A0A3Q0KTA0_SCHMA Loading...

Protein kinase domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KTA0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 523 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	50.2	Low	54.4	Low	218 Å²	218	123.5 Å²	123.5	100%	1.074	63%	0.633	S	S	*	*				0	-10.6	0	-78	176.6	81.6	0	0	114.2
2	Y	48.2	Very low	53.8	Low	199 Å²	199	126.8 Å²	126.8	78%	0.78	63%	0.634	S	S	*	*	H	α-helix	trans	-81	-15.3	179.8	-77	-79.6	0	0	0	116.1
3	S	53	Low	53.3	Low	83 Å²	83	120.9 Å²	120.9	58%	0.58	61%	0.612	S	S	*	*	H	α-helix	trans	-79.3	-29.3	-176.2	68.6	0	0	0	0	114.3
4	V	55.2	Low	52.4	Low	96 Å²	96	116.4 Å²	116.4	58%	0.582	60%	0.596	S	S	*	*	H	α-helix	trans	-74	-36.7	-174.4	-178.9	0	0	0	0	111.8	I6 W7 V8	V4-I6 VanDerWaalsContact C-N 3.35Å; V4-I6 PolarHBondContact O-N 3.28Å; V4-W7 PolarHBondContact O-N 3.24Å; V4-V8 PolarHBondContact O-N 3.36Å
5	N	52.6	Low	51.9	Low	118 Å²	118	113.5 Å²	113.5	63%	0.631	59%	0.586	S	S	*	*	H	α-helix	trans	-68.4	-32.2	179.6	-77.9	-23	0	0	0	113	V8 V9	N5-V8 PolarHBondContact O-N 3.49Å; N5-V9 WeakPolarHBondContact O-CG2 3.42Å; N5-V9 PolarHBondContact O-N 3.37Å
6	I	58.9	Low	51.2	Low	111 Å²	111	112.1 Å²	112.1	57%	0.569	58%	0.579	S	S	*	*	H	α-helix	trans	-67.1	-39.9	176.7	-68.7	167.8	0	0	0	110.6	V4 V9 V10	V4-I6 VanDerWaalsContact C-N 3.35Å; V4-I6 PolarHBondContact O-N 3.28Å; I6-V9 PolarHBondContact O-N 2.75Å; I6-V10 HydrophobicContact CG2-CG2 4.3Å; I6-V10 VanDerWaalsContact O-CG2 3.3Å; I6-V10 WeakPolarHBondContact O-CG2 3.04Å; I6-V10 PolarHBondContact O-N 3.04Å
7	W	52.7	Low	50.2	Low	176 Å²	176	111.3 Å²	111.3	67%	0.667	58%	0.575	S	S	*	*	H	α-helix	trans	-65.5	-39.8	178.5	-86.6	95.8	0	0	0	112.9	V4 V10 L11	V4-W7 PolarHBondContact O-N 3.24Å; W7-V10 PolarHBondContact O-N 2.87Å; W7-L11 HydrophobicContact CE3-CD1 4.37Å; W7-L11 WeakPolarHBondContact O-CB 3.17Å; W7-L11 PolarHBondContact O-N 3.29Å
8	V	61	Low	49.4	Very low	86 Å²	86	111.3 Å²	111.3	52%	0.521	58%	0.575	S	S	.	*	H	α-helix	trans	-65.1	-43.3	177.4	177.4	0	0	0	0	110.8	V4 N5 L11 Y12	V4-V8 PolarHBondContact O-N 3.36Å; N5-V8 PolarHBondContact O-N 3.49Å; V8-L11 PolarHBondContact O-N 3.28Å; V8-Y12 WeakPolarHBondContact O-CB 3.16Å; V8-Y12 PolarHBondContact O-N 2.83Å
9	V	58.8	Low	48.7	Very low	93 Å²	93	113.6 Å²	113.6	56%	0.564	58%	0.583	S	S	*	*	H	α-helix	trans	-66	-42	178.1	176.3	0	0	0	0	111.3	N5 I6 Y12 S13	N5-V9 WeakPolarHBondContact O-CG2 3.42Å; N5-V9 PolarHBondContact O-N 3.37Å; I6-V9 PolarHBondContact O-N 2.75Å; V9-Y12 PolarHBondContact O-N 2.86Å; V9-S13 VanDerWaalsContact O-CB 3.29Å; V9-S13 WeakPolarHBondContact O-CB 3.38Å; V9-S13 PolarHBondContact O-N 2.8Å; V9-S13 PolarHBondContact O-OG 2.89Å
10	V	55.8	Low	47.9	Very low	72 Å²	72	114.4 Å²	114.4	44%	0.436	59%	0.588	S	S	.	*	H	α-helix	trans	-66.7	-41.5	178	172.7	0	0	0	0	111.5	I6 W7 S13 C14	I6-V10 HydrophobicContact CG2-CG2 4.3Å; I6-V10 VanDerWaalsContact O-CG2 3.3Å; I6-V10 WeakPolarHBondContact O-CG2 3.04Å; I6-V10 PolarHBondContact O-N 3.04Å; W7-V10 PolarHBondContact O-N 2.87Å; V10-S13 PolarHBondContact O-N 3.41Å; V10-C14 VanDerWaalsContact O-CB 3.3Å; V10-C14 WeakPolarHBondContact O-CB 3.04Å; V10-C14 PolarHBondContact O-N 3.2Å; V10-C14 PolarHBondContact O-SG 2.71Å
11	L	51.7	Low	47.1	Very low	106 Å²	106	114.8 Å²	114.8	56%	0.555	59%	0.59	S	S	*	*	H	α-helix	trans	-62.3	-44.6	174.5	-91.7	150.1	0	0	0	111.4	W7 V8 S13 C14 T15	W7-L11 HydrophobicContact CE3-CD1 4.37Å; W7-L11 WeakPolarHBondContact O-CB 3.17Å; W7-L11 PolarHBondContact O-N 3.29Å; V8-L11 PolarHBondContact O-N 3.28Å; L11-S13 VanDerWaalsContact C-N 3.35Å; L11-S13 PolarHBondContact O-N 3.4Å; L11-C14 PolarHBondContact O-N 3.34Å; L11-T15 WeakPolarHBondContact O-CG2 3.45Å; L11-T15 PolarHBondContact O-N 2.87Å; L11-T15 PolarHBondContact O-OG1 2.94Å
12	Y	47.7	Very low	46.4	Very low	164 Å²	164	110 Å²	110	64%	0.643	57%	0.572	S	S	*	*	H	α-helix	trans	-65.5	-39.4	178.1	-139.1	-94.7	0	0	0	111.8	V8 V9 T15 L16	V8-Y12 WeakPolarHBondContact O-CB 3.16Å; V8-Y12 PolarHBondContact O-N 2.83Å; V9-Y12 PolarHBondContact O-N 2.86Å; Y12-T15 WeakPolarHBondContact CA-OG1 3.44Å; Y12-T15 PolarHBondContact O-N 3.34Å; Y12-T15 PolarHBondContact O-OG1 3.07Å; Y12-L16 HydrophobicContact CD1-CD1 3.69Å; Y12-L16 HydrophobicContact CE1-CD1 4Å; Y12-L16 WeakPolarHBondContact O-CB 3.34Å; Y12-L16 PolarHBondContact O-N 2.9Å
13	S	47.7	Very low	46.1	Very low	50 Å²	50	105.1 Å²	105.1	35%	0.35	56%	0.563	S	S	.	*	H	α-helix	trans	-65.8	-44.7	175.6	-52.4	0	0	0	0	111.1	V9 V10 L11 L16 I17	V9-S13 VanDerWaalsContact O-CB 3.29Å; V9-S13 WeakPolarHBondContact O-CB 3.38Å; V9-S13 PolarHBondContact O-N 2.8Å; V9-S13 PolarHBondContact O-OG 2.89Å; V10-S13 PolarHBondContact O-N 3.41Å; L11-S13 VanDerWaalsContact C-N 3.35Å; L11-S13 PolarHBondContact O-N 3.4Å; S13-L16 PolarHBondContact O-N 3.03Å; S13-I17 VanDerWaalsContact O-CB 3.31Å; S13-I17 WeakPolarHBondContact O-CB 3.24Å; S13-I17 WeakPolarHBondContact O-CD1 3.47Å; S13-I17 WeakPolarHBondContact O-CG1 3.49Å; S13-I17 PolarHBondContact O-N 3.14Å
14	C	40.7	Very low	46.1	Very low	58 Å²	58	103.6 Å²	103.6	39%	0.392	55%	0.553	S	S	.	*	H	α-helix	trans	-65.9	-38.4	176.7	-79.6	0	0	0	0	111.4	V10 L11 I17 I18	V10-C14 VanDerWaalsContact O-CB 3.3Å; V10-C14 WeakPolarHBondContact O-CB 3.04Å; V10-C14 PolarHBondContact O-N 3.2Å; V10-C14 PolarHBondContact O-SG 2.71Å; L11-C14 PolarHBondContact O-N 3.34Å; C14-I17 PolarHBondContact O-N 3.12Å; C14-I18 HydrophobicContact CB-CD1 4.41Å; C14-I18 WeakPolarHBondContact O-CB 2.81Å; C14-I18 WeakPolarHBondContact O-CD1 3.44Å; C14-I18 WeakPolarHBondContact O-CG1 3.08Å; C14-I18 PolarHBondContact O-N 3.31Å
15	T	44.6	Very low	46.6	Very low	72 Å²	72	105.3 Å²	105.3	44%	0.442	56%	0.563	S	S	.	*	H	α-helix	trans	-67.1	-38.4	174.7	48.4	0	0	0	0	112.2	L11 Y12 Q19	L11-T15 WeakPolarHBondContact O-CG2 3.45Å; L11-T15 PolarHBondContact O-N 2.87Å; L11-T15 PolarHBondContact O-OG1 2.94Å; Y12-T15 WeakPolarHBondContact CA-OG1 3.44Å; Y12-T15 PolarHBondContact O-N 3.34Å; Y12-T15 PolarHBondContact O-OG1 3.07Å; T15-Q19 WeakPolarHBondContact O-CB 3.48Å; T15-Q19 WeakPolarHBondContact O-CG 3.37Å; T15-Q19 PolarHBondContact O-N 2.89Å
16	L	40.4	Very low	47.8	Very low	91 Å²	91	102 Å²	102	48%	0.476	54%	0.544	S	S	.	.	H	α-helix	trans	-69	-38.6	175	-90.5	154.1	0	0	0	112.5	Y12 S13 N20	Y12-L16 HydrophobicContact CD1-CD1 3.69Å; Y12-L16 HydrophobicContact CE1-CD1 4Å; Y12-L16 WeakPolarHBondContact O-CB 3.34Å; Y12-L16 PolarHBondContact O-N 2.9Å; S13-L16 PolarHBondContact O-N 3.03Å; L16-N20 PolarHBondContact O-N 3.39Å; L16-N20 PolarHBondContact O-ND2 2.96Å
17	I	34.9	Very low	49.1	Very low	99 Å²	99	101.5 Å²	101.5	51%	0.508	54%	0.542	S	S	.	.	H	α-helix	trans	-72.6	-39.7	177.4	-67.8	166.7	0	0	0	110.5	S13 C14 N20 I21	S13-I17 VanDerWaalsContact O-CB 3.31Å; S13-I17 WeakPolarHBondContact O-CB 3.24Å; S13-I17 WeakPolarHBondContact O-CD1 3.47Å; S13-I17 WeakPolarHBondContact O-CG1 3.49Å; S13-I17 PolarHBondContact O-N 3.14Å; C14-I17 PolarHBondContact O-N 3.12Å; I17-N20 PolarHBondContact O-N 3.27Å; I17-I21 HydrophobicContact CG2-CD1 3.59Å; I17-I21 HydrophobicContact CG2-CG1 4.43Å; I17-I21 VanDerWaalsContact O-CG1 3.31Å; I17-I21 WeakPolarHBondContact O-CG1 3.49Å; I17-I21 PolarHBondContact O-N 2.89Å; I17-I21 VanDerWaalsContact O-N 3.17Å
18	I	35.5	Very low	50.8	Low	112 Å²	112	94.6 Å²	94.6	57%	0.574	52%	0.518	S	S	*	.	H	α-helix	trans	-70.4	-38.6	178.5	-67.6	165.6	0	0	0	111.1	C14 N20 I21	C14-I18 HydrophobicContact CB-CD1 4.41Å; C14-I18 WeakPolarHBondContact O-CB 2.81Å; C14-I18 WeakPolarHBondContact O-CD1 3.44Å; C14-I18 WeakPolarHBondContact O-CG1 3.08Å; C14-I18 PolarHBondContact O-N 3.31Å; I18-N20 PolarHBondContact O-N 2.87Å; I18-I21 PolarHBondContact O-N 3.16Å
19	Q	35.2	Very low	52.2	Low	155 Å²	155	93.7 Å²	93.7	72%	0.724	51%	0.512	S	S	*	.	H	α-helix	trans	-63.5	-28.4	173.4	-80.4	-176.7	-25.3	0	0	112.4	T15	T15-Q19 WeakPolarHBondContact O-CB 3.48Å; T15-Q19 WeakPolarHBondContact O-CG 3.37Å; T15-Q19 PolarHBondContact O-N 2.89Å
20	N	32.8	Very low	53.9	Low	129 Å²	129	90.5 Å²	90.5	69%	0.69	49%	0.494	S	S	*	.	H	α-helix	trans	-84	-14	176.2	-81.7	-21.7	0	0	0	114.8	L16 I17 I18	L16-N20 PolarHBondContact O-N 3.39Å; L16-N20 PolarHBondContact O-ND2 2.96Å; I17-N20 PolarHBondContact O-N 3.27Å; I18-N20 PolarHBondContact O-N 2.87Å
21	I	31.7	Very low	55.7	Low	123 Å²	123	94 Å²	94	63%	0.631	50%	0.5	S	S	*	.	H	α-helix	trans	-95.8	-6.6	-172.7	-74.7	175.2	0	0	0	114.3	I17 I18	I17-I21 HydrophobicContact CG2-CD1 3.59Å; I17-I21 HydrophobicContact CG2-CG1 4.43Å; I17-I21 VanDerWaalsContact O-CG1 3.31Å; I17-I21 WeakPolarHBondContact O-CG1 3.49Å; I17-I21 PolarHBondContact O-N 2.89Å; I17-I21 VanDerWaalsContact O-N 3.17Å; I18-I21 PolarHBondContact O-N 3.16Å
22	V	35	Very low	57.7	Low	116 Å²	116	89.3 Å²	89.3	70%	0.703	48%	0.476	S	S	*	.			trans	-125.1	49.2	175.7	-157.8	0	0	0	0	111.7	S24	V22-S24 VanDerWaalsContact C-N 3.27Å; V22-S24 PolarHBondContact O-N 2.81Å
23	V	43.1	Very low	60	Low	98 Å²	98	81.9 Å²	81.9	59%	0.594	45%	0.449	S	S	*	.	S	Bend	trans	-77.5	98	143.3	-174.7	0	0	0	0	103.5	T25	V23-T25 PolarHBondContact O-N 3.12Å
24	S	53	Low	62.1	Low	51 Å²	51	86.4 Å²	86.4	36%	0.357	46%	0.463	S	S	.	.			trans	-49.1	113	171.7	50.1	0	0	0	0	106.4	V22 F26	V22-S24 VanDerWaalsContact C-N 3.27Å; V22-S24 PolarHBondContact O-N 2.81Å; S24-F26 WeakPolarHBondContact O-CD2 3.35Å; S24-F26 PolarHBondContact O-N 2.85Å; S24-F26 VanDerWaalsContact OG-CZ 3.25Å; S24-F26 WeakPolarHBondContact OG-CZ 3.43Å
25	T	65.7	Low	64.6	Low	131 Å²	131	84.3 Å²	84.3	80%	0.804	45%	0.448	S	S	*	.			trans	-66.8	109.2	179.8	41.7	0	0	0	0	106	V23	V23-T25 PolarHBondContact O-N 3.12Å
26	F	77.4	Confident	66.7	Low	50 Å²	50	88 Å²	88	22%	0.219	47%	0.466	C	S	.	.			trans	-78.5	128.9	175.5	-63.2	-71.6	0	0	0	108.3	S24 I28 V45 K46 N47 A199 L200	S24-F26 WeakPolarHBondContact O-CD2 3.35Å; S24-F26 PolarHBondContact O-N 2.85Å; S24-F26 VanDerWaalsContact OG-CZ 3.25Å; S24-F26 WeakPolarHBondContact OG-CZ 3.43Å; F26-I28 HydrophobicContact CB-CG1 4.23Å; F26-V45 HydrophobicContact CB-CG1 3.89Å; F26-V45 HydrophobicContact CD1-CG1 3.82Å; F26-V45 HydrophobicContact CG-CG1 3.96Å; F26-K46 WeakPolarHBondContact CA-O 3.12Å; F26-N47 HydrophobicContact CD1-CB 4.03Å; F26-N47 HydrophobicContact CE1-CB 4.07Å; F26-A199 HydrophobicContact CB-CB 4.4Å; F26-A199 HydrophobicContact CD2-CB 4.32Å; F26-A199 HydrophobicContact CG-CB 4.41Å; F26-L200 HydrophobicContact CE1-CD2 4.2Å; F26-L200 HydrophobicContact CZ-CD1 4.29Å; F26-L200 HydrophobicContact CZ-CD2 4.16Å; F26-L200 HydrophobicContact CZ-CG 4.32Å
27	D	85.6	Confident	68.9	Low	100 Å²	100	89.5 Å²	89.5	54%	0.535	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	120.8	164.8	-173.7	16	0	0	0	108.2	V45 K46	D27-V45 WeakPolarHBondContact O-CA 3.2Å; D27-K46 HydrophobicContact CB-CB 4.49Å; D27-K46 PolarHBondContact N-O 3.33Å; D27-K46 PolarHBondContact O-N 3.13Å
28	I	89.2	Confident	71.5	Confident	31 Å²	31	85 Å²	85	16%	0.159	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	112.4	-175	-53.5	173.3	0	0	0	107.8	F26 I43 S44 V45 I155 K183 A199	F26-I28 HydrophobicContact CB-CG1 4.23Å; I28-I43 HydrophobicContact CG2-CG2 4.23Å; I28-S44 WeakPolarHBondContact CA-O 3.18Å; I28-V45 HydrophobicContact CG1-CG1 4.36Å; I28-V45 HydrophobicContact CG1-CG2 4.14Å; I28-V45 HydrophobicContact CG2-CG2 4.16Å; I28-I155 HydrophobicContact CG2-CD1 3.82Å; I28-K183 HydrophobicContact CD1-CB 3.93Å; I28-K183 HydrophobicContact CD1-CG 4.02Å; I28-A199 HydrophobicContact CD1-CB 3.48Å; I28-A199 VanDerWaalsContact CD1-CB 3.48Å; I28-A199 HydrophobicContact CG1-CB 4.13Å
29	T	90.4	Very high	74.3	Confident	66 Å²	66	81.5 Å²	81.5	41%	0.405	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	156.2	175.7	85.8	0	0	0	0	109.8	I43 S44	T29-I43 CarbonylContact O-C 3.57Å; T29-I43 WeakPolarHBondContact O-CA 3.37Å; T29-S44 PolarHBondContact N-O 2.69Å; T29-S44 PolarHBondContact O-N 2.06Å; T29-S44 PolarHBondContact OG1-OG 3.02Å
30	S	93	Very high	77.2	Confident	26 Å²	26	74.1 Å²	74.1	18%	0.182	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	148	166.5	68.4	0	0	0	0	111.5	Q42 N148	S30-Q42 CarbonylContact C-O 3.34Å; S30-Q42 WeakPolarHBondContact CA-O 3.39Å; S30-Q42 WeakPolarHBondContact CB-O 3.36Å; S30-N148 PolarHBondContact OG-ND2 3.08Å
31	Y	94	Very high	80.3	Confident	145 Å²	145	68.4 Å²	68.4	57%	0.569	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.9	152.2	-178.4	176.5	-101.1	0	0	0	108.6	A33 Q42	Y31-A33 HydrophobicContact CE1-CB 4.05Å; Y31-Q42 PolarHBondContact N-O 3.11Å; Y31-Q42 PolarHBondContact O-N 3.4Å
32	V	94.8	Very high	83.4	Confident	8 Å²	8	62.9 Å²	62.9	5%	0.048	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	119.9	175.3	-172.3	0	0	0	0	107.8	F34 N39 L40 Y41 F146	V32-F34 HydrophobicContact CB-CD2 4.24Å; V32-F34 HydrophobicContact CB-CE1 4.21Å; V32-F34 HydrophobicContact CB-CE2 3.7Å; V32-F34 HydrophobicContact CB-CZ 3.68Å; V32-F34 HydrophobicContact CG1-CD1 3.97Å; V32-F34 HydrophobicContact CG1-CD2 4.25Å; V32-F34 HydrophobicContact CG1-CE1 3.68Å; V32-F34 HydrophobicContact CG1-CE2 3.99Å; V32-F34 HydrophobicContact CG1-CG 4.25Å; V32-F34 HydrophobicContact CG1-CZ 3.69Å; V32-F34 HydrophobicContact CG2-CZ 4.32Å; V32-F34 WeakPolarHBondContact O-CD2 3.44Å; V32-F34 PolarHBondContact O-N 2.63Å; V32-N39 HydrophobicContact CG1-CB 4.11Å; V32-L40 WeakPolarHBondContact CA-O 3.33Å; V32-Y41 HydrophobicContact CB-CD1 4.43Å; V32-Y41 HydrophobicContact CB-CE1 4.48Å; V32-Y41 HydrophobicContact CG1-CD1 4.19Å; V32-Y41 HydrophobicContact CG1-CE1 4.03Å; V32-Y41 HydrophobicContact CG2-CD1 3.46Å; V32-Y41 VanDerWaalsContact CG2-CD1 3.46Å; V32-Y41 HydrophobicContact CG2-CE1 3.57Å; V32-Y41 HydrophobicContact CG2-CG 4.36Å; V32-F146 HydrophobicContact CG2-CD1 4.13Å; V32-F146 HydrophobicContact CG2-CE1 3.63Å; V32-F146 HydrophobicContact CG2-CZ 3.95Å
33	A	94.8	Very high	86.3	Confident	9 Å²	9	57.5 Å²	57.5	7%	0.074	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	102.7	166.5	0	0	0	0	0	107.7	Y31 C35 L40 V79	Y31-A33 HydrophobicContact CE1-CB 4.05Å; A33-C35 PolarHBondContact O-N 2.86Å; A33-L40 HydrophobicContact CB-CB 4.28Å; A33-L40 PolarHBondContact N-O 2.8Å; A33-L40 PolarHBondContact O-N 3.42Å; A33-L40 VanDerWaalsContact O-N 3.08Å; A33-V79 HydrophobicContact CB-CB 4.26Å; A33-V79 HydrophobicContact CB-CG2 3.92Å
34	F	92.9	Very high	88.7	Confident	145 Å²	145	53.3 Å²	53.3	64%	0.636	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80	108.6	175.5	-62.8	-81	0	0	0	109.5	V32 N39	V32-F34 HydrophobicContact CB-CD2 4.24Å; V32-F34 HydrophobicContact CB-CE1 4.21Å; V32-F34 HydrophobicContact CB-CE2 3.7Å; V32-F34 HydrophobicContact CB-CZ 3.68Å; V32-F34 HydrophobicContact CG1-CD1 3.97Å; V32-F34 HydrophobicContact CG1-CD2 4.25Å; V32-F34 HydrophobicContact CG1-CE1 3.68Å; V32-F34 HydrophobicContact CG1-CE2 3.99Å; V32-F34 HydrophobicContact CG1-CG 4.25Å; V32-F34 HydrophobicContact CG1-CZ 3.69Å; V32-F34 HydrophobicContact CG2-CZ 4.32Å; V32-F34 WeakPolarHBondContact O-CD2 3.44Å; V32-F34 PolarHBondContact O-N 2.63Å; F34-N39 WeakPolarHBondContact CA-OD1 3.41Å; F34-N39 WeakPolarHBondContact CD1-OD1 3.47Å
35	C	92.3	Very high	90.6	Very high	13 Å²	13	51.1 Å²	51.1	9%	0.088	27%	0.266	C	S	.	.			trans	-99.1	176.5	165.3	-49.7	0	0	0	0	108.6	A33 T38 C81 D85	A33-C35 PolarHBondContact O-N 2.86Å; C35-T38 CarbonylContact C-O 3.49Å; C35-T38 WeakPolarHBondContact CA-O 3.27Å; C35-T38 WeakPolarHBondContact CB-O 3.33Å; C35-T38 PolarHBondContact N-O 2.78Å; C35-C81 VanDerWaalsContact CA-SG 3.53Å; C35-C81 HydrophobicContact CB-CB 3.57Å; C35-C81 WeakPolarHBondContact CB-SG 3.17Å; C35-C81 WeakPolarHBondContact SG-CA 3.26Å; C35-C81 WeakPolarHBondContact SG-CB 3.41Å; C35-C81 CovalentContact SG-SG 2.06Å; C35-C81 PolarHBondContact SG-SG 3.47Å; C35-D85 WeakPolarHBondContact CB-OD1 3.45Å; C35-D85 WeakPolarHBondContact CB-OD2 3.13Å
36	N	89.8	Confident	91.8	Very high	151 Å²	151	48.6 Å²	48.6	81%	0.807	24%	0.244	S	C	*	.	S	Bend	trans	-65.7	-43.6	-171.8	-71.2	-24.4	0	0	0	112.6	D85	N36-D85 WeakPolarHBondContact CA-OD2 3.25Å; N36-D85 WeakPolarHBondContact CB-OD2 3.37Å; N36-D85 PolarHBondContact N-OD2 3.09Å
37	N	86.1	Confident	92.2	Very high	121 Å²	121	48.4 Å²	48.4	65%	0.647	25%	0.245	S	C	*	.	S	Bend	trans	-114.9	-16.2	-174.2	-62	-31	0	0	0	112.4	D85	N37-D85 PolarHBondContact N-OD1 3.07Å; N37-D85 VanDerWaalsContact N-OD1 3.13Å
38	T	89.1	Confident	92.1	Very high	5 Å²	5	52.4 Å²	52.4	3%	0.031	26%	0.261	C	S	.	.			trans	-136.2	148.1	-171.8	64.5	0	0	0	0	110.9	C35 F84 D85	C35-T38 CarbonylContact C-O 3.49Å; C35-T38 WeakPolarHBondContact CA-O 3.27Å; C35-T38 WeakPolarHBondContact CB-O 3.33Å; C35-T38 PolarHBondContact N-O 2.78Å; T38-F84 WeakPolarHBondContact OG1-CD1 3.45Å; T38-F84 VanDerWaalsContact OG1-CE1 3.28Å; T38-F84 WeakPolarHBondContact OG1-CE1 3.07Å; T38-D85 PolarHBondContact N-OD1 2.59Å; T38-D85 PolarHBondContact OG1-OD1 3.49Å
39	N	94	Very high	91.9	Very high	38 Å²	38	54.1 Å²	54.1	20%	0.203	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	131	177.9	-66.1	-42.1	0	0	0	109	V32 F34 Y41 S57	V32-N39 HydrophobicContact CG1-CB 4.11Å; F34-N39 WeakPolarHBondContact CA-OD1 3.41Å; F34-N39 WeakPolarHBondContact CD1-OD1 3.47Å; N39-Y41 HydrophobicContact CB-CD2 4.48Å; N39-Y41 HydrophobicContact CB-CE2 3.91Å; N39-S57 PolarHBondContact O-OG 2.69Å
40	L	97.2	Very high	91.9	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	111.6	169.1	-177.2	65.8	0	0	0	109.5	V32 A33 Q42 L55 V77 V79 F84 V96 L323	V32-L40 WeakPolarHBondContact CA-O 3.33Å; A33-L40 HydrophobicContact CB-CB 4.28Å; A33-L40 PolarHBondContact N-O 2.8Å; A33-L40 PolarHBondContact O-N 3.42Å; A33-L40 VanDerWaalsContact O-N 3.08Å; L40-Q42 HydrophobicContact CD2-CG 4.3Å; L40-Q42 HydrophobicContact CG-CG 4.14Å; L40-L55 HydrophobicContact CD1-CB 4.24Å; L40-V77 HydrophobicContact CD2-CG1 4.24Å; L40-V79 HydrophobicContact CB-CG2 4.5Å; L40-V79 HydrophobicContact CD2-CG2 3.46Å; L40-V79 VanDerWaalsContact CD2-CG2 3.46Å; L40-F84 HydrophobicContact CB-CE1 4.14Å; L40-F84 HydrophobicContact CB-CZ 4.34Å; L40-V96 HydrophobicContact CD2-CG1 4.02Å; L40-V96 HydrophobicContact CD2-CG2 4.01Å; L40-L323 HydrophobicContact CD1-CD1 3.57Å; L40-L323 HydrophobicContact CD1-CD2 3.67Å; L40-L323 HydrophobicContact CD1-CG 4.28Å
41	Y	97.7	Very high	91.9	Very high	9 Å²	9	52.9 Å²	52.9	4%	0.035	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	132.6	171.4	-65	-95.6	0	0	0	109.6	V32 N39 L55 I56 V143 F146 I157 Y159	V32-Y41 HydrophobicContact CB-CD1 4.43Å; V32-Y41 HydrophobicContact CB-CE1 4.48Å; V32-Y41 HydrophobicContact CG1-CD1 4.19Å; V32-Y41 HydrophobicContact CG1-CE1 4.03Å; V32-Y41 HydrophobicContact CG2-CD1 3.46Å; V32-Y41 VanDerWaalsContact CG2-CD1 3.46Å; V32-Y41 HydrophobicContact CG2-CE1 3.57Å; V32-Y41 HydrophobicContact CG2-CG 4.36Å; N39-Y41 HydrophobicContact CB-CD2 4.48Å; N39-Y41 HydrophobicContact CB-CE2 3.91Å; Y41-L55 WeakPolarHBondContact O-CA 3.17Å; Y41-I56 PolarHBondContact N-O 3.47Å; Y41-I56 PolarHBondContact O-N 2.83Å; Y41-V143 HydrophobicContact CE2-CG2 4.15Å; Y41-V143 VanDerWaalsContact OH-CG1 3.23Å; Y41-V143 WeakPolarHBondContact OH-CG1 3.41Å; Y41-V143 VanDerWaalsContact OH-CG2 3.29Å; Y41-V143 WeakPolarHBondContact OH-CG2 3.16Å; Y41-F146 AromaticContact CD1-CD2 3.83Å; Y41-F146 HydrophobicContact CD1-CD2 3.83Å; Y41-F146 AromaticContact CD1-CE2 3.9Å; Y41-F146 HydrophobicContact CD1-CE2 3.9Å; Y41-F146 HydrophobicContact CD1-CG 4.17Å; Y41-F146 HydrophobicContact CD1-CZ 4.3Å; Y41-F146 HydrophobicContact CE1-CB 3.86Å; Y41-F146 AromaticContact CE1-CD1 3.99Å; Y41-F146 HydrophobicContact CE1-CD1 3.99Å; Y41-F146 AromaticContact CE1-CD2 3.68Å; Y41-F146 HydrophobicContact CE1-CD2 3.68Å; Y41-F146 HydrophobicContact CE1-CE1 4.44Å; Y41-F146 HydrophobicContact CE1-CE2 4.16Å; Y41-F146 AromaticContact CE1-CG 3.57Å; Y41-F146 HydrophobicContact CE1-CG 3.57Å; Y41-I157 HydrophobicContact CD1-CD1 3.81Å; Y41-I157 HydrophobicContact CD1-CG1 3.78Å; Y41-I157 HydrophobicContact CD1-CG2 4.28Å; Y41-I157 HydrophobicContact CD2-CG2 4.09Å; Y41-I157 HydrophobicContact CE1-CG1 4.27Å; Y41-I157 HydrophobicContact CE1-CG2 4.27Å; Y41-I157 HydrophobicContact CE2-CG2 4.05Å; Y41-I157 HydrophobicContact CG-CD1 3.7Å; Y41-I157 HydrophobicContact CG-CG1 4.07Å; Y41-I157 HydrophobicContact CG-CG2 4.2Å; Y41-Y159 WeakPolarHBondContact CD2-OH 3.37Å; Y41-Y159 AromaticContact CE2-CZ 3.93Å; Y41-Y159 WeakPolarHBondContact CE2-OH 3.39Å
42	Q	96.9	Very high	92	Very high	8 Å²	8	46.5 Å²	46.5	4%	0.037	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	116.5	-176.8	-49.8	176.9	14.5	0	0	107.4	S30 Y31 L40 W53 L55 V77	S30-Q42 CarbonylContact C-O 3.34Å; S30-Q42 WeakPolarHBondContact CA-O 3.39Å; S30-Q42 WeakPolarHBondContact CB-O 3.36Å; Y31-Q42 PolarHBondContact N-O 3.11Å; Y31-Q42 PolarHBondContact O-N 3.4Å; L40-Q42 HydrophobicContact CD2-CG 4.3Å; L40-Q42 HydrophobicContact CG-CG 4.14Å; Q42-W53 HydrophobicContact CB-CE3 4.34Å; Q42-W53 HydrophobicContact CB-CZ3 4.23Å; Q42-L55 HydrophobicContact CB-CD2 4.15Å; Q42-L55 HydrophobicContact CG-CD2 4.01Å; Q42-V77 HydrophobicContact CG-CG1 4.45Å
43	I	95.5	Very high	92.1	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.015	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	120.3	172	-54.8	171.5	0	0	0	106.8	I28 T29 W53 F54 I56 I155 I157 V181	I28-I43 HydrophobicContact CG2-CG2 4.23Å; T29-I43 CarbonylContact O-C 3.57Å; T29-I43 WeakPolarHBondContact O-CA 3.37Å; I43-W53 CarbonylContact O-C 3.55Å; I43-W53 WeakPolarHBondContact O-CA 3.17Å; I43-F54 HydrophobicContact CB-CB 4.15Å; I43-F54 HydrophobicContact CB-CD2 4.09Å; I43-F54 HydrophobicContact CG2-CD2 4.14Å; I43-F54 PolarHBondContact N-O 3.47Å; I43-F54 PolarHBondContact O-N 3.35Å; I43-I56 HydrophobicContact CD1-CD1 4.38Å; I43-I155 HydrophobicContact CD1-CB 4.28Å; I43-I155 HydrophobicContact CD1-CG2 3.78Å; I43-I155 HydrophobicContact CG1-CG2 4.27Å; I43-I155 HydrophobicContact CG2-CD1 3.95Å; I43-I157 HydrophobicContact CD1-CD1 4.16Å; I43-V181 HydrophobicContact CD1-CB 4.24Å; I43-V181 HydrophobicContact CD1-CG2 3.66Å; I43-V181 HydrophobicContact CG2-CG1 4.47Å
