Å; L41-V357 HydrophobicContact CD2-CG2 4Å; L48-V357 HydrophobicContact CD2-CG1 4.09Å; L48-V357 WeakPolarHBondContact CD2-O 3.36Å; L82-V357 HydrophobicContact CD2-CG2 4.08Å; V353-V357 PolarHBondContact O-N 3.34Å; V354-V357 PolarHBondContact O-N 3.18Å; V354-V357 VanDerWaalsContact O-N 3.1Å; N355-V357 VanDerWaalsContact C-N 3.3Å; N355-V357 PolarHBondContact O-N 3.13Å; V357-P360 WeakPolarHBondContact O-CD 3.49Å; V357-F361 WeakPolarHBondContact O-CD2 3.39Å; V357-F361 WeakPolarHBondContact O-CE2 3.39Å
358	T	93	Very high	84.2	Confident	40 Å²	40	37.1 Å²	37.1	25%	0.245	18%	0.179	C	C	.	.	H	α-helix	trans	-76.7	-34.3	-175.3	-57	0	0	0	0	112.6	A315 V354 N355 F361 I362	A315-T358 HydrophobicContact CB-CG2 4.29Å; V354-T358 WeakPolarHBondContact O-CB 3.41Å; V354-T358 PolarHBondContact O-N 2.85Å; V354-T358 PolarHBondContact O-OG1 3.28Å; N355-T358 PolarHBondContact O-N 3.42Å; N355-T358 VanDerWaalsContact O-N 3.15Å; T358-F361 WeakPolarHBondContact O-CB 3.43Å; T358-F361 PolarHBondContact O-N 3.4Å; T358-I362 HydrophobicContact CG2-CD1 3.88Å; T358-I362 HydrophobicContact CG2-CG1 4.33Å
359	N	92	Very high	82.4	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-52.2	-48.1	-173.1	-71.5	-27	0	0	0	114.5	L74 D78 L312 N355 F361 I362 Y363	L74-N359 HydrophobicContact CD2-CB 4.43Å; D78-N359 PolarHBondContact OD1-ND2 3.08Å; D78-N359 WeakPolarHBondContact OD2-CB 3.48Å; D78-N359 PolarHBondContact OD2-ND2 2.86Å; L312-N359 WeakPolarHBondContact CD2-OD1 3.39Å; N355-N359 PolarHBondContact O-N 3.08Å; N355-N359 PolarHBondContact O-OD1 3.29Å; N359-F361 VanDerWaalsContact C-N 3.26Å; N359-F361 PolarHBondContact O-N 2.75Å; N359-I362 PolarHBondContact O-N 2.87Å; N359-Y363 VanDerWaalsContact C-CD1 3.48Å; N359-Y363 HydrophobicContact CB-CD1 4.19Å; N359-Y363 HydrophobicContact CB-CE1 3.7Å; N359-Y363 WeakPolarHBondContact O-CD1 3.37Å; N359-Y363 WeakPolarHBondContact O-CE1 3.08Å; N359-Y363 PolarHBondContact O-N 3.23Å
360	P	91.4	Very high	80.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-52	-38	175.5	-29.4	35.2	0	0	0	115.4	L48 N49 A52 V357 I362 L364	L48-P360 HydrophobicContact CD1-CB 4.33Å; L48-P360 HydrophobicContact CD2-CB 4.23Å; L48-P360 HydrophobicContact CD2-CG 4.24Å; L48-P360 HydrophobicContact CG-CB 4.05Å; L48-P360 HydrophobicContact CG-CG 4.14Å; N49-P360 WeakPolarHBondContact OD1-CG 3.39Å; A52-P360 HydrophobicContact CB-CB 4.03Å; A52-P360 HydrophobicContact CB-CG 4.24Å; V357-P360 WeakPolarHBondContact O-CD 3.49Å; P360-I362 VanDerWaalsContact C-N 3.27Å; P360-I362 PolarHBondContact O-N 2.9Å; P360-L364 HydrophobicContact CB-CD1 4.45Å; P360-L364 VanDerWaalsContact O-CB 3.3Å; P360-L364 WeakPolarHBondContact O-CB 3.37Å; P360-L364 WeakPolarHBondContact O-CG 3.34Å; P360-L364 PolarHBondContact O-N 2.8Å
