A0A061AJF0_CAEEL Loading...

Bestrophin homolog

Forms chloride channels.

AlphaFold DB , UniProt , Accession A0A061AJF0, Species CAEEL (Caenorhabditis elegans), Gene best-22, Length 510 aa.

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(Predicted Aligned Error values between residue pairs)

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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	57.5	Low	81	Confident	97 Å²	97	84.5 Å²	84.5	48%	0.478	47%	0.468	S	S	.	.				0	108.4	0	-62.7	-133.9	-67.7	0	0	108.2	Y5 D302	M1-Y5 HydrophobicContact CE-CE1 4.01Å; M1-Y5 WeakPolarHBondContact CE-OH 3.32Å; M1-D302 WeakPolarHBondContact CA-O 3.3Å; M1-D302 WeakPolarHBondContact CA-OD1 3.37Å; M1-D302 HydrophobicContact CB-CB 4.3Å; M1-D302 HydrophobicContact CG-CB 3.99Å; M1-D302 PolarHBondContact N-O 3.25Å; M1-D302 HydrophobicContact SD-CB 4.31Å
2	T	75.3	Confident	81.1	Confident	50 Å²	50	90.5 Å²	90.5	31%	0.307	51%	0.508	S	S	.	.			trans	-105.6	-12.9	-176.8	48.8	0	0	0	0	111.2	S4 D301 D303 E305	T2-S4 PolarHBondContact O-N 3.49Å; T2-D301 PolarHBondContact OG1-O 3.48Å; T2-D303 WeakPolarHBondContact CG2-O 3.38Å; T2-D303 PolarHBondContact OG1-O 3.3Å; T2-E305 HydrophobicContact CG2-CB 4.45Å; T2-E305 HydrophobicContact CG2-CG 3.71Å; T2-E305 PolarHBondContact OG1-OE1 2.85Å
3	I	81.6	Confident	81.6	Confident	41 Å²	41	88.5 Å²	88.5	21%	0.21	50%	0.496	C	S	.	.	S	Bend	trans	-72.7	99.6	168.8	-63.4	171.6	0	0	0	109.2	Y5 R25 D301 D302	I3-Y5 WeakPolarHBondContact O-CD1 3.28Å; I3-Y5 PolarHBondContact O-N 3.48Å; I3-R25 HydrophobicContact CD1-CB 3.82Å; I3-D301 HydrophobicContact CD1-CB 3.88Å; I3-D302 WeakPolarHBondContact CB-OD1 3.4Å; I3-D302 PolarHBondContact N-OD1 3.38Å
4	S	84.5	Confident	81.8	Confident	87 Å²	87	92.1 Å²	92.1	61%	0.608	51%	0.512	S	S	*	.			trans	-71.6	126.1	176.6	-173	0	0	0	0	111.5	T2 R23	T2-S4 PolarHBondContact O-N 3.49Å; S4-R23 PolarHBondContact O-NH1 2.9Å
5	Y	86.4	Confident	82.1	Confident	91 Å²	91	95.8 Å²	95.8	36%	0.357	52%	0.524	S	S	.	.			trans	-128.8	8.9	169.4	57.6	-94.9	0	0	0	112.1	M1 I3 L7 D8 V9 L20	M1-Y5 HydrophobicContact CE-CE1 4.01Å; M1-Y5 WeakPolarHBondContact CE-OH 3.32Å; I3-Y5 WeakPolarHBondContact O-CD1 3.28Å; I3-Y5 PolarHBondContact O-N 3.48Å; Y5-L7 VanDerWaalsContact C-N 3.26Å; Y5-L7 PolarHBondContact O-N 3.36Å; Y5-D8 WeakPolarHBondContact O-CB 3.41Å; Y5-D8 PolarHBondContact O-N 3.21Å; Y5-D8 VanDerWaalsContact O-N 3.1Å; Y5-V9 HydrophobicContact CD2-CG1 4.11Å; Y5-V9 HydrophobicContact CD2-CG2 4.09Å; Y5-V9 HydrophobicContact CE2-CG2 4.47Å; Y5-V9 PolarHBondContact O-N 3.32Å; Y5-L20 HydrophobicContact CD2-CD1 3.54Å; Y5-L20 HydrophobicContact CE2-CD1 3.98Å; Y5-L20 HydrophobicContact CG-CD1 3.99Å
6	T	86.9	Confident	82.2	Confident	102 Å²	102	91 Å²	91	63%	0.626	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-37.2	-175.1	-51.3	0	0	0	0	112.6	V9 S10	T6-V9 PolarHBondContact O-N 2.93Å; T6-S10 PolarHBondContact O-N 3.46Å
7	L	85.6	Confident	82.4	Confident	138 Å²	138	92.7 Å²	92.7	72%	0.723	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-42.3	177.6	-176.4	62.9	0	0	0	111.8	Y5 V9 S10	Y5-L7 VanDerWaalsContact C-N 3.26Å; Y5-L7 PolarHBondContact O-N 3.36Å; L7-V9 PolarHBondContact O-N 2.96Å; L7-S10 WeakPolarHBondContact O-CB 3.04Å; L7-S10 PolarHBondContact O-N 3.2Å; L7-S10 VanDerWaalsContact O-N 3.11Å; L7-S10 PolarHBondContact O-OG 3.24Å
8	D	80.7	Confident	82.5	Confident	61 Å²	61	94.2 Å²	94.2	33%	0.326	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-30.1	179.7	-68.8	16.8	0	0	0	112	Y5 S16 R23	Y5-D8 WeakPolarHBondContact O-CB 3.41Å; Y5-D8 PolarHBondContact O-N 3.21Å; Y5-D8 VanDerWaalsContact O-N 3.1Å; D8-S16 WeakPolarHBondContact O-CB 3.48Å; D8-S16 PolarHBondContact O-OG 3.44Å; D8-R23 VanDerWaalsContact CG-NH2 3.3Å; D8-R23 IonicContact OD1-NH2 3.86Å; D8-R23 IonicContact OD2-CZ 3.81Å; D8-R23 IonicContact OD2-NE 2.88Å; D8-R23 PolarHBondContact OD2-NE 3.44Å; D8-R23 IonicContact OD2-NH2 2.69Å; D8-R23 PolarHBondContact OD2-NH2 3.49Å
9	V	85.6	Confident	82.6	Confident	64 Å²	64	91.8 Å²	91.8	39%	0.388	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	14.7	176.9	-58	0	0	0	0	113.4	Y5 T6 L7 Q11 L20	Y5-V9 HydrophobicContact CD2-CG1 4.11Å; Y5-V9 HydrophobicContact CD2-CG2 4.09Å; Y5-V9 HydrophobicContact CE2-CG2 4.47Å; Y5-V9 PolarHBondContact O-N 3.32Å; T6-V9 PolarHBondContact O-N 2.93Å; L7-V9 PolarHBondContact O-N 2.96Å; V9-Q11 PolarHBondContact O-N 3.46Å; V9-Q11 VanDerWaalsContact O-N 3.14Å; V9-L20 HydrophobicContact CG1-CD1 3.73Å
10	S	84.9	Confident	82.8	Confident	82 Å²	82	90.3 Å²	90.3	57%	0.573	49%	0.485	S	S	*	.	S	Bend	trans	-63.6	-17.8	178.3	62.7	0	0	0	0	113.3	T6 L7	T6-S10 PolarHBondContact O-N 3.46Å; L7-S10 WeakPolarHBondContact O-CB 3.04Å; L7-S10 PolarHBondContact O-N 3.2Å; L7-S10 VanDerWaalsContact O-N 3.11Å; L7-S10 PolarHBondContact O-OG 3.24Å
11	Q	82.6	Confident	83	Confident	117 Å²	117	88.9 Å²	88.9	55%	0.547	48%	0.477	S	S	.	.	S	Bend	trans	-129.9	147.5	174.9	-66.5	-178.5	1.1	0	0	110.5	V9 N13	V9-Q11 PolarHBondContact O-N 3.46Å; V9-Q11 VanDerWaalsContact O-N 3.14Å; Q11-N13 WeakPolarHBondContact CB-OD1 3.28Å; Q11-N13 PolarHBondContact O-N 3.45Å; Q11-N13 PolarHBondContact O-OD1 3.05Å; Q11-N13 PolarHBondContact OE1-ND2 3.31Å
12	T	82.1	Confident	84.5	Confident	156 Å²	156	91.3 Å²	91.3	96%	0.957	49%	0.492	S	S	*	.			trans	-90.6	71.7	177.5	56.2	0	0	0	0	110.5
13	N	86.6	Confident	85	Confident	64 Å²	64	92.5 Å²	92.5	34%	0.342	49%	0.49	S	S	.	.			trans	-117.9	151.4	178.5	18.1	14.5	0	0	0	110.6	Q11 Q15 S16 F17	Q11-N13 WeakPolarHBondContact CB-OD1 3.28Å; Q11-N13 PolarHBondContact O-N 3.45Å; Q11-N13 PolarHBondContact O-OD1 3.05Å; Q11-N13 PolarHBondContact OE1-ND2 3.31Å; N13-Q15 PolarHBondContact O-N 2.71Å; N13-S16 WeakPolarHBondContact O-CB 3.38Å; N13-S16 PolarHBondContact O-N 3.46Å; N13-S16 VanDerWaalsContact O-N 3.1Å; N13-S16 PolarHBondContact OD1-OG 3.18Å; N13-F17 PolarHBondContact O-N 3.34Å
14	L	85.2	Confident	85.4	Confident	140 Å²	140	97.5 Å²	97.5	73%	0.733	51%	0.507	S	S	*	.	H	α-helix	trans	-58.9	-36	-179.3	-70.7	172.7	0	0	0	112.1	S16 F17 F18	L14-S16 VanDerWaalsContact C-N 3.35Å; L14-S16 PolarHBondContact O-N 3.49Å; L14-F17 WeakPolarHBondContact O-CB 3.33Å; L14-F17 PolarHBondContact O-N 3.42Å; L14-F18 WeakPolarHBondContact O-CD2 3.48Å; L14-F18 PolarHBondContact O-N 2.8Å; L14-F18 VanDerWaalsContact O-N 3.11Å
15	Q	85.7	Confident	85.4	Confident	147 Å²	147	102.6 Å²	102.6	69%	0.687	51%	0.513	S	S	*	.	H	α-helix	trans	-60	-44.3	175.8	-176.4	176.5	-4.6	0	0	111.8	N13 F17 F18 S19	N13-Q15 PolarHBondContact O-N 2.71Å; Q15-F17 VanDerWaalsContact C-N 3.27Å; Q15-F17 PolarHBondContact O-N 3.44Å; Q15-F18 PolarHBondContact O-N 3.13Å; Q15-S19 WeakPolarHBondContact O-CB 3.39Å; Q15-S19 PolarHBondContact O-N 2.62Å; Q15-S19 PolarHBondContact O-OG 2.9Å; Q15-S19 VanDerWaalsContact O-OG 3.04Å
16	S	84.8	Confident	85.3	Confident	19 Å²	19	100 Å²	100	13%	0.133	51%	0.513	C	S	.	.	H	α-helix	trans	-60.1	-38.8	178.6	-54.5	0	0	0	0	111.9	D8 N13 L14 L20	D8-S16 WeakPolarHBondContact O-CB 3.48Å; D8-S16 PolarHBondContact O-OG 3.44Å; N13-S16 WeakPolarHBondContact O-CB 3.38Å; N13-S16 PolarHBondContact O-N 3.46Å; N13-S16 VanDerWaalsContact O-N 3.1Å; N13-S16 PolarHBondContact OD1-OG 3.18Å; L14-S16 VanDerWaalsContact C-N 3.35Å; L14-S16 PolarHBondContact O-N 3.49Å; S16-L20 WeakPolarHBondContact O-CB 3.49Å; S16-L20 PolarHBondContact O-N 2.71Å; S16-L20 VanDerWaalsContact O-N 3.09Å
17	F	84.2	Confident	85.5	Confident	120 Å²	120	96 Å²	96	53%	0.526	49%	0.49	S	S	.	.	H	α-helix	trans	-63.6	-48.4	173.8	177.3	-104.2	0	0	0	112.3	N13 L14 Q15 L20 L21	N13-F17 PolarHBondContact O-N 3.34Å; L14-F17 WeakPolarHBondContact O-CB 3.33Å; L14-F17 PolarHBondContact O-N 3.42Å; Q15-F17 VanDerWaalsContact C-N 3.27Å; Q15-F17 PolarHBondContact O-N 3.44Å; F17-L20 PolarHBondContact O-N 3.44Å; F17-L21 HydrophobicContact CD1-CD1 3.97Å; F17-L21 HydrophobicContact CE1-CD1 3.35Å; F17-L21 HydrophobicContact CE1-CG 4.23Å; F17-L21 HydrophobicContact CE2-CD1 4.29Å; F17-L21 HydrophobicContact CE2-CG 4.43Å; F17-L21 HydrophobicContact CZ-CD1 3.54Å; F17-L21 HydrophobicContact CZ-CD2 4.5Å; F17-L21 HydrophobicContact CZ-CG 4.14Å; F17-L21 PolarHBondContact O-N 2.97Å
18	F	85.3	Confident	85.7	Confident	120 Å²	120	92.2 Å²	92.2	53%	0.526	47%	0.472	S	S	.	.	H	α-helix	trans	-67.3	-39.9	178.5	-75.9	-67.6	0	0	0	113	L14 Q15 L20 L21 L22	L14-F18 WeakPolarHBondContact O-CD2 3.48Å; L14-F18 PolarHBondContact O-N 2.8Å; L14-F18 VanDerWaalsContact O-N 3.11Å; Q15-F18 PolarHBondContact O-N 3.13Å; F18-L20 VanDerWaalsContact C-N 3.25Å; F18-L20 PolarHBondContact O-N 2.89Å; F18-L21 PolarHBondContact O-N 2.86Å; F18-L22 WeakPolarHBondContact O-CG 3.43Å; F18-L22 PolarHBondContact O-N 3.26Å
19	S	83.9	Confident	86.2	Confident	48 Å²	48	93.6 Å²	93.6	34%	0.336	47%	0.473	S	S	.	.	H	α-helix	trans	-57.8	-40.1	174.5	-66.7	0	0	0	0	111.5	Q15	Q15-S19 WeakPolarHBondContact O-CB 3.39Å; Q15-S19 PolarHBondContact O-N 2.62Å; Q15-S19 PolarHBondContact O-OG 2.9Å; Q15-S19 VanDerWaalsContact O-OG 3.04Å
20	L	87.3	Confident	86.4	Confident	61 Å²	61	95.3 Å²	95.3	32%	0.319	48%	0.475	S	S	.	.	H	α-helix	trans	-68.2	-44	175.9	-171	124	0	0	0	112	Y5 V9 S16 F17 F18 L22 R23	Y5-L20 HydrophobicContact CD2-CD1 3.54Å; Y5-L20 HydrophobicContact CE2-CD1 3.98Å; Y5-L20 HydrophobicContact CG-CD1 3.99Å; V9-L20 HydrophobicContact CG1-CD1 3.73Å; S16-L20 WeakPolarHBondContact O-CB 3.49Å; S16-L20 PolarHBondContact O-N 2.71Å; S16-L20 VanDerWaalsContact O-N 3.09Å; F17-L20 PolarHBondContact O-N 3.44Å; F18-L20 VanDerWaalsContact C-N 3.25Å; F18-L20 PolarHBondContact O-N 2.89Å; L20-L22 VanDerWaalsContact C-N 3.27Å; L20-L22 PolarHBondContact O-N 3.34Å; L20-R23 PolarHBondContact O-N 2.98Å
21	L	86.9	Confident	86.7	Confident	62 Å²	62	93.4 Å²	93.4	33%	0.325	46%	0.464	S	S	.	.	H	α-helix	trans	-62.7	-31.2	177.8	-74.8	-179.5	0	0	0	113.2	F17 F18 R23 W29	F17-L21 HydrophobicContact CD1-CD1 3.97Å; F17-L21 HydrophobicContact CE1-CD1 3.35Å; F17-L21 HydrophobicContact CE1-CG 4.23Å; F17-L21 HydrophobicContact CE2-CD1 4.29Å; F17-L21 HydrophobicContact CE2-CG 4.43Å; F17-L21 HydrophobicContact CZ-CD1 3.54Å; F17-L21 HydrophobicContact CZ-CD2 4.5Å; F17-L21 HydrophobicContact CZ-CG 4.14Å; F17-L21 PolarHBondContact O-N 2.97Å; F18-L21 PolarHBondContact O-N 2.86Å; L21-R23 VanDerWaalsContact C-N 3.32Å; L21-R23 PolarHBondContact O-N 3.21Å; L21-W29 PolarHBondContact O-NE1 3.08Å
22	L	87.8	Confident	87.2	Confident	148 Å²	148	87.8 Å²	87.8	78%	0.775	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-1.1	-177.4	-68.3	172.4	0	0	0	114.1	F18 L20	F18-L22 WeakPolarHBondContact O-CG 3.43Å; F18-L22 PolarHBondContact O-N 3.26Å; L20-L22 VanDerWaalsContact C-N 3.27Å; L20-L22 PolarHBondContact O-N 3.34Å
23	R	87.3	Confident	87.8	Confident	74 Å²	74	86 Å²	86	28%	0.279	42%	0.417	S	S	.	.			trans	-70.1	142	176.6	-74.4	178.6	169.1	-134.9	-0.7	111.4	S4 D8 L20 L21 S27	S4-R23 PolarHBondContact O-NH1 2.9Å; D8-R23 VanDerWaalsContact CG-NH2 3.3Å; D8-R23 IonicContact OD1-NH2 3.86Å; D8-R23 IonicContact OD2-CZ 3.81Å; D8-R23 IonicContact OD2-NE 2.88Å; D8-R23 PolarHBondContact OD2-NE 3.44Å; D8-R23 IonicContact OD2-NH2 2.69Å; D8-R23 PolarHBondContact OD2-NH2 3.49Å; L20-R23 PolarHBondContact O-N 2.98Å; L21-R23 VanDerWaalsContact C-N 3.32Å; L21-R23 PolarHBondContact O-N 3.21Å; R23-S27 WeakPolarHBondContact O-CB 3.41Å; R23-S27 PolarHBondContact O-OG 3.42Å
24	W	88.3	Confident	88.1	Confident	146 Å²	146	85.2 Å²	85.2	55%	0.553	42%	0.424	S	S	*	.			trans	-100.2	-47.2	179.2	-176.6	-100.8	0	0	0	114	S27 W29 K30	W24-S27 PolarHBondContact O-N 3.36Å; W24-S27 PolarHBondContact O-OG 2.94Å; W24-W29 HydrophobicContact CE3-CB 3.97Å; W24-W29 HydrophobicContact CZ3-CB 3.78Å; W24-K30 HydrophobicContact CD2-CB 4.49Å; W24-K30 HydrophobicContact CZ2-CB 4.31Å; W24-K30 HydrophobicContact CZ2-CG 4.4Å; W24-K30 WeakPolarHBondContact O-CB 3.49Å
25	R	86.3	Confident	88.6	Confident	194 Å²	194	81.5 Å²	81.5	73%	0.732	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	136.8	179	-67.2	-173.4	177.7	177.5	-1.6	110.2	I3 S27	I3-R25 HydrophobicContact CD1-CB 3.82Å; R25-S27 PolarHBondContact O-N 3.23Å; R25-S27 VanDerWaalsContact O-N 3.12Å
26	G	83.9	Confident	89	Confident	36 Å²	36	75.3 Å²	75.3	37%	0.371	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	14.4	-176.8	0	0	0	0	0	115.2	D301 D302	G26-D301 PolarHBondContact N-OD2 2.93Å; G26-D301 VanDerWaalsContact N-OD2 3.16Å; G26-D302 WeakPolarHBondContact CA-OD2 3.36Å
27	S	90.4	Very high	89.6	Confident	19 Å²	19	76.7 Å²	76.7	13%	0.133	39%	0.387	C	S	.	.	S	Bend	trans	-98.8	161	-172	84.8	0	0	0	0	113.6	R23 W24 R25 W29 K30 A31	R23-S27 WeakPolarHBondContact O-CB 3.41Å; R23-S27 PolarHBondContact O-OG 3.42Å; W24-S27 PolarHBondContact O-N 3.36Å; W24-S27 PolarHBondContact O-OG 2.94Å; R25-S27 PolarHBondContact O-N 3.23Å; R25-S27 VanDerWaalsContact O-N 3.12Å; S27-W29 PolarHBondContact O-N 3.33Å; S27-W29 PolarHBondContact OG-N 2.87Å; S27-K30 PolarHBondContact O-N 3.46Å; S27-A31 PolarHBondContact O-N 2.81Å
28	V	89.6	Confident	90.2	Very high	59 Å²	59	75.7 Å²	75.7	36%	0.358	39%	0.39	S	S	.	.	H	α-helix	trans	-56.4	-30.6	173.6	68.6	0	0	0	0	112.1	A31 V32	V28-A31 PolarHBondContact O-N 3.19Å; V28-V32 HydrophobicContact CG2-CG2 3.9Å; V28-V32 WeakPolarHBondContact O-CB 3.47Å; V28-V32 WeakPolarHBondContact O-CG2 3.36Å; V28-V32 PolarHBondContact O-N 3.14Å
29	W	91.2	Very high	90.8	Very high	90 Å²	90	70.7 Å²	70.7	34%	0.341	37%	0.368	S	S	.	.	H	α-helix	trans	-66	-51	179	-52.8	115.3	0	0	0	111.1	L21 W24 S27 A31 V32 F33 L281	L21-W29 PolarHBondContact O-NE1 3.08Å; W24-W29 HydrophobicContact CE3-CB 3.97Å; W24-W29 HydrophobicContact CZ3-CB 3.78Å; S27-W29 PolarHBondContact O-N 3.33Å; S27-W29 PolarHBondContact OG-N 2.87Å; W29-A31 PolarHBondContact O-N 3.24Å; W29-V32 PolarHBondContact O-N 3Å; W29-F33 WeakPolarHBondContact O-CB 3.28Å; W29-F33 PolarHBondContact O-N 3.42Å; W29-L281 HydrophobicContact CE3-CD2 4.38Å; W29-L281 HydrophobicContact CH2-CD1 4.35Å; W29-L281 HydrophobicContact CZ3-CD1 3.91Å; W29-L281 HydrophobicContact CZ3-CD2 4.02Å
30	K	91.3	Very high	91.4	Very high	100 Å²	100	69.4 Å²	69.4	44%	0.435	36%	0.358	S	S	.	.	H	α-helix	trans	-58.9	-38.3	177.3	-171.4	-173.1	-177.3	-164.9	0	111.3	W24 S27 D301	W24-K30 HydrophobicContact CD2-CB 4.49Å; W24-K30 HydrophobicContact CZ2-CB 4.31Å; W24-K30 HydrophobicContact CZ2-CG 4.4Å; W24-K30 WeakPolarHBondContact O-CB 3.49Å; S27-K30 PolarHBondContact O-N 3.46Å; K30-D301 WeakPolarHBondContact CD-OD2 3.42Å; K30-D301 IonicContact NZ-OD1 3.68Å; K30-D301 PolarHBondContact NZ-OD1 2.87Å; K30-D301 IonicContact NZ-OD2 3.87Å; K30-D301 PolarHBondContact NZ-OD2 3.34Å
31	A	90.1	Very high	91.9	Very high	41 Å²	41	69.2 Å²	69.2	34%	0.339	37%	0.366	S	S	.	.	H	α-helix	trans	-74.7	-35.5	-176.9	0	0	0	0	0	114.5	S27 V28 W29 K288	S27-A31 PolarHBondContact O-N 2.81Å; V28-A31 PolarHBondContact O-N 3.19Å; W29-A31 PolarHBondContact O-N 3.24Å; A31-K288 HydrophobicContact CB-CB 4.11Å; A31-K288 HydrophobicContact CB-CD 4.32Å; A31-K288 HydrophobicContact CB-CG 4.15Å
32	V	94.1	Very high	92.4	Very high	0 Å²	0	69 Å²	69	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-112	-26.8	-168	-175.4	0	0	0	0	113.3	V28 W29 G34 Q35 L36 F280 L281 M284 K288	V28-V32 HydrophobicContact CG2-CG2 3.9Å; V28-V32 WeakPolarHBondContact O-CB 3.47Å; V28-V32 WeakPolarHBondContact O-CG2 3.36Å; V28-V32 PolarHBondContact O-N 3.14Å; W29-V32 PolarHBondContact O-N 3Å; V32-G34 VanDerWaalsContact C-N 3.34Å; V32-G34 PolarHBondContact O-N 3.35Å; V32-Q35 PolarHBondContact O-N 3.48Å; V32-L36 PolarHBondContact O-N 2.66Å; V32-F280 HydrophobicContact CG1-CD1 3.88Å; V32-F280 HydrophobicContact CG1-CE1 3.63Å; V32-L281 HydrophobicContact CB-CD2 4.45Å; V32-L281 HydrophobicContact CG1-CD2 4.04Å; V32-M284 HydrophobicContact CG1-CB 3.93Å; V32-M284 HydrophobicContact CG2-CB 4.4Å; V32-K288 HydrophobicContact CG2-CG 4.2Å
33	F	92.9	Very high	92.8	Very high	119 Å²	119	61.9 Å²	61.9	52%	0.522	33%	0.33	S	S	.	.	H	α-helix	trans	-55.8	-43.7	-169.2	-177.6	-97.9	0	0	0	113.5	W29 Q35 L36 A37	W29-F33 WeakPolarHBondContact O-CB 3.28Å; W29-F33 PolarHBondContact O-N 3.42Å; F33-Q35 VanDerWaalsContact C-N 3.32Å; F33-Q35 PolarHBondContact O-N 3.24Å; F33-L36 PolarHBondContact O-N 3.39Å; F33-A37 WeakPolarHBondContact O-CB 3.48Å; F33-A37 PolarHBondContact O-N 3.01Å
34	G	93.9	Very high	93.2	Very high	47 Å²	47	60.9 Å²	60.9	49%	0.485	33%	0.33	S	S	.	.	H	α-helix	trans	-61.2	-39	177.5	0	0	0	0	0	113.2	V32 V38	V32-G34 VanDerWaalsContact C-N 3.34Å; V32-G34 PolarHBondContact O-N 3.35Å; G34-V38 WeakPolarHBondContact O-CG2 3.24Å; G34-V38 PolarHBondContact O-N 3.36Å
35	Q	94.9	Very high	93.6	Very high	62 Å²	62	58.9 Å²	58.9	29%	0.29	33%	0.329	S	S	.	.	H	α-helix	trans	-74.5	-38	179.3	-60.7	179.4	34.9	0	0	111.6	V32 F33 V38 W39 F280	V32-Q35 PolarHBondContact O-N 3.48Å; F33-Q35 VanDerWaalsContact C-N 3.32Å; F33-Q35 PolarHBondContact O-N 3.24Å; Q35-V38 PolarHBondContact O-N 3.43Å; Q35-W39 WeakPolarHBondContact O-CB 3.45Å; Q35-W39 PolarHBondContact O-N 2.93Å; Q35-F280 HydrophobicContact CB-CE1 4.27Å; Q35-F280 HydrophobicContact CB-CZ 4.07Å
36	L	95.7	Very high	94.1	Very high	16 Å²	16	51.2 Å²	51.2	8%	0.084	30%	0.302	C	S	.	.	H	α-helix	trans	-62.4	-44	173.5	179.6	63.9	0	0	0	110.9	V32 F33 V38 W39 T40 M277 F280 L281	V32-L36 PolarHBondContact O-N 2.66Å; F33-L36 PolarHBondContact O-N 3.39Å; L36-V38 PolarHBondContact O-N 3.36Å; L36-W39 HydrophobicContact CD1-CE3 4.43Å; L36-W39 PolarHBondContact O-N 2.66Å; L36-T40 WeakPolarHBondContact O-CB 3.48Å; L36-T40 PolarHBondContact O-N 3.33Å; L36-T40 PolarHBondContact O-OG1 3.48Å; L36-M277 HydrophobicContact CD1-CB 4.23Å; L36-M277 HydrophobicContact CD1-CE 4.23Å; L36-M277 HydrophobicContact CD1-CG 4.21Å; L36-M277 HydrophobicContact CD2-CE 4.27Å; L36-M277 HydrophobicContact CG-CE 4.37Å; L36-F280 HydrophobicContact CB-CD1 4.02Å; L36-F280 HydrophobicContact CB-CE1 3.84Å; L36-F280 HydrophobicContact CD1-CB 4.21Å; L36-F280 HydrophobicContact CD1-CD1 3.68Å; L36-F280 HydrophobicContact CD1-CE1 4.22Å; L36-F280 HydrophobicContact CD1-CG 4Å; L36-F280 HydrophobicContact CG-CD1 4.41Å; L36-L281 HydrophobicContact CD2-CD1 4.35Å; L36-L281 HydrophobicContact CD2-CD2 3.81Å; L36-L281 HydrophobicContact CD2-CG 4.01Å
37	A	96.4	Very high	94.5	Very high	49 Å²	49	49.5 Å²	49.5	41%	0.405	29%	0.285	S	S	.	.	H	α-helix	trans	-59.6	-45.2	178.3	0	0	0	0	0	112	F33 T40 A41	F33-A37 WeakPolarHBondContact O-CB 3.48Å; F33-A37 PolarHBondContact O-N 3.01Å; A37-T40 PolarHBondContact O-N 3.48Å; A37-A41 WeakPolarHBondContact O-CB 3.41Å; A37-A41 PolarHBondContact O-N 3.28Å
38	V	97	Very high	94.7	Very high	98 Å²	98	50.9 Å²	50.9	59%	0.594	29%	0.294	S	S	*	.	H	α-helix	trans	-63	-46.8	174.9	172.7	0	0	0	0	111	G34 Q35 L36 T40 A41 V42	G34-V38 WeakPolarHBondContact O-CG2 3.24Å; G34-V38 PolarHBondContact O-N 3.36Å; Q35-V38 PolarHBondContact O-N 3.43Å; L36-V38 PolarHBondContact O-N 3.36Å; V38-T40 PolarHBondContact O-N 2.89Å; V38-A41 PolarHBondContact O-N 3.23Å; V38-V42 WeakPolarHBondContact O-CG2 3.48Å; V38-V42 PolarHBondContact O-N 2.74Å
39	W	97.5	Very high	95	Very high	15 Å²	15	51.2 Å²	51.2	6%	0.057	29%	0.293	C	S	.	.	H	α-helix	trans	-59.8	-45	178.6	-176.8	91.1	0	0	0	111.7	Q35 L36 V42 F43 F249 C252 L253 P273 T276 M277 F280	Q35-W39 WeakPolarHBondContact O-CB 3.45Å; Q35-W39 PolarHBondContact O-N 2.93Å; L36-W39 HydrophobicContact CD1-CE3 4.43Å; L36-W39 PolarHBondContact O-N 2.66Å; W39-V42 PolarHBondContact O-N 3.11Å; W39-F43 HydrophobicContact CH2-CB 4.43Å; W39-F43 AromaticContact CH2-CD2 3.71Å; W39-F43 HydrophobicContact CH2-CD2 3.71Å; W39-F43 HydrophobicContact CH2-CE2 4.28Å; W39-F43 HydrophobicContact CH2-CG 4.19Å; W39-F43 AromaticContact CZ2-CD2 3.99Å; W39-F43 HydrophobicContact CZ2-CD2 3.99Å; W39-F43 HydrophobicContact CZ3-CB 4.3Å; W39-F43 HydrophobicContact CZ3-CD2 4.34Å; W39-F43 HydrophobicContact CZ3-CG 4.37Å; W39-F43 WeakPolarHBondContact O-CB 3.47Å; W39-F43 PolarHBondContact O-N 3.13Å; W39-F249 PolarHBondContact NE1-O 2.85Å; W39-C252 HydrophobicContact CZ2-CB 4.24Å; W39-L253 HydrophobicContact CD2-CD2 4.08Å; W39-L253 HydrophobicContact CG-CD2 4.02Å; W39-L253 HydrophobicContact CZ2-CD2 4.27Å; W39-L253 WeakPolarHBondContact O-CD2 3.31Å; W39-P273 HydrophobicContact CH2-CG 3.67Å; W39-P273 HydrophobicContact CZ3-CG 3.81Å; W39-T276 HydrophobicContact CH2-CG2 3.55Å; W39-T276 HydrophobicContact CZ2-CG2 3.71Å; W39-M277 HydrophobicContact CZ3-CG 3.91Å; W39-F280 HydrophobicContact CB-CE2 3.93Å; W39-F280 HydrophobicContact CB-CZ 4.19Å; W39-F280 AromaticContact CD1-CE2 3.82Å; W39-F280 HydrophobicContact CD2-CD2 4.25Å; W39-F280 HydrophobicContact CD2-CE2 4.44Å; W39-F280 HydrophobicContact CG-CD2 4.06Å; W39-F280 AromaticContact CG-CE2 3.78Å; W39-F280 HydrophobicContact CG-CE2 3.78Å
40	T	96.6	Very high	95.1	Very high	21 Å²	21	47 Å²	47	13%	0.129	28%	0.277	C	S	.	.	H	α-helix	trans	-64.1	-41.8	177	-61.9	0	0	0	0	111.7	L36 A37 V38 V42 F43 L44 L272	L36-T40 WeakPolarHBondContact O-CB 3.48Å; L36-T40 PolarHBondContact O-N 3.33Å; L36-T40 PolarHBondContact O-OG1 3.48Å; A37-T40 PolarHBondContact O-N 3.48Å; V38-T40 PolarHBondContact O-N 2.89Å; T40-V42 PolarHBondContact O-N 2.87Å; T40-F43 PolarHBondContact O-N 2.91Å; T40-L44 HydrophobicContact CG2-CD1 4.07Å; T40-L44 HydrophobicContact CG2-CG 4.37Å; T40-L44 WeakPolarHBondContact O-CB 3.36Å; T40-L44 VanDerWaalsContact O-CG 3.31Å; T40-L44 WeakPolarHBondContact O-CG 3.26Å; T40-L44 PolarHBondContact O-N 3.38Å; T40-L272 HydrophobicContact CG2-CD2 3.77Å
41	A	97.1	Very high	95	Very high	58 Å²	58	44.3 Å²	44.3	48%	0.479	26%	0.264	S	S	.	.	H	α-helix	trans	-61.5	-44	176.8	0	0	0	0	0	111.9	A37 V38 L44 L45	A37-A41 WeakPolarHBondContact O-CB 3.41Å; A37-A41 PolarHBondContact O-N 3.28Å; V38-A41 PolarHBondContact O-N 3.23Å; A41-L44 PolarHBondContact O-N 3.1Å; A41-L45 WeakPolarHBondContact O-CB 3.32Å; A41-L45 PolarHBondContact O-N 3.13Å
42	V	97.6	Very high	95.1	Very high	56 Å²	56	50.4 Å²	50.4	34%	0.339	28%	0.279	S	S	.	.	H	α-helix	trans	-66.9	-41.2	176.3	177.2	0	0	0	0	111.1	V38 W39 T40 L44 L45 I46 L253	V38-V42 WeakPolarHBondContact O-CG2 3.48Å; V38-V42 PolarHBondContact O-N 2.74Å; W39-V42 PolarHBondContact O-N 3.11Å; T40-V42 PolarHBondContact O-N 2.87Å; V42-L44 PolarHBondContact O-N 2.99Å; V42-L45 PolarHBondContact O-N 3.24Å; V42-I46 HydrophobicContact CG1-CD1 3.98Å; V42-I46 WeakPolarHBondContact O-CG1 3.39Å; V42-I46 PolarHBondContact O-N 3.24Å; V42-L253 HydrophobicContact CB-CD2 4.17Å; V42-L253 HydrophobicContact CG1-CD1 3.86Å; V42-L253 HydrophobicContact CG1-CD2 4.03Å
43	F	96.8	Very high	95.1	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-59.1	-47.3	176.4	-175.4	-82.5	0	0	0	111.6	W39 T40 I46 S47 L253 R256 Q257 F258 P273	W39-F43 HydrophobicContact CH2-CB 4.43Å; W39-F43 AromaticContact CH2-CD2 3.71Å; W39-F43 HydrophobicContact CH2-CD2 3.71Å; W39-F43 HydrophobicContact CH2-CE2 4.28Å; W39-F43 HydrophobicContact CH2-CG 4.19Å; W39-F43 AromaticContact CZ2-CD2 3.99Å; W39-F43 HydrophobicContact CZ2-CD2 3.99Å; W39-F43 HydrophobicContact CZ3-CB 4.3Å; W39-F43 HydrophobicContact CZ3-CD2 4.34Å; W39-F43 HydrophobicContact CZ3-CG 4.37Å; W39-F43 WeakPolarHBondContact O-CB 3.47Å; W39-F43 PolarHBondContact O-N 3.13Å; T40-F43 PolarHBondContact O-N 2.91Å; F43-I46 PolarHBondContact O-N 2.87Å; F43-S47 PolarHBondContact O-N 3Å; F43-L253 HydrophobicContact CB-CD2 3.98Å; F43-R256 HydrophobicContact CE2-CB 4.4Å; F43-R256 VanDerWaalsContact CZ-O 3.29Å; F43-R256 WeakPolarHBondContact CZ-O 3.31Å; F43-Q257 HydrophobicContact CE2-CG 4.22Å; F43-Q257 HydrophobicContact CZ-CG 4.34Å; F43-Q257 PolarHBondContact O-NE2 3.5Å; F43-F258 HydrophobicContact CZ-CD2 4.44Å; F43-F258 HydrophobicContact CZ-CE2 4.45Å; F43-P273 HydrophobicContact CD1-CG 3.82Å; F43-P273 HydrophobicContact CD2-CG 4.02Å; F43-P273 HydrophobicContact CE1-CB 4.16Å; F43-P273 VanDerWaalsContact CE1-CD 3.43Å; F43-P273 HydrophobicContact CE1-CG 3.57Å; F43-P273 HydrophobicContact CE2-CB 4.19Å; F43-P273 HydrophobicContact CE2-CG 3.76Å; F43-P273 HydrophobicContact CG-CG 4.05Å; F43-P273 HydrophobicContact CZ-CB 3.79Å; F43-P273 HydrophobicContact CZ-CG 3.52Å
44	L	96.1	Very high	95.1	Very high	53 Å²	53	53.7 Å²	53.7	28%	0.277	30%	0.299	S	S	.	.	H	α-helix	trans	-65.1	-40	177.6	-71.8	175.4	0	0	0	111.8	T40 A41 V42 I46 S47 C48 W271 L272	T40-L44 HydrophobicContact CG2-CD1 4.07Å; T40-L44 HydrophobicContact CG2-CG 4.37Å; T40-L44 WeakPolarHBondContact O-CB 3.36Å; T40-L44 VanDerWaalsContact O-CG 3.31Å; T40-L44 WeakPolarHBondContact O-CG 3.26Å; T40-L44 PolarHBondContact O-N 3.38Å; A41-L44 PolarHBondContact O-N 3.1Å; V42-L44 PolarHBondContact O-N 2.99Å; L44-I46 PolarHBondContact O-N 3.36Å; L44-S47 WeakPolarHBondContact O-CB 3.39Å; L44-S47 PolarHBondContact O-N 3.12Å; L44-C48 PolarHBondContact O-N 2.91Å; L44-C48 PolarHBondContact O-SG 3.33Å; L44-C48 VanDerWaalsContact O-SG 3.36Å; L44-W271 VanDerWaalsContact CD2-O 3.23Å; L44-W271 WeakPolarHBondContact CD2-O 3.32Å; L44-L272 HydrophobicContact CD1-CD2 4.1Å; L44-L272 HydrophobicContact CD2-CD2 3.91Å; L44-L272 HydrophobicContact CG-CD2 4.22Å
45	L	96.6	Very high	95.1	Very high	103 Å²	103	53.6 Å²	53.6	54%	0.539	29%	0.291	S	S	.	.	H	α-helix	trans	-58.8	-46.9	175.2	178.4	64.6	0	0	0	111.4	A41 V42 S47 C48 I49	A41-L45 WeakPolarHBondContact O-CB 3.32Å; A41-L45 PolarHBondContact O-N 3.13Å; V42-L45 PolarHBondContact O-N 3.24Å; L45-S47 VanDerWaalsContact C-N 3.31Å; L45-S47 PolarHBondContact O-N 2.95Å; L45-C48 PolarHBondContact O-N 3.41Å; L45-I49 HydrophobicContact CD1-CD1 4.41Å; L45-I49 HydrophobicContact CG-CD1 4.14Å; L45-I49 WeakPolarHBondContact O-CG1 3.46Å; L45-I49 PolarHBondContact O-N 3.47Å
46	I	95.9	Very high	94.8	Very high	34 Å²	34	55.4 Å²	55.4	17%	0.174	31%	0.308	C	S	.	.	H	α-helix	trans	-61.3	-42.3	176.1	-66.9	166.2	0	0	0	110.5	V42 F43 L44 C48 I49 Y50 F62 L253 Q257	V42-I46 HydrophobicContact CG1-CD1 3.98Å; V42-I46 WeakPolarHBondContact O-CG1 3.39Å; V42-I46 PolarHBondContact O-N 3.24Å; F43-I46 PolarHBondContact O-N 2.87Å; L44-I46 PolarHBondContact O-N 3.36Å; I46-C48 PolarHBondContact O-N 3.07Å; I46-I49 PolarHBondContact O-N 3.01Å; I46-Y50 PolarHBondContact O-N 3.39Å; I46-F62 HydrophobicContact CG2-CE2 4.26Å; I46-F62 HydrophobicContact CG2-CZ 3.65Å; I46-L253 HydrophobicContact CD1-CB 3.98Å; I46-Q257 HydrophobicContact CG2-CG 4.08Å
47	S	93.9	Very high	94.5	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-61.6	-42.2	176.7	-157.7	0	0	0	0	112.2	F43 L44 L45 Y50 R51	F43-S47 PolarHBondContact O-N 3Å; L44-S47 WeakPolarHBondContact O-CB 3.39Å; L44-S47 PolarHBondContact O-N 3.12Å; L45-S47 VanDerWaalsContact C-N 3.31Å; L45-S47 PolarHBondContact O-N 2.95Å; S47-Y50 PolarHBondContact O-N 2.98Å; S47-R51 VanDerWaalsContact O-CG 3.32Å; S47-R51 WeakPolarHBondContact O-CG 3.45Å; S47-R51 PolarHBondContact O-N 3.2Å; S47-R51 PolarHBondContact OG-NE 3.39Å
48	C	94.3	Very high	94.2	Very high	48 Å²	48	60.7 Å²	60.7	32%	0.324	33%	0.333	S	S	.	.	H	α-helix	trans	-62.8	-42.4	174.9	-72.6	0	0	0	0	112.2	L44 L45 I46 R51 Y52	L44-C48 PolarHBondContact O-N 2.91Å; L44-C48 PolarHBondContact O-SG 3.33Å; L44-C48 VanDerWaalsContact O-SG 3.36Å; L45-C48 PolarHBondContact O-N 3.41Å; I46-C48 PolarHBondContact O-N 3.07Å; C48-R51 PolarHBondContact O-N 3.44Å; C48-Y52 HydrophobicContact CB-CD2 4.38Å; C48-Y52 WeakPolarHBondContact O-CB 3.45Å; C48-Y52 WeakPolarHBondContact O-CD2 3.41Å; C48-Y52 PolarHBondContact O-N 3.48Å
49	I	94.9	Very high	93.9	Very high	65 Å²	65	57.3 Å²	57.3	33%	0.333	31%	0.311	S	S	.	.	I	π-helix	trans	-60.7	-47.9	176.2	-68.4	165.5	0	0	0	109.9	L45 I46 R51 M53 L54	L45-I49 HydrophobicContact CD1-CD1 4.41Å; L45-I49 HydrophobicContact CG-CD1 4.14Å; L45-I49 WeakPolarHBondContact O-CG1 3.46Å; L45-I49 PolarHBondContact O-N 3.47Å; I46-I49 PolarHBondContact O-N 3.01Å; I49-R51 PolarHBondContact O-N 3.08Å; I49-M53 HydrophobicContact CG1-SD 3.93Å; I49-M53 HydrophobicContact CG2-CB 4.3Å; I49-M53 WeakPolarHBondContact O-CA 3.35Å; I49-M53 WeakPolarHBondContact O-CB 3.48Å; I49-M53 PolarHBondContact O-N 3.48Å; I49-L54 HydrophobicContact CG2-CD2 4.3Å; I49-L54 HydrophobicContact CG2-CG 4.29Å; I49-L54 PolarHBondContact O-N 3.49Å; I49-L54 VanDerWaalsContact O-N 3.09Å
50	Y	92.8	Very high	93.5	Very high	1 Å²	1	60.6 Å²	60.6	0%	0.004	33%	0.329	C	S	.	.	I	π-helix	trans	-58.5	-45.8	178.1	165.1	-113.3	0	0	0	112.7	I46 S47 L54 Q59 F62 E63 F258 V260 T261	I46-Y50 PolarHBondContact O-N 3.39Å; S47-Y50 PolarHBondContact O-N 2.98Å; Y50-L54 HydrophobicContact CD2-CD1 4.25Å; Y50-Q59 HydrophobicContact CD2-CB 4.38Å; Y50-Q59 HydrophobicContact CD2-CG 3.98Å; Y50-Q59 HydrophobicContact CE2-CB 3.89Å; Y50-Q59 HydrophobicContact CE2-CG 3.85Å; Y50-Q59 PolarHBondContact O-NE2 3.24Å; Y50-F62 AromaticContact CD2-CD1 3.32Å; Y50-F62 HydrophobicContact CD2-CD1 3.32Å; Y50-F62 AromaticContact CD2-CE1 3.86Å; Y50-F62 HydrophobicContact CD2-CE1 3.86Å; Y50-F62 HydrophobicContact CD2-CG 4.24Å; Y50-F62 AromaticContact CE2-CD1 3.95Å; Y50-F62 HydrophobicContact CE2-CD1 3.95Å; Y50-F62 AromaticContact CG-CD1 3.8Å; Y50-F62 HydrophobicContact CG-CD1 3.8Å; Y50-F62 AromaticContact CG-CE1 3.82Å; Y50-F62 HydrophobicContact CG-CE1 3.82Å; Y50-E63 HydrophobicContact CE2-CG 4.16Å; Y50-E63 PolarHBondContact OH-OE1 3.32Å; Y50-F258 WeakPolarHBondContact CE1-O 3.41Å; Y50-V260 HydrophobicContact CE1-CB 4.17Å; Y50-V260 HydrophobicContact CE1-CG2 3.94Å; Y50-V260 PolarHBondContact OH-N 3.28Å; Y50-T261 PolarHBondContact OH-N 3.02Å
51	R	89.8	Confident	93.3	Very high	45 Å²	45	63.9 Å²	63.9	17%	0.17	35%	0.349	C	S	.	.	I	π-helix	trans	-77	-37.4	-174.9	-67.9	172.8	-168.9	-102.3	-1.4	114.3	S47 C48 I49 D269	S47-R51 VanDerWaalsContact O-CG 3.32Å; S47-R51 WeakPolarHBondContact O-CG 3.45Å; S47-R51 PolarHBondContact O-N 3.2Å; S47-R51 PolarHBondContact OG-NE 3.39Å; C48-R51 PolarHBondContact O-N 3.44Å; I49-R51 PolarHBondContact O-N 3.08Å; R51-D269 IonicContact CZ-OD1 3.84Å; R51-D269 IonicContact CZ-OD2 3.67Å; R51-D269 IonicContact NH1-OD1 3.65Å; R51-D269 IonicContact NH1-OD2 3.82Å; R51-D269 PolarHBondContact NH1-OD2 3.45Å; R51-D269 VanDerWaalsContact NH2-CG 3.26Å; R51-D269 IonicContact NH2-OD1 3.17Å; R51-D269 PolarHBondContact NH2-OD1 3.31Å; R51-D269 IonicContact NH2-OD2 2.66Å; R51-D269 PolarHBondContact NH2-OD2 2.86Å; R51-D269 VanDerWaalsContact NH2-OD2 3.08Å
52	Y	92.4	Very high	93.1	Very high	168 Å²	168	62.8 Å²	62.8	66%	0.659	33%	0.333	S	S	*	.	I	π-helix	trans	-115.1	-21.6	-168.2	-59.3	-63.1	0	0	0	114.9	C48 W271	C48-Y52 HydrophobicContact CB-CD2 4.38Å; C48-Y52 WeakPolarHBondContact O-CB 3.45Å; C48-Y52 WeakPolarHBondContact O-CD2 3.41Å; C48-Y52 PolarHBondContact O-N 3.48Å; Y52-W271 AromaticContact CE2-CH2 3.84Å; Y52-W271 HydrophobicContact CE2-CH2 3.84Å
53	M	94.4	Very high	92.8	Very high	143 Å²	143	60.3 Å²	60.3	70%	0.704	32%	0.318	S	S	*	.	I	π-helix	trans	-109.6	-32.2	-173.6	-60.6	-174.6	71	0	0	113.6	I49	I49-M53 HydrophobicContact CG1-SD 3.93Å; I49-M53 HydrophobicContact CG2-CB 4.3Å; I49-M53 WeakPolarHBondContact O-CA 3.35Å; I49-M53 WeakPolarHBondContact O-CB 3.48Å; I49-M53 PolarHBondContact O-N 3.48Å
54	L	92.8	Very high	92.5	Very high	46 Å²	46	66.2 Å²	66.2	24%	0.241	35%	0.346	C	S	.	.	S	Bend	trans	-76	138.6	-178.2	-65.1	-173.2	0	0	0	112	I49 Y50 Q58 Q59 F62	I49-L54 HydrophobicContact CG2-CD2 4.3Å; I49-L54 HydrophobicContact CG2-CG 4.29Å; I49-L54 PolarHBondContact O-N 3.49Å; I49-L54 VanDerWaalsContact O-N 3.09Å; Y50-L54 HydrophobicContact CD2-CD1 4.25Å; L54-Q58 HydrophobicContact CB-CB 4.08Å; L54-Q58 HydrophobicContact CD2-CB 4.13Å; L54-Q58 HydrophobicContact CG-CB 4.49Å; L54-Q59 HydrophobicContact CB-CG 3.73Å; L54-F62 HydrophobicContact CD1-CB 4Å; L54-F62 HydrophobicContact CD1-CG 4.15Å
55	S	93.1	Very high	92.3	Very high	44 Å²	44	67 Å²	67	31%	0.308	35%	0.35	S	S	.	.			trans	-70.9	160.5	169.2	68.9	0	0	0	0	111.1	S57 Q58 Q59	S55-S57 VanDerWaalsContact C-N 3.28Å; S55-S57 PolarHBondContact O-N 2.84Å; S55-S57 PolarHBondContact OG-OG 3.48Å; S55-S57 VanDerWaalsContact OG-OG 3.08Å; S55-Q58 VanDerWaalsContact N-OE1 3.07Å; S55-Q58 CarbonylContact O-C 3.57Å; S55-Q58 WeakPolarHBondContact O-CA 3.34Å; S55-Q58 WeakPolarHBondContact O-CB 3.33Å; S55-Q58 PolarHBondContact O-N 2.84Å; S55-Q58 VanDerWaalsContact OG-CG 3.31Å; S55-Q58 WeakPolarHBondContact OG-CG 3.47Å; S55-Q58 PolarHBondContact OG-OE1 2.96Å; S55-Q59 WeakPolarHBondContact O-CG 3.49Å; S55-Q59 PolarHBondContact O-N 2.93Å
56	P	89	Confident	92	Very high	100 Å²	100	62.4 Å²	62.4	65%	0.649	33%	0.326	S	S	*	.	H	α-helix	trans	-54.3	-41.6	-179.9	-28.7	35.9	0	0	0	113.8	Q58 Q59 D60	P56-Q58 VanDerWaalsContact C-N 3.32Å; P56-Q58 PolarHBondContact O-N 2.94Å; P56-Q59 WeakPolarHBondContact O-CB 3.28Å; P56-Q59 PolarHBondContact O-N 3.32Å; P56-D60 PolarHBondContact O-N 3.42Å; P56-D60 VanDerWaalsContact O-N 3.1Å
57	S	88.9	Confident	91.8	Very high	78 Å²	78	65.4 Å²	65.4	55%	0.545	34%	0.335	S	S	.	.	H	α-helix	trans	-64.5	-32.3	175	52.9	0	0	0	0	113.9	S55	S55-S57 VanDerWaalsContact C-N 3.28Å; S55-S57 PolarHBondContact O-N 2.84Å; S55-S57 PolarHBondContact OG-OG 3.48Å; S55-S57 VanDerWaalsContact OG-OG 3.08Å
58	Q	91.4	Very high	91.6	Very high	99 Å²	99	73.8 Å²	73.8	46%	0.463	37%	0.368	S	S	.	.	H	α-helix	trans	-78.2	-34.3	176	-69.9	172.8	-26.1	0	0	111.5	L54 S55 P56 D60 V61 F62	L54-Q58 HydrophobicContact CB-CB 4.08Å; L54-Q58 HydrophobicContact CD2-CB 4.13Å; L54-Q58 HydrophobicContact CG-CB 4.49Å; S55-Q58 VanDerWaalsContact N-OE1 3.07Å; S55-Q58 CarbonylContact O-C 3.57Å; S55-Q58 WeakPolarHBondContact O-CA 3.34Å; S55-Q58 WeakPolarHBondContact O-CB 3.33Å; S55-Q58 PolarHBondContact O-N 2.84Å; S55-Q58 VanDerWaalsContact OG-CG 3.31Å; S55-Q58 WeakPolarHBondContact OG-CG 3.47Å; S55-Q58 PolarHBondContact OG-OE1 2.96Å; P56-Q58 VanDerWaalsContact C-N 3.32Å; P56-Q58 PolarHBondContact O-N 2.94Å; Q58-D60 VanDerWaalsContact C-N 3.34Å; Q58-V61 PolarHBondContact O-N 3.46Å; Q58-F62 WeakPolarHBondContact O-CB 3.13Å; Q58-F62 PolarHBondContact O-N 3.29Å
59	Q	90.9	Very high	91.4	Very high	27 Å²	27	74.4 Å²	74.4	13%	0.126	37%	0.365	C	S	.	.	H	α-helix	trans	-59.8	-44.8	173	-71.8	177.3	-24	0	0	110.5	Y50 L54 S55 P56 V61 F62 E63	Y50-Q59 HydrophobicContact CD2-CB 4.38Å; Y50-Q59 HydrophobicContact CD2-CG 3.98Å; Y50-Q59 HydrophobicContact CE2-CB 3.89Å; Y50-Q59 HydrophobicContact CE2-CG 3.85Å; Y50-Q59 PolarHBondContact O-NE2 3.24Å; L54-Q59 HydrophobicContact CB-CG 3.73Å; S55-Q59 WeakPolarHBondContact O-CG 3.49Å; S55-Q59 PolarHBondContact O-N 2.93Å; P56-Q59 WeakPolarHBondContact O-CB 3.28Å; P56-Q59 PolarHBondContact O-N 3.32Å; Q59-V61 VanDerWaalsContact C-N 3.33Å; Q59-V61 PolarHBondContact O-N 3.02Å; Q59-F62 WeakPolarHBondContact O-CB 3.42Å; Q59-F62 PolarHBondContact O-N 2.63Å; Q59-F62 VanDerWaalsContact O-N 3.14Å; Q59-E63 VanDerWaalsContact O-CG 3.32Å; Q59-E63 WeakPolarHBondContact O-CG 3.29Å; Q59-E63 PolarHBondContact O-N 3.09Å
60	D	89.3	Confident	91.2	Very high	83 Å²	83	74.6 Å²	74.6	44%	0.444	37%	0.367	S	S	.	.	H	α-helix	trans	-57.1	-43.4	175.9	-73.8	-29.6	0	0	0	112.9	P56 Q58 E63 Q64	P56-D60 PolarHBondContact O-N 3.42Å; P56-D60 VanDerWaalsContact O-N 3.1Å; Q58-D60 VanDerWaalsContact C-N 3.34Å; D60-E63 PolarHBondContact O-N 3.01Å; D60-Q64 WeakPolarHBondContact O-CG 3.34Å; D60-Q64 PolarHBondContact O-N 2.98Å; D60-Q64 VanDerWaalsContact O-N 3.14Å
61	V	91.4	Very high	90.9	Very high	91 Å²	91	80 Å²	80	55%	0.552	40%	0.396	S	S	*	.	H	α-helix	trans	-67.5	-41.9	177.3	176.1	0	0	0	0	110.8	Q58 Q59 E63 Q64 L65	Q58-V61 PolarHBondContact O-N 3.46Å; Q59-V61 VanDerWaalsContact C-N 3.33Å; Q59-V61 PolarHBondContact O-N 3.02Å; V61-E63 VanDerWaalsContact C-N 3.33Å; V61-E63 PolarHBondContact O-N 3.36Å; V61-Q64 PolarHBondContact O-N 3.03Å; V61-L65 PolarHBondContact O-N 3.02Å; V61-L65 VanDerWaalsContact O-N 3.08Å