44	S	94.3	Very high	92.2	Very high	10 Å²	10	46.9 Å²	46.9	7%	0.07	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	129.2	176.7	73.1	0	0	0	0	109.7	I28 T29 L52	I28-S44 WeakPolarHBondContact CA-O 3.18Å; T29-S44 PolarHBondContact N-O 2.69Å; T29-S44 PolarHBondContact O-N 2.06Å; T29-S44 PolarHBondContact OG1-OG 3.02Å; S44-L52 CarbonylContact C-O 3.59Å; S44-L52 WeakPolarHBondContact CA-O 3.46Å
45	V	92.3	Very high	92.5	Very high	4 Å²	4	40 Å²	40	2%	0.024	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	105.3	171.6	177.7	0	0	0	0	107.2	F26 D27 I28 L52 F54 A199	F26-V45 HydrophobicContact CB-CG1 3.89Å; F26-V45 HydrophobicContact CD1-CG1 3.82Å; F26-V45 HydrophobicContact CG-CG1 3.96Å; D27-V45 WeakPolarHBondContact O-CA 3.2Å; I28-V45 HydrophobicContact CG1-CG1 4.36Å; I28-V45 HydrophobicContact CG1-CG2 4.14Å; I28-V45 HydrophobicContact CG2-CG2 4.16Å; V45-L52 HydrophobicContact CB-CB 4.27Å; V45-L52 PolarHBondContact N-O 3.15Å; V45-L52 PolarHBondContact O-N 3.45Å; V45-F54 HydrophobicContact CG2-CD2 4.48Å; V45-F54 HydrophobicContact CG2-CE2 3.89Å; V45-A199 HydrophobicContact CB-CB 4.37Å; V45-A199 HydrophobicContact CG1-CB 3.47Å; V45-A199 VanDerWaalsContact CG1-CB 3.47Å; V45-A199 HydrophobicContact CG2-CB 4.01Å; V45-A199 WeakPolarHBondContact CG2-O 3.25Å
46	K	90.6	Very high	92.7	Very high	78 Å²	78	39.4 Å²	39.4	34%	0.339	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	133.5	-171.7	-175.2	171.4	-178.2	-178.9	0	110.5	F26 D27 T51	F26-K46 WeakPolarHBondContact CA-O 3.12Å; D27-K46 HydrophobicContact CB-CB 4.49Å; D27-K46 PolarHBondContact N-O 3.33Å; D27-K46 PolarHBondContact O-N 3.13Å; K46-T51 HydrophobicContact CB-CG2 4.33Å
47	N	86.5	Confident	93.1	Very high	46 Å²	46	32.2 Å²	32.2	25%	0.246	16%	0.162	C	C	.	.			trans	-114.3	-170.2	161.3	71.7	21.3	0	0	0	109.4	F26 T49 H50	F26-N47 HydrophobicContact CD1-CB 4.03Å; F26-N47 HydrophobicContact CE1-CB 4.07Å; N47-T49 PolarHBondContact O-N 2.65Å; N47-T49 VanDerWaalsContact O-N 3.15Å; N47-T49 PolarHBondContact OD1-N 3.11Å; N47-T49 PolarHBondContact OD1-OG1 3.43Å; N47-H50 PolarHBondContact N-O 3.28Å; N47-H50 PolarHBondContact OD1-N 3.02Å; N47-H50 PolarHBondContact OD1-O 3.28Å
48	E	81.9	Confident	93.5	Very high	184 Å²	184	26.7 Å²	26.7	86%	0.86	13%	0.133	S	C	*	.	S	Bend	trans	-61.6	-21.7	-177.4	-63.6	-177.1	170.1	0	0	114.5
49	T	85.5	Confident	93.7	Very high	68 Å²	68	26.9 Å²	26.9	42%	0.417	13%	0.134	S	C	.	.	S	Bend	trans	-126	-26.8	-167.6	51.5	0	0	0	0	114.3	N47 E73	N47-T49 PolarHBondContact O-N 2.65Å; N47-T49 VanDerWaalsContact O-N 3.15Å; N47-T49 PolarHBondContact OD1-N 3.11Å; N47-T49 PolarHBondContact OD1-OG1 3.43Å; T49-E73 WeakPolarHBondContact O-CG 3.35Å; T49-E73 PolarHBondContact O-N 2.79Å; T49-E73 VanDerWaalsContact O-N 3.09Å
50	H	90.7	Very high	93.3	Very high	62 Å²	62	28.2 Å²	28.2	29%	0.287	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	151.1	-171.9	-60.6	86.5	0	0	0	110.7	N47 Q70 T71	N47-H50 PolarHBondContact N-O 3.28Å; N47-H50 PolarHBondContact OD1-N 3.02Å; N47-H50 PolarHBondContact OD1-O 3.28Å; H50-Q70 HydrophobicContact CB-CG 4.43Å; H50-T71 WeakPolarHBondContact CA-O 3.45Å
51	T	93.8	Very high	92.7	Very high	4 Å²	4	33.4 Å²	33.4	3%	0.025	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	124.4	170.2	-52.7	0	0	0	0	108.8	K46 W53 T71 E73	K46-T51 HydrophobicContact CB-CG2 4.33Å; T51-W53 HydrophobicContact CG2-CD2 4.34Å; T51-W53 HydrophobicContact CG2-CZ2 3.99Å; T51-T71 WeakPolarHBondContact CB-OG1 3.33Å; T51-T71 PolarHBondContact N-O 2.9Å; T51-T71 PolarHBondContact O-N 3.04Å; T51-T71 PolarHBondContact O-OG1 3.15Å; T51-E73 PolarHBondContact OG1-O 3.08Å
52	L	94.6	Very high	92.3	Very high	10 Å²	10	33.1 Å²	33.1	5%	0.052	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	125.9	168.1	170.9	56.6	0	0	0	109	S44 V45 F54 L68 I69 L200 I376	S44-L52 CarbonylContact C-O 3.59Å; S44-L52 WeakPolarHBondContact CA-O 3.46Å; V45-L52 HydrophobicContact CB-CB 4.27Å; V45-L52 PolarHBondContact N-O 3.15Å; V45-L52 PolarHBondContact O-N 3.45Å; L52-F54 HydrophobicContact CD2-CE1 4.31Å; L52-F54 HydrophobicContact CD2-CE2 3.84Å; L52-F54 HydrophobicContact CD2-CZ 3.55Å; L52-F54 HydrophobicContact CG-CE2 3.96Å; L52-F54 HydrophobicContact CG-CZ 4.05Å; L52-L68 HydrophobicContact CD1-CB 4.42Å; L52-I69 CarbonylContact C-O 3.6Å; L52-I69 WeakPolarHBondContact CA-O 3.36Å; L52-L200 HydrophobicContact CD2-CD2 4.19Å; L52-I376 HydrophobicContact CD1-CD1 4.31Å; L52-I376 HydrophobicContact CD1-CG1 3.59Å; L52-I376 HydrophobicContact CD2-CB 4.24Å; L52-I376 HydrophobicContact CD2-CG1 3.96Å; L52-I376 HydrophobicContact CG-CG1 4.43Å
53	W	97	Very high	92.2	Very high	26 Å²	26	32.8 Å²	32.8	10%	0.098	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	131.5	174	-63.8	87.3	0	0	0	110.9	Q42 I43 T51 L55 L68 I69 T71 S75 V77 I98	Q42-W53 HydrophobicContact CB-CE3 4.34Å; Q42-W53 HydrophobicContact CB-CZ3 4.23Å; I43-W53 CarbonylContact O-C 3.55Å; I43-W53 WeakPolarHBondContact O-CA 3.17Å; T51-W53 HydrophobicContact CG2-CD2 4.34Å; T51-W53 HydrophobicContact CG2-CZ2 3.99Å; W53-L55 HydrophobicContact CB-CD2 4.2Å; W53-L55 HydrophobicContact CB-CG 4.45Å; W53-L55 HydrophobicContact CE3-CD2 4.43Å; W53-L68 CarbonylContact O-C 3.45Å; W53-L68 WeakPolarHBondContact O-CA 3.49Å; W53-I69 HydrophobicContact CB-CB 4.27Å; W53-I69 PolarHBondContact N-O 3.04Å; W53-I69 PolarHBondContact O-N 2.84Å; W53-T71 PolarHBondContact NE1-OG1 2.86Å; W53-S75 WeakPolarHBondContact CZ2-O 3.43Å; W53-S75 PolarHBondContact NE1-OG 3.08Å; W53-V77 HydrophobicContact CD2-CG2 3.74Å; W53-V77 HydrophobicContact CE3-CG2 3.68Å; W53-V77 HydrophobicContact CG-CG2 4.3Å; W53-V77 HydrophobicContact CH2-CG2 4.28Å; W53-V77 HydrophobicContact CZ2-CG2 4.34Å; W53-V77 HydrophobicContact CZ3-CG2 3.95Å; W53-I98 HydrophobicContact CB-CD1 4.42Å; W53-I98 HydrophobicContact CD2-CD1 4.47Å; W53-I98 HydrophobicContact CG-CD1 3.91Å
54	F	97.6	Very high	92.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	112.9	159.9	-52.1	-91.8	0	0	0	107.9	I43 V45 L52 L66 I67 L68 V181 A199 I202	I43-F54 HydrophobicContact CB-CB 4.15Å; I43-F54 HydrophobicContact CB-CD2 4.09Å; I43-F54 HydrophobicContact CG2-CD2 4.14Å; I43-F54 PolarHBondContact N-O 3.47Å; I43-F54 PolarHBondContact O-N 3.35Å; V45-F54 HydrophobicContact CG2-CD2 4.48Å; V45-F54 HydrophobicContact CG2-CE2 3.89Å; L52-F54 HydrophobicContact CD2-CE1 4.31Å; L52-F54 HydrophobicContact CD2-CE2 3.84Å; L52-F54 HydrophobicContact CD2-CZ 3.55Å; L52-F54 HydrophobicContact CG-CE2 3.96Å; L52-F54 HydrophobicContact CG-CZ 4.05Å; F54-L66 HydrophobicContact CB-CD1 4.26Å; F54-L66 HydrophobicContact CD1-CD1 4.37Å; F54-I67 WeakPolarHBondContact CA-O 3.25Å; F54-L68 HydrophobicContact CD1-CD2 4.1Å; F54-L68 HydrophobicContact CD1-CG 4.13Å; F54-L68 HydrophobicContact CE1-CD2 3.71Å; F54-L68 HydrophobicContact CE1-CG 4.24Å; F54-V181 HydrophobicContact CD2-CG2 4.21Å; F54-V181 HydrophobicContact CE2-CG1 4.3Å; F54-V181 HydrophobicContact CE2-CG2 4.35Å; F54-V181 HydrophobicContact CG-CG2 4.38Å; F54-A199 WeakPolarHBondContact CE2-O 3.16Å; F54-A199 WeakPolarHBondContact CZ-O 3.31Å; F54-I202 HydrophobicContact CB-CD1 4.49Å; F54-I202 HydrophobicContact CD1-CB 3.93Å; F54-I202 HydrophobicContact CD1-CD1 4.16Å; F54-I202 HydrophobicContact CD1-CG2 3.82Å; F54-I202 HydrophobicContact CE1-CB 3.79Å; F54-I202 HydrophobicContact CE1-CG2 3.78Å; F54-I202 HydrophobicContact CG-CD1 4.49Å
55	L	98.4	Very high	92.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	121.9	175	-53.5	-171.8	0	0	0	108.9	L40 Y41 Q42 W53 L66 I67 I69 V77 V96 L323	L40-L55 HydrophobicContact CD1-CB 4.24Å; Y41-L55 WeakPolarHBondContact O-CA 3.17Å; Q42-L55 HydrophobicContact CB-CD2 4.15Å; Q42-L55 HydrophobicContact CG-CD2 4.01Å; W53-L55 HydrophobicContact CB-CD2 4.2Å; W53-L55 HydrophobicContact CB-CG 4.45Å; W53-L55 HydrophobicContact CE3-CD2 4.43Å; L55-L66 CarbonylContact O-C 3.59Å; L55-L66 WeakPolarHBondContact O-CA 3.36Å; L55-I67 HydrophobicContact CB-CB 4.3Å; L55-I67 PolarHBondContact N-O 2.72Å; L55-I67 PolarHBondContact O-N 3.07Å; L55-I69 HydrophobicContact CD1-CD1 3.57Å; L55-I69 HydrophobicContact CG-CD1 4.21Å; L55-V77 HydrophobicContact CD1-CG1 4.39Å; L55-V77 HydrophobicContact CD2-CG1 4.25Å; L55-V77 HydrophobicContact CD2-CG2 4.03Å; L55-V96 HydrophobicContact CD1-CG1 4.4Å; L55-L323 HydrophobicContact CB-CD2 3.8Å; L55-L323 WeakPolarHBondContact O-CD2 3.02Å
56	I	98.2	Very high	92.7	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	129.9	-173.5	-59.3	156.1	0	0	0	109.2	Y41 I43 S65 L66 I157 Y159 F179 I202	Y41-I56 PolarHBondContact N-O 3.47Å; Y41-I56 PolarHBondContact O-N 2.83Å; I43-I56 HydrophobicContact CD1-CD1 4.38Å; I56-S65 WeakPolarHBondContact CA-O 3.37Å; I56-L66 HydrophobicContact CD1-CD1 4.29Å; I56-L66 HydrophobicContact CG1-CD1 3.64Å; I56-I157 HydrophobicContact CB-CD1 4.39Å; I56-I157 HydrophobicContact CD1-CD1 3.6Å; I56-Y159 HydrophobicContact CG2-CE2 3.95Å; I56-F179 HydrophobicContact CD1-CB 3.92Å; I56-F179 HydrophobicContact CD1-CD1 4.17Å; I56-F179 HydrophobicContact CD1-CG 4.04Å; I56-F179 HydrophobicContact CG1-CD1 4.32Å; I56-F179 HydrophobicContact CG1-CG 4.48Å; I56-F179 HydrophobicContact CG2-CD1 4.31Å; I56-F179 HydrophobicContact CG2-CD2 3.71Å; I56-F179 HydrophobicContact CG2-CE1 4.28Å; I56-F179 HydrophobicContact CG2-CE2 3.67Å; I56-F179 HydrophobicContact CG2-CG 4.03Å; I56-F179 HydrophobicContact CG2-CZ 3.95Å; I56-I202 HydrophobicContact CD1-CD1 3.66Å
57	S	97	Very high	93.1	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.007	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	141.9	177.5	-179.4	0	0	0	0	111	N39 P64 S65	N39-S57 PolarHBondContact O-OG 2.69Å; S57-P64 WeakPolarHBondContact O-CA 2.84Å; S57-S65 PolarHBondContact N-O 3.34Å; S57-S65 PolarHBondContact O-N 2.82Å
58	A	95.2	Very high	93.6	Very high	5 Å²	5	26.2 Å²	26.2	4%	0.041	13%	0.125	C	C	.	.			trans	-152.1	150.3	165.8	0	0	0	0	0	109.1	P64 W141 Y159	A58-P64 HydrophobicContact CB-CB 3.85Å; A58-P64 HydrophobicContact CB-CG 3.86Å; A58-W141 HydrophobicContact CB-CB 4Å; A58-W141 HydrophobicContact CB-CG 4.15Å; A58-Y159 HydrophobicContact CB-CD1 3.73Å; A58-Y159 HydrophobicContact CB-CD2 4.24Å; A58-Y159 HydrophobicContact CB-CE1 3.68Å; A58-Y159 HydrophobicContact CB-CE2 4.21Å; A58-Y159 HydrophobicContact CB-CG 3.99Å; A58-Y159 PolarHBondContact N-OH 2.86Å; A58-Y159 WeakPolarHBondContact O-CE1 3.43Å
59	S	92.8	Very high	94.3	Very high	8 Å²	8	17.4 Å²	17.4	6%	0.056	8%	0.084	C	C	.	.			trans	-156.2	-177.6	174.5	73.2	0	0	0	0	110.6	Y61 H62 W141	S59-Y61 PolarHBondContact O-N 2.89Å; S59-Y61 VanDerWaalsContact O-N 3.13Å; S59-H62 PolarHBondContact N-O 3.47Å; S59-H62 VanDerWaalsContact N-O 3.1Å; S59-H62 PolarHBondContact O-N 2.99Å; S59-H62 VanDerWaalsContact O-O 3.13Å; S59-H62 VanDerWaalsContact OG-CB 3.23Å; S59-H62 WeakPolarHBondContact OG-CB 3Å; S59-H62 PolarHBondContact OG-N 2.75Å; S59-W141 CarbonylContact C-O 3.51Å
60	E	86.6	Confident	94.8	Very high	66 Å²	66	15.7 Å²	15.7	31%	0.308	7%	0.071	S	C	.	.	S	Bend	trans	-50.6	-35.6	177.9	-177.5	176.8	158.4	0	0	113.9	N140 L165	E60-N140 WeakPolarHBondContact CB-OD1 3.47Å; E60-N140 HydrophobicContact CG-CB 4.43Å; E60-N140 WeakPolarHBondContact CG-OD1 3.12Å; E60-L165 HydrophobicContact CG-CD1 4Å; E60-L165 HydrophobicContact CG-CD2 4.2Å; E60-L165 WeakPolarHBondContact O-CD1 3.25Å
61	Y	82.8	Confident	95	Very high	110 Å²	110	12.8 Å²	12.8	43%	0.431	6%	0.057	S	C	.	.	S	Bend	trans	-113.7	-8.4	-178.4	-56.4	-66.2	0	0	0	113.5	S59 L165	S59-Y61 PolarHBondContact O-N 2.89Å; S59-Y61 VanDerWaalsContact O-N 3.13Å; Y61-L165 HydrophobicContact CD1-CD1 3.83Å; Y61-L165 HydrophobicContact CE1-CD1 3.62Å
62	H	90.6	Very high	94.8	Very high	3 Å²	3	15.4 Å²	15.4	1%	0.014	7%	0.074	C	C	.	.	S	Bend	trans	-109.3	118.4	-173	-61.6	-174.2	0	0	0	109.4	S59 F84 Y92 F321	S59-H62 PolarHBondContact N-O 3.47Å; S59-H62 VanDerWaalsContact N-O 3.1Å; S59-H62 PolarHBondContact O-N 2.99Å; S59-H62 VanDerWaalsContact O-O 3.13Å; S59-H62 VanDerWaalsContact OG-CB 3.23Å; S59-H62 WeakPolarHBondContact OG-CB 3Å; S59-H62 PolarHBondContact OG-N 2.75Å; H62-F84 PolarHBondContact CE1-O 3.3Å; H62-Y92 AromaticContact CE1-CE2 3.41Å; H62-Y92 VanDerWaalsContact CE1-CE2 3.41Å; H62-Y92 WeakPolarHBondContact CE1-CE2 3.5Å; H62-Y92 AromaticContact CE1-CZ 3.9Å; H62-Y92 AromaticContact ND1-CE2 3.96Å; H62-F321 WeakPolarHBondContact CB-O 3.44Å; H62-F321 VanDerWaalsContact CD2-CB 3.46Å; H62-F321 WeakPolarHBondContact CD2-CB 3.43Å; H62-F321 VanDerWaalsContact CG-O 3.27Å
63	P	94.2	Very high	93.8	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.096	C	C	.	.			trans	-65.2	144.6	-179.2	29.2	-33.8	0	0	0	110.1	S65 I108	P63-S65 PolarHBondContact O-N 3.24Å; P63-S65 VanDerWaalsContact O-N 3.15Å; P63-S65 PolarHBondContact O-OG 3.04Å; P63-I108 HydrophobicContact CB-CG2 3.65Å; P63-I108 HydrophobicContact CG-CG2 3.7Å
64	P	96.8	Very high	93	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.013	13%	0.125	C	C	.	.			trans	-59.3	124.8	-179.2	-20.9	30.7	0	0	0	110.8	S57 A58 I108 L109 W141 L177	S57-P64 WeakPolarHBondContact O-CA 2.84Å; A58-P64 HydrophobicContact CB-CB 3.85Å; A58-P64 HydrophobicContact CB-CG 3.86Å; P64-I108 WeakPolarHBondContact O-CA 3.46Å; P64-L109 HydrophobicContact CB-CB 4.36Å; P64-L109 HydrophobicContact CG-CB 4.47Å; P64-L109 HydrophobicContact CG-CD2 4.48Å; P64-L109 PolarHBondContact O-N 2.84Å; P64-W141 VanDerWaalsContact CD-NE1 3.26Å; P64-W141 HydrophobicContact CG-CD2 3.67Å; P64-W141 HydrophobicContact CG-CE3 4.3Å; P64-W141 HydrophobicContact CG-CG 4.06Å; P64-W141 HydrophobicContact CG-CH2 4.11Å; P64-W141 HydrophobicContact CG-CZ2 3.49Å; P64-W141 VanDerWaalsContact CG-CZ2 3.49Å; P64-W141 HydrophobicContact CG-CZ3 4.49Å; P64-L177 HydrophobicContact CB-CD2 3.28Å; P64-L177 HydrophobicContact CG-CD2 3.9Å
65	S	97.9	Very high	92.8	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	141.8	-171.8	-58.1	0	0	0	0	110.2	I56 S57 P63 L107 L323	I56-S65 WeakPolarHBondContact CA-O 3.37Å; S57-S65 PolarHBondContact N-O 3.34Å; S57-S65 PolarHBondContact O-N 2.82Å; P63-S65 PolarHBondContact O-N 3.24Å; P63-S65 VanDerWaalsContact O-N 3.15Å; P63-S65 PolarHBondContact O-OG 3.04Å; S65-L107 WeakPolarHBondContact CA-O 3.21Å; S65-L323 VanDerWaalsContact CB-CB 3.46Å; S65-L323 PolarHBondContact OG-N 3.09Å
66	L	98.4	Very high	92.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	133.2	172.1	165.3	68.4	0	0	0	108.7	F54 L55 I56 L68 G106 L107 F179 I202 I204 A374	F54-L66 HydrophobicContact CB-CD1 4.26Å; F54-L66 HydrophobicContact CD1-CD1 4.37Å; L55-L66 CarbonylContact O-C 3.59Å; L55-L66 WeakPolarHBondContact O-CA 3.36Å; I56-L66 HydrophobicContact CD1-CD1 4.29Å; I56-L66 HydrophobicContact CG1-CD1 3.64Å; L66-L68 HydrophobicContact CD2-CD1 4.07Å; L66-L68 HydrophobicContact CG-CD1 4.12Å; L66-G106 CarbonylContact O-C 3.6Å; L66-G106 WeakPolarHBondContact O-CA 3.11Å; L66-L107 HydrophobicContact CB-CD1 4.42Å; L66-L107 HydrophobicContact CB-CG 4.25Å; L66-L107 HydrophobicContact CD2-CD2 4.25Å; L66-L107 HydrophobicContact CD2-CG 4.5Å; L66-L107 PolarHBondContact N-O 2.75Å; L66-L107 PolarHBondContact O-N 3.37Å; L66-F179 HydrophobicContact CB-CE1 4.06Å; L66-I202 HydrophobicContact CD1-CD1 4.11Å; L66-I202 HydrophobicContact CD1-CG2 4.45Å; L66-I202 HydrophobicContact CD2-CG2 3.62Å; L66-I204 HydrophobicContact CD2-CD1 4.01Å; L66-I204 HydrophobicContact CD2-CG1 4.38Å; L66-A374 HydrophobicContact CD2-CB 4.1Å
67	I	98.3	Very high	92.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	125.8	168	-39.1	-164.3	0	0	0	109.1	F54 L55 I69 Y105 F227 L323 P324 L327	F54-I67 WeakPolarHBondContact CA-O 3.25Å; L55-I67 HydrophobicContact CB-CB 4.3Å; L55-I67 PolarHBondContact N-O 2.72Å; L55-I67 PolarHBondContact O-N 3.07Å; I67-I69 HydrophobicContact CB-CD1 4.48Å; I67-I69 HydrophobicContact CB-CG1 4.28Å; I67-I69 HydrophobicContact CG2-CD1 3.91Å; I67-I69 HydrophobicContact CG2-CG1 3.52Å; I67-Y105 CarbonylContact C-O 3.57Å; I67-Y105 WeakPolarHBondContact CA-O 3.42Å; I67-Y105 WeakPolarHBondContact CG2-O 3.35Å; I67-F227 HydrophobicContact CB-CZ 4.45Å; I67-F227 HydrophobicContact CD1-CZ 4.26Å; I67-F227 HydrophobicContact CG1-CZ 3.95Å; I67-F227 HydrophobicContact CG2-CE2 4.18Å; I67-F227 HydrophobicContact CG2-CZ 4.25Å; I67-L323 HydrophobicContact CD1-CB 4.32Å; I67-L323 HydrophobicContact CD1-CD2 4.21Å; I67-L323 HydrophobicContact CD1-CG 3.75Å; I67-L323 HydrophobicContact CG1-CB 4.48Å; I67-L323 HydrophobicContact CG1-CD2 3.87Å; I67-L323 HydrophobicContact CG1-CG 3.96Å; I67-P324 HydrophobicContact CD1-CB 4.37Å; I67-P324 HydrophobicContact CD1-CG 4.15Å; I67-L327 HydrophobicContact CD1-CB 4.18Å; I67-L327 HydrophobicContact CD1-CD2 3.69Å; I67-L327 HydrophobicContact CG2-CD2 4.22Å
68	L	97.6	Very high	92.4	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	122.9	165.8	-55.1	92.9	0	0	0	107.7	L52 W53 F54 L66 S104 Y105 A374 I376	L52-L68 HydrophobicContact CD1-CB 4.42Å; W53-L68 CarbonylContact O-C 3.45Å; W53-L68 WeakPolarHBondContact O-CA 3.49Å; F54-L68 HydrophobicContact CD1-CD2 4.1Å; F54-L68 HydrophobicContact CD1-CG 4.13Å; F54-L68 HydrophobicContact CE1-CD2 3.71Å; F54-L68 HydrophobicContact CE1-CG 4.24Å; L66-L68 HydrophobicContact CD2-CD1 4.07Å; L66-L68 HydrophobicContact CG-CD1 4.12Å; L68-S104 CarbonylContact O-C 3.59Å; L68-S104 WeakPolarHBondContact O-CA 3.41Å; L68-S104 WeakPolarHBondContact O-CB 3.16Å; L68-Y105 PolarHBondContact N-O 2.91Å; L68-Y105 PolarHBondContact O-N 2.83Å; L68-A374 HydrophobicContact CD1-CB 4.05Å; L68-A374 HydrophobicContact CD2-CB 4.33Å; L68-I376 HydrophobicContact CB-CD1 4.04Å; L68-I376 HydrophobicContact CB-CG1 4.26Å; L68-I376 HydrophobicContact CD2-CD1 4.49Å; L68-I376 HydrophobicContact CD2-CG1 4.07Å
69	I	96.6	Very high	92.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	119.6	-179.2	-47.7	179.4	0	0	0	109.2	L52 W53 L55 I67 T71 I98 A101 L327	L52-I69 CarbonylContact C-O 3.6Å; L52-I69 WeakPolarHBondContact CA-O 3.36Å; W53-I69 HydrophobicContact CB-CB 4.27Å; W53-I69 PolarHBondContact N-O 3.04Å; W53-I69 PolarHBondContact O-N 2.84Å; L55-I69 HydrophobicContact CD1-CD1 3.57Å; L55-I69 HydrophobicContact CG-CD1 4.21Å; I67-I69 HydrophobicContact CB-CD1 4.48Å; I67-I69 HydrophobicContact CB-CG1 4.28Å; I67-I69 HydrophobicContact CG2-CD1 3.91Å; I67-I69 HydrophobicContact CG2-CG1 3.52Å; I69-T71 HydrophobicContact CG2-CG2 3.94Å; I69-I98 HydrophobicContact CB-CD1 4.24Å; I69-I98 HydrophobicContact CD1-CD1 4.09Å; I69-I98 HydrophobicContact CD1-CG2 4.12Å; I69-I98 HydrophobicContact CG2-CD1 3.9Å; I69-I98 HydrophobicContact CG2-CG2 4.43Å; I69-A101 HydrophobicContact CG2-CB 4.08Å; I69-L327 HydrophobicContact CD1-CD2 3.65Å
70	Q	94.9	Very high	92.7	Very high	32 Å²	32	39.5 Å²	39.5	15%	0.15	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	132.1	166.4	-159.6	-163.7	35.5	0	0	109.6	H50 I102 Q103 P279	H50-Q70 HydrophobicContact CB-CG 4.43Å; Q70-I102 PolarHBondContact O-N 3.16Å; Q70-Q103 PolarHBondContact N-O 3.04Å; Q70-Q103 PolarHBondContact O-N 3Å; Q70-P279 HydrophobicContact CB-CG 4.05Å; Q70-P279 HydrophobicContact CG-CG 4.36Å
71	T	95.2	Very high	93.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	160.6	176.8	59.5	0	0	0	0	110.7	H50 T51 W53 I69 S75 I98 N100	H50-T71 WeakPolarHBondContact CA-O 3.45Å; T51-T71 WeakPolarHBondContact CB-OG1 3.33Å; T51-T71 PolarHBondContact N-O 2.9Å; T51-T71 PolarHBondContact O-N 3.04Å; T51-T71 PolarHBondContact O-OG1 3.15Å; W53-T71 PolarHBondContact NE1-OG1 2.86Å; I69-T71 HydrophobicContact CG2-CG2 3.94Å; T71-S75 WeakPolarHBondContact CB-OG 3.46Å; T71-S75 VanDerWaalsContact OG1-CB 3.27Å; T71-S75 WeakPolarHBondContact OG1-CB 3.28Å; T71-S75 PolarHBondContact OG1-OG 3.37Å; T71-I98 HydrophobicContact CG2-CD1 3.44Å; T71-I98 VanDerWaalsContact CG2-CD1 3.44Å; T71-I98 HydrophobicContact CG2-CG1 3.94Å; T71-N100 WeakPolarHBondContact CA-O 3.45Å; T71-N100 WeakPolarHBondContact CB-O 3.36Å
72	T	89.6	Confident	93.7	Very high	60 Å²	60	37.7 Å²	37.7	37%	0.368	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	159.2	164.7	69.5	0	0	0	0	110.4	N100 I102	T72-N100 PolarHBondContact N-O 3.19Å; T72-N100 VanDerWaalsContact N-O 3.15Å; T72-N100 WeakPolarHBondContact OG1-CB 3.41Å; T72-I102 HydrophobicContact CG2-CD1 3.61Å; T72-I102 HydrophobicContact CG2-CG1 3.93Å
73	E	74.5	Confident	94	Very high	110 Å²	110	40.9 Å²	40.9	51%	0.514	22%	0.223	S	C	.	.	S	Bend	trans	1.5	-118.9	176.3	-63.9	-173.7	178.6	0	0	117.9	T49 T51 S75	T49-E73 WeakPolarHBondContact O-CG 3.35Å; T49-E73 PolarHBondContact O-N 2.79Å; T49-E73 VanDerWaalsContact O-N 3.09Å; T51-E73 PolarHBondContact OG1-O 3.08Å; E73-S75 PolarHBondContact O-N 3.15Å
74	E	80.4	Confident	94	Very high	153 Å²	153	40.9 Å²	40.9	72%	0.715	22%	0.223	S	C	*	.	S	Bend	trans	-72.1	71.4	-172.7	-64.4	-171.3	164.7	0	0	112
75	S	92.1	Very high	93.8	Very high	12 Å²	12	41.7 Å²	41.7	8%	0.084	23%	0.227	C	C	.	.			trans	-86.9	150.1	170.8	57.1	0	0	0	0	111.9	W53 T71 E73 N99	W53-S75 WeakPolarHBondContact CZ2-O 3.43Å; W53-S75 PolarHBondContact NE1-OG 3.08Å; T71-S75 WeakPolarHBondContact CB-OG 3.46Å; T71-S75 VanDerWaalsContact OG1-CB 3.27Å; T71-S75 WeakPolarHBondContact OG1-CB 3.28Å; T71-S75 PolarHBondContact OG1-OG 3.37Å; E73-S75 PolarHBondContact O-N 3.15Å; S75-N99 WeakPolarHBondContact CA-OD1 3.29Å
76	I	93.2	Very high	93.5	Very high	106 Å²	106	42.6 Å²	42.6	54%	0.544	23%	0.234	S	C	.	.			trans	-136.5	131.6	-178.1	-59.6	175.5	0	0	0	107.5	N99	I76-N99 PolarHBondContact N-OD1 3.09Å; I76-N99 PolarHBondContact O-OD1 2.76Å