361	F	89.2	Confident	78.8	Confident	75 Å²	75	39.9 Å²	39.9	33%	0.329	22%	0.216	S	C	.	.	H	α-helix	trans	-67.1	-32.2	179.5	-62.4	-78.3	0	0	0	111.9	L48 V357 T358 N359 F367 L371	L48-F361 HydrophobicContact CD1-CE1 4.45Å; L48-F361 HydrophobicContact CD1-CZ 4.19Å; L48-F361 HydrophobicContact CD2-CD2 4.01Å; L48-F361 HydrophobicContact CD2-CE1 4.39Å; L48-F361 HydrophobicContact CD2-CE2 3.23Å; L48-F361 HydrophobicContact CD2-CZ 3.46Å; L48-F361 VanDerWaalsContact CD2-CZ 3.46Å; L48-F361 HydrophobicContact CG-CZ 4.47Å; V357-F361 WeakPolarHBondContact O-CD2 3.39Å; V357-F361 WeakPolarHBondContact O-CE2 3.39Å; T358-F361 WeakPolarHBondContact O-CB 3.43Å; T358-F361 PolarHBondContact O-N 3.4Å; N359-F361 VanDerWaalsContact C-N 3.26Å; N359-F361 PolarHBondContact O-N 2.75Å; F361-F367 HydrophobicContact CD1-CB 4.03Å; F361-F367 AromaticContact CD1-CD1 3.79Å; F361-F367 HydrophobicContact CD1-CD1 3.79Å; F361-F367 HydrophobicContact CD1-CE1 4.47Å; F361-F367 HydrophobicContact CD1-CG 4.01Å; F361-F367 AromaticContact CE1-CD1 3.86Å; F361-F367 HydrophobicContact CE1-CD1 3.86Å; F361-F367 HydrophobicContact CE1-CE1 4.14Å; F361-F367 HydrophobicContact CE1-CG 4.48Å; F361-L371 HydrophobicContact CB-CD1 4.42Å
362	I	86.5	Confident	76.8	Confident	15 Å²	15	41.5 Å²	41.5	8%	0.077	23%	0.23	C	C	.	.	H	α-helix	trans	-76.5	-47	-178.3	-62.1	168.7	0	0	0	111	T308 L311 L312 A315 T358 N359 P360	T308-I362 HydrophobicContact CG2-CG2 3.86Å; T308-I362 WeakPolarHBondContact O-CG2 3.47Å; L311-I362 HydrophobicContact CB-CD1 4.17Å; L311-I362 HydrophobicContact CB-CG1 4.15Å; L311-I362 HydrophobicContact CB-CG2 3.63Å; L311-I362 HydrophobicContact CD1-CG2 4.17Å; L312-I362 HydrophobicContact CD2-CB 4.09Å; L312-I362 HydrophobicContact CD2-CD1 3.93Å; L312-I362 HydrophobicContact CD2-CG2 3.87Å; L312-I362 HydrophobicContact CG-CG2 3.81Å; A315-I362 HydrophobicContact CB-CD1 3.91Å; T358-I362 HydrophobicContact CG2-CD1 3.88Å; T358-I362 HydrophobicContact CG2-CG1 4.33Å; N359-I362 PolarHBondContact O-N 2.87Å; P360-I362 VanDerWaalsContact C-N 3.27Å; P360-I362 PolarHBondContact O-N 2.9Å
363	Y	79.7	Confident	74.6	Confident	7 Å²	7	44.2 Å²	44.2	3%	0.027	25%	0.25	C	C	.	.	H	α-helix	trans	-96.5	-10.2	-168.3	65.1	-116.4	0	0	0	115.8	K71 L74 N75 N359	K71-Y363 HydrophobicContact CD-CD2 4.07Å; K71-Y363 HydrophobicContact CD-CG 4.16Å; K71-Y363 HydrophobicContact CG-CG 4.38Å; K71-Y363 PolarHBondContact NZ-O 3.21Å; L74-Y363 HydrophobicContact CD2-CD1 4.28Å; L74-Y363 HydrophobicContact CD2-CE1 4.26Å; N75-Y363 PolarHBondContact ND2-OH 3.31Å; N359-Y363 VanDerWaalsContact C-CD1 3.48Å; N359-Y363 HydrophobicContact CB-CD1 4.19Å; N359-Y363 HydrophobicContact CB-CE1 3.7Å; N359-Y363 WeakPolarHBondContact O-CD1 3.37Å; N359-Y363 WeakPolarHBondContact O-CE1 3.08Å; N359-Y363 PolarHBondContact O-N 3.23Å