62	F	92.6	Very high	90.4	Very high	34 Å²	34	84.6 Å²	84.6	15%	0.149	42%	0.417	C	S	.	.	H	α-helix	trans	-62	-41.7	176.9	-173.7	-108.8	0	0	0	111.4	I46 Y50 L54 Q58 Q59 Q64 L65 I66 I254 Q257	I46-F62 HydrophobicContact CG2-CE2 4.26Å; I46-F62 HydrophobicContact CG2-CZ 3.65Å; Y50-F62 AromaticContact CD2-CD1 3.32Å; Y50-F62 HydrophobicContact CD2-CD1 3.32Å; Y50-F62 AromaticContact CD2-CE1 3.86Å; Y50-F62 HydrophobicContact CD2-CE1 3.86Å; Y50-F62 HydrophobicContact CD2-CG 4.24Å; Y50-F62 AromaticContact CE2-CD1 3.95Å; Y50-F62 HydrophobicContact CE2-CD1 3.95Å; Y50-F62 AromaticContact CG-CD1 3.8Å; Y50-F62 HydrophobicContact CG-CD1 3.8Å; Y50-F62 AromaticContact CG-CE1 3.82Å; Y50-F62 HydrophobicContact CG-CE1 3.82Å; L54-F62 HydrophobicContact CD1-CB 4Å; L54-F62 HydrophobicContact CD1-CG 4.15Å; Q58-F62 WeakPolarHBondContact O-CB 3.13Å; Q58-F62 PolarHBondContact O-N 3.29Å; Q59-F62 WeakPolarHBondContact O-CB 3.42Å; Q59-F62 PolarHBondContact O-N 2.63Å; Q59-F62 VanDerWaalsContact O-N 3.14Å; F62-Q64 PolarHBondContact O-N 3.15Å; F62-L65 HydrophobicContact CD2-CD2 4.43Å; F62-L65 CarbonylContact O-C 3.57Å; F62-L65 WeakPolarHBondContact O-CA 3.33Å; F62-L65 WeakPolarHBondContact O-CB 3.42Å; F62-L65 PolarHBondContact O-N 3.36Å; F62-L65 VanDerWaalsContact O-N 3.09Å; F62-I66 HydrophobicContact CD1-CD1 3.71Å; F62-I66 HydrophobicContact CD1-CG1 4.14Å; F62-I66 HydrophobicContact CE1-CD1 3.58Å; F62-I66 HydrophobicContact CE1-CG1 3.98Å; F62-I66 HydrophobicContact CZ-CD1 4.39Å; F62-I66 HydrophobicContact CZ-CG1 4.36Å; F62-I66 WeakPolarHBondContact O-CG1 3.27Å; F62-I66 PolarHBondContact O-N 2.69Å; F62-I254 HydrophobicContact CE2-CG2 3.87Å; F62-I254 HydrophobicContact CZ-CG2 4.15Å; F62-Q257 HydrophobicContact CE1-CB 4.33Å; F62-Q257 HydrophobicContact CE1-CG 4.4Å; F62-Q257 HydrophobicContact CZ-CG 4.17Å
63	E	91.4	Very high	90.1	Very high	4 Å²	4	77 Å²	77	2%	0.019	39%	0.388	C	S	.	.	H	α-helix	trans	-64	-38.2	176.6	-72.2	-178.7	-166.9	0	0	113.4	Y50 Q59 D60 V61 L65 I66 R67 I259	Y50-E63 HydrophobicContact CE2-CG 4.16Å; Y50-E63 PolarHBondContact OH-OE1 3.32Å; Q59-E63 VanDerWaalsContact O-CG 3.32Å; Q59-E63 WeakPolarHBondContact O-CG 3.29Å; Q59-E63 PolarHBondContact O-N 3.09Å; D60-E63 PolarHBondContact O-N 3.01Å; V61-E63 VanDerWaalsContact C-N 3.33Å; V61-E63 PolarHBondContact O-N 3.36Å; E63-L65 VanDerWaalsContact C-N 3.27Å; E63-L65 PolarHBondContact O-N 3.17Å; E63-I66 PolarHBondContact O-N 3.18Å; E63-R67 WeakPolarHBondContact O-CG 3.36Å; E63-R67 PolarHBondContact O-N 3.28Å; E63-I259 HydrophobicContact CB-CD1 4.32Å; E63-I259 HydrophobicContact CG-CD1 4.3Å; E63-I259 HydrophobicContact CG-CG1 4.13Å; E63-I259 HydrophobicContact CG-CG2 3.83Å; E63-I259 WeakPolarHBondContact OE1-CG2 3.41Å; E63-I259 WeakPolarHBondContact OE2-CG2 3.49Å
64	Q	90	Very high	89.4	Confident	125 Å²	125	74.2 Å²	74.2	58%	0.584	38%	0.376	S	S	*	.	H	α-helix	trans	-62.2	-39.5	171.9	-70.4	173.3	38.9	0	0	111.3	D60 V61 F62 R67 Y68	D60-Q64 WeakPolarHBondContact O-CG 3.34Å; D60-Q64 PolarHBondContact O-N 2.98Å; D60-Q64 VanDerWaalsContact O-N 3.14Å; V61-Q64 PolarHBondContact O-N 3.03Å; F62-Q64 PolarHBondContact O-N 3.15Å; Q64-R67 PolarHBondContact O-N 3.4Å; Q64-Y68 WeakPolarHBondContact O-CB 3.18Å; Q64-Y68 PolarHBondContact O-N 3.23Å
65	L	91.8	Very high	88.8	Confident	68 Å²	68	75.7 Å²	75.7	36%	0.356	40%	0.395	S	S	.	.	H	α-helix	trans	-70.8	-37.8	179	-176	125.6	0	0	0	112.2	V61 F62 E63 Y68 F69 I254	V61-L65 PolarHBondContact O-N 3.02Å; V61-L65 VanDerWaalsContact O-N 3.08Å; F62-L65 HydrophobicContact CD2-CD2 4.43Å; F62-L65 CarbonylContact O-C 3.57Å; F62-L65 WeakPolarHBondContact O-CA 3.33Å; F62-L65 WeakPolarHBondContact O-CB 3.42Å; F62-L65 PolarHBondContact O-N 3.36Å; F62-L65 VanDerWaalsContact O-N 3.09Å; E63-L65 VanDerWaalsContact C-N 3.27Å; E63-L65 PolarHBondContact O-N 3.17Å; L65-Y68 PolarHBondContact O-N 3.18Å; L65-F69 HydrophobicContact CD1-CE2 3.97Å; L65-F69 HydrophobicContact CD2-CD2 3.87Å; L65-F69 HydrophobicContact CD2-CE2 3.72Å; L65-F69 HydrophobicContact CG-CD2 3.8Å; L65-F69 HydrophobicContact CG-CE2 3.62Å; L65-F69 VanDerWaalsContact O-CD2 3.28Å; L65-F69 WeakPolarHBondContact O-CD2 3.49Å; L65-F69 PolarHBondContact O-N 3.43Å; L65-I254 HydrophobicContact CD2-CB 4.48Å; L65-I254 HydrophobicContact CD2-CD1 4.42Å; L65-I254 HydrophobicContact CD2-CG2 3.31Å
66	I	92.2	Very high	88.2	Confident	7 Å²	7	79 Å²	79	4%	0.036	41%	0.409	C	S	.	.	H	α-helix	trans	-54.9	-53.8	168.7	-65.5	171.1	0	0	0	109.4	F62 E63 Y68 F69 D70 I254 G255 Q257 I259	F62-I66 HydrophobicContact CD1-CD1 3.71Å; F62-I66 HydrophobicContact CD1-CG1 4.14Å; F62-I66 HydrophobicContact CE1-CD1 3.58Å; F62-I66 HydrophobicContact CE1-CG1 3.98Å; F62-I66 HydrophobicContact CZ-CD1 4.39Å; F62-I66 HydrophobicContact CZ-CG1 4.36Å; F62-I66 WeakPolarHBondContact O-CG1 3.27Å; F62-I66 PolarHBondContact O-N 2.69Å; E63-I66 PolarHBondContact O-N 3.18Å; I66-Y68 VanDerWaalsContact C-N 3.31Å; I66-Y68 PolarHBondContact O-N 2.79Å; I66-F69 PolarHBondContact O-N 3.39Å; I66-D70 WeakPolarHBondContact O-CB 3.34Å; I66-D70 PolarHBondContact O-N 3.16Å; I66-I254 HydrophobicContact CG1-CG2 4.48Å; I66-I254 WeakPolarHBondContact CG1-O 3.3Å; I66-G255 WeakPolarHBondContact CG2-O 3.31Å; I66-Q257 HydrophobicContact CD1-CB 3.73Å; I66-Q257 HydrophobicContact CG1-CB 4.16Å; I66-I259 HydrophobicContact CB-CD1 4.47Å; I66-I259 HydrophobicContact CD1-CD1 4.41Å; I66-I259 HydrophobicContact CD1-CG1 3.8Å; I66-I259 HydrophobicContact CG2-CD1 4.2Å; I66-I259 HydrophobicContact CG2-CG1 4.36Å
67	R	89.7	Confident	88	Confident	97 Å²	97	76.2 Å²	76.2	37%	0.366	39%	0.388	S	S	.	.	H	α-helix	trans	-61.3	-39.2	-179	-69.3	174.1	-172.4	160.2	10.3	112.1	E63 Q64 N71 I259	E63-R67 WeakPolarHBondContact O-CG 3.36Å; E63-R67 PolarHBondContact O-N 3.28Å; Q64-R67 PolarHBondContact O-N 3.4Å; R67-N71 WeakPolarHBondContact O-CB 3.48Å; R67-N71 PolarHBondContact O-N 3.35Å; R67-I259 HydrophobicContact CG-CD1 4.38Å
68	Y	90.7	Very high	87.9	Confident	177 Å²	177	75.8 Å²	75.8	69%	0.694	38%	0.384	S	S	*	.	H	α-helix	trans	-60.9	-46.8	176.3	175.2	-98.9	0	0	0	111.7	Q64 L65 I66	Q64-Y68 WeakPolarHBondContact O-CB 3.18Å; Q64-Y68 PolarHBondContact O-N 3.23Å; L65-Y68 PolarHBondContact O-N 3.18Å; I66-Y68 VanDerWaalsContact C-N 3.31Å; I66-Y68 PolarHBondContact O-N 2.79Å
69	F	91.1	Very high	87.9	Confident	60 Å²	60	71.3 Å²	71.3	26%	0.263	36%	0.363	S	S	.	.	H	α-helix	trans	-74.3	-32.6	-177.9	-80.2	-53.5	0	0	0	114	L65 I66 L73 I251 I254	L65-F69 HydrophobicContact CD1-CE2 3.97Å; L65-F69 HydrophobicContact CD2-CD2 3.87Å; L65-F69 HydrophobicContact CD2-CE2 3.72Å; L65-F69 HydrophobicContact CG-CD2 3.8Å; L65-F69 HydrophobicContact CG-CE2 3.62Å; L65-F69 VanDerWaalsContact O-CD2 3.28Å; L65-F69 WeakPolarHBondContact O-CD2 3.49Å; L65-F69 PolarHBondContact O-N 3.43Å; I66-F69 PolarHBondContact O-N 3.39Å; F69-L73 WeakPolarHBondContact O-CB 3.41Å; F69-I251 HydrophobicContact CB-CG2 3.73Å; F69-I251 HydrophobicContact CD1-CG1 4.5Å; F69-I251 HydrophobicContact CD1-CG2 3.54Å; F69-I251 HydrophobicContact CE1-CG2 4.4Å; F69-I251 HydrophobicContact CG-CG2 3.86Å; F69-I254 HydrophobicContact CD2-CB 4.27Å; F69-I254 HydrophobicContact CD2-CG2 4.17Å; F69-I254 HydrophobicContact CE2-CD1 4.31Å
70	D	88.8	Confident	87.9	Confident	70 Å²	70	73.7 Å²	73.7	37%	0.374	38%	0.379	S	S	.	.	H	α-helix	trans	-77.8	-32.6	178	-162.4	42.5	0	0	0	112.5	I66 K72 L73 G255 R256	I66-D70 WeakPolarHBondContact O-CB 3.34Å; I66-D70 PolarHBondContact O-N 3.16Å; D70-K72 PolarHBondContact O-N 2.9Å; D70-L73 PolarHBondContact O-N 2.88Å; D70-G255 WeakPolarHBondContact CB-O 3.28Å; D70-R256 WeakPolarHBondContact OD1-CD 3.36Å; D70-R256 IonicContact OD1-CZ 2.91Å; D70-R256 IonicContact OD1-NE 3.2Å; D70-R256 PolarHBondContact OD1-NE 3.12Å; D70-R256 IonicContact OD1-NH2 2.95Å
71	N	86.8	Confident	88	Confident	113 Å²	113	76 Å²	76	60%	0.604	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	113.5	-176.3	-172.6	16.5	0	0	0	111.3	R67 L73	R67-N71 WeakPolarHBondContact O-CB 3.48Å; R67-N71 PolarHBondContact O-N 3.35Å; N71-L73 PolarHBondContact O-N 2.91Å
72	K	80	Confident	87.9	Confident	142 Å²	142	74.1 Å²	74.1	62%	0.617	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	19.2	-179.3	-60.3	-177.5	179.1	-176.9	0	115	D70 D74 A75 N76	D70-K72 PolarHBondContact O-N 2.9Å; K72-D74 VanDerWaalsContact C-N 3.3Å; K72-D74 PolarHBondContact O-N 2.95Å; K72-A75 HydrophobicContact CB-CB 4.29Å; K72-A75 PolarHBondContact O-N 3.42Å; K72-A75 VanDerWaalsContact O-N 3.08Å; K72-N76 WeakPolarHBondContact O-CB 3.38Å; K72-N76 PolarHBondContact O-N 2.92Å; K72-N76 PolarHBondContact O-ND2 2.65Å
73	L	85.9	Confident	88	Confident	9 Å²	9	72.6 Å²	72.6	5%	0.047	37%	0.366	C	S	.	.	H	α-helix	trans	-52.9	-49.5	177.9	-174.5	60.4	0	0	0	112.2	F69 D70 N71 A75 N76 I77 Y248 I251 C252	F69-L73 WeakPolarHBondContact O-CB 3.41Å; D70-L73 PolarHBondContact O-N 2.88Å; N71-L73 PolarHBondContact O-N 2.91Å; L73-A75 VanDerWaalsContact C-N 3.27Å; L73-A75 PolarHBondContact O-N 3.06Å; L73-N76 PolarHBondContact O-N 3.02Å; L73-I77 HydrophobicContact CD1-CD1 4.22Å; L73-I77 PolarHBondContact O-N 2.99Å; L73-I77 VanDerWaalsContact O-N 3.17Å; L73-Y248 HydrophobicContact CD1-CD2 4.28Å; L73-Y248 HydrophobicContact CD2-CD2 4.3Å; L73-Y248 HydrophobicContact CD2-CE2 3.97Å; L73-Y248 HydrophobicContact CG-CD2 4Å; L73-Y248 HydrophobicContact CG-CE2 3.73Å; L73-I251 HydrophobicContact CD1-CB 4.22Å; L73-I251 HydrophobicContact CD1-CD1 4.17Å; L73-I251 HydrophobicContact CD1-CG2 3.68Å; L73-I251 HydrophobicContact CD2-CG2 4.01Å; L73-C252 VanDerWaalsContact CD2-SG 3.58Å
74	D	79.7	Confident	88.1	Confident	84 Å²	84	73.2 Å²	73.2	45%	0.449	37%	0.373	S	S	.	.	H	α-helix	trans	-68.8	-24.6	-178.2	-64.9	-19.3	0	0	0	113	K72 Y248 R256	K72-D74 VanDerWaalsContact C-N 3.3Å; K72-D74 PolarHBondContact O-N 2.95Å; D74-Y248 WeakPolarHBondContact OD1-CE2 3.34Å; D74-Y248 PolarHBondContact OD1-OH 3.37Å; D74-R256 IonicContact OD1-NH2 2.65Å; D74-R256 PolarHBondContact OD1-NH2 3.26Å; D74-R256 IonicContact OD2-NH2 3.84Å; D74-R256 PolarHBondContact OD2-NH2 2.99Å; D74-R256 VanDerWaalsContact OD2-NH2 3.11Å
75	A	79.2	Confident	88.3	Confident	78 Å²	78	72.9 Å²	72.9	65%	0.645	37%	0.37	S	S	*	.	H	α-helix	trans	-84.8	-31.3	176.5	0	0	0	0	0	112.3	K72 L73	K72-A75 HydrophobicContact CB-CB 4.29Å; K72-A75 PolarHBondContact O-N 3.42Å; K72-A75 VanDerWaalsContact O-N 3.08Å; L73-A75 VanDerWaalsContact C-N 3.27Å; L73-A75 PolarHBondContact O-N 3.06Å
76	N	82.1	Confident	88.5	Confident	114 Å²	114	69.6 Å²	69.6	61%	0.61	35%	0.353	S	S	*	.	H	α-helix	trans	-79.2	-31.9	-177.3	-68.1	-21	0	0	0	112.3	K72 L73 P78	K72-N76 WeakPolarHBondContact O-CB 3.38Å; K72-N76 PolarHBondContact O-N 2.92Å; K72-N76 PolarHBondContact O-ND2 2.65Å; L73-N76 PolarHBondContact O-N 3.02Å; N76-P78 WeakPolarHBondContact O-CD 3.08Å
77	I	84.5	Confident	88.6	Confident	40 Å²	40	69.8 Å²	69.8	21%	0.205	35%	0.354	C	S	.	.	S	Bend	trans	-119.1	93.4	-178.9	-52.3	178.8	0	0	0	109.4	L73 L79 Y248 I251	L73-I77 HydrophobicContact CD1-CD1 4.22Å; L73-I77 PolarHBondContact O-N 2.99Å; L73-I77 VanDerWaalsContact O-N 3.17Å; I77-L79 HydrophobicContact CG2-CD2 3.55Å; I77-L79 HydrophobicContact CG2-CG 3.93Å; I77-L79 PolarHBondContact O-N 2.75Å; I77-Y248 HydrophobicContact CB-CD2 4.24Å; I77-Y248 HydrophobicContact CD1-CD2 4.28Å; I77-Y248 HydrophobicContact CG2-CD2 4.47Å; I77-I251 HydrophobicContact CD1-CD1 4.39Å
78	P	87.6	Confident	88.9	Confident	70 Å²	70	69 Å²	69	46%	0.455	36%	0.363	S	S	.	.			trans	-78.6	69	-177.4	33.1	-36.5	0	0	0	111.8	N76 T80 F81 L82	N76-P78 WeakPolarHBondContact O-CD 3.08Å; P78-T80 VanDerWaalsContact C-N 3.27Å; P78-T80 PolarHBondContact O-N 3.29Å; P78-F81 HydrophobicContact CB-CB 4.44Å; P78-F81 PolarHBondContact O-N 3.05Å; P78-L82 PolarHBondContact O-N 3Å
79	L	90.4	Very high	89.2	Confident	4 Å²	4	65 Å²	65	2%	0.021	35%	0.35	C	S	.	.	H	α-helix	trans	-55.6	-40	-177	-67.2	-178.7	0	0	0	112.8	I77 F81 L82 L83 A244 V245 Y248 Y283	I77-L79 HydrophobicContact CG2-CD2 3.55Å; I77-L79 HydrophobicContact CG2-CG 3.93Å; I77-L79 PolarHBondContact O-N 2.75Å; L79-F81 VanDerWaalsContact C-N 3.33Å; L79-F81 PolarHBondContact O-N 3.42Å; L79-L82 PolarHBondContact O-N 2.8Å; L79-L83 HydrophobicContact CB-CD1 4.36Å; L79-L83 VanDerWaalsContact O-CB 3.31Å; L79-L83 WeakPolarHBondContact O-CB 3.39Å; L79-L83 PolarHBondContact O-N 3.46Å; L79-A244 HydrophobicContact CD2-CB 4.37Å; L79-V245 HydrophobicContact CD2-CG2 3.99Å; L79-Y248 HydrophobicContact CD1-CD1 3.52Å; L79-Y248 HydrophobicContact CD1-CD2 3.84Å; L79-Y248 HydrophobicContact CD1-CE1 3.93Å; L79-Y248 HydrophobicContact CD1-CE2 4.22Å; L79-Y248 HydrophobicContact CD1-CG 3.48Å; L79-Y248 VanDerWaalsContact CD1-CG 3.48Å; L79-Y248 HydrophobicContact CG-CD2 4.34Å; L79-Y248 HydrophobicContact CG-CG 4.31Å; L79-Y283 HydrophobicContact CB-CD1 4.09Å; L79-Y283 HydrophobicContact CB-CE1 3.97Å; L79-Y283 HydrophobicContact CD1-CD1 4.42Å; L79-Y283 HydrophobicContact CD1-CD2 4.33Å; L79-Y283 HydrophobicContact CD1-CG 4.23Å
80	T	91.6	Very high	89.4	Confident	78 Å²	78	62.1 Å²	62.1	48%	0.479	34%	0.337	S	S	.	.	H	α-helix	trans	-60	-42.9	-177.6	-49.6	0	0	0	0	112.4	P78 G84 Y283 W286	P78-T80 VanDerWaalsContact C-N 3.27Å; P78-T80 PolarHBondContact O-N 3.29Å; T80-G84 PolarHBondContact O-N 3.21Å; T80-Y283 PolarHBondContact OG1-OH 2.92Å; T80-Y283 VanDerWaalsContact OG1-OH 3.07Å; T80-W286 HydrophobicContact CG2-CH2 4.32Å; T80-W286 HydrophobicContact CG2-CZ3 4.1Å; T80-W286 WeakPolarHBondContact O-CH2 3.28Å
81	F	90.8	Very high	89.7	Confident	131 Å²	131	61.7 Å²	61.7	58%	0.575	34%	0.337	S	S	*	.	H	α-helix	trans	-67.1	-51.5	177.6	179.7	-87.9	0	0	0	110	P78 L79 L83 G84 F85	P78-F81 HydrophobicContact CB-CB 4.44Å; P78-F81 PolarHBondContact O-N 3.05Å; L79-F81 VanDerWaalsContact C-N 3.33Å; L79-F81 PolarHBondContact O-N 3.42Å; F81-L83 PolarHBondContact O-N 3.45Å; F81-G84 PolarHBondContact O-N 2.99Å; F81-F85 AromaticContact CD1-CD2 3.96Å; F81-F85 HydrophobicContact CD1-CD2 3.96Å; F81-F85 HydrophobicContact CD1-CE2 4.19Å; F81-F85 HydrophobicContact CD2-CD2 4.05Å; F81-F85 AromaticContact CD2-CE2 3.52Å; F81-F85 HydrophobicContact CD2-CE2 3.52Å; F81-F85 AromaticContact CE1-CD2 3.74Å; F81-F85 HydrophobicContact CE1-CD2 3.74Å; F81-F85 AromaticContact CE1-CE2 3.82Å; F81-F85 HydrophobicContact CE1-CE2 3.82Å; F81-F85 AromaticContact CE2-CD2 3.88Å; F81-F85 HydrophobicContact CE2-CD2 3.88Å; F81-F85 AromaticContact CE2-CE2 3.12Å; F81-F85 HydrophobicContact CE2-CE2 3.12Å; F81-F85 AromaticContact CE2-CZ 3.92Å; F81-F85 HydrophobicContact CE2-CZ 3.92Å; F81-F85 HydrophobicContact CG-CD2 4.1Å; F81-F85 HydrophobicContact CG-CE2 4.04Å; F81-F85 AromaticContact CZ-CD2 3.69Å; F81-F85 HydrophobicContact CZ-CD2 3.69Å; F81-F85 AromaticContact CZ-CE2 3.27Å; F81-F85 HydrophobicContact CZ-CE2 3.27Å; F81-F85 HydrophobicContact CZ-CZ 4.03Å; F81-F85 VanDerWaalsContact O-CD2 3.28Å; F81-F85 WeakPolarHBondContact O-CD2 3.31Å; F81-F85 PolarHBondContact O-N 3.23Å; F81-F85 VanDerWaalsContact O-N 3.14Å
82	L	90.2	Very high	90.1	Very high	52 Å²	52	59.2 Å²	59.2	27%	0.272	33%	0.332	S	S	.	.	H	α-helix	trans	-56.4	-50.1	-178.9	-71.7	174.6	0	0	0	112.3	P78 L79 F86 I241	P78-L82 PolarHBondContact O-N 3Å; L79-L82 PolarHBondContact O-N 2.8Å; L82-F86 WeakPolarHBondContact O-CB 3.42Å; L82-F86 PolarHBondContact O-N 3.37Å; L82-I241 HydrophobicContact CB-CD1 3.66Å; L82-I241 HydrophobicContact CD2-CD1 4.15Å; L82-I241 HydrophobicContact CG-CD1 4.4Å
83	L	93.9	Very high	90.8	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-66.5	-41.1	177.5	-81.1	158.3	0	0	0	112.2	L79 F81 F85 F86 V87 I241 V245 Y283 W286 M287	L79-L83 HydrophobicContact CB-CD1 4.36Å; L79-L83 VanDerWaalsContact O-CB 3.31Å; L79-L83 WeakPolarHBondContact O-CB 3.39Å; L79-L83 PolarHBondContact O-N 3.46Å; F81-L83 PolarHBondContact O-N 3.45Å; L83-F85 PolarHBondContact O-N 3.35Å; L83-F86 PolarHBondContact O-N 3.44Å; L83-V87 HydrophobicContact CD2-CG2 4.48Å; L83-V87 VanDerWaalsContact O-CB 3.3Å; L83-V87 WeakPolarHBondContact O-CB 3.41Å; L83-V87 WeakPolarHBondContact O-CG2 3.44Å; L83-V87 PolarHBondContact O-N 2.81Å; L83-I241 HydrophobicContact CD2-CG2 4.04Å; L83-I241 HydrophobicContact CG-CG2 4.45Å; L83-V245 HydrophobicContact CD1-CG2 3.87Å; L83-V245 HydrophobicContact CD2-CG2 4.26Å; L83-V245 HydrophobicContact CG-CG2 4.17Å; L83-Y283 HydrophobicContact CD1-CD1 3.71Å; L83-Y283 HydrophobicContact CD1-CG 4.48Å; L83-W286 HydrophobicContact CB-CD2 3.96Å; L83-W286 HydrophobicContact CB-CE3 3.57Å; L83-W286 HydrophobicContact CB-CH2 4.15Å; L83-W286 HydrophobicContact CB-CZ3 3.68Å; L83-W286 HydrophobicContact CD1-CE3 3.96Å; L83-W286 HydrophobicContact CG-CE3 4.31Å; L83-M287 HydrophobicContact CD2-CB 3.85Å; L83-M287 HydrophobicContact CD2-CG 4.44Å
84	G	94.2	Very high	91.3	Very high	17 Å²	17	56.3 Å²	56.3	18%	0.175	32%	0.317	C	S	.	.	H	α-helix	trans	-58.1	-48.3	-179.3	0	0	0	0	0	113.1	T80 F81 S88 W286	T80-G84 PolarHBondContact O-N 3.21Å; F81-G84 PolarHBondContact O-N 2.99Å; G84-S88 VanDerWaalsContact O-CB 3.29Å; G84-S88 WeakPolarHBondContact O-CB 3.39Å; G84-S88 PolarHBondContact O-N 3.23Å; G84-S88 VanDerWaalsContact O-N 3.15Å; G84-S88 PolarHBondContact O-OG 2.85Å; G84-W286 VanDerWaalsContact CA-CZ2 3.48Å
85	F	93.8	Very high	92	Very high	118 Å²	118	53.3 Å²	53.3	52%	0.518	31%	0.305	S	S	.	.	H	α-helix	trans	-66.1	-45.8	176.5	-79.1	-77.7	0	0	0	112	F81 L83 S88 F89	F81-F85 AromaticContact CD1-CD2 3.96Å; F81-F85 HydrophobicContact CD1-CD2 3.96Å; F81-F85 HydrophobicContact CD1-CE2 4.19Å; F81-F85 HydrophobicContact CD2-CD2 4.05Å; F81-F85 AromaticContact CD2-CE2 3.52Å; F81-F85 HydrophobicContact CD2-CE2 3.52Å; F81-F85 AromaticContact CE1-CD2 3.74Å; F81-F85 HydrophobicContact CE1-CD2 3.74Å; F81-F85 AromaticContact CE1-CE2 3.82Å; F81-F85 HydrophobicContact CE1-CE2 3.82Å; F81-F85 AromaticContact CE2-CD2 3.88Å; F81-F85 HydrophobicContact CE2-CD2 3.88Å; F81-F85 AromaticContact CE2-CE2 3.12Å; F81-F85 HydrophobicContact CE2-CE2 3.12Å; F81-F85 AromaticContact CE2-CZ 3.92Å; F81-F85 HydrophobicContact CE2-CZ 3.92Å; F81-F85 HydrophobicContact CG-CD2 4.1Å; F81-F85 HydrophobicContact CG-CE2 4.04Å; F81-F85 AromaticContact CZ-CD2 3.69Å; F81-F85 HydrophobicContact CZ-CD2 3.69Å; F81-F85 AromaticContact CZ-CE2 3.27Å; F81-F85 HydrophobicContact CZ-CE2 3.27Å; F81-F85 HydrophobicContact CZ-CZ 4.03Å; F81-F85 VanDerWaalsContact O-CD2 3.28Å; F81-F85 WeakPolarHBondContact O-CD2 3.31Å; F81-F85 PolarHBondContact O-N 3.23Å; F81-F85 VanDerWaalsContact O-N 3.14Å; L83-F85 PolarHBondContact O-N 3.35Å; F85-S88 PolarHBondContact O-N 3.26Å; F85-F89 WeakPolarHBondContact O-CB 3.35Å; F85-F89 PolarHBondContact O-N 3.37Å
86	F	95.3	Very high	92.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.5	-48.7	-177.6	-179	-113.5	0	0	0	112.4	L82 L83 S88 F89 V90 V233 Y237 P238 I241 F242 A290 L294	L82-F86 WeakPolarHBondContact O-CB 3.42Å; L82-F86 PolarHBondContact O-N 3.37Å; L83-F86 PolarHBondContact O-N 3.44Å; F86-S88 PolarHBondContact O-N 3.23Å; F86-F89 PolarHBondContact O-N 3.19Å; F86-V90 HydrophobicContact CD2-CG2 4.39Å; F86-V90 HydrophobicContact CE1-CG2 4.24Å; F86-V90 HydrophobicContact CE2-CG2 4.01Å; F86-V90 HydrophobicContact CZ-CG2 3.93Å; F86-V90 WeakPolarHBondContact O-CG2 3.47Å; F86-V90 PolarHBondContact O-N 3.02Å; F86-V233 HydrophobicContact CE2-CG1 4.39Å; F86-Y237 HydrophobicContact CB-CE2 4.42Å; F86-Y237 HydrophobicContact CD2-CD1 4.2Å; F86-Y237 HydrophobicContact CD2-CD2 4.17Å; F86-Y237 HydrophobicContact CD2-CE1 4.11Å; F86-Y237 HydrophobicContact CD2-CE2 4.07Å; F86-Y237 HydrophobicContact CD2-CG 4.25Å; F86-Y237 HydrophobicContact CE2-CG 4.47Å; F86-P238 HydrophobicContact CE2-CB 4.41Å; F86-P238 HydrophobicContact CE2-CG 4Å; F86-P238 HydrophobicContact CZ-CB 4.02Å; F86-P238 HydrophobicContact CZ-CG 3.95Å; F86-I241 HydrophobicContact CB-CD1 4.32Å; F86-I241 HydrophobicContact CB-CG1 4.07Å; F86-I241 HydrophobicContact CB-CG2 4.49Å; F86-I241 HydrophobicContact CD1-CB 4.34Å; F86-I241 HydrophobicContact CD1-CG1 4.35Å; F86-I241 HydrophobicContact CD1-CG2 3.89Å; F86-I241 HydrophobicContact CD2-CG1 4.23Å; F86-I241 HydrophobicContact CE1-CG2 4.43Å; F86-I241 HydrophobicContact CG-CB 4.46Å; F86-I241 HydrophobicContact CG-CG1 3.96Å; F86-I241 HydrophobicContact CG-CG2 4.29Å; F86-F242 AromaticContact CE1-CE1 3.85Å; F86-F242 HydrophobicContact CE1-CE1 3.85Å; F86-F242 HydrophobicContact CE1-CZ 4.26Å; F86-F242 HydrophobicContact CZ-CE1 4.39Å; F86-F242 HydrophobicContact CZ-CZ 4.44Å; F86-A290 HydrophobicContact CD1-CB 3.75Å; F86-A290 HydrophobicContact CE1-CB 3.51Å; F86-L294 HydrophobicContact CZ-CD1 4.42Å; F86-L294 HydrophobicContact CZ-CD2 4.32Å
87	V	95.6	Very high	93.3	Very high	11 Å²	11	46.6 Å²	46.6	7%	0.067	26%	0.262	C	S	.	.	H	α-helix	trans	-63.6	-43.9	179.9	174.9	0	0	0	0	110.3	L83 F89 V90 V91 W286 V289 A290	L83-V87 HydrophobicContact CD2-CG2 4.48Å; L83-V87 VanDerWaalsContact O-CB 3.3Å; L83-V87 WeakPolarHBondContact O-CB 3.41Å; L83-V87 WeakPolarHBondContact O-CG2 3.44Å; L83-V87 PolarHBondContact O-N 2.81Å; V87-F89 VanDerWaalsContact C-N 3.31Å; V87-F89 PolarHBondContact O-N 3Å; V87-V90 PolarHBondContact O-N 3.24Å; V87-V91 HydrophobicContact CG1-CG2 4.17Å; V87-V91 WeakPolarHBondContact O-CB 3.35Å; V87-V91 VanDerWaalsContact O-CG2 3.28Å; V87-V91 WeakPolarHBondContact O-CG2 3.44Å; V87-V91 PolarHBondContact O-N 2.83Å; V87-W286 HydrophobicContact CG2-CG 4.26Å; V87-V289 HydrophobicContact CG1-CG1 4.48Å; V87-A290 HydrophobicContact CG2-CB 3.83Å
88	S	95.8	Very high	93.7	Very high	79 Å²	79	47.6 Å²	47.6	55%	0.552	27%	0.268	S	S	*	.	H	α-helix	trans	-60.9	-41.6	178.3	-59	0	0	0	0	111.9	G84 F85 F86 A92	G84-S88 VanDerWaalsContact O-CB 3.29Å; G84-S88 WeakPolarHBondContact O-CB 3.39Å; G84-S88 PolarHBondContact O-N 3.23Å; G84-S88 VanDerWaalsContact O-N 3.15Å; G84-S88 PolarHBondContact O-OG 2.85Å; F85-S88 PolarHBondContact O-N 3.26Å; F86-S88 PolarHBondContact O-N 3.23Å; S88-A92 WeakPolarHBondContact O-CB 3.39Å; S88-A92 PolarHBondContact O-N 3.39Å
89	F	95.4	Very high	94	Very high	93 Å²	93	51 Å²	51	41%	0.408	28%	0.282	S	S	.	.	H	α-helix	trans	-63	-46.1	175	170.5	-99.7	0	0	0	112.3	F85 F86 V87 A92 R93 V233	F85-F89 WeakPolarHBondContact O-CB 3.35Å; F85-F89 PolarHBondContact O-N 3.37Å; F86-F89 PolarHBondContact O-N 3.19Å; V87-F89 VanDerWaalsContact C-N 3.31Å; V87-F89 PolarHBondContact O-N 3Å; F89-A92 PolarHBondContact O-N 3.23Å; F89-R93 PolarHBondContact O-N 3.23Å; F89-V233 HydrophobicContact CD1-CG1 4.48Å; F89-V233 HydrophobicContact CE1-CB 4.25Å; F89-V233 HydrophobicContact CE1-CG1 3.72Å; F89-V233 HydrophobicContact CE1-CG2 3.63Å; F89-V233 HydrophobicContact CZ-CG2 4.44Å
90	V	95.8	Very high	94.1	Very high	1 Å²	1	51 Å²	51	1%	0.006	28%	0.282	C	S	.	.	H	α-helix	trans	-64.1	-41.9	178.2	173.8	0	0	0	0	111.5	F86 V87 A92 R93 W94 A290 L293 L294	F86-V90 HydrophobicContact CD2-CG2 4.39Å; F86-V90 HydrophobicContact CE1-CG2 4.24Å; F86-V90 HydrophobicContact CE2-CG2 4.01Å; F86-V90 HydrophobicContact CZ-CG2 3.93Å; F86-V90 WeakPolarHBondContact O-CG2 3.47Å; F86-V90 PolarHBondContact O-N 3.02Å; V87-V90 PolarHBondContact O-N 3.24Å; V90-A92 PolarHBondContact O-N 3Å; V90-R93 WeakPolarHBondContact O-CB 3.47Å; V90-R93 PolarHBondContact O-N 2.88Å; V90-W94 WeakPolarHBondContact O-CB 3.31Å; V90-W94 PolarHBondContact O-N 3.28Å; V90-A290 HydrophobicContact CB-CB 4.48Å; V90-A290 HydrophobicContact CG2-CB 4.39Å; V90-L293 HydrophobicContact CG1-CB 3.61Å; V90-L294 HydrophobicContact CG1-CG 4.49Å; V90-L294 HydrophobicContact CG2-CD2 3.94Å; V90-L294 HydrophobicContact CG2-CG 4.44Å
91	V	95.2	Very high	94	Very high	60 Å²	60	47.4 Å²	47.4	36%	0.364	26%	0.26	S	S	.	.	H	α-helix	trans	-62.9	-41.8	176.8	171	0	0	0	0	111.6	V87 R93 W94 G95 L293	V87-V91 HydrophobicContact CG1-CG2 4.17Å; V87-V91 WeakPolarHBondContact O-CB 3.35Å; V87-V91 VanDerWaalsContact O-CG2 3.28Å; V87-V91 WeakPolarHBondContact O-CG2 3.44Å; V87-V91 PolarHBondContact O-N 2.83Å; V91-R93 VanDerWaalsContact C-N 3.34Å; V91-R93 PolarHBondContact O-N 2.81Å; V91-W94 WeakPolarHBondContact O-CB 3.34Å; V91-W94 PolarHBondContact O-N 2.95Å; V91-G95 PolarHBondContact O-N 3.13Å; V91-L293 HydrophobicContact CG2-CD1 3.77Å
92	A	96	Very high	94	Very high	61 Å²	61	41.8 Å²	41.8	50%	0.504	24%	0.239	S	C	.	.	H	α-helix	trans	-63.4	-40.8	176.6	0	0	0	0	0	112.1	S88 F89 V90 G95 S96	S88-A92 WeakPolarHBondContact O-CB 3.39Å; S88-A92 PolarHBondContact O-N 3.39Å; F89-A92 PolarHBondContact O-N 3.23Å; V90-A92 PolarHBondContact O-N 3Å; A92-G95 PolarHBondContact O-N 3.15Å; A92-S96 PolarHBondContact O-N 3.17Å; A92-S96 VanDerWaalsContact O-N 3.17Å; A92-S96 PolarHBondContact O-OG 3.33Å; A92-S96 VanDerWaalsContact O-OG 3.05Å
93	R	95.1	Very high	94.2	Very high	35 Å²	35	45.2 Å²	45.2	13%	0.132	25%	0.249	C	C	.	.	H	α-helix	trans	-64.2	-45.9	174.3	179.2	177.9	164.1	102.7	3.1	111.6	F89 V90 V91 G95 S96 I97 Y228 V231	F89-R93 PolarHBondContact O-N 3.23Å; V90-R93 WeakPolarHBondContact O-CB 3.47Å; V90-R93 PolarHBondContact O-N 2.88Å; V91-R93 VanDerWaalsContact C-N 3.34Å; V91-R93 PolarHBondContact O-N 2.81Å; R93-G95 VanDerWaalsContact C-N 3.33Å; R93-G95 PolarHBondContact O-N 3.36Å; R93-S96 WeakPolarHBondContact O-CB 3.12Å; R93-S96 PolarHBondContact O-N 3.43Å; R93-S96 VanDerWaalsContact O-N 3.07Å; R93-I97 HydrophobicContact CG-CD1 4.32Å; R93-I97 PolarHBondContact O-N 2.95Å; R93-Y228 HydrophobicContact CG-CD1 3.87Å; R93-Y228 HydrophobicContact CG-CE1 3.81Å; R93-Y228 PolarHBondContact NH2-O 3.29Å; R93-V231 PolarHBondContact NH1-O 3.49Å; R93-V231 PolarHBondContact NH2-O 3.01Å
94	W	94.8	Very high	94.4	Very high	56 Å²	56	45.2 Å²	45.2	21%	0.212	25%	0.249	C	C	.	.	H	α-helix	trans	-54.6	-47.1	174.5	168.1	81	0	0	0	112	V90 V91 S96 I97 L98 L293	V90-W94 WeakPolarHBondContact O-CB 3.31Å; V90-W94 PolarHBondContact O-N 3.28Å; V91-W94 WeakPolarHBondContact O-CB 3.34Å; V91-W94 PolarHBondContact O-N 2.95Å; W94-S96 PolarHBondContact O-N 3.42Å; W94-I97 PolarHBondContact O-N 3.44Å; W94-I97 VanDerWaalsContact O-N 3.15Å; W94-L98 HydrophobicContact CH2-CD2 3.9Å; W94-L98 HydrophobicContact CZ2-CD2 4.04Å; W94-L98 PolarHBondContact O-N 2.69Å; W94-L293 HydrophobicContact CD2-CD2 4.42Å; W94-L293 HydrophobicContact CG-CD2 4.03Å
95	G	94.6	Very high	94.4	Very high	20 Å²	20	46.6 Å²	46.6	21%	0.206	25%	0.252	C	S	.	.	H	α-helix	trans	-61.1	-34.1	177.3	0	0	0	0	0	112.8	V91 A92 R93 L98 N99	V91-G95 PolarHBondContact O-N 3.13Å; A92-G95 PolarHBondContact O-N 3.15Å; R93-G95 VanDerWaalsContact C-N 3.33Å; R93-G95 PolarHBondContact O-N 3.36Å; G95-L98 PolarHBondContact O-N 3.1Å; G95-N99 VanDerWaalsContact O-CG 3.27Å; G95-N99 PolarHBondContact O-N 2.64Å; G95-N99 VanDerWaalsContact O-N 3.12Å; G95-N99 PolarHBondContact O-ND2 3.17Å
96	S	94.6	Very high	94.5	Very high	44 Å²	44	45.7 Å²	45.7	31%	0.308	25%	0.253	S	S	.	.	H	α-helix	trans	-71.8	-34.9	176.1	-57.8	0	0	0	0	113.1	A92 R93 W94 G100 Y228	A92-S96 PolarHBondContact O-N 3.17Å; A92-S96 VanDerWaalsContact O-N 3.17Å; A92-S96 PolarHBondContact O-OG 3.33Å; A92-S96 VanDerWaalsContact O-OG 3.05Å; R93-S96 WeakPolarHBondContact O-CB 3.12Å; R93-S96 PolarHBondContact O-N 3.43Å; R93-S96 VanDerWaalsContact O-N 3.07Å; W94-S96 PolarHBondContact O-N 3.42Å; S96-G100 PolarHBondContact O-N 3.16Å; S96-Y228 VanDerWaalsContact CB-CZ 3.48Å; S96-Y228 WeakPolarHBondContact CB-OH 3.38Å; S96-Y228 PolarHBondContact OG-OH 3.21Å
97	I	94.6	Very high	94.6	Very high	7 Å²	7	45.8 Å²	45.8	4%	0.036	25%	0.253	C	S	.	.	H	α-helix	trans	-64.9	-46.6	172.2	-66.6	167.6	0	0	0	109.7	R93 W94 N99 G100 L225 Y228 P296 L304	R93-I97 HydrophobicContact CG-CD1 4.32Å; R93-I97 PolarHBondContact O-N 2.95Å; W94-I97 PolarHBondContact O-N 3.44Å; W94-I97 VanDerWaalsContact O-N 3.15Å; I97-N99 VanDerWaalsContact C-N 3.3Å; I97-N99 PolarHBondContact O-N 3.32Å; I97-G100 WeakPolarHBondContact O-CA 3.19Å; I97-G100 PolarHBondContact O-N 3.4Å; I97-L225 HydrophobicContact CG2-CD2 3.9Å; I97-L225 VanDerWaalsContact O-CD2 3.25Å; I97-L225 WeakPolarHBondContact O-CD2 3.49Å; I97-Y228 HydrophobicContact CD1-CG 4.32Å; I97-Y228 HydrophobicContact CG1-CD1 4.25Å; I97-Y228 HydrophobicContact CG1-CD2 3.79Å; I97-Y228 HydrophobicContact CG1-CE2 4.44Å; I97-Y228 HydrophobicContact CG1-CG 3.7Å; I97-P296 HydrophobicContact CB-CG 4.34Å; I97-P296 HydrophobicContact CD1-CG 3.8Å; I97-P296 HydrophobicContact CG2-CG 3.94Å; I97-L304 HydrophobicContact CG2-CD1 4.24Å
98	L	93.2	Very high	94.6	Very high	62 Å²	62	45.2 Å²	45.2	33%	0.325	25%	0.25	S	S	.	.	H	α-helix	trans	-56.4	-43.5	177.9	179	63	0	0	0	112.1	W94 G95 G100 I101 L304	W94-L98 HydrophobicContact CH2-CD2 3.9Å; W94-L98 HydrophobicContact CZ2-CD2 4.04Å; W94-L98 PolarHBondContact O-N 2.69Å; G95-L98 PolarHBondContact O-N 3.1Å; L98-G100 PolarHBondContact O-N 3.22Å; L98-I101 HydrophobicContact CD1-CD1 3.86Å; L98-I101 PolarHBondContact O-N 3.38Å; L98-L304 HydrophobicContact CD1-CD2 3.79Å
99	N	92.6	Very high	94.4	Very high	141 Å²	141	45.8 Å²	45.8	75%	0.754	25%	0.246	S	C	*	.	H	α-helix	trans	-66.6	-18.6	177.1	-69.6	-25.5	0	0	0	113.5	G95 I97	G95-N99 VanDerWaalsContact O-CG 3.27Å; G95-N99 PolarHBondContact O-N 2.64Å; G95-N99 VanDerWaalsContact O-N 3.12Å; G95-N99 PolarHBondContact O-ND2 3.17Å; I97-N99 VanDerWaalsContact C-N 3.3Å; I97-N99 PolarHBondContact O-N 3.32Å
100	G	92.9	Very high	94.3	Very high	3 Å²	3	43 Å²	43	3%	0.031	24%	0.236	C	C	.	.	H	α-helix	trans	-86.9	-12.8	-178.9	0	0	0	0	0	115.4	S96 I97 L98 G102 G221	S96-G100 PolarHBondContact O-N 3.16Å; I97-G100 WeakPolarHBondContact O-CA 3.19Å; I97-G100 PolarHBondContact O-N 3.4Å; L98-G100 PolarHBondContact O-N 3.22Å; G100-G102 PolarHBondContact O-N 3.31Å; G100-G102 VanDerWaalsContact O-N 3.11Å; G100-G221 CarbonylContact O-C 3.42Å; G100-G221 WeakPolarHBondContact O-CA 3.39Å
101	I	90.9	Very high	94.2	Very high	3 Å²	3	43 Å²	43	2%	0.015	24%	0.235	C	C	.	.	S	Bend	trans	-56.6	-30.7	-171.1	-71.9	178.2	0	0	0	113.6	L98 Q137 L304 I309	L98-I101 HydrophobicContact CD1-CD1 3.86Å; L98-I101 PolarHBondContact O-N 3.38Å; I101-Q137 PolarHBondContact O-NE2 3.34Å; I101-L304 HydrophobicContact CD1-CB 4.47Å; I101-L304 HydrophobicContact CD1-CD1 3.6Å; I101-L304 HydrophobicContact CD1-CD2 3.99Å; I101-L304 HydrophobicContact CD1-CG 4.22Å; I101-L304 HydrophobicContact CG1-CD1 4.43Å; I101-I309 HydrophobicContact CD1-CD1 3.95Å; I101-I309 HydrophobicContact CG2-CB 4.41Å; I101-I309 HydrophobicContact CG2-CD1 3.54Å; I101-I309 HydrophobicContact CG2-CG1 4.16Å; I101-I309 HydrophobicContact CG2-CG2 3.63Å
102	G	89.6	Confident	93.8	Very high	13 Å²	13	40.6 Å²	40.6	13%	0.134	22%	0.222	C	C	.	.			trans	77.8	111.4	177.7	0	0	0	0	0	113.1	G100 Q137 N313	G100-G102 PolarHBondContact O-N 3.31Å; G100-G102 VanDerWaalsContact O-N 3.11Å; G102-Q137 PolarHBondContact O-NE2 2.91Å; G102-N313 PolarHBondContact O-ND2 3.25Å
103	W	95.4	Very high	93.3	Very high	125 Å²	125	41.3 Å²	41.3	47%	0.473	22%	0.22	S	C	.	.			trans	-100.5	139.8	174	-63.3	99.4	0	0	0	109.9	D105 I309 K312	W103-D105 VanDerWaalsContact C-N 3.33Å; W103-I309 HydrophobicContact CH2-CG1 4.39Å; W103-K312 HydrophobicContact CE3-CD 4.13Å; W103-K312 HydrophobicContact CZ3-CD 3.95Å
104	I	97.1	Very high	93	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.226	C	C	.	.	S	Bend	trans	-81.1	-15	-172.2	-158.1	47.2	0	0	0	113.8	D106 A107 S108 V130 L133 V134 F218 N313	I104-D106 PolarHBondContact O-N 2.91Å; I104-A107 PolarHBondContact O-N 3.3Å; I104-S108 WeakPolarHBondContact CG1-OG 3.24Å; I104-S108 WeakPolarHBondContact O-CB 3.01Å; I104-S108 PolarHBondContact O-N 3.02Å; I104-S108 PolarHBondContact O-OG 2.86Å; I104-V130 HydrophobicContact CD1-CG1 4.4Å; I104-V130 HydrophobicContact CG1-CG1 4Å; I104-L133 HydrophobicContact CD1-CB 3.74Å; I104-L133 HydrophobicContact CD1-CD1 3.76Å; I104-L133 HydrophobicContact CD1-CG 4.36Å; I104-V134 HydrophobicContact CD1-CG2 4.24Å; I104-V134 HydrophobicContact CG1-CG2 4.24Å; I104-F218 HydrophobicContact CD1-CE2 4.5Å; I104-N313 HydrophobicContact CB-CB 3.85Å; I104-N313 HydrophobicContact CG2-CB 3.95Å; I104-N313 WeakPolarHBondContact CG2-O 3.5Å; I104-N313 PolarHBondContact N-OD1 3.49Å
105	D	95.4	Very high	92.8	Very high	47 Å²	47	40.1 Å²	40.1	25%	0.251	22%	0.216	S	C	.	.	H	α-helix	trans	-61.6	-50.2	-162.2	-52.7	-122.9	0	0	0	110.8	W103 A107 S108 L109 K312	W103-D105 VanDerWaalsContact C-N 3.33Å; D105-A107 PolarHBondContact O-N 3.49Å; D105-S108 PolarHBondContact O-N 3.29Å; D105-L109 WeakPolarHBondContact O-CB 3.26Å; D105-L109 VanDerWaalsContact O-CG 3.27Å; D105-L109 WeakPolarHBondContact O-CG 3.05Å; D105-L109 PolarHBondContact O-N 3.49Å; D105-K312 IonicContact OD1-NZ 3.96Å; D105-K312 PolarHBondContact OD1-NZ 3.24Å; D105-K312 IonicContact OD2-NZ 2.63Å; D105-K312 PolarHBondContact OD2-NZ 3.1Å
106	D	95.5	Very high	92.2	Very high	98 Å²	98	46 Å²	46	52%	0.524	23%	0.232	S	C	.	.	H	α-helix	trans	-59.5	-49.2	179.5	-67.2	-30.7	0	0	0	111.1	I104 S108 L109 L110 E214	I104-D106 PolarHBondContact O-N 2.91Å; D106-S108 PolarHBondContact O-N 2.86Å; D106-L109 PolarHBondContact O-N 3.4Å; D106-L110 WeakPolarHBondContact O-CG 3.29Å; D106-L110 PolarHBondContact O-N 2.9Å; D106-L110 VanDerWaalsContact O-N 3.12Å; D106-E214 HydrophobicContact CB-CG 4.18Å
107	A	96.8	Very high	91.5	Very high	2 Å²	2	45.3 Å²	45.3	2%	0.017	23%	0.232	C	C	.	.	H	α-helix	trans	-61.2	-43.6	178	0	0	0	0	0	111.9	I104 D105 L110 F111 L133 E214	I104-A107 PolarHBondContact O-N 3.3Å; D105-A107 PolarHBondContact O-N 3.49Å; A107-L110 PolarHBondContact O-N 2.98Å; A107-F111 HydrophobicContact CB-CE2 4.01Å; A107-F111 HydrophobicContact CB-CZ 3.99Å; A107-F111 WeakPolarHBondContact O-CD1 3.4Å; A107-F111 VanDerWaalsContact O-CD2 3.27Å; A107-F111 WeakPolarHBondContact O-CD2 3.47Å; A107-F111 WeakPolarHBondContact O-CG 3.1Å; A107-F111 PolarHBondContact O-N 3.25Å; A107-L133 HydrophobicContact CB-CD1 3.6Å; A107-E214 HydrophobicContact CB-CG 4.13Å
108	S	95	Very high	90.5	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-65.4	-42.1	-179.1	-56.7	0	0	0	0	112.2	I104 D105 D106 L110 F111 A112 G317 V321	I104-S108 WeakPolarHBondContact CG1-OG 3.24Å; I104-S108 WeakPolarHBondContact O-CB 3.01Å; I104-S108 PolarHBondContact O-N 3.02Å; I104-S108 PolarHBondContact O-OG 2.86Å; D105-S108 PolarHBondContact O-N 3.29Å; D106-S108 PolarHBondContact O-N 2.86Å; S108-L110 VanDerWaalsContact C-N 3.31Å; S108-L110 PolarHBondContact O-N 3.5Å; S108-F111 PolarHBondContact O-N 3.42Å; S108-A112 WeakPolarHBondContact O-CB 3.41Å; S108-A112 PolarHBondContact O-N 2.9Å; S108-G317 VanDerWaalsContact OG-CA 3.28Å; S108-G317 WeakPolarHBondContact OG-CA 2.96Å; S108-V321 WeakPolarHBondContact O-CG1 3.43Å
109	L	91.7	Very high	90	Very high	90 Å²	90	47.8 Å²	47.8	47%	0.471	25%	0.254	S	S	.	.	H	α-helix	trans	-62.1	-40.5	176.2	-71.8	169	0	0	0	111.3	D105 D106 T113 I320	D105-L109 WeakPolarHBondContact O-CB 3.26Å; D105-L109 VanDerWaalsContact O-CG 3.27Å; D105-L109 WeakPolarHBondContact O-CG 3.05Å; D105-L109 PolarHBondContact O-N 3.49Å; D106-L109 PolarHBondContact O-N 3.4Å; L109-T113 WeakPolarHBondContact O-CB 2.86Å; L109-T113 PolarHBondContact O-N 3.25Å; L109-T113 PolarHBondContact O-OG1 3.4Å; L109-I320 HydrophobicContact CD2-CG2 3.99Å; L109-I320 HydrophobicContact CG-CG2 4.35Å
110	L	92.9	Very high	89.7	Confident	35 Å²	35	48.7 Å²	48.7	18%	0.183	25%	0.254	C	S	.	.	H	α-helix	trans	-67	-43.9	174.8	-65.1	-175.6	0	0	0	112.1	D106 A107 S108 A112 T113 Y114 E214	D106-L110 WeakPolarHBondContact O-CG 3.29Å; D106-L110 PolarHBondContact O-N 2.9Å; D106-L110 VanDerWaalsContact O-N 3.12Å; A107-L110 PolarHBondContact O-N 2.98Å; S108-L110 VanDerWaalsContact C-N 3.31Å; S108-L110 PolarHBondContact O-N 3.5Å; L110-A112 VanDerWaalsContact C-N 3.34Å; L110-A112 PolarHBondContact O-N 3.25Å; L110-T113 PolarHBondContact O-N 2.8Å; L110-Y114 HydrophobicContact CB-CD2 4.43Å; L110-Y114 HydrophobicContact CD2-CD2 4.14Å; L110-Y114 HydrophobicContact CD2-CE2 3.59Å; L110-Y114 WeakPolarHBondContact O-CB 3.42Å; L110-Y114 PolarHBondContact O-N 3.41Å; L110-E214 HydrophobicContact CD1-CB 3.65Å; L110-E214 HydrophobicContact CD1-CG 3.88Å
111	F	93.8	Very high	89.6	Confident	1 Å²	1	52.9 Å²	52.9	0%	0.004	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-44	176.7	-59.1	-26.8	0	0	0	111.6	A107 S108 I115 R126 L129 V130 L133 I211 I215 V321	A107-F111 HydrophobicContact CB-CE2 4.01Å; A107-F111 HydrophobicContact CB-CZ 3.99Å; A107-F111 WeakPolarHBondContact O-CD1 3.4Å; A107-F111 VanDerWaalsContact O-CD2 3.27Å; A107-F111 WeakPolarHBondContact O-CD2 3.47Å; A107-F111 WeakPolarHBondContact O-CG 3.1Å; A107-F111 PolarHBondContact O-N 3.25Å; S108-F111 PolarHBondContact O-N 3.42Å; F111-I115 HydrophobicContact CB-CD1 4.26Å; F111-I115 HydrophobicContact CD1-CD1 4.26Å; F111-I115 VanDerWaalsContact O-CB 3.31Å; F111-I115 WeakPolarHBondContact O-CB 3.28Å; F111-I115 PolarHBondContact O-N 3.44Å; F111-R126 WeakPolarHBondContact O-CD 3.33Å; F111-L129 HydrophobicContact CD1-CD1 4.02Å; F111-L129 HydrophobicContact CD2-CB 3.81Å; F111-L129 HydrophobicContact CE1-CB 4.36Å; F111-L129 HydrophobicContact CE1-CD1 4.24Å; F111-L129 HydrophobicContact CE2-CB 3.65Å; F111-L129 HydrophobicContact CG-CB 4.26Å; F111-L129 HydrophobicContact CG-CD1 4.2Å; F111-L129 HydrophobicContact CZ-CB 3.94Å; F111-V130 HydrophobicContact CD2-CG2 3.94Å; F111-V130 HydrophobicContact CE2-CG2 4.3Å; F111-L133 HydrophobicContact CE2-CD1 3.93Å; F111-L133 HydrophobicContact CZ-CD1 3.8Å; F111-L133 HydrophobicContact CZ-CG 4.49Å; F111-I211 HydrophobicContact CD1-CG2 3.7Å; F111-I211 HydrophobicContact CE1-CG2 3.45Å; F111-I211 VanDerWaalsContact CE1-CG2 3.45Å; F111-I215 HydrophobicContact CE1-CD1 4.03Å; F111-I215 HydrophobicContact CE1-CG1 4.1Å; F111-I215 HydrophobicContact CZ-CD1 4.2Å; F111-I215 HydrophobicContact CZ-CG1 4Å; F111-V321 HydrophobicContact CB-CG1 3.97Å; F111-V321 HydrophobicContact CD2-CG1 4.45Å