77	V	96.4	Very high	92.9	Very high	13 Å²	13	48 Å²	48	8%	0.079	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	120.9	169.8	179.2	0	0	0	0	108.3	L40 Q42 W53 L55 V79 V96 F97 I98	L40-V77 HydrophobicContact CD2-CG1 4.24Å; Q42-V77 HydrophobicContact CG-CG1 4.45Å; W53-V77 HydrophobicContact CD2-CG2 3.74Å; W53-V77 HydrophobicContact CE3-CG2 3.68Å; W53-V77 HydrophobicContact CG-CG2 4.3Å; W53-V77 HydrophobicContact CH2-CG2 4.28Å; W53-V77 HydrophobicContact CZ2-CG2 4.34Å; W53-V77 HydrophobicContact CZ3-CG2 3.95Å; L55-V77 HydrophobicContact CD1-CG1 4.39Å; L55-V77 HydrophobicContact CD2-CG1 4.25Å; L55-V77 HydrophobicContact CD2-CG2 4.03Å; V77-V79 HydrophobicContact CG1-CG2 4.48Å; V77-V96 HydrophobicContact CG1-CG1 4.16Å; V77-F97 CarbonylContact C-O 3.59Å; V77-F97 WeakPolarHBondContact CA-O 3.41Å; V77-I98 HydrophobicContact CG2-CB 4.39Å; V77-I98 HydrophobicContact CG2-CD1 3.71Å; V77-I98 HydrophobicContact CG2-CG1 3.92Å
78	S	96.4	Very high	92.4	Very high	65 Å²	65	51.7 Å²	51.7	46%	0.455	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.6	177.7	-61.6	0	0	0	0	109.9	F97	S78-F97 PolarHBondContact N-O 2.9Å; S78-F97 PolarHBondContact O-N 3.43Å
79	V	97.1	Very high	91.9	Very high	34 Å²	34	52.6 Å²	52.6	21%	0.206	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	124.7	179.6	-172.9	0	0	0	0	109.1	A33 L40 V77 C81 F84 V96	A33-V79 HydrophobicContact CB-CB 4.26Å; A33-V79 HydrophobicContact CB-CG2 3.92Å; L40-V79 HydrophobicContact CB-CG2 4.5Å; L40-V79 HydrophobicContact CD2-CG2 3.46Å; L40-V79 VanDerWaalsContact CD2-CG2 3.46Å; V77-V79 HydrophobicContact CG1-CG2 4.48Å; V79-C81 PolarHBondContact O-N 3.42Å; V79-F84 HydrophobicContact CG1-CB 3.93Å; V79-F84 HydrophobicContact CG1-CD1 4.07Å; V79-F84 HydrophobicContact CG1-CG 3.98Å; V79-V96 HydrophobicContact CG1-CG2 4.32Å; V79-V96 HydrophobicContact CG2-CG2 4.39Å
80	N	97.1	Very high	91.6	Very high	63 Å²	63	56.4 Å²	56.4	34%	0.337	31%	0.31	S	S	.	.			trans	-87.6	92.1	168.2	-175.8	-29.6	0	0	0	108.8	S82 R83 F84 S95	N80-S82 VanDerWaalsContact C-N 3.32Å; N80-S82 PolarHBondContact O-N 2.84Å; N80-S82 PolarHBondContact OD1-N 2.88Å; N80-S82 PolarHBondContact OD1-OG 2.93Å; N80-R83 HydrophobicContact CB-CB 4.23Å; N80-R83 WeakPolarHBondContact ND2-CD 3.16Å; N80-R83 PolarHBondContact O-N 3.14Å; N80-R83 PolarHBondContact OD1-N 3.19Å; N80-F84 WeakPolarHBondContact O-CB 3.43Å; N80-F84 PolarHBondContact O-N 2.86Å; N80-S95 PolarHBondContact N-O 3.4Å
81	C	96.2	Very high	91.5	Very high	39 Å²	39	58.7 Å²	58.7	26%	0.264	32%	0.323	S	S	.	.	H	α-helix	trans	-59.1	-36.4	-174	-80.4	0	0	0	0	114.3	C35 V79 R83 F84 D85	C35-C81 VanDerWaalsContact CA-SG 3.53Å; C35-C81 HydrophobicContact CB-CB 3.57Å; C35-C81 WeakPolarHBondContact CB-SG 3.17Å; C35-C81 WeakPolarHBondContact SG-CA 3.26Å; C35-C81 WeakPolarHBondContact SG-CB 3.41Å; C35-C81 CovalentContact SG-SG 2.06Å; C35-C81 PolarHBondContact SG-SG 3.47Å; V79-C81 PolarHBondContact O-N 3.42Å; C81-R83 PolarHBondContact O-N 3.42Å; C81-F84 PolarHBondContact O-N 3.03Å; C81-D85 WeakPolarHBondContact O-CB 3.32Å; C81-D85 PolarHBondContact O-N 2.86Å
82	S	94.9	Very high	91.4	Very high	99 Å²	99	58.7 Å²	58.7	69%	0.692	32%	0.323	S	S	*	.	H	α-helix	trans	-64.2	-28.7	178.4	60.2	0	0	0	0	112.4	N80	N80-S82 VanDerWaalsContact C-N 3.32Å; N80-S82 PolarHBondContact O-N 2.84Å; N80-S82 PolarHBondContact OD1-N 2.88Å; N80-S82 PolarHBondContact OD1-OG 2.93Å
83	R	95.6	Very high	91.6	Very high	69 Å²	69	58.6 Å²	58.6	26%	0.26	32%	0.316	S	S	.	.	H	α-helix	trans	-86.1	-40.2	174.9	-69.8	-176	69	-171.1	-2.5	111.9	N80 C81 D85 S86 D91 Y92 R93	N80-R83 HydrophobicContact CB-CB 4.23Å; N80-R83 WeakPolarHBondContact ND2-CD 3.16Å; N80-R83 PolarHBondContact O-N 3.14Å; N80-R83 PolarHBondContact OD1-N 3.19Å; C81-R83 PolarHBondContact O-N 3.42Å; R83-D85 VanDerWaalsContact C-N 3.3Å; R83-D85 PolarHBondContact O-N 3.14Å; R83-S86 WeakPolarHBondContact O-CB 3.33Å; R83-S86 PolarHBondContact O-N 2.87Å; R83-D91 WeakPolarHBondContact CB-O 3.46Å; R83-D91 PolarHBondContact NE-O 3.01Å; R83-D91 PolarHBondContact NH2-O 3.2Å; R83-Y92 WeakPolarHBondContact O-CA 3.32Å; R83-R93 PolarHBondContact NH2-O 3.32Å
84	F	95.1	Very high	92.6	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-67	-29.3	-179.2	-170.4	-117.2	0	0	0	113	T38 L40 H62 V79 N80 C81 S86 Y92 S95 V96 L323 A326	T38-F84 WeakPolarHBondContact OG1-CD1 3.45Å; T38-F84 VanDerWaalsContact OG1-CE1 3.28Å; T38-F84 WeakPolarHBondContact OG1-CE1 3.07Å; L40-F84 HydrophobicContact CB-CE1 4.14Å; L40-F84 HydrophobicContact CB-CZ 4.34Å; H62-F84 PolarHBondContact CE1-O 3.3Å; V79-F84 HydrophobicContact CG1-CB 3.93Å; V79-F84 HydrophobicContact CG1-CD1 4.07Å; V79-F84 HydrophobicContact CG1-CG 3.98Å; N80-F84 WeakPolarHBondContact O-CB 3.43Å; N80-F84 PolarHBondContact O-N 2.86Å; C81-F84 PolarHBondContact O-N 3.03Å; F84-S86 VanDerWaalsContact C-N 3.32Å; F84-Y92 HydrophobicContact CD2-CD2 4.24Å; F84-Y92 AromaticContact CD2-CE2 3.47Å; F84-Y92 HydrophobicContact CD2-CE2 3.47Å; F84-Y92 VanDerWaalsContact CD2-CE2 3.47Å; F84-Y92 AromaticContact CE2-CE2 3.72Å; F84-Y92 HydrophobicContact CE2-CE2 3.72Å; F84-Y92 HydrophobicContact CG-CE2 4.3Å; F84-Y92 VanDerWaalsContact O-CD2 3.25Å; F84-Y92 WeakPolarHBondContact O-CD2 3.12Å; F84-Y92 VanDerWaalsContact O-CE2 3.26Å; F84-Y92 WeakPolarHBondContact O-CE2 3.24Å; F84-S95 WeakPolarHBondContact CD2-OG 3.13Å; F84-V96 HydrophobicContact CD2-CG2 3.87Å; F84-V96 HydrophobicContact CE2-CG2 3.89Å; F84-L323 HydrophobicContact CE2-CD1 4.03Å; F84-L323 HydrophobicContact CZ-CD1 4.24Å; F84-A326 HydrophobicContact CD2-CB 3.94Å; F84-A326 HydrophobicContact CE2-CB 3.85Å
85	D	92.7	Very high	93.4	Very high	19 Å²	19	48 Å²	48	10%	0.102	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	0.7	171.1	-71.9	-36.7	0	0	0	113.8	C35 N36 N37 T38 C81 R83	C35-D85 WeakPolarHBondContact CB-OD1 3.45Å; C35-D85 WeakPolarHBondContact CB-OD2 3.13Å; N36-D85 WeakPolarHBondContact CA-OD2 3.25Å; N36-D85 WeakPolarHBondContact CB-OD2 3.37Å; N36-D85 PolarHBondContact N-OD2 3.09Å; N37-D85 PolarHBondContact N-OD1 3.07Å; N37-D85 VanDerWaalsContact N-OD1 3.13Å; T38-D85 PolarHBondContact N-OD1 2.59Å; T38-D85 PolarHBondContact OG1-OD1 3.49Å; C81-D85 WeakPolarHBondContact O-CB 3.32Å; C81-D85 PolarHBondContact O-N 2.86Å; R83-D85 VanDerWaalsContact C-N 3.3Å; R83-D85 PolarHBondContact O-N 3.14Å
86	S	90.9	Very high	93.6	Very high	20 Å²	20	47.4 Å²	47.4	14%	0.14	26%	0.264	C	S	.	.			trans	-72.5	133.2	-176	-170.3	0	0	0	0	111.3	R83 F84 D88	R83-S86 WeakPolarHBondContact O-CB 3.33Å; R83-S86 PolarHBondContact O-N 2.87Å; F84-S86 VanDerWaalsContact C-N 3.32Å; S86-D88 PolarHBondContact O-N 3.25Å; S86-D88 PolarHBondContact OG-N 2.87Å; S86-D88 VanDerWaalsContact OG-N 3.07Å
87	N	85.5	Confident	93.8	Very high	113 Å²	113	47.2 Å²	47.2	60%	0.604	26%	0.259	S	S	*	.	S	Bend	trans	-79.4	-1	168.4	-65.4	-19.4	0	0	0	112.2	F321	N87-F321 VanDerWaalsContact O-CZ 3.25Å; N87-F321 WeakPolarHBondContact O-CZ 3.39Å
88	D	89.5	Confident	93.8	Very high	78 Å²	78	48 Å²	48	42%	0.417	26%	0.262	S	S	.	.	S	Bend	trans	-94.2	119.2	170.9	-171.9	-19.9	0	0	0	109.7	S86 L90 D91 Y92	S86-D88 PolarHBondContact O-N 3.25Å; S86-D88 PolarHBondContact OG-N 2.87Å; S86-D88 VanDerWaalsContact OG-N 3.07Å; D88-L90 PolarHBondContact O-N 3.21Å; D88-L90 WeakPolarHBondContact OD1-CB 3.44Å; D88-L90 PolarHBondContact OD1-N 2.91Å; D88-D91 HydrophobicContact CB-CB 4.37Å; D88-D91 PolarHBondContact O-N 2.89Å; D88-D91 VanDerWaalsContact O-N 3.14Å; D88-Y92 WeakPolarHBondContact O-CB 3.19Å; D88-Y92 PolarHBondContact O-N 3.47Å
89	A	87.3	Confident	93.6	Very high	19 Å²	19	48 Å²	48	16%	0.157	26%	0.257	C	S	.	.	H	α-helix	trans	-57.2	-35.4	178.4	0	0	0	0	0	112.8	D91 Y92 R93 F321 F325	A89-D91 VanDerWaalsContact C-N 3.28Å; A89-D91 PolarHBondContact O-N 2.93Å; A89-Y92 PolarHBondContact O-N 2.69Å; A89-R93 PolarHBondContact O-N 3.23Å; A89-F321 HydrophobicContact CB-CE1 4.33Å; A89-F321 HydrophobicContact CB-CZ 4.16Å; A89-F325 HydrophobicContact CB-CE1 4.42Å; A89-F325 WeakPolarHBondContact O-CE1 3.3Å
90	L	89.7	Confident	93.5	Very high	81 Å²	81	50.2 Å²	50.2	42%	0.424	27%	0.268	S	S	.	.	H	α-helix	trans	-67.1	-31.6	-179.7	-67.1	174.5	0	0	0	112.5	D88 R93	D88-L90 PolarHBondContact O-N 3.21Å; D88-L90 WeakPolarHBondContact OD1-CB 3.44Å; D88-L90 PolarHBondContact OD1-N 2.91Å; L90-R93 WeakPolarHBondContact O-CG 3.29Å; L90-R93 PolarHBondContact O-NE 2.9Å; L90-R93 VanDerWaalsContact O-NE 3.12Å
91	D	92.5	Very high	93.3	Very high	79 Å²	79	49.4 Å²	49.4	42%	0.422	27%	0.27	S	S	.	.	H	α-helix	trans	-82	-41.4	174.2	-78.7	-22	0	0	0	110.9	R83 D88 A89 R93	R83-D91 WeakPolarHBondContact CB-O 3.46Å; R83-D91 PolarHBondContact NE-O 3.01Å; R83-D91 PolarHBondContact NH2-O 3.2Å; D88-D91 HydrophobicContact CB-CB 4.37Å; D88-D91 PolarHBondContact O-N 2.89Å; D88-D91 VanDerWaalsContact O-N 3.14Å; A89-D91 VanDerWaalsContact C-N 3.28Å; A89-D91 PolarHBondContact O-N 2.93Å; D91-R93 VanDerWaalsContact C-N 3.35Å; D91-R93 PolarHBondContact O-N 2.82Å
92	Y	93.3	Very high	93.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.3	-34.9	-177.6	-179.1	-108.4	0	0	0	113.7	H62 R83 F84 D88 A89 S95 F321 G322 F325 A326	H62-Y92 AromaticContact CE1-CE2 3.41Å; H62-Y92 VanDerWaalsContact CE1-CE2 3.41Å; H62-Y92 WeakPolarHBondContact CE1-CE2 3.5Å; H62-Y92 AromaticContact CE1-CZ 3.9Å; H62-Y92 AromaticContact ND1-CE2 3.96Å; R83-Y92 WeakPolarHBondContact O-CA 3.32Å; F84-Y92 HydrophobicContact CD2-CD2 4.24Å; F84-Y92 AromaticContact CD2-CE2 3.47Å; F84-Y92 HydrophobicContact CD2-CE2 3.47Å; F84-Y92 VanDerWaalsContact CD2-CE2 3.47Å; F84-Y92 AromaticContact CE2-CE2 3.72Å; F84-Y92 HydrophobicContact CE2-CE2 3.72Å; F84-Y92 HydrophobicContact CG-CE2 4.3Å; F84-Y92 VanDerWaalsContact O-CD2 3.25Å; F84-Y92 WeakPolarHBondContact O-CD2 3.12Å; F84-Y92 VanDerWaalsContact O-CE2 3.26Å; F84-Y92 WeakPolarHBondContact O-CE2 3.24Å; D88-Y92 WeakPolarHBondContact O-CB 3.19Å; D88-Y92 PolarHBondContact O-N 3.47Å; A89-Y92 PolarHBondContact O-N 2.69Å; Y92-S95 WeakPolarHBondContact O-CB 3.28Å; Y92-S95 PolarHBondContact O-N 3.14Å; Y92-S95 PolarHBondContact O-OG 3.43Å; Y92-F321 AromaticContact CD1-CD1 3.82Å; Y92-F321 HydrophobicContact CD1-CD1 3.82Å; Y92-F321 HydrophobicContact CE1-CB 4.34Å; Y92-F321 HydrophobicContact CE1-CD1 4.36Å; Y92-F321 AromaticContact CG-CD1 3.97Å; Y92-F321 HydrophobicContact CG-CD1 3.97Å; Y92-F321 HydrophobicContact CG-CE1 4.46Å; Y92-F321 PolarHBondContact OH-O 2.59Å; Y92-G322 WeakPolarHBondContact CE1-O 3.48Å; Y92-G322 PolarHBondContact OH-O 2.95Å; Y92-F325 AromaticContact CD1-CD1 3.68Å; Y92-F325 HydrophobicContact CD1-CD1 3.68Å; Y92-F325 HydrophobicContact CD1-CE1 4.27Å; Y92-F325 HydrophobicContact CE1-CB 4.49Å; Y92-F325 HydrophobicContact CE1-CD1 4.1Å; Y92-A326 HydrophobicContact CE1-CB 3.83Å; Y92-A326 HydrophobicContact CE2-CB 3.99Å
93	R	93.5	Very high	93	Very high	58 Å²	58	47.1 Å²	47.1	22%	0.219	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	142.4	177.5	78.1	-171.8	164.8	177.3	-1.8	112.2	R83 A89 L90 D91 S95 F325 D330	R83-R93 PolarHBondContact NH2-O 3.32Å; A89-R93 PolarHBondContact O-N 3.23Å; L90-R93 WeakPolarHBondContact O-CG 3.29Å; L90-R93 PolarHBondContact O-NE 2.9Å; L90-R93 VanDerWaalsContact O-NE 3.12Å; D91-R93 VanDerWaalsContact C-N 3.35Å; D91-R93 PolarHBondContact O-N 2.82Å; R93-S95 PolarHBondContact O-N 3.16Å; R93-F325 HydrophobicContact CB-CD1 4.04Å; R93-F325 HydrophobicContact CB-CE1 3.3Å; R93-F325 HydrophobicContact CB-CE2 4.25Å; R93-F325 HydrophobicContact CB-CZ 3.39Å; R93-F325 HydrophobicContact CG-CZ 4.47Å; R93-D330 VanDerWaalsContact CD-OD1 3.24Å; R93-D330 WeakPolarHBondContact CD-OD1 3.32Å; R93-D330 IonicContact CZ-OD1 3.12Å; R93-D330 IonicContact NE-OD1 3.94Å; R93-D330 IonicContact NH1-OD1 3.78Å; R93-D330 PolarHBondContact NH1-OD1 3.18Å; R93-D330 IonicContact NH1-OD2 3.05Å; R93-D330 PolarHBondContact NH1-OD2 2.86Å; R93-D330 VanDerWaalsContact NH1-OD2 3.12Å
94	N	95	Very high	93.1	Very high	41 Å²	41	44 Å²	44	22%	0.219	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	42.3	-179	-52.4	-53	0	0	0	111.6	F97 A326 G329	N94-F97 HydrophobicContact CB-CE1 4.16Å; N94-F97 HydrophobicContact CB-CZ 4.14Å; N94-F97 WeakPolarHBondContact O-CE2 3.23Å; N94-F97 WeakPolarHBondContact O-CZ 3.4Å; N94-A326 CarbonylContact C-O 3.55Å; N94-A326 WeakPolarHBondContact CA-O 3.49Å; N94-A326 PolarHBondContact N-O 3.17Å; N94-A326 VanDerWaalsContact N-O 3.08Å; N94-G329 PolarHBondContact OD1-N 2.96Å
95	S	96.8	Very high	93.2	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.235	C	C	.	.			trans	-92.8	-20	172.7	55.4	0	0	0	0	111.6	N80 F84 Y92 R93 A326	N80-S95 PolarHBondContact N-O 3.4Å; F84-S95 WeakPolarHBondContact CD2-OG 3.13Å; Y92-S95 WeakPolarHBondContact O-CB 3.28Å; Y92-S95 PolarHBondContact O-N 3.14Å; Y92-S95 PolarHBondContact O-OG 3.43Å; R93-S95 PolarHBondContact O-N 3.16Å; S95-A326 PolarHBondContact N-O 2.94Å; S95-A326 WeakPolarHBondContact OG-CB 3.5Å
96	V	97.7	Very high	93.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	129.9	173	179.2	0	0	0	0	108.6	L40 L55 V77 V79 F84 L323 A326 L327	L40-V96 HydrophobicContact CD2-CG1 4.02Å; L40-V96 HydrophobicContact CD2-CG2 4.01Å; L55-V96 HydrophobicContact CD1-CG1 4.4Å; V77-V96 HydrophobicContact CG1-CG1 4.16Å; V79-V96 HydrophobicContact CG1-CG2 4.32Å; V79-V96 HydrophobicContact CG2-CG2 4.39Å; F84-V96 HydrophobicContact CD2-CG2 3.87Å; F84-V96 HydrophobicContact CE2-CG2 3.89Å; V96-L323 HydrophobicContact CG2-CD1 4.14Å; V96-A326 HydrophobicContact CB-CB 4.43Å; V96-A326 HydrophobicContact CG2-CB 3.99Å; V96-A326 PolarHBondContact N-O 3.34Å; V96-L327 HydrophobicContact CG1-CD1 4.18Å
97	F	96.6	Very high	93.8	Very high	101 Å²	101	42.4 Å²	42.4	44%	0.443	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	140.6	179.7	-60.1	-88	0	0	0	109.8	V77 S78 N94	V77-F97 CarbonylContact C-O 3.59Å; V77-F97 WeakPolarHBondContact CA-O 3.41Å; S78-F97 PolarHBondContact N-O 2.9Å; S78-F97 PolarHBondContact O-N 3.43Å; N94-F97 HydrophobicContact CB-CE1 4.16Å; N94-F97 HydrophobicContact CB-CZ 4.14Å; N94-F97 WeakPolarHBondContact O-CE2 3.23Å; N94-F97 WeakPolarHBondContact O-CZ 3.4Å
98	I	95.8	Very high	94.3	Very high	29 Å²	29	37 Å²	37	15%	0.149	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	130.1	170.4	-167.8	172.9	0	0	0	108.2	W53 I69 T71 V77 A101 L327	W53-I98 HydrophobicContact CB-CD1 4.42Å; W53-I98 HydrophobicContact CD2-CD1 4.47Å; W53-I98 HydrophobicContact CG-CD1 3.91Å; I69-I98 HydrophobicContact CB-CD1 4.24Å; I69-I98 HydrophobicContact CD1-CD1 4.09Å; I69-I98 HydrophobicContact CD1-CG2 4.12Å; I69-I98 HydrophobicContact CG2-CD1 3.9Å; I69-I98 HydrophobicContact CG2-CG2 4.43Å; T71-I98 HydrophobicContact CG2-CD1 3.44Å; T71-I98 VanDerWaalsContact CG2-CD1 3.44Å; T71-I98 HydrophobicContact CG2-CG1 3.94Å; V77-I98 HydrophobicContact CG2-CB 4.39Å; V77-I98 HydrophobicContact CG2-CD1 3.71Å; V77-I98 HydrophobicContact CG2-CG1 3.92Å; I98-A101 HydrophobicContact CG2-CB 4.09Å; I98-L327 HydrophobicContact CG2-CD1 4.04Å
99	N	94	Very high	94.7	Very high	65 Å²	65	33.6 Å²	33.6	35%	0.348	18%	0.177	S	C	.	.	S	Bend	trans	-82	159.3	173.4	64.9	-20.1	0	0	0	110.3	S75 I76 A101	S75-N99 WeakPolarHBondContact CA-OD1 3.29Å; I76-N99 PolarHBondContact N-OD1 3.09Å; I76-N99 PolarHBondContact O-OD1 2.76Å; N99-A101 PolarHBondContact O-N 2.76Å; N99-A101 VanDerWaalsContact O-N 3.11Å
100	N	93	Very high	95	Very high	82 Å²	82	32.8 Å²	32.8	44%	0.439	17%	0.17	S	C	.	.	S	Bend	trans	57.9	27.7	171.2	-55.6	-22.9	0	0	0	115.3	T71 T72 I102	T71-N100 WeakPolarHBondContact CA-O 3.45Å; T71-N100 WeakPolarHBondContact CB-O 3.36Å; T72-N100 PolarHBondContact N-O 3.19Å; T72-N100 VanDerWaalsContact N-O 3.15Å; T72-N100 WeakPolarHBondContact OG1-CB 3.41Å; N100-I102 PolarHBondContact O-N 3.26Å
101	A	93.4	Very high	95.1	Very high	46 Å²	46	30.1 Å²	30.1	38%	0.38	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	129.9	173.7	0	0	0	0	0	111.7	I69 I98 N99	I69-A101 HydrophobicContact CG2-CB 4.08Å; I98-A101 HydrophobicContact CG2-CB 4.09Å; N99-A101 PolarHBondContact O-N 2.76Å; N99-A101 VanDerWaalsContact O-N 3.11Å
102	I	92	Very high	95.2	Very high	57 Å²	57	26.5 Å²	26.5	29%	0.292	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-58.8	177.2	-52.2	176.9	0	0	0	109.2	Q70 T72 N100	Q70-I102 PolarHBondContact O-N 3.16Å; T72-I102 HydrophobicContact CG2-CD1 3.61Å; T72-I102 HydrophobicContact CG2-CG1 3.93Å; N100-I102 PolarHBondContact O-N 3.26Å
103	Q	93.8	Very high	95.1	Very high	33 Å²	33	26.6 Å²	26.6	15%	0.154	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	151	177.1	-66.2	-57.9	-14.2	0	0	110.4	Q70 Y105 N229 R278 P279	Q70-Q103 PolarHBondContact N-O 3.04Å; Q70-Q103 PolarHBondContact O-N 3Å; Q103-Y105 HydrophobicContact CB-CE2 3.73Å; Q103-N229 PolarHBondContact OE1-ND2 3.38Å; Q103-N229 PolarHBondContact OE1-OD1 2.91Å; Q103-R278 WeakPolarHBondContact CG-O 3.12Å; Q103-P279 HydrophobicContact CB-CG 4.34Å
104	S	96.6	Very high	95	Very high	4 Å²	4	24 Å²	24	3%	0.028	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	142.6	176.7	42	0	0	0	0	112.8	L68 N229 Y328	L68-S104 CarbonylContact O-C 3.59Å; L68-S104 WeakPolarHBondContact O-CA 3.41Å; L68-S104 WeakPolarHBondContact O-CB 3.16Å; S104-N229 PolarHBondContact O-N 2.97Å; S104-N229 PolarHBondContact O-OD1 2.83Å; S104-N229 WeakPolarHBondContact OG-CB 3.16Å; S104-Y328 WeakPolarHBondContact CB-OH 3.18Å; S104-Y328 PolarHBondContact OG-OH 3.36Å
105	Y	97.6	Very high	94.8	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	162.1	-172.4	-54	-83.4	0	0	0	108.8	I67 L68 Q103 F227 H230 L263 T277 P279 A281 I376	I67-Y105 CarbonylContact C-O 3.57Å; I67-Y105 WeakPolarHBondContact CA-O 3.42Å; I67-Y105 WeakPolarHBondContact CG2-O 3.35Å; L68-Y105 PolarHBondContact N-O 2.91Å; L68-Y105 PolarHBondContact O-N 2.83Å; Q103-Y105 HydrophobicContact CB-CE2 3.73Å; Y105-F227 CarbonylContact C-O 3.52Å; Y105-F227 WeakPolarHBondContact CA-O 3.45Å; Y105-H230 AromaticContact CE1-CE1 3.95Å; Y105-L263 HydrophobicContact CD1-CB 3.5Å; Y105-L263 VanDerWaalsContact CD1-CB 3.5Å; Y105-L263 HydrophobicContact CD1-CD1 4.37Å; Y105-L263 HydrophobicContact CE1-CB 4.01Å; Y105-L263 HydrophobicContact CG-CB 4.21Å; Y105-L263 HydrophobicContact CG-CD1 4.37Å; Y105-T277 PolarHBondContact OH-OG1 2.9Å; Y105-P279 PolarHBondContact OH-O 2.97Å; Y105-A281 HydrophobicContact CD1-CB 4.05Å; Y105-A281 HydrophobicContact CD2-CB 3.31Å; Y105-A281 HydrophobicContact CE1-CB 4.45Å; Y105-A281 HydrophobicContact CE2-CB 3.78Å; Y105-A281 HydrophobicContact CG-CB 3.46Å; Y105-A281 VanDerWaalsContact CG-CB 3.46Å; Y105-I376 HydrophobicContact CD2-CD1 4Å; Y105-I376 HydrophobicContact CE2-CD1 4.4Å
106	G	97.8	Very high	94.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.2	-165	172.2	0	0	0	0	0	114	L66 F227	L66-G106 CarbonylContact O-C 3.6Å; L66-G106 WeakPolarHBondContact O-CA 3.11Å; G106-F227 PolarHBondContact N-O 2.88Å; G106-F227 WeakPolarHBondContact O-CD1 3.41Å; G106-F227 PolarHBondContact O-N 2.85Å
107	L	97.8	Very high	93.9	Very high	5 Å²	5	27.2 Å²	27.2	3%	0.026	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	155.2	-177.1	60.6	96.8	0	0	0	112.2	S65 L66 L225 L283 F372	S65-L107 WeakPolarHBondContact CA-O 3.21Å; L66-L107 HydrophobicContact CB-CD1 4.42Å; L66-L107 HydrophobicContact CB-CG 4.25Å; L66-L107 HydrophobicContact CD2-CD2 4.25Å; L66-L107 HydrophobicContact CD2-CG 4.5Å; L66-L107 PolarHBondContact N-O 2.75Å; L66-L107 PolarHBondContact O-N 3.37Å; L107-L225 CarbonylContact C-O 3.52Å; L107-L225 WeakPolarHBondContact CA-O 3.47Å; L107-L283 HydrophobicContact CD2-CD2 3.95Å; L107-F372 HydrophobicContact CD1-CE2 4.41Å; L107-F372 HydrophobicContact CD1-CZ 4.23Å; L107-F372 HydrophobicContact CD2-CE2 3.59Å; L107-F372 HydrophobicContact CD2-CZ 4.23Å
108	I	97.3	Very high	93.2	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	131.6	166.9	-53.3	178.8	0	0	0	107.5	P63 P64 H110 L224 L225 F227 P324 F332	P63-I108 HydrophobicContact CB-CG2 3.65Å; P63-I108 HydrophobicContact CG-CG2 3.7Å; P64-I108 WeakPolarHBondContact O-CA 3.46Å; I108-H110 VanDerWaalsContact C-N 3.27Å; I108-H110 PolarHBondContact O-N 3.42Å; I108-L224 WeakPolarHBondContact O-CA 3.43Å; I108-L225 HydrophobicContact CB-CB 4.22Å; I108-L225 PolarHBondContact N-O 2.78Å; I108-L225 PolarHBondContact O-N 3.25Å; I108-F227 HydrophobicContact CG1-CE1 4.41Å; I108-P324 HydrophobicContact CD1-CG 3.9Å; I108-P324 HydrophobicContact CG1-CG 4.01Å; I108-F332 HydrophobicContact CD1-CE1 3.99Å; I108-F332 HydrophobicContact CD1-CZ 3.68Å
109	L	96.8	Very high	92.6	Very high	5 Å²	5	30.9 Å²	30.9	3%	0.026	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	91.8	162.4	177.9	61.1	0	0	0	107.5	P64 I112 W141 L177 L206 P222 L224	P64-L109 HydrophobicContact CB-CB 4.36Å; P64-L109 HydrophobicContact CG-CB 4.47Å; P64-L109 HydrophobicContact CG-CD2 4.48Å; P64-L109 PolarHBondContact O-N 2.84Å; L109-I112 HydrophobicContact CD1-CG1 4.46Å; L109-W141 HydrophobicContact CD2-CH2 4.04Å; L109-W141 HydrophobicContact CD2-CZ2 3.97Å; L109-L177 HydrophobicContact CD2-CD2 4.35Å; L109-L206 HydrophobicContact CD1-CD2 4.25Å; L109-L206 HydrophobicContact CD2-CD1 3.98Å; L109-P222 HydrophobicContact CD1-CB 4.31Å; L109-L224 HydrophobicContact CD1-CD2 4.17Å
110	H	94.1	Very high	92.1	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.009	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-44.7	-170	170.1	-141	0	0	0	111.8	I108 G136 V223 L225 V314 S318 E348	I108-H110 VanDerWaalsContact C-N 3.27Å; I108-H110 PolarHBondContact O-N 3.42Å; H110-G136 PolarHBondContact O-N 3.02Å; H110-V223 PolarHBondContact N-O 2.93Å; H110-L225 HydrophobicContact CB-CB 4.47Å; H110-L225 HydrophobicContact CB-CD1 3.85Å; H110-L225 HydrophobicContact CB-CD2 4.48Å; H110-L225 HydrophobicContact CB-CG 3.59Å; H110-V314 WeakPolarHBondContact CE1-CG1 3.15Å; H110-V314 WeakPolarHBondContact NE2-CG1 3.18Å; H110-S318 PolarHBondContact CD2-OG 2.82Å; H110-S318 PolarHBondContact NE2-OG 2.9Å; H110-E348 IonicContact CE1-OE1 3.74Å; H110-E348 IonicContact ND1-OE1 3.58Å; H110-E348 PolarHBondContact ND1-OE1 2.93Å