364	L	75.7	Confident	72.3	Confident	22 Å²	22	47 Å²	47	12%	0.115	27%	0.269	C	S	.	.			trans	-96.7	122.8	176.2	-69.4	176.5	0	0	0	111.7	A52 P360 K366 F367 R368	A52-L364 HydrophobicContact CB-CD1 3.59Å; P360-L364 HydrophobicContact CB-CD1 4.45Å; P360-L364 VanDerWaalsContact O-CB 3.3Å; P360-L364 WeakPolarHBondContact O-CB 3.37Å; P360-L364 WeakPolarHBondContact O-CG 3.34Å; P360-L364 PolarHBondContact O-N 2.8Å; L364-K366 VanDerWaalsContact C-N 3.33Å; L364-K366 PolarHBondContact O-N 2.91Å; L364-F367 HydrophobicContact CB-CD2 3.91Å; L364-F367 HydrophobicContact CD1-CD2 3.79Å; L364-F367 HydrophobicContact CD1-CE2 3.83Å; L364-F367 PolarHBondContact O-N 2.99Å; L364-R368 PolarHBondContact O-N 3.5Å
365	P	66.1	Low	69.8	Low	104 Å²	104	51.8 Å²	51.8	68%	0.675	29%	0.289	S	S	*	.	H	α-helix	trans	-56.9	-37.3	-176.7	-26.5	33.6	0	0	0	115.3	R368 S369	P365-R368 PolarHBondContact O-N 3.46Å; P365-S369 PolarHBondContact O-N 3.5Å; P365-S369 PolarHBondContact O-OG 2.83Å
366	K	58.9	Low	67.3	Low	160 Å²	160	54.7 Å²	54.7	70%	0.696	31%	0.313	S	S	*	.	H	α-helix	trans	-66.9	-35.8	-177.9	-83.5	-168.6	175	-172	0	113.3	L364 S369 A370	L364-K366 VanDerWaalsContact C-N 3.33Å; L364-K366 PolarHBondContact O-N 2.91Å; K366-S369 WeakPolarHBondContact CA-OG 3.45Å; K366-S369 PolarHBondContact O-OG 3.24Å; K366-A370 WeakPolarHBondContact O-CB 3.43Å; K366-A370 PolarHBondContact O-N 2.72Å
367	F	55.4	Low	64.9	Low	47 Å²	47	59.8 Å²	59.8	21%	0.206	34%	0.344	C	S	.	.	H	α-helix	trans	-73.7	-38.5	176.6	-74.5	-70.9	0	0	0	110.7	L48 F361 L364 A370 L371	L48-F367 HydrophobicContact CD1-CE1 4.2Å; L48-F367 HydrophobicContact CD1-CE2 4.06Å; L48-F367 HydrophobicContact CD1-CZ 3.65Å; F361-F367 HydrophobicContact CD1-CB 4.03Å; F361-F367 AromaticContact CD1-CD1 3.79Å; F361-F367 HydrophobicContact CD1-CD1 3.79Å; F361-F367 HydrophobicContact CD1-CE1 4.47Å; F361-F367 HydrophobicContact CD1-CG 4.01Å; F361-F367 AromaticContact CE1-CD1 3.86Å; F361-F367 HydrophobicContact CE1-CD1 3.86Å; F361-F367 HydrophobicContact CE1-CE1 4.14Å; F361-F367 HydrophobicContact CE1-CG 4.48Å; L364-F367 HydrophobicContact CB-CD2 3.91Å; L364-F367 HydrophobicContact CD1-CD2 3.79Å; L364-F367 HydrophobicContact CD1-CE2 3.83Å; L364-F367 PolarHBondContact O-N 2.99Å; F367-A370 PolarHBondContact O-N 3.28Å; F367-L371 WeakPolarHBondContact O-CB 3.2Å; F367-L371 WeakPolarHBondContact O-CG 3.47Å; F367-L371 PolarHBondContact O-N 3.13Å
