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protein-serine/threonine phosphatase

Serine/threonine protein phosphatase that may dephosphorylate and activate lipins. Lipins are phosphatidate phosphatases that catalyze the conversion of phosphatidic acid to diacylglycerol and control the metabolism of fatty acids at different levels. May indirectly modulate the lipid composition of nuclear and/or endoplasmic reticulum membranes and be required for proper nuclear membrane morphology and/or dynamics. May also indirectly regulate the production of lipid droplets and triacylglycerol. May antagonize BMP signaling.

AlphaFold DB (A0A4W5PH55), UniProt , Accession A0A060XN94, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110500674, Length 245 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	52.9	Low	59.7	Low	192 Å²	192	123 Å²	123	95%	0.946	63%	0.626	S	S	*	*				0	-32.6	0	-96.9	175.9	72.1	0	0	115.2
2	L	53.5	Low	60.4	Low	138 Å²	138	127.8 Å²	127.8	72%	0.723	63%	0.631	S	S	*	*	H	α-helix	trans	-70.3	-41.9	-179.1	-101.6	85.5	0	0	0	115.2	T4 R5 Q6	L2-T4 VanDerWaalsContact C-N 3.34Å; L2-T4 PolarHBondContact O-N 2.61Å; L2-R5 PolarHBondContact O-N 3.1Å; L2-Q6 PolarHBondContact O-N 2.99Å; L2-Q6 VanDerWaalsContact O-N 3.13Å
3	K	54.9	Low	61.3	Low	180 Å²	180	124.6 Å²	124.6	78%	0.783	62%	0.623	S	S	*	*	H	α-helix	trans	-60.4	-39.2	-178.2	-87.6	-177.5	172.7	179.8	0	113.3	Q6 C7	K3-Q6 PolarHBondContact O-N 3.27Å; K3-C7 PolarHBondContact O-N 2.97Å; K3-C7 VanDerWaalsContact O-N 3.1Å
4	T	56.7	Low	62.5	Low	94 Å²	94	125.6 Å²	125.6	58%	0.577	62%	0.622	S	S	*	*	H	α-helix	trans	-68	-35.5	179.3	-26.2	0	0	0	0	111.9	L2 L8	L2-T4 VanDerWaalsContact C-N 3.34Å; L2-T4 PolarHBondContact O-N 2.61Å; T4-L8 PolarHBondContact O-N 2.95Å; T4-L8 VanDerWaalsContact O-N 3.1Å
5	R	55.3	Low	63.4	Low	193 Å²	193	124.1 Å²	124.1	73%	0.728	62%	0.616	S	S	*	*	H	α-helix	trans	-70.2	-39.4	175.6	-82.3	-173.1	164.8	-166.9	-3.2	112.7	L2 L9	L2-R5 PolarHBondContact O-N 3.1Å; R5-L9 WeakPolarHBondContact O-CB 3.26Å; R5-L9 PolarHBondContact O-N 3.2Å
6	Q	57.3	Low	64	Low	133 Å²	133	118.4 Å²	118.4	62%	0.621	60%	0.599	S	S	*	*	H	α-helix	trans	-66.4	-39.6	175.3	-78.5	176.2	-23.9	0	0	112.4	L2 K3 L9 G10	L2-Q6 PolarHBondContact O-N 2.99Å; L2-Q6 VanDerWaalsContact O-N 3.13Å; K3-Q6 PolarHBondContact O-N 3.27Å; Q6-L9 PolarHBondContact O-N 3.43Å; Q6-G10 PolarHBondContact O-N 3.15Å
7	C	59.8	Low	64.9	Low	79 Å²	79	116.2 Å²	116.2	53%	0.534	59%	0.593	S	S	.	*	H	α-helix	trans	-65.6	-43.3	176.2	-167.9	0	0	0	0	112.1	K3 L9 G10 I11	K3-C7 PolarHBondContact O-N 2.97Å; K3-C7 VanDerWaalsContact O-N 3.1Å; C7-L9 VanDerWaalsContact C-N 3.29Å; C7-L9 PolarHBondContact O-N 3.41Å; C7-G10 PolarHBondContact O-N 2.7Å; C7-I11 WeakPolarHBondContact O-CG1 3.39Å; C7-I11 PolarHBondContact O-N 3.02Å
8	L	62.3	Low	65.9	Low	101 Å²	101	112.7 Å²	112.7	53%	0.529	58%	0.578	S	S	.	*	H	α-helix	trans	-61.6	-36.7	173.6	-113.5	111.3	0	0	0	112.8	T4 R12	T4-L8 PolarHBondContact O-N 2.95Å; T4-L8 VanDerWaalsContact O-N 3.1Å; L8-R12 WeakPolarHBondContact O-CB 3.38Å; L8-R12 WeakPolarHBondContact O-CG 3.4Å; L8-R12 PolarHBondContact O-N 2.89Å
9	L	62.8	Low	66.7	Low	114 Å²	114	111.1 Å²	111.1	60%	0.597	58%	0.578	S	S	*	*	H	α-helix	trans	-67.3	-41.2	176.8	-152.7	77.4	0	0	0	111.1	R5 Q6 C7 R12 T13	R5-L9 WeakPolarHBondContact O-CB 3.26Å; R5-L9 PolarHBondContact O-N 3.2Å; Q6-L9 PolarHBondContact O-N 3.43Å; C7-L9 VanDerWaalsContact C-N 3.29Å; C7-L9 PolarHBondContact O-N 3.41Å; L9-R12 PolarHBondContact O-N 3.33Å; L9-T13 PolarHBondContact O-N 3.14Å; L9-T13 PolarHBondContact O-OG1 3.27Å
10	G	67.6	Low	67.4	Low	36 Å²	36	115.9 Å²	115.9	37%	0.371	59%	0.588	S	S	.	*	H	α-helix	trans	-63.7	-39	175	0	0	0	0	0	113.7	Q6 C7 T13 F14	Q6-G10 PolarHBondContact O-N 3.15Å; C7-G10 PolarHBondContact O-N 2.7Å; G10-T13 WeakPolarHBondContact CA-OG1 3.37Å; G10-T13 PolarHBondContact O-OG1 3.03Å; G10-F14 WeakPolarHBondContact O-CB 3.2Å; G10-F14 PolarHBondContact O-N 3.08Å
11	I	73.2	Confident	68.3	Low	93 Å²	93	115 Å²	115	48%	0.477	58%	0.584	S	S	.	*	H	α-helix	trans	-68.6	-40.5	174.6	-66.4	166.8	0	0	0	110.6	C7 F14 L15	C7-I11 WeakPolarHBondContact O-CG1 3.39Å; C7-I11 PolarHBondContact O-N 3.02Å; I11-F14 PolarHBondContact O-N 3.43Å; I11-L15 HydrophobicContact CG2-CD1 3.79Å; I11-L15 HydrophobicContact CG2-CG 4.3Å; I11-L15 WeakPolarHBondContact O-CB 3.39Å; I11-L15 VanDerWaalsContact O-CG 3.25Å; I11-L15 WeakPolarHBondContact O-CG 3.22Å; I11-L15 PolarHBondContact O-N 3.12Å
12	R	68.2	Low	69.8	Low	181 Å²	181	114 Å²	114	68%	0.683	57%	0.57	S	S	*	*	H	α-helix	trans	-65.4	-41.6	176	-80.9	-177.9	168.8	-174.5	-2.9	112.7	L8 L9 G16	L8-R12 WeakPolarHBondContact O-CB 3.38Å; L8-R12 WeakPolarHBondContact O-CG 3.4Å; L8-R12 PolarHBondContact O-N 2.89Å; L9-R12 PolarHBondContact O-N 3.33Å; R12-G16 PolarHBondContact O-N 3.47Å
13	T	72	Confident	71.2	Confident	86 Å²	86	109.2 Å²	109.2	53%	0.528	55%	0.554	S	S	.	*	H	α-helix	trans	-67.9	-41.2	174.9	46.5	0	0	0	0	111.2	L9 G10 G16 V17	L9-T13 PolarHBondContact O-N 3.14Å; L9-T13 PolarHBondContact O-OG1 3.27Å; G10-T13 WeakPolarHBondContact CA-OG1 3.37Å; G10-T13 PolarHBondContact O-OG1 3.03Å; T13-G16 PolarHBondContact O-N 2.63Å; T13-V17 VanDerWaalsContact O-CG2 3.29Å; T13-V17 WeakPolarHBondContact O-CG2 3.49Å; T13-V17 PolarHBondContact O-N 3.15Å
14	F	78.2	Confident	72.6	Confident	139 Å²	139	106.6 Å²	106.6	61%	0.61	54%	0.543	S	S	*	.	H	α-helix	trans	-60.7	-48.8	174.5	-176.8	-100.7	0	0	0	112.1	G10 I11 G16 V17 T18	G10-F14 WeakPolarHBondContact O-CB 3.2Å; G10-F14 PolarHBondContact O-N 3.08Å; I11-F14 PolarHBondContact O-N 3.43Å; F14-G16 VanDerWaalsContact C-N 3.3Å; F14-G16 PolarHBondContact O-N 3.2Å; F14-V17 PolarHBondContact O-N 3.13Å; F14-T18 HydrophobicContact CD1-CG2 4.15Å; F14-T18 HydrophobicContact CE1-CG2 3.79Å; F14-T18 HydrophobicContact CE2-CG2 4.21Å; F14-T18 HydrophobicContact CZ-CG2 3.82Å; F14-T18 WeakPolarHBondContact O-CG2 3.36Å; F14-T18 PolarHBondContact O-N 3.36Å; F14-T18 PolarHBondContact O-OG1 3.45Å
15	L	75.9	Confident	74	Confident	102 Å²	102	108.5 Å²	108.5	53%	0.534	54%	0.543	S	S	.	.	H	α-helix	trans	-61	-37.1	175.1	-74.2	168.8	0	0	0	112.6	I11 T18 S19	I11-L15 HydrophobicContact CG2-CD1 3.79Å; I11-L15 HydrophobicContact CG2-CG 4.3Å; I11-L15 WeakPolarHBondContact O-CB 3.39Å; I11-L15 VanDerWaalsContact O-CG 3.25Å; I11-L15 WeakPolarHBondContact O-CG 3.22Å; I11-L15 PolarHBondContact O-N 3.12Å; L15-T18 WeakPolarHBondContact CA-OG1 3.49Å; L15-T18 PolarHBondContact O-OG1 3.18Å; L15-T18 VanDerWaalsContact O-OG1 3.07Å; L15-S19 WeakPolarHBondContact O-CB 3.46Å; L15-S19 PolarHBondContact O-N 3.29Å
16	G	73.6	Confident	75.5	Confident	34 Å²	34	101.9 Å²	101.9	35%	0.351	52%	0.522	S	S	.	.	H	α-helix	trans	-66.1	-41.2	174.6	0	0	0	0	0	112.6	R12 T13 F14 R20	R12-G16 PolarHBondContact O-N 3.47Å; T13-G16 PolarHBondContact O-N 2.63Å; F14-G16 VanDerWaalsContact C-N 3.3Å; F14-G16 PolarHBondContact O-N 3.2Å; G16-R20 WeakPolarHBondContact O-CG 3.46Å; G16-R20 PolarHBondContact O-N 3.12Å; G16-R20 VanDerWaalsContact O-N 3.09Å
17	V	78.6	Confident	76.6	Confident	80 Å²	80	100.3 Å²	100.3	49%	0.485	51%	0.511	S	S	.	.	H	α-helix	trans	-68.8	-45.6	176.9	171.5	0	0	0	0	110.8	T13 F14 S19 R20 I21	T13-V17 VanDerWaalsContact O-CG2 3.29Å; T13-V17 WeakPolarHBondContact O-CG2 3.49Å; T13-V17 PolarHBondContact O-N 3.15Å; F14-V17 PolarHBondContact O-N 3.13Å; V17-S19 VanDerWaalsContact C-N 3.34Å; V17-S19 PolarHBondContact O-N 3.26Å; V17-R20 PolarHBondContact O-N 3.18Å; V17-I21 HydrophobicContact CG1-CD1 3.71Å; V17-I21 HydrophobicContact CG1-CG1 4.38Å; V17-I21 VanDerWaalsContact O-CG1 3.31Å; V17-I21 WeakPolarHBondContact O-CG1 3.46Å; V17-I21 PolarHBondContact O-N 2.91Å
18	T	82.6	Confident	77.8	Confident	54 Å²	54	99.3 Å²	99.3	33%	0.331	50%	0.5	S	S	.	.	H	α-helix	trans	-64.2	-38.5	177.4	56.9	0	0	0	0	111.8	F14 L15 R20 I21 W22	F14-T18 HydrophobicContact CD1-CG2 4.15Å; F14-T18 HydrophobicContact CE1-CG2 3.79Å; F14-T18 HydrophobicContact CE2-CG2 4.21Å; F14-T18 HydrophobicContact CZ-CG2 3.82Å; F14-T18 WeakPolarHBondContact O-CG2 3.36Å; F14-T18 PolarHBondContact O-N 3.36Å; F14-T18 PolarHBondContact O-OG1 3.45Å; L15-T18 WeakPolarHBondContact CA-OG1 3.49Å; L15-T18 PolarHBondContact O-OG1 3.18Å; L15-T18 VanDerWaalsContact O-OG1 3.07Å; T18-R20 PolarHBondContact O-N 3.47Å; T18-I21 PolarHBondContact O-N 2.85Å; T18-W22 VanDerWaalsContact O-CB 3.26Å; T18-W22 WeakPolarHBondContact O-CB 3.25Å; T18-W22 PolarHBondContact O-N 2.77Å
19	S	81.9	Confident	78.9	Confident	82 Å²	82	98.9 Å²	98.9	57%	0.573	50%	0.498	S	S	*	.	H	α-helix	trans	-60.8	-42.2	172.9	177.4	0	0	0	0	112.3	L15 V17 W22 G23	L15-S19 WeakPolarHBondContact O-CB 3.46Å; L15-S19 PolarHBondContact O-N 3.29Å; V17-S19 VanDerWaalsContact C-N 3.34Å; V17-S19 PolarHBondContact O-N 3.26Å; S19-W22 PolarHBondContact O-N 2.91Å; S19-G23 PolarHBondContact O-N 3.14Å
20	R	81.4	Confident	79.8	Confident	206 Å²	206	99 Å²	99	78%	0.777	49%	0.49	S	S	*	.	H	α-helix	trans	-66.8	-42.7	175.9	-73.9	179.4	-178.3	-169.6	1.4	112.4	G16 V17 T18 G23 F24	G16-R20 WeakPolarHBondContact O-CG 3.46Å; G16-R20 PolarHBondContact O-N 3.12Å; G16-R20 VanDerWaalsContact O-N 3.09Å; V17-R20 PolarHBondContact O-N 3.18Å; T18-R20 PolarHBondContact O-N 3.47Å; R20-G23 PolarHBondContact O-N 2.91Å; R20-F24 WeakPolarHBondContact O-CB 3.35Å; R20-F24 PolarHBondContact O-N 3.01Å
21	I	86.1	Confident	80.3	Confident	98 Å²	98	102.7 Å²	102.7	50%	0.503	50%	0.496	S	S	.	.	H	α-helix	trans	-63.3	-45.1	176.5	-67.2	167.1	0	0	0	110.1	V17 T18 F24 F25	V17-I21 HydrophobicContact CG1-CD1 3.71Å; V17-I21 HydrophobicContact CG1-CG1 4.38Å; V17-I21 VanDerWaalsContact O-CG1 3.31Å; V17-I21 WeakPolarHBondContact O-CG1 3.46Å; V17-I21 PolarHBondContact O-N 2.91Å; T18-I21 PolarHBondContact O-N 2.85Å; I21-F24 WeakPolarHBondContact O-CB 3.45Å; I21-F24 PolarHBondContact O-N 3.28Å; I21-F25 PolarHBondContact O-N 3.09Å
22	W	84.3	Confident	80.6	Confident	171 Å²	171	103.9 Å²	103.9	65%	0.648	50%	0.499	S	S	*	.	H	α-helix	trans	-62	-43.5	175.9	-174.6	-110.5	0	0	0	111.9	T18 S19 F24 F25 L26	T18-W22 VanDerWaalsContact O-CB 3.26Å; T18-W22 WeakPolarHBondContact O-CB 3.25Å; T18-W22 PolarHBondContact O-N 2.77Å; S19-W22 PolarHBondContact O-N 2.91Å; W22-F24 VanDerWaalsContact C-N 3.32Å; W22-F24 PolarHBondContact O-N 2.86Å; W22-F25 PolarHBondContact O-N 3.29Å; W22-L26 HydrophobicContact CZ2-CD2 4.26Å; W22-L26 WeakPolarHBondContact O-CB 3.36Å; W22-L26 WeakPolarHBondContact O-CG 3.49Å; W22-L26 PolarHBondContact O-N 3.26Å
23	G	82.3	Confident	81.1	Confident	38 Å²	38	99.7 Å²	99.7	39%	0.392	49%	0.49	S	S	.	.	H	α-helix	trans	-59.9	-41.1	174.1	0	0	0	0	0	112.7	S19 R20 Y27	S19-G23 PolarHBondContact O-N 3.14Å; R20-G23 PolarHBondContact O-N 2.91Å; G23-Y27 WeakPolarHBondContact O-CB 3.33Å; G23-Y27 PolarHBondContact O-N 2.88Å
24	F	83.6	Confident	81.1	Confident	125 Å²	125	97.6 Å²	97.6	55%	0.548	47%	0.472	S	S	.	.	H	α-helix	trans	-65.6	-42	174.3	-178.1	-104.8	0	0	0	112.2	R20 I21 W22 Y27 I28	R20-F24 WeakPolarHBondContact O-CB 3.35Å; R20-F24 PolarHBondContact O-N 3.01Å; I21-F24 WeakPolarHBondContact O-CB 3.45Å; I21-F24 PolarHBondContact O-N 3.28Å; W22-F24 VanDerWaalsContact C-N 3.32Å; W22-F24 PolarHBondContact O-N 2.86Å; F24-Y27 WeakPolarHBondContact O-CB 3.25Å; F24-Y27 PolarHBondContact O-N 3.12Å; F24-I28 HydrophobicContact CD1-CD1 3.94Å; F24-I28 HydrophobicContact CE1-CD1 3.32Å; F24-I28 HydrophobicContact CE1-CG1 4.24Å; F24-I28 HydrophobicContact CE2-CD1 4.36Å; F24-I28 HydrophobicContact CZ-CD1 3.57Å; F24-I28 HydrophobicContact CZ-CG1 4.26Å; F24-I28 WeakPolarHBondContact O-CG1 3.35Å; F24-I28 PolarHBondContact O-N 3.16Å
25	F	87.9	Confident	80.8	Confident	134 Å²	134	93.8 Å²	93.8	59%	0.588	46%	0.461	S	S	*	.	H	α-helix	trans	-63	-45.3	175.7	-124.4	-85.3	0	0	0	111.9	I21 W22 Y27 I28 L29	I21-F25 PolarHBondContact O-N 3.09Å; W22-F25 PolarHBondContact O-N 3.29Å; F25-Y27 VanDerWaalsContact C-N 3.31Å; F25-Y27 PolarHBondContact O-N 2.52Å; F25-I28 PolarHBondContact O-N 3.01Å; F25-L29 WeakPolarHBondContact O-CB 3.32Å; F25-L29 PolarHBondContact O-N 3.48Å
26	L	85.2	Confident	80.7	Confident	54 Å²	54	93.5 Å²	93.5	28%	0.283	46%	0.463	S	S	.	.	H	α-helix	trans	-62.6	-38.2	174.7	-73.4	179.6	0	0	0	111.9	W22 L29 R30	W22-L26 HydrophobicContact CZ2-CD2 4.26Å; W22-L26 WeakPolarHBondContact O-CB 3.36Å; W22-L26 WeakPolarHBondContact O-CG 3.49Å; W22-L26 PolarHBondContact O-N 3.26Å; L26-L29 PolarHBondContact O-N 2.85Å; L26-R30 VanDerWaalsContact O-CB 3.3Å; L26-R30 WeakPolarHBondContact O-CB 3.44Å; L26-R30 WeakPolarHBondContact O-CG 3.47Å; L26-R30 PolarHBondContact O-N 3.13Å
27	Y	81.4	Confident	80.5	Confident	99 Å²	99	95.2 Å²	95.2	39%	0.388	46%	0.463	S	S	.	.	H	α-helix	trans	-60.5	-49	173.8	170.5	-86.9	0	0	0	111.3	G23 F24 F25 R30 K31 P91	G23-Y27 WeakPolarHBondContact O-CB 3.33Å; G23-Y27 PolarHBondContact O-N 2.88Å; F24-Y27 WeakPolarHBondContact O-CB 3.25Å; F24-Y27 PolarHBondContact O-N 3.12Å; F25-Y27 VanDerWaalsContact C-N 3.31Å; F25-Y27 PolarHBondContact O-N 2.52Å; Y27-R30 PolarHBondContact O-N 3.21Å; Y27-K31 WeakPolarHBondContact O-CB 3.39Å; Y27-K31 PolarHBondContact O-N 3.1Å; Y27-P91 HydrophobicContact CD2-CB 3.94Å; Y27-P91 HydrophobicContact CE2-CB 3.37Å; Y27-P91 HydrophobicContact CE2-CG 4.35Å
28	I	85.6	Confident	79.8	Confident	58 Å²	58	92.4 Å²	92.4	30%	0.297	45%	0.445	S	S	.	.	H	α-helix	trans	-59.5	-49.5	176.2	-73.8	-176.9	0	0	0	110.3	F24 F25 R30 K31 H32	F24-I28 HydrophobicContact CD1-CD1 3.94Å; F24-I28 HydrophobicContact CE1-CD1 3.32Å; F24-I28 HydrophobicContact CE1-CG1 4.24Å; F24-I28 HydrophobicContact CE2-CD1 4.36Å; F24-I28 HydrophobicContact CZ-CD1 3.57Å; F24-I28 HydrophobicContact CZ-CG1 4.26Å; F24-I28 WeakPolarHBondContact O-CG1 3.35Å; F24-I28 PolarHBondContact O-N 3.16Å; F25-I28 PolarHBondContact O-N 3.01Å; I28-R30 PolarHBondContact O-N 3.4Å; I28-K31 WeakPolarHBondContact O-CB 3.32Å; I28-K31 PolarHBondContact O-N 3.11Å; I28-H32 VanDerWaalsContact CG2-CD2 3.44Å; I28-H32 WeakPolarHBondContact CG2-CD2 3.42Å; I28-H32 PolarHBondContact O-CD2 2.79Å; I28-H32 PolarHBondContact O-N 2.97Å
29	L	85.4	Confident	78.8	Confident	93 Å²	93	96.4 Å²	96.4	49%	0.487	46%	0.455	S	S	.	.	H	α-helix	trans	-59.2	-48.6	180	-179.2	65.4	0	0	0	111.8	F25 L26 K31 H32 L33	F25-L29 WeakPolarHBondContact O-CB 3.32Å; F25-L29 PolarHBondContact O-N 3.48Å; L26-L29 PolarHBondContact O-N 2.85Å; L29-K31 VanDerWaalsContact C-N 3.31Å; L29-K31 PolarHBondContact O-N 3.16Å; L29-H32 PolarHBondContact O-N 3.24Å; L29-L33 HydrophobicContact CD1-CD1 4.28Å; L29-L33 HydrophobicContact CD1-CG 4.32Å; L29-L33 HydrophobicContact CG-CD1 4Å; L29-L33 HydrophobicContact CG-CG 4.44Å; L29-L33 WeakPolarHBondContact O-CB 3.37Å; L29-L33 WeakPolarHBondContact O-CG 3.26Å; L29-L33 PolarHBondContact O-N 2.9Å
30	R	80.4	Confident	77.9	Confident	116 Å²	116	98.9 Å²	98.9	44%	0.438	46%	0.457	S	S	.	.	H	α-helix	trans	-60.6	-41.1	177.4	-75	174.2	-178.2	-171.4	-0.5	111.7	L26 Y27 I28 R34 G89	L26-R30 VanDerWaalsContact O-CB 3.3Å; L26-R30 WeakPolarHBondContact O-CB 3.44Å; L26-R30 WeakPolarHBondContact O-CG 3.47Å; L26-R30 PolarHBondContact O-N 3.13Å; Y27-R30 PolarHBondContact O-N 3.21Å; I28-R30 PolarHBondContact O-N 3.4Å; R30-R34 WeakPolarHBondContact O-CB 3.2Å; R30-R34 PolarHBondContact O-N 3.34Å; R30-G89 PolarHBondContact NH1-O 3.17Å
31	K	78.1	Confident	76.5	Confident	113 Å²	113	94.6 Å²	94.6	49%	0.491	45%	0.454	S	S	.	.	H	α-helix	trans	-60.6	-48.9	176	-172.9	178.5	179.9	-178.7	0	110.8	Y27 I28 L29 R34 T35 P91	Y27-K31 WeakPolarHBondContact O-CB 3.39Å; Y27-K31 PolarHBondContact O-N 3.1Å; I28-K31 WeakPolarHBondContact O-CB 3.32Å; I28-K31 PolarHBondContact O-N 3.11Å; L29-K31 VanDerWaalsContact C-N 3.31Å; L29-K31 PolarHBondContact O-N 3.16Å; K31-R34 PolarHBondContact O-N 2.77Å; K31-T35 PolarHBondContact O-N 2.75Å; K31-T35 PolarHBondContact O-OG1 3.08Å; K31-T35 VanDerWaalsContact O-OG1 3.08Å; K31-P91 HydrophobicContact CB-CG 4.33Å
32	H	80.7	Confident	75.1	Confident	119 Å²	119	93.2 Å²	93.2	55%	0.551	45%	0.45	S	S	*	.	H	α-helix	trans	-64.8	-44.3	178.4	-75.6	-67.7	0	0	0	113	I28 L29 R34 T35 V36	I28-H32 VanDerWaalsContact CG2-CD2 3.44Å; I28-H32 WeakPolarHBondContact CG2-CD2 3.42Å; I28-H32 PolarHBondContact O-CD2 2.79Å; I28-H32 PolarHBondContact O-N 2.97Å; L29-H32 PolarHBondContact O-N 3.24Å; H32-R34 VanDerWaalsContact C-N 3.28Å; H32-R34 PolarHBondContact O-N 3.06Å; H32-T35 WeakPolarHBondContact O-CB 3.44Å; H32-T35 PolarHBondContact O-N 3.12Å; H32-V36 WeakPolarHBondContact O-CG2 3.49Å; H32-V36 PolarHBondContact O-N 3.42Å
33	L	78.6	Confident	74	Confident	93 Å²	93	94.7 Å²	94.7	49%	0.487	46%	0.455	S	S	.	.	H	α-helix	trans	-59.4	-41	176.2	-72.6	172.1	0	0	0	111.5	L29 V36 I37	L29-L33 HydrophobicContact CD1-CD1 4.28Å; L29-L33 HydrophobicContact CD1-CG 4.32Å; L29-L33 HydrophobicContact CG-CD1 4Å; L29-L33 HydrophobicContact CG-CG 4.44Å; L29-L33 WeakPolarHBondContact O-CB 3.37Å; L29-L33 WeakPolarHBondContact O-CG 3.26Å; L29-L33 PolarHBondContact O-N 2.9Å; L33-V36 PolarHBondContact O-N 2.71Å; L33-I37 WeakPolarHBondContact O-CG1 3.29Å; L33-I37 PolarHBondContact O-N 2.94Å
34	R	71.8	Confident	73.3	Confident	41 Å²	41	95.4 Å²	95.4	16%	0.155	45%	0.447	C	S	.	.	H	α-helix	trans	-63.8	-43.9	176.6	-171.5	176.1	-178.1	-146.8	-12.9	111.7	R30 K31 H32 V36 I37 Q38 P91 D93 K111	R30-R34 WeakPolarHBondContact O-CB 3.2Å; R30-R34 PolarHBondContact O-N 3.34Å; K31-R34 PolarHBondContact O-N 2.77Å; H32-R34 VanDerWaalsContact C-N 3.28Å; H32-R34 PolarHBondContact O-N 3.06Å; R34-V36 VanDerWaalsContact C-N 3.31Å; R34-V36 PolarHBondContact O-N 2.75Å; R34-I37 PolarHBondContact O-N 3.18Å; R34-Q38 VanDerWaalsContact O-CB 3.23Å; R34-Q38 WeakPolarHBondContact O-CB 3.44Å; R34-Q38 PolarHBondContact O-N 3.48Å; R34-P91 PolarHBondContact NH1-O 2.84Å; R34-P91 VanDerWaalsContact NH1-O 3.15Å; R34-D93 IonicContact CZ-OD1 2.88Å; R34-D93 IonicContact CZ-OD2 3.84Å; R34-D93 VanDerWaalsContact NH1-CG 3.28Å; R34-D93 IonicContact NH1-OD1 3.72Å; R34-D93 PolarHBondContact NH1-OD1 3.18Å; R34-D93 IonicContact NH1-OD2 2.71Å; R34-D93 PolarHBondContact NH1-OD2 3.02Å; R34-D93 IonicContact NH2-OD1 3.62Å; R34-D93 IonicContact NH2-OD2 3.67Å; R34-D93 PolarHBondContact NH2-OD2 3.1Å; R34-K111 PolarHBondContact NH2-O 2.85Å; R34-K111 VanDerWaalsContact NH2-O 3.13Å
35	T	71.3	Confident	72.7	Confident	60 Å²	60	95 Å²	95	37%	0.368	45%	0.45	S	S	.	.	H	α-helix	trans	-56.3	-48.2	171.9	-57.9	0	0	0	0	110.2	K31 H32 I37 Q38 Y39	K31-T35 PolarHBondContact O-N 2.75Å; K31-T35 PolarHBondContact O-OG1 3.08Å; K31-T35 VanDerWaalsContact O-OG1 3.08Å; H32-T35 WeakPolarHBondContact O-CB 3.44Å; H32-T35 PolarHBondContact O-N 3.12Å; T35-I37 PolarHBondContact O-N 3.15Å; T35-Q38 PolarHBondContact O-N 2.96Å; T35-Y39 HydrophobicContact CG2-CD2 3.59Å; T35-Y39 HydrophobicContact CG2-CE2 3.85Å; T35-Y39 WeakPolarHBondContact O-CB 3.42Å; T35-Y39 WeakPolarHBondContact O-CD2 3.19Å; T35-Y39 PolarHBondContact O-N 3.28Å
36	V	74.7	Confident	71.9	Confident	96 Å²	96	92.7 Å²	92.7	58%	0.582	45%	0.447	S	S	*	.	H	α-helix	trans	-60.9	-42.5	178.8	172.2	0	0	0	0	112.4	H32 L33 R34 Y39 Q40	H32-V36 WeakPolarHBondContact O-CG2 3.49Å; H32-V36 PolarHBondContact O-N 3.42Å; L33-V36 PolarHBondContact O-N 2.71Å; R34-V36 VanDerWaalsContact C-N 3.31Å; R34-V36 PolarHBondContact O-N 2.75Å; V36-Y39 CarbonylContact O-C 3.57Å; V36-Q40 WeakPolarHBondContact O-CA 3.41Å; V36-Q40 WeakPolarHBondContact O-CB 3.45Å; V36-Q40 PolarHBondContact O-N 3.43Å