111	R	92.1	Very high	91.8	Very high	26 Å²	26	28.6 Å²	28.6	10%	0.098	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	160.6	178	56.3	-175.7	169.3	152.8	3.7	113.2	T133 F134 L135 V223 E348	R111-T133 HydrophobicContact CB-CG2 3.47Å; R111-T133 VanDerWaalsContact CB-CG2 3.47Å; R111-T133 HydrophobicContact CG-CG2 3.92Å; R111-F134 CarbonylContact C-O 3.51Å; R111-F134 WeakPolarHBondContact CA-O 3.17Å; R111-F134 WeakPolarHBondContact CB-O 3.36Å; R111-L135 HydrophobicContact CB-CD2 4.12Å; R111-V223 HydrophobicContact CG-CB 3.62Å; R111-V223 HydrophobicContact CG-CG1 4.19Å; R111-V223 HydrophobicContact CG-CG2 3.83Å; R111-V223 PolarHBondContact N-O 2.85Å; R111-V223 PolarHBondContact O-N 2.81Å; R111-E348 IonicContact CZ-OE1 3.01Å; R111-E348 VanDerWaalsContact CZ-OE1 3.3Å; R111-E348 IonicContact NE-OE1 3.54Å; R111-E348 PolarHBondContact NE-OE1 3.28Å; R111-E348 VanDerWaalsContact NH2-CD 3.34Å; R111-E348 IonicContact NH2-OE1 3.05Å; R111-E348 PolarHBondContact NH2-OE1 2.96Å; R111-E348 IonicContact NH2-OE2 3.59Å; R111-E348 PolarHBondContact NH2-OE2 3.1Å
112	I	93.9	Very high	91.6	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.015	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	118.7	168	-57	158.2	0	0	0	107	L109 F134 L139 I175 L208 F220	L109-I112 HydrophobicContact CD1-CG1 4.46Å; I112-F134 HydrophobicContact CB-CB 4.22Å; I112-F134 PolarHBondContact N-O 3.03Å; I112-F134 PolarHBondContact O-N 3.43Å; I112-L139 HydrophobicContact CD1-CD1 4.35Å; I112-I175 HydrophobicContact CD1-CD1 3.93Å; I112-I175 HydrophobicContact CD1-CG2 4.06Å; I112-L208 HydrophobicContact CD1-CD2 3.76Å; I112-L208 HydrophobicContact CG2-CD1 4.09Å; I112-F220 HydrophobicContact CG2-CB 4.22Å; I112-F220 HydrophobicContact CG2-CD1 3.79Å; I112-F220 HydrophobicContact CG2-CG 4.48Å
113	I	91.9	Very high	91.4	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	118.6	178.1	-60.8	172.3	0	0	0	108	Y115 T131 F220 S221 V223	I113-Y115 HydrophobicContact CG2-CD1 4.15Å; I113-T131 HydrophobicContact CG2-CG2 4.07Å; I113-F220 CarbonylContact O-C 3.53Å; I113-F220 VanDerWaalsContact O-CA 3.25Å; I113-F220 WeakPolarHBondContact O-CA 3.23Å; I113-S221 PolarHBondContact N-O 3.34Å; I113-S221 PolarHBondContact O-N 2.93Å; I113-V223 HydrophobicContact CD1-CG2 3.48Å; I113-V223 VanDerWaalsContact CD1-CG2 3.48Å; I113-V223 HydrophobicContact CG1-CG2 3.77Å
114	R	91.5	Very high	91.1	Very high	5 Å²	5	26.1 Å²	26.1	2%	0.019	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	121.8	159	179	171.2	66.4	-173.8	1.1	107.9	T131 E132 F134 E212 D218 N219 F220	R114-T131 WeakPolarHBondContact O-CA 3.47Å; R114-E132 IonicContact CZ-OE2 3.69Å; R114-E132 PolarHBondContact N-O 3.28Å; R114-E132 IonicContact NE-OE2 3.3Å; R114-E132 IonicContact NH2-OE1 3.62Å; R114-E132 IonicContact NH2-OE2 3.9Å; R114-E132 PolarHBondContact NH2-OE2 3.11Å; R114-E132 PolarHBondContact O-N 3.16Å; R114-E132 VanDerWaalsContact O-O 3.14Å; R114-F134 HydrophobicContact CB-CE2 3.99Å; R114-E212 PolarHBondContact NH1-O 3.02Å; R114-E212 IonicContact NH1-OE2 3.01Å; R114-D218 HydrophobicContact CG-CB 4.19Å; R114-N219 WeakPolarHBondContact CA-O 3.3Å; R114-F220 HydrophobicContact CB-CD1 4.07Å; R114-F220 HydrophobicContact CB-CE1 3.73Å; R114-F220 HydrophobicContact CB-CZ 4.31Å; R114-F220 HydrophobicContact CG-CE1 4.04Å; R114-F220 HydrophobicContact CG-CZ 4.09Å
115	Y	90.9	Very high	90.4	Very high	3 Å²	3	28.3 Å²	28.3	1%	0.012	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	149.2	-179.5	68.8	-79.5	0	0	0	111.5	I113 D117 T122 I123 A124 Q130 D218 N219	I113-Y115 HydrophobicContact CG2-CD1 4.15Å; Y115-D117 HydrophobicContact CD2-CB 4.4Å; Y115-D117 HydrophobicContact CE2-CB 3.9Å; Y115-D117 PolarHBondContact O-N 3.18Å; Y115-T122 VanDerWaalsContact OH-C 3.25Å; Y115-T122 WeakPolarHBondContact OH-CA 3.17Å; Y115-I123 WeakPolarHBondContact CE2-O 3.36Å; Y115-A124 HydrophobicContact CD1-CB 3.84Å; Y115-A124 HydrophobicContact CE1-CB 3.68Å; Y115-A124 HydrophobicContact CG-CB 4.41Å; Y115-Q130 WeakPolarHBondContact CA-O 3.42Å; Y115-D218 CarbonylContact O-C 3.58Å; Y115-D218 WeakPolarHBondContact O-CA 3.4Å; Y115-N219 HydrophobicContact CD1-CB 4.41Å; Y115-N219 WeakPolarHBondContact CD1-O 3.31Å; Y115-N219 HydrophobicContact CE1-CB 3.76Å; Y115-N219 HydrophobicContact CE2-CB 4.19Å; Y115-N219 PolarHBondContact N-O 3.01Å; Y115-N219 PolarHBondContact O-N 3.08Å
116	R	88.6	Confident	89.1	Confident	98 Å²	98	30.3 Å²	30.3	37%	0.37	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	111.1	175.6	-167.1	-179.2	-67.9	168.4	-1.2	110.4	I118 Q130 N215 N217	R116-I118 HydrophobicContact CB-CG1 4.45Å; R116-I118 HydrophobicContact CG-CG1 3.89Å; R116-I118 PolarHBondContact O-N 3.28Å; R116-I118 VanDerWaalsContact O-N 3.07Å; R116-Q130 PolarHBondContact N-O 2.85Å; R116-N215 PolarHBondContact NE-ND2 3.13Å; R116-N215 PolarHBondContact NH2-ND2 3.09Å; R116-N215 PolarHBondContact NH2-OD1 2.91Å; R116-N217 WeakPolarHBondContact CG-ND2 3.47Å; R116-N217 VanDerWaalsContact CG-OD1 3.24Å; R116-N217 WeakPolarHBondContact CG-OD1 3.49Å
117	D	86.5	Confident	87.7	Confident	6 Å²	6	33.9 Å²	33.9	3%	0.032	18%	0.175	C	C	.	.			trans	-84.6	80.7	179	-171.7	8.7	0	0	0	110.9	Y115 N119 G120 E121 T122 N217 N219 H360	Y115-D117 HydrophobicContact CD2-CB 4.4Å; Y115-D117 HydrophobicContact CE2-CB 3.9Å; Y115-D117 PolarHBondContact O-N 3.18Å; D117-N119 VanDerWaalsContact C-N 3.35Å; D117-G120 VanDerWaalsContact OD1-CA 3.32Å; D117-G120 WeakPolarHBondContact OD1-CA 3.46Å; D117-G120 PolarHBondContact OD1-N 2.87Å; D117-G120 WeakPolarHBondContact OD2-CA 3.34Å; D117-E121 PolarHBondContact OD1-N 2.88Å; D117-T122 PolarHBondContact OD1-N 2.9Å; D117-T122 VanDerWaalsContact OD2-CA 3.28Å; D117-T122 WeakPolarHBondContact OD2-CA 3.45Å; D117-T122 VanDerWaalsContact OD2-CG2 3.3Å; D117-T122 WeakPolarHBondContact OD2-CG2 3.43Å; D117-T122 PolarHBondContact OD2-N 2.76Å; D117-N217 PolarHBondContact N-O 3.05Å; D117-N219 WeakPolarHBondContact CB-ND2 3.17Å; D117-N219 PolarHBondContact OD2-ND2 2.83Å; D117-H360 PolarHBondContact O-CE1 3.04Å
118	I	82.7	Confident	85.9	Confident	97 Å²	97	35.8 Å²	35.8	50%	0.497	20%	0.196	S	C	.	.	S	Bend	trans	-69.4	-35.1	-175.4	-60.2	175.8	0	0	0	111.7	R116 Q130	R116-I118 HydrophobicContact CB-CG1 4.45Å; R116-I118 HydrophobicContact CG-CG1 3.89Å; R116-I118 PolarHBondContact O-N 3.28Å; R116-I118 VanDerWaalsContact O-N 3.07Å; I118-Q130 VanDerWaalsContact CD1-OE1 3.29Å
119	N	83.6	Confident	84.2	Confident	111 Å²	111	46.5 Å²	46.5	59%	0.594	24%	0.242	S	C	*	.	S	Bend	trans	-92	-6.9	-175.1	-61	-18.9	0	0	0	112.7	D117 E121	D117-N119 VanDerWaalsContact C-N 3.35Å; N119-E121 HydrophobicContact CB-CB 4.5Å; N119-E121 HydrophobicContact CB-CG 3.84Å; N119-E121 PolarHBondContact O-N 3.13Å
120	G	82.6	Confident	82.6	Confident	11 Å²	11	51 Å²	51	11%	0.113	26%	0.264	C	S	.	.	S	Bend	trans	65.6	23	-173.2	0	0	0	0	0	112.5	D117 T122 P356 H357	D117-G120 VanDerWaalsContact OD1-CA 3.32Å; D117-G120 WeakPolarHBondContact OD1-CA 3.46Å; D117-G120 PolarHBondContact OD1-N 2.87Å; D117-G120 WeakPolarHBondContact OD2-CA 3.34Å; G120-T122 VanDerWaalsContact C-N 3.32Å; G120-P356 CarbonylContact O-C 3.59Å; G120-H357 WeakPolarHBondContact O-CA 3.46Å; G120-H357 PolarHBondContact O-N 3.47Å
121	E	87.4	Confident	81.7	Confident	88 Å²	88	52.4 Å²	52.4	41%	0.411	27%	0.272	S	S	.	.			trans	-83.4	-15.1	-176.8	-73.6	-178.9	177.2	0	0	111.9	D117 N119 I123 R302	D117-E121 PolarHBondContact OD1-N 2.88Å; N119-E121 HydrophobicContact CB-CB 4.5Å; N119-E121 HydrophobicContact CB-CG 3.84Å; N119-E121 PolarHBondContact O-N 3.13Å; E121-I123 HydrophobicContact CB-CD1 4.21Å; E121-I123 HydrophobicContact CB-CG1 4.34Å; E121-I123 PolarHBondContact O-N 2.97Å; E121-R302 PolarHBondContact O-NH2 2.82Å
122	T	88	Confident	81.1	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.012	29%	0.285	C	S	.	.			trans	52.9	37.2	-175.7	59.8	0	0	0	0	112.5	Y115 D117 G120 R302 N352 G354 S355	Y115-T122 VanDerWaalsContact OH-C 3.25Å; Y115-T122 WeakPolarHBondContact OH-CA 3.17Å; D117-T122 PolarHBondContact OD1-N 2.9Å; D117-T122 VanDerWaalsContact OD2-CA 3.28Å; D117-T122 WeakPolarHBondContact OD2-CA 3.45Å; D117-T122 VanDerWaalsContact OD2-CG2 3.3Å; D117-T122 WeakPolarHBondContact OD2-CG2 3.43Å; D117-T122 PolarHBondContact OD2-N 2.76Å; G120-T122 VanDerWaalsContact C-N 3.32Å; T122-R302 PolarHBondContact O-NH2 3.15Å; T122-R302 PolarHBondContact OG1-NH2 2.93Å; T122-N352 WeakPolarHBondContact O-CB 3.18Å; T122-G354 PolarHBondContact OG1-O 3.44Å; T122-G354 VanDerWaalsContact OG1-O 3.08Å; T122-S355 PolarHBondContact OG1-O 2.84Å
123	I	88	Confident	80.7	Confident	79 Å²	79	56.4 Å²	56.4	41%	0.405	29%	0.294	S	S	.	.			trans	-109.8	118.2	174.5	-65.6	168.1	0	0	0	107.6	Y115 E121	Y115-I123 WeakPolarHBondContact CE2-O 3.36Å; E121-I123 HydrophobicContact CB-CD1 4.21Å; E121-I123 HydrophobicContact CB-CG1 4.34Å; E121-I123 PolarHBondContact O-N 2.97Å
124	A	87.9	Confident	80.6	Confident	3 Å²	3	56.4 Å²	56.4	3%	0.025	29%	0.294	C	S	.	.			trans	-70.8	129.6	176.7	0	0	0	0	0	110.1	Y115 S221 I350 N352	Y115-A124 HydrophobicContact CD1-CB 3.84Å; Y115-A124 HydrophobicContact CE1-CB 3.68Å; Y115-A124 HydrophobicContact CG-CB 4.41Å; A124-S221 WeakPolarHBondContact CB-OG 3.06Å; A124-I350 HydrophobicContact CB-CG2 3.94Å; A124-N352 PolarHBondContact N-OD1 2.93Å
125	P	82.5	Confident	80.5	Confident	49 Å²	49	58.3 Å²	58.3	32%	0.318	30%	0.304	S	S	.	.			trans	-74.1	139.2	173.6	28.7	-30.6	0	0	0	110.4	T127 T131	P125-T127 VanDerWaalsContact C-N 3.31Å; P125-T127 PolarHBondContact O-N 2.93Å; P125-T131 HydrophobicContact CB-CG2 4.42Å; P125-T131 HydrophobicContact CG-CG2 3.52Å
126	D	70.4	Confident	80.5	Confident	42 Å²	42	58.2 Å²	58.2	23%	0.225	30%	0.304	C	S	.	.	S	Bend	trans	-59.4	-38	-179	-81.9	24.2	0	0	0	113.9	T305 R307 I350	D126-T305 PolarHBondContact OD1-OG1 2.97Å; D126-R307 IonicContact OD2-CZ 2.83Å; D126-R307 IonicContact OD2-NE 3.35Å; D126-R307 IonicContact OD2-NH1 3.55Å; D126-R307 PolarHBondContact OD2-NH1 2.94Å; D126-I350 WeakPolarHBondContact OD1-CD1 3.47Å
127	T	67.3	Low	80.6	Confident	75 Å²	75	53.9 Å²	53.9	46%	0.46	29%	0.289	S	S	.	.	S	Bend	trans	-155.7	152.1	-179.4	58.4	0	0	0	0	109.5	P125 Y313	P125-T127 VanDerWaalsContact C-N 3.31Å; P125-T127 PolarHBondContact O-N 2.93Å; T127-Y313 HydrophobicContact CG2-CD1 4.33Å; T127-Y313 HydrophobicContact CG2-CG 4.38Å
128	G	61	Low	80.9	Confident	45 Å²	45	55.6 Å²	55.6	46%	0.464	30%	0.298	S	S	.	.			trans	161.9	172.4	168.8	0	0	0	0	0	114.5	Q130 T131	G128-Q130 PolarHBondContact O-N 3.43Å; G128-Q130 VanDerWaalsContact O-N 3.17Å; G128-T131 PolarHBondContact N-OG1 2.85Å; G128-T131 PolarHBondContact O-N 3Å; G128-T131 PolarHBondContact O-OG1 2.78Å
129	K	60.6	Low	81.4	Confident	225 Å²	225	51 Å²	51	98%	0.978	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-11	176.9	-67.1	-175.2	178.3	-178.4	0	113.9
130	Q	63	Low	81.8	Confident	101 Å²	101	47.7 Å²	47.7	47%	0.472	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	12.2	-176.9	-60.4	-179.8	-1.9	0	0	112.4	Y115 R116 I118 G128	Y115-Q130 WeakPolarHBondContact CA-O 3.42Å; R116-Q130 PolarHBondContact N-O 2.85Å; I118-Q130 VanDerWaalsContact CD1-OE1 3.29Å; G128-Q130 PolarHBondContact O-N 3.43Å; G128-Q130 VanDerWaalsContact O-N 3.17Å
131	T	76.1	Confident	82.4	Confident	31 Å²	31	47.5 Å²	47.5	19%	0.19	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.8	178.2	57.8	0	0	0	0	109.9	I113 R114 P125 G128	I113-T131 HydrophobicContact CG2-CG2 4.07Å; R114-T131 WeakPolarHBondContact O-CA 3.47Å; P125-T131 HydrophobicContact CB-CG2 4.42Å; P125-T131 HydrophobicContact CG-CG2 3.52Å; G128-T131 PolarHBondContact N-OG1 2.85Å; G128-T131 PolarHBondContact O-N 3Å; G128-T131 PolarHBondContact O-OG1 2.78Å
132	E	79.8	Confident	82.8	Confident	78 Å²	78	46.4 Å²	46.4	36%	0.364	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	147.4	161.8	-69.1	-174.3	-148.2	0	0	108.3	R114 I214	R114-E132 IonicContact CZ-OE2 3.69Å; R114-E132 PolarHBondContact N-O 3.28Å; R114-E132 IonicContact NE-OE2 3.3Å; R114-E132 IonicContact NH2-OE1 3.62Å; R114-E132 IonicContact NH2-OE2 3.9Å; R114-E132 PolarHBondContact NH2-OE2 3.11Å; R114-E132 PolarHBondContact O-N 3.16Å; R114-E132 VanDerWaalsContact O-O 3.14Å; E132-I214 WeakPolarHBondContact OE1-CD1 3.44Å
133	T	83.8	Confident	83.1	Confident	34 Å²	34	49 Å²	49	21%	0.209	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	114.9	-166.3	-64.3	0	0	0	0	108.6	R111 L135	R111-T133 HydrophobicContact CB-CG2 3.47Å; R111-T133 VanDerWaalsContact CB-CG2 3.47Å; R111-T133 HydrophobicContact CG-CG2 3.92Å; T133-L135 HydrophobicContact CG2-CD2 3.79Å; T133-L135 HydrophobicContact CG2-CG 4.32Å; T133-L135 PolarHBondContact O-N 3.28Å
134	F	89.6	Confident	83.5	Confident	1 Å²	1	47.6 Å²	47.6	0%	0.004	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	103.6	167.1	-59.6	-102.2	0	0	0	107.5	R111 I112 R114 G136 L139 E169 I171 V211 F220	R111-F134 CarbonylContact C-O 3.51Å; R111-F134 WeakPolarHBondContact CA-O 3.17Å; R111-F134 WeakPolarHBondContact CB-O 3.36Å; I112-F134 HydrophobicContact CB-CB 4.22Å; I112-F134 PolarHBondContact N-O 3.03Å; I112-F134 PolarHBondContact O-N 3.43Å; R114-F134 HydrophobicContact CB-CE2 3.99Å; F134-G136 PolarHBondContact O-N 3.08Å; F134-L139 HydrophobicContact CB-CD2 4.38Å; F134-L139 HydrophobicContact CD1-CD2 4.3Å; F134-E169 HydrophobicContact CD1-CB 3.82Å; F134-E169 HydrophobicContact CD1-CG 3.91Å; F134-E169 WeakPolarHBondContact CD1-OE2 3.47Å; F134-E169 HydrophobicContact CE1-CB 3.74Å; F134-E169 HydrophobicContact CE1-CG 4.11Å; F134-E169 HydrophobicContact CG-CG 4.41Å; F134-I171 HydrophobicContact CE1-CG1 4.25Å; F134-V211 HydrophobicContact CE1-CG1 3.98Å; F134-V211 HydrophobicContact CE2-CG1 4.24Å; F134-V211 HydrophobicContact CZ-CG1 3.68Å; F134-F220 HydrophobicContact CD2-CE1 4.45Å; F134-F220 AromaticContact CE2-CE1 3.81Å; F134-F220 HydrophobicContact CE2-CE1 3.81Å; F134-F220 HydrophobicContact CZ-CE1 4.43Å
135	L	90.3	Very high	83.8	Confident	45 Å²	45	48.4 Å²	48.4	24%	0.236	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	130.4	176.6	-68	178.6	0	0	0	109.4	R111 T133 S137 N138 L139	R111-L135 HydrophobicContact CB-CD2 4.12Å; T133-L135 HydrophobicContact CG2-CD2 3.79Å; T133-L135 HydrophobicContact CG2-CG 4.32Å; T133-L135 PolarHBondContact O-N 3.28Å; L135-S137 PolarHBondContact O-N 3.1Å; L135-N138 HydrophobicContact CB-CB 4.11Å; L135-N138 PolarHBondContact O-N 3.14Å; L135-L139 WeakPolarHBondContact O-CG 3.06Å; L135-L139 PolarHBondContact O-N 3.36Å
136	G	90.7	Very high	84.3	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.01	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-27.6	178.1	0	0	0	0	0	112.9	H110 F134 W141	H110-G136 PolarHBondContact O-N 3.02Å; F134-G136 PolarHBondContact O-N 3.08Å; G136-W141 PolarHBondContact O-NE1 2.88Å
137	S	91.5	Very high	85.2	Confident	7 Å²	7	54.5 Å²	54.5	5%	0.049	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-14.5	176	36.5	0	0	0	0	115	L135 S318	L135-S137 PolarHBondContact O-N 3.1Å; S137-S318 WeakPolarHBondContact CB-O 3.34Å; S137-S318 WeakPolarHBondContact OG-CA 3.41Å; S137-S318 PolarHBondContact OG-O 3.25Å
138	N	92.1	Very high	86.1	Confident	43 Å²	43	53.6 Å²	53.6	23%	0.23	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-11.2	174.9	-72.1	-3.7	0	0	0	112.1	L135 S164 L165	L135-N138 HydrophobicContact CB-CB 4.11Å; L135-N138 PolarHBondContact O-N 3.14Å; N138-S164 CarbonylContact O-C 3.49Å; N138-S164 WeakPolarHBondContact O-CA 3.14Å; N138-S164 PolarHBondContact O-OG 2.8Å; N138-L165 WeakPolarHBondContact O-CB 3.28Å; N138-L165 WeakPolarHBondContact O-CG 3.33Å; N138-L165 PolarHBondContact O-N 2.77Å
139	L	92.9	Very high	86.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	125.6	176.9	-68.6	177.7	0	0	0	109	I112 F134 L135 W141 A161 I171 I175	I112-L139 HydrophobicContact CD1-CD1 4.35Å; F134-L139 HydrophobicContact CB-CD2 4.38Å; F134-L139 HydrophobicContact CD1-CD2 4.3Å; L135-L139 WeakPolarHBondContact O-CG 3.06Å; L135-L139 PolarHBondContact O-N 3.36Å; L139-W141 VanDerWaalsContact C-N 3.29Å; L139-W141 HydrophobicContact CB-CD2 4.43Å; L139-W141 HydrophobicContact CB-CZ2 4.03Å; L139-W141 HydrophobicContact CD1-CH2 4.26Å; L139-W141 HydrophobicContact CD1-CZ2 3.51Å; L139-W141 HydrophobicContact CG-CZ2 4.43Å; L139-W141 PolarHBondContact O-N 2.97Å; L139-W141 PolarHBondContact O-NE1 3.06Å; L139-A161 HydrophobicContact CB-CB 3.87Å; L139-I171 HydrophobicContact CD2-CD1 3.56Å; L139-I175 HydrophobicContact CD1-CD1 3.92Å; L139-I175 HydrophobicContact CD2-CD1 4.02Å
140	N	93.3	Very high	87.4	Confident	41 Å²	41	51.3 Å²	51.3	22%	0.219	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	82.5	-178.8	-172	-3.2	0	0	0	110.5	E60 Q163	E60-N140 WeakPolarHBondContact CB-OD1 3.47Å; E60-N140 HydrophobicContact CG-CB 4.43Å; E60-N140 WeakPolarHBondContact CG-OD1 3.12Å; N140-Q163 PolarHBondContact N-O 3Å
141	W	95.3	Very high	87.9	Confident	7 Å²	7	55.8 Å²	55.8	3%	0.027	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	127.2	-177.5	-62	100.5	0	0	0	111.8	A58 S59 P64 L109 G136 L139 A161 I175 L177	A58-W141 HydrophobicContact CB-CB 4Å; A58-W141 HydrophobicContact CB-CG 4.15Å; S59-W141 CarbonylContact C-O 3.51Å; P64-W141 VanDerWaalsContact CD-NE1 3.26Å; P64-W141 HydrophobicContact CG-CD2 3.67Å; P64-W141 HydrophobicContact CG-CE3 4.3Å; P64-W141 HydrophobicContact CG-CG 4.06Å; P64-W141 HydrophobicContact CG-CH2 4.11Å; P64-W141 HydrophobicContact CG-CZ2 3.49Å; P64-W141 VanDerWaalsContact CG-CZ2 3.49Å; P64-W141 HydrophobicContact CG-CZ3 4.49Å; L109-W141 HydrophobicContact CD2-CH2 4.04Å; L109-W141 HydrophobicContact CD2-CZ2 3.97Å; G136-W141 PolarHBondContact O-NE1 2.88Å; L139-W141 VanDerWaalsContact C-N 3.29Å; L139-W141 HydrophobicContact CB-CD2 4.43Å; L139-W141 HydrophobicContact CB-CZ2 4.03Å; L139-W141 HydrophobicContact CD1-CH2 4.26Å; L139-W141 HydrophobicContact CD1-CZ2 3.51Å; L139-W141 HydrophobicContact CG-CZ2 4.43Å; L139-W141 PolarHBondContact O-N 2.97Å; L139-W141 PolarHBondContact O-NE1 3.06Å; W141-A161 HydrophobicContact CD2-CB 3.98Å; W141-A161 HydrophobicContact CE3-CB 3.8Å; W141-A161 HydrophobicContact CH2-CB 4.46Å; W141-A161 HydrophobicContact CZ3-CB 4.07Å; W141-I175 HydrophobicContact CH2-CB 4.45Å; W141-I175 HydrophobicContact CH2-CG2 3.59Å; W141-I175 HydrophobicContact CZ2-CG2 4.47Å; W141-I175 HydrophobicContact CZ3-CG2 4.14Å; W141-L177 HydrophobicContact CH2-CB 4.32Å; W141-L177 HydrophobicContact CZ3-CB 4.04Å
142	T	95.2	Very high	88	Confident	66 Å²	66	57.2 Å²	57.2	41%	0.405	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	149.9	173.2	59.9	0	0	0	0	109.7	A144 Y159 E160	T142-A144 PolarHBondContact O-N 3.42Å; T142-Y159 CarbonylContact O-C 3.56Å; T142-Y159 VanDerWaalsContact O-CA 3.24Å; T142-Y159 WeakPolarHBondContact O-CA 3.33Å; T142-E160 PolarHBondContact N-O 3.28Å; T142-E160 PolarHBondContact O-N 2.89Å; T142-E160 PolarHBondContact OG1-O 3.49Å
143	V	94.7	Very high	88.2	Confident	55 Å²	55	56.5 Å²	56.5	33%	0.333	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	113.2	174.5	178.7	0	0	0	0	108	Y41 Y159	Y41-V143 HydrophobicContact CE2-CG2 4.15Å; Y41-V143 VanDerWaalsContact OH-CG1 3.23Å; Y41-V143 WeakPolarHBondContact OH-CG1 3.41Å; Y41-V143 VanDerWaalsContact OH-CG2 3.29Å; Y41-V143 WeakPolarHBondContact OH-CG2 3.16Å; V143-Y159 HydrophobicContact CG2-CD1 4.05Å; V143-Y159 HydrophobicContact CG2-CE1 3.6Å
144	A	94.6	Very high	88.5	Confident	50 Å²	50	56.9 Å²	56.9	41%	0.413	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-41.9	174.1	0	0	0	0	0	111.1	T142 E158 E160	T142-A144 PolarHBondContact O-N 3.42Å; A144-E158 HydrophobicContact CB-CB 4.07Å; A144-E158 PolarHBondContact N-O 3.02Å; A144-E160 HydrophobicContact CB-CB 4.22Å; A144-E160 HydrophobicContact CB-CG 3.94Å
145	S	94.2	Very high	88.6	Confident	20 Å²	20	56.9 Å²	56.9	14%	0.14	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	149	178.8	88.1	0	0	0	0	112.5	E158	S145-E158 PolarHBondContact N-O 3.08Å; S145-E158 PolarHBondContact O-N 3.45Å; S145-E158 PolarHBondContact OG-OE2 2.85Å
146	F	93.6	Very high	88.9	Confident	74 Å²	74	55.1 Å²	55.1	33%	0.325	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	118.3	164.2	173.2	-126.9	0	0	0	108.1	V32 Y41 N148 I155 T156 I157	V32-F146 HydrophobicContact CG2-CD1 4.13Å; V32-F146 HydrophobicContact CG2-CE1 3.63Å; V32-F146 HydrophobicContact CG2-CZ 3.95Å; Y41-F146 AromaticContact CD1-CD2 3.83Å; Y41-F146 HydrophobicContact CD1-CD2 3.83Å; Y41-F146 AromaticContact CD1-CE2 3.9Å; Y41-F146 HydrophobicContact CD1-CE2 3.9Å; Y41-F146 HydrophobicContact CD1-CG 4.17Å; Y41-F146 HydrophobicContact CD1-CZ 4.3Å; Y41-F146 HydrophobicContact CE1-CB 3.86Å; Y41-F146 AromaticContact CE1-CD1 3.99Å; Y41-F146 HydrophobicContact CE1-CD1 3.99Å; Y41-F146 AromaticContact CE1-CD2 3.68Å; Y41-F146 HydrophobicContact CE1-CD2 3.68Å; Y41-F146 HydrophobicContact CE1-CE1 4.44Å; Y41-F146 HydrophobicContact CE1-CE2 4.16Å; Y41-F146 AromaticContact CE1-CG 3.57Å; Y41-F146 HydrophobicContact CE1-CG 3.57Å; F146-N148 HydrophobicContact CE2-CB 4.34Å; F146-N148 HydrophobicContact CZ-CB 4.02Å; F146-I155 HydrophobicContact CE2-CG2 3.96Å; F146-T156 CarbonylContact C-O 3.56Å; F146-T156 WeakPolarHBondContact CA-O 3.4Å; F146-I157 HydrophobicContact CD2-CG1 3.57Å; F146-I157 HydrophobicContact CE2-CG1 3.91Å