112	A	88.2	Confident	89.5	Confident	10 Å²	10	52.8 Å²	52.8	8%	0.083	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-43.4	178	0	0	0	0	0	111.7	S108 L110 I320 V321 M324	S108-A112 WeakPolarHBondContact O-CB 3.41Å; S108-A112 PolarHBondContact O-N 2.9Å; L110-A112 VanDerWaalsContact C-N 3.34Å; L110-A112 PolarHBondContact O-N 3.25Å; A112-I320 HydrophobicContact CB-CG2 4.09Å; A112-V321 HydrophobicContact CB-CG1 4.5Å; A112-M324 VanDerWaalsContact C-SD 3.54Å; A112-M324 HydrophobicContact CB-CG 4.28Å; A112-M324 HydrophobicContact CB-SD 3.73Å
113	T	85.6	Confident	89.5	Confident	76 Å²	76	57.4 Å²	57.4	47%	0.466	29%	0.285	S	S	.	.	H	α-helix	trans	-80.4	-40.3	-173.5	-51.9	0	0	0	0	113.5	L109 L110	L109-T113 WeakPolarHBondContact O-CB 2.86Å; L109-T113 PolarHBondContact O-N 3.25Å; L109-T113 PolarHBondContact O-OG1 3.4Å; L110-T113 PolarHBondContact O-N 2.8Å
114	Y	88.6	Confident	89.4	Confident	65 Å²	65	54.6 Å²	54.6	26%	0.255	28%	0.282	S	S	.	.	H	α-helix	trans	-100.3	-17.1	-168.7	-63.8	-17.3	0	0	0	114.4	L110 L207 K210 I211	L110-Y114 HydrophobicContact CB-CD2 4.43Å; L110-Y114 HydrophobicContact CD2-CD2 4.14Å; L110-Y114 HydrophobicContact CD2-CE2 3.59Å; L110-Y114 WeakPolarHBondContact O-CB 3.42Å; L110-Y114 PolarHBondContact O-N 3.41Å; Y114-L207 HydrophobicContact CD1-CD1 4.35Å; Y114-L207 HydrophobicContact CD1-CD2 4.07Å; Y114-L207 HydrophobicContact CD2-CB 4.19Å; Y114-L207 HydrophobicContact CD2-CD2 4.22Å; Y114-L207 HydrophobicContact CE1-CD2 3.86Å; Y114-L207 HydrophobicContact CE2-CD2 3.98Å; Y114-L207 HydrophobicContact CG-CB 4.25Å; Y114-L207 HydrophobicContact CG-CD2 4.27Å; Y114-K210 HydrophobicContact CE2-CB 4.06Å; Y114-I211 HydrophobicContact CD2-CD1 4.45Å; Y114-I211 HydrophobicContact CD2-CG1 4.03Å
115	I	89.3	Confident	89.3	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.284	C	S	.	.	S	Bend	trans	-99.4	94.4	175.5	-54.5	175.8	0	0	0	109	F111 T122 R126 L129 C196 V202 I211	F111-I115 HydrophobicContact CB-CD1 4.26Å; F111-I115 HydrophobicContact CD1-CD1 4.26Å; F111-I115 VanDerWaalsContact O-CB 3.31Å; F111-I115 WeakPolarHBondContact O-CB 3.28Å; F111-I115 PolarHBondContact O-N 3.44Å; I115-T122 HydrophobicContact CG2-CG2 3.83Å; I115-R126 HydrophobicContact CB-CG 4.07Å; I115-R126 HydrophobicContact CG2-CG 4.03Å; I115-R126 PolarHBondContact O-NH1 2.9Å; I115-L129 HydrophobicContact CD1-CD1 3.2Å; I115-C196 HydrophobicContact CG2-CB 4.47Å; I115-V202 HydrophobicContact CG1-CG2 4.16Å; I115-I211 HydrophobicContact CD1-CD1 4.46Å; I115-I211 HydrophobicContact CG1-CD1 4.04Å
116	R	83.6	Confident	89.3	Confident	143 Å²	143	53.3 Å²	53.3	54%	0.54	27%	0.274	S	S	.	.			trans	-86.7	144.8	-175.2	-61.5	-175.1	177.6	167.6	9.7	111.5	K201 D203	R116-K201 PolarHBondContact N-O 3.45Å; R116-K201 WeakPolarHBondContact O-CB 3.45Å; R116-D203 IonicContact CZ-OD1 2.76Å; R116-D203 IonicContact CZ-OD2 2.76Å; R116-D203 IonicContact NE-OD2 2.74Å; R116-D203 IonicContact NH1-OD1 2.81Å; R116-D203 PolarHBondContact NH1-OD1 3.35Å; R116-D203 IonicContact NH1-OD2 2.71Å; R116-D203 PolarHBondContact NH1-OD2 3.11Å; R116-D203 IonicContact NH2-OD2 2.67Å; R116-D203 PolarHBondContact NH2-OD2 2.92Å; R116-D203 VanDerWaalsContact NH2-OD2 3.15Å
117	G	78.6	Confident	89.3	Confident	30 Å²	30	52.6 Å²	52.6	31%	0.309	26%	0.264	S	S	.	.			trans	144.4	130.8	-179.3	0	0	0	0	0	111.2	D119 R126	G117-D119 WeakPolarHBondContact CA-OD1 3.45Å; G117-R126 PolarHBondContact O-NH1 3.26Å
118	A	74.9	Confident	89.3	Confident	57 Å²	57	54.3 Å²	54.3	47%	0.471	27%	0.272	S	S	.	.			trans	-93.8	-12.7	178.2	0	0	0	0	0	112.6	W325	A118-W325 HydrophobicContact CB-CZ2 4.28Å
119	D	82.4	Confident	89.4	Confident	65 Å²	65	54.3 Å²	54.3	35%	0.348	27%	0.272	S	S	.	.	S	Bend	trans	-66.6	149.4	179	56.1	-63.3	0	0	0	111.7	G117 E121 T122 R123 K201	G117-D119 WeakPolarHBondContact CA-OD1 3.45Å; D119-E121 PolarHBondContact O-N 3.17Å; D119-E121 WeakPolarHBondContact OD2-CB 3.45Å; D119-T122 PolarHBondContact O-N 3.01Å; D119-T122 VanDerWaalsContact O-N 3.13Å; D119-T122 WeakPolarHBondContact OD1-CB 3.49Å; D119-T122 PolarHBondContact OD1-OG1 3.16Å; D119-T122 PolarHBondContact OD2-N 3Å; D119-T122 PolarHBondContact OD2-OG1 3.25Å; D119-R123 PolarHBondContact O-N 3.17Å; D119-R123 VanDerWaalsContact O-N 3.1Å; D119-K201 IonicContact OD2-NZ 3.13Å; D119-K201 PolarHBondContact OD2-NZ 2.98Å
120	E	86.3	Confident	89.7	Confident	160 Å²	160	50 Å²	50	75%	0.748	25%	0.25	S	C	*	.	H	α-helix	trans	-55	-37.9	177.3	-174.9	174.5	-171.1	0	0	111.7	R123 V124	E120-R123 WeakPolarHBondContact O-CB 3.35Å; E120-R123 PolarHBondContact O-N 3.34Å; E120-V124 VanDerWaalsContact O-CG2 3.31Å; E120-V124 WeakPolarHBondContact O-CG2 3.39Å; E120-V124 PolarHBondContact O-N 2.89Å
121	E	89.8	Confident	90	Very high	91 Å²	91	49.6 Å²	49.6	43%	0.425	25%	0.246	S	C	.	.	H	α-helix	trans	-61.4	-47	177.6	-173.6	-152.6	139.6	0	0	111.6	D119 R123 V124 I125 K199 K201	D119-E121 PolarHBondContact O-N 3.17Å; D119-E121 WeakPolarHBondContact OD2-CB 3.45Å; E121-R123 VanDerWaalsContact C-N 3.32Å; E121-R123 PolarHBondContact O-N 2.79Å; E121-V124 PolarHBondContact O-N 3.3Å; E121-I125 HydrophobicContact CG-CD1 4.36Å; E121-I125 WeakPolarHBondContact O-CG1 3.31Å; E121-I125 PolarHBondContact O-N 3.04Å; E121-K199 IonicContact OE1-NZ 2.78Å; E121-K199 PolarHBondContact OE1-NZ 3.33Å; E121-K201 VanDerWaalsContact CD-NZ 3.3Å; E121-K201 IonicContact OE1-NZ 3.87Å; E121-K201 PolarHBondContact OE1-NZ 3.41Å; E121-K201 VanDerWaalsContact OE1-NZ 3.13Å; E121-K201 IonicContact OE2-NZ 2.67Å
122	T	89.4	Confident	90.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-62	-40.5	175.3	-56.1	0	0	0	0	112	I115 D119 V124 I125 R126 K201	I115-T122 HydrophobicContact CG2-CG2 3.83Å; D119-T122 PolarHBondContact O-N 3.01Å; D119-T122 VanDerWaalsContact O-N 3.13Å; D119-T122 WeakPolarHBondContact OD1-CB 3.49Å; D119-T122 PolarHBondContact OD1-OG1 3.16Å; D119-T122 PolarHBondContact OD2-N 3Å; D119-T122 PolarHBondContact OD2-OG1 3.25Å; T122-V124 VanDerWaalsContact C-N 3.34Å; T122-V124 PolarHBondContact O-N 2.89Å; T122-I125 PolarHBondContact O-N 3.46Å; T122-R126 PolarHBondContact O-N 2.91Å; T122-K201 HydrophobicContact CG2-CD 4.25Å; T122-K201 VanDerWaalsContact OG1-CD 3.28Å; T122-K201 WeakPolarHBondContact OG1-CD 3.35Å; T122-K201 WeakPolarHBondContact OG1-CE 3.41Å; T122-K201 PolarHBondContact OG1-NZ 3.35Å
123	R	89.4	Confident	90.7	Very high	111 Å²	111	50.2 Å²	50.2	42%	0.419	25%	0.246	S	C	.	.	H	α-helix	trans	-59.3	-46.3	175.9	-176.8	-175.2	-178.4	-174.6	2.5	111.1	D119 E120 E121 I125 R126 R127 D322	D119-R123 PolarHBondContact O-N 3.17Å; D119-R123 VanDerWaalsContact O-N 3.1Å; E120-R123 WeakPolarHBondContact O-CB 3.35Å; E120-R123 PolarHBondContact O-N 3.34Å; E121-R123 VanDerWaalsContact C-N 3.32Å; E121-R123 PolarHBondContact O-N 2.79Å; R123-I125 VanDerWaalsContact C-N 3.34Å; R123-I125 PolarHBondContact O-N 3.12Å; R123-R126 PolarHBondContact O-N 3.34Å; R123-R127 WeakPolarHBondContact O-CG 3.33Å; R123-R127 PolarHBondContact O-N 2.88Å; R123-D322 IonicContact CZ-OD1 2.66Å; R123-D322 IonicContact CZ-OD2 3.34Å; R123-D322 IonicContact NE-OD1 3.43Å; R123-D322 PolarHBondContact NE-OD1 2.7Å; R123-D322 IonicContact NE-OD2 3.62Å; R123-D322 VanDerWaalsContact NH2-CG 3.28Å; R123-D322 IonicContact NH2-OD1 3.5Å; R123-D322 PolarHBondContact NH2-OD1 3.43Å; R123-D322 IonicContact NH2-OD2 2.62Å; R123-D322 PolarHBondContact NH2-OD2 3.33Å
124	V	93.1	Very high	91.3	Very high	66 Å²	66	46.6 Å²	46.6	40%	0.4	22%	0.224	S	C	.	.	H	α-helix	trans	-59.9	-44.2	176	169.7	0	0	0	0	111	E120 E121 T122 R126 R127 N128	E120-V124 VanDerWaalsContact O-CG2 3.31Å; E120-V124 WeakPolarHBondContact O-CG2 3.39Å; E120-V124 PolarHBondContact O-N 2.89Å; E121-V124 PolarHBondContact O-N 3.3Å; T122-V124 VanDerWaalsContact C-N 3.34Å; T122-V124 PolarHBondContact O-N 2.89Å; V124-R126 PolarHBondContact O-N 3.39Å; V124-R127 PolarHBondContact O-N 3.47Å; V124-N128 WeakPolarHBondContact CG1-ND2 3.27Å; V124-N128 WeakPolarHBondContact O-CB 3.39Å; V124-N128 PolarHBondContact O-N 3.3Å
125	I	95	Very high	91.7	Very high	9 Å²	9	43.5 Å²	43.5	5%	0.046	21%	0.212	C	C	.	.	H	α-helix	trans	-60.6	-48.7	178.3	-66.6	164.6	0	0	0	111.3	E121 T122 R123 R127 N128 L129 L192 C196	E121-I125 HydrophobicContact CG-CD1 4.36Å; E121-I125 WeakPolarHBondContact O-CG1 3.31Å; E121-I125 PolarHBondContact O-N 3.04Å; T122-I125 PolarHBondContact O-N 3.46Å; R123-I125 VanDerWaalsContact C-N 3.34Å; R123-I125 PolarHBondContact O-N 3.12Å; I125-R127 VanDerWaalsContact C-N 3.34Å; I125-R127 PolarHBondContact O-N 2.74Å; I125-N128 PolarHBondContact O-N 3.03Å; I125-L129 HydrophobicContact CG2-CD1 4.1Å; I125-L129 HydrophobicContact CG2-CG 4.38Å; I125-L129 WeakPolarHBondContact O-CG 3.34Å; I125-L129 PolarHBondContact O-N 3.42Å; I125-L192 HydrophobicContact CG2-CB 4.24Å; I125-L192 HydrophobicContact CG2-CD1 4.45Å; I125-C196 VanDerWaalsContact CG2-SG 3.58Å
126	R	94.4	Very high	92.1	Very high	11 Å²	11	43.5 Å²	43.5	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-61.2	-42	179.8	-67.8	-166	-66.5	-92	-7.1	112.1	F111 I115 G117 T122 R123 V124 L129 V130 V321	F111-R126 WeakPolarHBondContact O-CD 3.33Å; I115-R126 HydrophobicContact CB-CG 4.07Å; I115-R126 HydrophobicContact CG2-CG 4.03Å; I115-R126 PolarHBondContact O-NH1 2.9Å; G117-R126 PolarHBondContact O-NH1 3.26Å; T122-R126 PolarHBondContact O-N 2.91Å; R123-R126 PolarHBondContact O-N 3.34Å; V124-R126 PolarHBondContact O-N 3.39Å; R126-L129 PolarHBondContact O-N 3.03Å; R126-V130 PolarHBondContact O-N 3.4Å; R126-V321 HydrophobicContact CB-CB 3.97Å; R126-V321 HydrophobicContact CB-CG2 4.31Å; R126-V321 PolarHBondContact NE-O 3.47Å
127	R	95.6	Very high	92.8	Very high	83 Å²	83	36.7 Å²	36.7	31%	0.313	19%	0.186	S	C	.	.	H	α-helix	trans	-64.5	-41.9	176.2	-69.2	178.1	66.5	82.2	6.2	112	R123 V124 I125 V130 R131 L318 V321 D322	R123-R127 WeakPolarHBondContact O-CG 3.33Å; R123-R127 PolarHBondContact O-N 2.88Å; V124-R127 PolarHBondContact O-N 3.47Å; I125-R127 VanDerWaalsContact C-N 3.34Å; I125-R127 PolarHBondContact O-N 2.74Å; R127-V130 PolarHBondContact O-N 3.01Å; R127-R131 WeakPolarHBondContact O-CB 3.39Å; R127-R131 PolarHBondContact O-N 3.32Å; R127-L318 HydrophobicContact CB-CD2 3.96Å; R127-L318 HydrophobicContact CG-CD2 4.15Å; R127-V321 HydrophobicContact CG-CG2 4.25Å; R127-D322 VanDerWaalsContact NH1-CG 3.34Å; R127-D322 IonicContact NH1-OD1 3.48Å; R127-D322 IonicContact NH1-OD2 3.36Å; R127-D322 PolarHBondContact NH1-OD2 2.88Å
128	N	97.4	Very high	93.7	Very high	37 Å²	37	35.2 Å²	35.2	20%	0.198	17%	0.171	C	C	.	.	H	α-helix	trans	-67.5	-36.4	177.7	-78.5	-20.6	0	0	0	112.5	V124 I125 V130 R131 Y132 L192	V124-N128 WeakPolarHBondContact CG1-ND2 3.27Å; V124-N128 WeakPolarHBondContact O-CB 3.39Å; V124-N128 PolarHBondContact O-N 3.3Å; I125-N128 PolarHBondContact O-N 3.03Å; N128-V130 PolarHBondContact O-N 3.44Å; N128-R131 PolarHBondContact O-N 2.71Å; N128-R131 PolarHBondContact OD1-NE 3.24Å; N128-R131 PolarHBondContact OD1-NH2 2.83Å; N128-Y132 HydrophobicContact CB-CE2 4.4Å; N128-Y132 WeakPolarHBondContact O-CB 3.48Å; N128-Y132 PolarHBondContact O-N 3.26Å; N128-L192 HydrophobicContact CB-CD1 4.12Å
129	L	98	Very high	94.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.1	-46.1	174.9	-76.3	170.4	0	0	0	112.2	F111 I115 I125 R126 L133 S189 L192 V193	F111-L129 HydrophobicContact CD1-CD1 4.02Å; F111-L129 HydrophobicContact CD2-CB 3.81Å; F111-L129 HydrophobicContact CE1-CB 4.36Å; F111-L129 HydrophobicContact CE1-CD1 4.24Å; F111-L129 HydrophobicContact CE2-CB 3.65Å; F111-L129 HydrophobicContact CG-CB 4.26Å; F111-L129 HydrophobicContact CG-CD1 4.2Å; F111-L129 HydrophobicContact CZ-CB 3.94Å; I115-L129 HydrophobicContact CD1-CD1 3.2Å; I125-L129 HydrophobicContact CG2-CD1 4.1Å; I125-L129 HydrophobicContact CG2-CG 4.38Å; I125-L129 WeakPolarHBondContact O-CG 3.34Å; I125-L129 PolarHBondContact O-N 3.42Å; R126-L129 PolarHBondContact O-N 3.03Å; L129-L133 WeakPolarHBondContact O-CG 3.35Å; L129-L133 PolarHBondContact O-N 3.43Å; L129-S189 WeakPolarHBondContact CD2-O 3.47Å; L129-L192 HydrophobicContact CD2-CB 3.98Å; L129-L192 HydrophobicContact CD2-CD1 4.31Å; L129-L192 HydrophobicContact CG-CB 4.48Å; L129-L192 HydrophobicContact CG-CD1 4.39Å; L129-V193 HydrophobicContact CD1-CG2 4.19Å; L129-V193 HydrophobicContact CD2-CG2 3.89Å
130	V	98.1	Very high	95.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.3	-51.9	173.4	172.5	0	0	0	0	110.2	I104 F111 R126 R127 N128 Y132 L133 V134 L318 V321	I104-V130 HydrophobicContact CD1-CG1 4.4Å; I104-V130 HydrophobicContact CG1-CG1 4Å; F111-V130 HydrophobicContact CD2-CG2 3.94Å; F111-V130 HydrophobicContact CE2-CG2 4.3Å; R126-V130 PolarHBondContact O-N 3.4Å; R127-V130 PolarHBondContact O-N 3.01Å; N128-V130 PolarHBondContact O-N 3.44Å; V130-Y132 VanDerWaalsContact C-N 3.28Å; V130-Y132 PolarHBondContact O-N 3.22Å; V130-L133 PolarHBondContact O-N 3.2Å; V130-V134 HydrophobicContact CG1-CG2 4.36Å; V130-V134 WeakPolarHBondContact O-CG2 3.5Å; V130-V134 PolarHBondContact O-N 2.67Å; V130-L318 HydrophobicContact CB-CD2 4.35Å; V130-L318 HydrophobicContact CG1-CD2 4.29Å; V130-L318 HydrophobicContact CG1-CG 4.33Å; V130-V321 HydrophobicContact CG2-CB 4.37Å; V130-V321 HydrophobicContact CG2-CG1 3.59Å; V130-V321 HydrophobicContact CG2-CG2 3.87Å
131	R	98.1	Very high	95.8	Very high	26 Å²	26	22.2 Å²	22.2	10%	0.098	10%	0.099	C	C	.	.	H	α-helix	trans	-59.5	-37.8	-177	-171.4	173	59.4	81	-1.5	112.2	R127 N128 V134 L135 L163 E168	R127-R131 WeakPolarHBondContact O-CB 3.39Å; R127-R131 PolarHBondContact O-N 3.32Å; N128-R131 PolarHBondContact O-N 2.71Å; N128-R131 PolarHBondContact OD1-NE 3.24Å; N128-R131 PolarHBondContact OD1-NH2 2.83Å; R131-V134 PolarHBondContact O-N 2.87Å; R131-L135 WeakPolarHBondContact O-CB 3.45Å; R131-L135 PolarHBondContact O-N 3.14Å; R131-L163 VanDerWaalsContact CG-O 3.29Å; R131-L163 WeakPolarHBondContact CG-O 3.27Å; R131-L163 PolarHBondContact NH1-O 3.11Å; R131-E168 IonicContact CZ-OE1 2.72Å; R131-E168 IonicContact CZ-OE2 3.35Å; R131-E168 IonicContact NH1-OE1 2.62Å; R131-E168 PolarHBondContact NH1-OE1 3.4Å; R131-E168 IonicContact NH1-OE2 2.75Å; R131-E168 PolarHBondContact NH1-OE2 3.18Å; R131-E168 IonicContact NH2-OE1 2.68Å; R131-E168 PolarHBondContact NH2-OE1 3.31Å; R131-E168 IonicContact NH2-OE2 2.76Å; R131-E168 PolarHBondContact NH2-OE2 3.37Å
132	Y	98.4	Very high	96.1	Very high	24 Å²	24	19 Å²	19	9%	0.094	8%	0.083	C	C	.	.	H	α-helix	trans	-69.7	-35.7	177.8	-71.3	-11.2	0	0	0	113.8	N128 V130 S136 E168 S185 W188 S189 L192	N128-Y132 HydrophobicContact CB-CE2 4.4Å; N128-Y132 WeakPolarHBondContact O-CB 3.48Å; N128-Y132 PolarHBondContact O-N 3.26Å; V130-Y132 VanDerWaalsContact C-N 3.28Å; V130-Y132 PolarHBondContact O-N 3.22Å; Y132-S136 PolarHBondContact O-N 3.44Å; Y132-E168 PolarHBondContact OH-OE1 3.46Å; Y132-S185 WeakPolarHBondContact O-CB 3.47Å; Y132-S185 PolarHBondContact O-OG 2.9Å; Y132-W188 HydrophobicContact CD1-CE3 4.08Å; Y132-W188 HydrophobicContact CD2-CB 3.65Å; Y132-W188 AromaticContact CE1-CE3 3.84Å; Y132-W188 HydrophobicContact CE1-CE3 3.84Å; Y132-W188 HydrophobicContact CE1-CZ3 4.35Å; Y132-W188 HydrophobicContact CE2-CB 3.49Å; Y132-W188 VanDerWaalsContact CE2-CB 3.49Å; Y132-W188 HydrophobicContact CE2-CE3 4.29Å; Y132-W188 HydrophobicContact CE2-CG 4.41Å; Y132-W188 HydrophobicContact CG-CB 4.48Å; Y132-W188 HydrophobicContact CG-CE3 4.42Å; Y132-W188 AromaticContact CZ-CE3 3.95Å; Y132-S189 WeakPolarHBondContact CB-OG 3Å; Y132-L192 HydrophobicContact CD2-CD1 4.05Å; Y132-L192 HydrophobicContact CE2-CD1 3.57Å; Y132-L192 HydrophobicContact CE2-CG 4.44Å
133	L	98.4	Very high	96.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-65.8	-47.2	171.3	-67.7	-170.7	0	0	0	111	I104 A107 F111 L129 V130 L135 S136 Q137 I186 I215 F218	I104-L133 HydrophobicContact CD1-CB 3.74Å; I104-L133 HydrophobicContact CD1-CD1 3.76Å; I104-L133 HydrophobicContact CD1-CG 4.36Å; A107-L133 HydrophobicContact CB-CD1 3.6Å; F111-L133 HydrophobicContact CE2-CD1 3.93Å; F111-L133 HydrophobicContact CZ-CD1 3.8Å; F111-L133 HydrophobicContact CZ-CG 4.49Å; L129-L133 WeakPolarHBondContact O-CG 3.35Å; L129-L133 PolarHBondContact O-N 3.43Å; V130-L133 PolarHBondContact O-N 3.2Å; L133-L135 VanDerWaalsContact C-N 3.31Å; L133-L135 PolarHBondContact O-N 3.14Å; L133-S136 WeakPolarHBondContact O-CB 3.28Å; L133-S136 PolarHBondContact O-N 3.42Å; L133-S136 VanDerWaalsContact O-N 3.16Å; L133-Q137 PolarHBondContact O-N 2.93Å; L133-I186 HydrophobicContact CD2-CD1 3.6Å; L133-I215 HydrophobicContact CD2-CG1 4.33Å; L133-I215 HydrophobicContact CD2-CG2 4.08Å; L133-F218 HydrophobicContact CB-CD1 4.3Å; L133-F218 HydrophobicContact CB-CE1 4.06Å; L133-F218 HydrophobicContact CB-CZ 4.35Å; L133-F218 HydrophobicContact CD2-CD1 4.2Å; L133-F218 VanDerWaalsContact O-CE1 3.31Å; L133-F218 WeakPolarHBondContact O-CE1 3.34Å
134	V	98.2	Very high	96.6	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-65.1	-37	178	-179.8	0	0	0	0	111.4	I104 V130 R131 Q137 A138 L163 I310 N313 L314	I104-V134 HydrophobicContact CD1-CG2 4.24Å; I104-V134 HydrophobicContact CG1-CG2 4.24Å; V130-V134 HydrophobicContact CG1-CG2 4.36Å; V130-V134 WeakPolarHBondContact O-CG2 3.5Å; V130-V134 PolarHBondContact O-N 2.67Å; R131-V134 PolarHBondContact O-N 2.87Å; V134-Q137 WeakPolarHBondContact O-CB 3.15Å; V134-Q137 PolarHBondContact O-N 2.85Å; V134-A138 WeakPolarHBondContact O-CB 3.48Å; V134-A138 PolarHBondContact O-N 3.28Å; V134-L163 HydrophobicContact CG1-CD2 3.8Å; V134-I310 HydrophobicContact CG1-CG2 4.09Å; V134-N313 HydrophobicContact CG2-CB 4.02Å; V134-L314 HydrophobicContact CG1-CB 4.23Å; V134-L314 HydrophobicContact CG1-CD1 4.43Å
135	L	97.8	Very high	96.7	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-60.2	-45.3	172.6	169.5	58.5	0	0	0	111.1	R131 L133 Q137 A138 L139 L158 M164 W188	R131-L135 WeakPolarHBondContact O-CB 3.45Å; R131-L135 PolarHBondContact O-N 3.14Å; L133-L135 VanDerWaalsContact C-N 3.31Å; L133-L135 PolarHBondContact O-N 3.14Å; L135-Q137 VanDerWaalsContact C-N 3.3Å; L135-Q137 PolarHBondContact O-N 3.27Å; L135-A138 PolarHBondContact O-N 3.11Å; L135-L139 HydrophobicContact CD1-CD1 4.05Å; L135-L139 HydrophobicContact CD1-CG 4Å; L135-L139 HydrophobicContact CG-CD1 4.2Å; L135-L139 VanDerWaalsContact O-CG 3.29Å; L135-L139 WeakPolarHBondContact O-CG 3.46Å; L135-L139 PolarHBondContact O-N 3.38Å; L135-L158 HydrophobicContact CD1-CD2 3.31Å; L135-M164 HydrophobicContact CD1-CB 4.2Å; L135-M164 HydrophobicContact CD1-CE 3.39Å; L135-M164 HydrophobicContact CD2-CB 4.29Å; L135-M164 HydrophobicContact CD2-CE 3.83Å; L135-M164 HydrophobicContact CD2-CG 4.16Å; L135-M164 HydrophobicContact CG-CE 4.14Å; L135-W188 HydrophobicContact CD2-CZ3 4.15Å
136	S	97.3	Very high	96.6	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-58.9	-44.6	175.9	-160.4	0	0	0	0	111.1	Y132 L133 L139 V140 Y182 S185 I186	Y132-S136 PolarHBondContact O-N 3.44Å; L133-S136 WeakPolarHBondContact O-CB 3.28Å; L133-S136 PolarHBondContact O-N 3.42Å; L133-S136 VanDerWaalsContact O-N 3.16Å; S136-L139 PolarHBondContact O-N 2.93Å; S136-V140 WeakPolarHBondContact O-CG2 3.42Å; S136-V140 PolarHBondContact O-N 3.39Å; S136-Y182 WeakPolarHBondContact OG-CD2 3.49Å; S136-Y182 PolarHBondContact OG-O 3.21Å; S136-S185 WeakPolarHBondContact CA-OG 3.48Å; S136-S185 VanDerWaalsContact CB-OG 3.27Å; S136-S185 WeakPolarHBondContact CB-OG 3.06Å; S136-S185 PolarHBondContact N-OG 3.26Å; S136-I186 WeakPolarHBondContact OG-CG1 3.42Å
137	Q	97.6	Very high	96.7	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62.5	-45.2	176.5	173.7	177.2	72.1	0	0	111.8	I101 G102 L133 V134 L135 L139 V140 L141 F218 L222 N313	I101-Q137 PolarHBondContact O-NE2 3.34Å; G102-Q137 PolarHBondContact O-NE2 2.91Å; L133-Q137 PolarHBondContact O-N 2.93Å; V134-Q137 WeakPolarHBondContact O-CB 3.15Å; V134-Q137 PolarHBondContact O-N 2.85Å; L135-Q137 VanDerWaalsContact C-N 3.3Å; L135-Q137 PolarHBondContact O-N 3.27Å; Q137-L139 PolarHBondContact O-N 3.35Å; Q137-V140 PolarHBondContact O-N 2.91Å; Q137-L141 HydrophobicContact CG-CD1 3.61Å; Q137-L141 HydrophobicContact CG-CG 4.16Å; Q137-L141 WeakPolarHBondContact O-CB 3.34Å; Q137-L141 VanDerWaalsContact O-CG 3.31Å; Q137-L141 WeakPolarHBondContact O-CG 3.43Å; Q137-L141 PolarHBondContact O-N 3.42Å; Q137-F218 HydrophobicContact CB-CE1 4.09Å; Q137-F218 HydrophobicContact CB-CZ 3.94Å; Q137-L222 HydrophobicContact CB-CD1 4.26Å; Q137-L222 HydrophobicContact CB-CD2 4.08Å; Q137-L222 HydrophobicContact CG-CD2 4.18Å; Q137-N313 PolarHBondContact NE2-ND2 3.32Å; Q137-N313 VanDerWaalsContact NE2-ND2 3.17Å; Q137-N313 PolarHBondContact OE1-ND2 2.78Å
138	A	97.2	Very high	96.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.6	-41.2	178.6	0	0	0	0	0	111.9	V134 L135 R142 L158 L163 I310	V134-A138 WeakPolarHBondContact O-CB 3.48Å; V134-A138 PolarHBondContact O-N 3.28Å; L135-A138 PolarHBondContact O-N 3.11Å; A138-R142 WeakPolarHBondContact O-CB 2.96Å; A138-R142 PolarHBondContact O-N 3.49Å; A138-L158 HydrophobicContact CB-CD1 4.27Å; A138-L163 HydrophobicContact CB-CD1 3.76Å; A138-I310 HydrophobicContact CB-CD1 4.28Å
139	L	96.1	Very high	96.7	Very high	6 Å²	6	20 Å²	20	3%	0.031	9%	0.091	C	C	.	.	H	α-helix	trans	-60.8	-46.9	174.9	-70.5	172.3	0	0	0	111.5	L135 S136 Q137 D143 M155 L158 L172	L135-L139 HydrophobicContact CD1-CD1 4.05Å; L135-L139 HydrophobicContact CD1-CG 4Å; L135-L139 HydrophobicContact CG-CD1 4.2Å; L135-L139 VanDerWaalsContact O-CG 3.29Å; L135-L139 WeakPolarHBondContact O-CG 3.46Å; L135-L139 PolarHBondContact O-N 3.38Å; S136-L139 PolarHBondContact O-N 2.93Å; Q137-L139 PolarHBondContact O-N 3.35Å; L139-D143 PolarHBondContact O-N 3.46Å; L139-M155 HydrophobicContact CD2-CE 3.96Å; L139-M155 HydrophobicContact CD2-SD 4.11Å; L139-L158 HydrophobicContact CD2-CD1 4.02Å; L139-L172 HydrophobicContact CD1-CD1 4.25Å
140	V	96.7	Very high	96.6	Very high	1 Å²	1	26 Å²	26	1%	0.006	12%	0.117	C	C	.	.	H	α-helix	trans	-64.4	-53.3	177.9	168.7	0	0	0	0	111.2	S136 Q137 R142 D143 I144 Y182 L222 L226	S136-V140 WeakPolarHBondContact O-CG2 3.42Å; S136-V140 PolarHBondContact O-N 3.39Å; Q137-V140 PolarHBondContact O-N 2.91Å; V140-R142 VanDerWaalsContact C-N 3.27Å; V140-R142 PolarHBondContact O-N 2.84Å; V140-D143 PolarHBondContact O-N 3.37Å; V140-I144 HydrophobicContact CG1-CD1 4.02Å; V140-I144 WeakPolarHBondContact O-CG1 3.19Å; V140-I144 PolarHBondContact O-N 3.41Å; V140-Y182 HydrophobicContact CG2-CD1 4.14Å; V140-Y182 HydrophobicContact CG2-CD2 3.41Å; V140-Y182 VanDerWaalsContact CG2-CD2 3.41Å; V140-Y182 HydrophobicContact CG2-CE2 4.07Å; V140-Y182 HydrophobicContact CG2-CG 3.45Å; V140-Y182 VanDerWaalsContact CG2-CG 3.45Å; V140-L222 HydrophobicContact CG1-CB 4.38Å; V140-L222 HydrophobicContact CG2-CB 4.19Å; V140-L222 HydrophobicContact CG2-CD1 4.3Å; V140-L226 HydrophobicContact CG1-CD2 3.99Å; V140-L226 HydrophobicContact CG1-CG 3.94Å; V140-L226 HydrophobicContact CG2-CD1 4.18Å; V140-L226 HydrophobicContact CG2-CG 4.47Å
141	L	96.7	Very high	96.5	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-63.6	-32.7	-177.2	-68.9	177.3	0	0	0	112.2	Q137 D143 I144 S145 V148 L225 C306 I310	Q137-L141 HydrophobicContact CG-CD1 3.61Å; Q137-L141 HydrophobicContact CG-CG 4.16Å; Q137-L141 WeakPolarHBondContact O-CB 3.34Å; Q137-L141 VanDerWaalsContact O-CG 3.31Å; Q137-L141 WeakPolarHBondContact O-CG 3.43Å; Q137-L141 PolarHBondContact O-N 3.42Å; L141-D143 PolarHBondContact O-N 3.01Å; L141-I144 HydrophobicContact CD2-CD1 4.36Å; L141-I144 PolarHBondContact O-N 3.31Å; L141-S145 WeakPolarHBondContact O-CA 3.21Å; L141-S145 WeakPolarHBondContact O-CB 3.22Å; L141-S145 PolarHBondContact O-N 3.13Å; L141-V148 HydrophobicContact CB-CB 4.34Å; L141-V148 HydrophobicContact CB-CG1 4.17Å; L141-V148 HydrophobicContact CB-CG2 4.05Å; L141-L225 HydrophobicContact CD2-CD1 4.18Å; L141-C306 HydrophobicContact CD1-CB 4.32Å; L141-I310 HydrophobicContact CB-CD1 4.47Å; L141-I310 HydrophobicContact CD1-CD1 4Å; L141-I310 HydrophobicContact CD1-CG1 3.91Å
142	R	95.3	Very high	96.4	Very high	23 Å²	23	29.3 Å²	29.3	9%	0.087	13%	0.129	C	C	.	.	H	α-helix	trans	-62.7	-31.7	173.7	-173.7	-156.8	69.5	-156.5	2.2	112.3	A138 V140 V148 R149 F152 M155	A138-R142 WeakPolarHBondContact O-CB 2.96Å; A138-R142 PolarHBondContact O-N 3.49Å; V140-R142 VanDerWaalsContact C-N 3.27Å; V140-R142 PolarHBondContact O-N 2.84Å; R142-V148 HydrophobicContact CB-CG1 3.98Å; R142-R149 WeakPolarHBondContact O-CB 3.34Å; R142-R149 WeakPolarHBondContact O-CD 3.29Å; R142-F152 WeakPolarHBondContact CD-O 3.4Å; R142-F152 HydrophobicContact CG-CB 4.29Å; R142-F152 WeakPolarHBondContact CG-O 3.23Å; R142-M155 PolarHBondContact NH1-SD 3.48Å
143	D	93.8	Very high	96.3	Very high	77 Å²	77	31 Å²	31	41%	0.412	14%	0.144	S	C	.	.	H	α-helix	trans	-84.2	-21.4	-177.8	-66.4	-11.5	0	0	0	112.4	L139 V140 L141	L139-D143 PolarHBondContact O-N 3.46Å; V140-D143 PolarHBondContact O-N 3.37Å; L141-D143 PolarHBondContact O-N 3.01Å
144	I	95.1	Very high	96.1	Very high	13 Å²	13	34.1 Å²	34.1	7%	0.067	16%	0.162	C	C	.	.	H	α-helix	trans	-118.1	-8	-176.3	67.5	177.7	0	0	0	115.3	V140 L141 L225 L226 D229 L297	V140-I144 HydrophobicContact CG1-CD1 4.02Å; V140-I144 WeakPolarHBondContact O-CG1 3.19Å; V140-I144 PolarHBondContact O-N 3.41Å; L141-I144 HydrophobicContact CD2-CD1 4.36Å; L141-I144 PolarHBondContact O-N 3.31Å; I144-L225 HydrophobicContact CD1-CB 3.64Å; I144-L225 HydrophobicContact CD1-CD1 4.41Å; I144-L226 HydrophobicContact CG2-CD2 3.84Å; I144-D229 HydrophobicContact CB-CB 4.07Å; I144-D229 HydrophobicContact CG2-CB 3.62Å; I144-L297 HydrophobicContact CB-CD1 4.32Å; I144-L297 HydrophobicContact CD1-CD1 3.58Å; I144-L297 HydrophobicContact CG1-CD1 3.8Å
145	S	96.1	Very high	95.8	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.021	17%	0.167	C	C	.	.			trans	-124	125.5	178.9	178.9	0	0	0	0	111.7	L141 Q147 V148 R149 L297	L141-S145 WeakPolarHBondContact O-CA 3.21Å; L141-S145 WeakPolarHBondContact O-CB 3.22Å; L141-S145 PolarHBondContact O-N 3.13Å; S145-Q147 VanDerWaalsContact C-N 3.31Å; S145-Q147 PolarHBondContact O-N 2.81Å; S145-V148 PolarHBondContact O-N 3.26Å; S145-R149 WeakPolarHBondContact O-CB 3.23Å; S145-R149 PolarHBondContact O-N 3Å; S145-L297 WeakPolarHBondContact CA-O 3.35Å; S145-L297 WeakPolarHBondContact CB-O 3.43Å; S145-L297 PolarHBondContact OG-O 3.31Å
146	M	93.4	Very high	95.7	Very high	106 Å²	106	39.6 Å²	39.6	52%	0.522	19%	0.191	S	C	.	.	H	α-helix	trans	-64	-36.2	178.1	-74.4	-57.6	-58.9	0	0	112.6	V148 R149 K150 E299	M146-V148 VanDerWaalsContact C-N 3.33Å; M146-V148 PolarHBondContact O-N 3.5Å; M146-R149 PolarHBondContact O-N 3.17Å; M146-K150 WeakPolarHBondContact O-CG 3.44Å; M146-K150 PolarHBondContact O-N 3.06Å; M146-E299 HydrophobicContact CB-CG 4.06Å
147	Q	94.6	Very high	95.6	Very high	35 Å²	35	42 Å²	42	16%	0.164	21%	0.206	C	C	.	.	H	α-helix	trans	-61.6	-42.5	177.6	-59.7	-178.5	44	0	0	111.9	S145 R151 G298 E299 L304 N307	S145-Q147 VanDerWaalsContact C-N 3.31Å; S145-Q147 PolarHBondContact O-N 2.81Å; Q147-R151 PolarHBondContact O-N 2.93Å; Q147-G298 VanDerWaalsContact CG-O 3.28Å; Q147-G298 WeakPolarHBondContact CG-O 3.48Å; Q147-G298 PolarHBondContact NE2-O 3.38Å; Q147-E299 HydrophobicContact CG-CG 3.93Å; Q147-L304 PolarHBondContact NE2-O 2.88Å; Q147-N307 PolarHBondContact O-ND2 3.38Å
148	V	96.6	Very high	95.4	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-76.7	-36.5	179.7	-176	0	0	0	0	110.4	L141 R142 S145 M146 K150 R151 F152 C306 I310	L141-V148 HydrophobicContact CB-CB 4.34Å; L141-V148 HydrophobicContact CB-CG1 4.17Å; L141-V148 HydrophobicContact CB-CG2 4.05Å; R142-V148 HydrophobicContact CB-CG1 3.98Å; S145-V148 PolarHBondContact O-N 3.26Å; M146-V148 VanDerWaalsContact C-N 3.33Å; M146-V148 PolarHBondContact O-N 3.5Å; V148-K150 VanDerWaalsContact C-N 3.32Å; V148-K150 PolarHBondContact O-N 2.87Å; V148-R151 PolarHBondContact O-N 2.89Å; V148-R151 VanDerWaalsContact O-N 3.14Å; V148-F152 HydrophobicContact CG1-CD2 3.78Å; V148-F152 HydrophobicContact CG1-CE2 4.22Å; V148-F152 PolarHBondContact O-N 3.28Å; V148-C306 HydrophobicContact CG2-CB 3.46Å; V148-C306 VanDerWaalsContact CG2-CB 3.46Å; V148-I310 HydrophobicContact CG1-CD1 3.78Å; V148-I310 HydrophobicContact CG2-CD1 4.11Å
149	R	96.2	Very high	95.2	Very high	106 Å²	106	42.4 Å²	42.4	40%	0.4	21%	0.209	S	C	.	.	H	α-helix	trans	-60.9	-38.6	173.9	-173.1	61.7	179.4	-167.3	5.2	112.7	R142 S145 M146 F152 P153	R142-R149 WeakPolarHBondContact O-CB 3.34Å; R142-R149 WeakPolarHBondContact O-CD 3.29Å; S145-R149 WeakPolarHBondContact O-CB 3.23Å; S145-R149 PolarHBondContact O-N 3Å; M146-R149 PolarHBondContact O-N 3.17Å; R149-F152 CarbonylContact O-C 3.39Å; R149-F152 VanDerWaalsContact O-C 3.28Å; R149-P153 VanDerWaalsContact O-CA 3.31Å; R149-P153 WeakPolarHBondContact O-CA 3.17Å
150	K	96.4	Very high	95.1	Very high	125 Å²	125	46.4 Å²	46.4	54%	0.543	24%	0.243	S	C	.	.	H	α-helix	trans	-67.9	-34.8	174.2	-75.4	177.4	-178.5	172.5	0	112.4	M146 V148 P153 E299	M146-K150 WeakPolarHBondContact O-CG 3.44Å; M146-K150 PolarHBondContact O-N 3.06Å; V148-K150 VanDerWaalsContact C-N 3.32Å; V148-K150 PolarHBondContact O-N 2.87Å; K150-P153 WeakPolarHBondContact O-CG 3.44Å; K150-E299 VanDerWaalsContact CD-OE1 3.3Å; K150-E299 WeakPolarHBondContact CD-OE1 3.31Å; K150-E299 WeakPolarHBondContact CE-OE1 3.27Å; K150-E299 IonicContact NZ-OE1 2.76Å; K150-E299 PolarHBondContact NZ-OE1 3.18Å; K150-E299 IonicContact NZ-OE2 3.69Å; K150-E299 PolarHBondContact NZ-OE2 3.47Å
151	R	96.9	Very high	95	Very high	90 Å²	90	48.8 Å²	48.8	34%	0.34	26%	0.26	S	S	.	.	H	α-helix	trans	-71.8	-41	176.3	-176.3	-179.3	176	-175.4	-0.1	112.5	Q147 V148 P153 N307 D311	Q147-R151 PolarHBondContact O-N 2.93Å; V148-R151 PolarHBondContact O-N 2.89Å; V148-R151 VanDerWaalsContact O-N 3.14Å; R151-P153 VanDerWaalsContact C-CD 3.48Å; R151-P153 WeakPolarHBondContact O-CD 3.44Å; R151-N307 WeakPolarHBondContact CD-OD1 3.47Å; R151-N307 PolarHBondContact NH1-O 3.23Å; R151-D311 IonicContact CZ-OD1 3.47Å; R151-D311 IonicContact CZ-OD2 3.43Å; R151-D311 IonicContact NH1-OD1 2.7Å; R151-D311 PolarHBondContact NH1-OD1 3.04Å; R151-D311 IonicContact NH1-OD2 3.91Å; R151-D311 PolarHBondContact NH1-OD2 3.43Å; R151-D311 IonicContact NH2-OD1 2.74Å; R151-D311 PolarHBondContact NH2-OD1 3.34Å; R151-D311 IonicContact NH2-OD2 2.66Å
152	F	96.8	Very high	94.9	Very high	5 Å²	5	50.9 Å²	50.9	2%	0.022	28%	0.282	C	S	.	.			trans	-123.2	73.5	179.6	-51.7	-60	0	0	0	111.4	R142 V148 R149 T154 T157 L158 L163 I310	R142-F152 WeakPolarHBondContact CD-O 3.4Å; R142-F152 HydrophobicContact CG-CB 4.29Å; R142-F152 WeakPolarHBondContact CG-O 3.23Å; V148-F152 HydrophobicContact CG1-CD2 3.78Å; V148-F152 HydrophobicContact CG1-CE2 4.22Å; V148-F152 PolarHBondContact O-N 3.28Å; R149-F152 CarbonylContact O-C 3.39Å; R149-F152 VanDerWaalsContact O-C 3.28Å; F152-T154 VanDerWaalsContact C-N 3.3Å; F152-T154 PolarHBondContact O-N 2.83Å; F152-T157 WeakPolarHBondContact CA-OG1 3.48Å; F152-L158 HydrophobicContact CB-CD1 4.47Å; F152-L163 HydrophobicContact CE1-CD1 4.42Å; F152-L163 HydrophobicContact CE2-CD1 4.2Å; F152-L163 HydrophobicContact CZ-CD1 3.86Å; F152-I310 HydrophobicContact CE2-CD1 4.3Å
153	P	95.8	Very high	94.9	Very high	61 Å²	61	50 Å²	50	40%	0.396	28%	0.279	S	S	.	.			trans	-64.9	-31.9	-178	-23.3	34.8	0	0	0	114.1	R149 K150 R151 T157	R149-P153 VanDerWaalsContact O-CA 3.31Å; R149-P153 WeakPolarHBondContact O-CA 3.17Å; K150-P153 WeakPolarHBondContact O-CG 3.44Å; R151-P153 VanDerWaalsContact C-CD 3.48Å; R151-P153 WeakPolarHBondContact O-CD 3.44Å; P153-T157 WeakPolarHBondContact CD-OG1 3.13Å
154	T	94.1	Very high	94.9	Very high	64 Å²	64	46.5 Å²	46.5	39%	0.393	26%	0.26	S	S	.	.	S	Bend	trans	-128.8	163.8	-176.9	71	0	0	0	0	111.9	F152 D156 T157 L158	F152-T154 VanDerWaalsContact C-N 3.3Å; F152-T154 PolarHBondContact O-N 2.83Å; T154-D156 VanDerWaalsContact C-N 3.25Å; T154-D156 PolarHBondContact O-N 3.44Å; T154-D156 PolarHBondContact OG1-N 2.84Å; T154-T157 PolarHBondContact N-OG1 3.39Å; T154-T157 VanDerWaalsContact N-OG1 3.1Å; T154-T157 PolarHBondContact O-N 3.36Å; T154-T157 PolarHBondContact O-OG1 3.12Å; T154-T157 PolarHBondContact OG1-N 3.42Å; T154-L158 PolarHBondContact O-N 2.74Å
155	M	92.1	Very high	94.9	Very high	21 Å²	21	48.7 Å²	48.7	10%	0.103	27%	0.274	C	S	.	.	H	α-helix	trans	-59.5	-38.6	171.6	-66.2	-56.4	-55.6	0	0	111.5	L139 R142 T157 L158 A159 M164 M169 L172	L139-M155 HydrophobicContact CD2-CE 3.96Å; L139-M155 HydrophobicContact CD2-SD 4.11Å; R142-M155 PolarHBondContact NH1-SD 3.48Å; M155-T157 VanDerWaalsContact C-N 3.34Å; M155-T157 PolarHBondContact O-N 3.19Å; M155-L158 WeakPolarHBondContact O-CA 3.34Å; M155-L158 WeakPolarHBondContact O-CB 3.48Å; M155-L158 PolarHBondContact O-N 3.47Å; M155-A159 PolarHBondContact O-N 3.34Å; M155-M164 HydrophobicContact CE-CE 3.6Å; M155-M164 HydrophobicContact CE-SD 4.28Å; M155-M169 HydrophobicContact CB-CG 4.26Å; M155-M169 HydrophobicContact CB-SD 3.98Å; M155-L172 HydrophobicContact CE-CD2 3.48Å; M155-L172 VanDerWaalsContact CE-CD2 3.48Å; M155-L172 HydrophobicContact SD-CD2 4.43Å
156	D	94.1	Very high	94.8	Very high	95 Å²	95	54.6 Å²	54.6	51%	0.508	30%	0.301	S	S	.	.	H	α-helix	trans	-60.6	-41.2	176.8	-54.5	-84.4	0	0	0	112.4	T154 L158 A159 A160	T154-D156 VanDerWaalsContact C-N 3.25Å; T154-D156 PolarHBondContact O-N 3.44Å; T154-D156 PolarHBondContact OG1-N 2.84Å; D156-L158 PolarHBondContact O-N 2.86Å; D156-A159 PolarHBondContact O-N 3.47Å; D156-A160 VanDerWaalsContact O-CB 3.28Å; D156-A160 WeakPolarHBondContact O-CB 3.47Å; D156-A160 PolarHBondContact O-N 3.14Å
157	T	95.5	Very high	94.8	Very high	51 Å²	51	56.5 Å²	56.5	31%	0.313	31%	0.309	S	S	.	.	H	α-helix	trans	-64.7	-31.4	176.7	56.2	0	0	0	0	112.2	F152 P153 T154 M155 S161	F152-T157 WeakPolarHBondContact CA-OG1 3.48Å; P153-T157 WeakPolarHBondContact CD-OG1 3.13Å; T154-T157 PolarHBondContact N-OG1 3.39Å; T154-T157 VanDerWaalsContact N-OG1 3.1Å; T154-T157 PolarHBondContact O-N 3.36Å; T154-T157 PolarHBondContact O-OG1 3.12Å; T154-T157 PolarHBondContact OG1-N 3.42Å; M155-T157 VanDerWaalsContact C-N 3.34Å; M155-T157 PolarHBondContact O-N 3.19Å; T157-S161 WeakPolarHBondContact O-CB 3.39Å; T157-S161 PolarHBondContact O-N 3.39Å; T157-S161 VanDerWaalsContact O-N 3.16Å
158	L	93.8	Very high	94.9	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-71.9	-41.9	175.1	-159.7	148.3	0	0	0	110.7	L135 A138 L139 F152 T154 M155 D156 S161 L163 M164	L135-L158 HydrophobicContact CD1-CD2 3.31Å; A138-L158 HydrophobicContact CB-CD1 4.27Å; L139-L158 HydrophobicContact CD2-CD1 4.02Å; F152-L158 HydrophobicContact CB-CD1 4.47Å; T154-L158 PolarHBondContact O-N 2.74Å; M155-L158 WeakPolarHBondContact O-CA 3.34Å; M155-L158 WeakPolarHBondContact O-CB 3.48Å; M155-L158 PolarHBondContact O-N 3.47Å; D156-L158 PolarHBondContact O-N 2.86Å; L158-S161 PolarHBondContact O-N 3.43Å; L158-S161 PolarHBondContact O-OG 3.17Å; L158-L163 HydrophobicContact CD2-CB 3.76Å; L158-L163 HydrophobicContact CD2-CD1 4.4Å; L158-L163 HydrophobicContact CG-CB 4.4Å; L158-L163 HydrophobicContact CG-CD1 4.26Å; L158-M164 HydrophobicContact CD2-CB 4.01Å; L158-M164 HydrophobicContact CD2-CE 4.05Å
159	A	94.1	Very high	94.8	Very high	8 Å²	8	56.1 Å²	56.1	7%	0.066	31%	0.307	C	S	.	.	H	α-helix	trans	-64	-47.5	173.7	0	0	0	0	0	112.2	M155 D156 S161 G162 M164 M169	M155-A159 PolarHBondContact O-N 3.34Å; D156-A159 PolarHBondContact O-N 3.47Å; A159-S161 PolarHBondContact O-N 3.01Å; A159-S161 VanDerWaalsContact O-N 3.16Å; A159-G162 PolarHBondContact O-N 3.15Å; A159-M164 WeakPolarHBondContact CA-O 3.3Å; A159-M169 HydrophobicContact CB-SD 3.95Å
160	A	93.5	Very high	94.6	Very high	90 Å²	90	55.1 Å²	55.1	74%	0.744	31%	0.31	S	S	*	.	H	α-helix	trans	-60.5	-26.7	178.2	0	0	0	0	0	113.2	D156 G162	D156-A160 VanDerWaalsContact O-CB 3.28Å; D156-A160 WeakPolarHBondContact O-CB 3.47Å; D156-A160 PolarHBondContact O-N 3.14Å; A160-G162 PolarHBondContact O-N 3.2Å