37	I	68.9	Low	71.7	Confident	69 Å²	69	96.8 Å²	96.8	35%	0.354	47%	0.469	S	S	.	.	H	α-helix	trans	-66.6	-44.9	177.5	-67.2	165.2	0	0	0	110.7	L33 R34 T35 Y39 Q40 P210	L33-I37 WeakPolarHBondContact O-CG1 3.29Å; L33-I37 PolarHBondContact O-N 2.94Å; R34-I37 PolarHBondContact O-N 3.18Å; T35-I37 PolarHBondContact O-N 3.15Å; I37-Y39 VanDerWaalsContact C-N 3.29Å; I37-Y39 PolarHBondContact O-N 3.44Å; I37-Q40 WeakPolarHBondContact O-CB 3.41Å; I37-Q40 PolarHBondContact O-N 3.18Å; I37-P210 HydrophobicContact CG2-CB 4.36Å; I37-P210 VanDerWaalsContact CG2-O 3.3Å; I37-P210 WeakPolarHBondContact CG2-O 3.19Å
38	Q	63.8	Low	71.9	Confident	21 Å²	21	97.6 Å²	97.6	10%	0.098	49%	0.486	C	S	.	.	H	α-helix	trans	-63.7	-34.9	-179.8	-177	179.3	-5.5	0	0	112.6	R34 T35 H114	R34-Q38 VanDerWaalsContact O-CB 3.23Å; R34-Q38 WeakPolarHBondContact O-CB 3.44Å; R34-Q38 PolarHBondContact O-N 3.48Å; T35-Q38 PolarHBondContact O-N 2.96Å; Q38-H114 PolarHBondContact O-CE1 2.85Å; Q38-H114 PolarHBondContact O-ND1 3.28Å
39	Y	61.5	Low	72.1	Confident	139 Å²	139	96.9 Å²	96.9	55%	0.545	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	12.8	178.6	-64.1	-74.9	0	0	0	112.9	T35 V36 I37 T41	T35-Y39 HydrophobicContact CG2-CD2 3.59Å; T35-Y39 HydrophobicContact CG2-CE2 3.85Å; T35-Y39 WeakPolarHBondContact O-CB 3.42Å; T35-Y39 WeakPolarHBondContact O-CD2 3.19Å; T35-Y39 PolarHBondContact O-N 3.28Å; V36-Y39 CarbonylContact O-C 3.57Å; I37-Y39 VanDerWaalsContact C-N 3.29Å; I37-Y39 PolarHBondContact O-N 3.44Å; Y39-T41 PolarHBondContact O-N 2.8Å
40	Q	62.3	Low	72.5	Confident	134 Å²	134	95 Å²	95	63%	0.626	48%	0.477	S	S	*	.	S	Bend	trans	-59.3	117.8	172.5	-153.7	177	0.3	0	0	105.4	V36 I37 V42	V36-Q40 WeakPolarHBondContact O-CA 3.41Å; V36-Q40 WeakPolarHBondContact O-CB 3.45Å; V36-Q40 PolarHBondContact O-N 3.43Å; I37-Q40 WeakPolarHBondContact O-CB 3.41Å; I37-Q40 PolarHBondContact O-N 3.18Å; Q40-V42 VanDerWaalsContact C-N 3.32Å; Q40-V42 PolarHBondContact O-N 3.27Å
41	T	53.7	Low	73.2	Confident	115 Å²	115	93.9 Å²	93.9	71%	0.706	49%	0.485	S	S	*	.			trans	-60.1	87.9	-156.8	34.2	0	0	0	0	112.4	Y39 R43	Y39-T41 PolarHBondContact O-N 2.8Å; T41-R43 PolarHBondContact O-N 2.88Å
42	V	56	Low	74	Confident	69 Å²	69	93.8 Å²	93.8	42%	0.418	49%	0.489	S	S	.	.			trans	-77	101.5	157.6	179.8	0	0	0	0	105.3	Q40 Y44 L216	Q40-V42 VanDerWaalsContact C-N 3.32Å; Q40-V42 PolarHBondContact O-N 3.27Å; V42-Y44 PolarHBondContact O-N 3.5Å; V42-L216 HydrophobicContact CB-CD1 3.89Å; V42-L216 HydrophobicContact CG1-CD1 3.77Å; V42-L216 HydrophobicContact CG1-CD2 4.17Å; V42-L216 HydrophobicContact CG1-CG 4.48Å; V42-L216 HydrophobicContact CG2-CD1 3.6Å
43	R	61.2	Low	74.6	Confident	202 Å²	202	90 Å²	90	76%	0.762	48%	0.475	S	S	*	.			trans	-81.2	103.9	171	-69.1	-171.3	177.8	171.5	-0.1	107.7	T41	T41-R43 PolarHBondContact O-N 2.88Å
44	Y	67	Low	75.3	Confident	54 Å²	54	91.5 Å²	91.5	21%	0.212	48%	0.475	C	S	.	.			trans	-92.6	91.1	160.3	-164.5	-87.8	0	0	0	106.7	V42 T46 W125 L219 P220	V42-Y44 PolarHBondContact O-N 3.5Å; Y44-T46 HydrophobicContact CD1-CG2 4.48Å; Y44-T46 PolarHBondContact O-N 3.33Å; Y44-W125 AromaticContact CE1-CH2 3.72Å; Y44-W125 HydrophobicContact CE1-CH2 3.72Å; Y44-W125 HydrophobicContact CE1-CZ2 4.06Å; Y44-L219 HydrophobicContact CD1-CD1 4.39Å; Y44-L219 HydrophobicContact CD2-CB 3.94Å; Y44-L219 HydrophobicContact CD2-CD1 3.81Å; Y44-L219 HydrophobicContact CE1-CB 4.39Å; Y44-L219 HydrophobicContact CE2-CB 3.47Å; Y44-L219 VanDerWaalsContact CE2-CB 3.47Å; Y44-L219 HydrophobicContact CE2-CD1 4.23Å; Y44-L219 HydrophobicContact CG-CD1 3.89Å; Y44-L219 PolarHBondContact OH-O 2.86Å; Y44-P220 HydrophobicContact CE2-CG 4.02Å; Y44-P220 WeakPolarHBondContact OH-CA 3.35Å
45	D	70.8	Confident	76.4	Confident	116 Å²	116	94.9 Å²	94.9	62%	0.62	50%	0.496	S	S	*	.			trans	-67.9	108.4	-179.4	-67.3	-33.1	0	0	0	108.6	L47	D45-L47 VanDerWaalsContact C-N 3.32Å; D45-L47 HydrophobicContact CB-CD2 4.43Å; D45-L47 PolarHBondContact O-N 3.33Å
46	T	71	Confident	77.4	Confident	86 Å²	86	100.1 Å²	100.1	53%	0.528	51%	0.509	S	S	.	.			trans	-70.8	92.4	172.7	49.1	0	0	0	0	108.7	Y44	Y44-T46 HydrophobicContact CD1-CG2 4.48Å; Y44-T46 PolarHBondContact O-N 3.33Å
47	L	81.1	Confident	78.4	Confident	140 Å²	140	97.2 Å²	97.2	73%	0.733	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-71	135.4	176.8	-61.5	178.6	0	0	0	109.8	D45 L49	D45-L47 VanDerWaalsContact C-N 3.32Å; D45-L47 HydrophobicContact CB-CD2 4.43Å; D45-L47 PolarHBondContact O-N 3.33Å; L47-L49 PolarHBondContact O-N 2.76Å
48	P	86.3	Confident	79.5	Confident	115 Å²	115	99.7 Å²	99.7	75%	0.747	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-62.8	136.1	176.3	26.2	-33.2	0	0	0	110.1	S50	P48-S50 PolarHBondContact O-N 3.4Å
49	L	89.1	Confident	81	Confident	43 Å²	43	102.8 Å²	102.8	23%	0.225	53%	0.533	C	S	.	.	P	Polyproline II helix	trans	-62.6	137	175.6	-64.1	-178.2	0	0	0	110.7	L47 R54 L57 F227	L47-L49 PolarHBondContact O-N 2.76Å; L49-R54 HydrophobicContact CB-CB 4.45Å; L49-R54 PolarHBondContact O-NH2 3.29Å; L49-L57 HydrophobicContact CD1-CD2 3.69Å; L49-F227 HydrophobicContact CD1-CE1 4.39Å; L49-F227 HydrophobicContact CD1-CZ 3.99Å; L49-F227 HydrophobicContact CD2-CZ 3.75Å
50	S	93.5	Very high	82.6	Confident	53 Å²	53	97.8 Å²	97.8	37%	0.371	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-58.3	156.3	167.6	78.7	0	0	0	0	110.4	P48 I52 S53 R54	P48-S50 PolarHBondContact O-N 3.4Å; S50-I52 PolarHBondContact O-N 3.27Å; S50-S53 PolarHBondContact O-N 2.93Å; S50-S53 VanDerWaalsContact O-N 3.12Å; S50-S53 WeakPolarHBondContact OG-CB 3.42Å; S50-S53 PolarHBondContact OG-N 2.64Å; S50-S53 VanDerWaalsContact OG-N 3.08Å; S50-S53 PolarHBondContact OG-OG 2.8Å; S50-S53 VanDerWaalsContact OG-OG 3.06Å; S50-R54 PolarHBondContact O-N 2.8Å
51	P	95.2	Very high	84	Confident	93 Å²	93	97.6 Å²	97.6	60%	0.604	51%	0.514	S	S	*	.	H	α-helix	trans	-53.7	-38.8	175.8	-27	35.2	0	0	0	113	R54 N55	P51-R54 PolarHBondContact O-N 2.85Å; P51-N55 VanDerWaalsContact O-CG 3.28Å; P51-N55 PolarHBondContact O-N 3.48Å
52	I	94.7	Very high	86.1	Confident	111 Å²	111	99.3 Å²	99.3	57%	0.569	51%	0.508	S	S	*	.	H	α-helix	trans	-65.9	-48.1	177.9	-61.6	171.6	0	0	0	110.6	S50 R54 N55 R56	S50-I52 PolarHBondContact O-N 3.27Å; I52-R54 VanDerWaalsContact C-N 3.31Å; I52-R54 PolarHBondContact O-N 2.99Å; I52-N55 PolarHBondContact O-N 2.85Å; I52-R56 WeakPolarHBondContact O-CG 3.41Å; I52-R56 PolarHBondContact O-N 3.5Å
53	S	93.3	Very high	88	Confident	39 Å²	39	96.2 Å²	96.2	27%	0.273	49%	0.488	S	S	.	.	H	α-helix	trans	-62	-41.1	178.4	-60.7	0	0	0	0	111.1	S50 N55 R56 L57 F227	S50-S53 PolarHBondContact O-N 2.93Å; S50-S53 VanDerWaalsContact O-N 3.12Å; S50-S53 WeakPolarHBondContact OG-CB 3.42Å; S50-S53 PolarHBondContact OG-N 2.64Å; S50-S53 VanDerWaalsContact OG-N 3.08Å; S50-S53 PolarHBondContact OG-OG 2.8Å; S50-S53 VanDerWaalsContact OG-OG 3.06Å; S53-N55 PolarHBondContact O-N 2.86Å; S53-R56 PolarHBondContact O-N 3.3Å; S53-L57 WeakPolarHBondContact O-CB 3.34Å; S53-L57 PolarHBondContact O-N 3.2Å; S53-F227 WeakPolarHBondContact O-CE1 3.44Å
54	R	93.9	Very high	89.8	Confident	126 Å²	126	86.8 Å²	86.8	48%	0.475	45%	0.453	S	S	.	.	H	α-helix	trans	-60.8	-45.2	175.8	-170.7	178	-62.4	143.9	5.5	111.8	L49 S50 P51 I52 R56 L57 N58	L49-R54 HydrophobicContact CB-CB 4.45Å; L49-R54 PolarHBondContact O-NH2 3.29Å; S50-R54 PolarHBondContact O-N 2.8Å; P51-R54 PolarHBondContact O-N 2.85Å; I52-R54 VanDerWaalsContact C-N 3.31Å; I52-R54 PolarHBondContact O-N 2.99Å; R54-R56 VanDerWaalsContact C-N 3.35Å; R54-R56 PolarHBondContact O-N 3.17Å; R54-L57 PolarHBondContact O-N 3.42Å; R54-N58 PolarHBondContact O-N 2.54Å; R54-N58 PolarHBondContact O-OD1 3.4Å
55	N	94.6	Very high	91.4	Very high	112 Å²	112	84.2 Å²	84.2	60%	0.599	44%	0.443	S	S	*	.	H	α-helix	trans	-62.7	-41.3	176.6	-71.7	-9.4	0	0	0	112	P51 I52 S53 N58 A59	P51-N55 VanDerWaalsContact O-CG 3.28Å; P51-N55 PolarHBondContact O-N 3.48Å; I52-N55 PolarHBondContact O-N 2.85Å; S53-N55 PolarHBondContact O-N 2.86Å; N55-N58 PolarHBondContact O-N 3.36Å; N55-A59 PolarHBondContact O-N 2.93Å
56	R	93.7	Very high	92.7	Very high	170 Å²	170	78.7 Å²	78.7	64%	0.642	41%	0.414	S	S	*	.	H	α-helix	trans	-63.7	-41.6	174.9	-72.8	-179.8	176.9	-178.4	-0.9	112.3	I52 S53 R54 N58 A59	I52-R56 WeakPolarHBondContact O-CG 3.41Å; I52-R56 PolarHBondContact O-N 3.5Å; S53-R56 PolarHBondContact O-N 3.3Å; R54-R56 VanDerWaalsContact C-N 3.35Å; R54-R56 PolarHBondContact O-N 3.17Å; R56-N58 VanDerWaalsContact C-N 3.33Å; R56-A59 WeakPolarHBondContact O-CB 3.25Å; R56-A59 PolarHBondContact O-N 2.86Å
57	L	94.1	Very high	94	Very high	34 Å²	34	74.6 Å²	74.6	18%	0.178	39%	0.388	C	S	.	.	H	α-helix	trans	-64.5	-40	176.9	-174.3	63.2	0	0	0	111.5	L49 S53 R54 A59 V60 R226 F227	L49-L57 HydrophobicContact CD1-CD2 3.69Å; S53-L57 WeakPolarHBondContact O-CB 3.34Å; S53-L57 PolarHBondContact O-N 3.2Å; R54-L57 PolarHBondContact O-N 3.42Å; L57-A59 PolarHBondContact O-N 3.31Å; L57-V60 HydrophobicContact CD1-CG2 4.18Å; L57-V60 WeakPolarHBondContact O-CG2 3.43Å; L57-V60 PolarHBondContact O-N 3.28Å; L57-R226 HydrophobicContact CD1-CB 3.79Å; L57-R226 WeakPolarHBondContact CD1-O 3.45Å; L57-R226 VanDerWaalsContact CD2-NH2 3.26Å; L57-F227 HydrophobicContact CB-CD1 4.1Å; L57-F227 HydrophobicContact CB-CE1 3.75Å; L57-F227 HydrophobicContact CD1-CD1 4.31Å; L57-F227 HydrophobicContact CD1-CE1 4.29Å; L57-F227 HydrophobicContact CG-CE1 4.44Å
58	N	93.8	Very high	94.9	Very high	121 Å²	121	68.4 Å²	68.4	65%	0.647	36%	0.356	S	S	*	.	H	α-helix	trans	-67	-20.9	176.6	-69.2	-11.8	0	0	0	113.1	R54 N55 R56 V60	R54-N58 PolarHBondContact O-N 2.54Å; R54-N58 PolarHBondContact O-OD1 3.4Å; N55-N58 PolarHBondContact O-N 3.36Å; R56-N58 VanDerWaalsContact C-N 3.33Å; N58-V60 VanDerWaalsContact C-N 3.3Å
59	A	94.6	Very high	95.4	Very high	86 Å²	86	63 Å²	63	71%	0.711	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-10.1	176.5	0	0	0	0	0	113.2	N55 R56 L57	N55-A59 PolarHBondContact O-N 2.93Å; R56-A59 WeakPolarHBondContact O-CB 3.25Å; R56-A59 PolarHBondContact O-N 2.86Å; L57-A59 PolarHBondContact O-N 3.31Å
60	V	94.1	Very high	95.9	Very high	35 Å²	35	61.7 Å²	61.7	21%	0.212	31%	0.314	C	S	.	.	S	Bend	trans	-116.3	154.3	176.8	-63.1	0	0	0	0	110.6	L57 N58 R226	L57-V60 HydrophobicContact CD1-CG2 4.18Å; L57-V60 WeakPolarHBondContact O-CG2 3.43Å; L57-V60 PolarHBondContact O-N 3.28Å; N58-V60 VanDerWaalsContact C-N 3.3Å; V60-R226 VanDerWaalsContact CG2-O 3.28Å; V60-R226 WeakPolarHBondContact CG2-O 3.32Å
61	K	93	Very high	96	Very high	129 Å²	129	61.5 Å²	61.5	56%	0.561	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-68.7	150.7	177.1	-62.5	-179.8	-170.4	168.7	0	110.4	K63 D179	K61-K63 WeakPolarHBondContact O-CD 3.23Å; K61-K63 WeakPolarHBondContact O-CE 3.4Å; K61-K63 PolarHBondContact O-N 3Å; K61-D179 IonicContact NZ-OD2 2.6Å; K61-D179 PolarHBondContact NZ-OD2 3.47Å
62	R	96.1	Very high	96.2	Very high	152 Å²	152	57 Å²	57	57%	0.574	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-63.7	134.4	165	-170.8	177.3	-177.7	178.8	-2	109	S123 Y126	R62-S123 PolarHBondContact NH2-O 2.65Å; R62-Y126 PolarHBondContact NH2-O 2.79Å
63	K	97.9	Very high	96.4	Very high	3 Å²	3	51.8 Å²	51.8	1%	0.013	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	159.8	-174.2	-53.1	-43.5	-174.7	89.9	0	111.3	K61 Y126 E127 S181 S182 T228 A229 V231	K61-K63 WeakPolarHBondContact O-CD 3.23Å; K61-K63 WeakPolarHBondContact O-CE 3.4Å; K61-K63 PolarHBondContact O-N 3Å; K63-Y126 HydrophobicContact CB-CD1 3.64Å; K63-Y126 HydrophobicContact CB-CE1 3.52Å; K63-Y126 HydrophobicContact CG-CE1 4.36Å; K63-Y126 CarbonylContact O-C 3.48Å; K63-Y126 VanDerWaalsContact O-CA 3.32Å; K63-Y126 WeakPolarHBondContact O-CA 3.5Å; K63-E127 PolarHBondContact O-N 2.57Å; K63-S181 PolarHBondContact NZ-O 3.4Å; K63-S182 CarbonylContact C-O 3.59Å; K63-S182 WeakPolarHBondContact CA-O 3.41Å; K63-S182 WeakPolarHBondContact CB-O 3.21Å; K63-S182 WeakPolarHBondContact CD-OG 3.37Å; K63-T228 VanDerWaalsContact CE-O 3.26Å; K63-T228 WeakPolarHBondContact CE-O 3.45Å; K63-T228 PolarHBondContact NZ-O 3.19Å; K63-A229 PolarHBondContact NZ-O 3.39Å; K63-V231 HydrophobicContact CG-CG1 4.37Å
64	I	98.8	Very high	96.6	Very high	5 Å²	5	49.9 Å²	49.9	3%	0.026	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	127.4	177.5	-58.8	172.7	0	0	0	108.5	V66 E127 V129 V176 H177 S182 I183 V184	I64-V66 HydrophobicContact CG2-CG2 4.15Å; I64-E127 CarbonylContact C-O 3.5Å; I64-E127 WeakPolarHBondContact CA-O 3.49Å; I64-E127 HydrophobicContact CG1-CB 4.32Å; I64-V129 HydrophobicContact CG2-CB 4.28Å; I64-V129 HydrophobicContact CG2-CG2 3.58Å; I64-V176 HydrophobicContact CG2-CG1 4.1Å; I64-H177 HydrophobicContact CD1-CB 3.62Å; I64-S182 PolarHBondContact N-O 3.01Å; I64-I183 HydrophobicContact CB-CG1 4.45Å; I64-I183 HydrophobicContact CD1-CG1 4.46Å; I64-I183 WeakPolarHBondContact O-CA 3.22Å; I64-V184 PolarHBondContact O-N 2.82Å
65	L	98.9	Very high	96.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	107.5	171.8	-178	62.3	0	0	0	109	L67 F118 V122 Y126 E127 L128 V129 V184 L186 L222	L65-L67 HydrophobicContact CD1-CD2 4.43Å; L65-L67 HydrophobicContact CD2-CD2 3.88Å; L65-L67 HydrophobicContact CG-CD2 3.78Å; L65-L67 HydrophobicContact CG-CG 4.2Å; L65-F118 HydrophobicContact CD2-CZ 4.29Å; L65-V122 HydrophobicContact CD2-CB 4.07Å; L65-V122 HydrophobicContact CD2-CG1 4.32Å; L65-V122 HydrophobicContact CD2-CG2 4.07Å; L65-Y126 HydrophobicContact CB-CD1 3.8Å; L65-Y126 HydrophobicContact CB-CG 3.76Å; L65-Y126 HydrophobicContact CD2-CD2 4.5Å; L65-E127 PolarHBondContact N-O 3.27Å; L65-L128 HydrophobicContact CB-CD2 3.96Å; L65-L128 HydrophobicContact CD2-CD2 4.13Å; L65-L128 HydrophobicContact CG-CD2 4.45Å; L65-V129 PolarHBondContact O-N 3.06Å; L65-V184 CarbonylContact C-O 3.55Å; L65-V184 WeakPolarHBondContact CA-O 3.36Å; L65-V184 HydrophobicContact CD1-CB 4.04Å; L65-V184 HydrophobicContact CD1-CG1 3.95Å; L65-L186 HydrophobicContact CD1-CB 4.45Å; L65-L222 HydrophobicContact CD1-CD2 4.13Å; L65-L222 HydrophobicContact CD2-CD1 4.31Å; L65-L222 HydrophobicContact CD2-CD2 4.45Å
66	V	98.9	Very high	96.6	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	124.8	174.1	-178.1	0	0	0	0	108.6	I64 V129 F131 L173 V176 I183 V184 I185 L186	I64-V66 HydrophobicContact CG2-CG2 4.15Å; V66-V129 CarbonylContact C-O 3.59Å; V66-V129 WeakPolarHBondContact CA-O 3.4Å; V66-V129 HydrophobicContact CG2-CB 4.23Å; V66-V129 HydrophobicContact CG2-CG1 4.46Å; V66-F131 HydrophobicContact CG1-CB 3.37Å; V66-F131 HydrophobicContact CG1-CD1 4.17Å; V66-F131 HydrophobicContact CG1-CG 4.28Å; V66-L173 HydrophobicContact CG1-CD2 4.47Å; V66-L173 HydrophobicContact CG2-CD2 4.23Å; V66-V176 HydrophobicContact CG2-CG1 4.16Å; V66-V176 HydrophobicContact CG2-CG2 4.38Å; V66-I183 HydrophobicContact CG2-CG2 3.72Å; V66-V184 PolarHBondContact N-O 3.49Å; V66-I185 HydrophobicContact CB-CB 4.14Å; V66-I185 HydrophobicContact CB-CG1 4.16Å; V66-I185 HydrophobicContact CG1-CB 4.5Å; V66-I185 HydrophobicContact CG1-CD1 4.17Å; V66-I185 HydrophobicContact CG1-CG1 4.05Å; V66-I185 WeakPolarHBondContact O-CA 3.4Å; V66-L186 PolarHBondContact O-N 3.17Å
67	L	98.9	Very high	96.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	122.9	-173.4	-63	171	0	0	0	109.9	L65 L73 F118 L119 L128 V129 F131 L153 L186	L65-L67 HydrophobicContact CD1-CD2 4.43Å; L65-L67 HydrophobicContact CD2-CD2 3.88Å; L65-L67 HydrophobicContact CG-CD2 3.78Å; L65-L67 HydrophobicContact CG-CG 4.2Å; L67-L73 HydrophobicContact CB-CD1 4.2Å; L67-L73 HydrophobicContact CD1-CD1 4.34Å; L67-F118 HydrophobicContact CD2-CE1 4.04Å; L67-F118 HydrophobicContact CD2-CZ 4.46Å; L67-L119 HydrophobicContact CD1-CD2 3.66Å; L67-L128 HydrophobicContact CD1-CB 4.39Å; L67-L128 HydrophobicContact CD1-CD1 4.32Å; L67-L128 HydrophobicContact CD1-CD2 4.36Å; L67-V129 PolarHBondContact N-O 2.86Å; L67-F131 PolarHBondContact O-N 2.79Å; L67-L153 HydrophobicContact CD1-CD2 4.34Å; L67-L186 HydrophobicContact CD2-CB 4.16Å; L67-L186 HydrophobicContact CD2-CD2 3.98Å
68	D	98.8	Very high	96	Very high	10 Å²	10	35.8 Å²	35.8	5%	0.053	18%	0.183	C	C	.	.			trans	-72.8	164.3	162.1	-173.8	50.5	0	0	0	111.7	T72 L73 K171 L186 D187 N188	D68-T72 HydrophobicContact CB-CG2 4.21Å; D68-T72 PolarHBondContact OD2-OG1 3.46Å; D68-T72 VanDerWaalsContact OD2-OG1 3.13Å; D68-L73 WeakPolarHBondContact O-CG 3.46Å; D68-K171 IonicContact OD1-NZ 3.76Å; D68-K171 PolarHBondContact OD1-NZ 3.31Å; D68-L186 PolarHBondContact N-O 3.18Å; D68-L186 VanDerWaalsContact N-O 3.08Å; D68-D187 HydrophobicContact CB-CB 4.17Å; D68-N188 PolarHBondContact OD2-OD1 2.99Å
69	L	98.6	Very high	95.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.173	C	C	.	.			trans	-107.5	-71.1	-177.4	-64.2	-176	0	0	0	112.7	T72 L73 I74 V130 T132 V142 L146	L69-T72 PolarHBondContact O-N 3.43Å; L69-L73 HydrophobicContact CD2-CD1 4.21Å; L69-L73 PolarHBondContact O-N 3.37Å; L69-I74 HydrophobicContact CB-CG1 4.49Å; L69-I74 WeakPolarHBondContact O-CG1 3.47Å; L69-I74 PolarHBondContact O-N 3.13Å; L69-V130 HydrophobicContact CD1-CG1 3.87Å; L69-V130 HydrophobicContact CD2-CG1 3.91Å; L69-V130 HydrophobicContact CD2-CG2 4.49Å; L69-V130 HydrophobicContact CG-CG1 3.82Å; L69-T132 HydrophobicContact CD1-CG2 3.97Å; L69-T132 HydrophobicContact CG-CG2 4.44Å; L69-V142 HydrophobicContact CD1-CB 4.21Å; L69-V142 HydrophobicContact CD1-CG1 4.08Å; L69-V142 HydrophobicContact CD2-CG1 4.47Å; L69-L146 HydrophobicContact CD2-CD1 4.19Å
70	D	97.6	Very high	93.7	Very high	17 Å²	17	32.8 Å²	32.8	9%	0.091	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-69.3	134.7	-172.3	-61.8	-66.5	0	0	0	110.4	T72 S134 Y138 N188	D70-T72 PolarHBondContact O-N 3.37Å; D70-S134 PolarHBondContact OD2-OG 2.99Å; D70-Y138 WeakPolarHBondContact OD1-CE1 2.98Å; D70-Y138 PolarHBondContact OD1-OH 2.9Å; D70-Y138 WeakPolarHBondContact OD2-CE1 3.38Å; D70-N188 PolarHBondContact O-OD1 3.43Å
71	E	97.3	Very high	92.5	Very high	48 Å²	48	34 Å²	34	22%	0.224	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	-3.2	-172.1	-68.8	68.4	-125.9	0	0	115.9	I74 H75 S205 W206 F207	E71-I74 WeakPolarHBondContact CA-O 3.47Å; E71-I74 PolarHBondContact N-O 3.35Å; E71-H75 IonicContact OE1-CE1 3.26Å; E71-H75 PolarHBondContact OE1-CE1 3.48Å; E71-H75 IonicContact OE1-CG 2.93Å; E71-H75 IonicContact OE1-ND1 3.69Å; E71-H75 PolarHBondContact OE1-ND1 3.2Å; E71-S205 CarbonylContact O-C 3.59Å; E71-S205 WeakPolarHBondContact O-CA 3.47Å; E71-W206 PolarHBondContact O-N 3.35Å; E71-F207 HydrophobicContact CG-CD1 4.12Å; E71-F207 HydrophobicContact CG-CE1 3.52Å; E71-F207 HydrophobicContact CG-CZ 3.88Å
72	T	98.4	Very high	90.7	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-62	177	-66.4	0	0	0	0	112.1	D68 L69 D70 R112 L186 N188 I203	D68-T72 HydrophobicContact CB-CG2 4.21Å; D68-T72 PolarHBondContact OD2-OG1 3.46Å; D68-T72 VanDerWaalsContact OD2-OG1 3.13Å; L69-T72 PolarHBondContact O-N 3.43Å; D70-T72 PolarHBondContact O-N 3.37Å; T72-R112 WeakPolarHBondContact O-CD 3.15Å; T72-R112 PolarHBondContact O-NH1 3.43Å; T72-L186 HydrophobicContact CG2-CD2 4.38Å; T72-L186 HydrophobicContact CG2-CG 4.12Å; T72-N188 PolarHBondContact OG1-N 2.88Å; T72-N188 PolarHBondContact OG1-OD1 3.3Å; T72-I203 HydrophobicContact CG2-CG2 4.04Å
73	L	98.5	Very high	89.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-26.4	179.5	-62.4	-174	0	0	0	112.8	L67 D68 L69 R112 V115 F118 L119 L146 L215	L67-L73 HydrophobicContact CB-CD1 4.2Å; L67-L73 HydrophobicContact CD1-CD1 4.34Å; D68-L73 WeakPolarHBondContact O-CG 3.46Å; L69-L73 HydrophobicContact CD2-CD1 4.21Å; L69-L73 PolarHBondContact O-N 3.37Å; L73-R112 WeakPolarHBondContact O-CB 3.13Å; L73-R112 PolarHBondContact O-N 2.82Å; L73-V115 HydrophobicContact CB-CG2 3.93Å; L73-V115 HydrophobicContact CD2-CG2 4.06Å; L73-V115 HydrophobicContact CG-CG2 4.39Å; L73-F118 HydrophobicContact CD2-CD1 4.46Å; L73-F118 HydrophobicContact CD2-CE1 4.37Å; L73-L119 HydrophobicContact CD1-CD2 4.43Å; L73-L146 HydrophobicContact CB-CD1 4.29Å; L73-L146 HydrophobicContact CD1-CD1 4.2Å; L73-L215 HydrophobicContact CD2-CD1 4.22Å; L73-L215 HydrophobicContact CD2-CD2 4.03Å