147	R	90.5	Very high	89.1	Confident	145 Å²	145	55.1 Å²	55.1	55%	0.547	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	119.7	-178.4	-58.6	-175.2	-169.4	-175.7	3.7	109.5	I155 T156	R147-I155 WeakPolarHBondContact O-CA 3.02Å; R147-T156 PolarHBondContact N-O 3.05Å; R147-T156 PolarHBondContact O-N 2.5Å
148	N	86.2	Confident	89.4	Confident	56 Å²	56	57.3 Å²	57.3	30%	0.299	30%	0.302	S	S	.	.			trans	-144.7	64.2	171.8	179.6	27.8	0	0	0	109.2	S30 F146 I155 K183	S30-N148 PolarHBondContact OG-ND2 3.08Å; F146-N148 HydrophobicContact CE2-CB 4.34Å; F146-N148 HydrophobicContact CZ-CB 4.02Å; N148-I155 HydrophobicContact CB-CG1 4.44Å; N148-I155 HydrophobicContact CB-CG2 4.31Å; N148-I155 WeakPolarHBondContact OD1-CG1 3.42Å; N148-K183 PolarHBondContact OD1-NZ 2.97Å
149	D	77.4	Confident	89.7	Confident	103 Å²	103	55.3 Å²	55.3	55%	0.551	29%	0.291	S	S	*	.			trans	-79.2	142.9	173.4	-72.1	-22.6	0	0	0	109.8	K151 D152 K183	D149-K151 PolarHBondContact O-N 3.21Å; D149-K151 VanDerWaalsContact O-N 3.14Å; D149-D152 HydrophobicContact CB-CB 4.21Å; D149-D152 PolarHBondContact O-N 3.09Å; D149-K183 PolarHBondContact O-NZ 3.3Å
150	S	71.8	Confident	89.9	Confident	120 Å²	120	57 Å²	57	84%	0.839	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-20.1	178.1	68.6	0	0	0	0	112.8
151	K	73	Confident	90.1	Very high	195 Å²	195	55.1 Å²	55.1	85%	0.848	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-20.9	176.3	-64.1	-177.9	-178.7	176.9	0	112.8	D149	D149-K151 PolarHBondContact O-N 3.21Å; D149-K151 VanDerWaalsContact O-N 3.14Å
152	D	77.5	Confident	90.1	Very high	60 Å²	60	60.6 Å²	60.6	32%	0.321	31%	0.31	S	S	.	.	S	Bend	trans	-78.4	133.4	178.3	-74.3	-5.6	0	0	0	109.3	D149 Q154 K183	D149-D152 HydrophobicContact CB-CB 4.21Å; D149-D152 PolarHBondContact O-N 3.09Å; D152-Q154 PolarHBondContact O-N 3Å; D152-K183 WeakPolarHBondContact O-CD 3.43Å; D152-K183 PolarHBondContact O-NZ 3.14Å
153	N	84.9	Confident	90	Very high	64 Å²	64	63.8 Å²	63.8	34%	0.342	32%	0.32	S	S	.	.	S	Bend	trans	-75	4.4	176.8	67.4	-22.3	0	0	0	112.9	K183	N153-K183 WeakPolarHBondContact O-CB 3.47Å; N153-K183 PolarHBondContact O-N 2.93Å
154	Q	89.3	Confident	89.9	Confident	41 Å²	41	62.1 Å²	62.1	19%	0.192	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	162.2	-177.8	66.7	-176.3	53	0	0	111.9	D152 T156 V181 Y182	D152-Q154 PolarHBondContact O-N 3Å; Q154-T156 PolarHBondContact NE2-OG1 3.03Å; Q154-V181 CarbonylContact C-O 3.56Å; Q154-V181 WeakPolarHBondContact CA-O 3.48Å; Q154-V181 WeakPolarHBondContact CB-O 3.17Å; Q154-Y182 HydrophobicContact CB-CD1 3.83Å; Q154-Y182 HydrophobicContact CB-CE1 4.09Å; Q154-Y182 HydrophobicContact CB-CG 4.43Å
155	I	92.8	Very high	89.6	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	130.5	167.8	-58.5	177.8	0	0	0	106.6	I28 I43 F146 R147 N148 K180 V181	I28-I155 HydrophobicContact CG2-CD1 3.82Å; I43-I155 HydrophobicContact CD1-CB 4.28Å; I43-I155 HydrophobicContact CD1-CG2 3.78Å; I43-I155 HydrophobicContact CG1-CG2 4.27Å; I43-I155 HydrophobicContact CG2-CD1 3.95Å; F146-I155 HydrophobicContact CE2-CG2 3.96Å; R147-I155 WeakPolarHBondContact O-CA 3.02Å; N148-I155 HydrophobicContact CB-CG1 4.44Å; N148-I155 HydrophobicContact CB-CG2 4.31Å; N148-I155 WeakPolarHBondContact OD1-CG1 3.42Å; I155-K180 CarbonylContact O-C 3.56Å; I155-K180 WeakPolarHBondContact O-CA 3.42Å; I155-V181 PolarHBondContact N-O 3.01Å; I155-V181 PolarHBondContact O-N 3.17Å
156	T	94.7	Very high	89.2	Confident	9 Å²	9	64.9 Å²	64.9	6%	0.055	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	131.5	-177.7	-56.1	0	0	0	0	111.1	F146 R147 Q154 E158 F179 K180	F146-T156 CarbonylContact C-O 3.56Å; F146-T156 WeakPolarHBondContact CA-O 3.4Å; R147-T156 PolarHBondContact N-O 3.05Å; R147-T156 PolarHBondContact O-N 2.5Å; Q154-T156 PolarHBondContact NE2-OG1 3.03Å; T156-E158 HydrophobicContact CG2-CG 4.16Å; T156-F179 CarbonylContact C-O 3.5Å; T156-F179 VanDerWaalsContact CA-O 3.3Å; T156-F179 WeakPolarHBondContact CA-O 3.08Å; T156-K180 HydrophobicContact CG2-CG 3.94Å
157	I	96.9	Very high	88.5	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.005	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	120.9	172.3	-57.3	151.6	0	0	0	107	Y41 I43 I56 F146 Y159 S178 F179	Y41-I157 HydrophobicContact CD1-CD1 3.81Å; Y41-I157 HydrophobicContact CD1-CG1 3.78Å; Y41-I157 HydrophobicContact CD1-CG2 4.28Å; Y41-I157 HydrophobicContact CD2-CG2 4.09Å; Y41-I157 HydrophobicContact CE1-CG1 4.27Å; Y41-I157 HydrophobicContact CE1-CG2 4.27Å; Y41-I157 HydrophobicContact CE2-CG2 4.05Å; Y41-I157 HydrophobicContact CG-CD1 3.7Å; Y41-I157 HydrophobicContact CG-CG1 4.07Å; Y41-I157 HydrophobicContact CG-CG2 4.2Å; I43-I157 HydrophobicContact CD1-CD1 4.16Å; I56-I157 HydrophobicContact CB-CD1 4.39Å; I56-I157 HydrophobicContact CD1-CD1 3.6Å; F146-I157 HydrophobicContact CD2-CG1 3.57Å; F146-I157 HydrophobicContact CE2-CG1 3.91Å; I157-Y159 HydrophobicContact CG2-CD2 4.14Å; I157-Y159 HydrophobicContact CG2-CE2 3.54Å; I157-S178 CarbonylContact O-C 3.6Å; I157-S178 WeakPolarHBondContact O-CA 3.44Å; I157-F179 HydrophobicContact CB-CB 4.36Å; I157-F179 PolarHBondContact N-O 3.21Å; I157-F179 PolarHBondContact O-N 2.92Å
158	E	97.7	Very high	88.1	Confident	53 Å²	53	66.5 Å²	66.5	25%	0.248	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130.5	176.5	-76.2	178.6	119	0	0	110.6	A144 S145 T156 L177	A144-E158 HydrophobicContact CB-CB 4.07Å; A144-E158 PolarHBondContact N-O 3.02Å; S145-E158 PolarHBondContact N-O 3.08Å; S145-E158 PolarHBondContact O-N 3.45Å; S145-E158 PolarHBondContact OG-OE2 2.85Å; T156-E158 HydrophobicContact CG2-CG 4.16Å; E158-L177 WeakPolarHBondContact CA-O 3.47Å
159	Y	97.8	Very high	87.9	Confident	1 Å²	1	64.7 Å²	64.7	0%	0.004	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	146.6	167.5	-66	-86.4	0	0	0	110.4	Y41 I56 A58 T142 V143 I157 K176 L177 F179	Y41-Y159 WeakPolarHBondContact CD2-OH 3.37Å; Y41-Y159 AromaticContact CE2-CZ 3.93Å; Y41-Y159 WeakPolarHBondContact CE2-OH 3.39Å; I56-Y159 HydrophobicContact CG2-CE2 3.95Å; A58-Y159 HydrophobicContact CB-CD1 3.73Å; A58-Y159 HydrophobicContact CB-CD2 4.24Å; A58-Y159 HydrophobicContact CB-CE1 3.68Å; A58-Y159 HydrophobicContact CB-CE2 4.21Å; A58-Y159 HydrophobicContact CB-CG 3.99Å; A58-Y159 PolarHBondContact N-OH 2.86Å; A58-Y159 WeakPolarHBondContact O-CE1 3.43Å; T142-Y159 CarbonylContact O-C 3.56Å; T142-Y159 VanDerWaalsContact O-CA 3.24Å; T142-Y159 WeakPolarHBondContact O-CA 3.33Å; V143-Y159 HydrophobicContact CG2-CD1 4.05Å; V143-Y159 HydrophobicContact CG2-CE1 3.6Å; I157-Y159 HydrophobicContact CG2-CD2 4.14Å; I157-Y159 HydrophobicContact CG2-CE2 3.54Å; Y159-K176 CarbonylContact O-C 3.56Å; Y159-K176 WeakPolarHBondContact O-CA 3.31Å; Y159-L177 PolarHBondContact N-O 2.8Å; Y159-L177 PolarHBondContact O-N 3.3Å; Y159-F179 HydrophobicContact CD2-CD2 4.23Å; Y159-F179 AromaticContact CD2-CE2 3.95Å; Y159-F179 HydrophobicContact CD2-CE2 3.95Å; Y159-F179 HydrophobicContact CE2-CD2 4.33Å; Y159-F179 HydrophobicContact CE2-CE2 4.12Å
160	E	97.5	Very high	88.4	Confident	36 Å²	36	64.4 Å²	64.4	17%	0.168	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	141.4	171.1	71.1	173	-156.2	0	0	112	T142 A144 R162 V174 I175 K176	T142-E160 PolarHBondContact N-O 3.28Å; T142-E160 PolarHBondContact O-N 2.89Å; T142-E160 PolarHBondContact OG1-O 3.49Å; A144-E160 HydrophobicContact CB-CB 4.22Å; A144-E160 HydrophobicContact CB-CG 3.94Å; E160-R162 IonicContact OE1-CZ 3.38Å; E160-R162 IonicContact OE1-NE 2.69Å; E160-R162 PolarHBondContact OE1-NE 2.86Å; E160-R162 IonicContact OE1-NH2 2.86Å; E160-R162 PolarHBondContact OE1-NH2 2.91Å; E160-R162 IonicContact OE2-CZ 3.3Å; E160-R162 IonicContact OE2-NE 3.08Å; E160-R162 IonicContact OE2-NH2 3.98Å; E160-R162 PolarHBondContact OE2-NH2 2.91Å; E160-V174 HydrophobicContact CB-CG2 3.63Å; E160-V174 HydrophobicContact CG-CG2 4.45Å; E160-I175 CarbonylContact C-O 3.59Å; E160-I175 WeakPolarHBondContact CA-O 3.39Å; E160-K176 HydrophobicContact CB-CG 4.31Å
161	A	96.7	Very high	89.3	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	120.2	169.2	0	0	0	0	0	109	L139 W141 I175	L139-A161 HydrophobicContact CB-CB 3.87Å; W141-A161 HydrophobicContact CD2-CB 3.98Å; W141-A161 HydrophobicContact CE3-CB 3.8Å; W141-A161 HydrophobicContact CH2-CB 4.46Å; W141-A161 HydrophobicContact CZ3-CB 4.07Å; A161-I175 HydrophobicContact CB-CB 4.46Å; A161-I175 PolarHBondContact N-O 3.03Å; A161-I175 PolarHBondContact O-N 3.45Å
162	R	95.9	Very high	90.1	Very high	122 Å²	122	55 Å²	55	46%	0.46	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-8.3	178.5	-64.4	179	177.7	-80.9	-8	112.9	E160 V174	E160-R162 IonicContact OE1-CZ 3.38Å; E160-R162 IonicContact OE1-NE 2.69Å; E160-R162 PolarHBondContact OE1-NE 2.86Å; E160-R162 IonicContact OE1-NH2 2.86Å; E160-R162 PolarHBondContact OE1-NH2 2.91Å; E160-R162 IonicContact OE2-CZ 3.3Å; E160-R162 IonicContact OE2-NE 3.08Å; E160-R162 IonicContact OE2-NH2 3.98Å; E160-R162 PolarHBondContact OE2-NH2 2.91Å; R162-V174 HydrophobicContact CG-CB 4.22Å; R162-V174 HydrophobicContact CG-CG2 3.96Å
163	Q	93.5	Very high	90.9	Very high	133 Å²	133	52.7 Å²	52.7	62%	0.621	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.4	147	-177.3	-61.4	-177.9	12.5	0	0	108.3	N140	N140-Q163 PolarHBondContact N-O 3Å
164	S	91.6	Very high	91.5	Very high	21 Å²	21	49.8 Å²	49.8	15%	0.147	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	148.4	164.4	-173.8	0	0	0	0	109.4	N138 D166 E169	N138-S164 CarbonylContact O-C 3.49Å; N138-S164 WeakPolarHBondContact O-CA 3.14Å; N138-S164 PolarHBondContact O-OG 2.8Å; S164-D166 PolarHBondContact OG-N 3.16Å; S164-D166 VanDerWaalsContact OG-N 3.1Å; S164-E169 VanDerWaalsContact CB-CB 3.47Å; S164-E169 VanDerWaalsContact CB-OE2 3.27Å; S164-E169 WeakPolarHBondContact CB-OE2 3.3Å; S164-E169 PolarHBondContact OG-OE2 2.79Å
165	L	88.9	Confident	91.8	Very high	76 Å²	76	47.9 Å²	47.9	40%	0.398	24%	0.243	S	C	.	.	S	Bend	trans	-73.5	-18.9	168.3	-61.1	176	0	0	0	111.5	E60 Y61 N138	E60-L165 HydrophobicContact CG-CD1 4Å; E60-L165 HydrophobicContact CG-CD2 4.2Å; E60-L165 WeakPolarHBondContact O-CD1 3.25Å; Y61-L165 HydrophobicContact CD1-CD1 3.83Å; Y61-L165 HydrophobicContact CE1-CD1 3.62Å; N138-L165 WeakPolarHBondContact O-CB 3.28Å; N138-L165 WeakPolarHBondContact O-CG 3.33Å; N138-L165 PolarHBondContact O-N 2.77Å
166	D	85.9	Confident	92.1	Very high	52 Å²	52	51.4 Å²	51.4	28%	0.278	26%	0.258	S	S	.	.	S	Bend	trans	-82.5	117.8	170.2	-165.6	-35.4	0	0	0	110	S164 H168 E169	S164-D166 PolarHBondContact OG-N 3.16Å; S164-D166 VanDerWaalsContact OG-N 3.1Å; D166-H168 PolarHBondContact O-N 3.24Å; D166-H168 WeakPolarHBondContact OD1-CB 3.24Å; D166-H168 IonicContact OD1-CD2 3.93Å; D166-H168 PolarHBondContact OD1-CD2 2.86Å; D166-H168 IonicContact OD1-CG 3.95Å; D166-H168 PolarHBondContact OD1-N 2.8Å; D166-E169 HydrophobicContact CB-CB 4.3Å; D166-E169 HydrophobicContact CB-CG 3.98Å; D166-E169 PolarHBondContact O-N 2.84Å
167	S	78.9	Confident	92.2	Very high	111 Å²	111	51.2 Å²	51.2	78%	0.776	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-16.1	-178.9	62	0	0	0	0	114.9
168	H	81.2	Confident	92.2	Very high	142 Å²	142	51.4 Å²	51.4	66%	0.657	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-12.3	176.4	-59.7	-58.2	0	0	0	113	D166	D166-H168 PolarHBondContact O-N 3.24Å; D166-H168 WeakPolarHBondContact OD1-CB 3.24Å; D166-H168 IonicContact OD1-CD2 3.93Å; D166-H168 PolarHBondContact OD1-CD2 2.86Å; D166-H168 IonicContact OD1-CG 3.95Å; D166-H168 PolarHBondContact OD1-N 2.8Å
169	E	82.8	Confident	92.2	Very high	18 Å²	18	49 Å²	49	8%	0.084	25%	0.247	C	C	.	.			trans	-101.5	110.3	-178.3	-68.7	173.9	-158.5	0	0	110.4	F134 S164 D166	F134-E169 HydrophobicContact CD1-CB 3.82Å; F134-E169 HydrophobicContact CD1-CG 3.91Å; F134-E169 WeakPolarHBondContact CD1-OE2 3.47Å; F134-E169 HydrophobicContact CE1-CB 3.74Å; F134-E169 HydrophobicContact CE1-CG 4.11Å; F134-E169 HydrophobicContact CG-CG 4.41Å; S164-E169 VanDerWaalsContact CB-CB 3.47Å; S164-E169 VanDerWaalsContact CB-OE2 3.27Å; S164-E169 WeakPolarHBondContact CB-OE2 3.3Å; S164-E169 PolarHBondContact OG-OE2 2.79Å; D166-E169 HydrophobicContact CB-CB 4.3Å; D166-E169 HydrophobicContact CB-CG 3.98Å; D166-E169 PolarHBondContact O-N 2.84Å
170	K	86.2	Confident	92	Very high	96 Å²	96	50.5 Å²	50.5	42%	0.417	25%	0.253	S	S	.	.			trans	-105	133.8	179.4	-160.3	-174.1	177.8	-130.3	0	111.9	D172 E212	K170-D172 WeakPolarHBondContact CE-OD1 3.48Å; K170-D172 VanDerWaalsContact NZ-CG 3.28Å; K170-D172 IonicContact NZ-OD1 3.81Å; K170-D172 PolarHBondContact NZ-OD1 2.88Å; K170-D172 IonicContact NZ-OD2 3.94Å; K170-D172 PolarHBondContact NZ-OD2 2.84Å; K170-E212 HydrophobicContact CB-CB 4.06Å; K170-E212 VanDerWaalsContact CB-OE2 3.23Å; K170-E212 WeakPolarHBondContact CB-OE2 3.46Å; K170-E212 VanDerWaalsContact CD-OE1 3.29Å; K170-E212 WeakPolarHBondContact CD-OE1 3.35Å; K170-E212 IonicContact NZ-OE1 3.36Å; K170-E212 WeakPolarHBondContact O-CB 3.42Å; K170-E212 PolarHBondContact O-N 3.33Å
171	I	90.9	Very high	91.8	Very high	17 Å²	17	48.8 Å²	48.8	9%	0.087	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	104.7	175.5	-56.4	171	0	0	0	106.9	F134 L139 I175	F134-I171 HydrophobicContact CE1-CG1 4.25Å; L139-I171 HydrophobicContact CD2-CD1 3.56Å; I171-I175 HydrophobicContact CD1-CD1 3.82Å; I171-I175 HydrophobicContact CD1-CG1 4.29Å; I171-I175 HydrophobicContact CG1-CD1 4.39Å
172	D	90.9	Very high	91.3	Very high	101 Å²	101	48.9 Å²	48.9	54%	0.54	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	-23	179.8	-74.3	-28.4	0	0	0	112	K170 K210	K170-D172 WeakPolarHBondContact CE-OD1 3.48Å; K170-D172 VanDerWaalsContact NZ-CG 3.28Å; K170-D172 IonicContact NZ-OD1 3.81Å; K170-D172 PolarHBondContact NZ-OD1 2.88Å; K170-D172 IonicContact NZ-OD2 3.94Å; K170-D172 PolarHBondContact NZ-OD2 2.84Å; D172-K210 PolarHBondContact N-O 3Å; D172-K210 VanDerWaalsContact N-O 3.16Å
173	G	94.1	Very high	90.8	Very high	11 Å²	11	45.4 Å²	45.4	11%	0.113	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	-106.7	173.4	0	0	0	0	0	112.7	D209 K210	G173-D209 CarbonylContact C-O 3.53Å; G173-D209 VanDerWaalsContact CA-O 3.29Å; G173-D209 WeakPolarHBondContact CA-O 3.43Å; G173-K210 PolarHBondContact N-O 2.86Å
174	V	96.3	Very high	89.9	Confident	4 Å²	4	42.5 Å²	42.5	2%	0.024	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	138.7	-171.8	63.4	0	0	0	0	112.1	E160 R162 K176 D209	E160-V174 HydrophobicContact CB-CG2 3.63Å; E160-V174 HydrophobicContact CG-CG2 4.45Å; R162-V174 HydrophobicContact CG-CB 4.22Å; R162-V174 HydrophobicContact CG-CG2 3.96Å; V174-K176 HydrophobicContact CG1-CD 4.32Å; V174-K176 HydrophobicContact CG1-CG 4.09Å; V174-K176 HydrophobicContact CG2-CG 3.72Å; V174-D209 HydrophobicContact CG1-CB 4.06Å; V174-D209 PolarHBondContact N-O 2.79Å; V174-D209 PolarHBondContact O-N 2.77Å
175	I	97.2	Very high	88.8	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	123.6	162.6	-60.3	176.4	0	0	0	106.7	I112 L139 W141 E160 A161 I171 L206 T207 L208 V211	I112-I175 HydrophobicContact CD1-CD1 3.93Å; I112-I175 HydrophobicContact CD1-CG2 4.06Å; L139-I175 HydrophobicContact CD1-CD1 3.92Å; L139-I175 HydrophobicContact CD2-CD1 4.02Å; W141-I175 HydrophobicContact CH2-CB 4.45Å; W141-I175 HydrophobicContact CH2-CG2 3.59Å; W141-I175 HydrophobicContact CZ2-CG2 4.47Å; W141-I175 HydrophobicContact CZ3-CG2 4.14Å; E160-I175 CarbonylContact C-O 3.59Å; E160-I175 WeakPolarHBondContact CA-O 3.39Å; A161-I175 HydrophobicContact CB-CB 4.46Å; A161-I175 PolarHBondContact N-O 3.03Å; A161-I175 PolarHBondContact O-N 3.45Å; I171-I175 HydrophobicContact CD1-CD1 3.82Å; I171-I175 HydrophobicContact CD1-CG1 4.29Å; I171-I175 HydrophobicContact CG1-CD1 4.39Å; I175-L206 HydrophobicContact CG2-CD1 3.92Å; I175-T207 CarbonylContact C-O 3.53Å; I175-T207 WeakPolarHBondContact CA-O 3.35Å; I175-L208 HydrophobicContact CB-CD2 4.4Å; I175-L208 HydrophobicContact CD1-CD2 4.36Å; I175-L208 HydrophobicContact CG1-CD2 3.97Å; I175-L208 HydrophobicContact CG2-CD2 3.85Å; I175-V211 HydrophobicContact CD1-CG2 4.1Å; I175-V211 HydrophobicContact CG1-CG2 3.6Å
176	K	97.8	Very high	87.6	Confident	74 Å²	74	45.3 Å²	45.3	32%	0.322	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	142.2	178.9	-61.9	-179.2	176.1	175.4	0	110.9	Y159 E160 V174 L206 T207	Y159-K176 CarbonylContact O-C 3.56Å; Y159-K176 WeakPolarHBondContact O-CA 3.31Å; E160-K176 HydrophobicContact CB-CG 4.31Å; V174-K176 HydrophobicContact CG1-CD 4.32Å; V174-K176 HydrophobicContact CG1-CG 4.09Å; V174-K176 HydrophobicContact CG2-CG 3.72Å; K176-L206 WeakPolarHBondContact O-CA 3.21Å; K176-T207 PolarHBondContact N-O 3.37Å; K176-T207 PolarHBondContact O-N 3.43Å
177	L	97.9	Very high	86.1	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.031	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	115.4	171.7	-170.1	68.6	0	0	0	109.1	P64 L109 W141 E158 Y159 F179 I204 E205 L206	P64-L177 HydrophobicContact CB-CD2 3.28Å; P64-L177 HydrophobicContact CG-CD2 3.9Å; L109-L177 HydrophobicContact CD2-CD2 4.35Å; W141-L177 HydrophobicContact CH2-CB 4.32Å; W141-L177 HydrophobicContact CZ3-CB 4.04Å; E158-L177 WeakPolarHBondContact CA-O 3.47Å; Y159-L177 PolarHBondContact N-O 2.8Å; Y159-L177 PolarHBondContact O-N 3.3Å; L177-F179 HydrophobicContact CD2-CE2 3.57Å; L177-F179 HydrophobicContact CD2-CZ 3.47Å; L177-F179 VanDerWaalsContact CD2-CZ 3.47Å; L177-F179 HydrophobicContact CG-CE2 3.75Å; L177-F179 HydrophobicContact CG-CZ 3.92Å; L177-I204 HydrophobicContact CD1-CG2 3.68Å; L177-I204 HydrophobicContact CG-CG2 4.45Å; L177-E205 CarbonylContact C-O 3.51Å; L177-E205 WeakPolarHBondContact CA-O 3.37Å; L177-L206 HydrophobicContact CD1-CB 4.09Å; L177-L206 HydrophobicContact CD1-CD1 4.27Å
178	S	97.3	Very high	84.9	Confident	4 Å²	4	45.9 Å²	45.9	3%	0.028	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.5	178.9	-179.3	0	0	0	0	110.5	I157 K180 I204 E205	I157-S178 CarbonylContact O-C 3.6Å; I157-S178 WeakPolarHBondContact O-CA 3.44Å; S178-K180 VanDerWaalsContact OG-CE 3.31Å; S178-K180 WeakPolarHBondContact OG-CE 3.18Å; S178-I204 WeakPolarHBondContact O-CA 3.41Å; S178-E205 PolarHBondContact N-O 3.45Å; S178-E205 PolarHBondContact O-N 2.77Å
179	F	96.7	Very high	83.6	Confident	4 Å²	4	43.9 Å²	43.9	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.2	171.5	-61.9	-89.3	0	0	0	109.3	I56 L66 T156 I157 Y159 L177 I202 L203 I204	I56-F179 HydrophobicContact CD1-CB 3.92Å; I56-F179 HydrophobicContact CD1-CD1 4.17Å; I56-F179 HydrophobicContact CD1-CG 4.04Å; I56-F179 HydrophobicContact CG1-CD1 4.32Å; I56-F179 HydrophobicContact CG1-CG 4.48Å; I56-F179 HydrophobicContact CG2-CD1 4.31Å; I56-F179 HydrophobicContact CG2-CD2 3.71Å; I56-F179 HydrophobicContact CG2-CE1 4.28Å; I56-F179 HydrophobicContact CG2-CE2 3.67Å; I56-F179 HydrophobicContact CG2-CG 4.03Å; I56-F179 HydrophobicContact CG2-CZ 3.95Å; L66-F179 HydrophobicContact CB-CE1 4.06Å; T156-F179 CarbonylContact C-O 3.5Å; T156-F179 VanDerWaalsContact CA-O 3.3Å; T156-F179 WeakPolarHBondContact CA-O 3.08Å; I157-F179 HydrophobicContact CB-CB 4.36Å; I157-F179 PolarHBondContact N-O 3.21Å; I157-F179 PolarHBondContact O-N 2.92Å; Y159-F179 HydrophobicContact CD2-CD2 4.23Å; Y159-F179 AromaticContact CD2-CE2 3.95Å; Y159-F179 HydrophobicContact CD2-CE2 3.95Å; Y159-F179 HydrophobicContact CE2-CD2 4.33Å; Y159-F179 HydrophobicContact CE2-CE2 4.12Å; L177-F179 HydrophobicContact CD2-CE2 3.57Å; L177-F179 HydrophobicContact CD2-CZ 3.47Å; L177-F179 VanDerWaalsContact CD2-CZ 3.47Å; L177-F179 HydrophobicContact CG-CE2 3.75Å; L177-F179 HydrophobicContact CG-CZ 3.92Å; F179-I202 HydrophobicContact CB-CD1 4.01Å; F179-I202 HydrophobicContact CD1-CD1 4.07Å; F179-L203 CarbonylContact C-O 3.59Å; F179-L203 VanDerWaalsContact CA-O 3.23Å; F179-L203 WeakPolarHBondContact CA-O 3.43Å; F179-I204 HydrophobicContact CD1-CG1 3.78Å; F179-I204 HydrophobicContact CD1-CG2 4.44Å; F179-I204 HydrophobicContact CE1-CG1 3.93Å; F179-I204 HydrophobicContact CE1-CG2 4.21Å
180	K	93.9	Very high	82.2	Confident	31 Å²	31	51 Å²	51	14%	0.135	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	119	-176.5	-63.1	174.5	-175.1	152.6	0	110.8	I155 T156 S178 Y182 L203 E205	I155-K180 CarbonylContact O-C 3.56Å; I155-K180 WeakPolarHBondContact O-CA 3.42Å; T156-K180 HydrophobicContact CG2-CG 3.94Å; S178-K180 VanDerWaalsContact OG-CE 3.31Å; S178-K180 WeakPolarHBondContact OG-CE 3.18Å; K180-Y182 HydrophobicContact CB-CE2 4.06Å; K180-L203 HydrophobicContact CB-CD2 4.11Å; K180-L203 HydrophobicContact CD-CD2 3.88Å; K180-L203 HydrophobicContact CG-CD2 4.32Å; K180-L203 PolarHBondContact N-O 2.83Å; K180-L203 WeakPolarHBondContact O-CA 3.4Å; K180-L203 PolarHBondContact O-N 2.85Å; K180-E205 IonicContact NZ-OE2 2.88Å; K180-E205 PolarHBondContact NZ-OE2 3.26Å
181	V	92.2	Very high	81	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	124.4	172.1	178.8	0	0	0	0	108.6	I43 F54 Q154 I155 I202	I43-V181 HydrophobicContact CD1-CB 4.24Å; I43-V181 HydrophobicContact CD1-CG2 3.66Å; I43-V181 HydrophobicContact CG2-CG1 4.47Å; F54-V181 HydrophobicContact CD2-CG2 4.21Å; F54-V181 HydrophobicContact CE2-CG1 4.3Å; F54-V181 HydrophobicContact CE2-CG2 4.35Å; F54-V181 HydrophobicContact CG-CG2 4.38Å; Q154-V181 CarbonylContact C-O 3.56Å; Q154-V181 WeakPolarHBondContact CA-O 3.48Å; Q154-V181 WeakPolarHBondContact CB-O 3.17Å; I155-V181 PolarHBondContact N-O 3.01Å; I155-V181 PolarHBondContact O-N 3.17Å; V181-I202 HydrophobicContact CG2-CB 4Å; V181-I202 HydrophobicContact CG2-CD1 3.72Å; V181-I202 HydrophobicContact CG2-CG1 3.72Å