368	R	51.6	Low	62.4	Low	56 Å²	56	66.8 Å²	66.8	21%	0.211	38%	0.376	C	S	.	.	H	α-helix	trans	-62.4	-42.2	172	-172.9	175.3	174.7	-178.3	-2.2	112.5	N304 H307 L364 P365 C372	N304-R368 PolarHBondContact OD1-NH2 3.04Å; H307-R368 PolarHBondContact ND1-NH2 2.73Å; L364-R368 PolarHBondContact O-N 3.5Å; P365-R368 PolarHBondContact O-N 3.46Å; R368-C372 WeakPolarHBondContact O-CB 3.46Å; R368-C372 PolarHBondContact O-N 3.31Å; R368-C372 PolarHBondContact O-SG 3.29Å
369	S	53.2	Low	59.9	Low	71 Å²	71	69.9 Å²	69.9	50%	0.497	40%	0.399	S	S	.	.	H	α-helix	trans	-66.6	-38.7	177	60.9	0	0	0	0	111.9	P365 K366 C372 S373	P365-S369 PolarHBondContact O-N 3.5Å; P365-S369 PolarHBondContact O-OG 2.83Å; K366-S369 WeakPolarHBondContact CA-OG 3.45Å; K366-S369 PolarHBondContact O-OG 3.24Å; S369-C372 PolarHBondContact O-N 2.93Å; S369-S373 WeakPolarHBondContact O-CB 3.35Å; S369-S373 PolarHBondContact O-N 2.81Å; S369-S373 PolarHBondContact O-OG 3.37Å
370	A	51	Low	57.3	Low	52 Å²	52	76.9 Å²	76.9	43%	0.43	45%	0.448	S	S	.	.	H	α-helix	trans	-63.6	-43.8	176.4	0	0	0	0	0	112.4	K366 F367 S373 S374	K366-A370 WeakPolarHBondContact O-CB 3.43Å; K366-A370 PolarHBondContact O-N 2.72Å; F367-A370 PolarHBondContact O-N 3.28Å; A370-S373 VanDerWaalsContact CA-OG 3.3Å; A370-S373 WeakPolarHBondContact CA-OG 3.49Å; A370-S373 PolarHBondContact O-N 3.25Å; A370-S373 PolarHBondContact O-OG 3.5Å; A370-S374 PolarHBondContact O-N 3.39Å; A370-S374 PolarHBondContact O-OG 3.3Å
371	L	51.1	Low	55.6	Low	91 Å²	91	80.8 Å²	80.8	48%	0.476	47%	0.47	S	S	.	.	H	α-helix	trans	-65.7	-39.2	174.8	-77.9	158.4	0	0	0	112.5	F361 F367 S374 H375	F361-L371 HydrophobicContact CB-CD1 4.42Å; F367-L371 WeakPolarHBondContact O-CB 3.2Å; F367-L371 WeakPolarHBondContact O-CG 3.47Å; F367-L371 PolarHBondContact O-N 3.13Å; L371-S374 PolarHBondContact O-OG 3.24Å; L371-H375 PolarHBondContact O-CD2 3.4Å; L371-H375 PolarHBondContact O-N 2.88Å
372	C	50.2	Low	53.9	Low	76 Å²	76	81.1 Å²	81.1	51%	0.514	48%	0.478	S	S	.	.	H	α-helix	trans	-73	-33.8	175.9	-70.4	0	0	0	0	112.5	R368 S369 H375 A376	R368-C372 WeakPolarHBondContact O-CB 3.46Å; R368-C372 PolarHBondContact O-N 3.31Å; R368-C372 PolarHBondContact O-SG 3.29Å; S369-C372 PolarHBondContact O-N 2.93Å; C372-H375 PolarHBondContact O-N 3.12Å; C372-A376 PolarHBondContact O-N 2.76Å; C372-A376 VanDerWaalsContact O-N 3.07Å