74	I	97.8	Very high	87.6	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	170.1	-178.2	58.5	137.3	0	0	0	110.3	L69 E71 V109 H110 Y138 V142 L146	L69-I74 HydrophobicContact CB-CG1 4.49Å; L69-I74 WeakPolarHBondContact O-CG1 3.47Å; L69-I74 PolarHBondContact O-N 3.13Å; E71-I74 WeakPolarHBondContact CA-O 3.47Å; E71-I74 PolarHBondContact N-O 3.35Å; I74-V109 HydrophobicContact CB-CG1 3.92Å; I74-V109 HydrophobicContact CD1-CG1 3.66Å; I74-V109 HydrophobicContact CG1-CG1 4.4Å; I74-V109 HydrophobicContact CG2-CG1 4.02Å; I74-H110 CarbonylContact C-O 3.55Å; I74-H110 WeakPolarHBondContact CA-O 3.43Å; I74-H110 WeakPolarHBondContact CB-O 3.39Å; I74-Y138 WeakPolarHBondContact CD1-OH 3.4Å; I74-V142 HydrophobicContact CD1-CG1 3.66Å; I74-V142 HydrophobicContact CD1-CG2 4.03Å; I74-V142 HydrophobicContact CG1-CG1 4.09Å; I74-V142 HydrophobicContact CG2-CG1 4.41Å; I74-L146 HydrophobicContact CG2-CD1 4.08Å; I74-L146 HydrophobicContact CG2-CD2 4.02Å; I74-L146 HydrophobicContact CG2-CG 4.45Å
75	H	95.7	Very high	86.3	Confident	9 Å²	9	45.6 Å²	45.6	4%	0.042	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	134.2	162.6	177.2	58.7	0	0	0	108.4	E71 T85 H110 W206 F207	E71-H75 IonicContact OE1-CE1 3.26Å; E71-H75 PolarHBondContact OE1-CE1 3.48Å; E71-H75 IonicContact OE1-CG 2.93Å; E71-H75 IonicContact OE1-ND1 3.69Å; E71-H75 PolarHBondContact OE1-ND1 3.2Å; H75-T85 PolarHBondContact NE2-OG1 3.1Å; H75-H110 PolarHBondContact N-O 3.02Å; H75-H110 PolarHBondContact O-N 3.22Å; H75-W206 HydrophobicContact CB-CE3 3.72Å; H75-W206 HydrophobicContact CB-CZ3 3.61Å; H75-F207 WeakPolarHBondContact CB-O 3.21Å; H75-F207 PolarHBondContact CD2-O 3.04Å; H75-F207 AromaticContact CE1-CD1 3.65Å; H75-F207 AromaticContact ND1-CD1 3.69Å
76	S	93.1	Very high	85.2	Confident	20 Å²	20	45.9 Å²	45.9	14%	0.14	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	154	178.4	83.8	0	0	0	0	112.2	F108 Y138	S76-F108 WeakPolarHBondContact CA-O 3.21Å; S76-Y138 WeakPolarHBondContact CB-OH 3.28Å; S76-Y138 PolarHBondContact OG-OH 3.41Å
77	H	89.9	Confident	84.1	Confident	36 Å²	36	55.3 Å²	55.3	17%	0.167	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	158.1	166.9	57.8	-88.1	0	0	0	109.2	V81 F107 F108 H110	H77-V81 HydrophobicContact CB-CG2 4.36Å; H77-F107 CarbonylContact O-C 3.52Å; H77-F107 WeakPolarHBondContact O-CA 3.48Å; H77-F108 AromaticContact CD2-CD2 3.93Å; H77-F108 PolarHBondContact N-O 3.45Å; H77-F108 AromaticContact NE2-CD2 3.98Å; H77-F108 AromaticContact NE2-CG 3.97Å; H77-F108 PolarHBondContact O-N 2.65Å; H77-H110 AromaticContact CE1-CE1 3.59Å
78	H	85.9	Confident	82.7	Confident	81 Å²	81	60.7 Å²	60.7	38%	0.375	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	162.8	179.2	58.2	-82.9	0	0	0	111.4	G80 V81 V105 R106 F107	H78-G80 PolarHBondContact O-N 3.06Å; H78-V81 PolarHBondContact O-N 2.88Å; H78-V81 VanDerWaalsContact O-N 3.08Å; H78-V105 HydrophobicContact CB-CG1 3.79Å; H78-R106 WeakPolarHBondContact CA-O 3.28Å; H78-R106 WeakPolarHBondContact CB-O 3.38Å; H78-F107 HydrophobicContact CB-CD1 4.06Å; H78-F107 HydrophobicContact CB-CE1 4.02Å; H78-F107 HydrophobicContact CB-CG 4.48Å; H78-F107 HydrophobicContact CB-CZ 4.39Å
79	D	73.6	Confident	81.3	Confident	85 Å²	85	62.7 Å²	62.7	46%	0.455	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-18.6	-175.4	-78.1	-46.7	0	0	0	115.1	R106 F108	D79-R106 VanDerWaalsContact CG-NH2 3.27Å; D79-R106 PolarHBondContact N-O 2.94Å; D79-R106 IonicContact OD1-CZ 2.85Å; D79-R106 IonicContact OD1-NE 3.92Å; D79-R106 IonicContact OD1-NH2 3.46Å; D79-R106 PolarHBondContact OD1-NH2 2.76Å; D79-R106 WeakPolarHBondContact OD2-CB 3.34Å; D79-R106 IonicContact OD2-CZ 3.51Å; D79-R106 VanDerWaalsContact OD2-CZ 3.26Å; D79-R106 IonicContact OD2-NE 2.75Å; D79-R106 PolarHBondContact OD2-NE 2.78Å; D79-R106 IonicContact OD2-NH2 3.67Å; D79-R106 PolarHBondContact OD2-NH2 3.25Å; D79-F108 WeakPolarHBondContact OD1-CE2 3.41Å; D79-F108 WeakPolarHBondContact OD1-CZ 3.36Å
80	G	65.4	Low	80.4	Confident	58 Å²	58	65 Å²	65	60%	0.598	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-2.5	-178.9	0	0	0	0	0	116	H78 L82	H78-G80 PolarHBondContact O-N 3.06Å; G80-L82 PolarHBondContact O-N 3.45Å
81	V	69.1	Low	79.8	Confident	61 Å²	61	64.7 Å²	64.7	37%	0.37	35%	0.353	S	S	.	.			trans	-81.3	113.4	-175.3	179.3	0	0	0	0	111.2	H77 H78 R83	H77-V81 HydrophobicContact CB-CG2 4.36Å; H78-V81 PolarHBondContact O-N 2.88Å; H78-V81 VanDerWaalsContact O-N 3.08Å; V81-R83 VanDerWaalsContact C-N 3.27Å; V81-R83 PolarHBondContact O-N 3.12Å
82	L	56.5	Low	79.5	Confident	171 Å²	171	64 Å²	64	90%	0.895	35%	0.352	S	S	*	.	S	Bend	trans	-61.6	-26.5	-178.3	-81.6	141.2	0	0	0	114.7	G80	G80-L82 PolarHBondContact O-N 3.45Å
83	R	61.2	Low	79.2	Confident	218 Å²	218	66.9 Å²	66.9	82%	0.823	37%	0.368	S	S	*	.	S	Bend	trans	-136.7	94.9	-178.6	-67.2	-173.7	-177	-162.2	1.4	110.1	V81 T85	V81-R83 VanDerWaalsContact C-N 3.27Å; V81-R83 PolarHBondContact O-N 3.12Å; R83-T85 PolarHBondContact O-N 3.08Å
84	P	66.2	Low	79	Confident	65 Å²	65	68.3 Å²	68.3	42%	0.422	37%	0.374	S	S	.	.			trans	-64.7	127	173.5	24.5	-30.4	0	0	0	109.6	V86	P84-V86 PolarHBondContact O-N 3.21Å
85	T	71.9	Confident	78.9	Confident	78 Å²	78	72.2 Å²	72.2	48%	0.479	39%	0.394	S	S	.	.	S	Bend	trans	-66.9	-20.9	170	42.4	0	0	0	0	111.9	H75 R83	H75-T85 PolarHBondContact NE2-OG1 3.1Å; R83-T85 PolarHBondContact O-N 3.08Å
86	V	77.1	Confident	78.8	Confident	6 Å²	6	72.3 Å²	72.3	4%	0.036	40%	0.395	C	S	.	.	S	Bend	trans	-86.3	136.7	173.3	-174.5	0	0	0	0	109.8	P84 T90	P84-V86 PolarHBondContact O-N 3.21Å; V86-T90 HydrophobicContact CG1-CG2 3.87Å
87	R	74.7	Confident	78.9	Confident	199 Å²	199	79.5 Å²	79.5	75%	0.751	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-52.5	132.4	177.2	-66.7	-176.8	-178.4	-177.5	1.2	111.3	G89 T90	R87-G89 PolarHBondContact O-N 3.25Å; R87-T90 WeakPolarHBondContact O-CB 3.46Å; R87-T90 PolarHBondContact O-N 3.47Å; R87-T90 VanDerWaalsContact O-N 3.08Å; R87-T90 PolarHBondContact O-OG1 3.02Å; R87-T90 VanDerWaalsContact O-OG1 3.05Å
88	P	69.1	Low	78.9	Confident	113 Å²	113	78.5 Å²	78.5	73%	0.734	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	129.8	177.8	-28.8	35.3	0	0	0	113.1
89	G	70.8	Confident	79.1	Confident	51 Å²	51	79.2 Å²	79.2	53%	0.526	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	13	-178.7	0	0	0	0	0	115	R30 R87	R30-G89 PolarHBondContact NH1-O 3.17Å; R87-G89 PolarHBondContact O-N 3.25Å
90	T	79	Confident	79.7	Confident	49 Å²	49	77.9 Å²	77.9	30%	0.301	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-73.6	125.5	160	-59.9	0	0	0	0	108.7	V86 R87	V86-T90 HydrophobicContact CG1-CG2 3.87Å; R87-T90 WeakPolarHBondContact O-CB 3.46Å; R87-T90 PolarHBondContact O-N 3.47Å; R87-T90 VanDerWaalsContact O-N 3.08Å; R87-T90 PolarHBondContact O-OG1 3.02Å; R87-T90 VanDerWaalsContact O-OG1 3.05Å
91	P	84.1	Confident	80.7	Confident	11 Å²	11	81.9 Å²	81.9	7%	0.071	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-74.7	137.7	179.1	30.3	-34.8	0	0	0	111.5	Y27 K31 R34	Y27-P91 HydrophobicContact CD2-CB 3.94Å; Y27-P91 HydrophobicContact CE2-CB 3.37Å; Y27-P91 HydrophobicContact CE2-CG 4.35Å; K31-P91 HydrophobicContact CB-CG 4.33Å; R34-P91 PolarHBondContact NH1-O 2.84Å; R34-P91 VanDerWaalsContact NH1-O 3.15Å
92	P	91.1	Very high	81.6	Confident	33 Å²	33	88.3 Å²	88.3	21%	0.214	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-66.9	154.4	170.6	33.4	-39.2	0	0	0	110.5	I95 F108	P92-I95 HydrophobicContact CB-CG1 4.42Å; P92-I95 HydrophobicContact CG-CD1 4.15Å; P92-I95 HydrophobicContact CG-CG1 3.79Å; P92-F108 HydrophobicContact CB-CB 4.14Å; P92-F108 HydrophobicContact CG-CD1 4.11Å
93	D	92.5	Very high	83	Confident	60 Å²	60	86.3 Å²	86.3	32%	0.321	44%	0.438	S	S	.	.	S	Bend	trans	-74.6	-37.1	172.6	-63.1	-72.9	0	0	0	110.9	R34 V109 H110 K111	R34-D93 IonicContact CZ-OD1 2.88Å; R34-D93 IonicContact CZ-OD2 3.84Å; R34-D93 VanDerWaalsContact NH1-CG 3.28Å; R34-D93 IonicContact NH1-OD1 3.72Å; R34-D93 PolarHBondContact NH1-OD1 3.18Å; R34-D93 IonicContact NH1-OD2 2.71Å; R34-D93 PolarHBondContact NH1-OD2 3.02Å; R34-D93 IonicContact NH2-OD1 3.62Å; R34-D93 IonicContact NH2-OD2 3.67Å; R34-D93 PolarHBondContact NH2-OD2 3.1Å; D93-V109 PolarHBondContact N-O 2.85Å; D93-H110 VanDerWaalsContact OD2-CA 3.26Å; D93-H110 WeakPolarHBondContact OD2-CA 3.49Å; D93-K111 HydrophobicContact CB-CB 4.48Å; D93-K111 HydrophobicContact CB-CD 3.84Å; D93-K111 HydrophobicContact CB-CG 3.84Å; D93-K111 PolarHBondContact OD2-N 3.08Å
94	F	94.8	Very high	84.4	Confident	30 Å²	30	81.1 Å²	81.1	13%	0.132	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	157.1	171	53.8	-90.1	0	0	0	111.3	L96 V109 K111 K145	F94-L96 HydrophobicContact CD2-CD2 3.88Å; F94-L96 HydrophobicContact CD2-CG 3.94Å; F94-L96 HydrophobicContact CE2-CD1 4.11Å; F94-L96 HydrophobicContact CE2-CD2 4.11Å; F94-L96 HydrophobicContact CE2-CG 4Å; F94-V109 HydrophobicContact CD2-CB 3.75Å; F94-V109 HydrophobicContact CD2-CG1 4.33Å; F94-V109 HydrophobicContact CD2-CG2 3.98Å; F94-V109 HydrophobicContact CE1-CB 4.3Å; F94-V109 HydrophobicContact CE1-CG1 3.98Å; F94-V109 HydrophobicContact CE2-CB 3.43Å; F94-V109 VanDerWaalsContact CE2-CB 3.43Å; F94-V109 HydrophobicContact CE2-CG1 3.55Å; F94-V109 HydrophobicContact CE2-CG2 3.6Å; F94-V109 HydrophobicContact CG-CB 4.34Å; F94-V109 HydrophobicContact CZ-CB 3.74Å; F94-V109 HydrophobicContact CZ-CG1 3.35Å; F94-V109 HydrophobicContact CZ-CG2 4.31Å; F94-V109 PolarHBondContact N-O 3.13Å; F94-V109 PolarHBondContact O-N 3.03Å; F94-K111 HydrophobicContact CD1-CD 4.49Å; F94-K111 HydrophobicContact CE1-CD 4.13Å; F94-K111 HydrophobicContact CE1-CG 3.95Å; F94-K145 HydrophobicContact CD1-CB 4.24Å; F94-K145 HydrophobicContact CD2-CB 4.05Å; F94-K145 HydrophobicContact CD2-CG 3.78Å; F94-K145 HydrophobicContact CE1-CB 3.96Å; F94-K145 HydrophobicContact CE2-CB 3.72Å; F94-K145 HydrophobicContact CE2-CG 3.83Å; F94-K145 HydrophobicContact CG-CB 4.28Å; F94-K145 HydrophobicContact CG-CG 4.2Å; F94-K145 HydrophobicContact CZ-CB 3.67Å; F94-K145 HydrophobicContact CZ-CG 4.3Å
95	I	94.5	Very high	85.6	Confident	82 Å²	82	79.5 Å²	79.5	42%	0.421	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	125.6	176.4	-58.6	173.4	0	0	0	107.8	P92 R106 F107 F108	P92-I95 HydrophobicContact CB-CG1 4.42Å; P92-I95 HydrophobicContact CG-CD1 4.15Å; P92-I95 HydrophobicContact CG-CG1 3.79Å; I95-R106 HydrophobicContact CG2-CB 4.32Å; I95-F107 CarbonylContact C-O 3.6Å; I95-F107 VanDerWaalsContact CA-O 3.31Å; I95-F107 WeakPolarHBondContact CA-O 3.44Å; I95-F108 HydrophobicContact CD1-CD1 4.07Å; I95-F108 HydrophobicContact CD1-CE1 3.98Å; I95-F108 HydrophobicContact CG1-CD1 4.02Å; I95-F108 HydrophobicContact CG1-CE1 4.37Å
96	L	95.1	Very high	86.5	Confident	11 Å²	11	81.2 Å²	81.2	6%	0.058	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	139.8	171.8	-59.2	179.4	0	0	0	109.5	F94 R106 F107 V109 Y138 A141 V142 K145	F94-L96 HydrophobicContact CD2-CD2 3.88Å; F94-L96 HydrophobicContact CD2-CG 3.94Å; F94-L96 HydrophobicContact CE2-CD1 4.11Å; F94-L96 HydrophobicContact CE2-CD2 4.11Å; F94-L96 HydrophobicContact CE2-CG 4Å; L96-R106 CarbonylContact O-C 3.59Å; L96-R106 VanDerWaalsContact O-CA 3.27Å; L96-R106 WeakPolarHBondContact O-CA 3.24Å; L96-F107 HydrophobicContact CB-CB 4.27Å; L96-F107 PolarHBondContact N-O 3.47Å; L96-F107 PolarHBondContact O-N 3.09Å; L96-V109 HydrophobicContact CD1-CG2 4.11Å; L96-V109 HydrophobicContact CG-CG2 4.18Å; L96-Y138 HydrophobicContact CD1-CD2 4.36Å; L96-Y138 HydrophobicContact CD1-CE2 4.34Å; L96-A141 HydrophobicContact CD1-CB 3.91Å; L96-A141 HydrophobicContact CD2-CB 4.12Å; L96-V142 HydrophobicContact CD1-CB 4.38Å; L96-V142 HydrophobicContact CD1-CG2 3.44Å; L96-V142 VanDerWaalsContact CD1-CG2 3.44Å; L96-K145 HydrophobicContact CD2-CG 3.94Å
97	K	93.8	Very high	87.3	Confident	172 Å²	172	82 Å²	82	75%	0.748	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	110.5	172.3	-57.5	-173.6	-179.4	174.9	0	107.1	R106	K97-R106 HydrophobicContact CG-CG 4.23Å
98	V	91.3	Very high	88.2	Confident	15 Å²	15	74.5 Å²	74.5	9%	0.091	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	150.5	-179.9	-60.2	0	0	0	0	109.1	I100 V105 F107 I137	V98-I100 HydrophobicContact CG2-CD1 4.26Å; V98-I100 HydrophobicContact CG2-CG1 4.14Å; V98-V105 PolarHBondContact N-O 2.71Å; V98-V105 PolarHBondContact O-N 2.7Å; V98-F107 HydrophobicContact CG2-CD2 3.72Å; V98-F107 HydrophobicContact CG2-CE2 3.35Å; V98-F107 HydrophobicContact CG2-CZ 4.49Å; V98-I137 WeakPolarHBondContact CG1-O 3.32Å
99	V	89.2	Confident	89.4	Confident	95 Å²	95	69.1 Å²	69.1	58%	0.576	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102	115.5	177.6	-179.1	0	0	0	0	108	H103	V99-H103 WeakPolarHBondContact CA-O 3.22Å
100	I	86.1	Confident	90.6	Very high	58 Å²	58	66.9 Å²	66.9	30%	0.297	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	120.8	177	-54.9	178.2	0	0	0	106.6	V98 K102 H103 V105 F107 I137	V98-I100 HydrophobicContact CG2-CD1 4.26Å; V98-I100 HydrophobicContact CG2-CG1 4.14Å; I100-K102 VanDerWaalsContact C-N 3.26Å; I100-K102 PolarHBondContact O-N 3.25Å; I100-K102 VanDerWaalsContact O-N 3.17Å; I100-H103 PolarHBondContact N-O 3.35Å; I100-H103 WeakPolarHBondContact O-CA 3.29Å; I100-H103 WeakPolarHBondContact O-CB 3.42Å; I100-H103 PolarHBondContact O-N 2.72Å; I100-V105 HydrophobicContact CB-CG2 4.27Å; I100-V105 HydrophobicContact CD1-CB 4.24Å; I100-V105 HydrophobicContact CD1-CG2 4.06Å; I100-V105 HydrophobicContact CG1-CG2 4.22Å; I100-F107 HydrophobicContact CD1-CE2 4.11Å; I100-F107 HydrophobicContact CD1-CZ 4.06Å; I100-I137 HydrophobicContact CG1-CD1 3.72Å
101	D	86.2	Confident	91.3	Very high	142 Å²	142	65.7 Å²	65.7	76%	0.759	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	46.4	179.6	-57.6	-34.8	0	0	0	113.5	H103	D101-H103 PolarHBondContact O-N 3.03Å; D101-H103 PolarHBondContact O-ND1 2.71Å
102	K	87.8	Confident	91.9	Very high	195 Å²	195	65.2 Å²	65.2	85%	0.848	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	3.5	-177.1	-50.7	176.4	-178.3	176.3	0	115.5	I100	I100-K102 VanDerWaalsContact C-N 3.26Å; I100-K102 PolarHBondContact O-N 3.25Å; I100-K102 VanDerWaalsContact O-N 3.17Å
103	H	87.1	Confident	92	Very high	130 Å²	130	64 Å²	64	60%	0.602	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.7	124.5	176.5	-63.6	82.5	0	0	0	110.3	V99 I100 D101 V105	V99-H103 WeakPolarHBondContact CA-O 3.22Å; I100-H103 PolarHBondContact N-O 3.35Å; I100-H103 WeakPolarHBondContact O-CA 3.29Å; I100-H103 WeakPolarHBondContact O-CB 3.42Å; I100-H103 PolarHBondContact O-N 2.72Å; D101-H103 PolarHBondContact O-N 3.03Å; D101-H103 PolarHBondContact O-ND1 2.71Å; H103-V105 PolarHBondContact O-N 2.65Å
104	P	89.5	Confident	92	Very high	109 Å²	109	62 Å²	62	71%	0.708	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	122.4	174.6	28.7	-32.3	0	0	0	110
105	V	91.3	Very high	92.1	Very high	31 Å²	31	60.5 Å²	60.5	19%	0.188	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	132	177.4	-175.1	0	0	0	0	108.9	H78 V98 I100 H103 F107	H78-V105 HydrophobicContact CB-CG1 3.79Å; V98-V105 PolarHBondContact N-O 2.71Å; V98-V105 PolarHBondContact O-N 2.7Å; I100-V105 HydrophobicContact CB-CG2 4.27Å; I100-V105 HydrophobicContact CD1-CB 4.24Å; I100-V105 HydrophobicContact CD1-CG2 4.06Å; I100-V105 HydrophobicContact CG1-CG2 4.22Å; H103-V105 PolarHBondContact O-N 2.65Å; V105-F107 HydrophobicContact CB-CE2 4Å; V105-F107 HydrophobicContact CG1-CD2 4.13Å; V105-F107 HydrophobicContact CG1-CE2 3.55Å; V105-F107 HydrophobicContact CG1-CZ 3.94Å
106	R	92.7	Very high	92.1	Very high	113 Å²	113	58.1 Å²	58.1	43%	0.426	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	131	173.2	-57.4	-176.4	-68	-177.7	2.5	110	H78 D79 I95 L96 K97 F108	H78-R106 WeakPolarHBondContact CA-O 3.28Å; H78-R106 WeakPolarHBondContact CB-O 3.38Å; D79-R106 VanDerWaalsContact CG-NH2 3.27Å; D79-R106 PolarHBondContact N-O 2.94Å; D79-R106 IonicContact OD1-CZ 2.85Å; D79-R106 IonicContact OD1-NE 3.92Å; D79-R106 IonicContact OD1-NH2 3.46Å; D79-R106 PolarHBondContact OD1-NH2 2.76Å; D79-R106 WeakPolarHBondContact OD2-CB 3.34Å; D79-R106 IonicContact OD2-CZ 3.51Å; D79-R106 VanDerWaalsContact OD2-CZ 3.26Å; D79-R106 IonicContact OD2-NE 2.75Å; D79-R106 PolarHBondContact OD2-NE 2.78Å; D79-R106 IonicContact OD2-NH2 3.67Å; D79-R106 PolarHBondContact OD2-NH2 3.25Å; I95-R106 HydrophobicContact CG2-CB 4.32Å; L96-R106 CarbonylContact O-C 3.59Å; L96-R106 VanDerWaalsContact O-CA 3.27Å; L96-R106 WeakPolarHBondContact O-CA 3.24Å; K97-R106 HydrophobicContact CG-CG 4.23Å; R106-F108 HydrophobicContact CB-CE2 4.48Å
107	F	93.4	Very high	92	Very high	23 Å²	23	60.6 Å²	60.6	10%	0.101	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.2	172.4	-67.8	-97.9	0	0	0	109.4	H77 H78 I95 L96 V98 I100 V105 V109 Y138	H77-F107 CarbonylContact O-C 3.52Å; H77-F107 WeakPolarHBondContact O-CA 3.48Å; H78-F107 HydrophobicContact CB-CD1 4.06Å; H78-F107 HydrophobicContact CB-CE1 4.02Å; H78-F107 HydrophobicContact CB-CG 4.48Å; H78-F107 HydrophobicContact CB-CZ 4.39Å; I95-F107 CarbonylContact C-O 3.6Å; I95-F107 VanDerWaalsContact CA-O 3.31Å; I95-F107 WeakPolarHBondContact CA-O 3.44Å; L96-F107 HydrophobicContact CB-CB 4.27Å; L96-F107 PolarHBondContact N-O 3.47Å; L96-F107 PolarHBondContact O-N 3.09Å; V98-F107 HydrophobicContact CG2-CD2 3.72Å; V98-F107 HydrophobicContact CG2-CE2 3.35Å; V98-F107 HydrophobicContact CG2-CZ 4.49Å; I100-F107 HydrophobicContact CD1-CE2 4.11Å; I100-F107 HydrophobicContact CD1-CZ 4.06Å; V105-F107 HydrophobicContact CB-CE2 4Å; V105-F107 HydrophobicContact CG1-CD2 4.13Å; V105-F107 HydrophobicContact CG1-CE2 3.55Å; V105-F107 HydrophobicContact CG1-CZ 3.94Å; F107-V109 HydrophobicContact CB-CG2 4.29Å; F107-Y138 HydrophobicContact CB-CD2 4.4Å; F107-Y138 HydrophobicContact CB-CE2 4.05Å; F107-Y138 AromaticContact CD1-CD2 3.81Å; F107-Y138 HydrophobicContact CD1-CD2 3.81Å; F107-Y138 AromaticContact CD1-CE2 3.58Å; F107-Y138 HydrophobicContact CD1-CE2 3.58Å; F107-Y138 AromaticContact CD2-CD2 3.99Å; F107-Y138 HydrophobicContact CD2-CD2 3.99Å; F107-Y138 HydrophobicContact CD2-CE2 4.42Å; F107-Y138 HydrophobicContact CE1-CD2 4.01Å; F107-Y138 HydrophobicContact CE1-CE2 4.1Å; F107-Y138 HydrophobicContact CE2-CD2 4.2Å; F107-Y138 AromaticContact CG-CD2 3.8Å; F107-Y138 HydrophobicContact CG-CD2 3.8Å; F107-Y138 AromaticContact CG-CE2 3.76Å; F107-Y138 HydrophobicContact CG-CE2 3.76Å; F107-Y138 HydrophobicContact CZ-CD2 4.21Å
108	F	93.4	Very high	92.1	Very high	41 Å²	41	52.4 Å²	52.4	18%	0.18	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	104.5	174.2	-58.9	-90.7	0	0	0	108	S76 H77 D79 P92 I95 R106	S76-F108 WeakPolarHBondContact CA-O 3.21Å; H77-F108 AromaticContact CD2-CD2 3.93Å; H77-F108 PolarHBondContact N-O 3.45Å; H77-F108 AromaticContact NE2-CD2 3.98Å; H77-F108 AromaticContact NE2-CG 3.97Å; H77-F108 PolarHBondContact O-N 2.65Å; D79-F108 WeakPolarHBondContact OD1-CE2 3.41Å; D79-F108 WeakPolarHBondContact OD1-CZ 3.36Å; P92-F108 HydrophobicContact CB-CB 4.14Å; P92-F108 HydrophobicContact CG-CD1 4.11Å; I95-F108 HydrophobicContact CD1-CD1 4.07Å; I95-F108 HydrophobicContact CD1-CE1 3.98Å; I95-F108 HydrophobicContact CG1-CD1 4.02Å; I95-F108 HydrophobicContact CG1-CE1 4.37Å; R106-F108 HydrophobicContact CB-CE2 4.48Å