182	Y	87.6	Confident	79.9	Confident	3 Å²	3	50.3 Å²	50.3	1%	0.012	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	129.2	-177.8	-68.8	-87.8	0	0	0	111.3	Q154 K180 E186 I196 A199	Q154-Y182 HydrophobicContact CB-CD1 3.83Å; Q154-Y182 HydrophobicContact CB-CE1 4.09Å; Q154-Y182 HydrophobicContact CB-CG 4.43Å; K180-Y182 HydrophobicContact CB-CE2 4.06Å; Y182-E186 HydrophobicContact CD1-CB 3.92Å; Y182-E186 HydrophobicContact CD1-CG 4.44Å; Y182-E186 HydrophobicContact CE1-CB 4.12Å; Y182-E186 HydrophobicContact CE1-CG 4.27Å; Y182-E186 WeakPolarHBondContact CE1-OE2 3.46Å; Y182-E186 HydrophobicContact CG-CB 4.45Å; Y182-E186 PolarHBondContact OH-OE2 2.93Å; Y182-I196 HydrophobicContact CD2-CD1 3.61Å; Y182-I196 HydrophobicContact CD2-CG2 3.84Å; Y182-I196 HydrophobicContact CE2-CD1 3.29Å; Y182-I196 HydrophobicContact CG-CG2 4.46Å; Y182-A199 PolarHBondContact O-N 2.89Å
183	K	84.6	Confident	79	Confident	48 Å²	48	45.6 Å²	45.6	21%	0.209	23%	0.225	C	C	.	.	S	Bend	trans	-78.2	-32.3	178.4	-57.3	177.1	-173.5	164.5	0	111.8	I28 N148 D149 D152 N153	I28-K183 HydrophobicContact CD1-CB 3.93Å; I28-K183 HydrophobicContact CD1-CG 4.02Å; N148-K183 PolarHBondContact OD1-NZ 2.97Å; D149-K183 PolarHBondContact O-NZ 3.3Å; D152-K183 WeakPolarHBondContact O-CD 3.43Å; D152-K183 PolarHBondContact O-NZ 3.14Å; N153-K183 WeakPolarHBondContact O-CB 3.47Å; N153-K183 PolarHBondContact O-N 2.93Å
184	T	75.9	Confident	78.1	Confident	73 Å²	73	45.1 Å²	45.1	45%	0.448	22%	0.22	S	C	.	.	S	Bend	trans	-119.3	152.6	176.4	57.7	0	0	0	0	109.7	E186	T184-E186 PolarHBondContact O-N 2.95Å
185	T	67.5	Low	77	Confident	100 Å²	100	46.9 Å²	46.9	61%	0.613	23%	0.232	S	C	*	.			trans	-58.6	115	174.5	-46.1	0	0	0	0	108.8
186	E	63.9	Low	75.8	Confident	56 Å²	56	47 Å²	47	26%	0.262	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-95.8	133.6	173.9	-153	-172.7	-149.9	0	0	108.2	Y182 T184	Y182-E186 HydrophobicContact CD1-CB 3.92Å; Y182-E186 HydrophobicContact CD1-CG 4.44Å; Y182-E186 HydrophobicContact CE1-CB 4.12Å; Y182-E186 HydrophobicContact CE1-CG 4.27Å; Y182-E186 WeakPolarHBondContact CE1-OE2 3.46Å; Y182-E186 HydrophobicContact CG-CB 4.45Å; Y182-E186 PolarHBondContact OH-OE2 2.93Å; T184-E186 PolarHBondContact O-N 2.95Å
187	Q	54.8	Low	74.5	Confident	159 Å²	159	45.6 Å²	45.6	74%	0.743	23%	0.227	S	C	*	.	P	Polyproline II helix	trans	-68.9	130.9	159.6	-75.1	-166	-26.8	0	0	106.7
188	P	53.8	Low	73.4	Confident	16 Å²	16	47.1 Å²	47.1	10%	0.104	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-52.5	163.3	-173.6	29.7	-42.2	0	0	0	111.2	K190 Y194	P188-K190 PolarHBondContact O-N 2.78Å; P188-Y194 HydrophobicContact CB-CD2 3.82Å; P188-Y194 HydrophobicContact CB-CE2 3.58Å; P188-Y194 WeakPolarHBondContact CB-O 3.09Å; P188-Y194 WeakPolarHBondContact CG-O 3.39Å
189	H	53.1	Low	72.5	Confident	99 Å²	99	47 Å²	47	46%	0.458	23%	0.234	S	C	.	.	S	Bend	trans	-41.1	112.3	153.3	-76.8	-72.8	0	0	0	107.1	Q191 M192	H189-Q191 PolarHBondContact O-N 2.77Å; H189-M192 PolarHBondContact O-N 2.92Å
190	K	52.5	Low	72.1	Confident	168 Å²	168	49.2 Å²	49.2	73%	0.73	25%	0.246	S	C	*	.	S	Bend	trans	-41.8	126.9	175.3	-69.2	-179.7	177.2	-179	0	105.8	P188	P188-K190 PolarHBondContact O-N 2.78Å
191	Q	61.9	Low	72	Confident	97 Å²	97	47.8 Å²	47.8	45%	0.453	24%	0.24	S	C	.	.	S	Bend	trans	88.4	42.9	178.8	-44.2	151.7	0.8	0	0	117.5	H189 P252	H189-Q191 PolarHBondContact O-N 2.77Å; Q191-P252 HydrophobicContact CB-CB 4.38Å; Q191-P252 HydrophobicContact CB-CG 4.48Å; Q191-P252 WeakPolarHBondContact O-CD 3.45Å; Q191-P252 VanDerWaalsContact O-CG 3.24Å; Q191-P252 WeakPolarHBondContact O-CG 3.41Å
192	M	66.9	Low	72.1	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	24%	0.24	C	C	.	.	S	Bend	trans	-136.7	13.5	179.5	-99.4	-77.9	177.2	0	0	117	H189 Y194 P286 W290 I371	H189-M192 PolarHBondContact O-N 2.92Å; M192-Y194 HydrophobicContact CB-CD1 3.85Å; M192-Y194 HydrophobicContact CB-CE1 3.43Å; M192-Y194 VanDerWaalsContact CB-CE1 3.43Å; M192-Y194 HydrophobicContact CG-CE1 4.04Å; M192-Y194 WeakPolarHBondContact O-CD1 3.26Å; M192-Y194 PolarHBondContact O-N 3.08Å; M192-Y194 HydrophobicContact SD-CE1 4.09Å; M192-P286 HydrophobicContact SD-CB 4.38Å; M192-W290 HydrophobicContact CE-CD2 4.01Å; M192-W290 HydrophobicContact CE-CG 4.02Å; M192-W290 HydrophobicContact CE-CZ2 3.85Å; M192-W290 HydrophobicContact CG-CZ2 4.24Å; M192-I371 HydrophobicContact CE-CD1 4Å; M192-I371 HydrophobicContact SD-CD1 4.32Å
193	Y	73.6	Confident	72.4	Confident	3 Å²	3	47.7 Å²	47.7	1%	0.012	24%	0.24	C	C	.	.	S	Bend	trans	62.4	17.5	174.7	-53.7	-75.3	0	0	0	116.8	P252 L253 G254 I256 Q284 A287 A288	Y193-P252 VanDerWaalsContact CE2-CD 3.43Å; Y193-L253 VanDerWaalsContact OH-CA 3.3Å; Y193-L253 WeakPolarHBondContact OH-CA 3.42Å; Y193-L253 WeakPolarHBondContact OH-CB 3.39Å; Y193-L253 PolarHBondContact OH-N 2.97Å; Y193-L253 VanDerWaalsContact OH-N 3.08Å; Y193-G254 WeakPolarHBondContact CE1-O 3.36Å; Y193-G254 PolarHBondContact OH-N 3.08Å; Y193-G254 PolarHBondContact OH-O 2.85Å; Y193-I256 HydrophobicContact CE1-CB 4.03Å; Y193-I256 HydrophobicContact CE1-CG1 4.46Å; Y193-Q284 PolarHBondContact O-NE2 2.61Å; Y193-A287 HydrophobicContact CD2-CB 4.04Å; Y193-A287 HydrophobicContact CE2-CB 4.11Å; Y193-A287 HydrophobicContact CG-CB 4.45Å; Y193-A288 HydrophobicContact CD2-CB 4.32Å; Y193-A288 HydrophobicContact CE2-CB 3.79Å
194	Y	75.7	Confident	72.9	Confident	1 Å²	1	45.5 Å²	45.5	0%	0.004	23%	0.23	C	C	.	.			trans	-138.5	153.5	-179.1	64.8	-105.9	0	0	0	115.5	P188 M192 I196 L203 Q284 P286 I371 I373	P188-Y194 HydrophobicContact CB-CD2 3.82Å; P188-Y194 HydrophobicContact CB-CE2 3.58Å; P188-Y194 WeakPolarHBondContact CB-O 3.09Å; P188-Y194 WeakPolarHBondContact CG-O 3.39Å; M192-Y194 HydrophobicContact CB-CD1 3.85Å; M192-Y194 HydrophobicContact CB-CE1 3.43Å; M192-Y194 VanDerWaalsContact CB-CE1 3.43Å; M192-Y194 HydrophobicContact CG-CE1 4.04Å; M192-Y194 WeakPolarHBondContact O-CD1 3.26Å; M192-Y194 PolarHBondContact O-N 3.08Å; M192-Y194 HydrophobicContact SD-CE1 4.09Å; Y194-I196 HydrophobicContact CD2-CD1 4.28Å; Y194-I196 HydrophobicContact CD2-CG1 3.68Å; Y194-I196 HydrophobicContact CE2-CD1 3.75Å; Y194-I196 HydrophobicContact CE2-CG1 3.68Å; Y194-L203 HydrophobicContact CE1-CD1 4.27Å; Y194-L203 HydrophobicContact CE2-CD1 3.87Å; Y194-L203 VanDerWaalsContact OH-CD1 3.3Å; Y194-L203 WeakPolarHBondContact OH-CD1 3.44Å; Y194-Q284 VanDerWaalsContact CB-NE2 3.3Å; Y194-P286 HydrophobicContact CD1-CB 4.22Å; Y194-P286 HydrophobicContact CD1-CG 3.53Å; Y194-P286 HydrophobicContact CE1-CG 4.07Å; Y194-I371 HydrophobicContact CE1-CG2 3.97Å; Y194-I373 HydrophobicContact CD1-CD1 4.07Å; Y194-I373 HydrophobicContact CD2-CD1 3.65Å; Y194-I373 HydrophobicContact CE2-CD1 4.41Å; Y194-I373 HydrophobicContact CG-CD1 3.49Å; Y194-I373 VanDerWaalsContact CG-CD1 3.49Å
195	C	71.8	Confident	73.9	Confident	41 Å²	41	43.4 Å²	43.4	28%	0.277	22%	0.215	S	C	.	.			trans	-117.1	130.1	163.3	-70	0	0	0	0	108.4	Q245	C195-Q245 PolarHBondContact O-NE2 2.84Å
196	I	72	Confident	75.3	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.015	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-89.8	118.1	179.5	-58	-177.2	0	0	0	108.6	Y182 Y194 N198 S201 L203 I373	Y182-I196 HydrophobicContact CD2-CD1 3.61Å; Y182-I196 HydrophobicContact CD2-CG2 3.84Å; Y182-I196 HydrophobicContact CE2-CD1 3.29Å; Y182-I196 HydrophobicContact CG-CG2 4.46Å; Y194-I196 HydrophobicContact CD2-CD1 4.28Å; Y194-I196 HydrophobicContact CD2-CG1 3.68Å; Y194-I196 HydrophobicContact CE2-CD1 3.75Å; Y194-I196 HydrophobicContact CE2-CG1 3.68Å; I196-N198 PolarHBondContact O-N 2.68Å; I196-S201 WeakPolarHBondContact CG2-OG 3.4Å; I196-L203 HydrophobicContact CD1-CB 4.35Å; I196-L203 HydrophobicContact CD1-CD1 3.79Å; I196-I373 HydrophobicContact CG1-CD1 4.45Å
197	E	71.6	Confident	76.9	Confident	45 Å²	45	36.9 Å²	36.9	21%	0.21	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-71	116.7	167.4	-70.3	177	-170.9	0	0	108.7	A199 S201	E197-A199 PolarHBondContact O-N 3.06Å; E197-S201 PolarHBondContact N-OG 3.06Å; E197-S201 PolarHBondContact O-N 2.82Å; E197-S201 PolarHBondContact O-OG 2.96Å
198	N	74.2	Confident	78.9	Confident	37 Å²	37	29.5 Å²	29.5	20%	0.198	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	136.7	-174.6	62.2	-41.2	0	0	0	111.3	I196 L200	I196-N198 PolarHBondContact O-N 2.68Å; N198-L200 PolarHBondContact O-N 3.1Å
199	A	79.3	Confident	80.9	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.008	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	-18.4	177.5	0	0	0	0	0	116.9	F26 I28 V45 F54 Y182 E197	F26-A199 HydrophobicContact CB-CB 4.4Å; F26-A199 HydrophobicContact CD2-CB 4.32Å; F26-A199 HydrophobicContact CG-CB 4.41Å; I28-A199 HydrophobicContact CD1-CB 3.48Å; I28-A199 VanDerWaalsContact CD1-CB 3.48Å; I28-A199 HydrophobicContact CG1-CB 4.13Å; V45-A199 HydrophobicContact CB-CB 4.37Å; V45-A199 HydrophobicContact CG1-CB 3.47Å; V45-A199 VanDerWaalsContact CG1-CB 3.47Å; V45-A199 HydrophobicContact CG2-CB 4.01Å; V45-A199 WeakPolarHBondContact CG2-O 3.25Å; F54-A199 WeakPolarHBondContact CE2-O 3.16Å; F54-A199 WeakPolarHBondContact CZ-O 3.31Å; Y182-A199 PolarHBondContact O-N 2.89Å; E197-A199 PolarHBondContact O-N 3.06Å
200	L	87.8	Confident	82.9	Confident	52 Å²	52	31.6 Å²	31.6	27%	0.272	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-7.6	179.2	-59.7	-177.5	0	0	0	113.3	F26 L52 N198 G375 I376	F26-L200 HydrophobicContact CE1-CD2 4.2Å; F26-L200 HydrophobicContact CZ-CD1 4.29Å; F26-L200 HydrophobicContact CZ-CD2 4.16Å; F26-L200 HydrophobicContact CZ-CG 4.32Å; L52-L200 HydrophobicContact CD2-CD2 4.19Å; N198-L200 PolarHBondContact O-N 3.1Å; L200-G375 WeakPolarHBondContact O-CA 3.08Å; L200-I376 PolarHBondContact O-N 3.48Å
201	S	91.2	Very high	84.8	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	157.4	178.3	67.8	0	0	0	0	112	I196 E197 A374	I196-S201 WeakPolarHBondContact CG2-OG 3.4Å; E197-S201 PolarHBondContact N-OG 3.06Å; E197-S201 PolarHBondContact O-N 2.82Å; E197-S201 PolarHBondContact O-OG 2.96Å; S201-A374 CarbonylContact C-O 3.55Å; S201-A374 VanDerWaalsContact CA-O 3.28Å; S201-A374 WeakPolarHBondContact CA-O 3.5Å
202	I	93.5	Very high	86.1	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	128.2	177.8	-174.3	167.1	0	0	0	110.6	F54 I56 L66 F179 V181 I204 I373 A374	F54-I202 HydrophobicContact CB-CD1 4.49Å; F54-I202 HydrophobicContact CD1-CB 3.93Å; F54-I202 HydrophobicContact CD1-CD1 4.16Å; F54-I202 HydrophobicContact CD1-CG2 3.82Å; F54-I202 HydrophobicContact CE1-CB 3.79Å; F54-I202 HydrophobicContact CE1-CG2 3.78Å; F54-I202 HydrophobicContact CG-CD1 4.49Å; I56-I202 HydrophobicContact CD1-CD1 3.66Å; L66-I202 HydrophobicContact CD1-CD1 4.11Å; L66-I202 HydrophobicContact CD1-CG2 4.45Å; L66-I202 HydrophobicContact CD2-CG2 3.62Å; F179-I202 HydrophobicContact CB-CD1 4.01Å; F179-I202 HydrophobicContact CD1-CD1 4.07Å; V181-I202 HydrophobicContact CG2-CB 4Å; V181-I202 HydrophobicContact CG2-CD1 3.72Å; V181-I202 HydrophobicContact CG2-CG1 3.72Å; I202-I204 HydrophobicContact CG2-CD1 4.02Å; I202-I204 WeakPolarHBondContact O-CD1 3.48Å; I202-I373 WeakPolarHBondContact O-CA 3.24Å; I202-A374 HydrophobicContact CG2-CB 3.91Å; I202-A374 WeakPolarHBondContact CG2-O 3.36Å; I202-A374 PolarHBondContact N-O 2.95Å; I202-A374 PolarHBondContact O-N 2.96Å; I202-A374 VanDerWaalsContact O-N 3.08Å
203	L	93.9	Very high	87.1	Confident	2 Å²	2	23.4 Å²	23.4	1%	0.01	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	110.8	162	169	-153	0	0	0	114.2	F179 K180 Y194 I196 I371 I373	F179-L203 CarbonylContact C-O 3.59Å; F179-L203 VanDerWaalsContact CA-O 3.23Å; F179-L203 WeakPolarHBondContact CA-O 3.43Å; K180-L203 HydrophobicContact CB-CD2 4.11Å; K180-L203 HydrophobicContact CD-CD2 3.88Å; K180-L203 HydrophobicContact CG-CD2 4.32Å; K180-L203 PolarHBondContact N-O 2.83Å; K180-L203 WeakPolarHBondContact O-CA 3.4Å; K180-L203 PolarHBondContact O-N 2.85Å; Y194-L203 HydrophobicContact CE1-CD1 4.27Å; Y194-L203 HydrophobicContact CE2-CD1 3.87Å; Y194-L203 VanDerWaalsContact OH-CD1 3.3Å; Y194-L203 WeakPolarHBondContact OH-CD1 3.44Å; I196-L203 HydrophobicContact CD1-CB 4.35Å; I196-L203 HydrophobicContact CD1-CD1 3.79Å; L203-I371 HydrophobicContact CD1-CG2 3.57Å; L203-I371 HydrophobicContact CD2-CG2 4.4Å; L203-I371 HydrophobicContact CG-CG2 3.66Å; L203-I373 HydrophobicContact CB-CG1 4.06Å
204	I	96.4	Very high	87.7	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	128.6	165.7	-52.3	96	0	0	0	110.4	L66 L177 S178 F179 I202 I371 F372 A374	L66-I204 HydrophobicContact CD2-CD1 4.01Å; L66-I204 HydrophobicContact CD2-CG1 4.38Å; L177-I204 HydrophobicContact CD1-CG2 3.68Å; L177-I204 HydrophobicContact CG-CG2 4.45Å; S178-I204 WeakPolarHBondContact O-CA 3.41Å; F179-I204 HydrophobicContact CD1-CG1 3.78Å; F179-I204 HydrophobicContact CD1-CG2 4.44Å; F179-I204 HydrophobicContact CE1-CG1 3.93Å; F179-I204 HydrophobicContact CE1-CG2 4.21Å; I202-I204 HydrophobicContact CG2-CD1 4.02Å; I202-I204 WeakPolarHBondContact O-CD1 3.48Å; I204-I371 CarbonylContact O-C 3.54Å; I204-I371 VanDerWaalsContact O-CA 3.3Å; I204-I371 WeakPolarHBondContact O-CA 3.3Å; I204-F372 HydrophobicContact CB-CD1 4.14Å; I204-F372 HydrophobicContact CB-CD2 4.31Å; I204-F372 HydrophobicContact CB-CE1 3.72Å; I204-F372 HydrophobicContact CB-CE2 3.89Å; I204-F372 HydrophobicContact CB-CG 4.42Å; I204-F372 HydrophobicContact CB-CZ 3.59Å; I204-F372 HydrophobicContact CD1-CD2 4.05Å; I204-F372 HydrophobicContact CD1-CE2 3.7Å; I204-F372 HydrophobicContact CD1-CZ 4.23Å; I204-F372 HydrophobicContact CG1-CE2 4.09Å; I204-F372 HydrophobicContact CG1-CZ 4.1Å; I204-F372 HydrophobicContact CG2-CD1 4.33Å; I204-F372 HydrophobicContact CG2-CE1 3.5Å; I204-F372 VanDerWaalsContact CG2-CE1 3.5Å; I204-F372 HydrophobicContact CG2-CE2 4.27Å; I204-F372 HydrophobicContact CG2-CZ 3.47Å; I204-F372 VanDerWaalsContact CG2-CZ 3.47Å; I204-F372 PolarHBondContact N-O 3.5Å; I204-F372 PolarHBondContact O-N 2.91Å; I204-F372 VanDerWaalsContact O-O 3.1Å; I204-A374 HydrophobicContact CD1-CB 3.99Å
205	E	96.1	Very high	88.2	Confident	29 Å²	29	29.7 Å²	29.7	14%	0.136	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	120.1	176.6	-180	175.4	-168.1	0	0	109.9	L177 S178 K180 S369 W370 I371	L177-E205 CarbonylContact C-O 3.51Å; L177-E205 WeakPolarHBondContact CA-O 3.37Å; S178-E205 PolarHBondContact N-O 3.45Å; S178-E205 PolarHBondContact O-N 2.77Å; K180-E205 IonicContact NZ-OE2 2.88Å; K180-E205 PolarHBondContact NZ-OE2 3.26Å; E205-S369 WeakPolarHBondContact CG-OG 3.39Å; E205-S369 PolarHBondContact OE1-OG 3.39Å; E205-W370 CarbonylContact C-O 3.59Å; E205-W370 WeakPolarHBondContact CA-O 3.43Å; E205-I371 HydrophobicContact CB-CG1 4.03Å; E205-I371 HydrophobicContact CG-CD1 4.49Å; E205-I371 HydrophobicContact CG-CG1 3.85Å
206	L	97.8	Very high	88.9	Confident	5 Å²	5	32.2 Å²	32.2	3%	0.026	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	119.6	172.7	173.9	65.2	0	0	0	109.1	L109 I175 K176 L177 L208 P222 S369 W370	L109-L206 HydrophobicContact CD1-CD2 4.25Å; L109-L206 HydrophobicContact CD2-CD1 3.98Å; I175-L206 HydrophobicContact CG2-CD1 3.92Å; K176-L206 WeakPolarHBondContact O-CA 3.21Å; L177-L206 HydrophobicContact CD1-CB 4.09Å; L177-L206 HydrophobicContact CD1-CD1 4.27Å; L206-L208 HydrophobicContact CD1-CD2 4.23Å; L206-L208 HydrophobicContact CG-CD2 4.37Å; L206-P222 HydrophobicContact CD2-CB 3.64Å; L206-P222 HydrophobicContact CD2-CG 4.07Å; L206-S369 WeakPolarHBondContact O-CA 3.3Å; L206-W370 HydrophobicContact CB-CE3 4.24Å; L206-W370 HydrophobicContact CD2-CE3 4.28Å; L206-W370 PolarHBondContact N-O 3.08Å; L206-W370 PolarHBondContact O-N 2.8Å
207	T	97.4	Very high	89.6	Confident	15 Å²	15	33.6 Å²	33.6	9%	0.092	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130.6	176.8	-50	0	0	0	0	110.7	I175 K176 Y367 S368 S369	I175-T207 CarbonylContact C-O 3.53Å; I175-T207 WeakPolarHBondContact CA-O 3.35Å; K176-T207 PolarHBondContact N-O 3.37Å; K176-T207 PolarHBondContact O-N 3.43Å; T207-Y367 HydrophobicContact CG2-CD2 4.28Å; T207-Y367 HydrophobicContact CG2-CE2 3.44Å; T207-Y367 VanDerWaalsContact CG2-CE2 3.44Å; T207-S368 CarbonylContact C-O 3.59Å; T207-S368 VanDerWaalsContact CA-O 3.29Å; T207-S368 WeakPolarHBondContact CA-O 3.28Å; T207-S369 PolarHBondContact OG1-OG 3.38Å
208	L	96.9	Very high	90.5	Very high	3 Å²	3	31.6 Å²	31.6	2%	0.016	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	104.3	170.5	-50	-176.7	0	0	0	108.2	I112 I175 L206 V211 F220 Y362 Y367 S368	I112-L208 HydrophobicContact CD1-CD2 3.76Å; I112-L208 HydrophobicContact CG2-CD1 4.09Å; I175-L208 HydrophobicContact CB-CD2 4.4Å; I175-L208 HydrophobicContact CD1-CD2 4.36Å; I175-L208 HydrophobicContact CG1-CD2 3.97Å; I175-L208 HydrophobicContact CG2-CD2 3.85Å; L206-L208 HydrophobicContact CD1-CD2 4.23Å; L206-L208 HydrophobicContact CG-CD2 4.37Å; L208-V211 HydrophobicContact CB-CG2 3.93Å; L208-V211 HydrophobicContact CD2-CG2 4.43Å; L208-F220 HydrophobicContact CD1-CB 3.54Å; L208-F220 HydrophobicContact CD1-CD1 4.05Å; L208-F220 HydrophobicContact CD1-CD2 4.44Å; L208-F220 HydrophobicContact CD1-CG 3.76Å; L208-Y362 HydrophobicContact CB-CE2 3.74Å; L208-Y362 HydrophobicContact CD1-CE2 4.47Å; L208-Y362 WeakPolarHBondContact O-CE2 3.41Å; L208-Y362 PolarHBondContact O-OH 2.91Å; L208-Y367 CarbonylContact O-C 3.51Å; L208-Y367 VanDerWaalsContact O-CA 3.3Å; L208-Y367 WeakPolarHBondContact O-CA 3.19Å; L208-S368 PolarHBondContact N-O 2.82Å; L208-S368 PolarHBondContact O-N 2.86Å
209	D	96	Very high	91.3	Very high	43 Å²	43	30.1 Å²	30.1	23%	0.23	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	113.6	179	177	17.6	0	0	0	109.5	G173 V174 V211 Y367	G173-D209 CarbonylContact C-O 3.53Å; G173-D209 VanDerWaalsContact CA-O 3.29Å; G173-D209 WeakPolarHBondContact CA-O 3.43Å; V174-D209 HydrophobicContact CG1-CB 4.06Å; V174-D209 PolarHBondContact N-O 2.79Å; V174-D209 PolarHBondContact O-N 2.77Å; D209-V211 VanDerWaalsContact C-N 3.32Å; D209-V211 PolarHBondContact O-N 2.92Å; D209-Y367 HydrophobicContact CB-CD2 4.07Å; D209-Y367 HydrophobicContact CB-CE2 4.38Å
210	K	94	Very high	91.9	Very high	116 Å²	116	30.3 Å²	30.3	50%	0.504	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	52.8	45.9	-177.8	-56.5	161.1	-170.4	174.5	0	113.2	D172 G173 N366	D172-K210 PolarHBondContact N-O 3Å; D172-K210 VanDerWaalsContact N-O 3.16Å; G173-K210 PolarHBondContact N-O 2.86Å; K210-N366 HydrophobicContact CG-CB 4.16Å; K210-N366 PolarHBondContact N-O 2.86Å
211	V	92.9	Very high	92.2	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.012	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	136.5	163	-175.3	0	0	0	0	107.5	F134 I175 L208 D209 V213 F220 Y362	F134-V211 HydrophobicContact CE1-CG1 3.98Å; F134-V211 HydrophobicContact CE2-CG1 4.24Å; F134-V211 HydrophobicContact CZ-CG1 3.68Å; I175-V211 HydrophobicContact CD1-CG2 4.1Å; I175-V211 HydrophobicContact CG1-CG2 3.6Å; L208-V211 HydrophobicContact CB-CG2 3.93Å; L208-V211 HydrophobicContact CD2-CG2 4.43Å; D209-V211 VanDerWaalsContact C-N 3.32Å; D209-V211 PolarHBondContact O-N 2.92Å; V211-V213 PolarHBondContact O-N 2.95Å; V211-F220 HydrophobicContact CB-CE1 4.32Å; V211-F220 HydrophobicContact CB-CZ 4.09Å; V211-F220 HydrophobicContact CG1-CE1 3.7Å; V211-F220 HydrophobicContact CG1-CZ 3.78Å; V211-Y362 WeakPolarHBondContact CB-OH 3.21Å; V211-Y362 PolarHBondContact N-OH 2.88Å
212	E	89.8	Confident	92.4	Very high	57 Å²	57	27.9 Å²	27.9	27%	0.266	15%	0.149	S	C	.	.			trans	-61.2	138.7	-173.2	-175.4	-175.1	-129.8	0	0	111.5	R114 K170	R114-E212 PolarHBondContact NH1-O 3.02Å; R114-E212 IonicContact NH1-OE2 3.01Å; K170-E212 HydrophobicContact CB-CB 4.06Å; K170-E212 VanDerWaalsContact CB-OE2 3.23Å; K170-E212 WeakPolarHBondContact CB-OE2 3.46Å; K170-E212 VanDerWaalsContact CD-OE1 3.29Å; K170-E212 WeakPolarHBondContact CD-OE1 3.35Å; K170-E212 IonicContact NZ-OE1 3.36Å; K170-E212 WeakPolarHBondContact O-CB 3.42Å; K170-E212 PolarHBondContact O-N 3.33Å
213	V	88	Confident	92.5	Very high	36 Å²	36	27.9 Å²	27.9	22%	0.218	15%	0.149	C	C	.	.			trans	-111.5	137.8	166.3	-69.9	0	0	0	0	109.2	V211 D218 F220 Y362 T363	V211-V213 PolarHBondContact O-N 2.95Å; V213-D218 HydrophobicContact CB-CB 4.19Å; V213-D218 HydrophobicContact CG1-CB 4.11Å; V213-F220 HydrophobicContact CG1-CE2 3.74Å; V213-F220 HydrophobicContact CG1-CZ 4.19Å; V213-Y362 HydrophobicContact CG1-CD1 3.79Å; V213-Y362 HydrophobicContact CG1-CE1 4.03Å; V213-T363 HydrophobicContact CG2-CG2 4.16Å
214	I	85.8	Confident	92.6	Very high	91 Å²	91	27.9 Å²	27.9	47%	0.467	15%	0.149	S	C	.	.	S	Bend	trans	-87.6	-38.2	176.9	-65.9	175.2	0	0	0	109.7	E132 D218	E132-I214 WeakPolarHBondContact OE1-CD1 3.44Å; I214-D218 WeakPolarHBondContact CA-OD2 3.28Å; I214-D218 PolarHBondContact N-OD2 3.29Å
215	N	86.6	Confident	92.5	Very high	45 Å²	45	27.8 Å²	27.8	24%	0.241	15%	0.148	C	C	.	.	S	Bend	trans	-123.3	156.1	-175.8	-45	-85.5	0	0	0	111.3	R116 N217 D218	R116-N215 PolarHBondContact NE-ND2 3.13Å; R116-N215 PolarHBondContact NH2-ND2 3.09Å; R116-N215 PolarHBondContact NH2-OD1 2.91Å; N215-N217 WeakPolarHBondContact CB-OD1 3.48Å; N215-N217 PolarHBondContact O-N 2.85Å; N215-N217 VanDerWaalsContact O-N 3.08Å; N215-D218 WeakPolarHBondContact CB-OD1 3.16Å; N215-D218 PolarHBondContact N-OD2 3.26Å; N215-D218 PolarHBondContact ND2-OD1 2.97Å; N215-D218 PolarHBondContact ND2-OD2 2.69Å; N215-D218 PolarHBondContact O-N 2.79Å; N215-D218 VanDerWaalsContact O-N 3.16Å
216	S	85.9	Confident	92.5	Very high	94 Å²	94	26.5 Å²	26.5	66%	0.657	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-15.9	-179.5	58.3	0	0	0	0	114.2	T363	S216-T363 VanDerWaalsContact O-CB 3.29Å; S216-T363 WeakPolarHBondContact O-CB 3.16Å; S216-T363 VanDerWaalsContact O-CG2 3.3Å; S216-T363 WeakPolarHBondContact O-CG2 3.4Å; S216-T363 PolarHBondContact O-OG1 2.93Å