161	S	93.9	Very high	94.5	Very high	50 Å²	50	52.8 Å²	52.8	35%	0.35	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-5.7	173.6	76.3	0	0	0	0	114.9	T157 L158 A159	T157-S161 WeakPolarHBondContact O-CB 3.39Å; T157-S161 PolarHBondContact O-N 3.39Å; T157-S161 VanDerWaalsContact O-N 3.16Å; L158-S161 PolarHBondContact O-N 3.43Å; L158-S161 PolarHBondContact O-OG 3.17Å; A159-S161 PolarHBondContact O-N 3.01Å; A159-S161 VanDerWaalsContact O-N 3.16Å
162	G	94.4	Very high	94.3	Very high	46 Å²	46	48.5 Å²	48.5	47%	0.474	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	5.9	179.2	0	0	0	0	0	115.1	A159 A160 M164	A159-G162 PolarHBondContact O-N 3.15Å; A160-G162 PolarHBondContact O-N 3.2Å; G162-M164 VanDerWaalsContact C-N 3.34Å
163	L	95.1	Very high	94	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.016	31%	0.306	C	S	.	.	S	Bend	trans	-74	-27.3	174.2	-70.6	175.9	0	0	0	112.5	R131 V134 A138 F152 L158 I310 L314	R131-L163 VanDerWaalsContact CG-O 3.29Å; R131-L163 WeakPolarHBondContact CG-O 3.27Å; R131-L163 PolarHBondContact NH1-O 3.11Å; V134-L163 HydrophobicContact CG1-CD2 3.8Å; A138-L163 HydrophobicContact CB-CD1 3.76Å; F152-L163 HydrophobicContact CE1-CD1 4.42Å; F152-L163 HydrophobicContact CE2-CD1 4.2Å; F152-L163 HydrophobicContact CZ-CD1 3.86Å; L158-L163 HydrophobicContact CD2-CB 3.76Å; L158-L163 HydrophobicContact CD2-CD1 4.4Å; L158-L163 HydrophobicContact CG-CB 4.4Å; L158-L163 HydrophobicContact CG-CD1 4.26Å; L163-I310 HydrophobicContact CD1-CG2 4.34Å; L163-L314 HydrophobicContact CD2-CD1 4.12Å; L163-L314 HydrophobicContact CD2-CD2 3.88Å
164	M	94.7	Very high	93.8	Very high	5 Å²	5	56.4 Å²	56.4	3%	0.025	32%	0.32	C	S	.	.	S	Bend	trans	-139	145.8	-179.2	-167.6	-172.6	-61	0	0	109.8	L135 M155 L158 A159 G162 E168 M169 L172	L135-M164 HydrophobicContact CD1-CB 4.2Å; L135-M164 HydrophobicContact CD1-CE 3.39Å; L135-M164 HydrophobicContact CD2-CB 4.29Å; L135-M164 HydrophobicContact CD2-CE 3.83Å; L135-M164 HydrophobicContact CD2-CG 4.16Å; L135-M164 HydrophobicContact CG-CE 4.14Å; M155-M164 HydrophobicContact CE-CE 3.6Å; M155-M164 HydrophobicContact CE-SD 4.28Å; L158-M164 HydrophobicContact CD2-CB 4.01Å; L158-M164 HydrophobicContact CD2-CE 4.05Å; A159-M164 WeakPolarHBondContact CA-O 3.3Å; G162-M164 VanDerWaalsContact C-N 3.34Å; M164-E168 WeakPolarHBondContact CA-OE2 3.12Å; M164-E168 HydrophobicContact CG-CB 3.5Å; M164-E168 VanDerWaalsContact CG-CB 3.5Å; M164-E168 WeakPolarHBondContact CG-OE2 3.46Å; M164-E168 HydrophobicContact SD-CB 4.22Å; M164-M169 HydrophobicContact CG-CB 4.49Å; M164-M169 WeakPolarHBondContact SD-CA 3.19Å; M164-M169 HydrophobicContact SD-CB 3.56Å; M164-M169 VanDerWaalsContact SD-CB 3.56Å; M164-M169 HydrophobicContact SD-CG 4.14Å; M164-M169 PolarHBondContact SD-N 3.46Å; M164-L172 HydrophobicContact CE-CD1 4.3Å
165	T	95.6	Very high	93.7	Very high	58 Å²	58	55.5 Å²	55.5	36%	0.356	31%	0.312	S	S	.	.			trans	-83.7	164.3	170.1	69.3	0	0	0	0	111	E167 E168 M169	T165-E167 VanDerWaalsContact C-N 3.32Å; T165-E167 PolarHBondContact O-N 2.97Å; T165-E168 PolarHBondContact N-OE2 3.47Å; T165-E168 PolarHBondContact O-N 3.44Å; T165-E168 WeakPolarHBondContact OG1-CB 3.4Å; T165-E168 VanDerWaalsContact OG1-CG 3.24Å; T165-E168 WeakPolarHBondContact OG1-CG 3.5Å; T165-E168 PolarHBondContact OG1-N 3.3Å; T165-E168 PolarHBondContact OG1-OE1 2.82Å; T165-E168 PolarHBondContact OG1-OE2 2.9Å; T165-M169 PolarHBondContact O-N 3.16Å
166	H	93.1	Very high	93.5	Very high	128 Å²	128	64.5 Å²	64.5	59%	0.593	35%	0.351	S	S	*	.	H	α-helix	trans	-61.6	-40.4	174.9	-76.5	-71.1	0	0	0	112.4	E168 M169 D170	H166-E168 PolarHBondContact O-N 3.3Å; H166-M169 WeakPolarHBondContact O-CB 3.25Å; H166-M169 PolarHBondContact O-N 2.92Å; H166-D170 PolarHBondContact O-N 3.13Å
167	E	94.3	Very high	93.1	Very high	145 Å²	145	62 Å²	62	68%	0.678	34%	0.338	S	S	*	.	H	α-helix	trans	-61.7	-43.7	176.9	-176.4	-178.1	179.1	0	0	111.8	T165 M169 D170 I171	T165-E167 VanDerWaalsContact C-N 3.32Å; T165-E167 PolarHBondContact O-N 2.97Å; E167-M169 VanDerWaalsContact C-N 3.3Å; E167-M169 PolarHBondContact O-N 2.75Å; E167-D170 PolarHBondContact O-N 2.76Å; E167-I171 HydrophobicContact CG-CD1 4.26Å; E167-I171 VanDerWaalsContact O-CG1 3.28Å; E167-I171 WeakPolarHBondContact O-CG1 3.49Å; E167-I171 PolarHBondContact O-N 3.35Å
168	E	96.1	Very high	92.5	Very high	16 Å²	16	65.1 Å²	65.1	8%	0.075	36%	0.359	C	S	.	.	H	α-helix	trans	-64.7	-36	176	-73.3	157.6	-163.7	0	0	112.4	R131 Y132 M164 T165 H166 I171 L172 W188	R131-E168 IonicContact CZ-OE1 2.72Å; R131-E168 IonicContact CZ-OE2 3.35Å; R131-E168 IonicContact NH1-OE1 2.62Å; R131-E168 PolarHBondContact NH1-OE1 3.4Å; R131-E168 IonicContact NH1-OE2 2.75Å; R131-E168 PolarHBondContact NH1-OE2 3.18Å; R131-E168 IonicContact NH2-OE1 2.68Å; R131-E168 PolarHBondContact NH2-OE1 3.31Å; R131-E168 IonicContact NH2-OE2 2.76Å; R131-E168 PolarHBondContact NH2-OE2 3.37Å; Y132-E168 PolarHBondContact OH-OE1 3.46Å; M164-E168 WeakPolarHBondContact CA-OE2 3.12Å; M164-E168 HydrophobicContact CG-CB 3.5Å; M164-E168 VanDerWaalsContact CG-CB 3.5Å; M164-E168 WeakPolarHBondContact CG-OE2 3.46Å; M164-E168 HydrophobicContact SD-CB 4.22Å; T165-E168 PolarHBondContact N-OE2 3.47Å; T165-E168 PolarHBondContact O-N 3.44Å; T165-E168 WeakPolarHBondContact OG1-CB 3.4Å; T165-E168 VanDerWaalsContact OG1-CG 3.24Å; T165-E168 WeakPolarHBondContact OG1-CG 3.5Å; T165-E168 PolarHBondContact OG1-N 3.3Å; T165-E168 PolarHBondContact OG1-OE1 2.82Å; T165-E168 PolarHBondContact OG1-OE2 2.9Å; H166-E168 PolarHBondContact O-N 3.3Å; E168-I171 PolarHBondContact O-N 3.37Å; E168-L172 VanDerWaalsContact O-CB 3.31Å; E168-L172 WeakPolarHBondContact O-CB 3.46Å; E168-L172 PolarHBondContact O-N 3.14Å; E168-W188 HydrophobicContact CB-CH2 3.85Å; E168-W188 HydrophobicContact CB-CZ3 3.91Å; E168-W188 HydrophobicContact CG-CH2 4.2Å; E168-W188 HydrophobicContact CG-CZ3 3.96Å; E168-W188 WeakPolarHBondContact O-CH2 3.34Å
169	M	94.1	Very high	92	Very high	11 Å²	11	75.3 Å²	75.3	5%	0.054	40%	0.399	C	S	.	.	H	α-helix	trans	-63.7	-46.6	175	-171.3	177.8	73.9	0	0	110.8	M155 A159 M164 T165 H166 E167 I171 L172 D173	M155-M169 HydrophobicContact CB-CG 4.26Å; M155-M169 HydrophobicContact CB-SD 3.98Å; A159-M169 HydrophobicContact CB-SD 3.95Å; M164-M169 HydrophobicContact CG-CB 4.49Å; M164-M169 WeakPolarHBondContact SD-CA 3.19Å; M164-M169 HydrophobicContact SD-CB 3.56Å; M164-M169 VanDerWaalsContact SD-CB 3.56Å; M164-M169 HydrophobicContact SD-CG 4.14Å; M164-M169 PolarHBondContact SD-N 3.46Å; T165-M169 PolarHBondContact O-N 3.16Å; H166-M169 WeakPolarHBondContact O-CB 3.25Å; H166-M169 PolarHBondContact O-N 2.92Å; E167-M169 VanDerWaalsContact C-N 3.3Å; E167-M169 PolarHBondContact O-N 2.75Å; M169-I171 VanDerWaalsContact C-N 3.35Å; M169-I171 PolarHBondContact O-N 3.43Å; M169-L172 CarbonylContact O-C 3.12Å; M169-L172 PolarHBondContact O-N 3.33Å; M169-L172 VanDerWaalsContact O-N 3.13Å; M169-D173 PolarHBondContact O-N 3.35Å
170	D	93.2	Very high	91.5	Very high	86 Å²	86	76.2 Å²	76.2	46%	0.46	41%	0.405	S	S	.	.	H	α-helix	trans	-58.7	-47.5	175.6	-68.6	-21.8	0	0	0	110.3	H166 E167 L172 D173 H174	H166-D170 PolarHBondContact O-N 3.13Å; E167-D170 PolarHBondContact O-N 2.76Å; D170-L172 VanDerWaalsContact C-N 3.29Å; D170-L172 PolarHBondContact O-N 2.62Å; D170-D173 PolarHBondContact O-N 3.11Å; D170-H174 PolarHBondContact O-N 3.25Å; D170-H174 PolarHBondContact O-ND1 3.36Å
171	I	93.9	Very high	91.4	Very high	75 Å²	75	75.3 Å²	75.3	39%	0.385	38%	0.382	S	S	.	.	H	α-helix	trans	-57.6	-44.2	176.4	-65	164.8	0	0	0	110.6	E167 E168 M169 D173 H174 I175 W188	E167-I171 HydrophobicContact CG-CD1 4.26Å; E167-I171 VanDerWaalsContact O-CG1 3.28Å; E167-I171 WeakPolarHBondContact O-CG1 3.49Å; E167-I171 PolarHBondContact O-N 3.35Å; E168-I171 PolarHBondContact O-N 3.37Å; M169-I171 VanDerWaalsContact C-N 3.35Å; M169-I171 PolarHBondContact O-N 3.43Å; I171-D173 VanDerWaalsContact C-N 3.33Å; I171-D173 PolarHBondContact O-N 2.61Å; I171-H174 PolarHBondContact O-N 2.94Å; I171-I175 WeakPolarHBondContact O-CG1 3.28Å; I171-I175 PolarHBondContact O-N 2.92Å; I171-W188 HydrophobicContact CB-CZ2 4.17Å; I171-W188 HydrophobicContact CG2-CZ2 3.74Å
172	L	92.1	Very high	91.3	Very high	1 Å²	1	74.1 Å²	74.1	1%	0.005	37%	0.37	C	S	.	.	H	α-helix	trans	-68.2	-30.2	-179.2	-165.2	124.2	0	0	0	112.8	L139 M155 M164 E168 M169 D170 R181 T184 W188	L139-L172 HydrophobicContact CD1-CD1 4.25Å; M155-L172 HydrophobicContact CE-CD2 3.48Å; M155-L172 VanDerWaalsContact CE-CD2 3.48Å; M155-L172 HydrophobicContact SD-CD2 4.43Å; M164-L172 HydrophobicContact CE-CD1 4.3Å; E168-L172 VanDerWaalsContact O-CB 3.31Å; E168-L172 WeakPolarHBondContact O-CB 3.46Å; E168-L172 PolarHBondContact O-N 3.14Å; M169-L172 CarbonylContact O-C 3.12Å; M169-L172 PolarHBondContact O-N 3.33Å; M169-L172 VanDerWaalsContact O-N 3.13Å; D170-L172 VanDerWaalsContact C-N 3.29Å; D170-L172 PolarHBondContact O-N 2.62Å; L172-R181 HydrophobicContact CD1-CB 4.28Å; L172-R181 HydrophobicContact CD2-CB 4.05Å; L172-R181 HydrophobicContact CG-CB 4.08Å; L172-R181 VanDerWaalsContact O-CD 3.32Å; L172-R181 WeakPolarHBondContact O-CD 3.03Å; L172-R181 PolarHBondContact O-NH1 2.86Å; L172-R181 VanDerWaalsContact O-NH1 3.11Å; L172-T184 HydrophobicContact CD1-CG2 4.31Å; L172-W188 HydrophobicContact CB-CH2 4.45Å; L172-W188 HydrophobicContact CD1-CH2 4.31Å
173	D	90.4	Very high	91.3	Very high	81 Å²	81	76.9 Å²	76.9	43%	0.433	37%	0.366	S	S	.	.	H	α-helix	trans	-76.8	-26.3	175.2	-76	-21.3	0	0	0	113.2	M169 D170 I171 I175 R181	M169-D173 PolarHBondContact O-N 3.35Å; D170-D173 PolarHBondContact O-N 3.11Å; I171-D173 VanDerWaalsContact C-N 3.33Å; I171-D173 PolarHBondContact O-N 2.61Å; D173-I175 VanDerWaalsContact C-N 3.27Å; D173-I175 PolarHBondContact O-N 3.43Å; D173-R181 IonicContact OD1-CZ 3.58Å; D173-R181 IonicContact OD1-NH1 2.89Å; D173-R181 PolarHBondContact OD1-NH1 2.75Å; D173-R181 IonicContact OD1-NH2 3.59Å
174	H	92.3	Very high	91.3	Very high	151 Å²	151	76.9 Å²	76.9	70%	0.699	37%	0.366	S	S	*	.	H	α-helix	trans	-75.4	-14	173.3	-74.3	81.8	0	0	0	113.6	D170 I171 K176	D170-H174 PolarHBondContact O-N 3.25Å; D170-H174 PolarHBondContact O-ND1 3.36Å; I171-H174 PolarHBondContact O-N 2.94Å; H174-K176 PolarHBondContact O-N 3.4Å
175	I	91.9	Very high	91.4	Very high	44 Å²	44	76.6 Å²	76.6	23%	0.226	37%	0.365	C	S	.	.			trans	-73.1	115.1	178.6	-67.5	172.3	0	0	0	110.1	I171 D173 D177 W183 T184	I171-I175 WeakPolarHBondContact O-CG1 3.28Å; I171-I175 PolarHBondContact O-N 2.92Å; D173-I175 VanDerWaalsContact C-N 3.27Å; D173-I175 PolarHBondContact O-N 3.43Å; I175-D177 HydrophobicContact CG2-CB 3.92Å; I175-D177 PolarHBondContact O-N 3.12Å; I175-W183 HydrophobicContact CG2-CZ2 4.11Å; I175-T184 HydrophobicContact CD1-CG2 3.24Å; I175-T184 VanDerWaalsContact CD1-OG1 3.26Å; I175-T184 WeakPolarHBondContact CD1-OG1 3.4Å
176	K	86.7	Confident	91.4	Very high	210 Å²	210	74.2 Å²	74.2	91%	0.913	35%	0.35	S	S	*	.			trans	-82.7	61.3	177.4	-60.1	-177.1	-177.7	179.8	0	111.5	H174	H174-K176 PolarHBondContact O-N 3.4Å
177	D	86.3	Confident	91.6	Very high	44 Å²	44	72 Å²	72	24%	0.235	34%	0.34	C	S	.	.			trans	-111.7	111.8	170.5	-172.2	-17.8	0	0	0	109.1	I175 Y179 S180 W183	I175-D177 HydrophobicContact CG2-CB 3.92Å; I175-D177 PolarHBondContact O-N 3.12Å; D177-Y179 PolarHBondContact O-N 2.81Å; D177-Y179 WeakPolarHBondContact OD1-CB 3.45Å; D177-Y179 WeakPolarHBondContact OD1-CD2 3.39Å; D177-Y179 PolarHBondContact OD1-N 2.94Å; D177-S180 VanDerWaalsContact CG-O 3.3Å; D177-S180 PolarHBondContact OD1-N 2.98Å; D177-W183 PolarHBondContact OD2-NE1 3.02Å
178	P	83.9	Confident	91.8	Very high	115 Å²	115	67 Å²	67	75%	0.747	32%	0.315	S	S	*	.	S	Bend	trans	-75.4	-10.8	-179.7	32.6	-35.5	0	0	0	113.2
179	Y	83.3	Confident	91.9	Very high	214 Å²	214	66.3 Å²	66.3	84%	0.839	31%	0.311	S	S	*	.	S	Bend	trans	-95.4	-62.1	-173.1	-57.6	-71.6	0	0	0	112.2	D177	D177-Y179 PolarHBondContact O-N 2.81Å; D177-Y179 WeakPolarHBondContact OD1-CB 3.45Å; D177-Y179 WeakPolarHBondContact OD1-CD2 3.39Å; D177-Y179 PolarHBondContact OD1-N 2.94Å
180	S	83.6	Confident	92.1	Very high	28 Å²	28	68.1 Å²	68.1	20%	0.196	32%	0.321	C	S	.	.			trans	-161.3	150.6	-179.1	-162.8	0	0	0	0	112.5	D177 Y182 W183	D177-S180 VanDerWaalsContact CG-O 3.3Å; D177-S180 PolarHBondContact OD1-N 2.98Å; S180-Y182 WeakPolarHBondContact OG-CD1 3.21Å; S180-W183 VanDerWaalsContact O-CD1 3.22Å; S180-W183 PolarHBondContact O-NE1 3.39Å
181	R	90.3	Very high	92.3	Very high	70 Å²	70	67.8 Å²	67.8	26%	0.264	32%	0.319	S	S	.	.			trans	-116.7	3.7	-176.1	-62.6	179.3	-74.8	165.5	-1.2	113.5	L172 D173 W183 T184	L172-R181 HydrophobicContact CD1-CB 4.28Å; L172-R181 HydrophobicContact CD2-CB 4.05Å; L172-R181 HydrophobicContact CG-CB 4.08Å; L172-R181 VanDerWaalsContact O-CD 3.32Å; L172-R181 WeakPolarHBondContact O-CD 3.03Å; L172-R181 PolarHBondContact O-NH1 2.86Å; L172-R181 VanDerWaalsContact O-NH1 3.11Å; D173-R181 IonicContact OD1-CZ 3.58Å; D173-R181 IonicContact OD1-NH1 2.89Å; D173-R181 PolarHBondContact OD1-NH1 2.75Å; D173-R181 IonicContact OD1-NH2 3.59Å; R181-W183 PolarHBondContact O-N 2.72Å; R181-T184 WeakPolarHBondContact O-CB 3.24Å; R181-T184 PolarHBondContact O-N 2.68Å; R181-T184 PolarHBondContact O-OG1 3.3Å; R181-T184 VanDerWaalsContact O-OG1 3.12Å
182	Y	92.5	Very high	92.4	Very high	26 Å²	26	65.5 Å²	65.5	10%	0.102	31%	0.308	C	S	.	.	H	α-helix	trans	-66.1	-25.3	-177.8	84.7	-79.8	0	0	0	113.5	S136 V140 S180 T184 R219 L222 L226	S136-Y182 WeakPolarHBondContact OG-CD2 3.49Å; S136-Y182 PolarHBondContact OG-O 3.21Å; V140-Y182 HydrophobicContact CG2-CD1 4.14Å; V140-Y182 HydrophobicContact CG2-CD2 3.41Å; V140-Y182 VanDerWaalsContact CG2-CD2 3.41Å; V140-Y182 HydrophobicContact CG2-CE2 4.07Å; V140-Y182 HydrophobicContact CG2-CG 3.45Å; V140-Y182 VanDerWaalsContact CG2-CG 3.45Å; S180-Y182 WeakPolarHBondContact OG-CD1 3.21Å; Y182-T184 PolarHBondContact O-N 3.32Å; Y182-R219 HydrophobicContact CE2-CG 4.34Å; Y182-L222 HydrophobicContact CE2-CB 4.42Å; Y182-L226 HydrophobicContact CD1-CD1 4.04Å; Y182-L226 HydrophobicContact CE1-CD1 3.52Å
183	W	94.1	Very high	92.7	Very high	103 Å²	103	65.4 Å²	65.4	39%	0.39	31%	0.307	S	S	.	.	H	α-helix	trans	-69	-21.7	179.6	64.6	-98.8	0	0	0	112.3	I175 D177 S180 R181 I186 Q187	I175-W183 HydrophobicContact CG2-CZ2 4.11Å; D177-W183 PolarHBondContact OD2-NE1 3.02Å; S180-W183 VanDerWaalsContact O-CD1 3.22Å; S180-W183 PolarHBondContact O-NE1 3.39Å; R181-W183 PolarHBondContact O-N 2.72Å; W183-I186 WeakPolarHBondContact O-CB 3.27Å; W183-I186 PolarHBondContact O-N 3.11Å; W183-Q187 HydrophobicContact CE3-CB 4.3Å; W183-Q187 HydrophobicContact CZ3-CB 4.33Å; W183-Q187 PolarHBondContact O-N 3.17Å
184	T	95	Very high	93	Very high	3 Å²	3	68.2 Å²	68.2	2%	0.018	31%	0.313	C	S	.	.	H	α-helix	trans	-62.4	-47.6	-175.8	-56.1	0	0	0	0	111.8	L172 I175 R181 Y182 I186 Q187 W188	L172-T184 HydrophobicContact CD1-CG2 4.31Å; I175-T184 HydrophobicContact CD1-CG2 3.24Å; I175-T184 VanDerWaalsContact CD1-OG1 3.26Å; I175-T184 WeakPolarHBondContact CD1-OG1 3.4Å; R181-T184 WeakPolarHBondContact O-CB 3.24Å; R181-T184 PolarHBondContact O-N 2.68Å; R181-T184 PolarHBondContact O-OG1 3.3Å; R181-T184 VanDerWaalsContact O-OG1 3.12Å; Y182-T184 PolarHBondContact O-N 3.32Å; T184-I186 PolarHBondContact O-N 2.79Å; T184-Q187 WeakPolarHBondContact O-CB 3.03Å; T184-Q187 PolarHBondContact O-N 2.86Å; T184-Q187 VanDerWaalsContact O-N 3.08Å; T184-W188 HydrophobicContact CG2-CD2 4.21Å; T184-W188 VanDerWaalsContact CG2-CE2 3.44Å; T184-W188 HydrophobicContact CG2-CH2 4.13Å; T184-W188 HydrophobicContact CG2-CZ2 3.39Å; T184-W188 PolarHBondContact O-N 2.96Å
185	S	95.7	Very high	93.1	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-66.8	-29.6	179	69.1	0	0	0	0	112.2	Y132 S136 W188 S189	Y132-S185 WeakPolarHBondContact O-CB 3.47Å; Y132-S185 PolarHBondContact O-OG 2.9Å; S136-S185 WeakPolarHBondContact CA-OG 3.48Å; S136-S185 VanDerWaalsContact CB-OG 3.27Å; S136-S185 WeakPolarHBondContact CB-OG 3.06Å; S136-S185 PolarHBondContact N-OG 3.26Å; S185-W188 PolarHBondContact O-N 3.48Å; S185-S189 PolarHBondContact O-N 3.3Å; S185-S189 PolarHBondContact O-OG 3.09Å
186	I	97.3	Very high	93.2	Very high	7 Å²	7	63 Å²	63	4%	0.036	29%	0.288	C	S	.	.	H	α-helix	trans	-65	-43.7	171.6	-57.7	-69.5	0	0	0	110.4	L133 S136 W183 T184 W188 S189 L190 I215 R219	L133-I186 HydrophobicContact CD2-CD1 3.6Å; S136-I186 WeakPolarHBondContact OG-CG1 3.42Å; W183-I186 WeakPolarHBondContact O-CB 3.27Å; W183-I186 PolarHBondContact O-N 3.11Å; T184-I186 PolarHBondContact O-N 2.79Å; I186-W188 VanDerWaalsContact C-N 3.34Å; I186-W188 PolarHBondContact O-N 3.32Å; I186-S189 WeakPolarHBondContact O-CB 3.46Å; I186-S189 PolarHBondContact O-N 3.12Å; I186-L190 WeakPolarHBondContact O-CG 2.96Å; I186-L190 PolarHBondContact O-N 2.7Å; I186-I215 HydrophobicContact CG2-CG2 3.8Å; I186-R219 HydrophobicContact CD1-CB 4.28Å; I186-R219 HydrophobicContact CG1-CB 4.42Å; I186-R219 HydrophobicContact CG1-CG 4.18Å; I186-R219 HydrophobicContact CG2-CB 4.31Å; I186-R219 HydrophobicContact CG2-CG 4.24Å
187	Q	97.1	Very high	93.6	Very high	82 Å²	82	54.4 Å²	54.4	38%	0.383	25%	0.251	S	S	.	.	H	α-helix	trans	-62.2	-41.1	175.4	-175.8	61.1	36.7	0	0	111.9	W183 T184 S189 L190 N191	W183-Q187 HydrophobicContact CE3-CB 4.3Å; W183-Q187 HydrophobicContact CZ3-CB 4.33Å; W183-Q187 PolarHBondContact O-N 3.17Å; T184-Q187 WeakPolarHBondContact O-CB 3.03Å; T184-Q187 PolarHBondContact O-N 2.86Å; T184-Q187 VanDerWaalsContact O-N 3.08Å; Q187-S189 VanDerWaalsContact C-N 3.3Å; Q187-S189 PolarHBondContact O-N 3.22Å; Q187-L190 PolarHBondContact O-N 2.81Å; Q187-N191 PolarHBondContact NE2-OD1 3.27Å; Q187-N191 VanDerWaalsContact O-CG 3.3Å; Q187-N191 PolarHBondContact O-N 3.06Å
188	W	97.8	Very high	94.1	Very high	41 Å²	41	60.2 Å²	60.2	16%	0.155	27%	0.274	C	S	.	.	H	α-helix	trans	-59.6	-42.2	174	-60.4	-22.8	0	0	0	111.5	Y132 L135 E168 I171 L172 T184 S185 I186 L190 N191 L192	Y132-W188 HydrophobicContact CD1-CE3 4.08Å; Y132-W188 HydrophobicContact CD2-CB 3.65Å; Y132-W188 AromaticContact CE1-CE3 3.84Å; Y132-W188 HydrophobicContact CE1-CE3 3.84Å; Y132-W188 HydrophobicContact CE1-CZ3 4.35Å; Y132-W188 HydrophobicContact CE2-CB 3.49Å; Y132-W188 VanDerWaalsContact CE2-CB 3.49Å; Y132-W188 HydrophobicContact CE2-CE3 4.29Å; Y132-W188 HydrophobicContact CE2-CG 4.41Å; Y132-W188 HydrophobicContact CG-CB 4.48Å; Y132-W188 HydrophobicContact CG-CE3 4.42Å; Y132-W188 AromaticContact CZ-CE3 3.95Å; L135-W188 HydrophobicContact CD2-CZ3 4.15Å; E168-W188 HydrophobicContact CB-CH2 3.85Å; E168-W188 HydrophobicContact CB-CZ3 3.91Å; E168-W188 HydrophobicContact CG-CH2 4.2Å; E168-W188 HydrophobicContact CG-CZ3 3.96Å; E168-W188 WeakPolarHBondContact O-CH2 3.34Å; I171-W188 HydrophobicContact CB-CZ2 4.17Å; I171-W188 HydrophobicContact CG2-CZ2 3.74Å; L172-W188 HydrophobicContact CB-CH2 4.45Å; L172-W188 HydrophobicContact CD1-CH2 4.31Å; T184-W188 HydrophobicContact CG2-CD2 4.21Å; T184-W188 VanDerWaalsContact CG2-CE2 3.44Å; T184-W188 HydrophobicContact CG2-CH2 4.13Å; T184-W188 HydrophobicContact CG2-CZ2 3.39Å; T184-W188 PolarHBondContact O-N 2.96Å; S185-W188 PolarHBondContact O-N 3.48Å; I186-W188 VanDerWaalsContact C-N 3.34Å; I186-W188 PolarHBondContact O-N 3.32Å; W188-L190 PolarHBondContact O-N 3.15Å; W188-N191 PolarHBondContact O-N 3Å; W188-L192 WeakPolarHBondContact O-CG 3.35Å; W188-L192 PolarHBondContact O-N 2.95Å
189	S	97.9	Very high	94.5	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60.4	-44.6	174.9	-62.7	0	0	0	0	112.5	L129 Y132 S185 I186 Q187 N191 L192 V193	L129-S189 WeakPolarHBondContact CD2-O 3.47Å; Y132-S189 WeakPolarHBondContact CB-OG 3Å; S185-S189 PolarHBondContact O-N 3.3Å; S185-S189 PolarHBondContact O-OG 3.09Å; I186-S189 WeakPolarHBondContact O-CB 3.46Å; I186-S189 PolarHBondContact O-N 3.12Å; Q187-S189 VanDerWaalsContact C-N 3.3Å; Q187-S189 PolarHBondContact O-N 3.22Å; S189-N191 VanDerWaalsContact C-N 3.34Å; S189-N191 PolarHBondContact O-N 3.05Å; S189-L192 PolarHBondContact O-N 3.05Å; S189-V193 WeakPolarHBondContact O-CG2 3.5Å; S189-V193 PolarHBondContact O-N 3.2Å
190	L	97.9	Very high	94.9	Very high	49 Å²	49	52 Å²	52	26%	0.257	25%	0.246	S	C	.	.	H	α-helix	trans	-63	-40.8	177.8	-65.1	176.8	0	0	0	112	I186 Q187 W188 V193 Y194 V212 I215	I186-L190 WeakPolarHBondContact O-CG 2.96Å; I186-L190 PolarHBondContact O-N 2.7Å; Q187-L190 PolarHBondContact O-N 2.81Å; W188-L190 PolarHBondContact O-N 3.15Å; L190-V193 PolarHBondContact O-N 3.13Å; L190-Y194 PolarHBondContact O-N 3.43Å; L190-V212 HydrophobicContact CD2-CB 4.29Å; L190-V212 HydrophobicContact CD2-CG1 3.87Å; L190-V212 HydrophobicContact CD2-CG2 3.99Å; L190-I215 HydrophobicContact CD2-CB 4.38Å; L190-I215 HydrophobicContact CD2-CD1 4.21Å; L190-I215 HydrophobicContact CD2-CG2 3.97Å; L190-I215 HydrophobicContact CG-CG2 4.41Å
191	N	97.9	Very high	95.1	Very high	79 Å²	79	51.7 Å²	51.7	42%	0.422	24%	0.241	S	C	.	.	H	α-helix	trans	-63	-44.3	176.1	-69.6	-10.3	0	0	0	111.5	Q187 W188 S189 V193 Y194 E195	Q187-N191 PolarHBondContact NE2-OD1 3.27Å; Q187-N191 VanDerWaalsContact O-CG 3.3Å; Q187-N191 PolarHBondContact O-N 3.06Å; W188-N191 PolarHBondContact O-N 3Å; S189-N191 VanDerWaalsContact C-N 3.34Å; S189-N191 PolarHBondContact O-N 3.05Å; N191-V193 VanDerWaalsContact C-N 3.34Å; N191-V193 PolarHBondContact O-N 3.07Å; N191-Y194 WeakPolarHBondContact O-CB 3.39Å; N191-Y194 PolarHBondContact O-N 3.17Å; N191-E195 WeakPolarHBondContact O-CG 3.48Å; N191-E195 PolarHBondContact O-N 2.95Å
192	L	97.2	Very high	95.2	Very high	27 Å²	27	48.5 Å²	48.5	14%	0.141	23%	0.229	C	C	.	.	H	α-helix	trans	-61.4	-40.9	176.4	-74.5	-178.7	0	0	0	112.4	I125 N128 L129 Y132 W188 S189 Y194 E195 C196	I125-L192 HydrophobicContact CG2-CB 4.24Å; I125-L192 HydrophobicContact CG2-CD1 4.45Å; N128-L192 HydrophobicContact CB-CD1 4.12Å; L129-L192 HydrophobicContact CD2-CB 3.98Å; L129-L192 HydrophobicContact CD2-CD1 4.31Å; L129-L192 HydrophobicContact CG-CB 4.48Å; L129-L192 HydrophobicContact CG-CD1 4.39Å; Y132-L192 HydrophobicContact CD2-CD1 4.05Å; Y132-L192 HydrophobicContact CE2-CD1 3.57Å; Y132-L192 HydrophobicContact CE2-CG 4.44Å; W188-L192 WeakPolarHBondContact O-CG 3.35Å; W188-L192 PolarHBondContact O-N 2.95Å; S189-L192 PolarHBondContact O-N 3.05Å; L192-Y194 VanDerWaalsContact C-N 3.33Å; L192-Y194 PolarHBondContact O-N 3.18Å; L192-E195 PolarHBondContact O-N 3.34Å; L192-C196 PolarHBondContact O-N 3.45Å; L192-C196 PolarHBondContact O-SG 3.35Å; L192-C196 VanDerWaalsContact O-SG 3.42Å
193	V	97.3	Very high	94.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.9	-41.6	175.9	171.1	0	0	0	0	111.1	L129 S189 L190 N191 C196 Q197 M208 I211 V212 I215	L129-V193 HydrophobicContact CD1-CG2 4.19Å; L129-V193 HydrophobicContact CD2-CG2 3.89Å; S189-V193 WeakPolarHBondContact O-CG2 3.5Å; S189-V193 PolarHBondContact O-N 3.2Å; L190-V193 PolarHBondContact O-N 3.13Å; N191-V193 VanDerWaalsContact C-N 3.34Å; N191-V193 PolarHBondContact O-N 3.07Å; V193-C196 WeakPolarHBondContact O-CB 3.44Å; V193-C196 PolarHBondContact O-N 2.82Å; V193-Q197 PolarHBondContact O-N 2.89Å; V193-Q197 VanDerWaalsContact O-N 3.08Å; V193-M208 HydrophobicContact CG1-CG 3.61Å; V193-I211 HydrophobicContact CG1-CB 4.37Å; V193-I211 HydrophobicContact CG1-CG2 4.18Å; V193-I211 HydrophobicContact CG2-CG2 3.68Å; V193-V212 HydrophobicContact CG1-CG2 4.19Å; V193-I215 HydrophobicContact CG2-CD1 4Å
194	Y	96.5	Very high	94.7	Very high	139 Å²	139	49.4 Å²	49.4	55%	0.545	25%	0.248	S	C	.	.	H	α-helix	trans	-64.3	-41.9	175.7	-174.8	-97.9	0	0	0	112.2	L190 N191 L192 C196 Q197 K198	L190-Y194 PolarHBondContact O-N 3.43Å; N191-Y194 WeakPolarHBondContact O-CB 3.39Å; N191-Y194 PolarHBondContact O-N 3.17Å; L192-Y194 VanDerWaalsContact C-N 3.33Å; L192-Y194 PolarHBondContact O-N 3.18Å; Y194-C196 PolarHBondContact O-N 3.02Å; Y194-Q197 PolarHBondContact O-N 3.22Å; Y194-K198 PolarHBondContact O-N 3.39Å
195	E	95.4	Very high	94.6	Very high	87 Å²	87	55.9 Å²	55.9	41%	0.407	27%	0.273	S	S	.	.	H	α-helix	trans	-62.4	-41.4	174.4	-74.4	-171.8	-172.7	0	0	112.6	N191 L192 Q197 K198 K199	N191-E195 WeakPolarHBondContact O-CG 3.48Å; N191-E195 PolarHBondContact O-N 2.95Å; L192-E195 PolarHBondContact O-N 3.34Å; E195-Q197 VanDerWaalsContact C-N 3.29Å; E195-Q197 PolarHBondContact O-N 3.22Å; E195-K198 PolarHBondContact O-N 2.86Å; E195-K199 WeakPolarHBondContact O-CB 3.22Å; E195-K199 VanDerWaalsContact O-CG 3.32Å; E195-K199 WeakPolarHBondContact O-CG 3.43Å; E195-K199 PolarHBondContact O-N 3.47Å; E195-K199 IonicContact OE2-NZ 3.65Å
196	C	94.3	Very high	94.6	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-58.6	-42.4	174	-78.8	0	0	0	0	111.7	I115 I125 L192 V193 Y194 K199 G200 K201 V202	I115-C196 HydrophobicContact CG2-CB 4.47Å; I125-C196 VanDerWaalsContact CG2-SG 3.58Å; L192-C196 PolarHBondContact O-N 3.45Å; L192-C196 PolarHBondContact O-SG 3.35Å; L192-C196 VanDerWaalsContact O-SG 3.42Å; V193-C196 WeakPolarHBondContact O-CB 3.44Å; V193-C196 PolarHBondContact O-N 2.82Å; Y194-C196 PolarHBondContact O-N 3.02Å; C196-K199 PolarHBondContact O-N 3.46Å; C196-G200 PolarHBondContact O-N 2.94Å; C196-K201 HydrophobicContact CB-CB 4.06Å; C196-K201 WeakPolarHBondContact O-CA 3.24Å; C196-K201 WeakPolarHBondContact O-CB 3.39Å; C196-K201 PolarHBondContact O-N 3.17Å; C196-V202 HydrophobicContact CB-CG2 3.94Å; C196-V202 PolarHBondContact O-N 2.7Å
197	Q	95.2	Very high	94.4	Very high	29 Å²	29	64 Å²	64	14%	0.136	31%	0.306	C	S	.	.	H	α-helix	trans	-64.2	-46.1	176	-171.9	-76.7	-28.1	0	0	111.1	V193 Y194 E195 K199 G200 V202 Y205 M208	V193-Q197 PolarHBondContact O-N 2.89Å; V193-Q197 VanDerWaalsContact O-N 3.08Å; Y194-Q197 PolarHBondContact O-N 3.22Å; E195-Q197 VanDerWaalsContact C-N 3.29Å; E195-Q197 PolarHBondContact O-N 3.22Å; Q197-K199 VanDerWaalsContact C-N 3.27Å; Q197-K199 PolarHBondContact O-N 3.4Å; Q197-G200 PolarHBondContact O-N 3.22Å; Q197-V202 HydrophobicContact CB-CB 4.45Å; Q197-Y205 HydrophobicContact CG-CD1 4.1Å; Q197-Y205 HydrophobicContact CG-CE1 3.99Å; Q197-Y205 PolarHBondContact NE2-OH 2.85Å; Q197-Y205 VanDerWaalsContact NE2-OH 3.14Å; Q197-M208 HydrophobicContact CB-CG 4.41Å; Q197-M208 HydrophobicContact CB-SD 3.75Å; Q197-M208 HydrophobicContact CG-SD 3.8Å
198	K	95	Very high	94.3	Very high	165 Å²	165	61.2 Å²	61.2	72%	0.717	29%	0.294	S	S	*	.	H	α-helix	trans	-61.4	-35.7	178	-173.1	-178.7	178	-176.2	0	112.6	Y194 E195 G200	Y194-K198 PolarHBondContact O-N 3.39Å; E195-K198 PolarHBondContact O-N 2.86Å; K198-G200 VanDerWaalsContact C-N 3.26Å; K198-G200 PolarHBondContact O-N 3Å
199	K	93.6	Very high	94.3	Very high	104 Å²	104	63.2 Å²	63.2	45%	0.452	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	0.1	176.3	-69.9	173.2	177.6	172.6	0	113.3	E121 E195 C196 Q197 K201	E121-K199 IonicContact OE1-NZ 2.78Å; E121-K199 PolarHBondContact OE1-NZ 3.33Å; E195-K199 WeakPolarHBondContact O-CB 3.22Å; E195-K199 VanDerWaalsContact O-CG 3.32Å; E195-K199 WeakPolarHBondContact O-CG 3.43Å; E195-K199 PolarHBondContact O-N 3.47Å; E195-K199 IonicContact OE2-NZ 3.65Å; C196-K199 PolarHBondContact O-N 3.46Å; Q197-K199 VanDerWaalsContact C-N 3.27Å; Q197-K199 PolarHBondContact O-N 3.4Å; K199-K201 HydrophobicContact CB-CD 4.41Å; K199-K201 HydrophobicContact CB-CG 4.17Å; K199-K201 PolarHBondContact O-N 3.02Å
200	G	90.7	Very high	94.2	Very high	53 Å²	53	67.1 Å²	67.1	55%	0.546	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	15.2	-177.9	0	0	0	0	0	114.6	C196 Q197 K198 V202	C196-G200 PolarHBondContact O-N 2.94Å; Q197-G200 PolarHBondContact O-N 3.22Å; K198-G200 VanDerWaalsContact C-N 3.26Å; K198-G200 PolarHBondContact O-N 3Å; G200-V202 VanDerWaalsContact C-N 3.26Å
201	K	88.3	Confident	94.2	Very high	21 Å²	21	64.8 Å²	64.8	9%	0.091	31%	0.312	C	S	.	.	S	Bend	trans	-74.7	-18	174.5	-63.5	-177.4	171.7	-170.6	0	112	R116 D119 E121 T122 C196 K199	R116-K201 PolarHBondContact N-O 3.45Å; R116-K201 WeakPolarHBondContact O-CB 3.45Å; D119-K201 IonicContact OD2-NZ 3.13Å; D119-K201 PolarHBondContact OD2-NZ 2.98Å; E121-K201 VanDerWaalsContact CD-NZ 3.3Å; E121-K201 IonicContact OE1-NZ 3.87Å; E121-K201 PolarHBondContact OE1-NZ 3.41Å; E121-K201 VanDerWaalsContact OE1-NZ 3.13Å; E121-K201 IonicContact OE2-NZ 2.67Å; T122-K201 HydrophobicContact CG2-CD 4.25Å; T122-K201 VanDerWaalsContact OG1-CD 3.28Å; T122-K201 WeakPolarHBondContact OG1-CD 3.35Å; T122-K201 WeakPolarHBondContact OG1-CE 3.41Å; T122-K201 PolarHBondContact OG1-NZ 3.35Å; C196-K201 HydrophobicContact CB-CB 4.06Å; C196-K201 WeakPolarHBondContact O-CA 3.24Å; C196-K201 WeakPolarHBondContact O-CB 3.39Å; C196-K201 PolarHBondContact O-N 3.17Å; K199-K201 HydrophobicContact CB-CD 4.41Å; K199-K201 HydrophobicContact CB-CG 4.17Å; K199-K201 PolarHBondContact O-N 3.02Å
202	V	91.6	Very high	94.2	Very high	3 Å²	3	63.2 Å²	63.2	2%	0.018	31%	0.305	C	S	.	.	S	Bend	trans	-116.9	119.4	171.4	177.7	0	0	0	0	108.5	I115 C196 Q197 G200 S204 L207 M208 I211	I115-V202 HydrophobicContact CG1-CG2 4.16Å; C196-V202 HydrophobicContact CB-CG2 3.94Å; C196-V202 PolarHBondContact O-N 2.7Å; Q197-V202 HydrophobicContact CB-CB 4.45Å; G200-V202 VanDerWaalsContact C-N 3.26Å; V202-S204 VanDerWaalsContact C-N 3.33Å; V202-S204 PolarHBondContact O-N 2.84Å; V202-L207 HydrophobicContact CG1-CB 3.96Å; V202-M208 HydrophobicContact CG1-CB 4.25Å; V202-I211 HydrophobicContact CG2-CD1 4.42Å
203	D	83.9	Confident	94.2	Very high	94 Å²	94	66.1 Å²	66.1	50%	0.503	32%	0.321	S	S	.	.	S	Bend	trans	-61.4	-35.2	-170.9	-65.5	-2.8	0	0	0	114.4	R116 L207	R116-D203 IonicContact CZ-OD1 2.76Å; R116-D203 IonicContact CZ-OD2 2.76Å; R116-D203 IonicContact NE-OD2 2.74Å; R116-D203 IonicContact NH1-OD1 2.81Å; R116-D203 PolarHBondContact NH1-OD1 3.35Å; R116-D203 IonicContact NH1-OD2 2.71Å; R116-D203 PolarHBondContact NH1-OD2 3.11Å; R116-D203 IonicContact NH2-OD2 2.67Å; R116-D203 PolarHBondContact NH2-OD2 2.92Å; R116-D203 VanDerWaalsContact NH2-OD2 3.15Å; D203-L207 HydrophobicContact CB-CD1 4.21Å
204	S	92	Very high	94.2	Very high	54 Å²	54	67.3 Å²	67.3	38%	0.378	33%	0.327	S	S	.	.			trans	-144.8	144.6	-170.7	175.2	0	0	0	0	112.4	V202 Y206 L207 M208	V202-S204 VanDerWaalsContact C-N 3.33Å; V202-S204 PolarHBondContact O-N 2.84Å; S204-Y206 PolarHBondContact O-N 3.48Å; S204-Y206 PolarHBondContact OG-N 3.21Å; S204-L207 WeakPolarHBondContact O-CB 3.03Å; S204-L207 PolarHBondContact O-N 3.04Å; S204-M208 PolarHBondContact O-N 3.16Å; S204-M208 VanDerWaalsContact O-N 3.09Å
205	Y	94.3	Very high	94.3	Very high	139 Å²	139	60.7 Å²	60.7	55%	0.545	30%	0.301	S	S	.	.	H	α-helix	trans	-56.7	-27.6	170.8	-70.4	-76.5	0	0	0	112.8	Q197 M208 N209	Q197-Y205 HydrophobicContact CG-CD1 4.1Å; Q197-Y205 HydrophobicContact CG-CE1 3.99Å; Q197-Y205 PolarHBondContact NE2-OH 2.85Å; Q197-Y205 VanDerWaalsContact NE2-OH 3.14Å; Y205-M208 HydrophobicContact CD1-CE 3.91Å; Y205-M208 HydrophobicContact CD1-SD 4.3Å; Y205-M208 WeakPolarHBondContact O-CB 3.37Å; Y205-M208 PolarHBondContact O-N 2.84Å; Y205-N209 PolarHBondContact O-N 3.48Å
206	Y	95.3	Very high	94.4	Very high	146 Å²	146	57.4 Å²	57.4	57%	0.573	29%	0.29	S	S	*	.	H	α-helix	trans	-63.1	-44.8	173.4	177.7	-96.2	0	0	0	111.9	S204 N209 K210	S204-Y206 PolarHBondContact O-N 3.48Å; S204-Y206 PolarHBondContact OG-N 3.21Å; Y206-N209 PolarHBondContact O-N 3.05Å; Y206-K210 HydrophobicContact CE1-CG 4.24Å; Y206-K210 PolarHBondContact O-N 3.48Å; Y206-K210 WeakPolarHBondContact OH-CE 3.46Å
207	L	92.1	Very high	94.5	Very high	31 Å²	31	63.4 Å²	63.4	16%	0.162	32%	0.316	C	S	.	.	H	α-helix	trans	-67.3	-39.8	177.3	-60.8	179.8	0	0	0	111	Y114 V202 D203 S204 N209 K210 I211	Y114-L207 HydrophobicContact CD1-CD1 4.35Å; Y114-L207 HydrophobicContact CD1-CD2 4.07Å; Y114-L207 HydrophobicContact CD2-CB 4.19Å; Y114-L207 HydrophobicContact CD2-CD2 4.22Å; Y114-L207 HydrophobicContact CE1-CD2 3.86Å; Y114-L207 HydrophobicContact CE2-CD2 3.98Å; Y114-L207 HydrophobicContact CG-CB 4.25Å; Y114-L207 HydrophobicContact CG-CD2 4.27Å; V202-L207 HydrophobicContact CG1-CB 3.96Å; D203-L207 HydrophobicContact CB-CD1 4.21Å; S204-L207 WeakPolarHBondContact O-CB 3.03Å; S204-L207 PolarHBondContact O-N 3.04Å; L207-N209 VanDerWaalsContact C-N 3.33Å; L207-N209 PolarHBondContact O-N 3.37Å; L207-K210 WeakPolarHBondContact O-CB 3.42Å; L207-K210 PolarHBondContact O-N 3.05Å; L207-K210 VanDerWaalsContact O-N 3.17Å; L207-I211 WeakPolarHBondContact O-CG1 3.49Å; L207-I211 PolarHBondContact O-N 2.71Å; L207-I211 VanDerWaalsContact O-N 3.15Å
208	M	96.3	Very high	94.6	Very high	24 Å²	24	62.5 Å²	62.5	12%	0.118	31%	0.312	C	S	.	.	H	α-helix	trans	-56	-47.4	172.9	-170.4	-169.6	75.2	0	0	111.4	V193 Q197 V202 S204 Y205 K210 I211 V212	V193-M208 HydrophobicContact CG1-CG 3.61Å; Q197-M208 HydrophobicContact CB-CG 4.41Å; Q197-M208 HydrophobicContact CB-SD 3.75Å; Q197-M208 HydrophobicContact CG-SD 3.8Å; V202-M208 HydrophobicContact CG1-CB 4.25Å; S204-M208 PolarHBondContact O-N 3.16Å; S204-M208 VanDerWaalsContact O-N 3.09Å; Y205-M208 HydrophobicContact CD1-CE 3.91Å; Y205-M208 HydrophobicContact CD1-SD 4.3Å; Y205-M208 WeakPolarHBondContact O-CB 3.37Å; Y205-M208 PolarHBondContact O-N 2.84Å; M208-K210 VanDerWaalsContact C-N 3.3Å; M208-K210 PolarHBondContact O-N 3.28Å; M208-I211 WeakPolarHBondContact O-CB 3.25Å; M208-I211 PolarHBondContact O-N 2.76Å; M208-I211 VanDerWaalsContact O-N 3.13Å; M208-V212 WeakPolarHBondContact O-CG2 3.35Å; M208-V212 PolarHBondContact O-N 2.67Å
209	N	96.4	Very high	94.7	Very high	84 Å²	84	58.3 Å²	58.3	45%	0.449	29%	0.292	S	S	.	.	H	α-helix	trans	-60.9	-37.8	177.7	-77.8	-19.4	0	0	0	112.3	Y205 Y206 L207 I211 V212 D213	Y205-N209 PolarHBondContact O-N 3.48Å; Y206-N209 PolarHBondContact O-N 3.05Å; L207-N209 VanDerWaalsContact C-N 3.33Å; L207-N209 PolarHBondContact O-N 3.37Å; N209-I211 VanDerWaalsContact C-N 3.31Å; N209-I211 PolarHBondContact O-N 2.86Å; N209-V212 PolarHBondContact O-N 3.16Å; N209-D213 WeakPolarHBondContact O-CB 3.5Å; N209-D213 PolarHBondContact O-N 3.42Å
210	K	96.8	Very high	94.8	Very high	82 Å²	82	58.7 Å²	58.7	36%	0.357	30%	0.295	S	S	.	.	H	α-helix	trans	-61.3	-40.4	174.7	-68.3	-61.9	-177.5	-173.6	0	112.7	Y114 Y206 L207 M208 E214	Y114-K210 HydrophobicContact CE2-CB 4.06Å; Y206-K210 HydrophobicContact CE1-CG 4.24Å; Y206-K210 PolarHBondContact O-N 3.48Å; Y206-K210 WeakPolarHBondContact OH-CE 3.46Å; L207-K210 WeakPolarHBondContact O-CB 3.42Å; L207-K210 PolarHBondContact O-N 3.05Å; L207-K210 VanDerWaalsContact O-N 3.17Å; M208-K210 VanDerWaalsContact C-N 3.3Å; M208-K210 PolarHBondContact O-N 3.28Å; K210-E214 PolarHBondContact O-N 3.4Å
211	I	97.3	Very high	95.1	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.1	-47.2	175.5	-60.8	171	0	0	0	110.4	F111 Y114 I115 V193 V202 L207 M208 N209 E214 I215	F111-I211 HydrophobicContact CD1-CG2 3.7Å; F111-I211 HydrophobicContact CE1-CG2 3.45Å; F111-I211 VanDerWaalsContact CE1-CG2 3.45Å; Y114-I211 HydrophobicContact CD2-CD1 4.45Å; Y114-I211 HydrophobicContact CD2-CG1 4.03Å; I115-I211 HydrophobicContact CD1-CD1 4.46Å; I115-I211 HydrophobicContact CG1-CD1 4.04Å; V193-I211 HydrophobicContact CG1-CB 4.37Å; V193-I211 HydrophobicContact CG1-CG2 4.18Å; V193-I211 HydrophobicContact CG2-CG2 3.68Å; V202-I211 HydrophobicContact CG2-CD1 4.42Å; L207-I211 WeakPolarHBondContact O-CG1 3.49Å; L207-I211 PolarHBondContact O-N 2.71Å; L207-I211 VanDerWaalsContact O-N 3.15Å; M208-I211 WeakPolarHBondContact O-CB 3.25Å; M208-I211 PolarHBondContact O-N 2.76Å; M208-I211 VanDerWaalsContact O-N 3.13Å; N209-I211 VanDerWaalsContact C-N 3.31Å; N209-I211 PolarHBondContact O-N 2.86Å; I211-E214 PolarHBondContact O-N 2.76Å; I211-I215 HydrophobicContact CG2-CD1 4.02Å; I211-I215 WeakPolarHBondContact O-CG1 3.47Å; I211-I215 PolarHBondContact O-N 2.75Å
212	V	97.9	Very high	95.5	Very high	45 Å²	45	55.9 Å²	55.9	27%	0.273	27%	0.272	S	S	.	.	H	α-helix	trans	-63.1	-42.4	-179.8	171.1	0	0	0	0	111.7	L190 V193 M208 N209 E214 I215 G216	L190-V212 HydrophobicContact CD2-CB 4.29Å; L190-V212 HydrophobicContact CD2-CG1 3.87Å; L190-V212 HydrophobicContact CD2-CG2 3.99Å; V193-V212 HydrophobicContact CG1-CG2 4.19Å; M208-V212 WeakPolarHBondContact O-CG2 3.35Å; M208-V212 PolarHBondContact O-N 2.67Å; N209-V212 PolarHBondContact O-N 3.16Å; V212-E214 VanDerWaalsContact C-N 3.27Å; V212-E214 PolarHBondContact O-N 2.74Å; V212-I215 PolarHBondContact O-N 3.26Å; V212-G216 PolarHBondContact O-N 2.96Å