109	V	94.6	Very high	92.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	130.8	-171.5	-172.5	0	0	0	0	110.2	I74 D93 F94 L96 F107	I74-V109 HydrophobicContact CB-CG1 3.92Å; I74-V109 HydrophobicContact CD1-CG1 3.66Å; I74-V109 HydrophobicContact CG1-CG1 4.4Å; I74-V109 HydrophobicContact CG2-CG1 4.02Å; D93-V109 PolarHBondContact N-O 2.85Å; F94-V109 HydrophobicContact CD2-CB 3.75Å; F94-V109 HydrophobicContact CD2-CG1 4.33Å; F94-V109 HydrophobicContact CD2-CG2 3.98Å; F94-V109 HydrophobicContact CE1-CB 4.3Å; F94-V109 HydrophobicContact CE1-CG1 3.98Å; F94-V109 HydrophobicContact CE2-CB 3.43Å; F94-V109 VanDerWaalsContact CE2-CB 3.43Å; F94-V109 HydrophobicContact CE2-CG1 3.55Å; F94-V109 HydrophobicContact CE2-CG2 3.6Å; F94-V109 HydrophobicContact CG-CB 4.34Å; F94-V109 HydrophobicContact CZ-CB 3.74Å; F94-V109 HydrophobicContact CZ-CG1 3.35Å; F94-V109 HydrophobicContact CZ-CG2 4.31Å; F94-V109 PolarHBondContact N-O 3.13Å; F94-V109 PolarHBondContact O-N 3.03Å; L96-V109 HydrophobicContact CD1-CG2 4.11Å; L96-V109 HydrophobicContact CG-CG2 4.18Å; F107-V109 HydrophobicContact CB-CG2 4.29Å
110	H	94.5	Very high	92.7	Very high	4 Å²	4	52 Å²	52	2%	0.019	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	131.5	174.3	-60.1	73	0	0	0	108.4	I74 H75 H77 D93 W206	I74-H110 CarbonylContact C-O 3.55Å; I74-H110 WeakPolarHBondContact CA-O 3.43Å; I74-H110 WeakPolarHBondContact CB-O 3.39Å; H75-H110 PolarHBondContact N-O 3.02Å; H75-H110 PolarHBondContact O-N 3.22Å; H77-H110 AromaticContact CE1-CE1 3.59Å; D93-H110 VanDerWaalsContact OD2-CA 3.26Å; D93-H110 WeakPolarHBondContact OD2-CA 3.49Å; H110-W206 HydrophobicContact CB-CH2 3.83Å; H110-W206 HydrophobicContact CB-CZ3 4.07Å; H110-W206 WeakPolarHBondContact O-CZ3 3.49Å
111	K	95.4	Very high	93.1	Very high	25 Å²	25	49.4 Å²	49.4	11%	0.109	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	132.6	175.7	-66.5	176.2	76.8	170.3	0	109.7	R34 D93 F94 V115 D116 L146 W206	R34-K111 PolarHBondContact NH2-O 2.85Å; R34-K111 VanDerWaalsContact NH2-O 3.13Å; D93-K111 HydrophobicContact CB-CB 4.48Å; D93-K111 HydrophobicContact CB-CD 3.84Å; D93-K111 HydrophobicContact CB-CG 3.84Å; D93-K111 PolarHBondContact OD2-N 3.08Å; F94-K111 HydrophobicContact CD1-CD 4.49Å; F94-K111 HydrophobicContact CE1-CD 4.13Å; F94-K111 HydrophobicContact CE1-CG 3.95Å; K111-V115 HydrophobicContact CB-CG1 3.79Å; K111-V115 HydrophobicContact CD-CG1 4.45Å; K111-V115 VanDerWaalsContact CE-CG1 3.46Å; K111-V115 HydrophobicContact CG-CG1 4.28Å; K111-D116 WeakPolarHBondContact CE-OD1 3.42Å; K111-D116 WeakPolarHBondContact CE-OD2 3.38Å; K111-D116 IonicContact NZ-OD1 2.94Å; K111-D116 PolarHBondContact NZ-OD1 3.06Å; K111-D116 IonicContact NZ-OD2 3.33Å; K111-D116 PolarHBondContact NZ-OD2 2.91Å; K111-L146 HydrophobicContact CG-CD2 4.44Å; K111-W206 VanDerWaalsContact C-CH2 3.42Å; K111-W206 WeakPolarHBondContact O-CH2 3.21Å
112	R	95.9	Very high	93.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-59.3	138.6	168.6	-173.1	170.2	-171.1	152.8	15.3	108.6	T72 L73 H114 V115 I203 K204 W206 D212 L215	T72-R112 WeakPolarHBondContact O-CD 3.15Å; T72-R112 PolarHBondContact O-NH1 3.43Å; L73-R112 WeakPolarHBondContact O-CB 3.13Å; L73-R112 PolarHBondContact O-N 2.82Å; R112-H114 PolarHBondContact O-N 3.03Å; R112-V115 WeakPolarHBondContact O-CB 3.47Å; R112-V115 VanDerWaalsContact O-CG1 3.31Å; R112-V115 WeakPolarHBondContact O-CG1 3.27Å; R112-V115 PolarHBondContact O-N 2.83Å; R112-I203 VanDerWaalsContact NH1-CD1 3.27Å; R112-K204 PolarHBondContact NH1-O 2.81Å; R112-K204 PolarHBondContact NH2-O 3.23Å; R112-W206 HydrophobicContact CB-CD2 3.81Å; R112-W206 HydrophobicContact CB-CE3 3.78Å; R112-W206 HydrophobicContact CB-CG 4.22Å; R112-W206 HydrophobicContact CB-CZ3 4.21Å; R112-W206 HydrophobicContact CG-CB 4.1Å; R112-W206 HydrophobicContact CG-CD2 3.74Å; R112-W206 HydrophobicContact CG-CE3 4.22Å; R112-W206 HydrophobicContact CG-CG 3.65Å; R112-D212 IonicContact CZ-OD1 2.81Å; R112-D212 IonicContact CZ-OD2 3.75Å; R112-D212 IonicContact NE-OD1 3.23Å; R112-D212 PolarHBondContact NE-OD1 2.79Å; R112-D212 IonicContact NE-OD2 2.62Å; R112-D212 IonicContact NH2-OD1 2.65Å; R112-D212 PolarHBondContact NH2-OD1 2.86Å; R112-D212 IonicContact NH2-OD2 2.7Å; R112-D212 PolarHBondContact NH2-OD2 2.93Å; R112-L215 HydrophobicContact CB-CD1 4.23Å; R112-L215 HydrophobicContact CG-CD1 4.07Å; R112-L215 HydrophobicContact CG-CG 4.44Å
113	P	92.6	Very high	94.1	Very high	7 Å²	7	34.4 Å²	34.4	5%	0.045	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	142	177.3	-27.1	33.8	0	0	0	111.3	V115 W206 D209 D212	P113-V115 PolarHBondContact O-N 2.89Å; P113-V115 VanDerWaalsContact O-N 3.13Å; P113-W206 VanDerWaalsContact CD-CE2 3.47Å; P113-W206 HydrophobicContact CG-CZ2 4.45Å; P113-D209 WeakPolarHBondContact CG-O 3.27Å; P113-D212 WeakPolarHBondContact CB-O 3.26Å; P113-D212 HydrophobicContact CG-CB 4.19Å
114	H	92.8	Very high	94.5	Very high	18 Å²	18	33.8 Å²	33.8	8%	0.083	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	5.7	178.5	-41.3	-68.6	0	0	0	117	Q38 R112 D116 F117 F118 D212 L216	Q38-H114 PolarHBondContact O-CE1 2.85Å; Q38-H114 PolarHBondContact O-ND1 3.28Å; R112-H114 PolarHBondContact O-N 3.03Å; H114-D116 VanDerWaalsContact C-N 3.29Å; H114-D116 PolarHBondContact O-N 2.96Å; H114-F117 PolarHBondContact O-N 2.88Å; H114-F118 WeakPolarHBondContact O-CB 3.32Å; H114-F118 PolarHBondContact O-N 3.33Å; H114-D212 PolarHBondContact CD2-O 2.89Å; H114-L216 HydrophobicContact CB-CD1 4Å; H114-L216 HydrophobicContact CB-CD2 3.73Å; H114-L216 HydrophobicContact CB-CG 3.62Å; H114-L216 WeakPolarHBondContact CD2-CD1 3.26Å; H114-L216 WeakPolarHBondContact NE2-CD1 3.39Å
115	V	96.4	Very high	94.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-56.4	-38.7	-178.8	67.7	0	0	0	0	114	L73 K111 R112 P113 F118 L119 L146 L215	L73-V115 HydrophobicContact CB-CG2 3.93Å; L73-V115 HydrophobicContact CD2-CG2 4.06Å; L73-V115 HydrophobicContact CG-CG2 4.39Å; K111-V115 HydrophobicContact CB-CG1 3.79Å; K111-V115 HydrophobicContact CD-CG1 4.45Å; K111-V115 VanDerWaalsContact CE-CG1 3.46Å; K111-V115 HydrophobicContact CG-CG1 4.28Å; R112-V115 WeakPolarHBondContact O-CB 3.47Å; R112-V115 VanDerWaalsContact O-CG1 3.31Å; R112-V115 WeakPolarHBondContact O-CG1 3.27Å; R112-V115 PolarHBondContact O-N 2.83Å; P113-V115 PolarHBondContact O-N 2.89Å; P113-V115 VanDerWaalsContact O-N 3.13Å; V115-F118 PolarHBondContact O-N 2.99Å; V115-L119 HydrophobicContact CG2-CD1 4.1Å; V115-L119 HydrophobicContact CG2-CG 4.35Å; V115-L119 WeakPolarHBondContact O-CB 3.3Å; V115-L119 VanDerWaalsContact O-CG 3.28Å; V115-L119 WeakPolarHBondContact O-CG 3.39Å; V115-L119 PolarHBondContact O-N 3.41Å; V115-L146 HydrophobicContact CG1-CD2 4.44Å; V115-L146 HydrophobicContact CG2-CD2 4.41Å; V115-L215 HydrophobicContact CB-CD1 3.92Å; V115-L215 HydrophobicContact CG2-CD1 4.22Å
116	D	95.1	Very high	95.1	Very high	31 Å²	31	28.2 Å²	28.2	17%	0.166	13%	0.128	C	C	.	.	H	α-helix	trans	-64.5	-47.8	-179.9	-69.5	-47.1	0	0	0	112.2	K111 H114 L119 E120	K111-D116 WeakPolarHBondContact CE-OD1 3.42Å; K111-D116 WeakPolarHBondContact CE-OD2 3.38Å; K111-D116 IonicContact NZ-OD1 2.94Å; K111-D116 PolarHBondContact NZ-OD1 3.06Å; K111-D116 IonicContact NZ-OD2 3.33Å; K111-D116 PolarHBondContact NZ-OD2 2.91Å; H114-D116 VanDerWaalsContact C-N 3.29Å; H114-D116 PolarHBondContact O-N 2.96Å; D116-L119 PolarHBondContact O-N 3.33Å; D116-E120 WeakPolarHBondContact O-CB 2.97Å; D116-E120 PolarHBondContact O-N 3.23Å
117	F	93.2	Very high	95.4	Very high	63 Å²	63	26.6 Å²	26.6	28%	0.276	13%	0.125	S	C	.	.	H	α-helix	trans	-65.3	-43.7	178.1	-179.2	-105.3	0	0	0	110.9	H114 L119 E120 V121 L216 L219	H114-F117 PolarHBondContact O-N 2.88Å; F117-L119 PolarHBondContact O-N 2.99Å; F117-E120 WeakPolarHBondContact O-CB 3.33Å; F117-E120 PolarHBondContact O-N 3.01Å; F117-V121 HydrophobicContact CD1-CG2 4.32Å; F117-V121 HydrophobicContact CD2-CG2 4.34Å; F117-V121 HydrophobicContact CE1-CG2 3.89Å; F117-V121 HydrophobicContact CE2-CG2 3.91Å; F117-V121 HydrophobicContact CZ-CG2 3.67Å; F117-V121 WeakPolarHBondContact O-CG2 3.36Å; F117-V121 PolarHBondContact O-N 3.1Å; F117-L216 HydrophobicContact CD1-CD2 3.75Å; F117-L216 HydrophobicContact CE1-CD2 4.14Å; F117-L219 HydrophobicContact CD1-CD1 4.38Å; F117-L219 HydrophobicContact CE1-CD1 3.93Å
118	F	96.3	Very high	95.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-54.3	-53.9	174	173.8	-96.8	0	0	0	110.9	L65 L67 L73 H114 V115 E120 V121 V122 L186 L215 L219 L222	L65-F118 HydrophobicContact CD2-CZ 4.29Å; L67-F118 HydrophobicContact CD2-CE1 4.04Å; L67-F118 HydrophobicContact CD2-CZ 4.46Å; L73-F118 HydrophobicContact CD2-CD1 4.46Å; L73-F118 HydrophobicContact CD2-CE1 4.37Å; H114-F118 WeakPolarHBondContact O-CB 3.32Å; H114-F118 PolarHBondContact O-N 3.33Å; V115-F118 PolarHBondContact O-N 2.99Å; F118-E120 VanDerWaalsContact C-N 3.34Å; F118-E120 PolarHBondContact O-N 3.32Å; F118-V121 PolarHBondContact O-N 3.37Å; F118-V122 HydrophobicContact CD1-CG2 4.13Å; F118-V122 HydrophobicContact CD2-CG1 4.1Å; F118-V122 HydrophobicContact CE1-CG1 4.35Å; F118-V122 HydrophobicContact CE1-CG2 3.88Å; F118-V122 HydrophobicContact CE2-CG1 3.75Å; F118-V122 HydrophobicContact CZ-CG1 3.88Å; F118-V122 HydrophobicContact CZ-CG2 4.2Å; F118-V122 WeakPolarHBondContact O-CG2 3.28Å; F118-V122 PolarHBondContact O-N 2.92Å; F118-L186 HydrophobicContact CE1-CD2 4.36Å; F118-L186 HydrophobicContact CZ-CD2 3.93Å; F118-L215 HydrophobicContact CB-CB 4.15Å; F118-L215 HydrophobicContact CB-CD1 4.42Å; F118-L215 HydrophobicContact CD1-CD2 4.36Å; F118-L215 HydrophobicContact CD2-CB 3.93Å; F118-L215 HydrophobicContact CD2-CD2 4.49Å; F118-L215 VanDerWaalsContact CD2-O 3.28Å; F118-L215 WeakPolarHBondContact CD2-O 3.3Å; F118-L215 HydrophobicContact CE1-CD2 4.36Å; F118-L215 HydrophobicContact CE2-CD2 4.47Å; F118-L215 HydrophobicContact CG-CB 4.03Å; F118-L215 HydrophobicContact CG-CD1 4.46Å; F118-L215 HydrophobicContact CG-CD2 4.43Å; F118-L215 HydrophobicContact CZ-CD2 4.41Å; F118-L219 HydrophobicContact CD2-CD2 3.74Å; F118-L219 HydrophobicContact CD2-CG 4.43Å; F118-L219 HydrophobicContact CE2-CD2 4.16Å; F118-L222 HydrophobicContact CE2-CD1 3.62Å; F118-L222 HydrophobicContact CZ-CD1 3.88Å
119	L	97.9	Very high	95.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.1	-39.2	179.2	-70.5	175	0	0	0	112.5	L67 L73 V115 D116 F117 V121 S123 L128 L146 I152 L153	L67-L119 HydrophobicContact CD1-CD2 3.66Å; L73-L119 HydrophobicContact CD1-CD2 4.43Å; V115-L119 HydrophobicContact CG2-CD1 4.1Å; V115-L119 HydrophobicContact CG2-CG 4.35Å; V115-L119 WeakPolarHBondContact O-CB 3.3Å; V115-L119 VanDerWaalsContact O-CG 3.28Å; V115-L119 WeakPolarHBondContact O-CG 3.39Å; V115-L119 PolarHBondContact O-N 3.41Å; D116-L119 PolarHBondContact O-N 3.33Å; F117-L119 PolarHBondContact O-N 2.99Å; L119-V121 VanDerWaalsContact C-N 3.35Å; L119-S123 WeakPolarHBondContact O-CB 3.41Å; L119-S123 PolarHBondContact O-N 2.91Å; L119-S123 PolarHBondContact O-OG 3.41Å; L119-L128 HydrophobicContact CD2-CD1 4.05Å; L119-L146 HydrophobicContact CD1-CB 4.13Å; L119-I152 HydrophobicContact CB-CD1 4.15Å; L119-L153 HydrophobicContact CD2-CD2 4.45Å
120	E	94.7	Very high	96.1	Very high	102 Å²	102	23.9 Å²	23.9	48%	0.477	11%	0.114	S	C	.	.	H	α-helix	trans	-59.7	-44.4	175.2	179.8	178.1	-173.9	0	0	112	D116 F117 F118 S123 Q124	D116-E120 WeakPolarHBondContact O-CB 2.97Å; D116-E120 PolarHBondContact O-N 3.23Å; F117-E120 WeakPolarHBondContact O-CB 3.33Å; F117-E120 PolarHBondContact O-N 3.01Å; F118-E120 VanDerWaalsContact C-N 3.34Å; F118-E120 PolarHBondContact O-N 3.32Å; E120-S123 PolarHBondContact O-OG 2.79Å; E120-Q124 PolarHBondContact O-NE2 2.97Å; E120-Q124 VanDerWaalsContact O-NE2 3.09Å
121	V	94.7	Very high	96.3	Very high	3 Å²	3	23.7 Å²	23.7	2%	0.018	11%	0.113	C	C	.	.	H	α-helix	trans	-72.6	-53.2	179.9	173.7	0	0	0	0	111	F117 F118 L119 S123 Q124 W125 L219	F117-V121 HydrophobicContact CD1-CG2 4.32Å; F117-V121 HydrophobicContact CD2-CG2 4.34Å; F117-V121 HydrophobicContact CE1-CG2 3.89Å; F117-V121 HydrophobicContact CE2-CG2 3.91Å; F117-V121 HydrophobicContact CZ-CG2 3.67Å; F117-V121 WeakPolarHBondContact O-CG2 3.36Å; F117-V121 PolarHBondContact O-N 3.1Å; F118-V121 PolarHBondContact O-N 3.37Å; L119-V121 VanDerWaalsContact C-N 3.35Å; V121-S123 VanDerWaalsContact C-N 3.28Å; V121-S123 PolarHBondContact O-N 2.78Å; V121-Q124 WeakPolarHBondContact O-CB 3.37Å; V121-Q124 PolarHBondContact O-N 2.94Å; V121-Q124 VanDerWaalsContact O-N 3.12Å; V121-W125 HydrophobicContact CG1-CD2 4.2Å; V121-W125 HydrophobicContact CG1-CE3 4.13Å; V121-W125 HydrophobicContact CG1-CH2 3.15Å; V121-W125 HydrophobicContact CG1-CZ2 3.2Å; V121-W125 HydrophobicContact CG1-CZ3 3.64Å; V121-L219 HydrophobicContact CB-CD2 4.23Å; V121-L219 HydrophobicContact CG1-CD2 3.9Å
122	V	97.3	Very high	96.5	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-68.8	-26.6	-173.8	-61.7	0	0	0	0	112.9	L65 F118 Q124 W125 Y126 L128 L219 L222	L65-V122 HydrophobicContact CD2-CB 4.07Å; L65-V122 HydrophobicContact CD2-CG1 4.32Å; L65-V122 HydrophobicContact CD2-CG2 4.07Å; F118-V122 HydrophobicContact CD1-CG2 4.13Å; F118-V122 HydrophobicContact CD2-CG1 4.1Å; F118-V122 HydrophobicContact CE1-CG1 4.35Å; F118-V122 HydrophobicContact CE1-CG2 3.88Å; F118-V122 HydrophobicContact CE2-CG1 3.75Å; F118-V122 HydrophobicContact CZ-CG1 3.88Å; F118-V122 HydrophobicContact CZ-CG2 4.2Å; F118-V122 WeakPolarHBondContact O-CG2 3.28Å; F118-V122 PolarHBondContact O-N 2.92Å; V122-Q124 PolarHBondContact O-N 2.98Å; V122-W125 HydrophobicContact CG1-CE3 4.29Å; V122-W125 HydrophobicContact CG1-CZ3 4.45Å; V122-W125 PolarHBondContact O-N 3.46Å; V122-Y126 HydrophobicContact CB-CD2 4.43Å; V122-Y126 PolarHBondContact O-N 2.75Å; V122-L128 HydrophobicContact CB-CD2 4.35Å; V122-L128 HydrophobicContact CG2-CD1 4.09Å; V122-L128 HydrophobicContact CG2-CD2 3.81Å; V122-L219 HydrophobicContact CG1-CD2 3.87Å; V122-L222 HydrophobicContact CG1-CD1 3.87Å
123	S	97.6	Very high	96.5	Very high	23 Å²	23	23.8 Å²	23.8	16%	0.161	12%	0.119	C	C	.	.	H	α-helix	trans	-66.2	-19	175.2	64.5	0	0	0	0	113.6	R62 L119 E120 V121	R62-S123 PolarHBondContact NH2-O 2.65Å; L119-S123 WeakPolarHBondContact O-CB 3.41Å; L119-S123 PolarHBondContact O-N 2.91Å; L119-S123 PolarHBondContact O-OG 3.41Å; E120-S123 PolarHBondContact O-OG 2.79Å; V121-S123 VanDerWaalsContact C-N 3.28Å; V121-S123 PolarHBondContact O-N 2.78Å
124	Q	95.1	Very high	96.7	Very high	116 Å²	116	24.5 Å²	24.5	54%	0.542	12%	0.123	S	C	.	.	H	α-helix	trans	-79.8	-23	172.9	-60.3	172.1	42.8	0	0	111.9	E120 V121 V122	E120-Q124 PolarHBondContact O-NE2 2.97Å; E120-Q124 VanDerWaalsContact O-NE2 3.09Å; V121-Q124 WeakPolarHBondContact O-CB 3.37Å; V121-Q124 PolarHBondContact O-N 2.94Å; V121-Q124 VanDerWaalsContact O-N 3.12Å; V122-Q124 PolarHBondContact O-N 2.98Å
125	W	95.8	Very high	96.8	Very high	22 Å²	22	28 Å²	28	8%	0.083	14%	0.141	C	C	.	.	H	α-helix	trans	-102.7	-38.7	-172.7	-57.7	-15.8	0	0	0	112.4	Y44 V121 V122 L219 L222 D223 R226	Y44-W125 AromaticContact CE1-CH2 3.72Å; Y44-W125 HydrophobicContact CE1-CH2 3.72Å; Y44-W125 HydrophobicContact CE1-CZ2 4.06Å; V121-W125 HydrophobicContact CG1-CD2 4.2Å; V121-W125 HydrophobicContact CG1-CE3 4.13Å; V121-W125 HydrophobicContact CG1-CH2 3.15Å; V121-W125 HydrophobicContact CG1-CZ2 3.2Å; V121-W125 HydrophobicContact CG1-CZ3 3.64Å; V122-W125 HydrophobicContact CG1-CE3 4.29Å; V122-W125 HydrophobicContact CG1-CZ3 4.45Å; V122-W125 PolarHBondContact O-N 3.46Å; W125-L219 HydrophobicContact CH2-CB 4.45Å; W125-L219 HydrophobicContact CH2-CD2 4.37Å; W125-L219 HydrophobicContact CZ3-CD2 4.08Å; W125-L222 HydrophobicContact CZ3-CB 4.38Å; W125-D223 HydrophobicContact CE3-CB 4.42Å; W125-D223 HydrophobicContact CH2-CB 3.84Å; W125-D223 HydrophobicContact CZ2-CB 4.34Å; W125-D223 HydrophobicContact CZ3-CB 3.9Å; W125-R226 HydrophobicContact CB-CG 4.07Å; W125-R226 VanDerWaalsContact CD1-CZ 3.48Å
126	Y	98.4	Very high	96.9	Very high	1 Å²	1	32.4 Å²	32.4	0%	0.004	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	153.8	-172.1	-68.1	-92.1	0	0	0	110.8	R62 K63 L65 V122 L222 L225 R226	R62-Y126 PolarHBondContact NH2-O 2.79Å; K63-Y126 HydrophobicContact CB-CD1 3.64Å; K63-Y126 HydrophobicContact CB-CE1 3.52Å; K63-Y126 HydrophobicContact CG-CE1 4.36Å; K63-Y126 CarbonylContact O-C 3.48Å; K63-Y126 VanDerWaalsContact O-CA 3.32Å; K63-Y126 WeakPolarHBondContact O-CA 3.5Å; L65-Y126 HydrophobicContact CB-CD1 3.8Å; L65-Y126 HydrophobicContact CB-CG 3.76Å; L65-Y126 HydrophobicContact CD2-CD2 4.5Å; V122-Y126 HydrophobicContact CB-CD2 4.43Å; V122-Y126 PolarHBondContact O-N 2.75Å; Y126-L222 HydrophobicContact CE2-CB 4.1Å; Y126-L222 HydrophobicContact CE2-CD2 4.43Å; Y126-L222 WeakPolarHBondContact CE2-O 3.4Å; Y126-L222 PolarHBondContact OH-O 2.93Å; Y126-L225 VanDerWaalsContact OH-CB 3.29Å; Y126-L225 WeakPolarHBondContact OH-CB 3.37Å; Y126-R226 HydrophobicContact CE2-CG 4.1Å
127	E	98.4	Very high	96.9	Very high	79 Å²	79	34.7 Å²	34.7	37%	0.369	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	124.4	154.7	-176.5	-177.9	168.4	0	0	108	K63 I64 L65 R155	K63-E127 PolarHBondContact O-N 2.57Å; I64-E127 CarbonylContact C-O 3.5Å; I64-E127 WeakPolarHBondContact CA-O 3.49Å; I64-E127 HydrophobicContact CG1-CB 4.32Å; L65-E127 PolarHBondContact N-O 3.27Å; E127-R155 WeakPolarHBondContact OE1-CD 3.34Å; E127-R155 IonicContact OE1-CZ 3.18Å; E127-R155 IonicContact OE1-NE 3.57Å; E127-R155 IonicContact OE1-NH1 2.77Å; E127-R155 PolarHBondContact OE1-NH1 2.85Å; E127-R155 IonicContact OE2-NH1 3.68Å
128	L	98.8	Very high	97	Very high	6 Å²	6	32.2 Å²	32.2	3%	0.031	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	134.1	-177.3	-52.6	-173.7	0	0	0	110.8	L65 L67 L119 V122 I152 L153	L65-L128 HydrophobicContact CB-CD2 3.96Å; L65-L128 HydrophobicContact CD2-CD2 4.13Å; L65-L128 HydrophobicContact CG-CD2 4.45Å; L67-L128 HydrophobicContact CD1-CB 4.39Å; L67-L128 HydrophobicContact CD1-CD1 4.32Å; L67-L128 HydrophobicContact CD1-CD2 4.36Å; L119-L128 HydrophobicContact CD2-CD1 4.05Å; V122-L128 HydrophobicContact CB-CD2 4.35Å; V122-L128 HydrophobicContact CG2-CD1 4.09Å; V122-L128 HydrophobicContact CG2-CD2 3.81Å; L128-I152 HydrophobicContact CD1-CB 4.49Å; L128-I152 HydrophobicContact CD1-CD1 4.27Å; L128-L153 HydrophobicContact CB-CD2 3.78Å; L128-L153 HydrophobicContact CD1-CD2 3.96Å
129	V	98.9	Very high	97	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	128.1	176.8	174.9	0	0	0	0	108.4	I64 L65 V66 L67 R155 Y157 V176	I64-V129 HydrophobicContact CG2-CB 4.28Å; I64-V129 HydrophobicContact CG2-CG2 3.58Å; L65-V129 PolarHBondContact O-N 3.06Å; V66-V129 CarbonylContact C-O 3.59Å; V66-V129 WeakPolarHBondContact CA-O 3.4Å; V66-V129 HydrophobicContact CG2-CB 4.23Å; V66-V129 HydrophobicContact CG2-CG1 4.46Å; L67-V129 PolarHBondContact N-O 2.86Å; V129-R155 WeakPolarHBondContact CA-O 3.48Å; V129-R155 HydrophobicContact CG1-CB 4.33Å; V129-R155 HydrophobicContact CG2-CB 3.97Å; V129-Y157 HydrophobicContact CG1-CD2 3.59Å; V129-Y157 HydrophobicContact CG1-CE2 3.6Å; V129-V176 HydrophobicContact CB-CG1 4.49Å; V129-V176 HydrophobicContact CG1-CG1 4.18Å; V129-V176 HydrophobicContact CG2-CG1 4.07Å
130	V	98.9	Very high	97	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	128.5	169.3	176.1	0	0	0	0	108.1	L69 T132 A143 L153 R155 R156 Y157	L69-V130 HydrophobicContact CD1-CG1 3.87Å; L69-V130 HydrophobicContact CD2-CG1 3.91Å; L69-V130 HydrophobicContact CD2-CG2 4.49Å; L69-V130 HydrophobicContact CG-CG1 3.82Å; V130-T132 HydrophobicContact CG1-CG2 4.43Å; V130-A143 HydrophobicContact CG2-CB 4.19Å; V130-L153 HydrophobicContact CG2-CB 4.03Å; V130-L153 HydrophobicContact CG2-CD1 4.06Å; V130-L153 HydrophobicContact CG2-CD2 4.1Å; V130-L153 HydrophobicContact CG2-CG 4.28Å; V130-R155 PolarHBondContact N-O 3.3Å; V130-R156 HydrophobicContact CB-CB 4.28Å; V130-R156 HydrophobicContact CB-CG 4.11Å; V130-R156 HydrophobicContact CG2-CG 4.41Å; V130-R156 CarbonylContact O-C 3.46Å; V130-R156 VanDerWaalsContact O-CA 3.32Å; V130-R156 WeakPolarHBondContact O-CA 3.2Å; V130-Y157 PolarHBondContact O-N 3.2Å