217	N	87.6	Confident	92.4	Very high	31 Å²	31	26.3 Å²	26.3	17%	0.166	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.1	20	179.7	64.2	-26.3	0	0	0	113.7	R116 D117 N215 H360	R116-N217 WeakPolarHBondContact CG-ND2 3.47Å; R116-N217 VanDerWaalsContact CG-OD1 3.24Å; R116-N217 WeakPolarHBondContact CG-OD1 3.49Å; D117-N217 PolarHBondContact N-O 3.05Å; N215-N217 WeakPolarHBondContact CB-OD1 3.48Å; N215-N217 PolarHBondContact O-N 2.85Å; N215-N217 VanDerWaalsContact O-N 3.08Å; N217-H360 VanDerWaalsContact CB-CD2 3.46Å; N217-H360 WeakPolarHBondContact CB-CD2 3.24Å; N217-H360 VanDerWaalsContact CB-NE2 3.33Å; N217-H360 WeakPolarHBondContact CB-NE2 3.37Å
218	D	89.6	Confident	92.3	Very high	4 Å²	4	25.6 Å²	25.6	2%	0.021	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	139.2	171.2	-69.4	-11.2	0	0	0	110.2	R114 Y115 V213 I214 N215 T363	R114-D218 HydrophobicContact CG-CB 4.19Å; Y115-D218 CarbonylContact O-C 3.58Å; Y115-D218 WeakPolarHBondContact O-CA 3.4Å; V213-D218 HydrophobicContact CB-CB 4.19Å; V213-D218 HydrophobicContact CG1-CB 4.11Å; I214-D218 WeakPolarHBondContact CA-OD2 3.28Å; I214-D218 PolarHBondContact N-OD2 3.29Å; N215-D218 WeakPolarHBondContact CB-OD1 3.16Å; N215-D218 PolarHBondContact N-OD2 3.26Å; N215-D218 PolarHBondContact ND2-OD1 2.97Å; N215-D218 PolarHBondContact ND2-OD2 2.69Å; N215-D218 PolarHBondContact O-N 2.79Å; N215-D218 VanDerWaalsContact O-N 3.16Å; D218-T363 PolarHBondContact O-OG1 3.39Å
219	N	90.3	Very high	92.2	Very high	5 Å²	5	26.8 Å²	26.8	3%	0.027	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	164.1	175	-85.4	-34.6	0	0	0	109.8	R114 Y115 D117	R114-N219 WeakPolarHBondContact CA-O 3.3Å; Y115-N219 HydrophobicContact CD1-CB 4.41Å; Y115-N219 WeakPolarHBondContact CD1-O 3.31Å; Y115-N219 HydrophobicContact CE1-CB 3.76Å; Y115-N219 HydrophobicContact CE2-CB 4.19Å; Y115-N219 PolarHBondContact N-O 3.01Å; Y115-N219 PolarHBondContact O-N 3.08Å; D117-N219 WeakPolarHBondContact CB-ND2 3.17Å; D117-N219 PolarHBondContact OD2-ND2 2.83Å
220	F	93	Very high	91.9	Very high	6 Å²	6	25.7 Å²	25.7	3%	0.026	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	141.2	-179.3	-67.2	-92.1	0	0	0	111.7	I112 I113 R114 F134 L208 V211 V213 Y362	I112-F220 HydrophobicContact CG2-CB 4.22Å; I112-F220 HydrophobicContact CG2-CD1 3.79Å; I112-F220 HydrophobicContact CG2-CG 4.48Å; I113-F220 CarbonylContact O-C 3.53Å; I113-F220 VanDerWaalsContact O-CA 3.25Å; I113-F220 WeakPolarHBondContact O-CA 3.23Å; R114-F220 HydrophobicContact CB-CD1 4.07Å; R114-F220 HydrophobicContact CB-CE1 3.73Å; R114-F220 HydrophobicContact CB-CZ 4.31Å; R114-F220 HydrophobicContact CG-CE1 4.04Å; R114-F220 HydrophobicContact CG-CZ 4.09Å; F134-F220 HydrophobicContact CD2-CE1 4.45Å; F134-F220 AromaticContact CE2-CE1 3.81Å; F134-F220 HydrophobicContact CE2-CE1 3.81Å; F134-F220 HydrophobicContact CZ-CE1 4.43Å; L208-F220 HydrophobicContact CD1-CB 3.54Å; L208-F220 HydrophobicContact CD1-CD1 4.05Å; L208-F220 HydrophobicContact CD1-CD2 4.44Å; L208-F220 HydrophobicContact CD1-CG 3.76Å; V211-F220 HydrophobicContact CB-CE1 4.32Å; V211-F220 HydrophobicContact CB-CZ 4.09Å; V211-F220 HydrophobicContact CG1-CE1 3.7Å; V211-F220 HydrophobicContact CG1-CZ 3.78Å; V213-F220 HydrophobicContact CG1-CE2 3.74Å; V213-F220 HydrophobicContact CG1-CZ 4.19Å; F220-Y362 AromaticContact CD2-CD1 3.54Å; F220-Y362 HydrophobicContact CD2-CD1 3.54Å; F220-Y362 AromaticContact CD2-CD2 3.98Å; F220-Y362 HydrophobicContact CD2-CD2 3.98Å; F220-Y362 AromaticContact CD2-CE1 3.73Å; F220-Y362 HydrophobicContact CD2-CE1 3.73Å; F220-Y362 HydrophobicContact CD2-CE2 4.17Å; F220-Y362 AromaticContact CD2-CG 3.66Å; F220-Y362 HydrophobicContact CD2-CG 3.66Å; F220-Y362 AromaticContact CE2-CD1 3.28Å; F220-Y362 HydrophobicContact CE2-CD1 3.28Å; F220-Y362 HydrophobicContact CE2-CD2 4.46Å; F220-Y362 AromaticContact CE2-CE1 3.22Å; F220-Y362 HydrophobicContact CE2-CE1 3.22Å; F220-Y362 HydrophobicContact CE2-CE2 4.43Å; F220-Y362 AromaticContact CE2-CG 3.93Å; F220-Y362 HydrophobicContact CE2-CG 3.93Å; F220-Y362 AromaticContact CE2-CZ 3.85Å; F220-Y362 HydrophobicContact CZ-CD1 4.46Å; F220-Y362 HydrophobicContact CZ-CE1 4.07Å
221	S	94	Very high	91.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	119.3	176	171.9	0	0	0	0	110.2	I113 A124 I350 I351	I113-S221 PolarHBondContact N-O 3.34Å; I113-S221 PolarHBondContact O-N 2.93Å; A124-S221 WeakPolarHBondContact CB-OG 3.06Å; S221-I350 WeakPolarHBondContact OG-CG2 3.3Å; S221-I351 WeakPolarHBondContact CB-O 3.35Å; S221-I351 PolarHBondContact OG-O 3.27Å
222	P	95.6	Very high	91.3	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.006	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	145.4	173.2	26.1	-25.8	0	0	0	110.6	L109 L206 I351 L353 W370	L109-P222 HydrophobicContact CD1-CB 4.31Å; L206-P222 HydrophobicContact CD2-CB 3.64Å; L206-P222 HydrophobicContact CD2-CG 4.07Å; P222-I351 WeakPolarHBondContact CD-O 3.47Å; P222-I351 HydrophobicContact CG-CB 4.01Å; P222-I351 HydrophobicContact CG-CG2 4.45Å; P222-I351 PolarHBondContact O-N 2.84Å; P222-L353 HydrophobicContact CG-CD1 4.28Å; P222-W370 HydrophobicContact CB-CE3 4.35Å; P222-W370 HydrophobicContact CB-CZ3 4.03Å; P222-W370 HydrophobicContact CG-CD2 4.38Å; P222-W370 HydrophobicContact CG-CE3 3.58Å; P222-W370 HydrophobicContact CG-CH2 4.32Å; P222-W370 HydrophobicContact CG-CZ3 3.56Å
223	V	94.4	Very high	91	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	122.8	177.2	-174.8	0	0	0	0	108.6	H110 R111 I113 E348 Q349 I350	H110-V223 PolarHBondContact N-O 2.93Å; R111-V223 HydrophobicContact CG-CB 3.62Å; R111-V223 HydrophobicContact CG-CG1 4.19Å; R111-V223 HydrophobicContact CG-CG2 3.83Å; R111-V223 PolarHBondContact N-O 2.85Å; R111-V223 PolarHBondContact O-N 2.81Å; I113-V223 HydrophobicContact CD1-CG2 3.48Å; I113-V223 VanDerWaalsContact CD1-CG2 3.48Å; I113-V223 HydrophobicContact CG1-CG2 3.77Å; V223-E348 HydrophobicContact CG1-CG 3.31Å; V223-E348 WeakPolarHBondContact CG1-OE1 3.26Å; V223-Q349 WeakPolarHBondContact CA-O 3.36Å; V223-I350 HydrophobicContact CG1-CG1 4.36Å; V223-I350 HydrophobicContact CG2-CG1 4.15Å
224	L	96.2	Very high	90.5	Very high	1 Å²	1	27 Å²	27	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	138.5	179.2	-57.9	-176.6	0	0	0	110	I108 L109 I226 F285 E348 Q349 W370 F372	I108-L224 WeakPolarHBondContact O-CA 3.43Å; L109-L224 HydrophobicContact CD1-CD2 4.17Å; L224-I226 HydrophobicContact CB-CG1 4.08Å; L224-F285 HydrophobicContact CD1-CE1 4.29Å; L224-E348 WeakPolarHBondContact O-CA 3.2Å; L224-Q349 PolarHBondContact N-O 2.8Å; L224-Q349 PolarHBondContact O-N 3.04Å; L224-W370 HydrophobicContact CD1-CH2 4Å; L224-F372 HydrophobicContact CD1-CE2 4.15Å; L224-F372 HydrophobicContact CD1-CZ 4.13Å; L224-F372 HydrophobicContact CD2-CZ 4.47Å
225	L	95.2	Very high	90.4	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	105.9	159.1	-65.9	175.4	0	0	0	107.5	L107 I108 H110 I309 Y319 V346 R347 E348	L107-L225 CarbonylContact C-O 3.52Å; L107-L225 WeakPolarHBondContact CA-O 3.47Å; I108-L225 HydrophobicContact CB-CB 4.22Å; I108-L225 PolarHBondContact N-O 2.78Å; I108-L225 PolarHBondContact O-N 3.25Å; H110-L225 HydrophobicContact CB-CB 4.47Å; H110-L225 HydrophobicContact CB-CD1 3.85Å; H110-L225 HydrophobicContact CB-CD2 4.48Å; H110-L225 HydrophobicContact CB-CG 3.59Å; L225-I309 HydrophobicContact CD1-CD1 4.02Å; L225-I309 HydrophobicContact CD2-CD1 3.7Å; L225-I309 HydrophobicContact CD2-CG1 3.81Å; L225-I309 HydrophobicContact CG-CD1 4.39Å; L225-Y319 HydrophobicContact CD1-CD1 3.9Å; L225-Y319 HydrophobicContact CD1-CG 3.89Å; L225-V346 HydrophobicContact CB-CG1 3.91Å; L225-V346 HydrophobicContact CD2-CG1 4.24Å; L225-V346 HydrophobicContact CG-CG1 4.47Å; L225-R347 CarbonylContact C-O 3.59Å; L225-R347 WeakPolarHBondContact CA-O 3.39Å; L225-E348 HydrophobicContact CD2-CB 3.81Å; L225-E348 HydrophobicContact CD2-CG 4.13Å
226	I	96.5	Very high	90.5	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.01	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	133.8	179.7	-55.8	170.8	0	0	0	108.1	L224 Y238 I261 L263 L283 V346 R347 Q349	L224-I226 HydrophobicContact CB-CG1 4.08Å; I226-Y238 HydrophobicContact CB-CE2 4.45Å; I226-Y238 HydrophobicContact CG2-CD2 4.29Å; I226-Y238 HydrophobicContact CG2-CE2 4.06Å; I226-I261 HydrophobicContact CD1-CD1 3.82Å; I226-L263 HydrophobicContact CG2-CD1 4.3Å; I226-L263 HydrophobicContact CG2-CD2 3.3Å; I226-L263 HydrophobicContact CG2-CG 4.43Å; I226-L283 HydrophobicContact CD1-CD1 3.62Å; I226-L283 HydrophobicContact CG1-CD1 3.83Å; I226-L283 HydrophobicContact CG2-CD1 3.95Å; I226-V346 CarbonylContact O-C 3.56Å; I226-V346 WeakPolarHBondContact O-CA 3.35Å; I226-R347 PolarHBondContact N-O 3.5Å; I226-R347 PolarHBondContact O-N 3.26Å; I226-Q349 HydrophobicContact CD1-CB 3.46Å; I226-Q349 VanDerWaalsContact CD1-CB 3.46Å; I226-Q349 HydrophobicContact CD1-CG 3.84Å; I226-Q349 HydrophobicContact CG1-CB 4.17Å
227	F	95.6	Very high	90.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	157.1	-177.6	68.2	-94.2	0	0	0	114.8	I67 Y105 G106 I108 P324 Y328 F332 V344 A345 V346	I67-F227 HydrophobicContact CB-CZ 4.45Å; I67-F227 HydrophobicContact CD1-CZ 4.26Å; I67-F227 HydrophobicContact CG1-CZ 3.95Å; I67-F227 HydrophobicContact CG2-CE2 4.18Å; I67-F227 HydrophobicContact CG2-CZ 4.25Å; Y105-F227 CarbonylContact C-O 3.52Å; Y105-F227 WeakPolarHBondContact CA-O 3.45Å; G106-F227 PolarHBondContact N-O 2.88Å; G106-F227 WeakPolarHBondContact O-CD1 3.41Å; G106-F227 PolarHBondContact O-N 2.85Å; I108-F227 HydrophobicContact CG1-CE1 4.41Å; F227-P324 HydrophobicContact CD1-CG 3.98Å; F227-P324 HydrophobicContact CE1-CB 4.1Å; F227-P324 HydrophobicContact CE1-CG 3.24Å; F227-P324 HydrophobicContact CE2-CB 4.3Å; F227-P324 HydrophobicContact CE2-CG 4.16Å; F227-P324 HydrophobicContact CZ-CB 4Å; F227-P324 HydrophobicContact CZ-CG 3.37Å; F227-Y328 HydrophobicContact CD2-CE2 4.28Å; F227-Y328 AromaticContact CE2-CE2 4Å; F227-Y328 HydrophobicContact CE2-CE2 4Å; F227-F332 HydrophobicContact CB-CE2 4.28Å; F227-F332 HydrophobicContact CD1-CE2 4.24Å; F227-F332 HydrophobicContact CG-CE2 4.17Å; F227-V344 HydrophobicContact CB-CG1 4.04Å; F227-V344 HydrophobicContact CD2-CG1 4Å; F227-V344 HydrophobicContact CG-CG1 4.36Å; F227-A345 WeakPolarHBondContact CA-O 3.33Å; F227-A345 WeakPolarHBondContact CB-O 3.48Å; F227-V346 HydrophobicContact CB-CB 4.48Å; F227-V346 HydrophobicContact CB-CG1 4.48Å; F227-V346 HydrophobicContact CB-CG2 3.93Å
228	S	95.5	Very high	91	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	148.6	170.9	70.8	0	0	0	0	109.5	H230 Y238 V344 A345	S228-H230 WeakPolarHBondContact CB-CE1 3.34Å; S228-H230 PolarHBondContact O-N 3.04Å; S228-H230 PolarHBondContact OG-CD2 3.45Å; S228-H230 PolarHBondContact OG-CE1 3.36Å; S228-H230 PolarHBondContact OG-ND1 2.86Å; S228-H230 PolarHBondContact OG-NE2 2.8Å; S228-H230 VanDerWaalsContact OG-NE2 3.11Å; S228-H230 PolarHBondContact OG-O 2.81Å; S228-Y238 PolarHBondContact N-OH 3.28Å; S228-Y238 VanDerWaalsContact N-OH 3.08Å; S228-Y238 PolarHBondContact OG-OH 3.34Å; S228-V344 WeakPolarHBondContact O-CG1 3.37Å; S228-A345 PolarHBondContact N-O 2.79Å; S228-A345 VanDerWaalsContact N-O 3.1Å; S228-A345 PolarHBondContact O-N 3.46Å
229	N	93.5	Very high	91.1	Very high	28 Å²	28	25.4 Å²	25.4	15%	0.15	13%	0.125	C	C	.	.	S	Bend	trans	-63.6	-17.8	179.6	67.9	-28.4	0	0	0	115	Q103 S104 Y328 R331	Q103-N229 PolarHBondContact OE1-ND2 3.38Å; Q103-N229 PolarHBondContact OE1-OD1 2.91Å; S104-N229 PolarHBondContact O-N 2.97Å; S104-N229 PolarHBondContact O-OD1 2.83Å; S104-N229 WeakPolarHBondContact OG-CB 3.16Å; N229-Y328 HydrophobicContact CB-CE1 4.21Å; N229-R331 PolarHBondContact O-NH2 3.46Å
230	H	89.5	Confident	91.2	Very high	21 Å²	21	28.9 Å²	28.9	10%	0.097	14%	0.144	C	C	.	.	S	Bend	trans	-90.5	153.5	175.8	59.1	-90.4	0	0	0	110.3	Y105 S228 L263 A345	Y105-H230 AromaticContact CE1-CE1 3.95Å; S228-H230 WeakPolarHBondContact CB-CE1 3.34Å; S228-H230 PolarHBondContact O-N 3.04Å; S228-H230 PolarHBondContact OG-CD2 3.45Å; S228-H230 PolarHBondContact OG-CE1 3.36Å; S228-H230 PolarHBondContact OG-ND1 2.86Å; S228-H230 PolarHBondContact OG-NE2 2.8Å; S228-H230 VanDerWaalsContact OG-NE2 3.11Å; S228-H230 PolarHBondContact OG-O 2.81Å; H230-L263 PolarHBondContact CE1-O 2.76Å; H230-L263 VanDerWaalsContact CE1-O 3.25Å; H230-A345 WeakPolarHBondContact O-CB 3.46Å; H230-A345 PolarHBondContact O-N 3.37Å; H230-A345 VanDerWaalsContact O-N 3.08Å
231	S	88.4	Confident	91	Very high	28 Å²	28	30.2 Å²	30.2	20%	0.196	15%	0.15	C	C	.	.			trans	-77.3	151.5	178.7	-49.9	0	0	0	0	110.8	T340 N342 H343	S231-T340 WeakPolarHBondContact CB-O 3.48Å; S231-T340 PolarHBondContact OG-O 3.31Å; S231-N342 PolarHBondContact OG-N 2.94Å; S231-N342 VanDerWaalsContact OG-N 3.14Å; S231-H343 VanDerWaalsContact CA-O 3.29Å; S231-H343 WeakPolarHBondContact CA-O 3.24Å; S231-H343 WeakPolarHBondContact CB-O 3.44Å; S231-H343 PolarHBondContact N-O 3.38Å; S231-H343 PolarHBondContact OG-N 3.29Å; S231-H343 PolarHBondContact OG-O 3.21Å
232	L	87	Confident	90.7	Very high	4 Å²	4	34 Å²	34	2%	0.021	17%	0.173	C	C	.	.			trans	-118.8	146.9	170.8	-74.2	-178.8	0	0	0	108.5	Y238 E266 T340 A345 R347	L232-Y238 HydrophobicContact CD1-CD1 4.11Å; L232-Y238 HydrophobicContact CD1-CD2 4.46Å; L232-Y238 HydrophobicContact CD1-CE1 3.68Å; L232-Y238 HydrophobicContact CD1-CE2 4.06Å; L232-Y238 HydrophobicContact CD1-CG 4.48Å; L232-Y238 HydrophobicContact CG-CE1 4.37Å; L232-E266 HydrophobicContact CD2-CB 3.54Å; L232-E266 VanDerWaalsContact CD2-CD 3.42Å; L232-E266 HydrophobicContact CD2-CG 3.39Å; L232-T340 VanDerWaalsContact O-CB 3.28Å; L232-T340 WeakPolarHBondContact O-CB 3.37Å; L232-T340 WeakPolarHBondContact O-CG2 3.41Å; L232-T340 PolarHBondContact O-OG1 3.49Å; L232-A345 HydrophobicContact CB-CB 3.74Å; L232-A345 HydrophobicContact CD1-CB 3.73Å; L232-A345 HydrophobicContact CG-CB 3.38Å; L232-R347 HydrophobicContact CD1-CG 4.33Å
233	M	82.7	Confident	90.3	Very high	117 Å²	117	33.9 Å²	33.9	58%	0.576	17%	0.173	S	C	*	.			trans	-63	152.6	167.6	-56.7	-174.1	78.3	0	0	111.1	N235 S236 E266 I274 R347	M233-N235 PolarHBondContact O-N 3.33Å; M233-N235 VanDerWaalsContact O-N 3.09Å; M233-S236 PolarHBondContact N-OG 2.7Å; M233-S236 VanDerWaalsContact N-OG 3.08Å; M233-S236 PolarHBondContact O-N 2.83Å; M233-S236 PolarHBondContact O-OG 3.35Å; M233-E266 PolarHBondContact N-OE1 2.8Å; M233-I274 HydrophobicContact SD-CD1 4.36Å; M233-R347 PolarHBondContact O-NH2 3.04Å
234	D	78.8	Confident	89.6	Confident	90 Å²	90	35 Å²	35	48%	0.481	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-33.9	-177.4	-69	-25.3	0	0	0	113.9	P308 H336 T340	D234-P308 WeakPolarHBondContact O-CG 3.13Å; D234-H336 IonicContact OD1-CE1 2.85Å; D234-T340 WeakPolarHBondContact OD1-CG2 3.37Å
235	N	82.7	Confident	88.7	Confident	99 Å²	99	35.2 Å²	35.2	53%	0.529	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	8	-177.7	-72.6	-52	0	0	0	113.8	M233 Y237 K269	M233-N235 PolarHBondContact O-N 3.33Å; M233-N235 VanDerWaalsContact O-N 3.09Å; N235-Y237 WeakPolarHBondContact O-CE2 3.21Å; N235-K269 HydrophobicContact CB-CD 4.4Å; N235-K269 WeakPolarHBondContact O-CG 3.23Å; N235-K269 WeakPolarHBondContact OD1-CE 3.34Å; N235-K269 PolarHBondContact OD1-NZ 2.88Å
236	S	88.1	Confident	87.6	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.007	20%	0.197	C	C	.	.			trans	-101	162.4	176.6	70.6	0	0	0	0	112	M233 E266 V267 R347	M233-S236 PolarHBondContact N-OG 2.7Å; M233-S236 VanDerWaalsContact N-OG 3.08Å; M233-S236 PolarHBondContact O-N 2.83Å; M233-S236 PolarHBondContact O-OG 3.35Å; S236-E266 WeakPolarHBondContact CB-OE1 3.28Å; S236-E266 PolarHBondContact OG-OE1 3.36Å; S236-V267 VanDerWaalsContact CA-O 3.28Å; S236-V267 WeakPolarHBondContact CA-O 3.2Å; S236-V267 VanDerWaalsContact CB-O 3.3Å; S236-V267 WeakPolarHBondContact CB-O 3.29Å; S236-R347 PolarHBondContact O-NE 3.46Å; S236-R347 VanDerWaalsContact O-NE 3.13Å; S236-R347 PolarHBondContact O-NH2 2.96Å
237	Y	91.1	Very high	86.5	Confident	64 Å²	64	47.3 Å²	47.3	25%	0.251	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	160.8	-174.5	-54.7	-89.4	0	0	0	110.1	N235 V267 K269	N235-Y237 WeakPolarHBondContact O-CE2 3.21Å; Y237-V267 PolarHBondContact N-O 2.92Å; Y237-V267 WeakPolarHBondContact O-CG2 3.33Å; Y237-V267 PolarHBondContact O-N 2.88Å; Y237-K269 HydrophobicContact CE2-CG 3.77Å
238	Y	93.2	Very high	85.3	Confident	12 Å²	12	48.4 Å²	48.4	5%	0.047	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	138.5	163.4	-59.6	-63.3	0	0	0	109.4	I226 S228 L232 N240 I261 L263 L265 A345 R347	I226-Y238 HydrophobicContact CB-CE2 4.45Å; I226-Y238 HydrophobicContact CG2-CD2 4.29Å; I226-Y238 HydrophobicContact CG2-CE2 4.06Å; S228-Y238 PolarHBondContact N-OH 3.28Å; S228-Y238 VanDerWaalsContact N-OH 3.08Å; S228-Y238 PolarHBondContact OG-OH 3.34Å; L232-Y238 HydrophobicContact CD1-CD1 4.11Å; L232-Y238 HydrophobicContact CD1-CD2 4.46Å; L232-Y238 HydrophobicContact CD1-CE1 3.68Å; L232-Y238 HydrophobicContact CD1-CE2 4.06Å; L232-Y238 HydrophobicContact CD1-CG 4.48Å; L232-Y238 HydrophobicContact CG-CE1 4.37Å; Y238-N240 PolarHBondContact O-N 2.92Å; Y238-I261 HydrophobicContact CG-CG2 4.34Å; Y238-L263 WeakPolarHBondContact CD1-O 3.44Å; Y238-L263 HydrophobicContact CD2-CD2 4.43Å; Y238-L263 VanDerWaalsContact CE1-O 3.26Å; Y238-L263 WeakPolarHBondContact CE1-O 3.46Å; Y238-L263 HydrophobicContact CG-CD2 4.32Å; Y238-L265 CarbonylContact C-O 3.56Å; Y238-L265 WeakPolarHBondContact CA-O 3.35Å; Y238-A345 WeakPolarHBondContact OH-CB 3.46Å; Y238-A345 PolarHBondContact OH-O 3.13Å; Y238-R347 HydrophobicContact CD2-CB 4.28Å; Y238-R347 HydrophobicContact CD2-CG 4.02Å; Y238-R347 HydrophobicContact CE2-CB 4Å; Y238-R347 HydrophobicContact CE2-CG 3.74Å
239	W	92.6	Very high	84.2	Confident	54 Å²	54	53.3 Å²	53.3	21%	0.205	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	132.6	174.3	-178.5	83.3	0	0	0	109.9	K241 I261 Q262 L265 V267 I381	W239-K241 HydrophobicContact CE3-CB 4.47Å; W239-K241 HydrophobicContact CH2-CB 3.34Å; W239-K241 HydrophobicContact CH2-CD 3.59Å; W239-K241 HydrophobicContact CH2-CG 4.06Å; W239-K241 HydrophobicContact CZ2-CB 3.58Å; W239-K241 HydrophobicContact CZ2-CD 3.73Å; W239-K241 HydrophobicContact CZ2-CG 4.18Å; W239-K241 HydrophobicContact CZ3-CB 3.8Å; W239-I261 CarbonylContact O-C 3.53Å; W239-I261 WeakPolarHBondContact O-CA 3.16Å; W239-Q262 HydrophobicContact CB-CB 4.5Å; W239-Q262 HydrophobicContact CE3-CB 3.89Å; W239-Q262 HydrophobicContact CE3-CG 3.63Å; W239-Q262 HydrophobicContact CZ3-CG 3.84Å; W239-Q262 PolarHBondContact O-N 2.95Å; W239-L265 HydrophobicContact CB-CB 3.77Å; W239-L265 HydrophobicContact CB-CD1 4.32Å; W239-L265 HydrophobicContact CG-CD1 4.47Å; W239-L265 PolarHBondContact N-O 2.86Å; W239-V267 HydrophobicContact CB-CG1 4.01Å; W239-V267 HydrophobicContact CB-CG2 4.49Å; W239-V267 HydrophobicContact CG-CG1 4.35Å; W239-I381 HydrophobicContact CH2-CD1 4.05Å; W239-I381 HydrophobicContact CZ3-CD1 4.41Å
240	N	91.6	Very high	83.6	Confident	79 Å²	79	56.4 Å²	56.4	42%	0.422	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	153.3	174.1	69.8	29.1	0	0	0	111.2	Y238 F260 I261 L303	Y238-N240 PolarHBondContact O-N 2.92Å; N240-F260 CarbonylContact C-O 3.59Å; N240-F260 WeakPolarHBondContact CA-O 3.49Å; N240-F260 WeakPolarHBondContact CB-O 3.18Å; N240-I261 HydrophobicContact CB-CG1 3.95Å; N240-L303 HydrophobicContact CB-CD1 4.41Å
241	K	88.9	Confident	83.3	Confident	34 Å²	34	55.9 Å²	55.9	15%	0.148	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	144.2	177.3	-175.6	-177.6	176.9	-163.6	0	110.3	W239 T243 P259 F260 I382 S384	W239-K241 HydrophobicContact CE3-CB 4.47Å; W239-K241 HydrophobicContact CH2-CB 3.34Å; W239-K241 HydrophobicContact CH2-CD 3.59Å; W239-K241 HydrophobicContact CH2-CG 4.06Å; W239-K241 HydrophobicContact CZ2-CB 3.58Å; W239-K241 HydrophobicContact CZ2-CD 3.73Å; W239-K241 HydrophobicContact CZ2-CG 4.18Å; W239-K241 HydrophobicContact CZ3-CB 3.8Å; K241-T243 HydrophobicContact CD-CG2 4.25Å; K241-T243 HydrophobicContact CG-CG2 4.46Å; K241-P259 CarbonylContact O-C 3.51Å; K241-F260 PolarHBondContact N-O 3.07Å; K241-F260 PolarHBondContact O-N 2.98Å; K241-I382 PolarHBondContact NZ-O 3.45Å; K241-S384 VanDerWaalsContact NZ-CA 3.29Å; K241-S384 PolarHBondContact NZ-OG 2.85Å
242	T	88.8	Confident	83.1	Confident	78 Å²	78	56.4 Å²	56.4	48%	0.479	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	115.6	170.2	-60.3	0	0	0	0	109.3	K257 S258	T242-K257 HydrophobicContact CG2-CB 3.49Å; T242-K257 VanDerWaalsContact CG2-CB 3.49Å; T242-S258 WeakPolarHBondContact CA-O 3.27Å
243	T	87.2	Confident	82.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	179.4	-176.4	-167.8	0	0	0	0	111.5	K241 K257 S258 F260 I381 D387	K241-T243 HydrophobicContact CD-CG2 4.25Å; K241-T243 HydrophobicContact CG-CG2 4.46Å; T243-K257 CarbonylContact O-C 3.58Å; T243-K257 WeakPolarHBondContact O-CA 3.28Å; T243-S258 PolarHBondContact N-O 3.19Å; T243-S258 PolarHBondContact O-N 2.85Å; T243-S258 VanDerWaalsContact O-O 3.06Å; T243-F260 HydrophobicContact CG2-CD2 3.91Å; T243-F260 HydrophobicContact CG2-CE2 3.91Å; T243-I381 HydrophobicContact CG2-CB 3.73Å; T243-I381 HydrophobicContact CG2-CD1 4.17Å; T243-I381 HydrophobicContact CG2-CG1 4.48Å; T243-I381 HydrophobicContact CG2-CG2 3.81Å; T243-D387 PolarHBondContact OG1-OD2 2.8Å
244	I	79	Confident	83	Confident	23 Å²	23	55.2 Å²	55.2	12%	0.118	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-94.2	133.9	178.9	-53.1	-175	0	0	0	108.4	C248 K255 K257 I382	I244-C248 WeakPolarHBondContact CG2-SG 3.35Å; I244-K255 HydrophobicContact CD1-CD 4.4Å; I244-K255 HydrophobicContact CD1-CG 4.18Å; I244-K257 HydrophobicContact CG1-CG 3.85Å; I244-I382 HydrophobicContact CB-CD1 4.09Å; I244-I382 HydrophobicContact CG2-CD1 4.31Å; I244-I382 PolarHBondContact O-N 2.96Å