213	D	97.6	Very high	95.7	Very high	89 Å²	89	56.3 Å²	56.3	48%	0.476	28%	0.276	S	S	.	.	H	α-helix	trans	-58.6	-42	175.9	-75.9	-17.8	0	0	0	110.8	N209 G216 K217	N209-D213 WeakPolarHBondContact O-CB 3.5Å; N209-D213 PolarHBondContact O-N 3.42Å; D213-G216 CarbonylContact O-C 3.6Å; D213-G216 WeakPolarHBondContact O-CA 3.43Å; D213-G216 PolarHBondContact O-N 2.76Å; D213-K217 WeakPolarHBondContact O-CG 3.22Å; D213-K217 PolarHBondContact O-N 2.94Å
214	E	97.6	Very high	96.2	Very high	24 Å²	24	53.7 Å²	53.7	11%	0.112	27%	0.265	C	S	.	.	H	α-helix	trans	-70.5	-43.3	-179.4	-162	53.2	-127.5	0	0	112.5	D106 A107 L110 K210 I211 V212 G216 K217 F218	D106-E214 HydrophobicContact CB-CG 4.18Å; A107-E214 HydrophobicContact CB-CG 4.13Å; L110-E214 HydrophobicContact CD1-CB 3.65Å; L110-E214 HydrophobicContact CD1-CG 3.88Å; K210-E214 PolarHBondContact O-N 3.4Å; I211-E214 PolarHBondContact O-N 2.76Å; V212-E214 VanDerWaalsContact C-N 3.27Å; V212-E214 PolarHBondContact O-N 2.74Å; E214-G216 PolarHBondContact O-N 3.03Å; E214-K217 PolarHBondContact O-N 3.42Å; E214-K217 WeakPolarHBondContact OE2-CD 3.38Å; E214-K217 IonicContact OE2-NZ 3.78Å; E214-K217 PolarHBondContact OE2-NZ 3.48Å; E214-F218 PolarHBondContact O-N 2.9Å
215	I	98.1	Very high	96.4	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-56.1	-42.6	169.5	-68.5	169.2	0	0	0	110.1	F111 L133 I186 L190 V193 I211 V212 F218 R219	F111-I215 HydrophobicContact CE1-CD1 4.03Å; F111-I215 HydrophobicContact CE1-CG1 4.1Å; F111-I215 HydrophobicContact CZ-CD1 4.2Å; F111-I215 HydrophobicContact CZ-CG1 4Å; L133-I215 HydrophobicContact CD2-CG1 4.33Å; L133-I215 HydrophobicContact CD2-CG2 4.08Å; I186-I215 HydrophobicContact CG2-CG2 3.8Å; L190-I215 HydrophobicContact CD2-CB 4.38Å; L190-I215 HydrophobicContact CD2-CD1 4.21Å; L190-I215 HydrophobicContact CD2-CG2 3.97Å; L190-I215 HydrophobicContact CG-CG2 4.41Å; V193-I215 HydrophobicContact CG2-CD1 4Å; I211-I215 HydrophobicContact CG2-CD1 4.02Å; I211-I215 WeakPolarHBondContact O-CG1 3.47Å; I211-I215 PolarHBondContact O-N 2.75Å; V212-I215 PolarHBondContact O-N 3.26Å; I215-F218 PolarHBondContact O-N 2.81Å; I215-R219 PolarHBondContact O-N 2.94Å
216	G	97.3	Very high	96.4	Very high	18 Å²	18	46.6 Å²	46.6	19%	0.186	23%	0.232	C	C	.	.	H	α-helix	trans	-59	-51.1	175.6	0	0	0	0	0	112	V212 D213 E214 F218 R219 H220	V212-G216 PolarHBondContact O-N 2.96Å; D213-G216 CarbonylContact O-C 3.6Å; D213-G216 WeakPolarHBondContact O-CA 3.43Å; D213-G216 PolarHBondContact O-N 2.76Å; E214-G216 PolarHBondContact O-N 3.03Å; G216-F218 VanDerWaalsContact C-N 3.34Å; G216-F218 PolarHBondContact O-N 3.25Å; G216-R219 WeakPolarHBondContact O-CB 3.29Å; G216-R219 PolarHBondContact O-N 3.17Å; G216-H220 VanDerWaalsContact C-ND1 3.33Å; G216-H220 PolarHBondContact O-N 3.33Å; G216-H220 PolarHBondContact O-ND1 3.34Å
217	K	96.8	Very high	96.4	Very high	126 Å²	126	46.2 Å²	46.2	55%	0.548	23%	0.233	S	C	.	.	H	α-helix	trans	-57	-45.9	177.4	-71.9	177.9	-156.7	158.5	0	111.9	D213 E214 R219 H220 G221	D213-K217 WeakPolarHBondContact O-CG 3.22Å; D213-K217 PolarHBondContact O-N 2.94Å; E214-K217 PolarHBondContact O-N 3.42Å; E214-K217 WeakPolarHBondContact OE2-CD 3.38Å; E214-K217 IonicContact OE2-NZ 3.78Å; E214-K217 PolarHBondContact OE2-NZ 3.48Å; K217-R219 PolarHBondContact O-N 3.43Å; K217-H220 PolarHBondContact O-N 3.47Å; K217-H220 VanDerWaalsContact O-N 3.14Å; K217-G221 PolarHBondContact O-N 2.82Å
218	F	97.4	Very high	96.5	Very high	9 Å²	9	47.6 Å²	47.6	4%	0.039	24%	0.237	C	C	.	.	H	α-helix	trans	-56.8	-49.6	176.6	-169.3	-87.4	0	0	0	111.2	I104 L133 Q137 E214 I215 G216 H220 G221 L222	I104-F218 HydrophobicContact CD1-CE2 4.5Å; L133-F218 HydrophobicContact CB-CD1 4.3Å; L133-F218 HydrophobicContact CB-CE1 4.06Å; L133-F218 HydrophobicContact CB-CZ 4.35Å; L133-F218 HydrophobicContact CD2-CD1 4.2Å; L133-F218 VanDerWaalsContact O-CE1 3.31Å; L133-F218 WeakPolarHBondContact O-CE1 3.34Å; Q137-F218 HydrophobicContact CB-CE1 4.09Å; Q137-F218 HydrophobicContact CB-CZ 3.94Å; E214-F218 PolarHBondContact O-N 2.9Å; I215-F218 PolarHBondContact O-N 2.81Å; G216-F218 VanDerWaalsContact C-N 3.34Å; G216-F218 PolarHBondContact O-N 3.25Å; F218-H220 VanDerWaalsContact C-N 3.34Å; F218-H220 PolarHBondContact O-N 3.2Å; F218-G221 PolarHBondContact O-N 3.25Å; F218-L222 HydrophobicContact CD1-CD1 4.06Å; F218-L222 HydrophobicContact CD1-CG 4.33Å; F218-L222 HydrophobicContact CE1-CD1 3.74Å; F218-L222 HydrophobicContact CE1-CG 4.17Å; F218-L222 PolarHBondContact O-N 2.87Å; F218-L222 VanDerWaalsContact O-N 3.15Å
219	R	96.8	Very high	96.4	Very high	78 Å²	78	50.3 Å²	50.3	29%	0.294	25%	0.252	S	S	.	.	H	α-helix	trans	-59.9	-39.6	175.4	-171.8	-148.5	74.2	88.4	-2.8	112.8	Y182 I186 I215 G216 K217 G221 L222 A223	Y182-R219 HydrophobicContact CE2-CG 4.34Å; I186-R219 HydrophobicContact CD1-CB 4.28Å; I186-R219 HydrophobicContact CG1-CB 4.42Å; I186-R219 HydrophobicContact CG1-CG 4.18Å; I186-R219 HydrophobicContact CG2-CB 4.31Å; I186-R219 HydrophobicContact CG2-CG 4.24Å; I215-R219 PolarHBondContact O-N 2.94Å; G216-R219 WeakPolarHBondContact O-CB 3.29Å; G216-R219 PolarHBondContact O-N 3.17Å; K217-R219 PolarHBondContact O-N 3.43Å; R219-G221 VanDerWaalsContact C-N 3.34Å; R219-L222 PolarHBondContact O-N 3.46Å; R219-A223 WeakPolarHBondContact O-CB 3.34Å; R219-A223 PolarHBondContact O-N 3.45Å
220	H	96.4	Very high	96.3	Very high	111 Å²	111	56.1 Å²	56.1	51%	0.514	27%	0.267	S	S	.	.	H	α-helix	trans	-64.9	-38.1	177.2	-71.9	108.4	0	0	0	112	G216 K217 F218 A223 S224	G216-H220 VanDerWaalsContact C-ND1 3.33Å; G216-H220 PolarHBondContact O-N 3.33Å; G216-H220 PolarHBondContact O-ND1 3.34Å; K217-H220 PolarHBondContact O-N 3.47Å; K217-H220 VanDerWaalsContact O-N 3.14Å; F218-H220 VanDerWaalsContact C-N 3.34Å; F218-H220 PolarHBondContact O-N 3.2Å; H220-A223 PolarHBondContact O-N 3.39Å; H220-S224 WeakPolarHBondContact O-CB 3.47Å; H220-S224 PolarHBondContact O-N 3.01Å
221	G	96.7	Very high	96.2	Very high	15 Å²	15	56 Å²	56	16%	0.155	27%	0.273	C	S	.	.	H	α-helix	trans	-56.8	-54	171.4	0	0	0	0	0	111.3	G100 K217 F218 R219 A223 S224 L225	G100-G221 CarbonylContact O-C 3.42Å; G100-G221 WeakPolarHBondContact O-CA 3.39Å; K217-G221 PolarHBondContact O-N 2.82Å; F218-G221 PolarHBondContact O-N 3.25Å; R219-G221 VanDerWaalsContact C-N 3.34Å; G221-A223 VanDerWaalsContact C-N 3.34Å; G221-A223 PolarHBondContact O-N 3.3Å; G221-S224 WeakPolarHBondContact O-CA 3.06Å; G221-S224 WeakPolarHBondContact O-CB 3.11Å; G221-S224 PolarHBondContact O-N 3.33Å; G221-L225 PolarHBondContact O-N 3.18Å; G221-L225 VanDerWaalsContact O-N 3.12Å
222	L	96.5	Very high	96	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-59.5	-42.1	177.7	-62.2	-174.6	0	0	0	113	Q137 V140 Y182 F218 R219 S224 L225 L226	Q137-L222 HydrophobicContact CB-CD1 4.26Å; Q137-L222 HydrophobicContact CB-CD2 4.08Å; Q137-L222 HydrophobicContact CG-CD2 4.18Å; V140-L222 HydrophobicContact CG1-CB 4.38Å; V140-L222 HydrophobicContact CG2-CB 4.19Å; V140-L222 HydrophobicContact CG2-CD1 4.3Å; Y182-L222 HydrophobicContact CE2-CB 4.42Å; F218-L222 HydrophobicContact CD1-CD1 4.06Å; F218-L222 HydrophobicContact CD1-CG 4.33Å; F218-L222 HydrophobicContact CE1-CD1 3.74Å; F218-L222 HydrophobicContact CE1-CG 4.17Å; F218-L222 PolarHBondContact O-N 2.87Å; F218-L222 VanDerWaalsContact O-N 3.15Å; R219-L222 PolarHBondContact O-N 3.46Å; L222-S224 VanDerWaalsContact C-N 3.26Å; L222-S224 PolarHBondContact O-N 3.23Å; L222-L225 HydrophobicContact CD2-CD1 4.19Å; L222-L225 WeakPolarHBondContact O-CB 3.27Å; L222-L225 PolarHBondContact O-N 2.96Å; L222-L226 PolarHBondContact O-N 3.48Å; L222-L226 VanDerWaalsContact O-N 3.14Å
223	A	95.3	Very high	95.8	Very high	13 Å²	13	58.3 Å²	58.3	11%	0.107	29%	0.289	C	S	.	.	H	α-helix	trans	-64.1	-32.6	175.7	0	0	0	0	0	112.3	R219 H220 G221 K227	R219-A223 WeakPolarHBondContact O-CB 3.34Å; R219-A223 PolarHBondContact O-N 3.45Å; H220-A223 PolarHBondContact O-N 3.39Å; G221-A223 VanDerWaalsContact C-N 3.34Å; G221-A223 PolarHBondContact O-N 3.3Å; A223-K227 WeakPolarHBondContact O-CG 3.04Å; A223-K227 PolarHBondContact O-N 3.05Å; A223-K227 VanDerWaalsContact O-N 3.11Å
224	S	95.6	Very high	95.7	Very high	39 Å²	39	58.1 Å²	58.1	27%	0.273	29%	0.293	S	S	.	.	H	α-helix	trans	-63.7	-43.1	173.4	-166.4	0	0	0	0	111	H220 G221 L222 L226 K227 Y228	H220-S224 WeakPolarHBondContact O-CB 3.47Å; H220-S224 PolarHBondContact O-N 3.01Å; G221-S224 WeakPolarHBondContact O-CA 3.06Å; G221-S224 WeakPolarHBondContact O-CB 3.11Å; G221-S224 PolarHBondContact O-N 3.33Å; L222-S224 VanDerWaalsContact C-N 3.26Å; L222-S224 PolarHBondContact O-N 3.23Å; S224-L226 PolarHBondContact O-N 2.82Å; S224-K227 WeakPolarHBondContact O-CB 3.4Å; S224-K227 PolarHBondContact O-N 3.4Å; S224-Y228 WeakPolarHBondContact O-CD2 3.35Å; S224-Y228 PolarHBondContact O-N 2.85Å
225	L	95.8	Very high	95.5	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-59	-47.1	176	-57.9	176.8	0	0	0	111.8	I97 L141 I144 G221 L222 K227 Y228 D229	I97-L225 HydrophobicContact CG2-CD2 3.9Å; I97-L225 VanDerWaalsContact O-CD2 3.25Å; I97-L225 WeakPolarHBondContact O-CD2 3.49Å; L141-L225 HydrophobicContact CD2-CD1 4.18Å; I144-L225 HydrophobicContact CD1-CB 3.64Å; I144-L225 HydrophobicContact CD1-CD1 4.41Å; G221-L225 PolarHBondContact O-N 3.18Å; G221-L225 VanDerWaalsContact O-N 3.12Å; L222-L225 HydrophobicContact CD2-CD1 4.19Å; L222-L225 WeakPolarHBondContact O-CB 3.27Å; L222-L225 PolarHBondContact O-N 2.96Å; L225-K227 VanDerWaalsContact C-N 3.29Å; L225-K227 PolarHBondContact O-N 3.48Å; L225-Y228 PolarHBondContact O-N 3.15Å; L225-Y228 VanDerWaalsContact O-N 3.14Å; L225-D229 PolarHBondContact O-N 2.83Å
226	L	94.8	Very high	95.4	Very high	43 Å²	43	67.1 Å²	67.1	23%	0.225	34%	0.344	C	S	.	.	H	α-helix	trans	-59.3	-38.3	176.1	-70	173.1	0	0	0	112.4	V140 I144 Y182 L222 S224 D229 W230	V140-L226 HydrophobicContact CG1-CD2 3.99Å; V140-L226 HydrophobicContact CG1-CG 3.94Å; V140-L226 HydrophobicContact CG2-CD1 4.18Å; V140-L226 HydrophobicContact CG2-CG 4.47Å; I144-L226 HydrophobicContact CG2-CD2 3.84Å; Y182-L226 HydrophobicContact CD1-CD1 4.04Å; Y182-L226 HydrophobicContact CE1-CD1 3.52Å; L222-L226 PolarHBondContact O-N 3.48Å; L222-L226 VanDerWaalsContact O-N 3.14Å; S224-L226 PolarHBondContact O-N 2.82Å; L226-D229 PolarHBondContact O-N 3.21Å; L226-W230 VanDerWaalsContact O-CB 3.23Å; L226-W230 WeakPolarHBondContact O-CB 3.28Å; L226-W230 PolarHBondContact O-N 3.26Å
227	K	94.4	Very high	95.3	Very high	137 Å²	137	70.2 Å²	70.2	60%	0.596	35%	0.351	S	S	*	.	H	α-helix	trans	-67	-39.4	176.1	-71.9	171.2	-174.1	179.2	0	112.1	A223 S224 L225 V231	A223-K227 WeakPolarHBondContact O-CG 3.04Å; A223-K227 PolarHBondContact O-N 3.05Å; A223-K227 VanDerWaalsContact O-N 3.11Å; S224-K227 WeakPolarHBondContact O-CB 3.4Å; S224-K227 PolarHBondContact O-N 3.4Å; L225-K227 VanDerWaalsContact C-N 3.29Å; L225-K227 PolarHBondContact O-N 3.48Å; K227-V231 PolarHBondContact O-N 3.31Å
228	Y	94.8	Very high	95.2	Very high	61 Å²	61	64.9 Å²	64.9	24%	0.239	33%	0.329	C	S	.	.	H	α-helix	trans	-64.3	-45.7	175.1	-79.7	-62.1	0	0	0	110.4	R93 S96 I97 S224 L225 V231	R93-Y228 HydrophobicContact CG-CD1 3.87Å; R93-Y228 HydrophobicContact CG-CE1 3.81Å; R93-Y228 PolarHBondContact NH2-O 3.29Å; S96-Y228 VanDerWaalsContact CB-CZ 3.48Å; S96-Y228 WeakPolarHBondContact CB-OH 3.38Å; S96-Y228 PolarHBondContact OG-OH 3.21Å; I97-Y228 HydrophobicContact CD1-CG 4.32Å; I97-Y228 HydrophobicContact CG1-CD1 4.25Å; I97-Y228 HydrophobicContact CG1-CD2 3.79Å; I97-Y228 HydrophobicContact CG1-CE2 4.44Å; I97-Y228 HydrophobicContact CG1-CG 3.7Å; S224-Y228 WeakPolarHBondContact O-CD2 3.35Å; S224-Y228 PolarHBondContact O-N 2.85Å; L225-Y228 PolarHBondContact O-N 3.15Å; L225-Y228 VanDerWaalsContact O-N 3.14Å; Y228-V231 CarbonylContact O-C 3.28Å
229	D	94.4	Very high	95.1	Very high	81 Å²	81	69.4 Å²	69.4	43%	0.433	35%	0.35	S	S	.	.	H	α-helix	trans	-61.7	-48.2	175.9	-175.2	71.1	0	0	0	112.6	I144 L225 L226 V231	I144-D229 HydrophobicContact CB-CB 4.07Å; I144-D229 HydrophobicContact CG2-CB 3.62Å; L225-D229 PolarHBondContact O-N 2.83Å; L226-D229 PolarHBondContact O-N 3.21Å; D229-V231 PolarHBondContact O-N 3.41Å
230	W	94.4	Very high	95	Very high	205 Å²	205	69.3 Å²	69.3	78%	0.777	36%	0.358	S	S	*	.	H	α-helix	trans	-64.2	-39.4	-179	177.4	43.5	0	0	0	113.6	L226 P232	L226-W230 VanDerWaalsContact O-CB 3.23Å; L226-W230 WeakPolarHBondContact O-CB 3.28Å; L226-W230 PolarHBondContact O-N 3.26Å; W230-P232 VanDerWaalsContact C-CD 3.45Å; W230-P232 WeakPolarHBondContact O-CD 3.49Å
231	V	94.9	Very high	95	Very high	79 Å²	79	64.1 Å²	64.1	48%	0.479	33%	0.334	S	S	.	.	S	Bend	trans	-111.9	83.7	-179.9	-170.6	0	0	0	0	109.2	R93 K227 Y228 D229	R93-V231 PolarHBondContact NH1-O 3.49Å; R93-V231 PolarHBondContact NH2-O 3.01Å; K227-V231 PolarHBondContact O-N 3.31Å; Y228-V231 CarbonylContact O-C 3.28Å; D229-V231 PolarHBondContact O-N 3.41Å
232	P	92.9	Very high	94.9	Very high	83 Å²	83	65.2 Å²	65.2	54%	0.539	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-69	172.1	172.7	30.9	-35.9	0	0	0	111	W230	W230-P232 VanDerWaalsContact C-CD 3.45Å; W230-P232 WeakPolarHBondContact O-CD 3.49Å
233	V	93.7	Very high	94.8	Very high	11 Å²	11	70.1 Å²	70.1	7%	0.067	36%	0.36	C	S	.	.	S	Bend	trans	-56.1	134	170.6	-174.3	0	0	0	0	109	F86 F89 L235 Y237 P238 L294	F86-V233 HydrophobicContact CE2-CG1 4.39Å; F89-V233 HydrophobicContact CD1-CG1 4.48Å; F89-V233 HydrophobicContact CE1-CB 4.25Å; F89-V233 HydrophobicContact CE1-CG1 3.72Å; F89-V233 HydrophobicContact CE1-CG2 3.63Å; F89-V233 HydrophobicContact CZ-CG2 4.44Å; V233-L235 PolarHBondContact O-N 3.38Å; V233-L235 VanDerWaalsContact O-N 3.13Å; V233-Y237 HydrophobicContact CG1-CD1 4.18Å; V233-P238 HydrophobicContact CB-CG 4.31Å; V233-P238 HydrophobicContact CG1-CG 4.1Å; V233-L294 HydrophobicContact CB-CD2 4.26Å; V233-L294 HydrophobicContact CG2-CD2 3.7Å
234	P	95	Very high	94.7	Very high	86 Å²	86	70.5 Å²	70.5	56%	0.558	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-50.8	123.3	-179.7	-28.9	35.2	0	0	0	111.2	V236 Y237 P238	P234-V236 HydrophobicContact CB-CG1 4.45Å; P234-V236 PolarHBondContact O-N 3.06Å; P234-Y237 WeakPolarHBondContact O-CB 3.38Å; P234-Y237 PolarHBondContact O-N 3.22Å; P234-P238 WeakPolarHBondContact O-CD 3.32Å
235	L	94.2	Very high	94.7	Very high	122 Å²	122	68.7 Å²	68.7	64%	0.639	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-38.1	-168.1	176.9	61.8	0	0	0	113.8	V233 Y237 P238 Q239	V233-L235 PolarHBondContact O-N 3.38Å; V233-L235 VanDerWaalsContact O-N 3.13Å; L235-Y237 PolarHBondContact O-N 3.12Å; L235-P238 WeakPolarHBondContact O-CD 3.29Å; L235-Q239 HydrophobicContact CD1-CG 4.17Å; L235-Q239 HydrophobicContact CG-CG 4.25Å; L235-Q239 WeakPolarHBondContact O-CB 3.1Å; L235-Q239 WeakPolarHBondContact O-CG 3.49Å; L235-Q239 PolarHBondContact O-N 2.62Å; L235-Q239 VanDerWaalsContact O-N 3.16Å
236	V	96.2	Very high	94.6	Very high	91 Å²	91	73 Å²	73	55%	0.552	37%	0.367	S	S	*	.	H	α-helix	trans	-57.4	-32	177.7	66.8	0	0	0	0	112.7	P234 Q239 V240	P234-V236 HydrophobicContact CB-CG1 4.45Å; P234-V236 PolarHBondContact O-N 3.06Å; V236-Q239 PolarHBondContact O-N 3.36Å; V236-V240 HydrophobicContact CG2-CG2 4.16Å; V236-V240 WeakPolarHBondContact O-CB 3.29Å; V236-V240 VanDerWaalsContact O-CG2 3.24Å; V236-V240 WeakPolarHBondContact O-CG2 3.38Å; V236-V240 PolarHBondContact O-N 3.41Å
237	Y	94.6	Very high	94.6	Very high	84 Å²	84	74.5 Å²	74.5	33%	0.329	38%	0.375	S	S	.	.	H	α-helix	trans	-73	-54.7	-173.8	-168.7	-168.6	0	0	0	111.8	F86 V233 P234 L235 Q239 V240 I241	F86-Y237 HydrophobicContact CB-CE2 4.42Å; F86-Y237 HydrophobicContact CD2-CD1 4.2Å; F86-Y237 HydrophobicContact CD2-CD2 4.17Å; F86-Y237 HydrophobicContact CD2-CE1 4.11Å; F86-Y237 HydrophobicContact CD2-CE2 4.07Å; F86-Y237 HydrophobicContact CD2-CG 4.25Å; F86-Y237 HydrophobicContact CE2-CG 4.47Å; V233-Y237 HydrophobicContact CG1-CD1 4.18Å; P234-Y237 WeakPolarHBondContact O-CB 3.38Å; P234-Y237 PolarHBondContact O-N 3.22Å; L235-Y237 PolarHBondContact O-N 3.12Å; Y237-Q239 VanDerWaalsContact C-N 3.27Å; Y237-Q239 PolarHBondContact O-N 3.17Å; Y237-V240 PolarHBondContact O-N 3.24Å; Y237-I241 HydrophobicContact CD2-CD1 4.48Å; Y237-I241 HydrophobicContact CD2-CG1 3.96Å; Y237-I241 HydrophobicContact CE2-CD1 4.09Å; Y237-I241 HydrophobicContact CE2-CG1 3.96Å; Y237-I241 WeakPolarHBondContact O-CG1 3.38Å; Y237-I241 PolarHBondContact O-N 3.18Å
238	P	95.3	Very high	94.6	Very high	13 Å²	13	68.2 Å²	68.2	8%	0.084	35%	0.347	C	S	.	.	H	α-helix	trans	-56.1	-40.8	169.2	-23.8	32.8	0	0	0	112.5	F86 V233 P234 L235 V240 I241 F242	F86-P238 HydrophobicContact CE2-CB 4.41Å; F86-P238 HydrophobicContact CE2-CG 4Å; F86-P238 HydrophobicContact CZ-CB 4.02Å; F86-P238 HydrophobicContact CZ-CG 3.95Å; V233-P238 HydrophobicContact CB-CG 4.31Å; V233-P238 HydrophobicContact CG1-CG 4.1Å; P234-P238 WeakPolarHBondContact O-CD 3.32Å; L235-P238 WeakPolarHBondContact O-CD 3.29Å; P238-V240 PolarHBondContact O-N 3.47Å; P238-I241 PolarHBondContact O-N 3.22Å; P238-F242 HydrophobicContact CB-CD2 4.07Å; P238-F242 HydrophobicContact CB-CE2 3.8Å; P238-F242 HydrophobicContact CB-CZ 4.21Å; P238-F242 WeakPolarHBondContact O-CB 3.49Å; P238-F242 WeakPolarHBondContact O-CD2 3.27Å; P238-F242 WeakPolarHBondContact O-CG 3.5Å; P238-F242 PolarHBondContact O-N 2.78Å
239	Q	95.5	Very high	94.7	Very high	104 Å²	104	65.5 Å²	65.5	49%	0.486	34%	0.337	S	S	.	.	H	α-helix	trans	-56.8	-50.6	178.5	-77.3	175.4	-22.5	0	0	112.4	L235 V236 Y237 I241 L243	L235-Q239 HydrophobicContact CD1-CG 4.17Å; L235-Q239 HydrophobicContact CG-CG 4.25Å; L235-Q239 WeakPolarHBondContact O-CB 3.1Å; L235-Q239 WeakPolarHBondContact O-CG 3.49Å; L235-Q239 PolarHBondContact O-N 2.62Å; L235-Q239 VanDerWaalsContact O-N 3.16Å; V236-Q239 PolarHBondContact O-N 3.36Å; Y237-Q239 VanDerWaalsContact C-N 3.27Å; Y237-Q239 PolarHBondContact O-N 3.17Å; Q239-I241 PolarHBondContact O-N 3.1Å; Q239-L243 WeakPolarHBondContact O-CB 3.45Å; Q239-L243 PolarHBondContact O-N 3.01Å
240	V	94.6	Very high	94.7	Very high	77 Å²	77	67.3 Å²	67.3	47%	0.467	34%	0.344	S	S	.	.	H	α-helix	trans	-60.8	-45.8	179.9	167.6	0	0	0	0	110.9	V236 Y237 P238 A244	V236-V240 HydrophobicContact CG2-CG2 4.16Å; V236-V240 WeakPolarHBondContact O-CB 3.29Å; V236-V240 VanDerWaalsContact O-CG2 3.24Å; V236-V240 WeakPolarHBondContact O-CG2 3.38Å; V236-V240 PolarHBondContact O-N 3.41Å; Y237-V240 PolarHBondContact O-N 3.24Å; P238-V240 PolarHBondContact O-N 3.47Å; V240-A244 WeakPolarHBondContact O-CB 3.36Å; V240-A244 PolarHBondContact O-N 3.44Å
241	I	95	Very high	94.7	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-67.1	-49.5	-178.5	-59.7	-64.8	0	0	0	110.9	L82 L83 F86 Y237 P238 Q239 L243 A244 V245	L82-I241 HydrophobicContact CB-CD1 3.66Å; L82-I241 HydrophobicContact CD2-CD1 4.15Å; L82-I241 HydrophobicContact CG-CD1 4.4Å; L83-I241 HydrophobicContact CD2-CG2 4.04Å; L83-I241 HydrophobicContact CG-CG2 4.45Å; F86-I241 HydrophobicContact CB-CD1 4.32Å; F86-I241 HydrophobicContact CB-CG1 4.07Å; F86-I241 HydrophobicContact CB-CG2 4.49Å; F86-I241 HydrophobicContact CD1-CB 4.34Å; F86-I241 HydrophobicContact CD1-CG1 4.35Å; F86-I241 HydrophobicContact CD1-CG2 3.89Å; F86-I241 HydrophobicContact CD2-CG1 4.23Å; F86-I241 HydrophobicContact CE1-CG2 4.43Å; F86-I241 HydrophobicContact CG-CB 4.46Å; F86-I241 HydrophobicContact CG-CG1 3.96Å; F86-I241 HydrophobicContact CG-CG2 4.29Å; Y237-I241 HydrophobicContact CD2-CD1 4.48Å; Y237-I241 HydrophobicContact CD2-CG1 3.96Å; Y237-I241 HydrophobicContact CE2-CD1 4.09Å; Y237-I241 HydrophobicContact CE2-CG1 3.96Å; Y237-I241 WeakPolarHBondContact O-CG1 3.38Å; Y237-I241 PolarHBondContact O-N 3.18Å; P238-I241 PolarHBondContact O-N 3.22Å; Q239-I241 PolarHBondContact O-N 3.1Å; I241-L243 VanDerWaalsContact C-N 3.3Å; I241-L243 PolarHBondContact O-N 3.12Å; I241-A244 PolarHBondContact O-N 3.45Å; I241-V245 WeakPolarHBondContact O-CG2 3.45Å; I241-V245 PolarHBondContact O-N 3.35Å; I241-V245 VanDerWaalsContact O-N 3.08Å
242	F	94.7	Very high	94.7	Very high	37 Å²	37	55.5 Å²	55.5	16%	0.162	29%	0.293	C	S	.	.	H	α-helix	trans	-63.9	-36.3	-178.9	-69.5	-9.6	0	0	0	112.6	F86 P238 R246 M287 E291 L294	F86-F242 AromaticContact CE1-CE1 3.85Å; F86-F242 HydrophobicContact CE1-CE1 3.85Å; F86-F242 HydrophobicContact CE1-CZ 4.26Å; F86-F242 HydrophobicContact CZ-CE1 4.39Å; F86-F242 HydrophobicContact CZ-CZ 4.44Å; P238-F242 HydrophobicContact CB-CD2 4.07Å; P238-F242 HydrophobicContact CB-CE2 3.8Å; P238-F242 HydrophobicContact CB-CZ 4.21Å; P238-F242 WeakPolarHBondContact O-CB 3.49Å; P238-F242 WeakPolarHBondContact O-CD2 3.27Å; P238-F242 WeakPolarHBondContact O-CG 3.5Å; P238-F242 PolarHBondContact O-N 2.78Å; F242-R246 VanDerWaalsContact CB-NH1 3.35Å; F242-R246 WeakPolarHBondContact O-CB 3.27Å; F242-R246 VanDerWaalsContact O-CG 3.29Å; F242-R246 WeakPolarHBondContact O-CG 3.35Å; F242-R246 PolarHBondContact O-N 2.85Å; F242-R246 PolarHBondContact O-NH1 2.93Å; F242-M287 HydrophobicContact CB-SD 4.36Å; F242-M287 HydrophobicContact CD1-CG 3.51Å; F242-M287 HydrophobicContact CD1-SD 3.66Å; F242-M287 HydrophobicContact CE1-CG 3.7Å; F242-M287 HydrophobicContact CE1-SD 4.39Å; F242-M287 HydrophobicContact CG-SD 4.31Å; F242-E291 HydrophobicContact CZ-CB 4.09Å; F242-E291 HydrophobicContact CZ-CG 4.15Å; F242-L294 HydrophobicContact CE2-CD1 4.11Å; F242-L294 HydrophobicContact CZ-CD1 3.73Å
243	L	94.1	Very high	94.9	Very high	103 Å²	103	52 Å²	52	54%	0.539	27%	0.27	S	S	.	.	H	α-helix	trans	-72.8	-46	175.2	-174.9	65.3	0	0	0	111.1	Q239 I241 V245 R246 I247	Q239-L243 WeakPolarHBondContact O-CB 3.45Å; Q239-L243 PolarHBondContact O-N 3.01Å; I241-L243 VanDerWaalsContact C-N 3.3Å; I241-L243 PolarHBondContact O-N 3.12Å; L243-V245 PolarHBondContact O-N 2.88Å; L243-R246 PolarHBondContact O-N 3.48Å; L243-I247 HydrophobicContact CD1-CD1 3.76Å; L243-I247 HydrophobicContact CD1-CG1 3.91Å; L243-I247 HydrophobicContact CD2-CD1 4.04Å; L243-I247 HydrophobicContact CG-CD1 3.55Å; L243-I247 HydrophobicContact CG-CG1 4.05Å; L243-I247 WeakPolarHBondContact O-CB 3.43Å; L243-I247 WeakPolarHBondContact O-CG1 3.48Å; L243-I247 PolarHBondContact O-N 2.96Å
244	A	94.3	Very high	94.9	Very high	21 Å²	21	53.8 Å²	53.8	17%	0.174	28%	0.278	C	S	.	.	H	α-helix	trans	-58.4	-45.3	-179	0	0	0	0	0	112.1	L79 V240 I241 Y248	L79-A244 HydrophobicContact CD2-CB 4.37Å; V240-A244 WeakPolarHBondContact O-CB 3.36Å; V240-A244 PolarHBondContact O-N 3.44Å; I241-A244 PolarHBondContact O-N 3.45Å; A244-Y248 VanDerWaalsContact O-CB 3.29Å; A244-Y248 WeakPolarHBondContact O-CB 3.4Å; A244-Y248 PolarHBondContact O-N 3.39Å
245	V	95.3	Very high	94.8	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.012	25%	0.253	C	S	.	.	H	α-helix	trans	-63.4	-44.4	177.4	179.3	0	0	0	0	110.9	L79 L83 I241 L243 Y248 F249 M284 M287	L79-V245 HydrophobicContact CD2-CG2 3.99Å; L83-V245 HydrophobicContact CD1-CG2 3.87Å; L83-V245 HydrophobicContact CD2-CG2 4.26Å; L83-V245 HydrophobicContact CG-CG2 4.17Å; I241-V245 WeakPolarHBondContact O-CG2 3.45Å; I241-V245 PolarHBondContact O-N 3.35Å; I241-V245 VanDerWaalsContact O-N 3.08Å; L243-V245 PolarHBondContact O-N 2.88Å; V245-Y248 PolarHBondContact O-N 2.88Å; V245-F249 HydrophobicContact CG1-CD2 4.03Å; V245-F249 HydrophobicContact CG1-CE2 3.89Å; V245-F249 WeakPolarHBondContact O-CD2 3.47Å; V245-F249 PolarHBondContact O-N 2.95Å; V245-M284 HydrophobicContact CG1-CG 4.42Å; V245-M284 HydrophobicContact CG1-SD 3.52Å; V245-M284 VanDerWaalsContact CG1-SD 3.52Å; V245-M287 HydrophobicContact CB-SD 3.88Å; V245-M287 HydrophobicContact CG1-SD 4.06Å; V245-M287 HydrophobicContact CG2-SD 4.21Å
246	R	94.3	Very high	94.7	Very high	90 Å²	90	46 Å²	46	34%	0.34	23%	0.23	S	C	.	.	H	α-helix	trans	-68	-44.1	179.7	-74	176.1	179.9	77.3	-5	112.3	F242 L243 Y248 F249 M250 M287	F242-R246 VanDerWaalsContact CB-NH1 3.35Å; F242-R246 WeakPolarHBondContact O-CB 3.27Å; F242-R246 VanDerWaalsContact O-CG 3.29Å; F242-R246 WeakPolarHBondContact O-CG 3.35Å; F242-R246 PolarHBondContact O-N 2.85Å; F242-R246 PolarHBondContact O-NH1 2.93Å; L243-R246 PolarHBondContact O-N 3.48Å; R246-Y248 VanDerWaalsContact C-N 3.32Å; R246-Y248 PolarHBondContact O-N 3.39Å; R246-F249 PolarHBondContact O-N 3.08Å; R246-M250 VanDerWaalsContact O-CG 3.28Å; R246-M250 WeakPolarHBondContact O-CG 3.49Å; R246-M250 PolarHBondContact O-N 2.86Å; R246-M287 PolarHBondContact NH1-SD 3.34Å
247	I	93.7	Very high	94.5	Very high	76 Å²	76	42 Å²	42	39%	0.39	21%	0.205	S	C	.	.	H	α-helix	trans	-60.7	-43.8	176.3	-72.4	179.7	0	0	0	110.2	L243 F249 M250 I251	L243-I247 HydrophobicContact CD1-CD1 3.76Å; L243-I247 HydrophobicContact CD1-CG1 3.91Å; L243-I247 HydrophobicContact CD2-CD1 4.04Å; L243-I247 HydrophobicContact CG-CD1 3.55Å; L243-I247 HydrophobicContact CG-CG1 4.05Å; L243-I247 WeakPolarHBondContact O-CB 3.43Å; L243-I247 WeakPolarHBondContact O-CG1 3.48Å; L243-I247 PolarHBondContact O-N 2.96Å; I247-F249 VanDerWaalsContact C-N 3.32Å; I247-F249 PolarHBondContact O-N 2.79Å; I247-M250 WeakPolarHBondContact O-CB 3.38Å; I247-M250 PolarHBondContact O-N 3.3Å; I247-M250 VanDerWaalsContact O-N 3.15Å; I247-I251 HydrophobicContact CG2-CD1 3.81Å; I247-I251 HydrophobicContact CG2-CG1 4.34Å; I247-I251 WeakPolarHBondContact O-CG1 3.29Å; I247-I251 PolarHBondContact O-N 3.19Å
248	Y	95.1	Very high	94.3	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.016	20%	0.197	C	C	.	.	H	α-helix	trans	-54.6	-49	175.5	174.5	-89	0	0	0	111.3	L73 D74 I77 L79 A244 V245 R246 M250 I251 C252	L73-Y248 HydrophobicContact CD1-CD2 4.28Å; L73-Y248 HydrophobicContact CD2-CD2 4.3Å; L73-Y248 HydrophobicContact CD2-CE2 3.97Å; L73-Y248 HydrophobicContact CG-CD2 4Å; L73-Y248 HydrophobicContact CG-CE2 3.73Å; D74-Y248 WeakPolarHBondContact OD1-CE2 3.34Å; D74-Y248 PolarHBondContact OD1-OH 3.37Å; I77-Y248 HydrophobicContact CB-CD2 4.24Å; I77-Y248 HydrophobicContact CD1-CD2 4.28Å; I77-Y248 HydrophobicContact CG2-CD2 4.47Å; L79-Y248 HydrophobicContact CD1-CD1 3.52Å; L79-Y248 HydrophobicContact CD1-CD2 3.84Å; L79-Y248 HydrophobicContact CD1-CE1 3.93Å; L79-Y248 HydrophobicContact CD1-CE2 4.22Å; L79-Y248 HydrophobicContact CD1-CG 3.48Å; L79-Y248 VanDerWaalsContact CD1-CG 3.48Å; L79-Y248 HydrophobicContact CG-CD2 4.34Å; L79-Y248 HydrophobicContact CG-CG 4.31Å; A244-Y248 VanDerWaalsContact O-CB 3.29Å; A244-Y248 WeakPolarHBondContact O-CB 3.4Å; A244-Y248 PolarHBondContact O-N 3.39Å; V245-Y248 PolarHBondContact O-N 2.88Å; R246-Y248 VanDerWaalsContact C-N 3.32Å; R246-Y248 PolarHBondContact O-N 3.39Å; Y248-M250 PolarHBondContact O-N 2.96Å; Y248-I251 PolarHBondContact O-N 3.23Å; Y248-C252 PolarHBondContact O-N 2.84Å; Y248-C252 PolarHBondContact O-SG 3.22Å
249	F	95.8	Very high	93.9	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.018	20%	0.195	C	C	.	.	H	α-helix	trans	-73.2	-24.7	178.4	-72.7	-62.2	0	0	0	114.6	W39 V245 R246 I247 C252 L253 Q279 F280 Y283 M284	W39-F249 PolarHBondContact NE1-O 2.85Å; V245-F249 HydrophobicContact CG1-CD2 4.03Å; V245-F249 HydrophobicContact CG1-CE2 3.89Å; V245-F249 WeakPolarHBondContact O-CD2 3.47Å; V245-F249 PolarHBondContact O-N 2.95Å; R246-F249 PolarHBondContact O-N 3.08Å; I247-F249 VanDerWaalsContact C-N 3.32Å; I247-F249 PolarHBondContact O-N 2.79Å; F249-C252 HydrophobicContact CD1-CB 4.44Å; F249-C252 PolarHBondContact O-N 3.42Å; F249-L253 PolarHBondContact O-N 3.14Å; F249-Q279 HydrophobicContact CE1-CB 4.49Å; F249-F280 HydrophobicContact CB-CD2 4.05Å; F249-F280 HydrophobicContact CB-CE2 4.09Å; F249-F280 HydrophobicContact CD1-CB 4.24Å; F249-F280 AromaticContact CD1-CD2 3.58Å; F249-F280 HydrophobicContact CD1-CD2 3.58Å; F249-F280 HydrophobicContact CD1-CE2 4.44Å; F249-F280 HydrophobicContact CD1-CG 4.35Å; F249-F280 AromaticContact CD2-CD2 3.88Å; F249-F280 HydrophobicContact CD2-CD2 3.88Å; F249-F280 HydrophobicContact CD2-CE2 4.22Å; F249-F280 HydrophobicContact CE1-CB 3.83Å; F249-F280 AromaticContact CE1-CD2 3.98Å; F249-F280 HydrophobicContact CE1-CD2 3.98Å; F249-F280 HydrophobicContact CE1-CG 4.33Å; F249-F280 HydrophobicContact CE2-CD2 4.26Å; F249-F280 AromaticContact CG-CD2 3.54Å; F249-F280 HydrophobicContact CG-CD2 3.54Å; F249-F280 AromaticContact CG-CE2 4Å; F249-F280 HydrophobicContact CG-CE2 4Å; F249-F280 HydrophobicContact CZ-CB 4.12Å; F249-F280 HydrophobicContact CZ-CD2 4.33Å; F249-Y283 HydrophobicContact CZ-CD2 4.01Å; F249-Y283 HydrophobicContact CZ-CG 4.44Å; F249-M284 HydrophobicContact CD2-CG 3.93Å; F249-M284 HydrophobicContact CD2-SD 3.97Å; F249-M284 HydrophobicContact CE2-CG 3.82Å; F249-M284 HydrophobicContact CE2-SD 4.26Å
250	M	94.9	Very high	93	Very high	120 Å²	120	37.4 Å²	37.4	59%	0.591	19%	0.19	S	C	*	.	H	α-helix	trans	-66.9	-40.3	168.9	-73.5	-63.3	-64.5	0	0	111.4	R246 I247 Y248 C252 L253	R246-M250 VanDerWaalsContact O-CG 3.28Å; R246-M250 WeakPolarHBondContact O-CG 3.49Å; R246-M250 PolarHBondContact O-N 2.86Å; I247-M250 WeakPolarHBondContact O-CB 3.38Å; I247-M250 PolarHBondContact O-N 3.3Å; I247-M250 VanDerWaalsContact O-N 3.15Å; Y248-M250 PolarHBondContact O-N 2.96Å; M250-C252 VanDerWaalsContact C-N 3.35Å; M250-L253 HydrophobicContact CE-CD1 4.12Å; M250-L253 WeakPolarHBondContact O-CB 3.15Å; M250-L253 PolarHBondContact O-N 2.71Å; M250-L253 HydrophobicContact SD-CD1 3.75Å
251	I	94.9	Very high	91.5	Very high	36 Å²	36	37.5 Å²	37.5	19%	0.185	19%	0.19	C	C	.	.	H	α-helix	trans	-65.9	-41	173.9	-65.9	166.6	0	0	0	110	F69 L73 I77 I247 Y248 L253 I254 G255	F69-I251 HydrophobicContact CB-CG2 3.73Å; F69-I251 HydrophobicContact CD1-CG1 4.5Å; F69-I251 HydrophobicContact CD1-CG2 3.54Å; F69-I251 HydrophobicContact CE1-CG2 4.4Å; F69-I251 HydrophobicContact CG-CG2 3.86Å; L73-I251 HydrophobicContact CD1-CB 4.22Å; L73-I251 HydrophobicContact CD1-CD1 4.17Å; L73-I251 HydrophobicContact CD1-CG2 3.68Å; L73-I251 HydrophobicContact CD2-CG2 4.01Å; I77-I251 HydrophobicContact CD1-CD1 4.39Å; I247-I251 HydrophobicContact CG2-CD1 3.81Å; I247-I251 HydrophobicContact CG2-CG1 4.34Å; I247-I251 WeakPolarHBondContact O-CG1 3.29Å; I247-I251 PolarHBondContact O-N 3.19Å; Y248-I251 PolarHBondContact O-N 3.23Å; I251-L253 PolarHBondContact O-N 2.78Å; I251-I254 PolarHBondContact O-N 3.31Å; I251-G255 PolarHBondContact O-N 3.45Å
252	C	95.1	Very high	89.8	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.4	-24.5	175.6	-70.8	0	0	0	0	114	W39 L73 Y248 F249 M250 I254 R256 T276	W39-C252 HydrophobicContact CZ2-CB 4.24Å; L73-C252 VanDerWaalsContact CD2-SG 3.58Å; Y248-C252 PolarHBondContact O-N 2.84Å; Y248-C252 PolarHBondContact O-SG 3.22Å; F249-C252 HydrophobicContact CD1-CB 4.44Å; F249-C252 PolarHBondContact O-N 3.42Å; M250-C252 VanDerWaalsContact C-N 3.35Å; C252-I254 PolarHBondContact O-N 3.42Å; C252-R256 HydrophobicContact CB-CG 4.09Å; C252-R256 WeakPolarHBondContact O-CB 3.15Å; C252-R256 PolarHBondContact O-N 3.05Å; C252-T276 HydrophobicContact CB-CG2 4.12Å
253	L	96	Very high	88	Confident	10 Å²	10	42.4 Å²	42.4	5%	0.052	23%	0.231	C	C	.	.	H	α-helix	trans	-58.4	-28	174.2	-74	170.7	0	0	0	112.3	W39 V42 F43 I46 F249 M250 I251 Q257	W39-L253 HydrophobicContact CD2-CD2 4.08Å; W39-L253 HydrophobicContact CG-CD2 4.02Å; W39-L253 HydrophobicContact CZ2-CD2 4.27Å; W39-L253 WeakPolarHBondContact O-CD2 3.31Å; V42-L253 HydrophobicContact CB-CD2 4.17Å; V42-L253 HydrophobicContact CG1-CD1 3.86Å; V42-L253 HydrophobicContact CG1-CD2 4.03Å; F43-L253 HydrophobicContact CB-CD2 3.98Å; I46-L253 HydrophobicContact CD1-CB 3.98Å; F249-L253 PolarHBondContact O-N 3.14Å; M250-L253 HydrophobicContact CE-CD1 4.12Å; M250-L253 WeakPolarHBondContact O-CB 3.15Å; M250-L253 PolarHBondContact O-N 2.71Å; M250-L253 HydrophobicContact SD-CD1 3.75Å; I251-L253 PolarHBondContact O-N 2.78Å; L253-Q257 WeakPolarHBondContact O-CG 3.29Å; L253-Q257 PolarHBondContact O-NE2 3.26Å
254	I	94.6	Very high	86.4	Confident	47 Å²	47	43 Å²	43	24%	0.241	24%	0.235	C	C	.	.	H	α-helix	trans	-108	-51.4	179.8	-51.8	170.3	0	0	0	110.7	F62 L65 I66 F69 I251 C252 R256 Q257	F62-I254 HydrophobicContact CE2-CG2 3.87Å; F62-I254 HydrophobicContact CZ-CG2 4.15Å; L65-I254 HydrophobicContact CD2-CB 4.48Å; L65-I254 HydrophobicContact CD2-CD1 4.42Å; L65-I254 HydrophobicContact CD2-CG2 3.31Å; I66-I254 HydrophobicContact CG1-CG2 4.48Å; I66-I254 WeakPolarHBondContact CG1-O 3.3Å; F69-I254 HydrophobicContact CD2-CB 4.27Å; F69-I254 HydrophobicContact CD2-CG2 4.17Å; F69-I254 HydrophobicContact CE2-CD1 4.31Å; I251-I254 PolarHBondContact O-N 3.31Å; C252-I254 PolarHBondContact O-N 3.42Å; I254-R256 PolarHBondContact O-N 3.45Å; I254-R256 VanDerWaalsContact O-N 3.13Å; I254-Q257 WeakPolarHBondContact O-CB 3.49Å; I254-Q257 WeakPolarHBondContact O-CG 3.37Å; I254-Q257 PolarHBondContact O-N 3.06Å; I254-Q257 VanDerWaalsContact O-N 3.16Å
255	G	91.9	Very high	85.2	Confident	2 Å²	2	45.9 Å²	45.9	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-23.9	-176	0	0	0	0	0	114.6	I66 D70 I251	I66-G255 WeakPolarHBondContact CG2-O 3.31Å; D70-G255 WeakPolarHBondContact CB-O 3.28Å; I251-G255 PolarHBondContact O-N 3.45Å
256	R	92.4	Very high	83.8	Confident	44 Å²	44	47.7 Å²	47.7	17%	0.166	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	15.7	-179.7	-60.1	-68.9	178.1	88.5	2.8	113.8	F43 D70 D74 C252 I254 T276	F43-R256 HydrophobicContact CE2-CB 4.4Å; F43-R256 VanDerWaalsContact CZ-O 3.29Å; F43-R256 WeakPolarHBondContact CZ-O 3.31Å; D70-R256 WeakPolarHBondContact OD1-CD 3.36Å; D70-R256 IonicContact OD1-CZ 2.91Å; D70-R256 IonicContact OD1-NE 3.2Å; D70-R256 PolarHBondContact OD1-NE 3.12Å; D70-R256 IonicContact OD1-NH2 2.95Å; D74-R256 IonicContact OD1-NH2 2.65Å; D74-R256 PolarHBondContact OD1-NH2 3.26Å; D74-R256 IonicContact OD2-NH2 3.84Å; D74-R256 PolarHBondContact OD2-NH2 2.99Å; D74-R256 VanDerWaalsContact OD2-NH2 3.11Å; C252-R256 HydrophobicContact CB-CG 4.09Å; C252-R256 WeakPolarHBondContact O-CB 3.15Å; C252-R256 PolarHBondContact O-N 3.05Å; I254-R256 PolarHBondContact O-N 3.45Å; I254-R256 VanDerWaalsContact O-N 3.13Å; R256-T276 HydrophobicContact CG-CG2 4.31Å; R256-T276 PolarHBondContact NH1-OG1 3.44Å
257	Q	93.1	Very high	82.7	Confident	6 Å²	6	47.4 Å²	47.4	3%	0.028	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-69	145.8	172.9	-69.7	-70.7	-19.7	0	0	111.3	F43 I46 F62 I66 L253 I254	F43-Q257 HydrophobicContact CE2-CG 4.22Å; F43-Q257 HydrophobicContact CZ-CG 4.34Å; F43-Q257 PolarHBondContact O-NE2 3.5Å; I46-Q257 HydrophobicContact CG2-CG 4.08Å; F62-Q257 HydrophobicContact CE1-CB 4.33Å; F62-Q257 HydrophobicContact CE1-CG 4.4Å; F62-Q257 HydrophobicContact CZ-CG 4.17Å; I66-Q257 HydrophobicContact CD1-CB 3.73Å; I66-Q257 HydrophobicContact CG1-CB 4.16Å; L253-Q257 WeakPolarHBondContact O-CG 3.29Å; L253-Q257 PolarHBondContact O-NE2 3.26Å; I254-Q257 WeakPolarHBondContact O-CB 3.49Å; I254-Q257 WeakPolarHBondContact O-CG 3.37Å; I254-Q257 PolarHBondContact O-N 3.06Å; I254-Q257 VanDerWaalsContact O-N 3.16Å
258	F	90.3	Very high	81.8	Confident	34 Å²	34	49.9 Å²	49.9	15%	0.149	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-83.9	124.6	179	-65.1	-89.9	0	0	0	110.7	F43 Y50 I268 D269 L270 P273	F43-F258 HydrophobicContact CZ-CD2 4.44Å; F43-F258 HydrophobicContact CZ-CE2 4.45Å; Y50-F258 WeakPolarHBondContact CE1-O 3.41Å; F258-I268 VanDerWaalsContact CD1-O 3.27Å; F258-I268 WeakPolarHBondContact CD1-O 3.41Å; F258-I268 WeakPolarHBondContact CE1-O 2.97Å; F258-D269 VanDerWaalsContact CB-OD1 3.25Å; F258-D269 WeakPolarHBondContact CB-OD1 2.96Å; F258-L270 WeakPolarHBondContact CD2-O 3.34Å; F258-L270 HydrophobicContact CE1-CB 4.25Å; F258-L270 HydrophobicContact CE2-CB 4.3Å; F258-L270 WeakPolarHBondContact CE2-O 3.35Å; F258-L270 HydrophobicContact CZ-CB 3.89Å; F258-L270 WeakPolarHBondContact CZ-O 3.38Å; F258-P273 HydrophobicContact CE2-CB 3.91Å; F258-P273 HydrophobicContact CZ-CB 4.33Å
259	I	85.8	Confident	80.9	Confident	11 Å²	11	52.5 Å²	52.5	6%	0.056	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-84	118.8	179.4	-62.8	178.2	0	0	0	108.6	E63 I66 R67 S266	E63-I259 HydrophobicContact CB-CD1 4.32Å; E63-I259 HydrophobicContact CG-CD1 4.3Å; E63-I259 HydrophobicContact CG-CG1 4.13Å; E63-I259 HydrophobicContact CG-CG2 3.83Å; E63-I259 WeakPolarHBondContact OE1-CG2 3.41Å; E63-I259 WeakPolarHBondContact OE2-CG2 3.49Å; I66-I259 HydrophobicContact CB-CD1 4.47Å; I66-I259 HydrophobicContact CD1-CD1 4.41Å; I66-I259 HydrophobicContact CD1-CG1 3.8Å; I66-I259 HydrophobicContact CG2-CD1 4.2Å; I66-I259 HydrophobicContact CG2-CG1 4.36Å; R67-I259 HydrophobicContact CG-CD1 4.38Å; I259-S266 PolarHBondContact N-OG 3.46Å; I259-S266 PolarHBondContact O-N 3.25Å