131	F	98.8	Very high	97.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	104.3	168.5	-160.9	163.3	0	0	0	108.5	V66 L67 Y157 H161 K171 V175 V176	V66-F131 HydrophobicContact CG1-CB 3.37Å; V66-F131 HydrophobicContact CG1-CD1 4.17Å; V66-F131 HydrophobicContact CG1-CG 4.28Å; L67-F131 PolarHBondContact O-N 2.79Å; F131-Y157 CarbonylContact C-O 3.19Å; F131-Y157 VanDerWaalsContact CA-O 3.3Å; F131-Y157 WeakPolarHBondContact CA-O 3.49Å; F131-Y157 VanDerWaalsContact CD2-CB 3.43Å; F131-Y157 HydrophobicContact CG-CG 4.46Å; F131-H161 HydrophobicContact CE2-CB 4.23Å; F131-H161 HydrophobicContact CZ-CB 4.38Å; F131-K171 HydrophobicContact CB-CD 4.3Å; F131-K171 HydrophobicContact CD1-CB 3.85Å; F131-K171 HydrophobicContact CD1-CD 4.37Å; F131-K171 HydrophobicContact CD1-CG 4.26Å; F131-K171 HydrophobicContact CD2-CB 4.3Å; F131-K171 HydrophobicContact CD2-CD 3.97Å; F131-K171 HydrophobicContact CD2-CG 3.86Å; F131-K171 HydrophobicContact CE1-CB 3.63Å; F131-K171 HydrophobicContact CE1-CG 4.24Å; F131-K171 HydrophobicContact CE2-CB 4.12Å; F131-K171 HydrophobicContact CE2-CD 4.46Å; F131-K171 HydrophobicContact CE2-CG 3.84Å; F131-K171 HydrophobicContact CG-CB 4.19Å; F131-K171 HydrophobicContact CG-CD 3.93Å; F131-K171 HydrophobicContact CG-CG 4.09Å; F131-K171 HydrophobicContact CZ-CB 3.78Å; F131-K171 HydrophobicContact CZ-CG 4.04Å; F131-K171 VanDerWaalsContact O-CE 3.27Å; F131-K171 WeakPolarHBondContact O-CE 3.35Å; F131-K171 PolarHBondContact O-NZ 3.48Å; F131-V175 HydrophobicContact CE1-CG2 4.13Å; F131-V175 HydrophobicContact CZ-CG2 4.43Å; F131-V176 HydrophobicContact CD1-CG2 4.09Å; F131-V176 HydrophobicContact CE1-CG2 4.3Å
132	T	98.5	Very high	97.3	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.006	16%	0.157	C	C	.	.			trans	-119.4	146.5	-177.3	179.2	0	0	0	0	111.5	L69 V130 S134 Y157 Y158 R159	L69-T132 HydrophobicContact CD1-CG2 3.97Å; L69-T132 HydrophobicContact CG-CG2 4.44Å; V130-T132 HydrophobicContact CG1-CG2 4.43Å; T132-S134 PolarHBondContact O-N 2.75Å; T132-S134 WeakPolarHBondContact OG1-CB 3.3Å; T132-S134 PolarHBondContact OG1-N 3.07Å; T132-S134 VanDerWaalsContact OG1-N 3.1Å; T132-Y157 PolarHBondContact N-O 2.94Å; T132-Y158 HydrophobicContact CG2-CD1 3.72Å; T132-Y158 HydrophobicContact CG2-CE1 4.38Å; T132-Y158 CarbonylContact O-C 3.56Å; T132-Y158 VanDerWaalsContact O-CA 3.3Å; T132-Y158 WeakPolarHBondContact O-CA 3.44Å; T132-R159 PolarHBondContact O-N 3.45Å
133	A	97.3	Very high	97.4	Very high	27 Å²	27	29.7 Å²	29.7	22%	0.223	16%	0.157	C	C	.	.	S	Bend	trans	-78.3	5.2	169.7	0	0	0	0	0	113	R159 Y169	A133-R159 WeakPolarHBondContact O-CB 3.42Å; A133-R159 VanDerWaalsContact O-CZ 3.3Å; A133-R159 PolarHBondContact O-NE 3.31Å; A133-R159 PolarHBondContact O-NH2 2.76Å; A133-Y169 HydrophobicContact CB-CD2 4.14Å; A133-Y169 HydrophobicContact CB-CG 4.11Å
134	S	95.9	Very high	97.4	Very high	21 Å²	21	32.7 Å²	32.7	15%	0.147	17%	0.171	C	C	.	.	S	Bend	trans	-86.7	159.5	177.6	-72.3	0	0	0	0	113	D70 T132 R159	D70-S134 PolarHBondContact OD2-OG 2.99Å; T132-S134 PolarHBondContact O-N 2.75Å; T132-S134 WeakPolarHBondContact OG1-CB 3.3Å; T132-S134 PolarHBondContact OG1-N 3.07Å; T132-S134 VanDerWaalsContact OG1-N 3.1Å; S134-R159 WeakPolarHBondContact O-CB 3.36Å; S134-R159 PolarHBondContact O-N 2.84Å
135	M	95.4	Very high	97.5	Very high	91 Å²	91	32.6 Å²	32.6	45%	0.448	17%	0.169	S	C	.	.			trans	-62.7	142.9	176.8	-63.6	-59.8	-73	0	0	110.9	I137 Y138 G139 R159	M135-I137 VanDerWaalsContact C-N 3.31Å; M135-I137 HydrophobicContact CB-CG1 3.96Å; M135-I137 PolarHBondContact O-N 3.02Å; M135-Y138 PolarHBondContact O-N 3.42Å; M135-G139 PolarHBondContact O-N 3.47Å; M135-R159 VanDerWaalsContact CG-NH1 3.3Å; M135-R159 HydrophobicContact SD-CB 4.39Å; M135-R159 PolarHBondContact SD-NH1 2.94Å
136	E	97.1	Very high	97.6	Very high	93 Å²	93	31.5 Å²	31.5	44%	0.435	17%	0.165	S	C	.	.	H	α-helix	trans	-53.7	-43.7	180	173.9	163.1	-164.3	0	0	113.6	Y138 G139 S140 Y158 Q160	E136-Y138 PolarHBondContact O-N 3.46Å; E136-Y138 VanDerWaalsContact O-N 3.09Å; E136-G139 PolarHBondContact O-N 2.87Å; E136-S140 WeakPolarHBondContact O-CB 3.37Å; E136-S140 PolarHBondContact O-N 3.03Å; E136-S140 PolarHBondContact O-OG 2.88Å; E136-Y158 HydrophobicContact CB-CD1 4.27Å; E136-Y158 HydrophobicContact CB-CD2 3.49Å; E136-Y158 VanDerWaalsContact CB-CD2 3.49Å; E136-Y158 HydrophobicContact CB-CE2 3.98Å; E136-Y158 HydrophobicContact CB-CG 3.64Å; E136-Y158 HydrophobicContact CG-CD2 3.47Å; E136-Y158 VanDerWaalsContact CG-CD2 3.47Å; E136-Y158 HydrophobicContact CG-CE2 3.43Å; E136-Y158 VanDerWaalsContact CG-CE2 3.43Å; E136-Y158 HydrophobicContact CG-CG 4.08Å; E136-Q160 PolarHBondContact OE2-NE2 3.29Å
137	I	95.2	Very high	97.6	Very high	80 Å²	80	32 Å²	32	41%	0.41	17%	0.168	S	C	.	.	H	α-helix	trans	-56.6	-29.7	179.7	53.2	166.6	0	0	0	113.6	V98 I100 M135	V98-I137 WeakPolarHBondContact CG1-O 3.32Å; I100-I137 HydrophobicContact CG1-CD1 3.72Å; M135-I137 VanDerWaalsContact C-N 3.31Å; M135-I137 HydrophobicContact CB-CG1 3.96Å; M135-I137 PolarHBondContact O-N 3.02Å
138	Y	95.9	Very high	97.5	Very high	11 Å²	11	33.7 Å²	33.7	4%	0.043	18%	0.179	C	C	.	.	H	α-helix	trans	-93.3	-49.8	176.7	164.2	-94.5	0	0	0	110.8	D70 I74 S76 L96 F107 M135 E136 S140 A141 V142	D70-Y138 WeakPolarHBondContact OD1-CE1 2.98Å; D70-Y138 PolarHBondContact OD1-OH 2.9Å; D70-Y138 WeakPolarHBondContact OD2-CE1 3.38Å; I74-Y138 WeakPolarHBondContact CD1-OH 3.4Å; S76-Y138 WeakPolarHBondContact CB-OH 3.28Å; S76-Y138 PolarHBondContact OG-OH 3.41Å; L96-Y138 HydrophobicContact CD1-CD2 4.36Å; L96-Y138 HydrophobicContact CD1-CE2 4.34Å; F107-Y138 HydrophobicContact CB-CD2 4.4Å; F107-Y138 HydrophobicContact CB-CE2 4.05Å; F107-Y138 AromaticContact CD1-CD2 3.81Å; F107-Y138 HydrophobicContact CD1-CD2 3.81Å; F107-Y138 AromaticContact CD1-CE2 3.58Å; F107-Y138 HydrophobicContact CD1-CE2 3.58Å; F107-Y138 AromaticContact CD2-CD2 3.99Å; F107-Y138 HydrophobicContact CD2-CD2 3.99Å; F107-Y138 HydrophobicContact CD2-CE2 4.42Å; F107-Y138 HydrophobicContact CE1-CD2 4.01Å; F107-Y138 HydrophobicContact CE1-CE2 4.1Å; F107-Y138 HydrophobicContact CE2-CD2 4.2Å; F107-Y138 AromaticContact CG-CD2 3.8Å; F107-Y138 HydrophobicContact CG-CD2 3.8Å; F107-Y138 AromaticContact CG-CE2 3.76Å; F107-Y138 HydrophobicContact CG-CE2 3.76Å; F107-Y138 HydrophobicContact CZ-CD2 4.21Å; M135-Y138 PolarHBondContact O-N 3.42Å; E136-Y138 PolarHBondContact O-N 3.46Å; E136-Y138 VanDerWaalsContact O-N 3.09Å; Y138-S140 VanDerWaalsContact C-N 3.34Å; Y138-S140 PolarHBondContact O-N 3.26Å; Y138-A141 PolarHBondContact O-N 3.41Å; Y138-V142 HydrophobicContact CD1-CG2 4.42Å; Y138-V142 HydrophobicContact CD2-CG2 4.21Å; Y138-V142 HydrophobicContact CE1-CG2 3.95Å; Y138-V142 HydrophobicContact CE2-CG2 3.69Å; Y138-V142 WeakPolarHBondContact O-CG2 3.32Å; Y138-V142 PolarHBondContact O-N 3.22Å
139	G	97.4	Very high	97.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.5	-38.4	-175.8	0	0	0	0	0	113	M135 E136 A143	M135-G139 PolarHBondContact O-N 3.47Å; E136-G139 PolarHBondContact O-N 2.87Å; G139-A143 VanDerWaalsContact O-CB 3.3Å; G139-A143 WeakPolarHBondContact O-CB 3.41Å; G139-A143 PolarHBondContact O-N 3.42Å
140	S	97.6	Very high	97.3	Very high	29 Å²	29	44.8 Å²	44.8	20%	0.203	23%	0.232	C	C	.	.	H	α-helix	trans	-62.5	-47.3	174.4	59.9	0	0	0	0	111.6	E136 Y138 V142 A143 D144 R156 Y158	E136-S140 WeakPolarHBondContact O-CB 3.37Å; E136-S140 PolarHBondContact O-N 3.03Å; E136-S140 PolarHBondContact O-OG 2.88Å; Y138-S140 VanDerWaalsContact C-N 3.34Å; Y138-S140 PolarHBondContact O-N 3.26Å; S140-V142 PolarHBondContact O-N 3.04Å; S140-A143 PolarHBondContact O-N 3.13Å; S140-D144 VanDerWaalsContact O-CG 3.3Å; S140-D144 PolarHBondContact O-N 3.12Å; S140-R156 PolarHBondContact O-NH1 2.62Å; S140-Y158 WeakPolarHBondContact CA-OH 3.47Å; S140-Y158 VanDerWaalsContact CB-OH 3.25Å; S140-Y158 WeakPolarHBondContact CB-OH 3.33Å
141	A	97.3	Very high	97.2	Very high	23 Å²	23	49.3 Å²	49.3	19%	0.19	26%	0.256	C	S	.	.	H	α-helix	trans	-64	-37.7	179.2	0	0	0	0	0	112.7	L96 Y138 K145	L96-A141 HydrophobicContact CD1-CB 3.91Å; L96-A141 HydrophobicContact CD2-CB 4.12Å; Y138-A141 PolarHBondContact O-N 3.41Å; A141-K145 WeakPolarHBondContact O-CG 3.43Å; A141-K145 PolarHBondContact O-N 3.29Å
142	V	98.1	Very high	97.2	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.5	-49.5	171.6	172.4	0	0	0	0	110.6	L69 I74 L96 Y138 S140 D144 K145 L146	L69-V142 HydrophobicContact CD1-CB 4.21Å; L69-V142 HydrophobicContact CD1-CG1 4.08Å; L69-V142 HydrophobicContact CD2-CG1 4.47Å; I74-V142 HydrophobicContact CD1-CG1 3.66Å; I74-V142 HydrophobicContact CD1-CG2 4.03Å; I74-V142 HydrophobicContact CG1-CG1 4.09Å; I74-V142 HydrophobicContact CG2-CG1 4.41Å; L96-V142 HydrophobicContact CD1-CB 4.38Å; L96-V142 HydrophobicContact CD1-CG2 3.44Å; L96-V142 VanDerWaalsContact CD1-CG2 3.44Å; Y138-V142 HydrophobicContact CD1-CG2 4.42Å; Y138-V142 HydrophobicContact CD2-CG2 4.21Å; Y138-V142 HydrophobicContact CE1-CG2 3.95Å; Y138-V142 HydrophobicContact CE2-CG2 3.69Å; Y138-V142 WeakPolarHBondContact O-CG2 3.32Å; Y138-V142 PolarHBondContact O-N 3.22Å; S140-V142 PolarHBondContact O-N 3.04Å; V142-D144 VanDerWaalsContact C-N 3.29Å; V142-D144 PolarHBondContact O-N 2.84Å; V142-K145 PolarHBondContact O-N 3.09Å; V142-K145 VanDerWaalsContact O-N 3.11Å; V142-L146 HydrophobicContact CG1-CD1 4.04Å; V142-L146 HydrophobicContact CG1-CG 4.37Å; V142-L146 PolarHBondContact O-N 2.79Å
143	A	98.3	Very high	97.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.3	-39.1	-179	0	0	0	0	0	111.9	V130 G139 S140 K145 L146 D147	V130-A143 HydrophobicContact CG2-CB 4.19Å; G139-A143 VanDerWaalsContact O-CB 3.3Å; G139-A143 WeakPolarHBondContact O-CB 3.41Å; G139-A143 PolarHBondContact O-N 3.42Å; S140-A143 PolarHBondContact O-N 3.13Å; A143-K145 PolarHBondContact O-N 3.21Å; A143-L146 PolarHBondContact O-N 3.24Å; A143-D147 VanDerWaalsContact O-CB 3.22Å; A143-D147 WeakPolarHBondContact O-CB 3.22Å; A143-D147 PolarHBondContact O-N 3.23Å
144	D	98.1	Very high	97.2	Very high	85 Å²	85	56.2 Å²	56.2	46%	0.455	28%	0.283	S	S	.	.	H	α-helix	trans	-63.2	-40.3	175.4	-69.3	-23.1	0	0	0	112.6	S140 V142 N148 R156	S140-D144 VanDerWaalsContact O-CG 3.3Å; S140-D144 PolarHBondContact O-N 3.12Å; V142-D144 VanDerWaalsContact C-N 3.29Å; V142-D144 PolarHBondContact O-N 2.84Å; D144-N148 PolarHBondContact O-N 3.35Å; D144-R156 IonicContact OD1-CZ 2.71Å; D144-R156 IonicContact OD1-NH1 3.62Å; D144-R156 PolarHBondContact OD1-NH1 3.31Å; D144-R156 IonicContact OD1-NH2 3.64Å; D144-R156 PolarHBondContact OD1-NH2 3.36Å; D144-R156 IonicContact OD2-NH1 2.71Å
145	K	98	Very high	97.3	Very high	114 Å²	114	58.3 Å²	58.3	50%	0.496	29%	0.287	S	S	.	.	H	α-helix	trans	-67.7	-35.6	176.5	-68.2	-62.4	-178.2	-171.4	0	112.7	F94 L96 A141 V142 A143	F94-K145 HydrophobicContact CD1-CB 4.24Å; F94-K145 HydrophobicContact CD2-CB 4.05Å; F94-K145 HydrophobicContact CD2-CG 3.78Å; F94-K145 HydrophobicContact CE1-CB 3.96Å; F94-K145 HydrophobicContact CE2-CB 3.72Å; F94-K145 HydrophobicContact CE2-CG 3.83Å; F94-K145 HydrophobicContact CG-CB 4.28Å; F94-K145 HydrophobicContact CG-CG 4.2Å; F94-K145 HydrophobicContact CZ-CB 3.67Å; F94-K145 HydrophobicContact CZ-CG 4.3Å; L96-K145 HydrophobicContact CD2-CG 3.94Å; A141-K145 WeakPolarHBondContact O-CG 3.43Å; A141-K145 PolarHBondContact O-N 3.29Å; V142-K145 PolarHBondContact O-N 3.09Å; V142-K145 VanDerWaalsContact O-N 3.11Å; A143-K145 PolarHBondContact O-N 3.21Å
146	L	98.3	Very high	97.4	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-75.2	-39.3	175.2	-67.4	179	0	0	0	112.1	L69 L73 I74 K111 V115 L119 V142 A143 N148 R150 L153	L69-L146 HydrophobicContact CD2-CD1 4.19Å; L73-L146 HydrophobicContact CB-CD1 4.29Å; L73-L146 HydrophobicContact CD1-CD1 4.2Å; I74-L146 HydrophobicContact CG2-CD1 4.08Å; I74-L146 HydrophobicContact CG2-CD2 4.02Å; I74-L146 HydrophobicContact CG2-CG 4.45Å; K111-L146 HydrophobicContact CG-CD2 4.44Å; V115-L146 HydrophobicContact CG1-CD2 4.44Å; V115-L146 HydrophobicContact CG2-CD2 4.41Å; L119-L146 HydrophobicContact CD1-CB 4.13Å; V142-L146 HydrophobicContact CG1-CD1 4.04Å; V142-L146 HydrophobicContact CG1-CG 4.37Å; V142-L146 PolarHBondContact O-N 2.79Å; A143-L146 PolarHBondContact O-N 3.24Å; L146-N148 VanDerWaalsContact C-N 3.34Å; L146-N148 PolarHBondContact O-N 2.69Å; L146-R150 PolarHBondContact O-NH2 2.94Å; L146-L153 HydrophobicContact CB-CD1 4.14Å
147	D	97.9	Very high	97.5	Very high	11 Å²	11	54 Å²	54	6%	0.059	26%	0.263	C	S	.	.	H	α-helix	trans	-63.8	-41	178.5	-173.9	84.7	0	0	0	111.2	A143 N149 R150 N151 I152 L153	A143-D147 VanDerWaalsContact O-CB 3.22Å; A143-D147 WeakPolarHBondContact O-CB 3.22Å; A143-D147 PolarHBondContact O-N 3.23Å; D147-N149 VanDerWaalsContact C-N 3.28Å; D147-N149 PolarHBondContact O-N 3.46Å; D147-N149 WeakPolarHBondContact OD2-CA 3.19Å; D147-N149 PolarHBondContact OD2-N 3.41Å; D147-R150 VanDerWaalsContact O-CB 3.26Å; D147-R150 WeakPolarHBondContact O-CB 3.28Å; D147-R150 VanDerWaalsContact O-CG 3.27Å; D147-R150 WeakPolarHBondContact O-CG 3.37Å; D147-R150 PolarHBondContact O-N 3.19Å; D147-R150 VanDerWaalsContact O-N 3.14Å; D147-R150 PolarHBondContact O-NE 3.46Å; D147-R150 PolarHBondContact OD2-N 3.05Å; D147-N151 PolarHBondContact OD1-N 2.87Å; D147-N151 PolarHBondContact OD2-N 3.25Å; D147-I152 VanDerWaalsContact OD1-CG1 3.3Å; D147-I152 WeakPolarHBondContact OD1-CG1 3.45Å; D147-I152 PolarHBondContact OD1-N 3.32Å; D147-L153 HydrophobicContact CB-CB 4.32Å; D147-L153 HydrophobicContact CB-CD1 4.34Å; D147-L153 HydrophobicContact CB-CG 4.4Å; D147-L153 PolarHBondContact OD1-N 3.09Å
148	N	96.4	Very high	97.7	Very high	115 Å²	115	50.7 Å²	50.7	62%	0.615	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.1	44.4	179	-168.5	41.7	0	0	0	112.6	D144 L146 R150	D144-N148 PolarHBondContact O-N 3.35Å; L146-N148 VanDerWaalsContact C-N 3.34Å; L146-N148 PolarHBondContact O-N 2.69Å; N148-R150 PolarHBondContact O-N 2.7Å
149	N	96.4	Very high	97.8	Very high	155 Å²	155	54 Å²	54	83%	0.829	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	17.5	-179	-51.5	-52	0	0	0	115.1	D147	D147-N149 VanDerWaalsContact C-N 3.28Å; D147-N149 PolarHBondContact O-N 3.46Å; D147-N149 WeakPolarHBondContact OD2-CA 3.19Å; D147-N149 PolarHBondContact OD2-N 3.41Å
150	R	96.9	Very high	97.7	Very high	83 Å²	83	58.9 Å²	58.9	31%	0.313	28%	0.28	S	S	.	.	S	Bend	trans	-77	-15.3	174.6	-65.4	179	-71.9	174.5	-3.8	112.4	L146 D147 N148 I152	L146-R150 PolarHBondContact O-NH2 2.94Å; D147-R150 VanDerWaalsContact O-CB 3.26Å; D147-R150 WeakPolarHBondContact O-CB 3.28Å; D147-R150 VanDerWaalsContact O-CG 3.27Å; D147-R150 WeakPolarHBondContact O-CG 3.37Å; D147-R150 PolarHBondContact O-N 3.19Å; D147-R150 VanDerWaalsContact O-N 3.14Å; D147-R150 PolarHBondContact O-NE 3.46Å; D147-R150 PolarHBondContact OD2-N 3.05Å; N148-R150 PolarHBondContact O-N 2.7Å; R150-I152 VanDerWaalsContact C-N 3.26Å; R150-I152 HydrophobicContact CB-CD1 4.45Å; R150-I152 HydrophobicContact CB-CG1 4.15Å; R150-I152 HydrophobicContact CB-CG2 4.05Å; R150-I152 PolarHBondContact O-N 3.05Å
151	N	97.1	Very high	97.8	Very high	96 Å²	96	61.2 Å²	61.2	51%	0.513	29%	0.287	S	S	.	.			trans	62.4	33.9	177.6	-150.1	12.6	0	0	0	112.4	D147 K154	D147-N151 PolarHBondContact OD1-N 2.87Å; D147-N151 PolarHBondContact OD2-N 3.25Å; N151-K154 VanDerWaalsContact ND2-CE 3.32Å; N151-K154 WeakPolarHBondContact ND2-CE 3.08Å; N151-K154 PolarHBondContact ND2-NZ 3.26Å; N151-K154 WeakPolarHBondContact O-CE 3.41Å; N151-K154 WeakPolarHBondContact OD1-CD 3.11Å; N151-K154 WeakPolarHBondContact OD1-CE 3.35Å; N151-K154 WeakPolarHBondContact OD1-CG 3.19Å; N151-K154 PolarHBondContact OD1-NZ 2.87Å
152	I	98.3	Very high	97.8	Very high	35 Å²	35	60.9 Å²	60.9	18%	0.179	28%	0.284	C	S	.	.			trans	-96.7	-24	-179.2	59.6	171.1	0	0	0	112.2	L119 L128 D147 R150	L119-I152 HydrophobicContact CB-CD1 4.15Å; L128-I152 HydrophobicContact CD1-CB 4.49Å; L128-I152 HydrophobicContact CD1-CD1 4.27Å; D147-I152 VanDerWaalsContact OD1-CG1 3.3Å; D147-I152 WeakPolarHBondContact OD1-CG1 3.45Å; D147-I152 PolarHBondContact OD1-N 3.32Å; R150-I152 VanDerWaalsContact C-N 3.26Å; R150-I152 HydrophobicContact CB-CD1 4.45Å; R150-I152 HydrophobicContact CB-CG1 4.15Å; R150-I152 HydrophobicContact CB-CG2 4.05Å; R150-I152 PolarHBondContact O-N 3.05Å
153	L	98.3	Very high	97.7	Very high	0 Å²	0	65 Å²	65	0%	0	31%	0.309	C	S	.	.			trans	-107.4	51.9	179.8	-58	-178	0	0	0	112	L67 L119 L128 V130 L146 D147 R156	L67-L153 HydrophobicContact CD1-CD2 4.34Å; L119-L153 HydrophobicContact CD2-CD2 4.45Å; L128-L153 HydrophobicContact CB-CD2 3.78Å; L128-L153 HydrophobicContact CD1-CD2 3.96Å; V130-L153 HydrophobicContact CG2-CB 4.03Å; V130-L153 HydrophobicContact CG2-CD1 4.06Å; V130-L153 HydrophobicContact CG2-CD2 4.1Å; V130-L153 HydrophobicContact CG2-CG 4.28Å; L146-L153 HydrophobicContact CB-CD1 4.14Å; D147-L153 HydrophobicContact CB-CB 4.32Å; D147-L153 HydrophobicContact CB-CD1 4.34Å; D147-L153 HydrophobicContact CB-CG 4.4Å; D147-L153 PolarHBondContact OD1-N 3.09Å; L153-R156 PolarHBondContact O-NE 3.38Å; L153-R156 PolarHBondContact O-NH2 2.98Å
154	K	96.8	Very high	97.5	Very high	138 Å²	138	70 Å²	70	60%	0.6	34%	0.335	S	S	*	.			trans	-75.9	-39.3	-174.7	-53.9	-165.4	-151.4	-162.7	0	114.1	N151	N151-K154 VanDerWaalsContact ND2-CE 3.32Å; N151-K154 WeakPolarHBondContact ND2-CE 3.08Å; N151-K154 PolarHBondContact ND2-NZ 3.26Å; N151-K154 WeakPolarHBondContact O-CE 3.41Å; N151-K154 WeakPolarHBondContact OD1-CD 3.11Å; N151-K154 WeakPolarHBondContact OD1-CE 3.35Å; N151-K154 WeakPolarHBondContact OD1-CG 3.19Å; N151-K154 PolarHBondContact OD1-NZ 2.87Å
155	R	98.4	Very high	97.2	Very high	66 Å²	66	69 Å²	69	25%	0.249	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	121.6	-178	-69.9	174.4	63.3	-168.6	-2.7	108.7	E127 V129 V130 V176	E127-R155 WeakPolarHBondContact OE1-CD 3.34Å; E127-R155 IonicContact OE1-CZ 3.18Å; E127-R155 IonicContact OE1-NE 3.57Å; E127-R155 IonicContact OE1-NH1 2.77Å; E127-R155 PolarHBondContact OE1-NH1 2.85Å; E127-R155 IonicContact OE2-NH1 3.68Å; V129-R155 WeakPolarHBondContact CA-O 3.48Å; V129-R155 HydrophobicContact CG1-CB 4.33Å; V129-R155 HydrophobicContact CG2-CB 3.97Å; V130-R155 PolarHBondContact N-O 3.3Å; R155-V176 PolarHBondContact NH2-O 3.33Å
156	R	98.6	Very high	96.6	Very high	53 Å²	53	70.8 Å²	70.8	20%	0.2	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	131.8	-170.5	-52.4	-177.6	-177.7	174.2	-2.6	110.4	V130 S140 D144 L153 Y158	V130-R156 HydrophobicContact CB-CB 4.28Å; V130-R156 HydrophobicContact CB-CG 4.11Å; V130-R156 HydrophobicContact CG2-CG 4.41Å; V130-R156 CarbonylContact O-C 3.46Å; V130-R156 VanDerWaalsContact O-CA 3.32Å; V130-R156 WeakPolarHBondContact O-CA 3.2Å; S140-R156 PolarHBondContact O-NH1 2.62Å; D144-R156 IonicContact OD1-CZ 2.71Å; D144-R156 IonicContact OD1-NH1 3.62Å; D144-R156 PolarHBondContact OD1-NH1 3.31Å; D144-R156 IonicContact OD1-NH2 3.64Å; D144-R156 PolarHBondContact OD1-NH2 3.36Å; D144-R156 IonicContact OD2-NH1 2.71Å; L153-R156 PolarHBondContact O-NE 3.38Å; L153-R156 PolarHBondContact O-NH2 2.98Å; R156-Y158 HydrophobicContact CB-CE1 4.2Å; R156-Y158 HydrophobicContact CB-CE2 4Å; R156-Y158 WeakPolarHBondContact CB-OH 3.3Å; R156-Y158 WeakPolarHBondContact CD-OH 3.48Å