373	S	47.3	Very low	52.1	Low	65 Å²	65	84.7 Å²	84.7	46%	0.455	50%	0.5	S	S	.	.	H	α-helix	trans	-70.2	-33.1	175.6	52.9	0	0	0	0	112.3	S369 A370 A376 V377	S369-S373 WeakPolarHBondContact O-CB 3.35Å; S369-S373 PolarHBondContact O-N 2.81Å; S369-S373 PolarHBondContact O-OG 3.37Å; A370-S373 VanDerWaalsContact CA-OG 3.3Å; A370-S373 WeakPolarHBondContact CA-OG 3.49Å; A370-S373 PolarHBondContact O-N 3.25Å; A370-S373 PolarHBondContact O-OG 3.5Å; S373-A376 PolarHBondContact O-N 3.46Å; S373-V377 VanDerWaalsContact O-CG2 3.31Å; S373-V377 WeakPolarHBondContact O-CG2 3.24Å; S373-V377 PolarHBondContact O-N 2.94Å
374	S	46.3	Very low	50.4	Low	59 Å²	59	89.3 Å²	89.3	41%	0.413	53%	0.528	S	S	.	.	H	α-helix	trans	-68	-35.9	174	59.6	0	0	0	0	112.2	A370 L371 V377 Q378	A370-S374 PolarHBondContact O-N 3.39Å; A370-S374 PolarHBondContact O-OG 3.3Å; L371-S374 PolarHBondContact O-OG 3.24Å; S374-V377 PolarHBondContact O-N 3.19Å; S374-Q378 PolarHBondContact O-N 3.49Å
375	H	42.3	Very low	48.9	Very low	130 Å²	130	93.5 Å²	93.5	60%	0.602	55%	0.554	S	S	*	*	H	α-helix	trans	-70	-34.6	173.7	-88.8	-69.5	0	0	0	113.4	L371 C372 V377 Q378 S379	L371-H375 PolarHBondContact O-CD2 3.4Å; L371-H375 PolarHBondContact O-N 2.88Å; C372-H375 PolarHBondContact O-N 3.12Å; H375-V377 PolarHBondContact O-N 3.23Å; H375-Q378 PolarHBondContact O-N 3.1Å; H375-S379 PolarHBondContact O-N 3.4Å; H375-S379 PolarHBondContact O-OG 3.46Å
376	A	42.9	Very low	47.7	Very low	61 Å²	61	92.8 Å²	92.8	50%	0.504	55%	0.546	S	S	.	.	H	α-helix	trans	-69.1	-23.7	176	0	0	0	0	0	112.9	C372 S373	C372-A376 PolarHBondContact O-N 2.76Å; C372-A376 VanDerWaalsContact O-N 3.07Å; S373-A376 PolarHBondContact O-N 3.46Å
377	V	44.6	Very low	46.9	Very low	108 Å²	108	88 Å²	88	66%	0.655	54%	0.535	S	S	*	.	H	α-helix	trans	-85.8	-17.8	177	174.3	0	0	0	0	112.3	S373 S374 H375 S380	S373-V377 VanDerWaalsContact O-CG2 3.31Å; S373-V377 WeakPolarHBondContact O-CG2 3.24Å; S373-V377 PolarHBondContact O-N 2.94Å; S374-V377 PolarHBondContact O-N 3.19Å; H375-V377 PolarHBondContact O-N 3.23Å; V377-S380 PolarHBondContact O-OG 3.42Å
378	Q	41.2	Very low	46.3	Very low	164 Å²	164	91.2 Å²	91.2	77%	0.766	56%	0.56	S	S	*	*	H	α-helix	trans	-95.5	-9.5	175.6	-82.1	-178.7	-22.7	0	0	114.2	S374 H375	S374-Q378 PolarHBondContact O-N 3.49Å; H375-Q378 PolarHBondContact O-N 3.1Å
379	S	42.1	Very low	45.8	Very low	105 Å²	105	94.1 Å²	94.1	73%	0.734	59%	0.589	S	S	*	*			trans	-106.7	15.7	175.7	74	0	0	0	0	113.7	H375	H375-S379 PolarHBondContact O-N 3.4Å; H375-S379 PolarHBondContact O-OG 3.46Å
380	S	37.7	Very low	45.1	Very low	147 Å²	147	96.2 Å²	96.2	100%	1.028	60%	0.598	S	S	*	*			trans	-116.5	0	168.9	61	0	0	0	0	108.5	V377	V377-S380 PolarHBondContact O-OG 3.42Å

Retrieved 380 of 380 residues in 111.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).