260	V	76.3	Confident	80.2	Confident	60 Å²	60	56.1 Å²	56.1	36%	0.364	34%	0.336	S	S	.	.			trans	-96.5	-34.3	-176.3	-179	0	0	0	0	111.3	Y50	Y50-V260 HydrophobicContact CE1-CB 4.17Å; Y50-V260 HydrophobicContact CE1-CG2 3.94Å; Y50-V260 PolarHBondContact OH-N 3.28Å
261	T	63.8	Low	79.6	Confident	79 Å²	79	55.5 Å²	55.5	49%	0.485	33%	0.327	S	S	.	.	S	Bend	trans	-137.4	86	-163.4	-18.2	0	0	0	0	111.9	Y50	Y50-T261 PolarHBondContact OH-N 3.02Å
262	G	60.4	Low	79.4	Confident	29 Å²	29	57.3 Å²	57.3	30%	0.299	34%	0.337	S	S	.	.	S	Bend	trans	-170.7	176.6	177.4	0	0	0	0	0	113.4	N264 P265	G262-N264 PolarHBondContact O-N 3.03Å; G262-N264 VanDerWaalsContact O-N 3.1Å; G262-P265 WeakPolarHBondContact O-CD 3.41Å
263	P	55.8	Low	79.2	Confident	112 Å²	112	57.6 Å²	57.6	73%	0.727	34%	0.338	S	S	*	.	S	Bend	trans	-64.7	-14.1	-177.9	23.3	-32.1	0	0	0	114.3
264	N	59.9	Low	79	Confident	116 Å²	116	61.9 Å²	61.9	62%	0.62	36%	0.361	S	S	*	.	S	Bend	trans	-138.1	81.9	174.1	-72.7	-40.4	0	0	0	108.9	G262	G262-N264 PolarHBondContact O-N 3.03Å; G262-N264 VanDerWaalsContact O-N 3.1Å
265	P	68.7	Low	78.9	Confident	81 Å²	81	64.5 Å²	64.5	53%	0.526	38%	0.379	S	S	.	.			trans	-66.2	153.2	178	28.2	-33.1	0	0	0	110.8	G262 G267	G262-P265 WeakPolarHBondContact O-CD 3.41Å; P265-G267 PolarHBondContact O-N 3.33Å
266	S	67.5	Low	78.9	Confident	40 Å²	40	64.7 Å²	64.7	28%	0.28	38%	0.379	S	S	.	.			trans	-60.3	128	169.3	-65.2	0	0	0	0	108.7	I259 I268	I259-S266 PolarHBondContact N-OG 3.46Å; I259-S266 PolarHBondContact O-N 3.25Å; S266-I268 PolarHBondContact O-N 3.37Å; S266-I268 VanDerWaalsContact O-N 3.15Å
267	G	69.4	Low	79.1	Confident	85 Å²	85	64.6 Å²	64.6	88%	0.876	38%	0.381	S	S	*	.	S	Bend	trans	-57	-35.2	-170.7	0	0	0	0	0	114.4	P265	P265-G267 PolarHBondContact O-N 3.33Å
268	I	75.1	Confident	79.1	Confident	127 Å²	127	68.1 Å²	68.1	65%	0.651	40%	0.403	S	S	*	.	S	Bend	trans	-130.4	122.9	171	-55.7	176.8	0	0	0	107.6	F258 S266 L270	F258-I268 VanDerWaalsContact CD1-O 3.27Å; F258-I268 WeakPolarHBondContact CD1-O 3.41Å; F258-I268 WeakPolarHBondContact CE1-O 2.97Å; S266-I268 PolarHBondContact O-N 3.37Å; S266-I268 VanDerWaalsContact O-N 3.15Å; I268-L270 HydrophobicContact CG2-CD2 4.04Å; I268-L270 HydrophobicContact CG2-CG 3.94Å; I268-L270 PolarHBondContact O-N 3.48Å
269	D	77.6	Confident	79.3	Confident	60 Å²	60	68.8 Å²	68.8	32%	0.321	41%	0.407	S	S	.	.			trans	-90.3	94.5	176.6	-176.1	17.5	0	0	0	110.7	R51 F258	R51-D269 IonicContact CZ-OD1 3.84Å; R51-D269 IonicContact CZ-OD2 3.67Å; R51-D269 IonicContact NH1-OD1 3.65Å; R51-D269 IonicContact NH1-OD2 3.82Å; R51-D269 PolarHBondContact NH1-OD2 3.45Å; R51-D269 VanDerWaalsContact NH2-CG 3.26Å; R51-D269 IonicContact NH2-OD1 3.17Å; R51-D269 PolarHBondContact NH2-OD1 3.31Å; R51-D269 IonicContact NH2-OD2 2.66Å; R51-D269 PolarHBondContact NH2-OD2 2.86Å; R51-D269 VanDerWaalsContact NH2-OD2 3.08Å; F258-D269 VanDerWaalsContact CB-OD1 3.25Å; F258-D269 WeakPolarHBondContact CB-OD1 2.96Å
270	L	80.8	Confident	79.8	Confident	79 Å²	79	68.6 Å²	68.6	41%	0.414	41%	0.406	S	S	.	.			trans	-96.5	127.8	171.6	-62	173.1	0	0	0	108.1	F258 I268 L272	F258-L270 WeakPolarHBondContact CD2-O 3.34Å; F258-L270 HydrophobicContact CE1-CB 4.25Å; F258-L270 HydrophobicContact CE2-CB 4.3Å; F258-L270 WeakPolarHBondContact CE2-O 3.35Å; F258-L270 HydrophobicContact CZ-CB 3.89Å; F258-L270 WeakPolarHBondContact CZ-O 3.38Å; I268-L270 HydrophobicContact CG2-CD2 4.04Å; I268-L270 HydrophobicContact CG2-CG 3.94Å; I268-L270 PolarHBondContact O-N 3.48Å; L270-L272 WeakPolarHBondContact CB-O 3.44Å; L270-L272 PolarHBondContact O-N 2.92Å
271	W	82.9	Confident	80.7	Confident	107 Å²	107	67.6 Å²	67.6	41%	0.405	40%	0.398	S	S	.	.	S	Bend	trans	-58.8	-24.2	172.9	-79.6	76.6	0	0	0	112.8	L44 Y52	L44-W271 VanDerWaalsContact CD2-O 3.23Å; L44-W271 WeakPolarHBondContact CD2-O 3.32Å; Y52-W271 AromaticContact CE2-CH2 3.84Å; Y52-W271 HydrophobicContact CE2-CH2 3.84Å
272	L	89.6	Confident	82.1	Confident	75 Å²	75	67.8 Å²	67.8	39%	0.393	40%	0.399	S	S	.	.	S	Bend	trans	-114.2	127.9	179.4	-70.9	171.2	0	0	0	111.4	T40 L44 L270 I274 M277	T40-L272 HydrophobicContact CG2-CD2 3.77Å; L44-L272 HydrophobicContact CD1-CD2 4.1Å; L44-L272 HydrophobicContact CD2-CD2 3.91Å; L44-L272 HydrophobicContact CG-CD2 4.22Å; L270-L272 WeakPolarHBondContact CB-O 3.44Å; L270-L272 PolarHBondContact O-N 2.92Å; L272-I274 VanDerWaalsContact C-N 3.3Å; L272-I274 PolarHBondContact O-N 2.92Å; L272-M277 HydrophobicContact CD2-SD 4.49Å
273	P	91.7	Very high	83.7	Confident	5 Å²	5	68.7 Å²	68.7	3%	0.032	39%	0.394	C	S	.	.			trans	-83.7	73	-179.9	36.5	-36.8	0	0	0	110.3	W39 F43 F258 T275 T276 M277	W39-P273 HydrophobicContact CH2-CG 3.67Å; W39-P273 HydrophobicContact CZ3-CG 3.81Å; F43-P273 HydrophobicContact CD1-CG 3.82Å; F43-P273 HydrophobicContact CD2-CG 4.02Å; F43-P273 HydrophobicContact CE1-CB 4.16Å; F43-P273 VanDerWaalsContact CE1-CD 3.43Å; F43-P273 HydrophobicContact CE1-CG 3.57Å; F43-P273 HydrophobicContact CE2-CB 4.19Å; F43-P273 HydrophobicContact CE2-CG 3.76Å; F43-P273 HydrophobicContact CG-CG 4.05Å; F43-P273 HydrophobicContact CZ-CB 3.79Å; F43-P273 HydrophobicContact CZ-CG 3.52Å; F258-P273 HydrophobicContact CE2-CB 3.91Å; F258-P273 HydrophobicContact CZ-CB 4.33Å; P273-T275 VanDerWaalsContact C-N 3.31Å; P273-T275 PolarHBondContact O-N 3.06Å; P273-T276 PolarHBondContact O-N 3.07Å; P273-M277 HydrophobicContact CG-CG 4.44Å; P273-M277 WeakPolarHBondContact O-CG 3.36Å; P273-M277 PolarHBondContact O-N 3.45Å
274	I	92	Very high	85.6	Confident	101 Å²	101	63.5 Å²	63.5	52%	0.518	36%	0.36	S	S	.	.	H	α-helix	trans	-52.6	-47	-172.1	-62.7	172.1	0	0	0	111.8	L272 T276 M277 V278	L272-I274 VanDerWaalsContact C-N 3.3Å; L272-I274 PolarHBondContact O-N 2.92Å; I274-T276 VanDerWaalsContact C-N 3.34Å; I274-T276 PolarHBondContact O-N 3.27Å; I274-M277 WeakPolarHBondContact O-CB 3.18Å; I274-M277 PolarHBondContact O-N 3.2Å; I274-M277 VanDerWaalsContact O-N 3.16Å; I274-V278 WeakPolarHBondContact O-CG2 3.18Å; I274-V278 PolarHBondContact O-N 3.16Å
275	T	91	Very high	87.3	Confident	101 Å²	101	58.3 Å²	58.3	62%	0.62	33%	0.333	S	S	*	.	H	α-helix	trans	-60	-42.7	179.4	-52.1	0	0	0	0	112.3	P273 V278 Q279	P273-T275 VanDerWaalsContact C-N 3.31Å; P273-T275 PolarHBondContact O-N 3.06Å; T275-V278 PolarHBondContact O-N 3.21Å; T275-Q279 WeakPolarHBondContact O-CG 3.39Å; T275-Q279 PolarHBondContact O-N 3.27Å
276	T	93.4	Very high	88.5	Confident	6 Å²	6	58.2 Å²	58.2	4%	0.037	32%	0.322	C	S	.	.	H	α-helix	trans	-69.6	-34.1	177.3	-58.1	0	0	0	0	111.6	W39 C252 R256 P273 I274 Q279 F280	W39-T276 HydrophobicContact CH2-CG2 3.55Å; W39-T276 HydrophobicContact CZ2-CG2 3.71Å; C252-T276 HydrophobicContact CB-CG2 4.12Å; R256-T276 HydrophobicContact CG-CG2 4.31Å; R256-T276 PolarHBondContact NH1-OG1 3.44Å; P273-T276 PolarHBondContact O-N 3.07Å; I274-T276 VanDerWaalsContact C-N 3.34Å; I274-T276 PolarHBondContact O-N 3.27Å; T276-Q279 PolarHBondContact O-N 2.96Å; T276-F280 WeakPolarHBondContact O-CB 3.12Å; T276-F280 PolarHBondContact O-N 2.89Å
277	M	95.1	Very high	89.8	Confident	42 Å²	42	56.3 Å²	56.3	21%	0.207	31%	0.309	C	S	.	.	H	α-helix	trans	-64.4	-39.3	172.6	-66.6	176.2	66.9	0	0	111.8	L36 W39 L272 P273 I274 F280 L281	L36-M277 HydrophobicContact CD1-CB 4.23Å; L36-M277 HydrophobicContact CD1-CE 4.23Å; L36-M277 HydrophobicContact CD1-CG 4.21Å; L36-M277 HydrophobicContact CD2-CE 4.27Å; L36-M277 HydrophobicContact CG-CE 4.37Å; W39-M277 HydrophobicContact CZ3-CG 3.91Å; L272-M277 HydrophobicContact CD2-SD 4.49Å; P273-M277 HydrophobicContact CG-CG 4.44Å; P273-M277 WeakPolarHBondContact O-CG 3.36Å; P273-M277 PolarHBondContact O-N 3.45Å; I274-M277 WeakPolarHBondContact O-CB 3.18Å; I274-M277 PolarHBondContact O-N 3.2Å; I274-M277 VanDerWaalsContact O-N 3.16Å; M277-F280 WeakPolarHBondContact O-CB 3.27Å; M277-F280 PolarHBondContact O-N 3.34Å; M277-L281 WeakPolarHBondContact O-CG 3.38Å; M277-L281 PolarHBondContact O-N 3.23Å
278	V	94.5	Very high	91	Very high	81 Å²	81	54 Å²	54	49%	0.491	28%	0.275	S	S	.	.	H	α-helix	trans	-64.9	-44.5	172.7	178.1	0	0	0	0	110.9	I274 T275 F280 L281 V282	I274-V278 WeakPolarHBondContact O-CG2 3.18Å; I274-V278 PolarHBondContact O-N 3.16Å; T275-V278 PolarHBondContact O-N 3.21Å; V278-F280 VanDerWaalsContact C-N 3.28Å; V278-F280 PolarHBondContact O-N 3.39Å; V278-L281 PolarHBondContact O-N 3.33Å; V278-V282 WeakPolarHBondContact O-CG2 3.44Å; V278-V282 PolarHBondContact O-N 2.78Å
279	Q	93.9	Very high	91.9	Very high	47 Å²	47	51.3 Å²	51.3	22%	0.22	26%	0.264	C	S	.	.	H	α-helix	trans	-58.2	-41.3	173.9	-72.4	178.4	-30.6	0	0	111.6	F249 T275 T276 V282 Y283	F249-Q279 HydrophobicContact CE1-CB 4.49Å; T275-Q279 WeakPolarHBondContact O-CG 3.39Å; T275-Q279 PolarHBondContact O-N 3.27Å; T276-Q279 PolarHBondContact O-N 2.96Å; Q279-V282 PolarHBondContact O-N 3.49Å; Q279-Y283 HydrophobicContact CB-CD2 4.37Å; Q279-Y283 HydrophobicContact CB-CE2 4.49Å; Q279-Y283 VanDerWaalsContact O-CD2 3.27Å; Q279-Y283 WeakPolarHBondContact O-CD2 3.28Å; Q279-Y283 PolarHBondContact O-N 3.33Å
280	F	95.5	Very high	92.6	Very high	8 Å²	8	48.5 Å²	48.5	4%	0.035	25%	0.249	C	C	.	.	H	α-helix	trans	-58.4	-52.3	174.8	-170.9	-80.1	0	0	0	111.3	V32 Q35 L36 W39 F249 T276 M277 V278 V282 Y283 M284	V32-F280 HydrophobicContact CG1-CD1 3.88Å; V32-F280 HydrophobicContact CG1-CE1 3.63Å; Q35-F280 HydrophobicContact CB-CE1 4.27Å; Q35-F280 HydrophobicContact CB-CZ 4.07Å; L36-F280 HydrophobicContact CB-CD1 4.02Å; L36-F280 HydrophobicContact CB-CE1 3.84Å; L36-F280 HydrophobicContact CD1-CB 4.21Å; L36-F280 HydrophobicContact CD1-CD1 3.68Å; L36-F280 HydrophobicContact CD1-CE1 4.22Å; L36-F280 HydrophobicContact CD1-CG 4Å; L36-F280 HydrophobicContact CG-CD1 4.41Å; W39-F280 HydrophobicContact CB-CE2 3.93Å; W39-F280 HydrophobicContact CB-CZ 4.19Å; W39-F280 AromaticContact CD1-CE2 3.82Å; W39-F280 HydrophobicContact CD2-CD2 4.25Å; W39-F280 HydrophobicContact CD2-CE2 4.44Å; W39-F280 HydrophobicContact CG-CD2 4.06Å; W39-F280 AromaticContact CG-CE2 3.78Å; W39-F280 HydrophobicContact CG-CE2 3.78Å; F249-F280 HydrophobicContact CB-CD2 4.05Å; F249-F280 HydrophobicContact CB-CE2 4.09Å; F249-F280 HydrophobicContact CD1-CB 4.24Å; F249-F280 AromaticContact CD1-CD2 3.58Å; F249-F280 HydrophobicContact CD1-CD2 3.58Å; F249-F280 HydrophobicContact CD1-CE2 4.44Å; F249-F280 HydrophobicContact CD1-CG 4.35Å; F249-F280 AromaticContact CD2-CD2 3.88Å; F249-F280 HydrophobicContact CD2-CD2 3.88Å; F249-F280 HydrophobicContact CD2-CE2 4.22Å; F249-F280 HydrophobicContact CE1-CB 3.83Å; F249-F280 AromaticContact CE1-CD2 3.98Å; F249-F280 HydrophobicContact CE1-CD2 3.98Å; F249-F280 HydrophobicContact CE1-CG 4.33Å; F249-F280 HydrophobicContact CE2-CD2 4.26Å; F249-F280 AromaticContact CG-CD2 3.54Å; F249-F280 HydrophobicContact CG-CD2 3.54Å; F249-F280 AromaticContact CG-CE2 4Å; F249-F280 HydrophobicContact CG-CE2 4Å; F249-F280 HydrophobicContact CZ-CB 4.12Å; F249-F280 HydrophobicContact CZ-CD2 4.33Å; T276-F280 WeakPolarHBondContact O-CB 3.12Å; T276-F280 PolarHBondContact O-N 2.89Å; M277-F280 WeakPolarHBondContact O-CB 3.27Å; M277-F280 PolarHBondContact O-N 3.34Å; V278-F280 VanDerWaalsContact C-N 3.28Å; V278-F280 PolarHBondContact O-N 3.39Å; F280-V282 VanDerWaalsContact C-N 3.29Å; F280-V282 PolarHBondContact O-N 2.91Å; F280-Y283 PolarHBondContact O-N 3.39Å; F280-M284 HydrophobicContact CD1-CB 4.13Å; F280-M284 HydrophobicContact CD1-CG 3.8Å; F280-M284 HydrophobicContact CD2-CG 4Å; F280-M284 HydrophobicContact CE1-CB 4.02Å; F280-M284 HydrophobicContact CE1-CG 3.64Å; F280-M284 HydrophobicContact CE2-CG 3.84Å; F280-M284 HydrophobicContact CE2-SD 4.49Å; F280-M284 HydrophobicContact CG-CG 3.98Å; F280-M284 HydrophobicContact CZ-CB 4.47Å; F280-M284 HydrophobicContact CZ-CE 4.06Å; F280-M284 HydrophobicContact CZ-CG 3.67Å; F280-M284 HydrophobicContact CZ-SD 4.4Å; F280-M284 WeakPolarHBondContact O-CB 3.47Å; F280-M284 WeakPolarHBondContact O-CG 3.35Å; F280-M284 PolarHBondContact O-N 3.27Å
281	L	95.3	Very high	93.2	Very high	39 Å²	39	47.9 Å²	47.9	20%	0.204	24%	0.244	C	C	.	.	H	α-helix	trans	-56	-43.8	177.8	-74.6	171	0	0	0	112.1	W29 V32 L36 M277 V278 G285	W29-L281 HydrophobicContact CE3-CD2 4.38Å; W29-L281 HydrophobicContact CH2-CD1 4.35Å; W29-L281 HydrophobicContact CZ3-CD1 3.91Å; W29-L281 HydrophobicContact CZ3-CD2 4.02Å; V32-L281 HydrophobicContact CB-CD2 4.45Å; V32-L281 HydrophobicContact CG1-CD2 4.04Å; L36-L281 HydrophobicContact CD2-CD1 4.35Å; L36-L281 HydrophobicContact CD2-CD2 3.81Å; L36-L281 HydrophobicContact CD2-CG 4.01Å; M277-L281 WeakPolarHBondContact O-CG 3.38Å; M277-L281 PolarHBondContact O-N 3.23Å; V278-L281 PolarHBondContact O-N 3.33Å; L281-G285 VanDerWaalsContact O-CA 3.27Å; L281-G285 WeakPolarHBondContact O-CA 3.21Å; L281-G285 PolarHBondContact O-N 2.98Å
282	V	93.8	Very high	93.5	Very high	83 Å²	83	44.4 Å²	44.4	50%	0.503	24%	0.238	S	C	.	.	H	α-helix	trans	-67.4	-55.8	-179.6	173.9	0	0	0	0	111.5	V278 Q279 F280 W286	V278-V282 WeakPolarHBondContact O-CG2 3.44Å; V278-V282 PolarHBondContact O-N 2.78Å; Q279-V282 PolarHBondContact O-N 3.49Å; F280-V282 VanDerWaalsContact C-N 3.29Å; F280-V282 PolarHBondContact O-N 2.91Å; V282-W286 WeakPolarHBondContact O-CB 3.29Å; V282-W286 PolarHBondContact O-N 3.09Å
283	Y	95	Very high	93.7	Very high	47 Å²	47	42 Å²	42	18%	0.184	23%	0.226	C	C	.	.	H	α-helix	trans	-74.1	-40.4	-174	-70.6	-63.2	0	0	0	113	L79 T80 L83 F249 Q279 F280 W286 M287	L79-Y283 HydrophobicContact CB-CD1 4.09Å; L79-Y283 HydrophobicContact CB-CE1 3.97Å; L79-Y283 HydrophobicContact CD1-CD1 4.42Å; L79-Y283 HydrophobicContact CD1-CD2 4.33Å; L79-Y283 HydrophobicContact CD1-CG 4.23Å; T80-Y283 PolarHBondContact OG1-OH 2.92Å; T80-Y283 VanDerWaalsContact OG1-OH 3.07Å; L83-Y283 HydrophobicContact CD1-CD1 3.71Å; L83-Y283 HydrophobicContact CD1-CG 4.48Å; F249-Y283 HydrophobicContact CZ-CD2 4.01Å; F249-Y283 HydrophobicContact CZ-CG 4.44Å; Q279-Y283 HydrophobicContact CB-CD2 4.37Å; Q279-Y283 HydrophobicContact CB-CE2 4.49Å; Q279-Y283 VanDerWaalsContact O-CD2 3.27Å; Q279-Y283 WeakPolarHBondContact O-CD2 3.28Å; Q279-Y283 PolarHBondContact O-N 3.33Å; F280-Y283 PolarHBondContact O-N 3.39Å; Y283-W286 HydrophobicContact CD1-CE3 4.49Å; Y283-W286 PolarHBondContact O-N 3.31Å; Y283-M287 WeakPolarHBondContact O-CB 3.48Å; Y283-M287 PolarHBondContact O-N 3.18Å
284	M	95.4	Very high	93.7	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.02	24%	0.235	C	C	.	.	H	α-helix	trans	-69.8	-38.6	175	-66.3	-69.5	-68.8	0	0	111.2	V32 V245 F249 F280 M287 K288	V32-M284 HydrophobicContact CG1-CB 3.93Å; V32-M284 HydrophobicContact CG2-CB 4.4Å; V245-M284 HydrophobicContact CG1-CG 4.42Å; V245-M284 HydrophobicContact CG1-SD 3.52Å; V245-M284 VanDerWaalsContact CG1-SD 3.52Å; F249-M284 HydrophobicContact CD2-CG 3.93Å; F249-M284 HydrophobicContact CD2-SD 3.97Å; F249-M284 HydrophobicContact CE2-CG 3.82Å; F249-M284 HydrophobicContact CE2-SD 4.26Å; F280-M284 HydrophobicContact CD1-CB 4.13Å; F280-M284 HydrophobicContact CD1-CG 3.8Å; F280-M284 HydrophobicContact CD2-CG 4Å; F280-M284 HydrophobicContact CE1-CB 4.02Å; F280-M284 HydrophobicContact CE1-CG 3.64Å; F280-M284 HydrophobicContact CE2-CG 3.84Å; F280-M284 HydrophobicContact CE2-SD 4.49Å; F280-M284 HydrophobicContact CG-CG 3.98Å; F280-M284 HydrophobicContact CZ-CB 4.47Å; F280-M284 HydrophobicContact CZ-CE 4.06Å; F280-M284 HydrophobicContact CZ-CG 3.67Å; F280-M284 HydrophobicContact CZ-SD 4.4Å; F280-M284 WeakPolarHBondContact O-CB 3.47Å; F280-M284 WeakPolarHBondContact O-CG 3.35Å; F280-M284 PolarHBondContact O-N 3.27Å; M284-M287 HydrophobicContact CE-CE 3.59Å; M284-M287 PolarHBondContact O-N 2.94Å; M284-M287 HydrophobicContact SD-CE 3.69Å; M284-K288 WeakPolarHBondContact O-CB 3.18Å; M284-K288 VanDerWaalsContact O-CG 3.27Å; M284-K288 WeakPolarHBondContact O-CG 3.27Å; M284-K288 PolarHBondContact O-N 2.7Å
285	G	94.7	Very high	93.7	Very high	6 Å²	6	43 Å²	43	6%	0.062	23%	0.231	C	C	.	.	H	α-helix	trans	-61.1	-46.1	173.3	0	0	0	0	0	111.8	L281 M287 K288 V289	L281-G285 VanDerWaalsContact O-CA 3.27Å; L281-G285 WeakPolarHBondContact O-CA 3.21Å; L281-G285 PolarHBondContact O-N 2.98Å; G285-M287 PolarHBondContact O-N 2.94Å; G285-K288 WeakPolarHBondContact O-CB 3.48Å; G285-K288 PolarHBondContact O-N 3.11Å; G285-K288 VanDerWaalsContact O-N 3.12Å; G285-V289 WeakPolarHBondContact O-CG2 3.2Å; G285-V289 PolarHBondContact O-N 3.33Å
286	W	94.8	Very high	93.7	Very high	79 Å²	79	38.2 Å²	38.2	30%	0.299	20%	0.203	S	C	.	.	H	α-helix	trans	-65.1	-39.7	178.4	-163.9	20	0	0	0	112.7	T80 L83 G84 V87 V282 Y283 K288 V289 A290	T80-W286 HydrophobicContact CG2-CH2 4.32Å; T80-W286 HydrophobicContact CG2-CZ3 4.1Å; T80-W286 WeakPolarHBondContact O-CH2 3.28Å; L83-W286 HydrophobicContact CB-CD2 3.96Å; L83-W286 HydrophobicContact CB-CE3 3.57Å; L83-W286 HydrophobicContact CB-CH2 4.15Å; L83-W286 HydrophobicContact CB-CZ3 3.68Å; L83-W286 HydrophobicContact CD1-CE3 3.96Å; L83-W286 HydrophobicContact CG-CE3 4.31Å; G84-W286 VanDerWaalsContact CA-CZ2 3.48Å; V87-W286 HydrophobicContact CG2-CG 4.26Å; V282-W286 WeakPolarHBondContact O-CB 3.29Å; V282-W286 PolarHBondContact O-N 3.09Å; Y283-W286 HydrophobicContact CD1-CE3 4.49Å; Y283-W286 PolarHBondContact O-N 3.31Å; W286-K288 VanDerWaalsContact C-N 3.33Å; W286-V289 WeakPolarHBondContact O-CB 3.47Å; W286-V289 PolarHBondContact O-N 3.07Å; W286-A290 PolarHBondContact O-N 3.44Å
287	M	95.4	Very high	93.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.4	-42.8	170.4	-176.1	-172.7	67	0	0	111.5	L83 F242 V245 R246 Y283 M284 G285 V289 A290 E291	L83-M287 HydrophobicContact CD2-CB 3.85Å; L83-M287 HydrophobicContact CD2-CG 4.44Å; F242-M287 HydrophobicContact CB-SD 4.36Å; F242-M287 HydrophobicContact CD1-CG 3.51Å; F242-M287 HydrophobicContact CD1-SD 3.66Å; F242-M287 HydrophobicContact CE1-CG 3.7Å; F242-M287 HydrophobicContact CE1-SD 4.39Å; F242-M287 HydrophobicContact CG-SD 4.31Å; V245-M287 HydrophobicContact CB-SD 3.88Å; V245-M287 HydrophobicContact CG1-SD 4.06Å; V245-M287 HydrophobicContact CG2-SD 4.21Å; R246-M287 PolarHBondContact NH1-SD 3.34Å; Y283-M287 WeakPolarHBondContact O-CB 3.48Å; Y283-M287 PolarHBondContact O-N 3.18Å; M284-M287 HydrophobicContact CE-CE 3.59Å; M284-M287 PolarHBondContact O-N 2.94Å; M284-M287 HydrophobicContact SD-CE 3.69Å; G285-M287 PolarHBondContact O-N 2.94Å; M287-V289 VanDerWaalsContact C-N 3.32Å; M287-V289 PolarHBondContact O-N 3.43Å; M287-A290 PolarHBondContact O-N 3.19Å; M287-A290 VanDerWaalsContact O-N 3.17Å; M287-E291 PolarHBondContact O-N 3.46Å
288	K	93.9	Very high	93.4	Very high	38 Å²	38	36.8 Å²	36.8	17%	0.165	20%	0.198	C	C	.	.	H	α-helix	trans	-64.9	-32.7	178.5	-79.8	-72	177.6	-166.9	0	113.2	A31 V32 M284 G285 W286 A290 E291 A292	A31-K288 HydrophobicContact CB-CB 4.11Å; A31-K288 HydrophobicContact CB-CD 4.32Å; A31-K288 HydrophobicContact CB-CG 4.15Å; V32-K288 HydrophobicContact CG2-CG 4.2Å; M284-K288 WeakPolarHBondContact O-CB 3.18Å; M284-K288 VanDerWaalsContact O-CG 3.27Å; M284-K288 WeakPolarHBondContact O-CG 3.27Å; M284-K288 PolarHBondContact O-N 2.7Å; G285-K288 WeakPolarHBondContact O-CB 3.48Å; G285-K288 PolarHBondContact O-N 3.11Å; G285-K288 VanDerWaalsContact O-N 3.12Å; W286-K288 VanDerWaalsContact C-N 3.33Å; K288-A290 VanDerWaalsContact C-N 3.34Å; K288-E291 WeakPolarHBondContact CD-OE2 3.37Å; K288-E291 VanDerWaalsContact CE-OE2 3.29Å; K288-E291 WeakPolarHBondContact CE-OE2 3.26Å; K288-E291 IonicContact NZ-OE1 3.81Å; K288-E291 PolarHBondContact NZ-OE1 2.94Å; K288-E291 IonicContact NZ-OE2 2.74Å; K288-E291 PolarHBondContact NZ-OE2 3.32Å; K288-E291 PolarHBondContact O-N 3.14Å; K288-A292 PolarHBondContact O-N 2.86Å
289	V	93	Very high	93.1	Very high	70 Å²	70	37.7 Å²	37.7	42%	0.424	20%	0.197	S	C	.	.	H	α-helix	trans	-58.4	-47.3	170.8	172.7	0	0	0	0	110.5	V87 G285 W286 M287 L293	V87-V289 HydrophobicContact CG1-CG1 4.48Å; G285-V289 WeakPolarHBondContact O-CG2 3.2Å; G285-V289 PolarHBondContact O-N 3.33Å; W286-V289 WeakPolarHBondContact O-CB 3.47Å; W286-V289 PolarHBondContact O-N 3.07Å; M287-V289 VanDerWaalsContact C-N 3.32Å; M287-V289 PolarHBondContact O-N 3.43Å; V289-L293 HydrophobicContact CG1-CD1 3.98Å; V289-L293 WeakPolarHBondContact O-CB 3.32Å; V289-L293 VanDerWaalsContact O-CG 3.27Å; V289-L293 WeakPolarHBondContact O-CG 3.37Å; V289-L293 PolarHBondContact O-N 3.14Å
290	A	93.3	Very high	92.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66.2	-39.9	176	0	0	0	0	0	112	F86 V87 V90 W286 M287 K288 A292 L293 L294	F86-A290 HydrophobicContact CD1-CB 3.75Å; F86-A290 HydrophobicContact CE1-CB 3.51Å; V87-A290 HydrophobicContact CG2-CB 3.83Å; V90-A290 HydrophobicContact CB-CB 4.48Å; V90-A290 HydrophobicContact CG2-CB 4.39Å; W286-A290 PolarHBondContact O-N 3.44Å; M287-A290 PolarHBondContact O-N 3.19Å; M287-A290 VanDerWaalsContact O-N 3.17Å; K288-A290 VanDerWaalsContact C-N 3.34Å; A290-A292 PolarHBondContact O-N 3.48Å; A290-L293 PolarHBondContact O-N 3.34Å; A290-L294 WeakPolarHBondContact O-CG 3.39Å; A290-L294 PolarHBondContact O-N 3.47Å
291	E	92.6	Very high	92.3	Very high	67 Å²	67	42.5 Å²	42.5	31%	0.313	22%	0.224	S	C	.	.	H	α-helix	trans	-58.6	-47.2	178.7	-165.5	179.5	148.4	0	0	112.2	F242 M287 K288 L293 L294	F242-E291 HydrophobicContact CZ-CB 4.09Å; F242-E291 HydrophobicContact CZ-CG 4.15Å; M287-E291 PolarHBondContact O-N 3.46Å; K288-E291 WeakPolarHBondContact CD-OE2 3.37Å; K288-E291 VanDerWaalsContact CE-OE2 3.29Å; K288-E291 WeakPolarHBondContact CE-OE2 3.26Å; K288-E291 IonicContact NZ-OE1 3.81Å; K288-E291 PolarHBondContact NZ-OE1 2.94Å; K288-E291 IonicContact NZ-OE2 2.74Å; K288-E291 PolarHBondContact NZ-OE2 3.32Å; K288-E291 PolarHBondContact O-N 3.14Å; E291-L293 VanDerWaalsContact C-N 3.34Å; E291-L293 PolarHBondContact O-N 3.49Å; E291-L294 PolarHBondContact O-N 2.9Å
292	A	90.8	Very high	91.9	Very high	34 Å²	34	41.7 Å²	41.7	28%	0.281	22%	0.22	S	C	.	.	H	α-helix	trans	-65.2	-35.9	177.3	0	0	0	0	0	112.4	K288 A290	K288-A292 PolarHBondContact O-N 2.86Å; A290-A292 PolarHBondContact O-N 3.48Å
293	L	92.1	Very high	91.8	Very high	24 Å²	24	38 Å²	38	13%	0.126	20%	0.198	C	C	.	.	H	α-helix	trans	-84.3	-7	-178.1	-64.5	178.1	0	0	0	114.1	V90 V91 W94 V289 A290 E291 N295	V90-L293 HydrophobicContact CG1-CB 3.61Å; V91-L293 HydrophobicContact CG2-CD1 3.77Å; W94-L293 HydrophobicContact CD2-CD2 4.42Å; W94-L293 HydrophobicContact CG-CD2 4.03Å; V289-L293 HydrophobicContact CG1-CD1 3.98Å; V289-L293 WeakPolarHBondContact O-CB 3.32Å; V289-L293 VanDerWaalsContact O-CG 3.27Å; V289-L293 WeakPolarHBondContact O-CG 3.37Å; V289-L293 PolarHBondContact O-N 3.14Å; A290-L293 PolarHBondContact O-N 3.34Å; E291-L293 VanDerWaalsContact C-N 3.34Å; E291-L293 PolarHBondContact O-N 3.49Å; L293-N295 VanDerWaalsContact C-N 3.32Å; L293-N295 PolarHBondContact O-N 3.41Å
294	L	91.9	Very high	91.7	Very high	44 Å²	44	36.3 Å²	36.3	23%	0.23	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-38.2	179.2	-88.4	170.9	0	0	0	112	F86 V90 V233 F242 A290 E291	F86-L294 HydrophobicContact CZ-CD1 4.42Å; F86-L294 HydrophobicContact CZ-CD2 4.32Å; V90-L294 HydrophobicContact CG1-CG 4.49Å; V90-L294 HydrophobicContact CG2-CD2 3.94Å; V90-L294 HydrophobicContact CG2-CG 4.44Å; V233-L294 HydrophobicContact CB-CD2 4.26Å; V233-L294 HydrophobicContact CG2-CD2 3.7Å; F242-L294 HydrophobicContact CE2-CD1 4.11Å; F242-L294 HydrophobicContact CZ-CD1 3.73Å; A290-L294 WeakPolarHBondContact O-CG 3.39Å; A290-L294 PolarHBondContact O-N 3.47Å; E291-L294 PolarHBondContact O-N 2.9Å
295	N	91.9	Very high	91.6	Very high	82 Å²	82	40.3 Å²	40.3	44%	0.439	21%	0.211	S	C	.	.			trans	-132.8	85	176.1	-176.8	11.9	0	0	0	111.2	L293 L297 G298	L293-N295 VanDerWaalsContact C-N 3.32Å; L293-N295 PolarHBondContact O-N 3.41Å; N295-L297 PolarHBondContact O-N 3.15Å; N295-L297 VanDerWaalsContact O-N 3.09Å; N295-L297 PolarHBondContact OD1-N 3.47Å; N295-G298 PolarHBondContact O-N 2.85Å
296	P	92.7	Very high	91.6	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.013	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	4.5	-176.8	33.7	-37.9	0	0	0	114.6	I97 D303 L304	I97-P296 HydrophobicContact CB-CG 4.34Å; I97-P296 HydrophobicContact CD1-CG 3.8Å; I97-P296 HydrophobicContact CG2-CG 3.94Å; P296-D303 WeakPolarHBondContact CA-OD1 3.04Å; P296-D303 WeakPolarHBondContact O-CB 3.48Å; P296-L304 HydrophobicContact CB-CD1 4.11Å; P296-L304 HydrophobicContact CB-CG 4.3Å; P296-L304 HydrophobicContact CG-CD1 4.35Å; P296-L304 WeakPolarHBondContact O-CB 3.49Å; P296-L304 WeakPolarHBondContact O-CG 3.37Å; P296-L304 PolarHBondContact O-N 3.25Å
297	L	91.6	Very high	91.7	Very high	7 Å²	7	38 Å²	38	4%	0.037	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	9.9	178.5	-58.7	173.8	0	0	0	111.9	I144 S145 N295 L304	I144-L297 HydrophobicContact CB-CD1 4.32Å; I144-L297 HydrophobicContact CD1-CD1 3.58Å; I144-L297 HydrophobicContact CG1-CD1 3.8Å; S145-L297 WeakPolarHBondContact CA-O 3.35Å; S145-L297 WeakPolarHBondContact CB-O 3.43Å; S145-L297 PolarHBondContact OG-O 3.31Å; N295-L297 PolarHBondContact O-N 3.15Å; N295-L297 VanDerWaalsContact O-N 3.09Å; N295-L297 PolarHBondContact OD1-N 3.47Å; L297-L304 HydrophobicContact CD2-CB 4.45Å; L297-L304 HydrophobicContact CD2-CD1 3.76Å
298	G	88.8	Confident	91.7	Very high	11 Å²	11	44.9 Å²	44.9	11%	0.113	23%	0.23	C	C	.	.	S	Bend	trans	-76.3	-142.2	178.7	0	0	0	0	0	113.2	Q147 N295 D303	Q147-G298 VanDerWaalsContact CG-O 3.28Å; Q147-G298 WeakPolarHBondContact CG-O 3.48Å; Q147-G298 PolarHBondContact NE2-O 3.38Å; N295-G298 PolarHBondContact O-N 2.85Å; G298-D303 WeakPolarHBondContact CA-OD2 3.39Å; G298-D303 PolarHBondContact N-OD2 2.87Å
299	E	88.6	Confident	91.8	Very high	100 Å²	100	43.6 Å²	43.6	47%	0.467	22%	0.224	S	C	.	.	S	Bend	trans	-131.7	17.2	-177.8	-53	-169.9	146.6	0	0	112.7	M146 Q147 K150 D303	M146-E299 HydrophobicContact CB-CG 4.06Å; Q147-E299 HydrophobicContact CG-CG 3.93Å; K150-E299 VanDerWaalsContact CD-OE1 3.3Å; K150-E299 WeakPolarHBondContact CD-OE1 3.31Å; K150-E299 WeakPolarHBondContact CE-OE1 3.27Å; K150-E299 IonicContact NZ-OE1 2.76Å; K150-E299 PolarHBondContact NZ-OE1 3.18Å; K150-E299 IonicContact NZ-OE2 3.69Å; K150-E299 PolarHBondContact NZ-OE2 3.47Å; E299-D303 PolarHBondContact N-OD2 3.23Å
300	D	88.1	Confident	92	Very high	97 Å²	97	40.3 Å²	40.3	52%	0.519	20%	0.204	S	C	.	.	S	Bend	trans	-69	156.7	174.8	-74.4	-25.2	0	0	0	110.7	D302 D303	D300-D302 PolarHBondContact O-N 3.47Å; D300-D303 PolarHBondContact N-OD2 2.84Å; D300-D303 WeakPolarHBondContact O-CB 3.45Å; D300-D303 PolarHBondContact O-N 2.95Å
301	D	85.3	Confident	92.2	Very high	58 Å²	58	43.1 Å²	43.1	31%	0.31	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	-25.9	-178.8	-76.1	7.8	0	0	0	113.9	T2 I3 G26 K30	T2-D301 PolarHBondContact OG1-O 3.48Å; I3-D301 HydrophobicContact CD1-CB 3.88Å; G26-D301 PolarHBondContact N-OD2 2.93Å; G26-D301 VanDerWaalsContact N-OD2 3.16Å; K30-D301 WeakPolarHBondContact CD-OD2 3.42Å; K30-D301 IonicContact NZ-OD1 3.68Å; K30-D301 PolarHBondContact NZ-OD1 2.87Å; K30-D301 IonicContact NZ-OD2 3.87Å; K30-D301 PolarHBondContact NZ-OD2 3.34Å
302	D	86.3	Confident	92.4	Very high	23 Å²	23	41.7 Å²	41.7	12%	0.123	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	5.2	-175.2	-87.5	-51.4	0	0	0	114	M1 I3 G26 D300	M1-D302 WeakPolarHBondContact CA-O 3.3Å; M1-D302 WeakPolarHBondContact CA-OD1 3.37Å; M1-D302 HydrophobicContact CB-CB 4.3Å; M1-D302 HydrophobicContact CG-CB 3.99Å; M1-D302 PolarHBondContact N-O 3.25Å; M1-D302 HydrophobicContact SD-CB 4.31Å; I3-D302 WeakPolarHBondContact CB-OD1 3.4Å; I3-D302 PolarHBondContact N-OD1 3.38Å; G26-D302 WeakPolarHBondContact CA-OD2 3.36Å; D300-D302 PolarHBondContact O-N 3.47Å
303	D	91.9	Very high	92.8	Very high	6 Å²	6	40 Å²	40	3%	0.032	20%	0.199	C	C	.	.	S	Bend	trans	-67.8	162.8	175	-76.1	-18.8	0	0	0	111.6	T2 P296 G298 E299 D300	T2-D303 WeakPolarHBondContact CG2-O 3.38Å; T2-D303 PolarHBondContact OG1-O 3.3Å; P296-D303 WeakPolarHBondContact CA-OD1 3.04Å; P296-D303 WeakPolarHBondContact O-CB 3.48Å; G298-D303 WeakPolarHBondContact CA-OD2 3.39Å; G298-D303 PolarHBondContact N-OD2 2.87Å; E299-D303 PolarHBondContact N-OD2 3.23Å; D300-D303 PolarHBondContact N-OD2 2.84Å; D300-D303 WeakPolarHBondContact O-CB 3.45Å; D300-D303 PolarHBondContact O-N 2.95Å
304	L	92.1	Very high	93	Very high	10 Å²	10	40.6 Å²	40.6	5%	0.052	20%	0.202	C	C	.	.			trans	-69.6	131.7	-175.9	-63	165	0	0	0	111	I97 L98 I101 Q147 P296 L297 C306	I97-L304 HydrophobicContact CG2-CD1 4.24Å; L98-L304 HydrophobicContact CD1-CD2 3.79Å; I101-L304 HydrophobicContact CD1-CB 4.47Å; I101-L304 HydrophobicContact CD1-CD1 3.6Å; I101-L304 HydrophobicContact CD1-CD2 3.99Å; I101-L304 HydrophobicContact CD1-CG 4.22Å; I101-L304 HydrophobicContact CG1-CD1 4.43Å; Q147-L304 PolarHBondContact NE2-O 2.88Å; P296-L304 HydrophobicContact CB-CD1 4.11Å; P296-L304 HydrophobicContact CB-CG 4.3Å; P296-L304 HydrophobicContact CG-CD1 4.35Å; P296-L304 WeakPolarHBondContact O-CB 3.49Å; P296-L304 WeakPolarHBondContact O-CG 3.37Å; P296-L304 PolarHBondContact O-N 3.25Å; L297-L304 HydrophobicContact CD2-CB 4.45Å; L297-L304 HydrophobicContact CD2-CD1 3.76Å; L304-C306 PolarHBondContact O-N 2.95Å; L304-C306 PolarHBondContact O-SG 2.7Å
305	E	93.7	Very high	93.2	Very high	89 Å²	89	44.1 Å²	44.1	42%	0.416	22%	0.219	S	C	.	.			trans	-72.1	69.9	175.1	-62.2	-54	152.8	0	0	111.6	T2 N307 Y308 I309	T2-E305 HydrophobicContact CG2-CB 4.45Å; T2-E305 HydrophobicContact CG2-CG 3.71Å; T2-E305 PolarHBondContact OG1-OE1 2.85Å; E305-N307 VanDerWaalsContact C-N 3.29Å; E305-N307 PolarHBondContact O-N 3.04Å; E305-Y308 WeakPolarHBondContact O-CB 3.35Å; E305-Y308 PolarHBondContact O-N 2.83Å; E305-I309 WeakPolarHBondContact O-CD1 3.39Å; E305-I309 PolarHBondContact O-N 3.48Å; E305-I309 VanDerWaalsContact O-N 3.13Å
306	C	95.1	Very high	93.3	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.007	21%	0.211	C	C	.	.	H	α-helix	trans	-62	-35.8	-174.2	-66.1	0	0	0	0	112.6	L141 V148 L304 I309 I310	L141-C306 HydrophobicContact CD1-CB 4.32Å; V148-C306 HydrophobicContact CG2-CB 3.46Å; V148-C306 VanDerWaalsContact CG2-CB 3.46Å; L304-C306 PolarHBondContact O-N 2.95Å; L304-C306 PolarHBondContact O-SG 2.7Å; C306-I309 PolarHBondContact O-N 2.94Å; C306-I310 WeakPolarHBondContact O-CG1 3.41Å; C306-I310 PolarHBondContact O-N 3.27Å; C306-I310 VanDerWaalsContact O-N 3.16Å
307	N	96.1	Very high	93.4	Very high	36 Å²	36	42.1 Å²	42.1	19%	0.193	21%	0.21	C	C	.	.	H	α-helix	trans	-64.1	-42.8	176.2	-75.7	-45.7	0	0	0	112.2	Q147 R151 E305 I309 I310 D311	Q147-N307 PolarHBondContact O-ND2 3.38Å; R151-N307 WeakPolarHBondContact CD-OD1 3.47Å; R151-N307 PolarHBondContact NH1-O 3.23Å; E305-N307 VanDerWaalsContact C-N 3.29Å; E305-N307 PolarHBondContact O-N 3.04Å; N307-I309 VanDerWaalsContact C-N 3.32Å; N307-I309 PolarHBondContact O-N 3.13Å; N307-I310 PolarHBondContact O-N 2.77Å; N307-D311 PolarHBondContact O-N 3Å; N307-D311 VanDerWaalsContact O-N 3.11Å
308	Y	95.6	Very high	93.5	Very high	144 Å²	144	43.4 Å²	43.4	57%	0.565	22%	0.217	S	C	*	.	H	α-helix	trans	-60.8	-42.4	175	164.9	-100.3	0	0	0	111.5	E305 I310 D311 K312	E305-Y308 WeakPolarHBondContact O-CB 3.35Å; E305-Y308 PolarHBondContact O-N 2.83Å; Y308-I310 PolarHBondContact O-N 3Å; Y308-D311 PolarHBondContact O-N 2.81Å; Y308-K312 HydrophobicContact CE1-CB 4.45Å; Y308-K312 HydrophobicContact CE2-CB 4.38Å; Y308-K312 VanDerWaalsContact O-CB 3.27Å; Y308-K312 WeakPolarHBondContact O-CB 3.34Å; Y308-K312 PolarHBondContact O-N 2.95Å
309	I	96.4	Very high	93.6	Very high	10 Å²	10	44.7 Å²	44.7	5%	0.051	22%	0.224	C	C	.	.	H	α-helix	trans	-60.9	-45.4	179.7	-69.1	153	0	0	0	111	I101 W103 E305 C306 N307 D311 N313	I101-I309 HydrophobicContact CD1-CD1 3.95Å; I101-I309 HydrophobicContact CG2-CB 4.41Å; I101-I309 HydrophobicContact CG2-CD1 3.54Å; I101-I309 HydrophobicContact CG2-CG1 4.16Å; I101-I309 HydrophobicContact CG2-CG2 3.63Å; W103-I309 HydrophobicContact CH2-CG1 4.39Å; E305-I309 WeakPolarHBondContact O-CD1 3.39Å; E305-I309 PolarHBondContact O-N 3.48Å; E305-I309 VanDerWaalsContact O-N 3.13Å; C306-I309 PolarHBondContact O-N 2.94Å; N307-I309 VanDerWaalsContact C-N 3.32Å; N307-I309 PolarHBondContact O-N 3.13Å; I309-D311 VanDerWaalsContact C-N 3.35Å; I309-D311 PolarHBondContact O-N 3.36Å; I309-N313 VanDerWaalsContact O-CB 3.23Å; I309-N313 WeakPolarHBondContact O-CB 3.43Å; I309-N313 VanDerWaalsContact O-CG 3.27Å; I309-N313 PolarHBondContact O-N 3.31Å; I309-N313 PolarHBondContact O-ND2 2.87Å
310	I	97.4	Very high	93.6	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-59.6	-47.3	177.3	-66.3	167.9	0	0	0	110.3	V134 A138 L141 V148 F152 L163 C306 N307 Y308 N313 L314	V134-I310 HydrophobicContact CG1-CG2 4.09Å; A138-I310 HydrophobicContact CB-CD1 4.28Å; L141-I310 HydrophobicContact CB-CD1 4.47Å; L141-I310 HydrophobicContact CD1-CD1 4Å; L141-I310 HydrophobicContact CD1-CG1 3.91Å; V148-I310 HydrophobicContact CG1-CD1 3.78Å; V148-I310 HydrophobicContact CG2-CD1 4.11Å; F152-I310 HydrophobicContact CE2-CD1 4.3Å; L163-I310 HydrophobicContact CD1-CG2 4.34Å; C306-I310 WeakPolarHBondContact O-CG1 3.41Å; C306-I310 PolarHBondContact O-N 3.27Å; C306-I310 VanDerWaalsContact O-N 3.16Å; N307-I310 PolarHBondContact O-N 2.77Å; Y308-I310 PolarHBondContact O-N 3Å; I310-N313 PolarHBondContact O-N 3.48Å; I310-L314 WeakPolarHBondContact O-CB 3.41Å; I310-L314 PolarHBondContact O-N 3.34Å
311	D	97.6	Very high	93.6	Very high	60 Å²	60	36.8 Å²	36.8	32%	0.321	19%	0.185	S	C	.	.	H	α-helix	trans	-65.6	-46.6	-178.3	-66.8	-15.3	0	0	0	111.9	R151 N307 Y308 I309 N313 L314 I315	R151-D311 IonicContact CZ-OD1 3.47Å; R151-D311 IonicContact CZ-OD2 3.43Å; R151-D311 IonicContact NH1-OD1 2.7Å; R151-D311 PolarHBondContact NH1-OD1 3.04Å; R151-D311 IonicContact NH1-OD2 3.91Å; R151-D311 PolarHBondContact NH1-OD2 3.43Å; R151-D311 IonicContact NH2-OD1 2.74Å; R151-D311 PolarHBondContact NH2-OD1 3.34Å; R151-D311 IonicContact NH2-OD2 2.66Å; N307-D311 PolarHBondContact O-N 3Å; N307-D311 VanDerWaalsContact O-N 3.11Å; Y308-D311 PolarHBondContact O-N 2.81Å; I309-D311 VanDerWaalsContact C-N 3.35Å; I309-D311 PolarHBondContact O-N 3.36Å; D311-N313 VanDerWaalsContact C-N 3.34Å; D311-N313 PolarHBondContact O-N 3.2Å; D311-L314 PolarHBondContact O-N 3.37Å; D311-I315 WeakPolarHBondContact O-CB 3.27Å; D311-I315 VanDerWaalsContact O-CG1 3.28Å; D311-I315 WeakPolarHBondContact O-CG1 3.42Å; D311-I315 PolarHBondContact O-N 3.04Å
312	K	96.9	Very high	93.4	Very high	36 Å²	36	36 Å²	36	16%	0.157	18%	0.18	C	C	.	.	H	α-helix	trans	-57.5	-49.6	175.1	-178.3	-87.2	176.5	168.2	0	110.3	W103 D105 Y308 L314 I315 T316	W103-K312 HydrophobicContact CE3-CD 4.13Å; W103-K312 HydrophobicContact CZ3-CD 3.95Å; D105-K312 IonicContact OD1-NZ 3.96Å; D105-K312 PolarHBondContact OD1-NZ 3.24Å; D105-K312 IonicContact OD2-NZ 2.63Å; D105-K312 PolarHBondContact OD2-NZ 3.1Å; Y308-K312 HydrophobicContact CE1-CB 4.45Å; Y308-K312 HydrophobicContact CE2-CB 4.38Å; Y308-K312 VanDerWaalsContact O-CB 3.27Å; Y308-K312 WeakPolarHBondContact O-CB 3.34Å; Y308-K312 PolarHBondContact O-N 2.95Å; K312-L314 VanDerWaalsContact C-N 3.3Å; K312-L314 PolarHBondContact O-N 3.01Å; K312-I315 PolarHBondContact O-N 3.44Å; K312-T316 WeakPolarHBondContact O-CB 3.46Å; K312-T316 PolarHBondContact O-N 2.8Å; K312-T316 PolarHBondContact O-OG1 3.03Å; K312-T316 VanDerWaalsContact O-OG1 3.13Å
313	N	98.1	Very high	92	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.9	-38.2	-177.5	-79.2	-16.2	0	0	0	111.5	G102 I104 V134 Q137 I309 I310 D311 G317	G102-N313 PolarHBondContact O-ND2 3.25Å; I104-N313 HydrophobicContact CB-CB 3.85Å; I104-N313 HydrophobicContact CG2-CB 3.95Å; I104-N313 WeakPolarHBondContact CG2-O 3.5Å; I104-N313 PolarHBondContact N-OD1 3.49Å; V134-N313 HydrophobicContact CG2-CB 4.02Å; Q137-N313 PolarHBondContact NE2-ND2 3.32Å; Q137-N313 VanDerWaalsContact NE2-ND2 3.17Å; Q137-N313 PolarHBondContact OE1-ND2 2.78Å; I309-N313 VanDerWaalsContact O-CB 3.23Å; I309-N313 WeakPolarHBondContact O-CB 3.43Å; I309-N313 VanDerWaalsContact O-CG 3.27Å; I309-N313 PolarHBondContact O-N 3.31Å; I309-N313 PolarHBondContact O-ND2 2.87Å; I310-N313 PolarHBondContact O-N 3.48Å; D311-N313 VanDerWaalsContact C-N 3.34Å; D311-N313 PolarHBondContact O-N 3.2Å; N313-G317 WeakPolarHBondContact O-CA 3.37Å; N313-G317 PolarHBondContact O-N 2.86Å