157	Y	98.7	Very high	96	Very high	41 Å²	41	74.1 Å²	74.1	16%	0.161	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	133.7	176.4	-59.5	-99.6	0	0	0	107.9	V129 V130 F131 T132 H161 V175 V176	V129-Y157 HydrophobicContact CG1-CD2 3.59Å; V129-Y157 HydrophobicContact CG1-CE2 3.6Å; V130-Y157 PolarHBondContact O-N 3.2Å; F131-Y157 CarbonylContact C-O 3.19Å; F131-Y157 VanDerWaalsContact CA-O 3.3Å; F131-Y157 WeakPolarHBondContact CA-O 3.49Å; F131-Y157 VanDerWaalsContact CD2-CB 3.43Å; F131-Y157 HydrophobicContact CG-CG 4.46Å; T132-Y157 PolarHBondContact N-O 2.94Å; Y157-H161 HydrophobicContact CD1-CB 4.15Å; Y157-V175 HydrophobicContact CD1-CG2 4.1Å; Y157-V175 HydrophobicContact CE1-CG2 3.92Å; Y157-V175 PolarHBondContact OH-O 3.26Å; Y157-V175 VanDerWaalsContact OH-O 3.09Å; Y157-V176 HydrophobicContact CD2-CG2 4.32Å; Y157-V176 HydrophobicContact CE2-CG2 3.99Å
158	Y	98.4	Very high	95.6	Very high	10 Å²	10	75.3 Å²	75.3	4%	0.039	39%	0.388	C	S	.	.			trans	-119.8	-177.8	-175.3	-52.7	-68.5	0	0	0	111	T132 E136 S140 R156 Q160 H161	T132-Y158 HydrophobicContact CG2-CD1 3.72Å; T132-Y158 HydrophobicContact CG2-CE1 4.38Å; T132-Y158 CarbonylContact O-C 3.56Å; T132-Y158 VanDerWaalsContact O-CA 3.3Å; T132-Y158 WeakPolarHBondContact O-CA 3.44Å; E136-Y158 HydrophobicContact CB-CD1 4.27Å; E136-Y158 HydrophobicContact CB-CD2 3.49Å; E136-Y158 VanDerWaalsContact CB-CD2 3.49Å; E136-Y158 HydrophobicContact CB-CE2 3.98Å; E136-Y158 HydrophobicContact CB-CG 3.64Å; E136-Y158 HydrophobicContact CG-CD2 3.47Å; E136-Y158 VanDerWaalsContact CG-CD2 3.47Å; E136-Y158 HydrophobicContact CG-CE2 3.43Å; E136-Y158 VanDerWaalsContact CG-CE2 3.43Å; E136-Y158 HydrophobicContact CG-CG 4.08Å; S140-Y158 WeakPolarHBondContact CA-OH 3.47Å; S140-Y158 VanDerWaalsContact CB-OH 3.25Å; S140-Y158 WeakPolarHBondContact CB-OH 3.33Å; R156-Y158 HydrophobicContact CB-CE1 4.2Å; R156-Y158 HydrophobicContact CB-CE2 4Å; R156-Y158 WeakPolarHBondContact CB-OH 3.3Å; R156-Y158 WeakPolarHBondContact CD-OH 3.48Å; Y158-Q160 VanDerWaalsContact CB-OE1 3.31Å; Y158-Q160 PolarHBondContact O-N 3.19Å; Y158-H161 PolarHBondContact N-ND1 2.87Å; Y158-H161 WeakPolarHBondContact O-CB 3.22Å; Y158-H161 PolarHBondContact O-N 2.73Å; Y158-H161 PolarHBondContact O-ND1 2.75Å
159	R	97.6	Very high	95.6	Very high	81 Å²	81	73.8 Å²	73.8	31%	0.306	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-43.7	-42.1	-178.8	-174.1	174.5	-66.2	160.1	1.5	115	T132 A133 S134 M135 H161 C162 Y169	T132-R159 PolarHBondContact O-N 3.45Å; A133-R159 WeakPolarHBondContact O-CB 3.42Å; A133-R159 VanDerWaalsContact O-CZ 3.3Å; A133-R159 PolarHBondContact O-NE 3.31Å; A133-R159 PolarHBondContact O-NH2 2.76Å; S134-R159 WeakPolarHBondContact O-CB 3.36Å; S134-R159 PolarHBondContact O-N 2.84Å; M135-R159 VanDerWaalsContact CG-NH1 3.3Å; M135-R159 HydrophobicContact SD-CB 4.39Å; M135-R159 PolarHBondContact SD-NH1 2.94Å; R159-H161 PolarHBondContact O-N 3.35Å; R159-H161 VanDerWaalsContact O-N 3.17Å; R159-C162 WeakPolarHBondContact O-CB 3.44Å; R159-C162 PolarHBondContact O-N 2.71Å; R159-Y169 HydrophobicContact CG-CD1 4.02Å; R159-Y169 HydrophobicContact CG-CE1 3.52Å; R159-Y169 HydrophobicContact CG-CE2 4.48Å
160	Q	97.1	Very high	95.7	Very high	102 Å²	102	67 Å²	67	48%	0.477	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-65.7	-15.3	-178.9	69.2	-88.4	18.9	0	0	114.3	E136 Y158	E136-Q160 PolarHBondContact OE2-NE2 3.29Å; Y158-Q160 VanDerWaalsContact CB-OE1 3.31Å; Y158-Q160 PolarHBondContact O-N 3.19Å
161	H	97.9	Very high	95.7	Very high	77 Å²	77	63 Å²	63	36%	0.356	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-95.5	-6.3	175.7	-48.6	90.7	0	0	0	112.3	F131 Y157 Y158 R159	F131-H161 HydrophobicContact CE2-CB 4.23Å; F131-H161 HydrophobicContact CZ-CB 4.38Å; Y157-H161 HydrophobicContact CD1-CB 4.15Å; Y158-H161 PolarHBondContact N-ND1 2.87Å; Y158-H161 WeakPolarHBondContact O-CB 3.22Å; Y158-H161 PolarHBondContact O-N 2.73Å; Y158-H161 PolarHBondContact O-ND1 2.75Å; R159-H161 PolarHBondContact O-N 3.35Å; R159-H161 VanDerWaalsContact O-N 3.17Å
162	C	97.8	Very high	95.7	Very high	17 Å²	17	60.8 Å²	60.8	12%	0.115	31%	0.31	C	S	.	.	S	Bend	trans	-82.7	151.8	173.9	-60.6	0	0	0	0	110.5	R159 Y169 I170	R159-C162 WeakPolarHBondContact O-CB 3.44Å; R159-C162 PolarHBondContact O-N 2.71Å; C162-Y169 HydrophobicContact CB-CD1 3.8Å; C162-Y169 HydrophobicContact CB-CG 4.27Å; C162-I170 CarbonylContact C-O 3.58Å; C162-I170 VanDerWaalsContact CA-O 3.26Å; C162-I170 WeakPolarHBondContact CA-O 3.19Å; C162-I170 WeakPolarHBondContact CB-O 3.01Å
163	T	96.6	Very high	95.7	Very high	85 Å²	85	59.1 Å²	59.1	52%	0.521	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	123.1	165.9	-62.6	0	0	0	0	109.1	D165 I170	T163-D165 PolarHBondContact O-N 3.26Å; T163-I170 PolarHBondContact N-O 3.48Å; T163-I170 PolarHBondContact O-N 2.91Å
164	L	94.8	Very high	95.6	Very high	107 Å²	107	61.6 Å²	61.6	56%	0.56	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	114.6	174.7	-179.1	65.3	0	0	0	109.4	Y169	L164-Y169 HydrophobicContact CB-CD1 4.43Å; L164-Y169 HydrophobicContact CB-CE1 4.29Å; L164-Y169 HydrophobicContact CD1-CD1 4.17Å; L164-Y169 HydrophobicContact CD1-CE1 3.95Å; L164-Y169 HydrophobicContact CD1-CE2 4.36Å; L164-Y169 HydrophobicContact CD1-CG 4.48Å
165	D	89.9	Confident	95.6	Very high	63 Å²	63	58.3 Å²	58.3	34%	0.337	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	127.9	179.7	176	47.7	0	0	0	110.7	T163 G167 S168 I170 R194	T163-D165 PolarHBondContact O-N 3.26Å; D165-G167 PolarHBondContact O-N 2.99Å; D165-G167 VanDerWaalsContact O-N 3.12Å; D165-S168 PolarHBondContact N-O 3.08Å; D165-S168 WeakPolarHBondContact O-CB 3.25Å; D165-S168 PolarHBondContact O-N 2.82Å; D165-S168 VanDerWaalsContact O-O 3.12Å; D165-I170 HydrophobicContact CB-CD1 3.58Å; D165-I170 HydrophobicContact CB-CG1 4.23Å; D165-R194 IonicContact OD2-NH1 3.18Å; D165-R194 PolarHBondContact OD2-NH1 3.28Å
166	L	85.8	Confident	95.6	Very high	151 Å²	151	55.6 Å²	55.6	79%	0.791	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	40.1	-178.3	-58.9	173.8	0	0	0	113.5	S168	L166-S168 PolarHBondContact O-N 2.72Å
167	G	86.2	Confident	95.5	Very high	70 Å²	70	56.8 Å²	56.8	72%	0.722	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	5.8	-179.2	0	0	0	0	0	115.2	D165	D165-G167 PolarHBondContact O-N 2.99Å; D165-G167 VanDerWaalsContact O-N 3.12Å
168	S	89.8	Confident	95.3	Very high	37 Å²	37	62.2 Å²	62.2	26%	0.259	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	142.5	175.2	-59.4	0	0	0	0	110.7	D165 L166	D165-S168 PolarHBondContact N-O 3.08Å; D165-S168 WeakPolarHBondContact O-CB 3.25Å; D165-S168 PolarHBondContact O-N 2.82Å; D165-S168 VanDerWaalsContact O-O 3.12Å; L166-S168 PolarHBondContact O-N 2.72Å
169	Y	96.9	Very high	95.2	Very high	83 Å²	83	63.5 Å²	63.5	33%	0.325	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	110.1	171.6	-71.8	-76.7	0	0	0	109.6	A133 R159 C162 L164 A192	A133-Y169 HydrophobicContact CB-CD2 4.14Å; A133-Y169 HydrophobicContact CB-CG 4.11Å; R159-Y169 HydrophobicContact CG-CD1 4.02Å; R159-Y169 HydrophobicContact CG-CE1 3.52Å; R159-Y169 HydrophobicContact CG-CE2 4.48Å; C162-Y169 HydrophobicContact CB-CD1 3.8Å; C162-Y169 HydrophobicContact CB-CG 4.27Å; L164-Y169 HydrophobicContact CB-CD1 4.43Å; L164-Y169 HydrophobicContact CB-CE1 4.29Å; L164-Y169 HydrophobicContact CD1-CD1 4.17Å; L164-Y169 HydrophobicContact CD1-CE1 3.95Å; L164-Y169 HydrophobicContact CD1-CE2 4.36Å; L164-Y169 HydrophobicContact CD1-CG 4.48Å; Y169-A192 WeakPolarHBondContact O-CA 3.32Å
170	I	97.5	Very high	95.2	Very high	11 Å²	11	61.4 Å²	61.4	6%	0.056	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	133.1	177.8	-54.9	-176.7	0	0	0	109.7	C162 T163 D165 S195	C162-I170 CarbonylContact C-O 3.58Å; C162-I170 VanDerWaalsContact CA-O 3.26Å; C162-I170 WeakPolarHBondContact CA-O 3.19Å; C162-I170 WeakPolarHBondContact CB-O 3.01Å; T163-I170 PolarHBondContact N-O 3.48Å; T163-I170 PolarHBondContact O-N 2.91Å; D165-I170 HydrophobicContact CB-CD1 3.58Å; D165-I170 HydrophobicContact CB-CG1 4.23Å; I170-S195 WeakPolarHBondContact CG2-OG 3.38Å
171	K	98.1	Very high	95.2	Very high	1 Å²	1	57.5 Å²	57.5	0%	0.004	33%	0.327	C	S	.	.			trans	-100.9	97.3	178	-60.2	177.2	-174.5	176.8	0	108.7	D68 F131 L173 I185 D187 A192	D68-K171 IonicContact OD1-NZ 3.76Å; D68-K171 PolarHBondContact OD1-NZ 3.31Å; F131-K171 HydrophobicContact CB-CD 4.3Å; F131-K171 HydrophobicContact CD1-CB 3.85Å; F131-K171 HydrophobicContact CD1-CD 4.37Å; F131-K171 HydrophobicContact CD1-CG 4.26Å; F131-K171 HydrophobicContact CD2-CB 4.3Å; F131-K171 HydrophobicContact CD2-CD 3.97Å; F131-K171 HydrophobicContact CD2-CG 3.86Å; F131-K171 HydrophobicContact CE1-CB 3.63Å; F131-K171 HydrophobicContact CE1-CG 4.24Å; F131-K171 HydrophobicContact CE2-CB 4.12Å; F131-K171 HydrophobicContact CE2-CD 4.46Å; F131-K171 HydrophobicContact CE2-CG 3.84Å; F131-K171 HydrophobicContact CG-CB 4.19Å; F131-K171 HydrophobicContact CG-CD 3.93Å; F131-K171 HydrophobicContact CG-CG 4.09Å; F131-K171 HydrophobicContact CZ-CB 3.78Å; F131-K171 HydrophobicContact CZ-CG 4.04Å; F131-K171 VanDerWaalsContact O-CE 3.27Å; F131-K171 WeakPolarHBondContact O-CE 3.35Å; F131-K171 PolarHBondContact O-NZ 3.48Å; K171-L173 PolarHBondContact O-N 2.79Å; K171-I185 HydrophobicContact CB-CD1 4.29Å; K171-I185 HydrophobicContact CD-CD1 3.93Å; K171-D187 WeakPolarHBondContact CE-OD2 3.26Å; K171-D187 IonicContact NZ-OD2 3.13Å; K171-D187 PolarHBondContact NZ-OD2 2.91Å; K171-A192 WeakPolarHBondContact CB-O 3.38Å; K171-A192 HydrophobicContact CD-CB 4.07Å; K171-A192 HydrophobicContact CG-CB 4.32Å; K171-A192 PolarHBondContact N-O 3.11Å
172	D	97.1	Very high	95.2	Very high	49 Å²	49	54 Å²	54	26%	0.262	31%	0.311	S	S	.	.			trans	-73.5	115.9	175.3	-174.7	-2.4	0	0	0	110	S174 V175 H196	D172-S174 VanDerWaalsContact C-N 3.26Å; D172-S174 PolarHBondContact O-N 2.76Å; D172-S174 WeakPolarHBondContact OD1-CB 3.5Å; D172-S174 PolarHBondContact OD1-N 3.39Å; D172-S174 PolarHBondContact OD1-OG 2.74Å; D172-S174 PolarHBondContact OD2-OG 2.76Å; D172-V175 HydrophobicContact CB-CG1 4.29Å; D172-V175 WeakPolarHBondContact O-CG2 3.06Å; D172-V175 PolarHBondContact O-N 2.6Å; D172-H196 IonicContact OD1-CD2 2.71Å; D172-H196 IonicContact OD1-CE1 3.88Å; D172-H196 IonicContact OD1-NE2 2.75Å; D172-H196 PolarHBondContact OD1-NE2 3.28Å
173	L	98.2	Very high	95.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-73	-18.2	-178	-61.3	-175.4	0	0	0	113.1	V66 K171 V175 V176 H177 L180 I183 I185 H196 N199	V66-L173 HydrophobicContact CG1-CD2 4.47Å; V66-L173 HydrophobicContact CG2-CD2 4.23Å; K171-L173 PolarHBondContact O-N 2.79Å; L173-V175 PolarHBondContact O-N 2.92Å; L173-V176 WeakPolarHBondContact O-CB 3.3Å; L173-V176 PolarHBondContact O-N 3.08Å; L173-H177 PolarHBondContact O-N 3.05Å; L173-L180 HydrophobicContact CB-CD2 3.86Å; L173-I183 HydrophobicContact CB-CD1 4.34Å; L173-I183 HydrophobicContact CB-CG2 4.42Å; L173-I183 HydrophobicContact CD1-CG2 4.01Å; L173-I183 HydrophobicContact CD2-CG2 4.32Å; L173-I183 HydrophobicContact CG-CG2 4.49Å; L173-I185 HydrophobicContact CD1-CB 4.29Å; L173-I185 HydrophobicContact CD1-CG2 4Å; L173-I185 HydrophobicContact CD2-CB 4.12Å; L173-I185 HydrophobicContact CD2-CD1 4.09Å; L173-I185 HydrophobicContact CD2-CG2 4.5Å; L173-H196 HydrophobicContact CD1-CB 3.72Å; L173-H196 HydrophobicContact CG-CB 4.1Å; L173-H196 PolarHBondContact N-CD2 3.01Å; L173-H196 VanDerWaalsContact N-CD2 3.26Å; L173-H196 PolarHBondContact N-NE2 3.14Å; L173-N199 HydrophobicContact CD1-CB 3.58Å
174	S	96.6	Very high	95.3	Very high	52 Å²	52	49.2 Å²	49.2	36%	0.364	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-62.4	-27.8	177	72.2	0	0	0	0	112.5	D172 V176	D172-S174 VanDerWaalsContact C-N 3.26Å; D172-S174 PolarHBondContact O-N 2.76Å; D172-S174 WeakPolarHBondContact OD1-CB 3.5Å; D172-S174 PolarHBondContact OD1-N 3.39Å; D172-S174 PolarHBondContact OD1-OG 2.74Å; D172-S174 PolarHBondContact OD2-OG 2.76Å; S174-V176 PolarHBondContact O-N 2.78Å
175	V	96.3	Very high	95.5	Very high	69 Å²	69	44.1 Å²	44.1	42%	0.418	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-72.8	-16.8	176	-44.9	0	0	0	0	112.6	F131 Y157 D172 L173	F131-V175 HydrophobicContact CE1-CG2 4.13Å; F131-V175 HydrophobicContact CZ-CG2 4.43Å; Y157-V175 HydrophobicContact CD1-CG2 4.1Å; Y157-V175 HydrophobicContact CE1-CG2 3.92Å; Y157-V175 PolarHBondContact OH-O 3.26Å; Y157-V175 VanDerWaalsContact OH-O 3.09Å; D172-V175 HydrophobicContact CB-CG1 4.29Å; D172-V175 WeakPolarHBondContact O-CG2 3.06Å; D172-V175 PolarHBondContact O-N 2.6Å; L173-V175 PolarHBondContact O-N 2.92Å
176	V	97.4	Very high	95.9	Very high	8 Å²	8	41.1 Å²	41.1	5%	0.048	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-48.7	177.5	-178.7	0	0	0	0	109.4	I64 V66 V129 F131 R155 Y157 L173 S174 I183	I64-V176 HydrophobicContact CG2-CG1 4.1Å; V66-V176 HydrophobicContact CG2-CG1 4.16Å; V66-V176 HydrophobicContact CG2-CG2 4.38Å; V129-V176 HydrophobicContact CB-CG1 4.49Å; V129-V176 HydrophobicContact CG1-CG1 4.18Å; V129-V176 HydrophobicContact CG2-CG1 4.07Å; F131-V176 HydrophobicContact CD1-CG2 4.09Å; F131-V176 HydrophobicContact CE1-CG2 4.3Å; R155-V176 PolarHBondContact NH2-O 3.33Å; Y157-V176 HydrophobicContact CD2-CG2 4.32Å; Y157-V176 HydrophobicContact CE2-CG2 3.99Å; L173-V176 WeakPolarHBondContact O-CB 3.3Å; L173-V176 PolarHBondContact O-N 3.08Å; S174-V176 PolarHBondContact O-N 2.78Å; V176-I183 HydrophobicContact CB-CD1 4.48Å
177	H	97.1	Very high	96.5	Very high	79 Å²	79	34 Å²	34	37%	0.366	20%	0.201	S	C	.	.			trans	-164.2	147.1	179.1	-169.3	-89	0	0	0	110.7	I64 L173 D179 I183	I64-H177 HydrophobicContact CD1-CB 3.62Å; L173-H177 PolarHBondContact O-N 3.05Å; H177-D179 WeakPolarHBondContact CE1-CB 3.32Å; H177-D179 VanDerWaalsContact ND1-CB 3.35Å; H177-D179 WeakPolarHBondContact ND1-CB 3.01Å; H177-D179 PolarHBondContact ND1-N 2.7Å; H177-D179 PolarHBondContact O-N 3.13Å; H177-I183 HydrophobicContact CB-CD1 3.69Å; H177-I183 HydrophobicContact CB-CG1 4.26Å; H177-I183 WeakPolarHBondContact O-CD1 3.3Å
178	D	94.9	Very high	97	Very high	154 Å²	154	31.9 Å²	31.9	82%	0.824	17%	0.173	S	C	*	.	S	Bend	trans	-69.4	-33.8	-177.6	-60.2	-34.9	0	0	0	113	L180	D178-L180 PolarHBondContact O-N 3.31Å; D178-L180 VanDerWaalsContact O-N 3.12Å
179	D	96.4	Very high	97.2	Very high	38 Å²	38	32.5 Å²	32.5	20%	0.203	18%	0.178	C	C	.	.			trans	-82.8	84	-179.6	-170.1	-1.5	0	0	0	112.2	K61 H177 S181 S182	K61-D179 IonicContact NZ-OD2 2.6Å; K61-D179 PolarHBondContact NZ-OD2 3.47Å; H177-D179 WeakPolarHBondContact CE1-CB 3.32Å; H177-D179 VanDerWaalsContact ND1-CB 3.35Å; H177-D179 WeakPolarHBondContact ND1-CB 3.01Å; H177-D179 PolarHBondContact ND1-N 2.7Å; H177-D179 PolarHBondContact O-N 3.13Å; D179-S181 PolarHBondContact O-N 2.91Å; D179-S181 VanDerWaalsContact O-N 3.16Å; D179-S181 VanDerWaalsContact OD1-CB 3.25Å; D179-S181 WeakPolarHBondContact OD1-CB 3.12Å; D179-S181 PolarHBondContact OD1-N 2.86Å; D179-S181 PolarHBondContact OD1-OG 3.29Å; D179-S182 PolarHBondContact O-N 3.37Å; D179-S182 VanDerWaalsContact O-N 3.1Å
180	L	97.5	Very high	97	Very high	36 Å²	36	30.5 Å²	30.5	19%	0.188	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-61.6	-18.2	176.4	-64.1	179.9	0	0	0	113.6	L173 D178 S182 I183 N199	L173-L180 HydrophobicContact CB-CD2 3.86Å; D178-L180 PolarHBondContact O-N 3.31Å; D178-L180 VanDerWaalsContact O-N 3.12Å; L180-S182 PolarHBondContact O-N 2.79Å; L180-S182 VanDerWaalsContact O-N 3.08Å; L180-I183 HydrophobicContact CD2-CD1 3.95Å; L180-I183 PolarHBondContact O-N 3.25Å; L180-N199 PolarHBondContact O-ND2 2.89Å
181	S	97.6	Very high	96.8	Very high	20 Å²	20	30.4 Å²	30.4	14%	0.14	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-65	-13.1	175.3	82	0	0	0	0	112.6	K63 D179 D230 V231	K63-S181 PolarHBondContact NZ-O 3.4Å; D179-S181 PolarHBondContact O-N 2.91Å; D179-S181 VanDerWaalsContact O-N 3.16Å; D179-S181 VanDerWaalsContact OD1-CB 3.25Å; D179-S181 WeakPolarHBondContact OD1-CB 3.12Å; D179-S181 PolarHBondContact OD1-N 2.86Å; D179-S181 PolarHBondContact OD1-OG 3.29Å; S181-D230 WeakPolarHBondContact CA-OD1 3.48Å; S181-D230 VanDerWaalsContact CB-CG 3.47Å; S181-D230 WeakPolarHBondContact O-CA 3.2Å; S181-V231 PolarHBondContact O-N 2.89Å
182	S	97.1	Very high	96.7	Very high	5 Å²	5	30.6 Å²	30.6	4%	0.035	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-118.7	8.1	-174.3	-65.1	0	0	0	0	115	K63 I64 D179 L180	K63-S182 CarbonylContact C-O 3.59Å; K63-S182 WeakPolarHBondContact CA-O 3.41Å; K63-S182 WeakPolarHBondContact CB-O 3.21Å; K63-S182 WeakPolarHBondContact CD-OG 3.37Å; I64-S182 PolarHBondContact N-O 3.01Å; D179-S182 PolarHBondContact O-N 3.37Å; D179-S182 VanDerWaalsContact O-N 3.1Å; L180-S182 PolarHBondContact O-N 2.79Å; L180-S182 VanDerWaalsContact O-N 3.08Å
183	I	98.3	Very high	96.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	134	-179.4	-50.9	178.5	0	0	0	110.2	I64 V66 L173 V176 H177 L180 N199 V231	I64-I183 HydrophobicContact CB-CG1 4.45Å; I64-I183 HydrophobicContact CD1-CG1 4.46Å; I64-I183 WeakPolarHBondContact O-CA 3.22Å; V66-I183 HydrophobicContact CG2-CG2 3.72Å; L173-I183 HydrophobicContact CB-CD1 4.34Å; L173-I183 HydrophobicContact CB-CG2 4.42Å; L173-I183 HydrophobicContact CD1-CG2 4.01Å; L173-I183 HydrophobicContact CD2-CG2 4.32Å; L173-I183 HydrophobicContact CG-CG2 4.49Å; V176-I183 HydrophobicContact CB-CD1 4.48Å; H177-I183 HydrophobicContact CB-CD1 3.69Å; H177-I183 HydrophobicContact CB-CG1 4.26Å; H177-I183 WeakPolarHBondContact O-CD1 3.3Å; L180-I183 HydrophobicContact CD2-CD1 3.95Å; L180-I183 PolarHBondContact O-N 3.25Å; I183-N199 PolarHBondContact O-ND2 2.62Å; I183-V231 WeakPolarHBondContact O-CG2 3.22Å
184	V	98.4	Very high	96.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	132.1	171.5	-178.7	0	0	0	0	108.1	I64 L65 V66 N199 I201 L225 V231 L235	I64-V184 PolarHBondContact O-N 2.82Å; L65-V184 CarbonylContact C-O 3.55Å; L65-V184 WeakPolarHBondContact CA-O 3.36Å; L65-V184 HydrophobicContact CD1-CB 4.04Å; L65-V184 HydrophobicContact CD1-CG1 3.95Å; V66-V184 PolarHBondContact N-O 3.49Å; V184-N199 CarbonylContact C-O 3.58Å; V184-N199 WeakPolarHBondContact CA-O 3.46Å; V184-I201 HydrophobicContact CG1-CD1 3.35Å; V184-I201 HydrophobicContact CG1-CG1 3.71Å; V184-L225 HydrophobicContact CG2-CD1 4.17Å; V184-V231 HydrophobicContact CG2-CB 3.94Å; V184-V231 HydrophobicContact CG2-CG1 3.85Å; V184-V231 HydrophobicContact CG2-CG2 3.89Å; V184-L235 HydrophobicContact CG1-CD1 4.04Å; V184-L235 HydrophobicContact CG2-CD1 4.16Å
185	I	98.5	Very high	96.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	130.1	172.3	-176	169.4	0	0	0	111	V66 K171 L173 D187 Y193 N199 A200 I201	V66-I185 HydrophobicContact CB-CB 4.14Å; V66-I185 HydrophobicContact CB-CG1 4.16Å; V66-I185 HydrophobicContact CG1-CB 4.5Å; V66-I185 HydrophobicContact CG1-CD1 4.17Å; V66-I185 HydrophobicContact CG1-CG1 4.05Å; V66-I185 WeakPolarHBondContact O-CA 3.4Å; K171-I185 HydrophobicContact CB-CD1 4.29Å; K171-I185 HydrophobicContact CD-CD1 3.93Å; L173-I185 HydrophobicContact CD1-CB 4.29Å; L173-I185 HydrophobicContact CD1-CG2 4Å; L173-I185 HydrophobicContact CD2-CB 4.12Å; L173-I185 HydrophobicContact CD2-CD1 4.09Å; L173-I185 HydrophobicContact CD2-CG2 4.5Å; I185-D187 HydrophobicContact CD1-CB 4.35Å; I185-D187 HydrophobicContact CG1-CB 4.17Å; I185-Y193 HydrophobicContact CG2-CG 4.43Å; I185-N199 PolarHBondContact N-O 3.42Å; I185-A200 HydrophobicContact CG2-CB 3.77Å; I185-A200 CarbonylContact O-C 3.59Å; I185-A200 WeakPolarHBondContact O-CA 3.48Å; I185-I201 PolarHBondContact O-N 3.15Å
186	L	98.6	Very high	96.2	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	113.3	171.9	179.2	63.8	0	0	0	109.1	L65 V66 L67 D68 T72 F118 I201 I203 L215 L218	L65-L186 HydrophobicContact CD1-CB 4.45Å; V66-L186 PolarHBondContact O-N 3.17Å; L67-L186 HydrophobicContact CD2-CB 4.16Å; L67-L186 HydrophobicContact CD2-CD2 3.98Å; D68-L186 PolarHBondContact N-O 3.18Å; D68-L186 VanDerWaalsContact N-O 3.08Å; T72-L186 HydrophobicContact CG2-CD2 4.38Å; T72-L186 HydrophobicContact CG2-CG 4.12Å; F118-L186 HydrophobicContact CE1-CD2 4.36Å; F118-L186 HydrophobicContact CZ-CD2 3.93Å; L186-I201 HydrophobicContact CD1-CB 4.05Å; L186-I201 HydrophobicContact CD1-CG2 3.81Å; L186-I201 WeakPolarHBondContact CD1-O 3.45Å; L186-I203 HydrophobicContact CD1-CB 3.7Å; L186-I203 HydrophobicContact CD1-CD1 4.13Å; L186-I203 HydrophobicContact CD1-CG1 4.46Å; L186-I203 HydrophobicContact CD1-CG2 3.74Å; L186-I203 HydrophobicContact CD2-CD1 4.48Å; L186-I203 HydrophobicContact CG-CG2 4.17Å; L186-L215 HydrophobicContact CD2-CD2 4.15Å; L186-L218 HydrophobicContact CD1-CD1 3.52Å; L186-L218 HydrophobicContact CD2-CD1 3.99Å; L186-L218 HydrophobicContact CG-CD1 4.43Å
187	D	98	Very high	96.1	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.011	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	143	-173	-161.6	-52.6	0	0	0	110.7	D68 K171 I185 S189 A192 Y193 I201 I203	D68-D187 HydrophobicContact CB-CB 4.17Å; K171-D187 WeakPolarHBondContact CE-OD2 3.26Å; K171-D187 IonicContact NZ-OD2 3.13Å; K171-D187 PolarHBondContact NZ-OD2 2.91Å; I185-D187 HydrophobicContact CD1-CB 4.35Å; I185-D187 HydrophobicContact CG1-CB 4.17Å; D187-S189 WeakPolarHBondContact OD1-CB 3.38Å; D187-S189 PolarHBondContact OD1-N 2.89Å; D187-A192 VanDerWaalsContact OD2-CB 3.23Å; D187-A192 WeakPolarHBondContact OD2-CB 3.41Å; D187-Y193 HydrophobicContact CB-CD1 3.79Å; D187-Y193 HydrophobicContact CB-CE1 3.99Å; D187-I201 PolarHBondContact N-O 2.84Å; D187-I203 PolarHBondContact O-N 3.35Å
188	N	96.4	Very high	96	Very high	25 Å²	25	33.3 Å²	33.3	13%	0.134	19%	0.187	C	C	.	.	S	Bend	trans	-86.7	-8.8	179.1	72.8	-81.6	0	0	0	114.2	D68 D70 T72 I203 S205	D68-N188 PolarHBondContact OD2-OD1 2.99Å; D70-N188 PolarHBondContact O-OD1 3.43Å; T72-N188 PolarHBondContact OG1-N 2.88Å; T72-N188 PolarHBondContact OG1-OD1 3.3Å; N188-I203 WeakPolarHBondContact CA-O 3.31Å; N188-I203 HydrophobicContact CB-CG2 4.14Å; N188-I203 WeakPolarHBondContact CB-O 3.32Å; N188-S205 PolarHBondContact ND2-OG 3.46Å
189	S	94.4	Very high	96.1	Very high	50 Å²	50	26.1 Å²	26.1	35%	0.35	15%	0.149	S	C	.	.			trans	-109.5	111.4	-177.3	-177.8	0	0	0	0	111.4	D187 G191 A192 Y193	D187-S189 WeakPolarHBondContact OD1-CB 3.38Å; D187-S189 PolarHBondContact OD1-N 2.89Å; S189-G191 PolarHBondContact O-N 3.02Å; S189-G191 VanDerWaalsContact O-N 3.13Å; S189-A192 WeakPolarHBondContact O-CB 3.42Å; S189-A192 PolarHBondContact O-N 3.5Å; S189-Y193 WeakPolarHBondContact O-CD1 3.36Å; S189-Y193 VanDerWaalsContact O-CE1 3.25Å; S189-Y193 WeakPolarHBondContact O-CE1 3.23Å
190	P	93.3	Very high	96.1	Very high	40 Å²	40	24.5 Å²	24.5	26%	0.26	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-28.2	174.7	-25.3	33.9	0	0	0	114.8	A192 Y193 R194 W245	P190-A192 VanDerWaalsContact C-N 3.25Å; P190-A192 PolarHBondContact O-N 3.34Å; P190-Y193 VanDerWaalsContact CA-CZ 3.41Å; P190-Y193 WeakPolarHBondContact CA-OH 3.34Å; P190-Y193 HydrophobicContact CB-CE2 4.26Å; P190-R194 PolarHBondContact O-N 2.91Å; P190-W245 WeakPolarHBondContact CG-O 3.4Å
191	G	93.6	Very high	96	Very high	9 Å²	9	23 Å²	23	9%	0.093	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-31.3	174.3	0	0	0	0	0	113	S189	S189-G191 PolarHBondContact O-N 3.02Å; S189-G191 VanDerWaalsContact O-N 3.13Å
192	A	96.1	Very high	95.9	Very high	5 Å²	5	23.2 Å²	23.2	4%	0.041	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-37.3	-175.5	0	0	0	0	0	112.8	Y169 K171 D187 S189 P190	Y169-A192 WeakPolarHBondContact O-CA 3.32Å; K171-A192 WeakPolarHBondContact CB-O 3.38Å; K171-A192 HydrophobicContact CD-CB 4.07Å; K171-A192 HydrophobicContact CG-CB 4.32Å; K171-A192 PolarHBondContact N-O 3.11Å; D187-A192 VanDerWaalsContact OD2-CB 3.23Å; D187-A192 WeakPolarHBondContact OD2-CB 3.41Å; S189-A192 WeakPolarHBondContact O-CB 3.42Å; S189-A192 PolarHBondContact O-N 3.5Å; P190-A192 VanDerWaalsContact C-N 3.25Å; P190-A192 PolarHBondContact O-N 3.34Å
193	Y	94.9	Very high	95.8	Very high	5 Å²	5	23.5 Å²	23.5	2%	0.02	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	20.9	179.1	51.8	-101.4	0	0	0	113.2	I185 D187 S189 P190 S195 H196 A200 H242	I185-Y193 HydrophobicContact CG2-CG 4.43Å; D187-Y193 HydrophobicContact CB-CD1 3.79Å; D187-Y193 HydrophobicContact CB-CE1 3.99Å; S189-Y193 WeakPolarHBondContact O-CD1 3.36Å; S189-Y193 VanDerWaalsContact O-CE1 3.25Å; S189-Y193 WeakPolarHBondContact O-CE1 3.23Å; P190-Y193 VanDerWaalsContact CA-CZ 3.41Å; P190-Y193 WeakPolarHBondContact CA-OH 3.34Å; P190-Y193 HydrophobicContact CB-CE2 4.26Å; Y193-S195 PolarHBondContact O-N 2.82Å; Y193-S195 VanDerWaalsContact O-N 3.09Å; Y193-H196 CarbonylContact O-C 3.21Å; Y193-H196 PolarHBondContact O-N 3.2Å; Y193-A200 HydrophobicContact CD1-CB 3.87Å; Y193-A200 HydrophobicContact CD2-CB 3.34Å; Y193-A200 HydrophobicContact CE1-CB 4.14Å; Y193-A200 HydrophobicContact CE2-CB 3.66Å; Y193-A200 HydrophobicContact CG-CB 3.43Å; Y193-A200 VanDerWaalsContact CG-CB 3.43Å; Y193-H242 AromaticContact CE2-CE1 3.89Å; Y193-H242 AromaticContact CE2-ND1 3.36Å; Y193-H242 WeakPolarHBondContact CE2-ND1 3.22Å; Y193-H242 AromaticContact CZ-ND1 3.73Å; Y193-H242 PolarHBondContact OH-ND1 3.23Å
194	R	92.8	Very high	95.6	Very high	110 Å²	110	29 Å²	29	42%	0.415	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-34.3	-177.2	-175.6	-174.6	-66.5	150.1	2.7	113.4	D165 P190 H196	D165-R194 IonicContact OD2-NH1 3.18Å; D165-R194 PolarHBondContact OD2-NH1 3.28Å; P190-R194 PolarHBondContact O-N 2.91Å; R194-H196 VanDerWaalsContact C-N 3.34Å
195	S	93.6	Very high	95.5	Very high	66 Å²	66	30.7 Å²	30.7	46%	0.462	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-21.2	178.1	-57.2	0	0	0	0	113.9	I170 Y193	I170-S195 WeakPolarHBondContact CG2-OG 3.38Å; Y193-S195 PolarHBondContact O-N 2.82Å; Y193-S195 VanDerWaalsContact O-N 3.09Å
196	H	95.1	Very high	95.4	Very high	26 Å²	26	31 Å²	31	12%	0.12	17%	0.171	C	C	.	.			trans	-138.2	55.5	-173.8	-57.2	-72.6	0	0	0	111.8	D172 L173 Y193 R194 D198 N199	D172-H196 IonicContact OD1-CD2 2.71Å; D172-H196 IonicContact OD1-CE1 3.88Å; D172-H196 IonicContact OD1-NE2 2.75Å; D172-H196 PolarHBondContact OD1-NE2 3.28Å; L173-H196 HydrophobicContact CD1-CB 3.72Å; L173-H196 HydrophobicContact CG-CB 4.1Å; L173-H196 PolarHBondContact N-CD2 3.01Å; L173-H196 VanDerWaalsContact N-CD2 3.26Å; L173-H196 PolarHBondContact N-NE2 3.14Å; Y193-H196 CarbonylContact O-C 3.21Å; Y193-H196 PolarHBondContact O-N 3.2Å; R194-H196 VanDerWaalsContact C-N 3.34Å; H196-D198 PolarHBondContact O-N 3.36Å; H196-N199 HydrophobicContact CB-CB 4.25Å; H196-N199 PolarHBondContact O-N 2.88Å; H196-N199 VanDerWaalsContact O-N 3.11Å
197	P	94.6	Very high	95	Very high	46 Å²	46	35.2 Å²	35.2	30%	0.299	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-62.6	-32.6	-174.8	26.5	-34.7	0	0	0	112.6	N199 A200 L239 H242	P197-N199 PolarHBondContact O-N 2.98Å; P197-N199 VanDerWaalsContact O-N 3.16Å; P197-A200 WeakPolarHBondContact O-CB 3.33Å; P197-A200 PolarHBondContact O-N 3.26Å; P197-A200 VanDerWaalsContact O-N 3.08Å; P197-L239 HydrophobicContact CB-CD2 4.37Å; P197-H242 PolarHBondContact O-NE2 3.1Å
198	D	95.4	Very high	94.5	Very high	61 Å²	61	37.4 Å²	37.4	33%	0.326	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-69	-11.7	179.4	-59.3	-45.1	0	0	0	113.8	H196 R232 L235	H196-D198 PolarHBondContact O-N 3.36Å; D198-R232 HydrophobicContact CB-CB 4.2Å; D198-R232 HydrophobicContact CB-CG 4.13Å; D198-R232 WeakPolarHBondContact O-CG 3.19Å; D198-L235 VanDerWaalsContact O-CB 3.25Å; D198-L235 WeakPolarHBondContact O-CB 3.25Å
199	N	97.3	Very high	94.1	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.021	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-99	-2.5	176.3	-70.8	89.4	0	0	0	112.6	L173 L180 I183 V184 I185 H196 P197 R232	L173-N199 HydrophobicContact CD1-CB 3.58Å; L180-N199 PolarHBondContact O-ND2 2.89Å; I183-N199 PolarHBondContact O-ND2 2.62Å; V184-N199 CarbonylContact C-O 3.58Å; V184-N199 WeakPolarHBondContact CA-O 3.46Å; I185-N199 PolarHBondContact N-O 3.42Å; H196-N199 HydrophobicContact CB-CB 4.25Å; H196-N199 PolarHBondContact O-N 2.88Å; H196-N199 VanDerWaalsContact O-N 3.11Å; P197-N199 PolarHBondContact O-N 2.98Å; P197-N199 VanDerWaalsContact O-N 3.16Å; N199-R232 WeakPolarHBondContact OD1-CD 3.44Å
200	A	96.6	Very high	93.6	Very high	3 Å²	3	40 Å²	40	3%	0.025	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	138.2	-168.4	0	0	0	0	0	113.3	I185 Y193 P197	I185-A200 HydrophobicContact CG2-CB 3.77Å; I185-A200 CarbonylContact O-C 3.59Å; I185-A200 WeakPolarHBondContact O-CA 3.48Å; Y193-A200 HydrophobicContact CD1-CB 3.87Å; Y193-A200 HydrophobicContact CD2-CB 3.34Å; Y193-A200 HydrophobicContact CE1-CB 4.14Å; Y193-A200 HydrophobicContact CE2-CB 3.66Å; Y193-A200 HydrophobicContact CG-CB 3.43Å; Y193-A200 VanDerWaalsContact CG-CB 3.43Å; P197-A200 WeakPolarHBondContact O-CB 3.33Å; P197-A200 PolarHBondContact O-N 3.26Å; P197-A200 VanDerWaalsContact O-N 3.08Å
201	I	96.3	Very high	93.3	Very high	6 Å²	6	42 Å²	42	3%	0.031	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	105.3	161.9	-61.3	172	0	0	0	106.3	V184 I185 L186 D187 L218 M221 L222 L225 L235	V184-I201 HydrophobicContact CG1-CD1 3.35Å; V184-I201 HydrophobicContact CG1-CG1 3.71Å; I185-I201 PolarHBondContact O-N 3.15Å; L186-I201 HydrophobicContact CD1-CB 4.05Å; L186-I201 HydrophobicContact CD1-CG2 3.81Å; L186-I201 WeakPolarHBondContact CD1-O 3.45Å; D187-I201 PolarHBondContact N-O 2.84Å; I201-L218 HydrophobicContact CG2-CD1 4.24Å; I201-L218 HydrophobicContact CG2-CD2 3.65Å; I201-M221 HydrophobicContact CD1-CE 3.39Å; I201-M221 HydrophobicContact CD1-SD 3.91Å; I201-M221 HydrophobicContact CG1-CE 3.78Å; I201-M221 HydrophobicContact CG2-CE 3.91Å; I201-L222 HydrophobicContact CD1-CD2 3.62Å; I201-L222 HydrophobicContact CD1-CG 4.47Å; I201-L225 HydrophobicContact CD1-CD1 4.38Å; I201-L235 HydrophobicContact CD1-CD2 4.41Å; I201-L235 HydrophobicContact CG1-CD1 4.39Å; I201-L235 HydrophobicContact CG1-CD2 3.77Å
202	P	95.3	Very high	93.2	Very high	24 Å²	24	42.2 Å²	42.2	16%	0.156	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	136.9	173.2	26.7	-30.5	0	0	0	109.5	Q241	P202-Q241 HydrophobicContact CG-CB 4.08Å
203	I	95.1	Very high	93	Very high	10 Å²	10	44.9 Å²	44.9	5%	0.051	25%	0.249	C	C	.	.			trans	-128.9	143.3	173.9	-169.7	172	0	0	0	110.5	T72 R112 L186 D187 N188 S205 A214 L215 L218	T72-I203 HydrophobicContact CG2-CG2 4.04Å; R112-I203 VanDerWaalsContact NH1-CD1 3.27Å; L186-I203 HydrophobicContact CD1-CB 3.7Å; L186-I203 HydrophobicContact CD1-CD1 4.13Å; L186-I203 HydrophobicContact CD1-CG1 4.46Å; L186-I203 HydrophobicContact CD1-CG2 3.74Å; L186-I203 HydrophobicContact CD2-CD1 4.48Å; L186-I203 HydrophobicContact CG-CG2 4.17Å; D187-I203 PolarHBondContact O-N 3.35Å; N188-I203 WeakPolarHBondContact CA-O 3.31Å; N188-I203 HydrophobicContact CB-CG2 4.14Å; N188-I203 WeakPolarHBondContact CB-O 3.32Å; I203-S205 PolarHBondContact O-N 2.99Å; I203-A214 HydrophobicContact CD1-CB 4.06Å; I203-A214 HydrophobicContact CG1-CB 4.13Å; I203-L215 HydrophobicContact CD1-CD2 3.68Å; I203-L215 HydrophobicContact CD1-CG 4.46Å; I203-L218 HydrophobicContact CD1-CD1 3.95Å
204	K	93.9	Very high	93	Very high	115 Å²	115	45.7 Å²	45.7	50%	0.5	26%	0.257	S	S	.	.			trans	-62.6	134.6	176.4	-175.7	-175.5	175.3	-174.7	0	110.4	R112 W206 W245	R112-K204 PolarHBondContact NH1-O 2.81Å; R112-K204 PolarHBondContact NH2-O 3.23Å; K204-W206 PolarHBondContact O-N 3.08Å; K204-W245 HydrophobicContact CB-CZ3 4.34Å; K204-W245 HydrophobicContact CD-CZ3 4.28Å; K204-W245 HydrophobicContact CG-CE3 4.42Å; K204-W245 HydrophobicContact CG-CZ3 4.13Å
205	S	95.9	Very high	93.1	Very high	37 Å²	37	40.5 Å²	40.5	26%	0.259	24%	0.237	S	C	.	.			trans	-55.3	132.8	169.7	-58.7	0	0	0	0	111.3	E71 N188 I203	E71-S205 CarbonylContact O-C 3.59Å; E71-S205 WeakPolarHBondContact O-CA 3.47Å; N188-S205 PolarHBondContact ND2-OG 3.46Å; I203-S205 PolarHBondContact O-N 2.99Å
206	W	95.2	Very high	93	Very high	6 Å²	6	37.9 Å²	37.9	2%	0.023	22%	0.218	C	C	.	.			trans	-114.2	134.1	178.2	-179.3	85.1	0	0	0	111.3	E71 H75 H110 K111 R112 P113 K204 D209 D212	E71-W206 PolarHBondContact O-N 3.35Å; H75-W206 HydrophobicContact CB-CE3 3.72Å; H75-W206 HydrophobicContact CB-CZ3 3.61Å; H110-W206 HydrophobicContact CB-CH2 3.83Å; H110-W206 HydrophobicContact CB-CZ3 4.07Å; H110-W206 WeakPolarHBondContact O-CZ3 3.49Å; K111-W206 VanDerWaalsContact C-CH2 3.42Å; K111-W206 WeakPolarHBondContact O-CH2 3.21Å; R112-W206 HydrophobicContact CB-CD2 3.81Å; R112-W206 HydrophobicContact CB-CE3 3.78Å; R112-W206 HydrophobicContact CB-CG 4.22Å; R112-W206 HydrophobicContact CB-CZ3 4.21Å; R112-W206 HydrophobicContact CG-CB 4.1Å; R112-W206 HydrophobicContact CG-CD2 3.74Å; R112-W206 HydrophobicContact CG-CE3 4.22Å; R112-W206 HydrophobicContact CG-CG 3.65Å; P113-W206 VanDerWaalsContact CD-CE2 3.47Å; P113-W206 HydrophobicContact CG-CZ2 4.45Å; K204-W206 PolarHBondContact O-N 3.08Å; W206-D209 PolarHBondContact NE1-O 3.03Å; W206-D212 VanDerWaalsContact CD1-CB 3.5Å
207	F	91.4	Very high	92.9	Very high	89 Å²	89	42 Å²	42	39%	0.39	24%	0.24	S	C	.	.	S	Bend	trans	-122.1	-52.3	-178	-60.6	-80.7	0	0	0	111.9	E71 H75	E71-F207 HydrophobicContact CG-CD1 4.12Å; E71-F207 HydrophobicContact CG-CE1 3.52Å; E71-F207 HydrophobicContact CG-CZ 3.88Å; H75-F207 WeakPolarHBondContact CB-O 3.21Å; H75-F207 PolarHBondContact CD2-O 3.04Å; H75-F207 AromaticContact CE1-CD1 3.65Å; H75-F207 AromaticContact ND1-CD1 3.69Å
208	S	86.4	Confident	92.9	Very high	48 Å²	48	40.9 Å²	40.9	34%	0.336	23%	0.232	S	C	.	.	S	Bend	trans	-157.2	4	-173.1	73	0	0	0	0	115.3	P210	S208-P210 WeakPolarHBondContact O-CD 3.31Å
209	D	87.9	Confident	92.8	Very high	64 Å²	64	38 Å²	38	34%	0.342	22%	0.217	S	C	.	.			trans	-72.2	111.7	-175.5	-177	-2.7	0	0	0	110	P113 W206 S211 D212	P113-D209 WeakPolarHBondContact CG-O 3.27Å; W206-D209 PolarHBondContact NE1-O 3.03Å; D209-S211 PolarHBondContact O-N 3.22Å; D209-S211 WeakPolarHBondContact OD1-CB 3.37Å; D209-S211 PolarHBondContact OD1-N 3.38Å; D209-S211 PolarHBondContact OD1-OG 2.98Å; D209-D212 HydrophobicContact CB-CB 4.38Å; D209-D212 PolarHBondContact O-N 2.87Å
210	P	84.7	Confident	92.6	Very high	66 Å²	66	41.4 Å²	41.4	43%	0.429	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-13.9	-179.4	33.3	-36.5	0	0	0	112.9	I37 S208	I37-P210 HydrophobicContact CG2-CB 4.36Å; I37-P210 VanDerWaalsContact CG2-O 3.3Å; I37-P210 WeakPolarHBondContact CG2-O 3.19Å; S208-P210 WeakPolarHBondContact O-CD 3.31Å
211	S	86.9	Confident	92.4	Very high	82 Å²	82	44.1 Å²	44.1	57%	0.573	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	3.6	179.6	70.3	0	0	0	0	113.8	D209 T213	D209-S211 PolarHBondContact O-N 3.22Å; D209-S211 WeakPolarHBondContact OD1-CB 3.37Å; D209-S211 PolarHBondContact OD1-N 3.38Å; D209-S211 PolarHBondContact OD1-OG 2.98Å; S211-T213 PolarHBondContact O-N 3.22Å
212	D	91.3	Very high	92.4	Very high	14 Å²	14	43.9 Å²	43.9	8%	0.075	25%	0.251	C	S	.	.			trans	-60.1	126.5	178.6	-177.2	-77.4	0	0	0	111	R112 P113 H114 W206 D209 A214	R112-D212 IonicContact CZ-OD1 2.81Å; R112-D212 IonicContact CZ-OD2 3.75Å; R112-D212 IonicContact NE-OD1 3.23Å; R112-D212 PolarHBondContact NE-OD1 2.79Å; R112-D212 IonicContact NE-OD2 2.62Å; R112-D212 IonicContact NH2-OD1 2.65Å; R112-D212 PolarHBondContact NH2-OD1 2.86Å; R112-D212 IonicContact NH2-OD2 2.7Å; R112-D212 PolarHBondContact NH2-OD2 2.93Å; P113-D212 WeakPolarHBondContact CB-O 3.26Å; P113-D212 HydrophobicContact CG-CB 4.19Å; H114-D212 PolarHBondContact CD2-O 2.89Å; W206-D212 VanDerWaalsContact CD1-CB 3.5Å; D209-D212 HydrophobicContact CB-CB 4.38Å; D209-D212 PolarHBondContact O-N 2.87Å; D212-A214 WeakPolarHBondContact OD1-CB 3.27Å; D212-A214 PolarHBondContact OD1-N 2.86Å
213	T	92.3	Very high	92.4	Very high	60 Å²	60	44.8 Å²	44.8	37%	0.368	25%	0.254	S	S	.	.			trans	-115.8	13.5	177.2	54.9	0	0	0	0	112.4	S211 L215 L216 N217	S211-T213 PolarHBondContact O-N 3.22Å; T213-L215 VanDerWaalsContact C-N 3.34Å; T213-L215 PolarHBondContact O-N 2.94Å; T213-L216 HydrophobicContact CG2-CD1 4.48Å; T213-L216 WeakPolarHBondContact O-CB 3.46Å; T213-L216 PolarHBondContact O-N 3.27Å; T213-N217 VanDerWaalsContact O-CG 3.24Å; T213-N217 PolarHBondContact O-N 2.94Å; T213-N217 PolarHBondContact O-ND2 2.94Å; T213-N217 PolarHBondContact OG1-ND2 3.27Å; T213-N217 VanDerWaalsContact OG1-ND2 3.1Å
214	A	94.3	Very high	92.3	Very high	23 Å²	23	47.1 Å²	47.1	19%	0.19	28%	0.275	C	S	.	.	H	α-helix	trans	-60.2	-43.4	-168.4	0	0	0	0	0	112.2	I203 D212 L216 N217 L218	I203-A214 HydrophobicContact CD1-CB 4.06Å; I203-A214 HydrophobicContact CG1-CB 4.13Å; D212-A214 WeakPolarHBondContact OD1-CB 3.27Å; D212-A214 PolarHBondContact OD1-N 2.86Å; A214-L216 VanDerWaalsContact C-N 3.32Å; A214-L216 PolarHBondContact O-N 3.46Å; A214-N217 PolarHBondContact O-N 2.71Å; A214-L218 WeakPolarHBondContact O-CG 3.36Å; A214-L218 PolarHBondContact O-N 3.45Å
215	L	95.6	Very high	92.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.4	-38.2	177.4	-66.3	179.7	0	0	0	112.5	L73 R112 V115 F118 L186 I203 T213 L218	L73-L215 HydrophobicContact CD2-CD1 4.22Å; L73-L215 HydrophobicContact CD2-CD2 4.03Å; R112-L215 HydrophobicContact CB-CD1 4.23Å; R112-L215 HydrophobicContact CG-CD1 4.07Å; R112-L215 HydrophobicContact CG-CG 4.44Å; V115-L215 HydrophobicContact CB-CD1 3.92Å; V115-L215 HydrophobicContact CG2-CD1 4.22Å; F118-L215 HydrophobicContact CB-CB 4.15Å; F118-L215 HydrophobicContact CB-CD1 4.42Å; F118-L215 HydrophobicContact CD1-CD2 4.36Å; F118-L215 HydrophobicContact CD2-CB 3.93Å; F118-L215 HydrophobicContact CD2-CD2 4.49Å; F118-L215 VanDerWaalsContact CD2-O 3.28Å; F118-L215 WeakPolarHBondContact CD2-O 3.3Å; F118-L215 HydrophobicContact CE1-CD2 4.36Å; F118-L215 HydrophobicContact CE2-CD2 4.47Å; F118-L215 HydrophobicContact CG-CB 4.03Å; F118-L215 HydrophobicContact CG-CD1 4.46Å; F118-L215 HydrophobicContact CG-CD2 4.43Å; F118-L215 HydrophobicContact CZ-CD2 4.41Å; L186-L215 HydrophobicContact CD2-CD2 4.15Å; I203-L215 HydrophobicContact CD1-CD2 3.68Å; I203-L215 HydrophobicContact CD1-CG 4.46Å; T213-L215 VanDerWaalsContact C-N 3.34Å; T213-L215 PolarHBondContact O-N 2.94Å; L215-L218 PolarHBondContact O-N 2.92Å
216	L	92	Very high	92.4	Very high	11 Å²	11	41.7 Å²	41.7	6%	0.058	25%	0.246	C	C	.	.	H	α-helix	trans	-68	-42.1	177.8	-68.2	173	0	0	0	111.9	V42 H114 F117 T213 A214 L218 L219	V42-L216 HydrophobicContact CB-CD1 3.89Å; V42-L216 HydrophobicContact CG1-CD1 3.77Å; V42-L216 HydrophobicContact CG1-CD2 4.17Å; V42-L216 HydrophobicContact CG1-CG 4.48Å; V42-L216 HydrophobicContact CG2-CD1 3.6Å; H114-L216 HydrophobicContact CB-CD1 4Å; H114-L216 HydrophobicContact CB-CD2 3.73Å; H114-L216 HydrophobicContact CB-CG 3.62Å; H114-L216 WeakPolarHBondContact CD2-CD1 3.26Å; H114-L216 WeakPolarHBondContact NE2-CD1 3.39Å; F117-L216 HydrophobicContact CD1-CD2 3.75Å; F117-L216 HydrophobicContact CE1-CD2 4.14Å; T213-L216 HydrophobicContact CG2-CD1 4.48Å; T213-L216 WeakPolarHBondContact O-CB 3.46Å; T213-L216 PolarHBondContact O-N 3.27Å; A214-L216 VanDerWaalsContact C-N 3.32Å; A214-L216 PolarHBondContact O-N 3.46Å; L216-L218 PolarHBondContact O-N 3.42Å; L216-L218 VanDerWaalsContact O-N 3.13Å; L216-L219 HydrophobicContact CD2-CD1 4.12Å; L216-L219 WeakPolarHBondContact O-CB 3.4Å; L216-L219 WeakPolarHBondContact O-CG 3.21Å; L216-L219 PolarHBondContact O-N 3.22Å
217	N	91.7	Very high	92.5	Very high	112 Å²	112	44.4 Å²	44.4	60%	0.599	26%	0.258	S	S	*	.	H	α-helix	trans	-64.4	-18.6	-178.7	-63.3	-24.2	0	0	0	112.4	T213 A214	T213-N217 VanDerWaalsContact O-CG 3.24Å; T213-N217 PolarHBondContact O-N 2.94Å; T213-N217 PolarHBondContact O-ND2 2.94Å; T213-N217 PolarHBondContact OG1-ND2 3.27Å; T213-N217 VanDerWaalsContact OG1-ND2 3.1Å; A214-N217 PolarHBondContact O-N 2.71Å