314	L	97.4	Very high	90.1	Very high	36 Å²	36	40.5 Å²	40.5	19%	0.188	20%	0.204	C	C	.	.	H	α-helix	trans	-65.2	-53.5	174.9	-171.4	63.3	0	0	0	111.6	V134 L163 I310 D311 K312 L318	V134-L314 HydrophobicContact CG1-CB 4.23Å; V134-L314 HydrophobicContact CG1-CD1 4.43Å; L163-L314 HydrophobicContact CD2-CD1 4.12Å; L163-L314 HydrophobicContact CD2-CD2 3.88Å; I310-L314 WeakPolarHBondContact O-CB 3.41Å; I310-L314 PolarHBondContact O-N 3.34Å; D311-L314 PolarHBondContact O-N 3.37Å; K312-L314 VanDerWaalsContact C-N 3.3Å; K312-L314 PolarHBondContact O-N 3.01Å; L314-L318 HydrophobicContact CD1-CD1 3.8Å; L314-L318 HydrophobicContact CD1-CG 4.24Å; L314-L318 HydrophobicContact CG-CD1 4Å; L314-L318 VanDerWaalsContact O-CB 3.26Å; L314-L318 WeakPolarHBondContact O-CB 3.26Å; L314-L318 WeakPolarHBondContact O-CG 3.36Å; L314-L318 PolarHBondContact O-N 3.04Å
315	I	95.6	Very high	88	Confident	117 Å²	117	45.5 Å²	45.5	60%	0.6	22%	0.222	S	C	*	.	H	α-helix	trans	-66.2	-52.4	-174	-66.2	166	0	0	0	110.8	D311 K312 S319	D311-I315 WeakPolarHBondContact O-CB 3.27Å; D311-I315 VanDerWaalsContact O-CG1 3.28Å; D311-I315 WeakPolarHBondContact O-CG1 3.42Å; D311-I315 PolarHBondContact O-N 3.04Å; K312-I315 PolarHBondContact O-N 3.44Å; I315-S319 WeakPolarHBondContact O-CB 3.39Å; I315-S319 PolarHBondContact O-N 3.18Å
316	T	94.4	Very high	85.7	Confident	43 Å²	43	46.5 Å²	46.5	26%	0.264	23%	0.225	S	C	.	.	H	α-helix	trans	-64.3	-44.9	-179.4	-60.1	0	0	0	0	111.1	K312 S319 I320	K312-T316 WeakPolarHBondContact O-CB 3.46Å; K312-T316 PolarHBondContact O-N 2.8Å; K312-T316 PolarHBondContact O-OG1 3.03Å; K312-T316 VanDerWaalsContact O-OG1 3.13Å; T316-S319 PolarHBondContact O-N 3.35Å; T316-I320 HydrophobicContact CG2-CD1 3.74Å; T316-I320 HydrophobicContact CG2-CG1 4.37Å; T316-I320 VanDerWaalsContact O-CG1 3.29Å; T316-I320 WeakPolarHBondContact O-CG1 3.42Å; T316-I320 PolarHBondContact O-N 2.81Å
317	G	94.8	Very high	83.1	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.6	-46.6	-179.5	0	0	0	0	0	112	S108 N313 S319 I320 V321	S108-G317 VanDerWaalsContact OG-CA 3.28Å; S108-G317 WeakPolarHBondContact OG-CA 2.96Å; N313-G317 WeakPolarHBondContact O-CA 3.37Å; N313-G317 PolarHBondContact O-N 2.86Å; G317-S319 VanDerWaalsContact C-N 3.35Å; G317-S319 PolarHBondContact O-N 3.34Å; G317-I320 PolarHBondContact O-N 3.24Å; G317-V321 WeakPolarHBondContact O-CG2 3.45Å; G317-V321 PolarHBondContact O-N 2.71Å
318	L	94.1	Very high	80.4	Confident	33 Å²	33	56.1 Å²	56.1	17%	0.173	27%	0.273	C	S	.	.	H	α-helix	trans	-63.5	-41	176.3	-71	178	0	0	0	111.5	R127 V130 L314 V321 D322	R127-L318 HydrophobicContact CB-CD2 3.96Å; R127-L318 HydrophobicContact CG-CD2 4.15Å; V130-L318 HydrophobicContact CB-CD2 4.35Å; V130-L318 HydrophobicContact CG1-CD2 4.29Å; V130-L318 HydrophobicContact CG1-CG 4.33Å; L314-L318 HydrophobicContact CD1-CD1 3.8Å; L314-L318 HydrophobicContact CD1-CG 4.24Å; L314-L318 HydrophobicContact CG-CD1 4Å; L314-L318 VanDerWaalsContact O-CB 3.26Å; L314-L318 WeakPolarHBondContact O-CB 3.26Å; L314-L318 WeakPolarHBondContact O-CG 3.36Å; L314-L318 PolarHBondContact O-N 3.04Å; L318-V321 PolarHBondContact O-N 3.11Å; L318-D322 WeakPolarHBondContact O-CB 3.4Å; L318-D322 PolarHBondContact O-N 3.27Å
319	S	90.4	Very high	77.9	Confident	38 Å²	38	57 Å²	57	27%	0.266	29%	0.287	S	S	.	.	H	α-helix	trans	-57.5	-52.8	174.6	-170.2	0	0	0	0	110.6	I315 T316 G317 V321 D322 T323	I315-S319 WeakPolarHBondContact O-CB 3.39Å; I315-S319 PolarHBondContact O-N 3.18Å; T316-S319 PolarHBondContact O-N 3.35Å; G317-S319 VanDerWaalsContact C-N 3.35Å; G317-S319 PolarHBondContact O-N 3.34Å; S319-V321 VanDerWaalsContact C-N 3.33Å; S319-V321 PolarHBondContact O-N 3.29Å; S319-D322 PolarHBondContact O-N 2.9Å; S319-T323 VanDerWaalsContact O-CB 3.24Å; S319-T323 WeakPolarHBondContact O-CB 3.41Å; S319-T323 WeakPolarHBondContact O-CG2 3.26Å; S319-T323 PolarHBondContact O-N 2.69Å; S319-T323 PolarHBondContact O-OG1 3.1Å
320	I	88.7	Confident	75.4	Confident	31 Å²	31	61.2 Å²	61.2	16%	0.159	31%	0.314	C	S	.	.	H	α-helix	trans	-56.2	-45.7	-177.2	-70.5	164.9	0	0	0	112.1	L109 A112 T316 G317 T323	L109-I320 HydrophobicContact CD2-CG2 3.99Å; L109-I320 HydrophobicContact CG-CG2 4.35Å; A112-I320 HydrophobicContact CB-CG2 4.09Å; T316-I320 HydrophobicContact CG2-CD1 3.74Å; T316-I320 HydrophobicContact CG2-CG1 4.37Å; T316-I320 VanDerWaalsContact O-CG1 3.29Å; T316-I320 WeakPolarHBondContact O-CG1 3.42Å; T316-I320 PolarHBondContact O-N 2.81Å; G317-I320 PolarHBondContact O-N 3.24Å; I320-T323 PolarHBondContact O-OG1 3.08Å
321	V	88	Confident	72.5	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-82.1	-18.6	-174.6	-58.6	0	0	0	0	114.2	S108 F111 A112 R126 R127 V130 G317 L318 S319	S108-V321 WeakPolarHBondContact O-CG1 3.43Å; F111-V321 HydrophobicContact CB-CG1 3.97Å; F111-V321 HydrophobicContact CD2-CG1 4.45Å; A112-V321 HydrophobicContact CB-CG1 4.5Å; R126-V321 HydrophobicContact CB-CB 3.97Å; R126-V321 HydrophobicContact CB-CG2 4.31Å; R126-V321 PolarHBondContact NE-O 3.47Å; R127-V321 HydrophobicContact CG-CG2 4.25Å; V130-V321 HydrophobicContact CG2-CB 4.37Å; V130-V321 HydrophobicContact CG2-CG1 3.59Å; V130-V321 HydrophobicContact CG2-CG2 3.87Å; G317-V321 WeakPolarHBondContact O-CG2 3.45Å; G317-V321 PolarHBondContact O-N 2.71Å; L318-V321 PolarHBondContact O-N 3.11Å; S319-V321 VanDerWaalsContact C-N 3.33Å; S319-V321 PolarHBondContact O-N 3.29Å
322	D	80.1	Confident	69.6	Low	41 Å²	41	72.7 Å²	72.7	22%	0.219	38%	0.376	C	S	.	.	H	α-helix	trans	-92.1	-31.1	178.8	-152.4	31.4	0	0	0	111.8	R123 R127 L318 S319 M324	R123-D322 IonicContact CZ-OD1 2.66Å; R123-D322 IonicContact CZ-OD2 3.34Å; R123-D322 IonicContact NE-OD1 3.43Å; R123-D322 PolarHBondContact NE-OD1 2.7Å; R123-D322 IonicContact NE-OD2 3.62Å; R123-D322 VanDerWaalsContact NH2-CG 3.28Å; R123-D322 IonicContact NH2-OD1 3.5Å; R123-D322 PolarHBondContact NH2-OD1 3.43Å; R123-D322 IonicContact NH2-OD2 2.62Å; R123-D322 PolarHBondContact NH2-OD2 3.33Å; R127-D322 VanDerWaalsContact NH1-CG 3.34Å; R127-D322 IonicContact NH1-OD1 3.48Å; R127-D322 IonicContact NH1-OD2 3.36Å; R127-D322 PolarHBondContact NH1-OD2 2.88Å; L318-D322 WeakPolarHBondContact O-CB 3.4Å; L318-D322 PolarHBondContact O-N 3.27Å; S319-D322 PolarHBondContact O-N 2.9Å; D322-M324 PolarHBondContact O-N 2.98Å
323	T	57.5	Low	66.6	Low	27 Å²	27	74.5 Å²	74.5	17%	0.166	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	39	179.3	64.7	0	0	0	0	112.8	S319 I320 M339 A340	S319-T323 VanDerWaalsContact O-CB 3.24Å; S319-T323 WeakPolarHBondContact O-CB 3.41Å; S319-T323 WeakPolarHBondContact O-CG2 3.26Å; S319-T323 PolarHBondContact O-N 2.69Å; S319-T323 PolarHBondContact O-OG1 3.1Å; I320-T323 PolarHBondContact O-OG1 3.08Å; T323-M339 VanDerWaalsContact CB-CB 3.4Å; T323-M339 HydrophobicContact CG2-CB 3.54Å; T323-M339 HydrophobicContact CG2-CG 4.36Å; T323-M339 HydrophobicContact CG2-SD 4.22Å; T323-M339 CarbonylContact O-C 3.59Å; T323-A340 WeakPolarHBondContact O-CA 3.2Å; T323-A340 WeakPolarHBondContact O-CB 3.39Å; T323-A340 PolarHBondContact O-N 3.33Å
324	M	51.6	Low	63.8	Low	97 Å²	97	83.3 Å²	83.3	48%	0.478	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	21.8	171.5	-88.8	-156.9	83.2	0	0	113.1	A112 D322	A112-M324 VanDerWaalsContact C-SD 3.54Å; A112-M324 HydrophobicContact CB-CG 4.28Å; A112-M324 HydrophobicContact CB-SD 3.73Å; D322-M324 PolarHBondContact O-N 2.98Å
325	W	48.1	Very low	61.1	Low	116 Å²	116	87.3 Å²	87.3	44%	0.439	46%	0.462	S	S	.	.			trans	-146.3	126.8	-175.7	-162.4	69.6	0	0	0	116.5	A118 H327	A118-W325 HydrophobicContact CB-CZ2 4.28Å; W325-H327 HydrophobicContact CH2-CB 3.73Å; W325-H327 AromaticContact CH2-CD2 3.7Å; W325-H327 HydrophobicContact CZ2-CB 3.7Å; W325-H327 AromaticContact CZ2-CD2 3.58Å; W325-H327 AromaticContact CZ2-CG 3.98Å; W325-H327 HydrophobicContact CZ3-CB 4.43Å
326	K	46.1	Very low	58.4	Low	110 Å²	110	89.4 Å²	89.4	48%	0.478	47%	0.47	S	S	.	.			trans	-137.7	138.6	144.2	-145	-174.8	-169	-175.9	0	109.9	E337	K326-E337 IonicContact NZ-OE1 2.71Å; K326-E337 PolarHBondContact NZ-OE1 3.06Å
327	H	39.4	Very low	55.9	Low	97 Å²	97	93.4 Å²	93.4	45%	0.449	49%	0.485	S	S	.	.			trans	-67	129.3	164.9	-152.4	-66.2	0	0	0	109.1	W325 T330	W325-H327 HydrophobicContact CH2-CB 3.73Å; W325-H327 AromaticContact CH2-CD2 3.7Å; W325-H327 HydrophobicContact CZ2-CB 3.7Å; W325-H327 AromaticContact CZ2-CD2 3.58Å; W325-H327 AromaticContact CZ2-CG 3.98Å; W325-H327 HydrophobicContact CZ3-CB 4.43Å; H327-T330 PolarHBondContact CE1-OG1 3.16Å; H327-T330 PolarHBondContact ND1-OG1 2.96Å
328	D	40.1	Very low	53.4	Low	142 Å²	142	101.5 Å²	101.5	76%	0.759	52%	0.523	S	S	*	.	S	Bend	trans	-78.1	131.9	157.9	-76.8	-27.6	0	0	0	107.8
329	D	42.4	Very low	50.9	Low	161 Å²	161	106.4 Å²	106.4	86%	0.861	55%	0.547	S	S	*	.	S	Bend	trans	92.5	14	163.3	-58.9	-18.6	0	0	0	124.6
330	T	43.8	Very low	48.9	Very low	99 Å²	99	106.3 Å²	106.3	61%	0.607	55%	0.548	S	S	*	.	S	Bend	trans	-131	12.3	-179.2	55.8	0	0	0	0	119.6	H327 Y332	H327-T330 PolarHBondContact CE1-OG1 3.16Å; H327-T330 PolarHBondContact ND1-OG1 2.96Å; T330-Y332 PolarHBondContact O-N 3.2Å
331	G	38.4	Very low	47.5	Very low	71 Å²	71	113.3 Å²	113.3	73%	0.732	58%	0.577	S	S	*	*			trans	72.1	17.8	152.4	0	0	0	0	0	119.5
332	Y	36	Very low	46.5	Very low	232 Å²	232	118.4 Å²	118.4	91%	0.91	61%	0.609	S	S	*	*			trans	-141.5	117.9	158.7	-88.5	-82.4	0	0	0	112.2	T330	T330-Y332 PolarHBondContact O-N 3.2Å
333	S	34.4	Very low	46.4	Very low	74 Å²	74	121.2 Å²	121.2	52%	0.517	63%	0.629	S	S	.	*			trans	-163.1	97.6	169.7	159	0	0	0	0	108.4
334	M	38.1	Very low	47.6	Very low	184 Å²	184	123.6 Å²	123.6	91%	0.906	65%	0.651	S	S	*	*			trans	-105.3	102.6	159.7	-70.3	-143.6	68.8	0	0	107.5
335	V	40.7	Very low	49.1	Very low	120 Å²	120	126.8 Å²	126.8	73%	0.727	67%	0.665	S	S	*	*	S	Bend	trans	167.3	109.4	136.1	172.8	0	0	0	0	107.5
336	E	39.4	Very low	51.1	Low	161 Å²	161	129.9 Å²	129.9	75%	0.752	68%	0.682	S	S	*	*			trans	64.8	89.5	157.8	-63.5	-179.1	-177.3	0	0	120.7	H338	E336-H338 VanDerWaalsContact C-N 3.31Å; E336-H338 PolarHBondContact O-N 3.29Å
337	E	42.8	Very low	53.1	Low	127 Å²	127	131.7 Å²	131.7	59%	0.593	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	22.1	-178.5	-157.8	165.7	-138.8	0	0	115.1	K326	K326-E337 IonicContact NZ-OE1 2.71Å; K326-E337 PolarHBondContact NZ-OE1 3.06Å
338	H	42.1	Very low	55.4	Low	170 Å²	170	131 Å²	131	79%	0.787	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.6	1.8	-163.5	-66.3	-31.6	0	0	0	118.6	E336	E336-H338 VanDerWaalsContact C-N 3.31Å; E336-H338 PolarHBondContact O-N 3.29Å
339	M	41.4	Very low	57.5	Low	136 Å²	136	129.9 Å²	129.9	67%	0.67	68%	0.68	S	S	*	*	S	Bend	trans	-122.8	-14.1	175	-75.1	-173.5	173.6	0	0	114.7	T323	T323-M339 VanDerWaalsContact CB-CB 3.4Å; T323-M339 HydrophobicContact CG2-CB 3.54Å; T323-M339 HydrophobicContact CG2-CG 4.36Å; T323-M339 HydrophobicContact CG2-SD 4.22Å; T323-M339 CarbonylContact O-C 3.59Å
340	A	48.7	Very low	59.6	Low	36 Å²	36	126 Å²	126	30%	0.298	66%	0.655	S	S	.	*	S	Bend	trans	-90.9	-12	-175.7	0	0	0	0	0	116.7	T323 T342	T323-A340 WeakPolarHBondContact O-CA 3.2Å; T323-A340 WeakPolarHBondContact O-CB 3.39Å; T323-A340 PolarHBondContact O-N 3.33Å; A340-T342 PolarHBondContact O-N 3.21Å
341	K	57.6	Low	61.7	Low	178 Å²	178	129.1 Å²	129.1	77%	0.774	66%	0.656	S	S	*	*			trans	-93.9	99.6	-177.2	-163	169.7	-172.5	169.1	0	108.4	P343	K341-P343 WeakPolarHBondContact O-CD 3.5Å
342	T	67.7	Low	63.9	Low	108 Å²	108	129.4 Å²	129.4	66%	0.663	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-50.3	118.7	160.2	-56.9	0	0	0	0	106.7	A340	A340-T342 PolarHBondContact O-N 3.21Å
343	P	78.1	Confident	66.3	Low	99 Å²	99	120.7 Å²	120.7	64%	0.643	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-56.3	147.7	-178.2	-26.3	35.2	0	0	0	110.4	K341 Q345	K341-P343 WeakPolarHBondContact O-CD 3.5Å; P343-Q345 PolarHBondContact O-N 2.93Å; P343-Q345 PolarHBondContact O-NE2 2.8Å
344	A	82.4	Confident	68.6	Low	77 Å²	77	125.2 Å²	125.2	64%	0.636	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-56	128.8	175.9	0	0	0	0	0	109.5	K346	A344-K346 PolarHBondContact O-N 3.38Å
345	Q	84.4	Confident	70.8	Confident	165 Å²	165	125.2 Å²	125.2	77%	0.771	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-68.7	124.1	-178.5	-57.7	-58.1	-64.3	0	0	109.2	P343	P343-Q345 PolarHBondContact O-N 2.93Å; P343-Q345 PolarHBondContact O-NE2 2.8Å
346	K	88.4	Confident	72.9	Confident	181 Å²	181	124.5 Å²	124.5	79%	0.787	63%	0.631	S	S	*	*			trans	-134.3	155.2	-179	-66.3	179	-175.8	-179.8	0	109	A344 D348	A344-K346 PolarHBondContact O-N 3.38Å; K346-D348 PolarHBondContact O-N 3.34Å
347	K	89.4	Confident	75	Confident	147 Å²	147	119.3 Å²	119.3	64%	0.639	62%	0.617	S	S	*	*			trans	-56.9	130.9	165.2	-68.4	176.1	175.8	177.6	0	108.2	W351	K347-W351 HydrophobicContact CB-CB 3.91Å; K347-W351 HydrophobicContact CB-CD2 4.19Å; K347-W351 HydrophobicContact CB-CG 3.86Å; K347-W351 HydrophobicContact CD-CD2 4.2Å; K347-W351 HydrophobicContact CD-CG 3.89Å; K347-W351 HydrophobicContact CG-CB 4.43Å; K347-W351 HydrophobicContact CG-CD2 3.83Å; K347-W351 HydrophobicContact CG-CE3 4.36Å; K347-W351 HydrophobicContact CG-CG 3.82Å
348	D	86.9	Confident	77.2	Confident	83 Å²	83	116.8 Å²	116.8	44%	0.444	61%	0.611	S	S	.	*			trans	-74.4	168.3	174.7	63	97.5	0	0	0	111.1	K346 F350 W351	K346-D348 PolarHBondContact O-N 3.34Å; D348-F350 PolarHBondContact O-N 3.01Å; D348-F350 VanDerWaalsContact O-N 3.17Å; D348-F350 VanDerWaalsContact OD1-CA 3.27Å; D348-F350 WeakPolarHBondContact OD1-CA 3.25Å; D348-F350 WeakPolarHBondContact OD1-CB 3.45Å; D348-F350 PolarHBondContact OD1-N 3.35Å; D348-W351 VanDerWaalsContact O-CB 3.24Å; D348-W351 WeakPolarHBondContact O-CB 3.31Å; D348-W351 PolarHBondContact O-N 2.97Å; D348-W351 VanDerWaalsContact O-N 3.11Å; D348-W351 PolarHBondContact OD1-N 3.25Å
349	E	83.6	Confident	79.2	Confident	118 Å²	118	115.5 Å²	115.5	55%	0.551	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-13.8	-178.9	-64.1	-179.4	176.2	0	0	113.3	I353	E349-I353 WeakPolarHBondContact O-CD1 3.32Å
350	F	88.3	Confident	81.3	Confident	80 Å²	80	116.7 Å²	116.7	35%	0.351	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.6	1.6	177.5	-46	-68.3	0	0	0	112.7	D348 G352 I353 I356	D348-F350 PolarHBondContact O-N 3.01Å; D348-F350 VanDerWaalsContact O-N 3.17Å; D348-F350 VanDerWaalsContact OD1-CA 3.27Å; D348-F350 WeakPolarHBondContact OD1-CA 3.25Å; D348-F350 WeakPolarHBondContact OD1-CB 3.45Å; D348-F350 PolarHBondContact OD1-N 3.35Å; F350-G352 PolarHBondContact O-N 3.22Å; F350-I353 PolarHBondContact O-N 3.39Å; F350-I353 VanDerWaalsContact O-N 3.11Å; F350-I356 HydrophobicContact CB-CD1 4.04Å; F350-I356 HydrophobicContact CB-CG1 4.14Å; F350-I356 HydrophobicContact CD1-CG2 3.7Å; F350-I356 HydrophobicContact CE1-CG2 4Å; F350-I356 HydrophobicContact CG-CG2 4.01Å
351	W	86.4	Confident	83.1	Confident	165 Å²	165	118.5 Å²	118.5	63%	0.625	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	118.9	-179.3	-172.5	-82.7	0	0	0	111.5	K347 D348	K347-W351 HydrophobicContact CB-CB 3.91Å; K347-W351 HydrophobicContact CB-CD2 4.19Å; K347-W351 HydrophobicContact CB-CG 3.86Å; K347-W351 HydrophobicContact CD-CD2 4.2Å; K347-W351 HydrophobicContact CD-CG 3.89Å; K347-W351 HydrophobicContact CG-CB 4.43Å; K347-W351 HydrophobicContact CG-CD2 3.83Å; K347-W351 HydrophobicContact CG-CE3 4.36Å; K347-W351 HydrophobicContact CG-CG 3.82Å; D348-W351 VanDerWaalsContact O-CB 3.24Å; D348-W351 WeakPolarHBondContact O-CB 3.31Å; D348-W351 PolarHBondContact O-N 2.97Å; D348-W351 VanDerWaalsContact O-N 3.11Å; D348-W351 PolarHBondContact OD1-N 3.25Å
352	G	85.3	Confident	84.3	Confident	76 Å²	76	113.9 Å²	113.9	78%	0.784	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	82.7	8.5	-179.6	0	0	0	0	0	115.2	F350	F350-G352 PolarHBondContact O-N 3.22Å
353	I	86.4	Confident	85	Confident	49 Å²	49	115.9 Å²	115.9	25%	0.251	60%	0.602	S	S	.	*			trans	-99.2	116	177.5	-55.2	-175.8	0	0	0	110.5	E349 F350 K355 W473	E349-I353 WeakPolarHBondContact O-CD1 3.32Å; F350-I353 PolarHBondContact O-N 3.39Å; F350-I353 VanDerWaalsContact O-N 3.11Å; I353-K355 VanDerWaalsContact C-N 3.3Å; I353-K355 WeakPolarHBondContact CG2-O 3.34Å; I353-K355 PolarHBondContact O-N 2.94Å; I353-W473 HydrophobicContact CD1-CE3 4.27Å
354	D	82.8	Confident	85.4	Confident	170 Å²	170	113.2 Å²	113.2	91%	0.909	59%	0.585	S	S	*	*	S	Bend	trans	-66.2	-28.1	178.9	-72.2	-19.2	0	0	0	114
355	K	83.2	Confident	85.7	Confident	184 Å²	184	111.3 Å²	111.3	80%	0.8	57%	0.569	S	S	*	*	S	Bend	trans	-124.2	94.6	-177.6	-69.7	-177.6	-176.6	172.9	0	110.8	I353 A357	I353-K355 VanDerWaalsContact C-N 3.3Å; I353-K355 WeakPolarHBondContact CG2-O 3.34Å; I353-K355 PolarHBondContact O-N 2.94Å; K355-A357 PolarHBondContact O-N 3.36Å
356	I	85.3	Confident	85.7	Confident	104 Å²	104	107.9 Å²	107.9	53%	0.533	55%	0.553	S	S	.	*			trans	-73.7	123.1	177.2	-56	-179.5	0	0	0	109.5	F350 P358	F350-I356 HydrophobicContact CB-CD1 4.04Å; F350-I356 HydrophobicContact CB-CG1 4.14Å; F350-I356 HydrophobicContact CD1-CG2 3.7Å; F350-I356 HydrophobicContact CE1-CG2 4Å; F350-I356 HydrophobicContact CG-CG2 4.01Å; I356-P358 HydrophobicContact CG2-CG 4.23Å
357	A	83.6	Confident	85.4	Confident	53 Å²	53	108 Å²	108	44%	0.438	55%	0.549	S	S	.	.			trans	-126.8	86.6	177.7	0	0	0	0	0	109.9	K355 W473	K355-A357 PolarHBondContact O-N 3.36Å; A357-W473 HydrophobicContact CB-CH2 4.46Å
358	P	88.2	Confident	84.9	Confident	73 Å²	73	105.3 Å²	105.3	47%	0.474	55%	0.549	S	S	.	.			trans	-59.6	141.7	178.8	-22.3	34.6	0	0	0	111.3	I356 Y360	I356-P358 HydrophobicContact CG2-CG 4.23Å; P358-Y360 VanDerWaalsContact O-CD2 3.27Å; P358-Y360 WeakPolarHBondContact O-CD2 3.45Å; P358-Y360 WeakPolarHBondContact O-CE2 3.44Å
359	L	85.7	Confident	84.5	Confident	143 Å²	143	106.9 Å²	106.9	75%	0.749	56%	0.561	S	S	*	*			trans	-76.3	143.6	-179.7	-62.5	179.1	0	0	0	111.3	W473	L359-W473 HydrophobicContact CD2-CZ2 4.11Å
360	Y	85.7	Confident	84.3	Confident	162 Å²	162	109.2 Å²	109.2	64%	0.635	57%	0.571	S	S	*	*			trans	-122.9	148	174	-72.7	-95.7	0	0	0	108.6	P358 S364	P358-Y360 VanDerWaalsContact O-CD2 3.27Å; P358-Y360 WeakPolarHBondContact O-CD2 3.45Å; P358-Y360 WeakPolarHBondContact O-CE2 3.44Å; Y360-S364 WeakPolarHBondContact CB-OG 3.35Å
361	S	86.4	Confident	84	Confident	73 Å²	73	109.3 Å²	109.3	51%	0.51	58%	0.58	S	S	.	*			trans	-60	150.5	164.4	74.3	0	0	0	0	109.4	E363 S364 A365	S361-E363 PolarHBondContact O-N 2.97Å; S361-S364 PolarHBondContact N-OG 3Å; S361-S364 PolarHBondContact O-N 3.25Å; S361-S364 PolarHBondContact O-OG 3.34Å; S361-S364 WeakPolarHBondContact OG-CB 3.47Å; S361-S364 PolarHBondContact OG-N 3.31Å; S361-S364 VanDerWaalsContact OG-N 3.14Å; S361-S364 PolarHBondContact OG-OG 2.99Å; S361-A365 WeakPolarHBondContact O-CB 3.2Å; S361-A365 PolarHBondContact O-N 2.86Å
362	M	82.5	Confident	83.8	Confident	82 Å²	82	110.2 Å²	110.2	40%	0.404	60%	0.596	S	S	.	*	H	α-helix	trans	-54.3	-39.5	180	-73.3	-60.5	-60.8	0	0	112.2	A365 E366 L437 R441	M362-A365 PolarHBondContact O-N 3.37Å; M362-E366 PolarHBondContact O-N 3.45Å; M362-L437 HydrophobicContact CE-CD1 4.32Å; M362-R441 HydrophobicContact CE-CB 3.8Å; M362-R441 HydrophobicContact CE-CG 3.93Å
363	E	82.8	Confident	83.6	Confident	150 Å²	150	110.3 Å²	110.3	70%	0.701	58%	0.582	S	S	*	*	H	α-helix	trans	-67.2	-44.2	177.5	-173.1	180	174.9	0	0	112.2	S361 A365 E366	S361-E363 PolarHBondContact O-N 2.97Å; E363-A365 VanDerWaalsContact C-N 3.32Å; E363-A365 PolarHBondContact O-N 2.85Å; E363-E366 PolarHBondContact O-N 3.04Å
364	S	86.7	Confident	83.4	Confident	43 Å²	43	110.3 Å²	110.3	30%	0.301	59%	0.594	S	S	.	*	H	α-helix	trans	-68.9	-29.4	177.7	59.1	0	0	0	0	113.4	Y360 S361 E366 R367	Y360-S364 WeakPolarHBondContact CB-OG 3.35Å; S361-S364 PolarHBondContact N-OG 3Å; S361-S364 PolarHBondContact O-N 3.25Å; S361-S364 PolarHBondContact O-OG 3.34Å; S361-S364 WeakPolarHBondContact OG-CB 3.47Å; S361-S364 PolarHBondContact OG-N 3.31Å; S361-S364 VanDerWaalsContact OG-N 3.14Å; S361-S364 PolarHBondContact OG-OG 2.99Å; S364-E366 VanDerWaalsContact C-N 3.3Å; S364-E366 PolarHBondContact O-N 3.22Å; S364-R367 PolarHBondContact O-N 3.09Å
365	A	87.3	Confident	83.5	Confident	36 Å²	36	108.1 Å²	108.1	30%	0.298	59%	0.592	S	S	.	*	H	α-helix	trans	-71.7	-23.9	179.9	0	0	0	0	0	113.1	S361 M362 E363 R367 L437	S361-A365 WeakPolarHBondContact O-CB 3.2Å; S361-A365 PolarHBondContact O-N 2.86Å; M362-A365 PolarHBondContact O-N 3.37Å; E363-A365 VanDerWaalsContact C-N 3.32Å; E363-A365 PolarHBondContact O-N 2.85Å; A365-R367 PolarHBondContact O-N 2.53Å; A365-L437 HydrophobicContact CB-CD1 3.92Å; A365-L437 HydrophobicContact CB-CD2 4.3Å; A365-L437 WeakPolarHBondContact O-CD2 3.37Å
366	E	84	Confident	83.6	Confident	94 Å²	94	102.5 Å²	102.5	44%	0.439	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.4	-18.6	175.7	-72.4	-179.6	174.1	0	0	112.6	M362 E363 S364 S368 L437 R441	M362-E366 PolarHBondContact O-N 3.45Å; E363-E366 PolarHBondContact O-N 3.04Å; S364-E366 VanDerWaalsContact C-N 3.3Å; S364-E366 PolarHBondContact O-N 3.22Å; E366-S368 PolarHBondContact O-N 3.07Å; E366-L437 HydrophobicContact CB-CD2 4.3Å; E366-L437 HydrophobicContact CG-CD2 3.77Å; E366-R441 IonicContact OE1-CZ 3.11Å; E366-R441 IonicContact OE1-NH1 3.35Å; E366-R441 PolarHBondContact OE1-NH1 3.2Å; E366-R441 IonicContact OE1-NH2 3.97Å
367	R	82	Confident	83.5	Confident	183 Å²	183	100.9 Å²	100.9	69%	0.691	58%	0.577	S	S	*	*	S	Bend	trans	-71.5	126.4	179.3	-67.3	-170.2	178.4	-175.1	1.3	110.7	S364 A365 V369	S364-R367 PolarHBondContact O-N 3.09Å; A365-R367 PolarHBondContact O-N 2.53Å; R367-V369 PolarHBondContact O-N 2.98Å
368	S	79.8	Confident	83.3	Confident	91 Å²	91	103.6 Å²	103.6	64%	0.636	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-64.8	126.3	174.3	57.3	0	0	0	0	110.9	E366	E366-S368 PolarHBondContact O-N 3.07Å
369	V	79.4	Confident	83.2	Confident	116 Å²	116	105 Å²	105	70%	0.703	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-97.3	132	173.9	-179.9	0	0	0	0	109.5	R367 P371	R367-V369 PolarHBondContact O-N 2.98Å; V369-P371 VanDerWaalsContact O-CD 3.28Å; V369-P371 WeakPolarHBondContact O-CD 3.29Å
370	H	79.3	Confident	83.3	Confident	166 Å²	166	99.6 Å²	99.6	77%	0.769	55%	0.554	S	S	*	*			trans	-106	93	172.2	-62.5	-61.4	0	0	0	109.1
371	P	80.8	Confident	83.4	Confident	83 Å²	83	99.1 Å²	99.1	54%	0.539	56%	0.561	S	S	.	*			trans	-68.7	147.4	-175.8	29.8	-36	0	0	0	110.7	V369 V373	V369-P371 VanDerWaalsContact O-CD 3.28Å; V369-P371 WeakPolarHBondContact O-CD 3.29Å; P371-V373 HydrophobicContact CB-CG2 3.93Å; P371-V373 HydrophobicContact CG-CG2 3.96Å; P371-V373 PolarHBondContact O-N 3.26Å
372	L	82.8	Confident	83.4	Confident	183 Å²	183	96.6 Å²	96.6	96%	0.958	54%	0.543	S	S	*	.			trans	-73.1	69	176.1	-172.2	68	0	0	0	110.8
373	V	80.7	Confident	83.5	Confident	79 Å²	79	100.2 Å²	100.2	48%	0.479	56%	0.556	S	S	.	*			trans	-109.8	104.6	172.9	-164.2	0	0	0	0	104.7	P371 S377	P371-V373 HydrophobicContact CB-CG2 3.93Å; P371-V373 HydrophobicContact CG-CG2 3.96Å; P371-V373 PolarHBondContact O-N 3.26Å; V373-S377 WeakPolarHBondContact CG1-OG 3.45Å
374	G	82.9	Confident	83.7	Confident	49 Å²	49	100.4 Å²	100.4	51%	0.505	56%	0.562	S	S	.	*			trans	-40.2	145.9	-164.9	0	0	0	0	0	114.8	A376 S377	G374-A376 PolarHBondContact O-N 3.39Å; G374-S377 WeakPolarHBondContact O-CB 3.46Å; G374-S377 PolarHBondContact O-N 3.23Å; G374-S377 PolarHBondContact O-OG 3.17Å
375	S	85.2	Confident	83.8	Confident	124 Å²	124	104.4 Å²	104.4	87%	0.867	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53	-30.3	-165.9	56.9	0	0	0	0	115.3
376	A	85	Confident	83.7	Confident	66 Å²	66	110.5 Å²	110.5	55%	0.545	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.5	-12.2	179.4	0	0	0	0	0	114.8	G374 K378 I379	G374-A376 PolarHBondContact O-N 3.39Å; A376-K378 VanDerWaalsContact C-N 3.26Å; A376-K378 PolarHBondContact O-N 3.28Å; A376-K378 VanDerWaalsContact O-N 3.13Å; A376-I379 WeakPolarHBondContact O-CB 3.37Å; A376-I379 PolarHBondContact O-N 2.89Å
377	S	81.8	Confident	84	Confident	69 Å²	69	110.8 Å²	110.8	48%	0.483	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.6	-32.4	-169.9	59.7	0	0	0	0	114.7	V373 G374	V373-S377 WeakPolarHBondContact CG1-OG 3.45Å; G374-S377 WeakPolarHBondContact O-CB 3.46Å; G374-S377 PolarHBondContact O-N 3.23Å; G374-S377 PolarHBondContact O-OG 3.17Å
378	K	80.7	Confident	84.5	Confident	110 Å²	110	104.8 Å²	104.8	48%	0.478	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97	-4.4	-178.4	-62.5	-171.6	-179.7	-172.9	0	113.5	A376 H421	A376-K378 VanDerWaalsContact C-N 3.26Å; A376-K378 PolarHBondContact O-N 3.28Å; A376-K378 VanDerWaalsContact O-N 3.13Å; K378-H421 PolarHBondContact O-NE2 3.35Å
379	I	85.1	Confident	85	Confident	102 Å²	102	104.6 Å²	104.6	52%	0.523	57%	0.571	S	S	.	*			trans	-78.8	125.3	-177.4	-57.7	-178.8	0	0	0	109.2	A376 L381	A376-I379 WeakPolarHBondContact O-CB 3.37Å; A376-I379 PolarHBondContact O-N 2.89Å; I379-L381 HydrophobicContact CG2-CD2 3.64Å; I379-L381 HydrophobicContact CG2-CG 3.9Å
380	N	88.3	Confident	85.4	Confident	30 Å²	30	104.6 Å²	104.6	16%	0.16	57%	0.565	C	S	.	*			trans	-103.1	99.4	168	-179.5	-3.8	0	0	0	109.6	V382 K383 N418	N380-V382 PolarHBondContact O-N 3.07Å; N380-V382 VanDerWaalsContact OD1-CG2 3.26Å; N380-V382 WeakPolarHBondContact OD1-CG2 3.35Å; N380-V382 PolarHBondContact OD1-N 2.76Å; N380-K383 PolarHBondContact OD1-N 2.94Å; N380-N418 PolarHBondContact ND2-OD1 3.08Å; N380-N418 PolarHBondContact OD1-OD1 3.18Å
381	L	87.6	Confident	85.9	Confident	153 Å²	153	100.4 Å²	100.4	80%	0.801	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-9.8	179.4	-66.2	175.8	0	0	0	113.6	I379	I379-L381 HydrophobicContact CG2-CD2 3.64Å; I379-L381 HydrophobicContact CG2-CG 3.9Å
382	V	87.6	Confident	86.2	Confident	19 Å²	19	98.2 Å²	98.2	12%	0.115	54%	0.537	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.8	18.2	-168.1	-64.3	0	0	0	0	113.4	N380 N384 K385 I388 V414 N418	N380-V382 PolarHBondContact O-N 3.07Å; N380-V382 VanDerWaalsContact OD1-CG2 3.26Å; N380-V382 WeakPolarHBondContact OD1-CG2 3.35Å; N380-V382 PolarHBondContact OD1-N 2.76Å; V382-N384 PolarHBondContact O-N 3.37Å; V382-K385 HydrophobicContact CB-CB 4.36Å; V382-K385 PolarHBondContact O-N 2.96Å; V382-I388 HydrophobicContact CB-CD1 4.01Å; V382-I388 HydrophobicContact CG1-CD1 3.13Å; V382-I388 HydrophobicContact CG1-CG1 3.77Å; V382-I388 HydrophobicContact CG2-CD1 4.31Å; V382-V414 HydrophobicContact CB-CG2 4.07Å; V382-V414 HydrophobicContact CG2-CB 4.14Å; V382-V414 HydrophobicContact CG2-CG2 3.98Å; V382-N418 PolarHBondContact O-ND2 2.87Å; V382-N418 PolarHBondContact O-OD1 2.92Å
383	K	84.4	Confident	86.5	Confident	159 Å²	159	95.2 Å²	95.2	69%	0.691	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.5	-36.9	-178.3	-171.7	-178.6	176.9	-172.1	0	114.7	N380 N418	N380-K383 PolarHBondContact OD1-N 2.94Å; K383-N418 WeakPolarHBondContact CA-OD1 3.39Å
384	N	86.9	Confident	86.9	Confident	154 Å²	154	98.8 Å²	98.8	82%	0.824	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	9.8	-176.8	-60	-17.1	0	0	0	113.5	V382	V382-N384 PolarHBondContact O-N 3.37Å
385	K	87.9	Confident	87.2	Confident	126 Å²	126	100.9 Å²	100.9	55%	0.548	53%	0.526	S	S	.	.			trans	-110.9	140.3	-179.2	-62.4	-174.7	179.9	-178.7	0	109.9	V382 V414 N418	V382-K385 HydrophobicContact CB-CB 4.36Å; V382-K385 PolarHBondContact O-N 2.96Å; K385-V414 WeakPolarHBondContact O-CG2 3.46Å; K385-N418 PolarHBondContact O-ND2 3.47Å
386	K	86.6	Confident	87.2	Confident	164 Å²	164	100.6 Å²	100.6	71%	0.713	51%	0.509	S	S	*	.	S	Bend	trans	-90.3	-27.7	171.4	-67.6	-175.7	178.5	-179.3	0	112	N413 V414	K386-N413 CarbonylContact O-C 3.53Å; K386-N413 WeakPolarHBondContact O-CA 3.5Å; K386-N413 PolarHBondContact O-OD1 3.01Å; K386-V414 PolarHBondContact O-N 3.26Å
387	E	90.1	Very high	87.2	Confident	100 Å²	100	99.3 Å²	99.3	47%	0.467	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	151.2	-177.1	-61.8	-179.5	175.5	0	0	111.4	V412	E387-V412 CarbonylContact C-O 3.59Å; E387-V412 VanDerWaalsContact CA-O 3.25Å; E387-V412 WeakPolarHBondContact CA-O 3.23Å
388	I	91.7	Very high	87.4	Confident	58 Å²	58	100.6 Å²	100.6	30%	0.297	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	136.2	171.6	-56	170.9	0	0	0	108.3	V382 R411 V412 V414	V382-I388 HydrophobicContact CB-CD1 4.01Å; V382-I388 HydrophobicContact CG1-CD1 3.13Å; V382-I388 HydrophobicContact CG1-CG1 3.77Å; V382-I388 HydrophobicContact CG2-CD1 4.31Å; I388-R411 WeakPolarHBondContact O-CA 3.26Å; I388-V412 PolarHBondContact N-O 3.44Å; I388-V412 PolarHBondContact O-N 3.2Å; I388-V414 HydrophobicContact CD1-CB 4.48Å; I388-V414 HydrophobicContact CD1-CG1 3.61Å; I388-V414 HydrophobicContact CD1-CG2 4.27Å; I388-V414 HydrophobicContact CG1-CG1 3.95Å; I388-V414 HydrophobicContact CG1-CG2 4.09Å
389	V	89.9	Confident	87.7	Confident	87 Å²	87	101.6 Å²	101.6	53%	0.527	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	123.9	169	-175.5	0	0	0	0	108.5	L409 R410 R411	V389-L409 HydrophobicContact CG1-CD2 3.98Å; V389-R410 CarbonylContact C-O 3.4Å; V389-R410 WeakPolarHBondContact CA-O 3.44Å; V389-R411 HydrophobicContact CG2-CG 4.07Å
390	M	88.9	Confident	87.6	Confident	115 Å²	115	98.7 Å²	98.7	57%	0.567	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.7	139.7	173	-59.3	-168.7	74.7	0	0	109.5	R410 V412	M390-R410 PolarHBondContact N-O 3.35Å; M390-R410 PolarHBondContact O-N 2.94Å; M390-V412 HydrophobicContact CG-CG2 4.07Å; M390-V412 HydrophobicContact SD-CG2 3.79Å
391	T	88.5	Confident	87.5	Confident	79 Å²	79	102.3 Å²	102.3	49%	0.485	51%	0.513	S	S	.	.			trans	-141.5	152.1	-179.2	-168.9	0	0	0	0	109.6
392	P	88	Confident	87.2	Confident	36 Å²	36	99.3 Å²	99.3	23%	0.234	50%	0.503	C	S	.	.			trans	-55.8	156.8	171.3	-24.9	33.2	0	0	0	113	L397 Y408	P392-L397 HydrophobicContact CB-CD2 4.02Å; P392-L397 HydrophobicContact CB-CG 4.11Å; P392-L397 HydrophobicContact CG-CD2 4.08Å; P392-L397 VanDerWaalsContact O-CD1 3.29Å; P392-L397 WeakPolarHBondContact O-CD1 3.41Å; P392-Y408 VanDerWaalsContact CG-CB 3.5Å; P392-Y408 HydrophobicContact CG-CG 4.15Å
393	H	89.8	Confident	86.8	Confident	121 Å²	121	102.3 Å²	102.3	56%	0.56	52%	0.524	S	S	*	.			trans	-62.4	145.5	175.8	-174.8	-96.7	0	0	0	111	N395 K396 L397	H393-N395 PolarHBondContact ND1-N 3.5Å; H393-N395 PolarHBondContact O-N 3.01Å; H393-K396 WeakPolarHBondContact O-CA 3.48Å; H393-K396 PolarHBondContact O-N 2.98Å; H393-L397 PolarHBondContact O-N 3.26Å
394	K	88.7	Confident	86.5	Confident	153 Å²	153	98.8 Å²	98.8	67%	0.665	51%	0.51	S	S	*	.	H	α-helix	trans	-50.5	-37.2	-174.3	64.1	178.6	-177.4	175.8	0	114.7	K396 L397 S398	K394-K396 VanDerWaalsContact C-N 3.29Å; K394-K396 PolarHBondContact O-N 2.88Å; K394-L397 PolarHBondContact O-N 3.48Å; K394-S398 PolarHBondContact O-N 3.3Å; K394-S398 VanDerWaalsContact O-N 3.12Å; K394-S398 PolarHBondContact O-OG 3.2Å
395	N	88.8	Confident	86.2	Confident	94 Å²	94	94.6 Å²	94.6	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-66.7	-30	178.9	-60.7	3.1	0	0	0	112.6	H393 S398	H393-N395 PolarHBondContact ND1-N 3.5Å; H393-N395 PolarHBondContact O-N 3.01Å; N395-S398 PolarHBondContact O-OG 3.44Å
396	K	86.2	Confident	85.7	Confident	117 Å²	117	96.1 Å²	96.1	51%	0.509	49%	0.493	S	S	.	.	H	α-helix	trans	-84.8	-30.8	174.4	-73.1	-58.8	-175.3	-173.2	0	112	H393 K394 S398 E399 L400	H393-K396 WeakPolarHBondContact O-CA 3.48Å; H393-K396 PolarHBondContact O-N 2.98Å; K394-K396 VanDerWaalsContact C-N 3.29Å; K394-K396 PolarHBondContact O-N 2.88Å; K396-S398 VanDerWaalsContact C-N 3.28Å; K396-S398 PolarHBondContact O-N 3.49Å; K396-E399 VanDerWaalsContact CD-OE2 3.29Å; K396-E399 WeakPolarHBondContact CD-OE2 3.38Å; K396-E399 IonicContact NZ-OE1 3.15Å; K396-E399 IonicContact NZ-OE2 3.8Å; K396-E399 PolarHBondContact NZ-OE2 3.32Å; K396-E399 PolarHBondContact O-N 2.93Å; K396-L400 WeakPolarHBondContact O-CG 3.34Å
397	L	84.6	Confident	85.5	Confident	39 Å²	39	93.5 Å²	93.5	20%	0.204	49%	0.49	C	S	.	.	H	α-helix	trans	-61.9	-35.6	172.4	-71	172.1	0	0	0	112.4	P392 H393 K394 E399 L400 Q405	P392-L397 HydrophobicContact CB-CD2 4.02Å; P392-L397 HydrophobicContact CB-CG 4.11Å; P392-L397 HydrophobicContact CG-CD2 4.08Å; P392-L397 VanDerWaalsContact O-CD1 3.29Å; P392-L397 WeakPolarHBondContact O-CD1 3.41Å; H393-L397 PolarHBondContact O-N 3.26Å; K394-L397 PolarHBondContact O-N 3.48Å; L397-E399 PolarHBondContact O-N 2.85Å; L397-L400 PolarHBondContact O-N 2.97Å; L397-Q405 HydrophobicContact CD2-CB 4.34Å; L397-Q405 HydrophobicContact CD2-CG 4.04Å; L397-Q405 PolarHBondContact O-NE2 3.45Å
398	S	85.1	Confident	85.1	Confident	96 Å²	96	94.7 Å²	94.7	67%	0.671	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-16.9	177.5	49.6	0	0	0	0	114.7	K394 N395 K396	K394-S398 PolarHBondContact O-N 3.3Å; K394-S398 VanDerWaalsContact O-N 3.12Å; K394-S398 PolarHBondContact O-OG 3.2Å; N395-S398 PolarHBondContact O-OG 3.44Å; K396-S398 VanDerWaalsContact C-N 3.28Å; K396-S398 PolarHBondContact O-N 3.49Å
399	E	86.8	Confident	84.8	Confident	132 Å²	132	96.1 Å²	96.1	62%	0.617	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-8.5	178.3	-64.5	170.9	-168.6	0	0	112.4	K396 L397	K396-E399 VanDerWaalsContact CD-OE2 3.29Å; K396-E399 WeakPolarHBondContact CD-OE2 3.38Å; K396-E399 IonicContact NZ-OE1 3.15Å; K396-E399 IonicContact NZ-OE2 3.8Å; K396-E399 PolarHBondContact NZ-OE2 3.32Å; K396-E399 PolarHBondContact O-N 2.93Å; L397-E399 PolarHBondContact O-N 2.85Å
400	L	84.5	Confident	84.6	Confident	41 Å²	41	100.5 Å²	100.5	22%	0.215	51%	0.506	C	S	.	.	S	Bend	trans	-107.9	143.6	-171.7	-67.1	171	0	0	0	111.9	K396 L397 E404 Q405 Y408	K396-L400 WeakPolarHBondContact O-CG 3.34Å; L397-L400 PolarHBondContact O-N 2.97Å; L400-E404 HydrophobicContact CB-CB 4.28Å; L400-E404 HydrophobicContact CD2-CB 4.34Å; L400-E404 WeakPolarHBondContact CD2-OE2 3.43Å; L400-Q405 HydrophobicContact CB-CG 3.89Å; L400-Q405 PolarHBondContact O-NE2 2.86Å; L400-Y408 HydrophobicContact CD1-CD2 3.93Å; L400-Y408 HydrophobicContact CD1-CE2 4.15Å; L400-Y408 HydrophobicContact CD2-CE2 4.37Å
401	D	86.2	Confident	84.6	Confident	106 Å²	106	104.3 Å²	104.3	57%	0.567	52%	0.515	S	S	*	.			trans	-69.9	153.5	174.9	-80.2	-26.4	0	0	0	111.8	S403 E404 Q405	D401-S403 PolarHBondContact O-N 3.01Å; D401-E404 HydrophobicContact CB-CG 4.3Å; D401-E404 PolarHBondContact N-OE2 3.47Å; D401-E404 WeakPolarHBondContact O-CA 3.44Å; D401-E404 WeakPolarHBondContact O-CB 3.46Å; D401-E404 PolarHBondContact O-N 3.28Å; D401-Q405 WeakPolarHBondContact O-CG 3.38Å; D401-Q405 PolarHBondContact O-N 3.41Å
402	P	81.3	Confident	84.6	Confident	90 Å²	90	103.2 Å²	103.2	58%	0.584	51%	0.508	S	S	*	.	H	α-helix	trans	-57.6	-26.8	-176.7	-26.9	34.9	0	0	0	115.2	K406	P402-K406 WeakPolarHBondContact O-CG 3.28Å
403	S	79.2	Confident	84.7	Confident	81 Å²	81	106 Å²	106	57%	0.566	52%	0.521	S	S	*	.	H	α-helix	trans	-70.4	-42.4	172.9	47.7	0	0	0	0	111.6	D401 K406 T407	D401-S403 PolarHBondContact O-N 3.01Å; S403-K406 PolarHBondContact O-N 3.26Å; S403-T407 PolarHBondContact O-N 2.79Å; S403-T407 PolarHBondContact O-OG1 2.89Å
404	E	78	Confident	84.7	Confident	85 Å²	85	101 Å²	101	40%	0.397	50%	0.498	S	S	.	.	H	α-helix	trans	-70.4	-40.5	178.7	-59.3	-174.8	138.9	0	0	111.6	L400 D401 K406 T407 Y408	L400-E404 HydrophobicContact CB-CB 4.28Å; L400-E404 HydrophobicContact CD2-CB 4.34Å; L400-E404 WeakPolarHBondContact CD2-OE2 3.43Å; D401-E404 HydrophobicContact CB-CG 4.3Å; D401-E404 PolarHBondContact N-OE2 3.47Å; D401-E404 WeakPolarHBondContact O-CA 3.44Å; D401-E404 WeakPolarHBondContact O-CB 3.46Å; D401-E404 PolarHBondContact O-N 3.28Å; E404-K406 PolarHBondContact O-N 3.03Å; E404-T407 WeakPolarHBondContact O-CB 3.3Å; E404-T407 PolarHBondContact O-N 3.47Å; E404-Y408 HydrophobicContact CB-CE2 4.47Å; E404-Y408 WeakPolarHBondContact O-CD2 3.46Å; E404-Y408 PolarHBondContact O-N 3.2Å
405	Q	79.7	Confident	84.7	Confident	66 Å²	66	95.6 Å²	95.6	31%	0.308	48%	0.48	S	S	.	.	H	α-helix	trans	-55.6	-39.4	176	-68.3	176.6	12.9	0	0	112.3	L397 L400 D401 Y408	L397-Q405 HydrophobicContact CD2-CB 4.34Å; L397-Q405 HydrophobicContact CD2-CG 4.04Å; L397-Q405 PolarHBondContact O-NE2 3.45Å; L400-Q405 HydrophobicContact CB-CG 3.89Å; L400-Q405 PolarHBondContact O-NE2 2.86Å; D401-Q405 WeakPolarHBondContact O-CG 3.38Å; D401-Q405 PolarHBondContact O-N 3.41Å; Q405-Y408 PolarHBondContact O-N 2.92Å
406	K	78.3	Confident	84.7	Confident	158 Å²	158	96.8 Å²	96.8	69%	0.687	49%	0.486	S	S	*	.	H	α-helix	trans	-67.9	-36.4	177	-72.9	177.4	-177.2	177.8	0	112.4	P402 S403 E404 Y408 L409	P402-K406 WeakPolarHBondContact O-CG 3.28Å; S403-K406 PolarHBondContact O-N 3.26Å; E404-K406 PolarHBondContact O-N 3.03Å; K406-Y408 VanDerWaalsContact C-N 3.26Å; K406-Y408 PolarHBondContact O-N 3.24Å; K406-L409 PolarHBondContact O-N 3.46Å