218	L	94.8	Very high	92.7	Very high	24 Å²	24	41.1 Å²	41.1	13%	0.126	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-21.6	174.8	-66.3	177.5	0	0	0	113.7	L186 I201 I203 A214 L215 L216 M221 L222	L186-L218 HydrophobicContact CD1-CD1 3.52Å; L186-L218 HydrophobicContact CD2-CD1 3.99Å; L186-L218 HydrophobicContact CG-CD1 4.43Å; I201-L218 HydrophobicContact CG2-CD1 4.24Å; I201-L218 HydrophobicContact CG2-CD2 3.65Å; I203-L218 HydrophobicContact CD1-CD1 3.95Å; A214-L218 WeakPolarHBondContact O-CG 3.36Å; A214-L218 PolarHBondContact O-N 3.45Å; L215-L218 PolarHBondContact O-N 2.92Å; L216-L218 PolarHBondContact O-N 3.42Å; L216-L218 VanDerWaalsContact O-N 3.13Å; L218-M221 HydrophobicContact CD2-CE 3.97Å; L218-M221 PolarHBondContact O-N 3.46Å; L218-L222 HydrophobicContact CB-CD1 4.02Å; L218-L222 HydrophobicContact CB-CG 4.41Å; L218-L222 WeakPolarHBondContact O-CB 3.48Å; L218-L222 WeakPolarHBondContact O-CG 3.46Å; L218-L222 PolarHBondContact O-N 3.11Å
219	L	94.2	Very high	93.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-57.6	-45.9	-173.2	-66.2	176.8	0	0	0	113.8	Y44 F117 F118 V121 V122 W125 L216 M221 L222 D223	Y44-L219 HydrophobicContact CD1-CD1 4.39Å; Y44-L219 HydrophobicContact CD2-CB 3.94Å; Y44-L219 HydrophobicContact CD2-CD1 3.81Å; Y44-L219 HydrophobicContact CE1-CB 4.39Å; Y44-L219 HydrophobicContact CE2-CB 3.47Å; Y44-L219 VanDerWaalsContact CE2-CB 3.47Å; Y44-L219 HydrophobicContact CE2-CD1 4.23Å; Y44-L219 HydrophobicContact CG-CD1 3.89Å; Y44-L219 PolarHBondContact OH-O 2.86Å; F117-L219 HydrophobicContact CD1-CD1 4.38Å; F117-L219 HydrophobicContact CE1-CD1 3.93Å; F118-L219 HydrophobicContact CD2-CD2 3.74Å; F118-L219 HydrophobicContact CD2-CG 4.43Å; F118-L219 HydrophobicContact CE2-CD2 4.16Å; V121-L219 HydrophobicContact CB-CD2 4.23Å; V121-L219 HydrophobicContact CG1-CD2 3.9Å; V122-L219 HydrophobicContact CG1-CD2 3.87Å; W125-L219 HydrophobicContact CH2-CB 4.45Å; W125-L219 HydrophobicContact CH2-CD2 4.37Å; W125-L219 HydrophobicContact CZ3-CD2 4.08Å; L216-L219 HydrophobicContact CD2-CD1 4.12Å; L216-L219 WeakPolarHBondContact O-CB 3.4Å; L216-L219 WeakPolarHBondContact O-CG 3.21Å; L216-L219 PolarHBondContact O-N 3.22Å; L219-M221 VanDerWaalsContact C-N 3.31Å; L219-M221 PolarHBondContact O-N 2.85Å; L219-L222 PolarHBondContact O-N 3.26Å; L219-D223 WeakPolarHBondContact O-CB 3.16Å; L219-D223 PolarHBondContact O-N 3.46Å
220	P	92.3	Very high	93.6	Very high	75 Å²	75	41.6 Å²	41.6	49%	0.487	26%	0.255	S	S	.	.	H	α-helix	trans	-60.6	-39.9	178.5	-22.8	32.9	0	0	0	113.2	Y44 D223 A224	Y44-P220 HydrophobicContact CE2-CG 4.02Å; Y44-P220 WeakPolarHBondContact OH-CA 3.35Å; P220-D223 PolarHBondContact O-N 2.85Å; P220-A224 PolarHBondContact O-N 3.43Å
221	M	93.4	Very high	94.2	Very high	60 Å²	60	38.4 Å²	38.4	30%	0.296	23%	0.234	S	C	.	.	H	α-helix	trans	-73.2	-42.5	-179.3	-177.6	-91.8	-67.9	0	0	111.2	I201 L218 L219 D223 A224 L225 L235	I201-M221 HydrophobicContact CD1-CE 3.39Å; I201-M221 HydrophobicContact CD1-SD 3.91Å; I201-M221 HydrophobicContact CG1-CE 3.78Å; I201-M221 HydrophobicContact CG2-CE 3.91Å; L218-M221 HydrophobicContact CD2-CE 3.97Å; L218-M221 PolarHBondContact O-N 3.46Å; L219-M221 VanDerWaalsContact C-N 3.31Å; L219-M221 PolarHBondContact O-N 2.85Å; M221-D223 VanDerWaalsContact C-N 3.28Å; M221-D223 PolarHBondContact O-N 3.5Å; M221-A224 PolarHBondContact O-N 3.24Å; M221-L225 WeakPolarHBondContact O-CG 3.34Å; M221-L225 PolarHBondContact O-N 3.22Å; M221-L225 HydrophobicContact SD-CD1 3.42Å; M221-L225 WeakPolarHBondContact SD-CD1 3.39Å; M221-L225 HydrophobicContact SD-CG 3.86Å; M221-L235 HydrophobicContact SD-CD2 4.2Å
222	L	96.4	Very high	94.6	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-61.5	-36.5	172.5	-71.3	173.1	0	0	0	111.5	L65 F118 V122 W125 Y126 I201 L218 L219	L65-L222 HydrophobicContact CD1-CD2 4.13Å; L65-L222 HydrophobicContact CD2-CD1 4.31Å; L65-L222 HydrophobicContact CD2-CD2 4.45Å; F118-L222 HydrophobicContact CE2-CD1 3.62Å; F118-L222 HydrophobicContact CZ-CD1 3.88Å; V122-L222 HydrophobicContact CG1-CD1 3.87Å; W125-L222 HydrophobicContact CZ3-CB 4.38Å; Y126-L222 HydrophobicContact CE2-CB 4.1Å; Y126-L222 HydrophobicContact CE2-CD2 4.43Å; Y126-L222 WeakPolarHBondContact CE2-O 3.4Å; Y126-L222 PolarHBondContact OH-O 2.93Å; I201-L222 HydrophobicContact CD1-CD2 3.62Å; I201-L222 HydrophobicContact CD1-CG 4.47Å; L218-L222 HydrophobicContact CB-CD1 4.02Å; L218-L222 HydrophobicContact CB-CG 4.41Å; L218-L222 WeakPolarHBondContact O-CB 3.48Å; L218-L222 WeakPolarHBondContact O-CG 3.46Å; L218-L222 PolarHBondContact O-N 3.11Å; L219-L222 PolarHBondContact O-N 3.26Å
223	D	94.4	Very high	94.8	Very high	43 Å²	43	40.5 Å²	40.5	23%	0.23	24%	0.237	C	C	.	.	H	α-helix	trans	-64.9	-45.1	174.6	-169.5	29.4	0	0	0	111.4	W125 L219 P220 M221 L225 R226 F227	W125-D223 HydrophobicContact CE3-CB 4.42Å; W125-D223 HydrophobicContact CH2-CB 3.84Å; W125-D223 HydrophobicContact CZ2-CB 4.34Å; W125-D223 HydrophobicContact CZ3-CB 3.9Å; L219-D223 WeakPolarHBondContact O-CB 3.16Å; L219-D223 PolarHBondContact O-N 3.46Å; P220-D223 PolarHBondContact O-N 2.85Å; M221-D223 VanDerWaalsContact C-N 3.28Å; M221-D223 PolarHBondContact O-N 3.5Å; D223-L225 PolarHBondContact O-N 2.87Å; D223-R226 VanDerWaalsContact O-CB 3.28Å; D223-R226 WeakPolarHBondContact O-CB 3.35Å; D223-R226 VanDerWaalsContact O-CD 3.24Å; D223-R226 WeakPolarHBondContact O-CD 3.47Å; D223-R226 VanDerWaalsContact O-CG 3.29Å; D223-R226 WeakPolarHBondContact O-CG 3.39Å; D223-R226 PolarHBondContact O-N 2.9Å; D223-R226 WeakPolarHBondContact OD1-CD 3.39Å; D223-R226 IonicContact OD1-CZ 2.85Å; D223-R226 IonicContact OD1-NE 2.64Å; D223-R226 IonicContact OD1-NH1 3.59Å; D223-R226 PolarHBondContact OD1-NH1 2.9Å; D223-F227 WeakPolarHBondContact O-CD2 3.4Å
224	A	93.8	Very high	94.9	Very high	60 Å²	60	40.1 Å²	40.1	50%	0.496	24%	0.235	S	C	.	.	H	α-helix	trans	-62.5	-40.4	177.3	0	0	0	0	0	113.2	P220 M221 R226 F227	P220-A224 PolarHBondContact O-N 3.43Å; M221-A224 PolarHBondContact O-N 3.24Å; A224-R226 PolarHBondContact O-N 3.36Å; A224-R226 VanDerWaalsContact O-N 3.15Å; A224-F227 PolarHBondContact O-N 2.85Å
225	L	96.8	Very high	94.9	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.016	23%	0.229	C	C	.	.	H	α-helix	trans	-60.8	-24.6	-179.3	-78.4	-177.9	0	0	0	113.4	Y126 V184 I201 M221 D223 F227 T228 V231 V234 L235	Y126-L225 VanDerWaalsContact OH-CB 3.29Å; Y126-L225 WeakPolarHBondContact OH-CB 3.37Å; V184-L225 HydrophobicContact CG2-CD1 4.17Å; I201-L225 HydrophobicContact CD1-CD1 4.38Å; M221-L225 WeakPolarHBondContact O-CG 3.34Å; M221-L225 PolarHBondContact O-N 3.22Å; M221-L225 HydrophobicContact SD-CD1 3.42Å; M221-L225 WeakPolarHBondContact SD-CD1 3.39Å; M221-L225 HydrophobicContact SD-CG 3.86Å; D223-L225 PolarHBondContact O-N 2.87Å; L225-F227 PolarHBondContact O-N 2.83Å; L225-F227 VanDerWaalsContact O-N 3.12Å; L225-T228 HydrophobicContact CD2-CG2 4.19Å; L225-T228 PolarHBondContact O-N 2.94Å; L225-T228 VanDerWaalsContact O-N 3.1Å; L225-T228 PolarHBondContact O-OG1 3.28Å; L225-V231 HydrophobicContact CD2-CB 4.34Å; L225-V234 HydrophobicContact CD2-CB 3.76Å; L225-V234 HydrophobicContact CD2-CG1 3.95Å; L225-V234 HydrophobicContact CD2-CG2 4.13Å; L225-L235 HydrophobicContact CD1-CD1 4.36Å; L225-L235 HydrophobicContact CD1-CD2 4.05Å; L225-L235 HydrophobicContact CD1-CG 4.3Å; L225-L235 HydrophobicContact CD2-CG 4.48Å
226	R	95.8	Very high	94.5	Very high	34 Å²	34	41.6 Å²	41.6	13%	0.128	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-31.4	176.6	-62.5	163.9	66.2	-165.7	2.8	112.8	L57 V60 W125 Y126 D223 A224	L57-R226 HydrophobicContact CD1-CB 3.79Å; L57-R226 WeakPolarHBondContact CD1-O 3.45Å; L57-R226 VanDerWaalsContact CD2-NH2 3.26Å; V60-R226 VanDerWaalsContact CG2-O 3.28Å; V60-R226 WeakPolarHBondContact CG2-O 3.32Å; W125-R226 HydrophobicContact CB-CG 4.07Å; W125-R226 VanDerWaalsContact CD1-CZ 3.48Å; Y126-R226 HydrophobicContact CE2-CG 4.1Å; D223-R226 VanDerWaalsContact O-CB 3.28Å; D223-R226 WeakPolarHBondContact O-CB 3.35Å; D223-R226 VanDerWaalsContact O-CD 3.24Å; D223-R226 WeakPolarHBondContact O-CD 3.47Å; D223-R226 VanDerWaalsContact O-CG 3.29Å; D223-R226 WeakPolarHBondContact O-CG 3.39Å; D223-R226 PolarHBondContact O-N 2.9Å; D223-R226 WeakPolarHBondContact OD1-CD 3.39Å; D223-R226 IonicContact OD1-CZ 2.85Å; D223-R226 IonicContact OD1-NE 2.64Å; D223-R226 IonicContact OD1-NH1 3.59Å; D223-R226 PolarHBondContact OD1-NH1 2.9Å; A224-R226 PolarHBondContact O-N 3.36Å; A224-R226 VanDerWaalsContact O-N 3.15Å
227	F	95.7	Very high	94.2	Very high	63 Å²	63	50.2 Å²	50.2	28%	0.276	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-2.8	-174.3	-61.1	-89.6	0	0	0	113.5	L49 S53 L57 D223 A224 L225	L49-F227 HydrophobicContact CD1-CE1 4.39Å; L49-F227 HydrophobicContact CD1-CZ 3.99Å; L49-F227 HydrophobicContact CD2-CZ 3.75Å; S53-F227 WeakPolarHBondContact O-CE1 3.44Å; L57-F227 HydrophobicContact CB-CD1 4.1Å; L57-F227 HydrophobicContact CB-CE1 3.75Å; L57-F227 HydrophobicContact CD1-CD1 4.31Å; L57-F227 HydrophobicContact CD1-CE1 4.29Å; L57-F227 HydrophobicContact CG-CE1 4.44Å; D223-F227 WeakPolarHBondContact O-CD2 3.4Å; A224-F227 PolarHBondContact O-N 2.85Å; L225-F227 PolarHBondContact O-N 2.83Å; L225-F227 VanDerWaalsContact O-N 3.12Å
228	T	95.9	Very high	93.1	Very high	21 Å²	21	48.8 Å²	48.8	13%	0.129	27%	0.267	C	S	.	.			trans	-80.9	141.1	-178.3	63.2	0	0	0	0	110.8	K63 L225 V234	K63-T228 VanDerWaalsContact CE-O 3.26Å; K63-T228 WeakPolarHBondContact CE-O 3.45Å; K63-T228 PolarHBondContact NZ-O 3.19Å; L225-T228 HydrophobicContact CD2-CG2 4.19Å; L225-T228 PolarHBondContact O-N 2.94Å; L225-T228 VanDerWaalsContact O-N 3.1Å; L225-T228 PolarHBondContact O-OG1 3.28Å; T228-V234 HydrophobicContact CG2-CG2 3.8Å
229	A	96.1	Very high	91.7	Very high	77 Å²	77	50.8 Å²	50.8	64%	0.636	28%	0.278	S	S	*	.	S	Bend	trans	-65.8	-49.3	167	0	0	0	0	0	109.8	K63	K63-A229 PolarHBondContact NZ-O 3.39Å
230	D	97.3	Very high	90.5	Very high	44 Å²	44	56.2 Å²	56.2	24%	0.235	30%	0.303	C	S	.	.			trans	-124.2	118.3	176.1	-170.2	-24.8	0	0	0	110.5	S181 R232 S233	S181-D230 WeakPolarHBondContact CA-OD1 3.48Å; S181-D230 VanDerWaalsContact CB-CG 3.47Å; S181-D230 WeakPolarHBondContact O-CA 3.2Å; D230-R232 PolarHBondContact O-N 3.2Å; D230-R232 WeakPolarHBondContact OD1-CB 3.49Å; D230-R232 WeakPolarHBondContact OD1-CG 3.26Å; D230-R232 IonicContact OD1-CZ 3.85Å; D230-R232 PolarHBondContact OD1-N 3.36Å; D230-R232 IonicContact OD1-NE 2.97Å; D230-R232 PolarHBondContact OD1-NE 2.95Å; D230-R232 IonicContact OD1-NH2 3.85Å; D230-R232 IonicContact OD2-CZ 3.34Å; D230-R232 IonicContact OD2-NE 3.15Å; D230-R232 PolarHBondContact OD2-NE 2.84Å; D230-R232 VanDerWaalsContact OD2-NE 3.15Å; D230-R232 IonicContact OD2-NH2 2.7Å; D230-R232 PolarHBondContact OD2-NH2 3.45Å; D230-S233 WeakPolarHBondContact O-CB 3.35Å; D230-S233 PolarHBondContact O-N 2.85Å; D230-S233 PolarHBondContact O-OG 3Å
231	V	97.3	Very high	89	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-28.9	-179.3	-60.9	0	0	0	0	112.4	K63 S181 I183 V184 L225 S233 V234 L235	K63-V231 HydrophobicContact CG-CG1 4.37Å; S181-V231 PolarHBondContact O-N 2.89Å; I183-V231 WeakPolarHBondContact O-CG2 3.22Å; V184-V231 HydrophobicContact CG2-CB 3.94Å; V184-V231 HydrophobicContact CG2-CG1 3.85Å; V184-V231 HydrophobicContact CG2-CG2 3.89Å; L225-V231 HydrophobicContact CD2-CB 4.34Å; V231-S233 PolarHBondContact O-N 2.91Å; V231-V234 PolarHBondContact O-N 3.09Å; V231-V234 VanDerWaalsContact O-N 3.12Å; V231-L235 HydrophobicContact CB-CD1 4.38Å; V231-L235 HydrophobicContact CG2-CD1 4.38Å; V231-L235 PolarHBondContact O-N 3.49Å
232	R	96.3	Very high	87.6	Confident	81 Å²	81	54.8 Å²	54.8	31%	0.306	29%	0.289	S	S	.	.	H	α-helix	trans	-67.2	-25.7	-179.1	-57.6	171.9	-67.3	-176.6	1.8	111.7	D198 N199 D230 V234 L235 S236	D198-R232 HydrophobicContact CB-CB 4.2Å; D198-R232 HydrophobicContact CB-CG 4.13Å; D198-R232 WeakPolarHBondContact O-CG 3.19Å; N199-R232 WeakPolarHBondContact OD1-CD 3.44Å; D230-R232 PolarHBondContact O-N 3.2Å; D230-R232 WeakPolarHBondContact OD1-CB 3.49Å; D230-R232 WeakPolarHBondContact OD1-CG 3.26Å; D230-R232 IonicContact OD1-CZ 3.85Å; D230-R232 PolarHBondContact OD1-N 3.36Å; D230-R232 IonicContact OD1-NE 2.97Å; D230-R232 PolarHBondContact OD1-NE 2.95Å; D230-R232 IonicContact OD1-NH2 3.85Å; D230-R232 IonicContact OD2-CZ 3.34Å; D230-R232 IonicContact OD2-NE 3.15Å; D230-R232 PolarHBondContact OD2-NE 2.84Å; D230-R232 VanDerWaalsContact OD2-NE 3.15Å; D230-R232 IonicContact OD2-NH2 2.7Å; D230-R232 PolarHBondContact OD2-NH2 3.45Å; R232-V234 PolarHBondContact O-N 3.07Å; R232-V234 VanDerWaalsContact O-N 3.14Å; R232-L235 PolarHBondContact O-N 3.18Å; R232-S236 WeakPolarHBondContact O-CB 3.36Å; R232-S236 PolarHBondContact O-N 2.99Å; R232-S236 PolarHBondContact O-OG 3.33Å
233	S	95	Very high	85.7	Confident	58 Å²	58	65.8 Å²	65.8	41%	0.406	33%	0.33	S	S	.	.	H	α-helix	trans	-60.6	-23	175.1	70.7	0	0	0	0	113.4	D230 V231 R237	D230-S233 WeakPolarHBondContact O-CB 3.35Å; D230-S233 PolarHBondContact O-N 2.85Å; D230-S233 PolarHBondContact O-OG 3Å; V231-S233 PolarHBondContact O-N 2.91Å; S233-R237 PolarHBondContact O-NE 3.03Å; S233-R237 VanDerWaalsContact O-NE 3.1Å
234	V	94.4	Very high	83.6	Confident	52 Å²	52	69.4 Å²	69.4	32%	0.315	35%	0.349	S	S	.	.	H	α-helix	trans	-100.6	-51.6	175.3	179.4	0	0	0	0	110.3	L225 T228 V231 R232 S236 R237	L225-V234 HydrophobicContact CD2-CB 3.76Å; L225-V234 HydrophobicContact CD2-CG1 3.95Å; L225-V234 HydrophobicContact CD2-CG2 4.13Å; T228-V234 HydrophobicContact CG2-CG2 3.8Å; V231-V234 PolarHBondContact O-N 3.09Å; V231-V234 VanDerWaalsContact O-N 3.12Å; R232-V234 PolarHBondContact O-N 3.07Å; R232-V234 VanDerWaalsContact O-N 3.14Å; V234-S236 PolarHBondContact O-N 2.91Å; V234-R237 WeakPolarHBondContact O-CB 3.32Å; V234-R237 PolarHBondContact O-N 3.39Å
235	L	93.7	Very high	81.4	Confident	12 Å²	12	75.3 Å²	75.3	6%	0.063	36%	0.359	C	S	.	.	H	α-helix	trans	-65.3	-37.4	-171.7	-68.1	179.8	0	0	0	113.5	V184 D198 I201 M221 L225 V231 R232 R237 N238	V184-L235 HydrophobicContact CG1-CD1 4.04Å; V184-L235 HydrophobicContact CG2-CD1 4.16Å; D198-L235 VanDerWaalsContact O-CB 3.25Å; D198-L235 WeakPolarHBondContact O-CB 3.25Å; I201-L235 HydrophobicContact CD1-CD2 4.41Å; I201-L235 HydrophobicContact CG1-CD1 4.39Å; I201-L235 HydrophobicContact CG1-CD2 3.77Å; M221-L235 HydrophobicContact SD-CD2 4.2Å; L225-L235 HydrophobicContact CD1-CD1 4.36Å; L225-L235 HydrophobicContact CD1-CD2 4.05Å; L225-L235 HydrophobicContact CD1-CG 4.3Å; L225-L235 HydrophobicContact CD2-CG 4.48Å; V231-L235 HydrophobicContact CB-CD1 4.38Å; V231-L235 HydrophobicContact CG2-CD1 4.38Å; V231-L235 PolarHBondContact O-N 3.49Å; R232-L235 PolarHBondContact O-N 3.18Å; L235-R237 PolarHBondContact O-N 3.31Å; L235-N238 PolarHBondContact O-N 3.42Å; L235-N238 VanDerWaalsContact O-N 3.14Å
236	S	88.4	Confident	80.6	Confident	43 Å²	43	79 Å²	79	30%	0.301	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-62.6	-10.6	177.3	62.2	0	0	0	0	114.3	R232 V234 N238 L239	R232-S236 WeakPolarHBondContact O-CB 3.36Å; R232-S236 PolarHBondContact O-N 2.99Å; R232-S236 PolarHBondContact O-OG 3.33Å; V234-S236 PolarHBondContact O-N 2.91Å; S236-N238 VanDerWaalsContact C-N 3.32Å; S236-L239 WeakPolarHBondContact O-CD1 3.31Å; S236-L239 VanDerWaalsContact O-CG 3.26Å; S236-L239 WeakPolarHBondContact O-CG 3.38Å
237	R	84.6	Confident	79.8	Confident	192 Å²	192	81.3 Å²	81.3	73%	0.725	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-77.4	-18.8	177.6	-60.4	-177.5	179.9	174	-1.5	113	S233 V234 L235	S233-R237 PolarHBondContact O-NE 3.03Å; S233-R237 VanDerWaalsContact O-NE 3.1Å; V234-R237 WeakPolarHBondContact O-CB 3.32Å; V234-R237 PolarHBondContact O-N 3.39Å; L235-R237 PolarHBondContact O-N 3.31Å
238	N	69.1	Low	78.9	Confident	81 Å²	81	82.3 Å²	82.3	43%	0.433	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-107.5	21.6	-175.5	-72.7	-24.2	0	0	0	113.6	L235 S236 H240 Q241	L235-N238 PolarHBondContact O-N 3.42Å; L235-N238 VanDerWaalsContact O-N 3.14Å; S236-N238 VanDerWaalsContact C-N 3.32Å; N238-H240 PolarHBondContact O-N 2.98Å; N238-Q241 WeakPolarHBondContact O-CB 3.34Å; N238-Q241 PolarHBondContact O-N 3.04Å
239	L	65.1	Low	77.9	Confident	67 Å²	67	85.9 Å²	85.9	35%	0.351	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-57.8	-22.1	-173.7	-70.3	170.9	0	0	0	114.7	P197 S236 Q241 H242	P197-L239 HydrophobicContact CB-CD2 4.37Å; S236-L239 WeakPolarHBondContact O-CD1 3.31Å; S236-L239 VanDerWaalsContact O-CG 3.26Å; S236-L239 WeakPolarHBondContact O-CG 3.38Å; L239-Q241 PolarHBondContact O-N 3.22Å; L239-H242 VanDerWaalsContact CA-CD2 3.49Å; L239-H242 WeakPolarHBondContact CA-CD2 3.48Å; L239-H242 VanDerWaalsContact CD2-CD2 3.46Å; L239-H242 WeakPolarHBondContact CD2-CD2 3.29Å; L239-H242 WeakPolarHBondContact CD2-NE2 3.45Å; L239-H242 PolarHBondContact O-CD2 3.37Å; L239-H242 PolarHBondContact O-N 3.1Å
240	H	68.8	Low	76.8	Confident	114 Å²	114	86.5 Å²	86.5	53%	0.528	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-60.3	-27.3	174.4	65.2	-84.8	0	0	0	112.8	N238 H242 R243	N238-H240 PolarHBondContact O-N 2.98Å; H240-H242 VanDerWaalsContact C-N 3.31Å; H240-H242 PolarHBondContact O-N 2.91Å; H240-R243 PolarHBondContact O-N 2.99Å
241	Q	61.4	Low	75.4	Confident	75 Å²	75	89.3 Å²	89.3	35%	0.35	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-69.7	-25.2	177.7	-68.4	-170.3	-31.6	0	0	113.1	P202 N238 L239 R243 L244	P202-Q241 HydrophobicContact CG-CB 4.08Å; N238-Q241 WeakPolarHBondContact O-CB 3.34Å; N238-Q241 PolarHBondContact O-N 3.04Å; L239-Q241 PolarHBondContact O-N 3.22Å; Q241-R243 PolarHBondContact O-N 3.44Å; Q241-R243 VanDerWaalsContact O-N 3.13Å; Q241-L244 PolarHBondContact O-N 3.13Å; Q241-L244 VanDerWaalsContact O-N 3.15Å
242	H	63.4	Low	73.8	Confident	29 Å²	29	95.7 Å²	95.7	13%	0.134	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-67.1	-13.4	177	-57	-64.2	0	0	0	113.6	Y193 P197 L239 H240	Y193-H242 AromaticContact CE2-CE1 3.89Å; Y193-H242 AromaticContact CE2-ND1 3.36Å; Y193-H242 WeakPolarHBondContact CE2-ND1 3.22Å; Y193-H242 AromaticContact CZ-ND1 3.73Å; Y193-H242 PolarHBondContact OH-ND1 3.23Å; P197-H242 PolarHBondContact O-NE2 3.1Å; L239-H242 VanDerWaalsContact CA-CD2 3.49Å; L239-H242 WeakPolarHBondContact CA-CD2 3.48Å; L239-H242 VanDerWaalsContact CD2-CD2 3.46Å; L239-H242 WeakPolarHBondContact CD2-CD2 3.29Å; L239-H242 WeakPolarHBondContact CD2-NE2 3.45Å; L239-H242 PolarHBondContact O-CD2 3.37Å; L239-H242 PolarHBondContact O-N 3.1Å; H240-H242 VanDerWaalsContact C-N 3.31Å; H240-H242 PolarHBondContact O-N 2.91Å
243	R	56.8	Low	72.1	Confident	233 Å²	233	96.8 Å²	96.8	88%	0.879	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-94.2	-7.3	177.6	-61.2	-176.1	-178.8	-179.9	0.3	113.5	H240 Q241	H240-R243 PolarHBondContact O-N 2.99Å; Q241-R243 PolarHBondContact O-N 3.44Å; Q241-R243 VanDerWaalsContact O-N 3.13Å
244	L	50.9	Low	70.2	Confident	119 Å²	119	100.1 Å²	100.1	62%	0.623	45%	0.45	S	S	*	.			trans	-97	-7.2	-170.3	-70.5	174.5	0	0	0	114.1	Q241	Q241-L244 PolarHBondContact O-N 3.13Å; Q241-L244 VanDerWaalsContact O-N 3.15Å
245	W	46	Very low	68	Low	184 Å²	184	104.5 Å²	104.5	70%	0.697	46%	0.462	S	S	*	.			trans	-132.8	0	-171.6	-48.2	99	0	0	0	111.7	P190 K204	P190-W245 WeakPolarHBondContact CG-O 3.4Å; K204-W245 HydrophobicContact CB-CZ3 4.34Å; K204-W245 HydrophobicContact CD-CZ3 4.28Å; K204-W245 HydrophobicContact CG-CE3 4.42Å; K204-W245 HydrophobicContact CG-CZ3 4.13Å

Retrieved 245 of 245 residues in 1274.9 ms (Link to these results)

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