407	T	81.9	Confident	84.8	Confident	109 Å²	109	95.7 Å²	95.7	67%	0.669	48%	0.483	S	S	*	.	H	α-helix	trans	-64.2	-31	178.9	-54.3	0	0	0	0	112.2	S403 E404	S403-T407 PolarHBondContact O-N 2.79Å; S403-T407 PolarHBondContact O-OG1 2.89Å; E404-T407 WeakPolarHBondContact O-CB 3.3Å; E404-T407 PolarHBondContact O-N 3.47Å
408	Y	80.8	Confident	85	Confident	126 Å²	126	95.1 Å²	95.1	49%	0.494	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	1.7	-179.3	-67	-69	0	0	0	115.2	P392 L400 E404 Q405 K406	P392-Y408 VanDerWaalsContact CG-CB 3.5Å; P392-Y408 HydrophobicContact CG-CG 4.15Å; L400-Y408 HydrophobicContact CD1-CD2 3.93Å; L400-Y408 HydrophobicContact CD1-CE2 4.15Å; L400-Y408 HydrophobicContact CD2-CE2 4.37Å; E404-Y408 HydrophobicContact CB-CE2 4.47Å; E404-Y408 WeakPolarHBondContact O-CD2 3.46Å; E404-Y408 PolarHBondContact O-N 3.2Å; Q405-Y408 PolarHBondContact O-N 2.92Å; K406-Y408 VanDerWaalsContact C-N 3.26Å; K406-Y408 PolarHBondContact O-N 3.24Å
409	L	84.9	Confident	85.2	Confident	88 Å²	88	93.5 Å²	93.5	46%	0.461	47%	0.473	S	S	.	.			trans	-79.2	123	172.8	-72.9	170.3	0	0	0	110.9	V389 K406	V389-L409 HydrophobicContact CG1-CD2 3.98Å; K406-L409 PolarHBondContact O-N 3.46Å
410	R	86.5	Confident	85.3	Confident	178 Å²	178	94.4 Å²	94.4	67%	0.672	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.9	130.5	176.6	-64.8	-172.6	178.5	-168.1	0.3	111.1	V389 M390	V389-R410 CarbonylContact C-O 3.4Å; V389-R410 WeakPolarHBondContact CA-O 3.44Å; M390-R410 PolarHBondContact N-O 3.35Å; M390-R410 PolarHBondContact O-N 2.94Å
411	R	88.1	Confident	85.5	Confident	196 Å²	196	94.3 Å²	94.3	74%	0.74	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	122	165.1	-72.8	-174.8	-173.7	-156.4	5.7	109	I388 V389	I388-R411 WeakPolarHBondContact O-CA 3.26Å; V389-R411 HydrophobicContact CG2-CG 4.07Å
412	V	88.7	Confident	85.5	Confident	56 Å²	56	92.3 Å²	92.3	34%	0.339	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	122	-179.2	-177.4	0	0	0	0	108.6	E387 I388 M390 V414	E387-V412 CarbonylContact C-O 3.59Å; E387-V412 VanDerWaalsContact CA-O 3.25Å; E387-V412 WeakPolarHBondContact CA-O 3.23Å; I388-V412 PolarHBondContact N-O 3.44Å; I388-V412 PolarHBondContact O-N 3.2Å; M390-V412 HydrophobicContact CG-CG2 4.07Å; M390-V412 HydrophobicContact SD-CG2 3.79Å; V412-V414 HydrophobicContact CG1-CG1 4.4Å
413	N	90.1	Very high	85.9	Confident	95 Å²	95	95.5 Å²	95.5	51%	0.508	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	129.4	172.3	-168.4	-48.7	0	0	0	109.6	K386 S415	K386-N413 CarbonylContact O-C 3.53Å; K386-N413 WeakPolarHBondContact O-CA 3.5Å; K386-N413 PolarHBondContact O-OD1 3.01Å; N413-S415 WeakPolarHBondContact OD1-CB 3.38Å; N413-S415 PolarHBondContact OD1-N 3.47Å; N413-S415 PolarHBondContact OD1-OG 2.95Å
414	V	90.7	Very high	86.3	Confident	14 Å²	14	97 Å²	97	9%	0.085	47%	0.474	C	S	.	.			trans	-118.9	11.2	-176.9	-63.2	0	0	0	0	113.2	V382 K385 K386 I388 V412 D416 H417 N418	V382-V414 HydrophobicContact CB-CG2 4.07Å; V382-V414 HydrophobicContact CG2-CB 4.14Å; V382-V414 HydrophobicContact CG2-CG2 3.98Å; K385-V414 WeakPolarHBondContact O-CG2 3.46Å; K386-V414 PolarHBondContact O-N 3.26Å; I388-V414 HydrophobicContact CD1-CB 4.48Å; I388-V414 HydrophobicContact CD1-CG1 3.61Å; I388-V414 HydrophobicContact CD1-CG2 4.27Å; I388-V414 HydrophobicContact CG1-CG1 3.95Å; I388-V414 HydrophobicContact CG1-CG2 4.09Å; V412-V414 HydrophobicContact CG1-CG1 4.4Å; V414-D416 VanDerWaalsContact C-N 3.32Å; V414-D416 PolarHBondContact O-N 3.48Å; V414-H417 HydrophobicContact CB-CB 4.48Å; V414-H417 WeakPolarHBondContact O-CB 3.32Å; V414-H417 PolarHBondContact O-N 3.38Å; V414-N418 PolarHBondContact O-N 3.27Å
415	S	89.1	Confident	86.6	Confident	41 Å²	41	97.6 Å²	97.6	29%	0.287	47%	0.472	S	S	.	.	H	α-helix	trans	-60.9	-42.1	179.6	-49.3	0	0	0	0	111.4	N413 H417 N418 A419	N413-S415 WeakPolarHBondContact OD1-CB 3.38Å; N413-S415 PolarHBondContact OD1-N 3.47Å; N413-S415 PolarHBondContact OD1-OG 2.95Å; S415-H417 VanDerWaalsContact C-N 3.35Å; S415-H417 PolarHBondContact O-N 2.98Å; S415-N418 PolarHBondContact O-N 3.29Å; S415-A419 PolarHBondContact O-N 2.96Å
416	D	87.9	Confident	86.8	Confident	118 Å²	118	96.4 Å²	96.4	63%	0.631	48%	0.478	S	S	*	.	H	α-helix	trans	-65.6	-37.1	176.9	-68.2	-16.3	0	0	0	112.5	V414 A419 K420	V414-D416 VanDerWaalsContact C-N 3.32Å; V414-D416 PolarHBondContact O-N 3.48Å; D416-A419 PolarHBondContact O-N 3.04Å; D416-K420 WeakPolarHBondContact O-CB 3.31Å; D416-K420 VanDerWaalsContact O-CG 3.27Å; D416-K420 WeakPolarHBondContact O-CG 3.43Å; D416-K420 PolarHBondContact O-N 2.87Å
417	H	88.4	Confident	87.1	Confident	94 Å²	94	93.7 Å²	93.7	44%	0.435	47%	0.47	S	S	.	.	H	α-helix	trans	-62.6	-46.7	174.5	173.6	86.7	0	0	0	110.7	V414 S415 A419 K420 H421	V414-H417 HydrophobicContact CB-CB 4.48Å; V414-H417 WeakPolarHBondContact O-CB 3.32Å; V414-H417 PolarHBondContact O-N 3.38Å; S415-H417 VanDerWaalsContact C-N 3.35Å; S415-H417 PolarHBondContact O-N 2.98Å; H417-A419 PolarHBondContact O-N 2.97Å; H417-K420 PolarHBondContact O-N 3.16Å; H417-H421 WeakPolarHBondContact O-CB 3.45Å; H417-H421 PolarHBondContact O-N 2.92Å
418	N	89.3	Confident	87.2	Confident	27 Å²	27	91.5 Å²	91.5	14%	0.144	45%	0.453	C	S	.	.	H	α-helix	trans	-60.8	-43	177.7	-74.1	-28.8	0	0	0	112.4	N380 V382 K383 K385 V414 S415 H421 A422	N380-N418 PolarHBondContact ND2-OD1 3.08Å; N380-N418 PolarHBondContact OD1-OD1 3.18Å; V382-N418 PolarHBondContact O-ND2 2.87Å; V382-N418 PolarHBondContact O-OD1 2.92Å; K383-N418 WeakPolarHBondContact CA-OD1 3.39Å; K385-N418 PolarHBondContact O-ND2 3.47Å; V414-N418 PolarHBondContact O-N 3.27Å; S415-N418 PolarHBondContact O-N 3.29Å; N418-H421 PolarHBondContact O-N 3.31Å; N418-A422 WeakPolarHBondContact O-CB 3.43Å; N418-A422 PolarHBondContact O-N 3.03Å
419	A	88.9	Confident	87.3	Confident	63 Å²	63	94.6 Å²	94.6	52%	0.521	46%	0.463	S	S	.	.	H	α-helix	trans	-63.7	-45.3	176.8	0	0	0	0	0	112	S415 D416 H417 A422 K423	S415-A419 PolarHBondContact O-N 2.96Å; D416-A419 PolarHBondContact O-N 3.04Å; H417-A419 PolarHBondContact O-N 2.97Å; A419-A422 PolarHBondContact O-N 2.95Å; A419-K423 PolarHBondContact O-N 3.31Å
420	K	88.2	Confident	87.3	Confident	151 Å²	151	93 Å²	93	66%	0.657	46%	0.462	S	S	*	.	H	α-helix	trans	-61.8	-46.1	176.4	-73.9	174.2	-175.1	178.1	0	111.8	D416 H417 A422 K423 Q424	D416-K420 WeakPolarHBondContact O-CB 3.31Å; D416-K420 VanDerWaalsContact O-CG 3.27Å; D416-K420 WeakPolarHBondContact O-CG 3.43Å; D416-K420 PolarHBondContact O-N 2.87Å; H417-K420 PolarHBondContact O-N 3.16Å; K420-A422 PolarHBondContact O-N 3.23Å; K420-K423 PolarHBondContact O-N 3.4Å; K420-Q424 WeakPolarHBondContact O-CB 3.49Å; K420-Q424 PolarHBondContact O-N 2.79Å
421	H	88.8	Confident	87.2	Confident	39 Å²	39	89.3 Å²	89.3	18%	0.181	46%	0.456	C	S	.	.	H	α-helix	trans	-62.1	-44.1	178.7	-168.3	-86.3	0	0	0	111.5	K378 H417 N418 K423 Q424 R425	K378-H421 PolarHBondContact O-NE2 3.35Å; H417-H421 WeakPolarHBondContact O-CB 3.45Å; H417-H421 PolarHBondContact O-N 2.92Å; N418-H421 PolarHBondContact O-N 3.31Å; H421-K423 PolarHBondContact O-N 3.39Å; H421-Q424 PolarHBondContact O-N 3.13Å; H421-R425 VanDerWaalsContact O-CG 3.26Å; H421-R425 WeakPolarHBondContact O-CG 3.42Å; H421-R425 PolarHBondContact O-N 3.16Å
422	A	87.2	Confident	87	Confident	64 Å²	64	81.8 Å²	81.8	53%	0.529	43%	0.434	S	S	.	.	H	α-helix	trans	-61	-44.8	175.7	0	0	0	0	0	112.4	N418 A419 K420 R425 G426	N418-A422 WeakPolarHBondContact O-CB 3.43Å; N418-A422 PolarHBondContact O-N 3.03Å; A419-A422 PolarHBondContact O-N 2.95Å; K420-A422 PolarHBondContact O-N 3.23Å; A422-R425 PolarHBondContact O-N 3.18Å; A422-G426 PolarHBondContact O-N 2.74Å
423	K	89.4	Confident	86.8	Confident	157 Å²	157	84 Å²	84	68%	0.683	45%	0.449	S	S	*	.	H	α-helix	trans	-61	-46	176.3	-174	179.5	-179.7	-179.6	0	111.7	A419 K420 H421 G426 L427	A419-K423 PolarHBondContact O-N 3.31Å; K420-K423 PolarHBondContact O-N 3.4Å; H421-K423 PolarHBondContact O-N 3.39Å; K423-G426 PolarHBondContact O-N 3.06Å; K423-L427 PolarHBondContact O-N 3.5Å
424	Q	86.3	Confident	86.6	Confident	112 Å²	112	84.7 Å²	84.7	52%	0.523	45%	0.453	S	S	.	.	H	α-helix	trans	-61.7	-46	178.6	-175.1	175.1	3.8	0	0	111.8	K420 H421 G426 L427 E428	K420-Q424 WeakPolarHBondContact O-CB 3.49Å; K420-Q424 PolarHBondContact O-N 2.79Å; H421-Q424 PolarHBondContact O-N 3.13Å; Q424-G426 VanDerWaalsContact C-N 3.28Å; Q424-G426 PolarHBondContact O-N 3.18Å; Q424-L427 PolarHBondContact O-N 2.96Å; Q424-E428 WeakPolarHBondContact O-CG 3.36Å; Q424-E428 PolarHBondContact O-N 2.92Å
425	R	84.5	Confident	86.3	Confident	98 Å²	98	89.3 Å²	89.3	37%	0.37	47%	0.472	S	S	.	.	H	α-helix	trans	-64	-33	176.9	-66.6	-65.7	-70	169.2	-8.8	112.7	H421 A422 E428 R429	H421-R425 VanDerWaalsContact O-CG 3.26Å; H421-R425 WeakPolarHBondContact O-CG 3.42Å; H421-R425 PolarHBondContact O-N 3.16Å; A422-R425 PolarHBondContact O-N 3.18Å; R425-E428 WeakPolarHBondContact CD-OE2 3.49Å; R425-E428 IonicContact CZ-OE2 3.08Å; R425-E428 IonicContact NE-OE2 3.33Å; R425-E428 IonicContact NH1-OE2 2.71Å; R425-E428 PolarHBondContact NH1-OE2 3.11Å; R425-R429 VanDerWaalsContact O-CG 3.3Å; R425-R429 WeakPolarHBondContact O-CG 3.37Å; R425-R429 PolarHBondContact O-N 3.35Å
426	G	85.1	Confident	86.1	Confident	41 Å²	41	89.9 Å²	89.9	42%	0.423	48%	0.475	S	S	.	.	H	α-helix	trans	-62.8	-47.1	171.9	0	0	0	0	0	112.3	A422 K423 Q424 R429 A430	A422-G426 PolarHBondContact O-N 2.74Å; K423-G426 PolarHBondContact O-N 3.06Å; Q424-G426 VanDerWaalsContact C-N 3.28Å; Q424-G426 PolarHBondContact O-N 3.18Å; G426-R429 PolarHBondContact O-N 3.18Å; G426-A430 PolarHBondContact O-N 3.03Å
427	L	84.7	Confident	86	Confident	101 Å²	101	86.1 Å²	86.1	53%	0.529	46%	0.455	S	S	.	.	H	α-helix	trans	-64.1	-43.1	177.5	-70.2	169.3	0	0	0	112.4	K423 Q424 R429 A430 N431	K423-L427 PolarHBondContact O-N 3.5Å; Q424-L427 PolarHBondContact O-N 2.96Å; L427-R429 VanDerWaalsContact C-N 3.3Å; L427-R429 PolarHBondContact O-N 3.01Å; L427-A430 PolarHBondContact O-N 3.2Å; L427-N431 PolarHBondContact O-N 3.34Å
428	E	84.1	Confident	85.7	Confident	63 Å²	63	84.8 Å²	84.8	29%	0.294	46%	0.456	S	S	.	.	H	α-helix	trans	-59	-40.2	176.2	-73.7	179	173.9	0	0	112	Q424 R425 N431 S432	Q424-E428 WeakPolarHBondContact O-CG 3.36Å; Q424-E428 PolarHBondContact O-N 2.92Å; R425-E428 WeakPolarHBondContact CD-OE2 3.49Å; R425-E428 IonicContact CZ-OE2 3.08Å; R425-E428 IonicContact NE-OE2 3.33Å; R425-E428 IonicContact NH1-OE2 2.71Å; R425-E428 PolarHBondContact NH1-OE2 3.11Å; E428-N431 CarbonylContact O-C 3.59Å; E428-S432 PolarHBondContact O-N 3.04Å
429	R	82.2	Confident	85.5	Confident	191 Å²	191	88.5 Å²	88.5	72%	0.721	47%	0.471	S	S	*	.	H	α-helix	trans	-69.9	-40.9	177.1	-73.7	172.9	176.7	-174.7	-2.8	112.3	R425 G426 L427 N431	R425-R429 VanDerWaalsContact O-CG 3.3Å; R425-R429 WeakPolarHBondContact O-CG 3.37Å; R425-R429 PolarHBondContact O-N 3.35Å; G426-R429 PolarHBondContact O-N 3.18Å; L427-R429 VanDerWaalsContact C-N 3.3Å; L427-R429 PolarHBondContact O-N 3.01Å; R429-N431 VanDerWaalsContact C-N 3.32Å
430	A	84.2	Confident	85.1	Confident	53 Å²	53	91.1 Å²	91.1	44%	0.438	47%	0.474	S	S	.	.	H	α-helix	trans	-65	-38.7	179.5	0	0	0	0	0	111.9	G426 L427	G426-A430 PolarHBondContact O-N 3.03Å; L427-A430 PolarHBondContact O-N 3.2Å
431	N	84.6	Confident	84.6	Confident	102 Å²	102	89.7 Å²	89.7	55%	0.545	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	44.5	-179	-63.9	-29.2	0	0	0	111.7	L427 E428 R429	L427-N431 PolarHBondContact O-N 3.34Å; E428-N431 CarbonylContact O-C 3.59Å; R429-N431 VanDerWaalsContact C-N 3.32Å
432	S	85.1	Confident	84.1	Confident	38 Å²	38	91.3 Å²	91.3	27%	0.266	48%	0.48	S	S	.	.			trans	-56.2	135	175.3	-178.4	0	0	0	0	110.4	E428 D434 K435 C436	E428-S432 PolarHBondContact O-N 3.04Å; S432-D434 VanDerWaalsContact C-N 3.27Å; S432-D434 PolarHBondContact O-N 3.18Å; S432-K435 WeakPolarHBondContact O-CA 3.39Å; S432-K435 WeakPolarHBondContact O-CB 3.35Å; S432-K435 PolarHBondContact O-N 3.25Å; S432-C436 PolarHBondContact O-N 3.35Å
433	P	84.9	Confident	83.5	Confident	101 Å²	101	94.8 Å²	94.8	66%	0.656	48%	0.479	S	S	*	.	H	α-helix	trans	-48.6	-45.9	179	-29.8	35.9	0	0	0	113.5	K435 C436 L437	P433-K435 VanDerWaalsContact C-N 3.3Å; P433-K435 PolarHBondContact O-N 3.3Å; P433-C436 WeakPolarHBondContact O-CB 3.48Å; P433-C436 PolarHBondContact O-N 3Å; P433-C436 VanDerWaalsContact O-N 3.09Å; P433-L437 PolarHBondContact O-N 3.02Å
434	D	84.2	Confident	82.3	Confident	111 Å²	111	89.6 Å²	89.6	59%	0.594	46%	0.463	S	S	*	.	H	α-helix	trans	-63.7	-36.5	-179.6	-53.6	-34.9	0	0	0	112.4	S432 C436 S438	S432-D434 VanDerWaalsContact C-N 3.27Å; S432-D434 PolarHBondContact O-N 3.18Å; D434-C436 VanDerWaalsContact C-N 3.35Å; D434-S438 WeakPolarHBondContact O-CB 3.5Å; D434-S438 PolarHBondContact O-N 3.29Å; D434-S438 PolarHBondContact O-OG 2.97Å
435	K	84.9	Confident	81.4	Confident	110 Å²	110	91.4 Å²	91.4	48%	0.478	47%	0.469	S	S	.	.	H	α-helix	trans	-71.1	-33.3	176.8	-167.2	176.8	-177.2	179.8	0	111.4	S432 P433 S438 K439	S432-K435 WeakPolarHBondContact O-CA 3.39Å; S432-K435 WeakPolarHBondContact O-CB 3.35Å; S432-K435 PolarHBondContact O-N 3.25Å; P433-K435 VanDerWaalsContact C-N 3.3Å; P433-K435 PolarHBondContact O-N 3.3Å; K435-S438 WeakPolarHBondContact CA-OG 2.85Å; K435-S438 PolarHBondContact O-OG 2.99Å; K435-S438 VanDerWaalsContact O-OG 3.06Å; K435-K439 WeakPolarHBondContact O-CD 3.12Å; K435-K439 VanDerWaalsContact O-CG 3.26Å; K435-K439 WeakPolarHBondContact O-CG 3.49Å; K435-K439 PolarHBondContact O-N 2.85Å
436	C	85.4	Confident	80.3	Confident	54 Å²	54	91 Å²	91	37%	0.365	48%	0.481	S	S	.	.	H	α-helix	trans	-72.3	-43.7	174.9	-67.7	0	0	0	0	111.1	S432 P433 D434 K439 M440	S432-C436 PolarHBondContact O-N 3.35Å; P433-C436 WeakPolarHBondContact O-CB 3.48Å; P433-C436 PolarHBondContact O-N 3Å; P433-C436 VanDerWaalsContact O-N 3.09Å; D434-C436 VanDerWaalsContact C-N 3.35Å; C436-K439 PolarHBondContact O-N 3.31Å; C436-M440 PolarHBondContact O-N 3.36Å
437	L	84.8	Confident	79.4	Confident	39 Å²	39	93.2 Å²	93.2	20%	0.204	48%	0.481	C	S	.	.	H	α-helix	trans	-66.5	-43.4	179.2	-175.5	63.3	0	0	0	112.1	M362 A365 E366 P433 K439 M440 R441	M362-L437 HydrophobicContact CE-CD1 4.32Å; A365-L437 HydrophobicContact CB-CD1 3.92Å; A365-L437 HydrophobicContact CB-CD2 4.3Å; A365-L437 WeakPolarHBondContact O-CD2 3.37Å; E366-L437 HydrophobicContact CB-CD2 4.3Å; E366-L437 HydrophobicContact CG-CD2 3.77Å; P433-L437 PolarHBondContact O-N 3.02Å; L437-K439 VanDerWaalsContact C-N 3.3Å; L437-K439 PolarHBondContact O-N 3.38Å; L437-M440 WeakPolarHBondContact O-CB 2.85Å; L437-M440 PolarHBondContact O-N 3.09Å; L437-M440 VanDerWaalsContact O-N 3.08Å; L437-R441 PolarHBondContact O-N 3.44Å
438	S	83.6	Confident	78.1	Confident	66 Å²	66	93.6 Å²	93.6	46%	0.462	48%	0.483	S	S	.	.	H	α-helix	trans	-59	-40.3	175.6	49.8	0	0	0	0	112.5	D434 K435 R441 S442	D434-S438 WeakPolarHBondContact O-CB 3.5Å; D434-S438 PolarHBondContact O-N 3.29Å; D434-S438 PolarHBondContact O-OG 2.97Å; K435-S438 WeakPolarHBondContact CA-OG 2.85Å; K435-S438 PolarHBondContact O-OG 2.99Å; K435-S438 VanDerWaalsContact O-OG 3.06Å; S438-R441 PolarHBondContact O-N 3.42Å; S438-S442 PolarHBondContact O-N 3.36Å
439	K	83.7	Confident	76.6	Confident	105 Å²	105	96.2 Å²	96.2	46%	0.457	50%	0.495	S	S	.	.	H	α-helix	trans	-63.9	-38.9	172.9	-74.1	173.9	179.9	-177.9	0	112.7	K435 C436 L437 S442 R443	K435-K439 WeakPolarHBondContact O-CD 3.12Å; K435-K439 VanDerWaalsContact O-CG 3.26Å; K435-K439 WeakPolarHBondContact O-CG 3.49Å; K435-K439 PolarHBondContact O-N 2.85Å; C436-K439 PolarHBondContact O-N 3.31Å; L437-K439 VanDerWaalsContact C-N 3.3Å; L437-K439 PolarHBondContact O-N 3.38Å; K439-S442 PolarHBondContact O-OG 2.88Å; K439-R443 WeakPolarHBondContact O-CG 3.48Å; K439-R443 PolarHBondContact O-N 2.96Å; K439-R443 VanDerWaalsContact O-N 3.16Å
440	M	80.3	Confident	75.4	Confident	118 Å²	118	94.7 Å²	94.7	58%	0.581	49%	0.49	S	S	*	.	H	α-helix	trans	-66.5	-40.1	175.3	-73.3	-59.8	-147.1	0	0	111.5	C436 L437 R443 S444	C436-M440 PolarHBondContact O-N 3.36Å; L437-M440 WeakPolarHBondContact O-CB 2.85Å; L437-M440 PolarHBondContact O-N 3.09Å; L437-M440 VanDerWaalsContact O-N 3.08Å; M440-R443 PolarHBondContact O-N 2.96Å; M440-S444 WeakPolarHBondContact O-CB 3.45Å; M440-S444 PolarHBondContact O-N 3.06Å
441	R	78.8	Confident	74.4	Confident	121 Å²	121	95.3 Å²	95.3	46%	0.457	49%	0.486	S	S	.	.	H	α-helix	trans	-64	-41	177.6	-169.8	176.7	-171.4	167.6	7.8	112.6	M362 E366 L437 S438 K445	M362-R441 HydrophobicContact CE-CB 3.8Å; M362-R441 HydrophobicContact CE-CG 3.93Å; E366-R441 IonicContact OE1-CZ 3.11Å; E366-R441 IonicContact OE1-NH1 3.35Å; E366-R441 PolarHBondContact OE1-NH1 3.2Å; E366-R441 IonicContact OE1-NH2 3.97Å; L437-R441 PolarHBondContact O-N 3.44Å; S438-R441 PolarHBondContact O-N 3.42Å; R441-K445 PolarHBondContact O-N 3Å
442	S	78.6	Confident	73.6	Confident	73 Å²	73	92.4 Å²	92.4	51%	0.51	47%	0.468	S	S	.	.	H	α-helix	trans	-65.8	-42.8	176.1	62.2	0	0	0	0	111.4	S438 K439 K445 S446	S438-S442 PolarHBondContact O-N 3.36Å; K439-S442 PolarHBondContact O-OG 2.88Å; S442-K445 PolarHBondContact O-N 2.97Å; S442-S446 PolarHBondContact O-N 2.91Å; S442-S446 PolarHBondContact O-OG 3.08Å
443	R	73.2	Confident	73	Confident	136 Å²	136	96 Å²	96	51%	0.513	48%	0.48	S	S	.	.	H	α-helix	trans	-62.5	-46	175.7	-74.3	178.2	177.7	-175.9	-4.6	112.8	K439 M440 K445 S446 E447	K439-R443 WeakPolarHBondContact O-CG 3.48Å; K439-R443 PolarHBondContact O-N 2.96Å; K439-R443 VanDerWaalsContact O-N 3.16Å; M440-R443 PolarHBondContact O-N 2.96Å; R443-K445 PolarHBondContact O-N 3.4Å; R443-K445 VanDerWaalsContact O-N 3.1Å; R443-S446 PolarHBondContact O-N 3.14Å; R443-S446 PolarHBondContact O-OG 3.32Å; R443-E447 VanDerWaalsContact O-CB 3.3Å; R443-E447 WeakPolarHBondContact O-CB 3.48Å; R443-E447 PolarHBondContact O-N 3.33Å
444	S	65.5	Low	72.5	Confident	48 Å²	48	97.7 Å²	97.7	34%	0.336	47%	0.474	S	S	.	.	H	α-helix	trans	-55.3	-31.9	178	170.2	0	0	0	0	112.9	M440 L448	M440-S444 WeakPolarHBondContact O-CB 3.45Å; M440-S444 PolarHBondContact O-N 3.06Å; S444-L448 VanDerWaalsContact O-CD2 3.26Å; S444-L448 WeakPolarHBondContact O-CD2 3.39Å; S444-L448 VanDerWaalsContact O-CG 3.32Å; S444-L448 WeakPolarHBondContact O-CG 3.25Å
445	K	66.4	Low	72.1	Confident	151 Å²	151	96.9 Å²	96.9	66%	0.657	47%	0.467	S	S	*	.	H	α-helix	trans	-79.9	-34.5	176.3	-69.2	-177.2	177.3	-173.2	0	113.7	R441 S442 R443	R441-K445 PolarHBondContact O-N 3Å; S442-K445 PolarHBondContact O-N 2.97Å; R443-K445 PolarHBondContact O-N 3.4Å; R443-K445 VanDerWaalsContact O-N 3.1Å
446	S	63.1	Low	71.7	Confident	88 Å²	88	98.7 Å²	98.7	62%	0.615	48%	0.482	S	S	*	.	H	α-helix	trans	-89.9	-21.2	-177.4	58.6	0	0	0	0	114.1	S442 R443	S442-S446 PolarHBondContact O-N 2.91Å; S442-S446 PolarHBondContact O-OG 3.08Å; R443-S446 PolarHBondContact O-N 3.14Å; R443-S446 PolarHBondContact O-OG 3.32Å
447	E	64.1	Low	71.1	Confident	89 Å²	89	98.5 Å²	98.5	42%	0.416	49%	0.488	S	S	.	.			trans	-121.1	32	-170.4	-67.5	175.8	-172.2	0	0	112.1	R443 Q449 Y450	R443-E447 VanDerWaalsContact O-CB 3.3Å; R443-E447 WeakPolarHBondContact O-CB 3.48Å; R443-E447 PolarHBondContact O-N 3.33Å; E447-Q449 PolarHBondContact O-N 3.32Å; E447-Q449 VanDerWaalsContact O-N 3.07Å; E447-Y450 HydrophobicContact CB-CD2 4.03Å; E447-Y450 HydrophobicContact CG-CD2 4.39Å; E447-Y450 PolarHBondContact O-N 3.34Å
448	L	57.6	Low	70.6	Confident	109 Å²	109	103.3 Å²	103.3	57%	0.571	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-52.9	-31.7	-179.3	-74.3	164	0	0	0	113.4	S444 Y450 I451	S444-L448 VanDerWaalsContact O-CD2 3.26Å; S444-L448 WeakPolarHBondContact O-CD2 3.39Å; S444-L448 VanDerWaalsContact O-CG 3.32Å; S444-L448 WeakPolarHBondContact O-CG 3.25Å; L448-Y450 PolarHBondContact O-N 3.48Å; L448-I451 HydrophobicContact CD2-CD1 4.03Å; L448-I451 PolarHBondContact O-N 2.85Å
449	Q	53.7	Low	69.8	Low	118 Å²	118	102.7 Å²	102.7	55%	0.551	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-65.5	-18.2	177.9	64.6	-172.7	-2.9	0	0	114.7	E447	E447-Q449 PolarHBondContact O-N 3.32Å; E447-Q449 VanDerWaalsContact O-N 3.07Å
450	Y	56	Low	69	Low	158 Å²	158	104.3 Å²	104.3	62%	0.62	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-101.9	0.3	179.2	-60.2	-70.7	0	0	0	113.2	E447 L448	E447-Y450 HydrophobicContact CB-CD2 4.03Å; E447-Y450 HydrophobicContact CG-CD2 4.39Å; E447-Y450 PolarHBondContact O-N 3.34Å; L448-Y450 PolarHBondContact O-N 3.48Å
451	I	64.3	Low	67.9	Low	67 Å²	67	102.2 Å²	102.2	34%	0.344	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-81.1	123.3	178.1	-57.2	-176	0	0	0	108.8	L448	L448-I451 HydrophobicContact CD2-CD1 4.03Å; L448-I451 PolarHBondContact O-N 2.85Å
452	Q	67.6	Low	66.6	Low	40 Å²	40	99.3 Å²	99.3	19%	0.187	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	129	174.1	-66.1	-179.7	-26.3	0	0	109.6	F459 R460 T461 V470	Q452-F459 HydrophobicContact CB-CB 4.49Å; Q452-F459 HydrophobicContact CB-CD1 3.96Å; Q452-R460 CarbonylContact C-O 3.5Å; Q452-T461 HydrophobicContact CG-CG2 4.13Å; Q452-V470 PolarHBondContact NE2-O 3.47Å
453	F	71.4	Confident	65	Low	114 Å²	114	99.6 Å²	99.6	50%	0.5	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	125.1	173.4	-70.7	-95	0	0	0	109.1	F459 R460	F453-F459 CarbonylContact O-C 3.53Å; F453-F459 VanDerWaalsContact O-CA 3.25Å; F453-F459 WeakPolarHBondContact O-CA 3.32Å; F453-R460 HydrophobicContact CB-CB 4.32Å; F453-R460 PolarHBondContact N-O 3.46Å; F453-R460 PolarHBondContact O-N 3.09Å
454	Y	75.1	Confident	63.5	Low	137 Å²	137	101 Å²	101	54%	0.537	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	115.1	171.5	-171.3	-97.8	0	0	0	109.4	G457 K458 F459	Y454-G457 WeakPolarHBondContact OH-CA 3.27Å; Y454-K458 WeakPolarHBondContact CA-O 3.36Å; Y454-F459 AromaticContact CD2-CD1 3.81Å; Y454-F459 HydrophobicContact CD2-CD1 3.81Å; Y454-F459 AromaticContact CD2-CD2 3.98Å; Y454-F459 HydrophobicContact CD2-CD2 3.98Å; Y454-F459 AromaticContact CD2-CE1 3.56Å; Y454-F459 HydrophobicContact CD2-CE1 3.56Å; Y454-F459 AromaticContact CD2-CE2 3.73Å; Y454-F459 HydrophobicContact CD2-CE2 3.73Å; Y454-F459 HydrophobicContact CD2-CG 4.02Å; Y454-F459 AromaticContact CD2-CZ 3.52Å; Y454-F459 HydrophobicContact CD2-CZ 3.52Å; Y454-F459 HydrophobicContact CE2-CD2 4.3Å; Y454-F459 HydrophobicContact CE2-CE1 4.43Å; Y454-F459 AromaticContact CE2-CE2 3.87Å; Y454-F459 HydrophobicContact CE2-CE2 3.87Å; Y454-F459 AromaticContact CE2-CZ 3.95Å; Y454-F459 HydrophobicContact CE2-CZ 3.95Å; Y454-F459 HydrophobicContact CG-CD1 4.48Å; Y454-F459 HydrophobicContact CG-CE1 4.2Å; Y454-F459 HydrophobicContact CG-CZ 4.46Å
455	E	75.8	Confident	62.4	Low	94 Å²	94	102.1 Å²	102.1	44%	0.439	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	129.6	-178.8	-171.5	-175.7	-160	0	0	109.6	G457 K458 R460	E455-G457 PolarHBondContact O-N 3.44Å; E455-K458 PolarHBondContact N-O 2.84Å; E455-K458 PolarHBondContact O-N 3.48Å; E455-R460 IonicContact OE2-CZ 2.97Å; E455-R460 IonicContact OE2-NH1 3.36Å; E455-R460 PolarHBondContact OE2-NH1 2.89Å
456	N	76.3	Confident	61.2	Low	148 Å²	148	100.6 Å²	100.6	79%	0.791	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	40.2	177.6	-59.5	-32.9	0	0	0	114
457	G	73.2	Confident	60.2	Low	49 Å²	49	104.9 Å²	104.9	51%	0.505	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	80.5	11.7	178.4	0	0	0	0	0	115.3	Y454 E455	Y454-G457 WeakPolarHBondContact OH-CA 3.27Å; E455-G457 PolarHBondContact O-N 3.44Å
458	K	73.5	Confident	59.2	Low	141 Å²	141	108.3 Å²	108.3	61%	0.613	58%	0.575	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-133.4	142.6	-178.6	-63.8	-176.7	-179.3	179.9	0	112.2	Y454 E455	Y454-K458 WeakPolarHBondContact CA-O 3.36Å; E455-K458 PolarHBondContact N-O 2.84Å; E455-K458 PolarHBondContact O-N 3.48Å
459	F	68.6	Low	58.5	Low	53 Å²	53	104.2 Å²	104.2	23%	0.232	56%	0.559	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-84	135.1	170.7	-67	-80.9	0	0	0	111.3	Q452 F453 Y454 D471	Q452-F459 HydrophobicContact CB-CB 4.49Å; Q452-F459 HydrophobicContact CB-CD1 3.96Å; F453-F459 CarbonylContact O-C 3.53Å; F453-F459 VanDerWaalsContact O-CA 3.25Å; F453-F459 WeakPolarHBondContact O-CA 3.32Å; Y454-F459 AromaticContact CD2-CD1 3.81Å; Y454-F459 HydrophobicContact CD2-CD1 3.81Å; Y454-F459 AromaticContact CD2-CD2 3.98Å; Y454-F459 HydrophobicContact CD2-CD2 3.98Å; Y454-F459 AromaticContact CD2-CE1 3.56Å; Y454-F459 HydrophobicContact CD2-CE1 3.56Å; Y454-F459 AromaticContact CD2-CE2 3.73Å; Y454-F459 HydrophobicContact CD2-CE2 3.73Å; Y454-F459 HydrophobicContact CD2-CG 4.02Å; Y454-F459 AromaticContact CD2-CZ 3.52Å; Y454-F459 HydrophobicContact CD2-CZ 3.52Å; Y454-F459 HydrophobicContact CE2-CD2 4.3Å; Y454-F459 HydrophobicContact CE2-CE1 4.43Å; Y454-F459 AromaticContact CE2-CE2 3.87Å; Y454-F459 HydrophobicContact CE2-CE2 3.87Å; Y454-F459 AromaticContact CE2-CZ 3.95Å; Y454-F459 HydrophobicContact CE2-CZ 3.95Å; Y454-F459 HydrophobicContact CG-CD1 4.48Å; Y454-F459 HydrophobicContact CG-CE1 4.2Å; Y454-F459 HydrophobicContact CG-CZ 4.46Å; F459-D471 HydrophobicContact CD2-CB 3.82Å; F459-D471 HydrophobicContact CE2-CB 4.23Å; F459-D471 HydrophobicContact CG-CB 4.34Å
460	R	65.6	Low	58.2	Low	139 Å²	139	104.1 Å²	104.1	53%	0.525	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128	135.7	176.9	-64.2	-179.6	171.2	179.8	-9.2	109.5	Q452 F453 E455	Q452-R460 CarbonylContact C-O 3.5Å; F453-R460 HydrophobicContact CB-CB 4.32Å; F453-R460 PolarHBondContact N-O 3.46Å; F453-R460 PolarHBondContact O-N 3.09Å; E455-R460 IonicContact OE2-CZ 2.97Å; E455-R460 IonicContact OE2-NH1 3.36Å; E455-R460 PolarHBondContact OE2-NH1 2.89Å
461	T	57.8	Low	57.8	Low	73 Å²	73	97.4 Å²	97.4	45%	0.448	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	141.9	172.6	40	0	0	0	0	110.6	Q452 A463	Q452-T461 HydrophobicContact CG-CG2 4.13Å; T461-A463 PolarHBondContact O-N 3.36Å
462	S	51.3	Low	56.9	Low	60 Å²	60	99.1 Å²	99.1	42%	0.42	55%	0.551	S	S	.	*	S	Bend	trans	-91.4	100.5	174.1	169.5	0	0	0	0	111.4
463	A	45.2	Very low	55.8	Low	79 Å²	79	102.4 Å²	102.4	65%	0.653	56%	0.562	S	S	*	*	S	Bend	trans	-176.5	115.1	130.2	0	0	0	0	0	108.2	T461	T461-A463 PolarHBondContact O-N 3.36Å
464	N	41.9	Very low	54.6	Low	166 Å²	166	101.1 Å²	101.1	89%	0.888	56%	0.563	S	S	*	*	S	Bend	trans	47.6	90.6	167.6	-65.9	-10.3	0	0	0	116.9
465	G	41	Very low	52.9	Low	71 Å²	71	104.6 Å²	104.6	73%	0.732	58%	0.575	S	S	*	*	S	Bend	trans	75.2	115.6	148.7	0	0	0	0	0	116.4
466	S	41.7	Very low	51.1	Low	120 Å²	120	103.5 Å²	103.5	84%	0.839	58%	0.582	S	S	*	*			trans	41.8	90.3	157.9	74	0	0	0	0	117.5
467	Q	43.3	Very low	49.2	Very low	177 Å²	177	99.5 Å²	99.5	83%	0.827	58%	0.576	S	S	*	*			trans	-154.1	131.3	132	-105.8	171.6	20.8	0	0	106.9	G469	Q467-G469 VanDerWaalsContact C-N 3.31Å; Q467-G469 PolarHBondContact O-N 3.38Å
468	N	42.2	Very low	47.3	Very low	161 Å²	161	104.6 Å²	104.6	86%	0.861	59%	0.592	S	S	*	*			trans	-60.9	99.1	169.6	-75.3	-24.4	0	0	0	106.7	V470	N468-V470 PolarHBondContact O-N 3.07Å
469	G	42.9	Very low	45.3	Very low	23 Å²	23	104.6 Å²	104.6	24%	0.237	60%	0.597	C	S	.	*	P	Polyproline II helix	trans	-60.7	128.8	-179	0	0	0	0	0	109.7	Q467 D471	Q467-G469 VanDerWaalsContact C-N 3.31Å; Q467-G469 PolarHBondContact O-N 3.38Å; G469-D471 PolarHBondContact O-N 2.87Å
470	V	48.1	Very low	43.4	Very low	116 Å²	116	109.6 Å²	109.6	70%	0.703	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-57.2	121.6	168.2	-177	0	0	0	0	107	Q452 N468 L472	Q452-V470 PolarHBondContact NE2-O 3.47Å; N468-V470 PolarHBondContact O-N 3.07Å; V470-L472 PolarHBondContact O-N 3.04Å
471	D	47	Very low	41.6	Very low	17 Å²	17	111.5 Å²	111.5	9%	0.091	64%	0.638	C	S	.	*	P	Polyproline II helix	trans	-62.5	133.1	174.7	149	45.9	0	0	0	108.4	F459 G469 W473 T474	F459-D471 HydrophobicContact CD2-CB 3.82Å; F459-D471 HydrophobicContact CE2-CB 4.23Å; F459-D471 HydrophobicContact CG-CB 4.34Å; G469-D471 PolarHBondContact O-N 2.87Å; D471-W473 PolarHBondContact O-N 2.9Å; D471-W473 WeakPolarHBondContact OD1-CB 3.49Å; D471-W473 PolarHBondContact OD1-N 2.71Å; D471-T474 WeakPolarHBondContact CA-OG1 3.38Å; D471-T474 WeakPolarHBondContact CB-OG1 3.44Å; D471-T474 VanDerWaalsContact CG-OG1 3.25Å; D471-T474 PolarHBondContact N-OG1 3.08Å; D471-T474 PolarHBondContact O-N 3.08Å; D471-T474 PolarHBondContact O-OG1 3.1Å; D471-T474 PolarHBondContact OD2-N 2.66Å; D471-T474 PolarHBondContact OD2-OG1 3.39Å
472	L	44.9	Very low	40	Very low	103 Å²	103	115 Å²	115	54%	0.539	65%	0.654	S	S	.	*	G	3₁₀ helix	trans	-68.3	-19	-176.2	-81.1	156.3	0	0	0	111.8	V470	V470-L472 PolarHBondContact O-N 3.04Å
473	W	45.7	Very low	39.3	Very low	110 Å²	110	118.8 Å²	118.8	42%	0.417	68%	0.675	S	S	.	*	G	3₁₀ helix	trans	-79.3	-20.8	170.7	-58.5	95.4	0	0	0	112.7	I353 A357 L359 D471 R475	I353-W473 HydrophobicContact CD1-CE3 4.27Å; A357-W473 HydrophobicContact CB-CH2 4.46Å; L359-W473 HydrophobicContact CD2-CZ2 4.11Å; D471-W473 PolarHBondContact O-N 2.9Å; D471-W473 WeakPolarHBondContact OD1-CB 3.49Å; D471-W473 PolarHBondContact OD1-N 2.71Å; W473-R475 PolarHBondContact O-N 3.28Å
474	T	44.6	Very low	38.5	Very low	86 Å²	86	118.7 Å²	118.7	53%	0.528	67%	0.674	S	S	.	*	G	3₁₀ helix	trans	-84	24.8	172.2	18.6	0	0	0	0	113.5	D471 A476	D471-T474 WeakPolarHBondContact CA-OG1 3.38Å; D471-T474 WeakPolarHBondContact CB-OG1 3.44Å; D471-T474 VanDerWaalsContact CG-OG1 3.25Å; D471-T474 PolarHBondContact N-OG1 3.08Å; D471-T474 PolarHBondContact O-N 3.08Å; D471-T474 PolarHBondContact O-OG1 3.1Å; D471-T474 PolarHBondContact OD2-N 2.66Å; D471-T474 PolarHBondContact OD2-OG1 3.39Å; T474-A476 PolarHBondContact O-N 3.2Å
475	R	40.5	Very low	37.8	Very low	210 Å²	210	117.3 Å²	117.3	79%	0.792	67%	0.672	S	S	*	*			trans	-73	76.8	166.8	-83.6	-169.6	178.2	-173.2	1.7	111.4	W473	W473-R475 PolarHBondContact O-N 3.28Å
476	A	38	Very low	37.2	Very low	71 Å²	71	119.5 Å²	119.5	59%	0.587	68%	0.676	S	S	*	*			trans	-176.6	97.8	138.6	0	0	0	0	0	107	T474 I479	T474-A476 PolarHBondContact O-N 3.2Å; A476-I479 HydrophobicContact CB-CD1 4.33Å
477	G	36.1	Very low	36.5	Very low	64 Å²	64	120.8 Å²	120.8	66%	0.66	67%	0.673	S	S	*	*	S	Bend	trans	-54.5	148.2	151.5	0	0	0	0	0	108.4	I479	G477-I479 PolarHBondContact O-N 2.99Å
478	D	33.2	Very low	35.9	Very low	157 Å²	157	117.7 Å²	117.7	84%	0.84	67%	0.668	S	S	*	*			trans	-24.3	93.5	178.4	-59.9	-54.5	0	0	0	113.1	E480	D478-E480 PolarHBondContact O-N 2.87Å
479	I	32.8	Very low	35.3	Very low	140 Å²	140	117.2 Å²	117.2	72%	0.718	67%	0.666	S	S	*	*			trans	-78.6	88.1	159.7	-59	177.2	0	0	0	103.4	A476 G477 M481	A476-I479 HydrophobicContact CB-CD1 4.33Å; G477-I479 PolarHBondContact O-N 2.99Å; I479-M481 PolarHBondContact O-N 2.63Å; I479-M481 VanDerWaalsContact O-N 3.12Å
480	E	28.6	Very low	34.6	Very low	158 Å²	158	123.8 Å²	123.8	74%	0.738	69%	0.69	S	S	*	*			trans	-44.3	122	150.9	-80.8	-175.1	154.6	0	0	106.3	D478 N482	D478-E480 PolarHBondContact O-N 2.87Å; E480-N482 PolarHBondContact O-N 3.43Å
481	M	27.1	Very low	33.8	Very low	179 Å²	179	125 Å²	125	88%	0.882	70%	0.698	S	S	*	*			trans	-62.4	83.9	173.3	-80.3	-173.9	178.8	0	0	108.6	I479 V483	I479-M481 PolarHBondContact O-N 2.63Å; I479-M481 VanDerWaalsContact O-N 3.12Å; M481-V483 VanDerWaalsContact C-N 3.3Å; M481-V483 PolarHBondContact O-N 3Å
482	N	24.6	Very low	32.9	Very low	146 Å²	146	131.8 Å²	131.8	78%	0.781	73%	0.729	S	S	*	*			trans	-70.7	96.8	159.8	-96.3	-32.4	0	0	0	106.8	E480 A484	E480-N482 PolarHBondContact O-N 3.43Å; N482-A484 VanDerWaalsContact C-N 3.3Å; N482-A484 PolarHBondContact O-N 2.89Å
483	V	37	Very low	32.1	Very low	141 Å²	141	131.9 Å²	131.9	86%	0.855	74%	0.735	S	S	*	*			trans	-62.6	92.4	164.9	178.9	0	0	0	0	107.5	M481	M481-V483 VanDerWaalsContact C-N 3.3Å; M481-V483 PolarHBondContact O-N 3Å
484	A	28.2	Very low	31.3	Very low	77 Å²	77	135.2 Å²	135.2	64%	0.636	76%	0.755	S	S	*	*			trans	-159.4	127.6	162.2	0	0	0	0	0	112.6	N482	N482-A484 VanDerWaalsContact C-N 3.3Å; N482-A484 PolarHBondContact O-N 2.89Å
485	T	27.1	Very low	30.5	Very low	137 Å²	137	137.1 Å²	137.1	84%	0.84	77%	0.772	S	S	*	*			trans	70.9	89.4	159.9	60.4	0	0	0	0	119.4
486	S	28	Very low	30	Very low	117 Å²	117	134.2 Å²	134.2	82%	0.818	77%	0.77	S	S	*	*			trans	-40.9	129.4	155.7	52.5	0	0	0	0	114.5
487	N	27.2	Very low	29.5	Very low	146 Å²	146	135 Å²	135	78%	0.781	78%	0.777	S	S	*	*			trans	-99.7	120.1	164.5	-156.7	-5.9	0	0	0	108.8	N489	N487-N489 VanDerWaalsContact C-N 3.3Å; N487-N489 PolarHBondContact O-N 3.42Å
488	P	30.9	Very low	29.2	Very low	112 Å²	112	138.3 Å²	138.3	73%	0.727	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	10.5	-160.6	-14	29.6	0	0	0	117.5
489	N	29.9	Very low	29	Very low	151 Å²	151	139.5 Å²	139.5	81%	0.807	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.4	29.6	-166.1	-82.2	-23.9	0	0	0	116.3	N487	N487-N489 VanDerWaalsContact C-N 3.3Å; N487-N489 PolarHBondContact O-N 3.42Å
490	Q	28.4	Very low	28.9	Very low	162 Å²	162	138.1 Å²	138.1	76%	0.757	78%	0.782	S	S	*	*			trans	-119.2	99.6	164.5	-79.1	-171.4	-7.3	0	0	111	H492	Q490-H492 PolarHBondContact O-N 3.14Å
491	V	29.3	Very low	29	Very low	142 Å²	142	136.4 Å²	136.4	86%	0.861	79%	0.785	S	S	*	*			trans	-77.7	102.2	172.7	178.9	0	0	0	0	108.8
492	H	28.4	Very low	29.2	Very low	159 Å²	159	137.2 Å²	137.2	74%	0.736	79%	0.787	S	S	*	*			trans	-80.6	132.7	160.6	-73.8	-82.9	0	0	0	109.6	Q490	Q490-H492 PolarHBondContact O-N 3.14Å
493	P	28.6	Very low	29.4	Very low	104 Å²	104	138.7 Å²	138.7	68%	0.675	79%	0.789	S	S	*	*			trans	-105.2	87.1	172.4	35.3	-24.3	0	0	0	110.2
494	H	29.2	Very low	29.2	Very low	180 Å²	180	141.4 Å²	141.4	83%	0.833	79%	0.792	S	S	*	*			trans	-157.4	91.4	154.4	-80.3	-55.7	0	0	0	109.6
495	S	27.3	Very low	29.3	Very low	127 Å²	127	146 Å²	146	89%	0.888	80%	0.8	S	S	*	*			trans	-86.9	108.6	159.5	40.5	0	0	0	0	108.2
496	I	29.4	Very low	29.5	Very low	148 Å²	148	145.2 Å²	145.2	76%	0.759	80%	0.796	S	S	*	*			trans	-89.2	116.3	162	-65.3	175.1	0	0	0	105.6	V498	I496-V498 PolarHBondContact O-N 3.15Å
497	A	29	Very low	29.5	Very low	88 Å²	88	145.8 Å²	145.8	73%	0.727	79%	0.794	S	S	*	*			trans	-69.7	113.8	171.1	0	0	0	0	0	108.6
498	V	29.2	Very low	29.5	Very low	133 Å²	133	143.7 Å²	143.7	81%	0.806	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-85	120.2	169	176.6	0	0	0	0	107.1	I496	I496-V498 PolarHBondContact O-N 3.15Å
499	F	28.6	Very low	29.7	Very low	183 Å²	183	149.3 Å²	149.3	80%	0.803	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-74	142.8	166.9	-77	-88.6	0	0	0	109.6
500	P	31.8	Very low	30	Very low	110 Å²	110	154.6 Å²	154.6	71%	0.714	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-76	156.4	-179.7	31.6	-33.2	0	0	0	111.9
501	P	30.6	Very low	30	Very low	123 Å²	123	154.3 Å²	154.3	80%	0.799	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-75.7	136.5	-178.6	30.2	-32.1	0	0	0	111.7	E503	P501-E503 PolarHBondContact O-N 3.1Å
502	E	29.8	Very low	30.1	Very low	196 Å²	196	154.9 Å²	154.9	92%	0.916	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-67.9	122.4	170.4	-77.4	179.5	153.9	0	0	110.5
503	E	29.1	Very low	30.2	Very low	177 Å²	177	154.7 Å²	154.7	83%	0.827	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-69.3	126.3	167	-77.7	179.5	147.3	0	0	110.4	P501 Q505	P501-E503 PolarHBondContact O-N 3.1Å; E503-Q505 PolarHBondContact O-N 3.3Å
504	Q	34.2	Very low	30.3	Very low	197 Å²	197	157.6 Å²	157.6	92%	0.921	83%	0.832	S	S	*	*			trans	-69	113.4	160.2	-76.6	178.8	-25.9	0	0	109.2
505	Q	29.4	Very low	30.3	Very low	173 Å²	173	156.3 Å²	156.3	81%	0.808	83%	0.831	S	S	*	*			trans	-127.4	127.9	154.9	-84.1	-171	1	0	0	111.5	E503	E503-Q505 PolarHBondContact O-N 3.3Å
506	T	31.2	Very low	30.5	Very low	122 Å²	122	158.2 Å²	158.2	75%	0.748	83%	0.828	S	S	*	*			trans	-44.9	147.5	165.9	46.4	0	0	0	0	115.4
507	T	28.6	Very low	30.6	Very low	128 Å²	128	158.9 Å²	158.9	79%	0.785	83%	0.833	S	S	*	*				145.6	116.1	128.3	50.5	0	0	0	0	111.9
508	S	27.5	Very low	30.7	Very low	103 Å²	103	164.4 Å²	164.4	72%	0.72	84%	0.841	S	S	*	*				90.7	118.3	110	73.2	0	0	0	0	116.5
509	R	33.9	Very low	30.9	Very low	229 Å²	229	167 Å²	167	86%	0.864	84%	0.844	S	S	*	*			trans	35.6	117.6	140.8	-68.1	-178.8	175.4	179.1	-1.6	118.6
510	H	35.6	Very low	31.1	Very low	263 Å²	263	165.5 Å²	165.5	100%	1.218	85%	0.847	S	S	*	*				-155.5	0	95.9	-107.5	-58.5	0	0	0	111.8

Retrieved 510 of 510 residues in 122.2 ms (Link to these results)

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