245	Q	76.3	Confident	83.1	Confident	5 Å²	5	57.6 Å²	57.6	2%	0.023	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-68.1	139.7	172.3	-166.4	-178.5	2.4	0	0	109.2	C195 Y247 C248 F260 D380	C195-Q245 PolarHBondContact O-NE2 2.84Å; Q245-Y247 PolarHBondContact O-N 2.79Å; Q245-C248 HydrophobicContact CB-CB 3.98Å; Q245-C248 PolarHBondContact O-N 2.72Å; Q245-C248 PolarHBondContact O-SG 2.75Å; Q245-F260 HydrophobicContact CB-CZ 4.11Å; Q245-D380 WeakPolarHBondContact CG-O 3.33Å
246	K	73	Confident	83.1	Confident	85 Å²	85	55.3 Å²	55.3	37%	0.37	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	133.1	174.1	-158.5	-175.7	-179.3	-161.5	0	108.6	C248 D380	K246-C248 PolarHBondContact O-N 3.45Å; K246-D380 HydrophobicContact CB-CB 4.25Å; K246-D380 VanDerWaalsContact CB-O 3.29Å; K246-D380 WeakPolarHBondContact CB-O 3.35Å; K246-D380 PolarHBondContact N-O 3.48Å
247	Y	72.7	Confident	83.1	Confident	172 Å²	172	59 Å²	59	68%	0.675	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	6.5	-179.3	-41.7	-70.1	0	0	0	116.7	Q245	Q245-Y247 PolarHBondContact O-N 2.79Å
248	C	71.5	Confident	82.9	Confident	23 Å²	23	56.1 Å²	56.1	16%	0.155	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-70.1	140.7	176.4	69.5	0	0	0	0	111.9	I244 Q245 K246	I244-C248 WeakPolarHBondContact CG2-SG 3.35Å; Q245-C248 HydrophobicContact CB-CB 3.98Å; Q245-C248 PolarHBondContact O-N 2.72Å; Q245-C248 PolarHBondContact O-SG 2.75Å; K246-C248 PolarHBondContact O-N 3.45Å
249	E	72.1	Confident	82.8	Confident	102 Å²	102	55.7 Å²	55.7	48%	0.477	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-75.5	163.2	167.8	-63.2	-173.4	167.4	0	0	111.3
250	D	80.3	Confident	82.8	Confident	94 Å²	94	53.1 Å²	53.1	50%	0.503	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-59.5	139	171	-69.8	-6.2	0	0	0	110.1	K255	D250-K255 VanDerWaalsContact OD1-CB 3.31Å; D250-K255 WeakPolarHBondContact OD1-CB 3.44Å
251	G	82.6	Confident	83	Confident	9 Å²	9	49.5 Å²	49.5	9%	0.093	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-90	-166.7	175.7	0	0	0	0	0	112.8	L253 G254	G251-L253 PolarHBondContact O-N 2.83Å; G251-G254 PolarHBondContact N-O 2.87Å; G251-G254 PolarHBondContact O-N 2.87Å; G251-G254 VanDerWaalsContact O-N 3.15Å
252	P	84.2	Confident	83.2	Confident	40 Å²	40	48.7 Å²	48.7	26%	0.26	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-16	-174.8	14.3	0.9	0	0	0	112.2	Q191 Y193 A288 W290 A298	Q191-P252 HydrophobicContact CB-CB 4.38Å; Q191-P252 HydrophobicContact CB-CG 4.48Å; Q191-P252 WeakPolarHBondContact O-CD 3.45Å; Q191-P252 VanDerWaalsContact O-CG 3.24Å; Q191-P252 WeakPolarHBondContact O-CG 3.41Å; Y193-P252 VanDerWaalsContact CE2-CD 3.43Å; P252-A288 HydrophobicContact CG-CB 3.97Å; P252-W290 HydrophobicContact CB-CH2 3.57Å; P252-W290 HydrophobicContact CB-CZ3 3.63Å; P252-W290 HydrophobicContact CG-CH2 3.52Å; P252-W290 HydrophobicContact CG-CZ2 4.14Å; P252-W290 HydrophobicContact CG-CZ3 3.78Å; P252-A298 HydrophobicContact CB-CB 3.75Å; P252-A298 HydrophobicContact CG-CB 3.63Å
253	L	84.5	Confident	83.5	Confident	64 Å²	64	45 Å²	45	34%	0.335	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	19.2	178.3	-54.1	178.3	0	0	0	112	Y193 G251 I256 A288 A298	Y193-L253 VanDerWaalsContact OH-CA 3.3Å; Y193-L253 WeakPolarHBondContact OH-CA 3.42Å; Y193-L253 WeakPolarHBondContact OH-CB 3.39Å; Y193-L253 PolarHBondContact OH-N 2.97Å; Y193-L253 VanDerWaalsContact OH-N 3.08Å; G251-L253 PolarHBondContact O-N 2.83Å; L253-I256 HydrophobicContact CB-CD1 3.45Å; L253-I256 VanDerWaalsContact CB-CD1 3.45Å; L253-I256 HydrophobicContact CB-CG1 4.44Å; L253-I256 HydrophobicContact CD1-CD1 4.23Å; L253-I256 HydrophobicContact CG-CD1 4.49Å; L253-I256 WeakPolarHBondContact O-CD1 3.31Å; L253-A288 HydrophobicContact CD1-CB 3.88Å; L253-A288 HydrophobicContact CG-CB 4.17Å; L253-A298 HydrophobicContact CD2-CB 4.14Å; L253-A298 HydrophobicContact CG-CB 4.25Å
254	G	84	Confident	83.8	Confident	31 Å²	31	45 Å²	45	32%	0.32	22%	0.223	S	C	.	.	B	Isolated β-bridge	trans	86.2	-145.8	-176.3	0	0	0	0	0	111.9	Y193 G251	Y193-G254 WeakPolarHBondContact CE1-O 3.36Å; Y193-G254 PolarHBondContact OH-N 3.08Å; Y193-G254 PolarHBondContact OH-O 2.85Å; G251-G254 PolarHBondContact N-O 2.87Å; G251-G254 PolarHBondContact O-N 2.87Å; G251-G254 VanDerWaalsContact O-N 3.15Å
255	K	81	Confident	84.4	Confident	141 Å²	141	45.1 Å²	45.1	61%	0.613	22%	0.223	S	C	*	.	S	Bend	trans	-96.6	107.4	177.9	-166.1	169.5	-180	173.4	0	111	I244 D250	I244-K255 HydrophobicContact CD1-CD 4.4Å; I244-K255 HydrophobicContact CD1-CG 4.18Å; D250-K255 VanDerWaalsContact OD1-CB 3.31Å; D250-K255 WeakPolarHBondContact OD1-CB 3.44Å
256	I	82.9	Confident	85.2	Confident	50 Å²	50	45.2 Å²	45.2	26%	0.256	22%	0.224	S	C	.	.			trans	-129.9	144.3	-175.3	-56.6	-172.2	0	0	0	109.8	Y193 L253 A287 L300	Y193-I256 HydrophobicContact CE1-CB 4.03Å; Y193-I256 HydrophobicContact CE1-CG1 4.46Å; L253-I256 HydrophobicContact CB-CD1 3.45Å; L253-I256 VanDerWaalsContact CB-CD1 3.45Å; L253-I256 HydrophobicContact CB-CG1 4.44Å; L253-I256 HydrophobicContact CD1-CD1 4.23Å; L253-I256 HydrophobicContact CG-CD1 4.49Å; L253-I256 WeakPolarHBondContact O-CD1 3.31Å; I256-A287 HydrophobicContact CB-CB 3.99Å; I256-A287 HydrophobicContact CG2-CB 3.68Å; I256-L300 HydrophobicContact CD1-CD1 4.49Å; I256-L300 HydrophobicContact CG2-CD1 4.16Å
257	K	87.1	Confident	86.1	Confident	80 Å²	80	41.4 Å²	41.4	35%	0.348	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-69.7	131.7	174.8	-63.9	-175.5	177.2	-171.4	0	110.4	T242 T243 I244 D387	T242-K257 HydrophobicContact CG2-CB 3.49Å; T242-K257 VanDerWaalsContact CG2-CB 3.49Å; T243-K257 CarbonylContact O-C 3.58Å; T243-K257 WeakPolarHBondContact O-CA 3.28Å; I244-K257 HydrophobicContact CG1-CG 3.85Å; K257-D387 IonicContact NZ-OD1 3.79Å; K257-D387 IonicContact NZ-OD2 3.61Å
258	S	88.5	Confident	86.9	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.014	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	140.9	175.7	-67.9	0	0	0	0	110.7	T242 T243 F260 F285 A287	T242-S258 WeakPolarHBondContact CA-O 3.27Å; T243-S258 PolarHBondContact N-O 3.19Å; T243-S258 PolarHBondContact O-N 2.85Å; T243-S258 VanDerWaalsContact O-O 3.06Å; S258-F260 WeakPolarHBondContact O-CD2 3.49Å; S258-F260 WeakPolarHBondContact O-CE2 3.43Å; S258-F285 VanDerWaalsContact CB-O 3.28Å; S258-F285 WeakPolarHBondContact CB-O 2.77Å; S258-A287 PolarHBondContact OG-N 3.33Å
259	P	91	Very high	87.5	Confident	4 Å²	4	39 Å²	39	3%	0.026	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	142.6	169.3	6.5	-9.7	0	0	0	113.3	K241 F285 L303	K241-P259 CarbonylContact O-C 3.51Å; P259-F285 HydrophobicContact CB-CB 4.21Å; P259-F285 HydrophobicContact CB-CD2 4.24Å; P259-F285 WeakPolarHBondContact CD-O 3.34Å; P259-F285 HydrophobicContact CG-CB 3.81Å; P259-F285 PolarHBondContact O-N 3.45Å; P259-L303 HydrophobicContact CB-CD1 3.61Å; P259-L303 HydrophobicContact CB-CD2 4.26Å; P259-L303 HydrophobicContact CB-CG 3.56Å; P259-L303 HydrophobicContact CG-CG 4.05Å
260	F	92.4	Very high	88.1	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	146.1	174.8	-63.5	-97.1	0	0	0	109.9	N240 K241 T243 Q245 S258 L283 Q284 P379 I381	N240-F260 CarbonylContact C-O 3.59Å; N240-F260 WeakPolarHBondContact CA-O 3.49Å; N240-F260 WeakPolarHBondContact CB-O 3.18Å; K241-F260 PolarHBondContact N-O 3.07Å; K241-F260 PolarHBondContact O-N 2.98Å; T243-F260 HydrophobicContact CG2-CD2 3.91Å; T243-F260 HydrophobicContact CG2-CE2 3.91Å; Q245-F260 HydrophobicContact CB-CZ 4.11Å; S258-F260 WeakPolarHBondContact O-CD2 3.49Å; S258-F260 WeakPolarHBondContact O-CE2 3.43Å; F260-L283 CarbonylContact C-O 3.59Å; F260-L283 VanDerWaalsContact CA-O 3.27Å; F260-L283 WeakPolarHBondContact CA-O 3.31Å; F260-Q284 HydrophobicContact CD1-CB 3.76Å; F260-Q284 HydrophobicContact CD1-CG 3.99Å; F260-Q284 HydrophobicContact CE1-CB 3.62Å; F260-Q284 VanDerWaalsContact CE1-CD 3.46Å; F260-Q284 HydrophobicContact CE1-CG 3.41Å; F260-Q284 VanDerWaalsContact CE1-CG 3.41Å; F260-Q284 HydrophobicContact CZ-CG 3.87Å; F260-P379 HydrophobicContact CD1-CB 3.92Å; F260-P379 HydrophobicContact CD1-CG 4.2Å; F260-P379 HydrophobicContact CE1-CB 4.15Å; F260-I381 HydrophobicContact CD1-CG2 3.94Å; F260-I381 HydrophobicContact CD2-CG2 4.05Å; F260-I381 HydrophobicContact CE1-CG2 3.69Å; F260-I381 HydrophobicContact CE2-CG2 3.84Å; F260-I381 HydrophobicContact CG-CG2 4.11Å; F260-I381 HydrophobicContact CZ-CG2 3.66Å
261	I	94.4	Very high	88.3	Confident	3 Å²	3	41.5 Å²	41.5	2%	0.015	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	127.4	170.6	-57.4	176.3	0	0	0	107.9	I226 Y238 W239 N240 L263 Y282 L283 F285 L303 Q349	I226-I261 HydrophobicContact CD1-CD1 3.82Å; Y238-I261 HydrophobicContact CG-CG2 4.34Å; W239-I261 CarbonylContact O-C 3.53Å; W239-I261 WeakPolarHBondContact O-CA 3.16Å; N240-I261 HydrophobicContact CB-CG1 3.95Å; I261-L263 HydrophobicContact CG2-CD2 3.81Å; I261-Y282 CarbonylContact O-C 3.58Å; I261-Y282 WeakPolarHBondContact O-CA 3.35Å; I261-L283 HydrophobicContact CB-CB 4.41Å; I261-L283 PolarHBondContact N-O 3.24Å; I261-L283 PolarHBondContact O-N 3.23Å; I261-F285 HydrophobicContact CD1-CE2 3.58Å; I261-F285 HydrophobicContact CD1-CZ 4.13Å; I261-F285 HydrophobicContact CG1-CE2 3.81Å; I261-L303 HydrophobicContact CD1-CD1 4.23Å; I261-L303 HydrophobicContact CD1-CD2 4.35Å; I261-L303 HydrophobicContact CG1-CD1 4.12Å; I261-Q349 HydrophobicContact CD1-CG 4.3Å
262	Q	94	Very high	88.6	Confident	16 Å²	16	48 Å²	48	8%	0.075	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	112.5	172.5	-71.7	-172.1	-59.7	0	0	109.9	W239 G264 L265 N280 A281 D378 P379	W239-Q262 HydrophobicContact CB-CB 4.5Å; W239-Q262 HydrophobicContact CE3-CB 3.89Å; W239-Q262 HydrophobicContact CE3-CG 3.63Å; W239-Q262 HydrophobicContact CZ3-CG 3.84Å; W239-Q262 PolarHBondContact O-N 2.95Å; Q262-G264 VanDerWaalsContact C-N 3.34Å; Q262-G264 PolarHBondContact O-N 3.31Å; Q262-L265 HydrophobicContact CB-CB 4.19Å; Q262-L265 HydrophobicContact CB-CD1 4.11Å; Q262-L265 HydrophobicContact CB-CG 4.1Å; Q262-L265 PolarHBondContact O-N 2.55Å; Q262-N280 PolarHBondContact NE2-ND2 3.28Å; Q262-A281 CarbonylContact C-O 3.54Å; Q262-A281 WeakPolarHBondContact CA-O 3.44Å; Q262-D378 PolarHBondContact NE2-OD1 2.97Å; Q262-P379 HydrophobicContact CG-CG 4.45Å
263	L	94.7	Very high	88.8	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-19.4	-170.7	-53	-175.9	0	0	0	113.3	Y105 I226 H230 Y238 I261 A281 L283	Y105-L263 HydrophobicContact CD1-CB 3.5Å; Y105-L263 VanDerWaalsContact CD1-CB 3.5Å; Y105-L263 HydrophobicContact CD1-CD1 4.37Å; Y105-L263 HydrophobicContact CE1-CB 4.01Å; Y105-L263 HydrophobicContact CG-CB 4.21Å; Y105-L263 HydrophobicContact CG-CD1 4.37Å; I226-L263 HydrophobicContact CG2-CD1 4.3Å; I226-L263 HydrophobicContact CG2-CD2 3.3Å; I226-L263 HydrophobicContact CG2-CG 4.43Å; H230-L263 PolarHBondContact CE1-O 2.76Å; H230-L263 VanDerWaalsContact CE1-O 3.25Å; Y238-L263 WeakPolarHBondContact CD1-O 3.44Å; Y238-L263 HydrophobicContact CD2-CD2 4.43Å; Y238-L263 VanDerWaalsContact CE1-O 3.26Å; Y238-L263 WeakPolarHBondContact CE1-O 3.46Å; Y238-L263 HydrophobicContact CG-CD2 4.32Å; I261-L263 HydrophobicContact CG2-CD2 3.81Å; L263-A281 HydrophobicContact CB-CB 4.2Å; L263-A281 HydrophobicContact CD1-CB 4.15Å; L263-A281 HydrophobicContact CG-CB 4.43Å; L263-A281 PolarHBondContact N-O 3.11Å; L263-L283 HydrophobicContact CD1-CD2 4.43Å; L263-L283 HydrophobicContact CD1-CG 4.16Å; L263-L283 HydrophobicContact CD2-CD1 4.29Å; L263-L283 HydrophobicContact CD2-CG 4.26Å; L263-L283 HydrophobicContact CG-CG 4.47Å
264	G	92.8	Very high	89	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	2.8	174.8	0	0	0	0	0	114.2	Q262 S276 T277 N280	Q262-G264 VanDerWaalsContact C-N 3.34Å; Q262-G264 PolarHBondContact O-N 3.31Å; G264-S276 CarbonylContact O-C 3.55Å; G264-S276 WeakPolarHBondContact O-CA 3.41Å; G264-T277 WeakPolarHBondContact CA-OG1 3.37Å; G264-T277 PolarHBondContact O-N 2.86Å; G264-T277 PolarHBondContact O-OG1 2.86Å; G264-T277 VanDerWaalsContact O-OG1 3.14Å; G264-N280 WeakPolarHBondContact CA-OD1 3.34Å; G264-N280 PolarHBondContact N-OD1 3.48Å
265	L	92.7	Very high	89.2	Confident	25 Å²	25	53.9 Å²	53.9	13%	0.131	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	114.9	178.1	-65.1	-170.9	0	0	0	111.1	Y238 W239 Q262 S276	Y238-L265 CarbonylContact C-O 3.56Å; Y238-L265 WeakPolarHBondContact CA-O 3.35Å; W239-L265 HydrophobicContact CB-CB 3.77Å; W239-L265 HydrophobicContact CB-CD1 4.32Å; W239-L265 HydrophobicContact CG-CD1 4.47Å; W239-L265 PolarHBondContact N-O 2.86Å; Q262-L265 HydrophobicContact CB-CB 4.19Å; Q262-L265 HydrophobicContact CB-CD1 4.11Å; Q262-L265 HydrophobicContact CB-CG 4.1Å; Q262-L265 PolarHBondContact O-N 2.55Å; L265-S276 VanDerWaalsContact CD2-CB 3.42Å; L265-S276 WeakPolarHBondContact CD2-OG 3.47Å
266	E	92.9	Very high	89.6	Confident	7 Å²	7	50.2 Å²	50.2	3%	0.033	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	132.2	172.1	178.2	176.1	-156.4	0	0	110.4	L232 M233 S236 V273 I274 Q275	L232-E266 HydrophobicContact CD2-CB 3.54Å; L232-E266 VanDerWaalsContact CD2-CD 3.42Å; L232-E266 HydrophobicContact CD2-CG 3.39Å; M233-E266 PolarHBondContact N-OE1 2.8Å; S236-E266 WeakPolarHBondContact CB-OE1 3.28Å; S236-E266 PolarHBondContact OG-OE1 3.36Å; E266-V273 WeakPolarHBondContact O-CA 3.47Å; E266-I274 HydrophobicContact CB-CB 4.38Å; E266-I274 HydrophobicContact CG-CB 3.89Å; E266-I274 HydrophobicContact CG-CD1 4.07Å; E266-I274 HydrophobicContact CG-CG1 4.38Å; E266-I274 HydrophobicContact CG-CG2 4.42Å; E266-I274 PolarHBondContact O-N 2.87Å; E266-Q275 HydrophobicContact CB-CB 4.09Å; E266-Q275 PolarHBondContact N-O 2.79Å
267	V	92.1	Very high	89.8	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.03	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	148.2	172.9	-66.7	0	0	0	0	112.8	S236 Y237 W239 K272 V273	S236-V267 VanDerWaalsContact CA-O 3.28Å; S236-V267 WeakPolarHBondContact CA-O 3.2Å; S236-V267 VanDerWaalsContact CB-O 3.3Å; S236-V267 WeakPolarHBondContact CB-O 3.29Å; Y237-V267 PolarHBondContact N-O 2.92Å; Y237-V267 WeakPolarHBondContact O-CG2 3.33Å; Y237-V267 PolarHBondContact O-N 2.88Å; W239-V267 HydrophobicContact CB-CG1 4.01Å; W239-V267 HydrophobicContact CB-CG2 4.49Å; W239-V267 HydrophobicContact CG-CG1 4.35Å; V267-K272 CarbonylContact C-O 3.47Å; V267-K272 VanDerWaalsContact CA-O 3.29Å; V267-K272 WeakPolarHBondContact CA-O 3.29Å; V267-V273 HydrophobicContact CG1-CG2 4.27Å
268	S	89.5	Confident	89.8	Confident	24 Å²	24	51.9 Å²	51.9	17%	0.168	26%	0.26	C	S	.	.			trans	-71	169.6	168.4	76.1	0	0	0	0	111.5	D270 N271 K272	S268-D270 PolarHBondContact O-N 2.82Å; S268-D270 VanDerWaalsContact O-N 3.11Å; S268-D270 PolarHBondContact OG-N 2.81Å; S268-N271 PolarHBondContact O-N 3.36Å; S268-K272 PolarHBondContact N-O 3.36Å; S268-K272 PolarHBondContact OG-N 2.77Å
269	K	84.7	Confident	89.8	Confident	122 Å²	122	52.9 Å²	52.9	53%	0.53	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-28.1	169.7	-77.6	177.1	175.9	175.5	0	113.8	N235 Y237 N271	N235-K269 HydrophobicContact CB-CD 4.4Å; N235-K269 WeakPolarHBondContact O-CG 3.23Å; N235-K269 WeakPolarHBondContact OD1-CE 3.34Å; N235-K269 PolarHBondContact OD1-NZ 2.88Å; Y237-K269 HydrophobicContact CE2-CG 3.77Å; K269-N271 VanDerWaalsContact C-N 3.28Å; K269-N271 PolarHBondContact O-N 3.05Å
270	D	84.7	Confident	89.8	Confident	126 Å²	126	52.7 Å²	52.7	67%	0.674	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	16.2	178.4	-53.7	-39.6	0	0	0	112.6	S268 K272	S268-D270 PolarHBondContact O-N 2.82Å; S268-D270 VanDerWaalsContact O-N 3.11Å; S268-D270 PolarHBondContact OG-N 2.81Å; D270-K272 PolarHBondContact O-N 2.95Å
271	N	84.3	Confident	89.8	Confident	121 Å²	121	52.8 Å²	52.8	65%	0.647	27%	0.266	S	S	*	.			trans	58.5	24.9	-178.4	-63.6	-41	0	0	0	114.9	S268 K269	S268-N271 PolarHBondContact O-N 3.36Å; K269-N271 VanDerWaalsContact C-N 3.28Å; K269-N271 PolarHBondContact O-N 3.05Å
272	K	88.2	Confident	89.8	Confident	146 Å²	146	52.7 Å²	52.7	64%	0.635	27%	0.265	S	S	*	.			trans	-84.2	129	171.2	-64.5	-177.6	-178.5	174.1	0	109.2	V267 S268 D270 I274	V267-K272 CarbonylContact C-O 3.47Å; V267-K272 VanDerWaalsContact CA-O 3.29Å; V267-K272 WeakPolarHBondContact CA-O 3.29Å; S268-K272 PolarHBondContact N-O 3.36Å; S268-K272 PolarHBondContact OG-N 2.77Å; D270-K272 PolarHBondContact O-N 2.95Å; K272-I274 PolarHBondContact O-N 3.23Å
273	V	88.6	Confident	89.9	Confident	93 Å²	93	52 Å²	52	56%	0.564	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63	121	174.5	-179	0	0	0	0	109	E266 V267	E266-V273 WeakPolarHBondContact O-CA 3.47Å; V267-V273 HydrophobicContact CG1-CG2 4.27Å
274	I	88.4	Confident	89.8	Confident	80 Å²	80	51.9 Å²	51.9	41%	0.41	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-49.3	176.2	-59.3	177.2	0	0	0	108.8	M233 E266 K272	M233-I274 HydrophobicContact SD-CD1 4.36Å; E266-I274 HydrophobicContact CB-CB 4.38Å; E266-I274 HydrophobicContact CG-CB 3.89Å; E266-I274 HydrophobicContact CG-CD1 4.07Å; E266-I274 HydrophobicContact CG-CG1 4.38Å; E266-I274 HydrophobicContact CG-CG2 4.42Å; E266-I274 PolarHBondContact O-N 2.87Å; K272-I274 PolarHBondContact O-N 3.23Å
275	Q	88.1	Confident	89.8	Confident	85 Å²	85	51.9 Å²	51.9	40%	0.397	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	148.6	-176.4	-171.6	174.4	9.6	0	0	111.2	E266	E266-Q275 HydrophobicContact CB-CB 4.09Å; E266-Q275 PolarHBondContact N-O 2.79Å
276	S	89.1	Confident	89.7	Confident	64 Å²	64	50.7 Å²	50.7	45%	0.448	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	132.8	169.4	179.4	0	0	0	0	109.5	G264 L265	G264-S276 CarbonylContact O-C 3.55Å; G264-S276 WeakPolarHBondContact O-CA 3.41Å; L265-S276 VanDerWaalsContact CD2-CB 3.42Å; L265-S276 WeakPolarHBondContact CD2-OG 3.47Å
277	T	88.7	Confident	89.5	Confident	12 Å²	12	50.4 Å²	50.4	7%	0.074	25%	0.254	C	S	.	.			trans	-112.8	150.2	174.9	55	0	0	0	0	110.4	Y105 G264	Y105-T277 PolarHBondContact OH-OG1 2.9Å; G264-T277 WeakPolarHBondContact CA-OG1 3.37Å; G264-T277 PolarHBondContact O-N 2.86Å; G264-T277 PolarHBondContact O-OG1 2.86Å; G264-T277 VanDerWaalsContact O-OG1 3.14Å
278	R	86	Confident	89.4	Confident	153 Å²	153	50.2 Å²	50.2	58%	0.577	25%	0.253	S	S	*	.	S	Bend	trans	-129.8	140.5	178.5	-69.7	-67.8	-174.5	161.5	-10.9	110.4	Q103 D378	Q103-R278 WeakPolarHBondContact CG-O 3.12Å; R278-D378 IonicContact CZ-OD1 3.19Å; R278-D378 IonicContact CZ-OD2 3.96Å; R278-D378 IonicContact NH1-OD1 2.68Å; R278-D378 IonicContact NH1-OD2 3.78Å; R278-D378 PolarHBondContact NH1-OD2 2.9Å; R278-D378 IonicContact NH2-OD1 2.84Å; R278-D378 IonicContact NH2-OD2 3.99Å; R278-D378 PolarHBondContact NH2-OD2 3.19Å
279	P	88.5	Confident	89.5	Confident	24 Å²	24	49.5 Å²	49.5	16%	0.156	25%	0.246	C	C	.	.	S	Bend	cis	-64.2	151	-8.8	36.1	-42.8	0	0	0	110	Q70 Q103 Y105 I376	Q70-P279 HydrophobicContact CB-CG 4.05Å; Q70-P279 HydrophobicContact CG-CG 4.36Å; Q103-P279 HydrophobicContact CB-CG 4.34Å; Y105-P279 PolarHBondContact OH-O 2.97Å; P279-I376 HydrophobicContact CB-CG2 4.01Å; P279-I376 HydrophobicContact CG-CG2 4.21Å
280	N	90.7	Very high	89.9	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.			trans	-76.2	170.3	172.8	-166.3	6.3	0	0	0	109.2	Q262 G264 G377 D378	Q262-N280 PolarHBondContact NE2-ND2 3.28Å; G264-N280 WeakPolarHBondContact CA-OD1 3.34Å; G264-N280 PolarHBondContact N-OD1 3.48Å; N280-G377 CarbonylContact C-O 3.57Å; N280-G377 PolarHBondContact O-N 3.16Å; N280-D378 PolarHBondContact ND2-OD1 2.91Å
281	A	93.8	Very high	90.3	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.008	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	158.3	164.5	0	0	0	0	0	109.2	Y105 Q262 L263 G375 I376	Y105-A281 HydrophobicContact CD1-CB 4.05Å; Y105-A281 HydrophobicContact CD2-CB 3.31Å; Y105-A281 HydrophobicContact CE1-CB 4.45Å; Y105-A281 HydrophobicContact CE2-CB 3.78Å; Y105-A281 HydrophobicContact CG-CB 3.46Å; Y105-A281 VanDerWaalsContact CG-CB 3.46Å; Q262-A281 CarbonylContact C-O 3.54Å; Q262-A281 WeakPolarHBondContact CA-O 3.44Å; L263-A281 HydrophobicContact CB-CB 4.2Å; L263-A281 HydrophobicContact CD1-CB 4.15Å; L263-A281 HydrophobicContact CG-CB 4.43Å; L263-A281 PolarHBondContact N-O 3.11Å; A281-G375 CarbonylContact C-O 3.6Å; A281-G375 WeakPolarHBondContact CA-O 3.32Å; A281-G375 WeakPolarHBondContact CB-O 3.44Å; A281-I376 HydrophobicContact CB-CD1 3.97Å
282	Y	94.3	Very high	90.5	Very high	1 Å²	1	33.1 Å²	33.1	0%	0.004	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	153.1	178.9	66.5	-91.3	0	0	0	112.2	I261 Q284 I373 A374 G375 P379	I261-Y282 CarbonylContact O-C 3.58Å; I261-Y282 WeakPolarHBondContact O-CA 3.35Å; Y282-Q284 HydrophobicContact CD2-CB 4.21Å; Y282-Q284 HydrophobicContact CE2-CB 4.28Å; Y282-I373 HydrophobicContact CE2-CG2 4.27Å; Y282-A374 WeakPolarHBondContact O-CA 3.28Å; Y282-G375 PolarHBondContact N-O 2.91Å; Y282-G375 PolarHBondContact O-N 3.44Å; Y282-P379 HydrophobicContact CD1-CB 4.02Å; Y282-P379 HydrophobicContact CD2-CB 3.91Å; Y282-P379 HydrophobicContact CE1-CB 4.35Å; Y282-P379 HydrophobicContact CE2-CB 4.26Å; Y282-P379 HydrophobicContact CG-CB 3.77Å; Y282-P379 HydrophobicContact CG-CG 4.19Å
283	L	95.8	Very high	90.5	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	129.1	158.8	-58.5	178.2	0	0	0	108.2	L107 I226 F260 I261 L263 F285 I373 A374	L107-L283 HydrophobicContact CD2-CD2 3.95Å; I226-L283 HydrophobicContact CD1-CD1 3.62Å; I226-L283 HydrophobicContact CG1-CD1 3.83Å; I226-L283 HydrophobicContact CG2-CD1 3.95Å; F260-L283 CarbonylContact C-O 3.59Å; F260-L283 VanDerWaalsContact CA-O 3.27Å; F260-L283 WeakPolarHBondContact CA-O 3.31Å; I261-L283 HydrophobicContact CB-CB 4.41Å; I261-L283 PolarHBondContact N-O 3.24Å; I261-L283 PolarHBondContact O-N 3.23Å; L263-L283 HydrophobicContact CD1-CD2 4.43Å; L263-L283 HydrophobicContact CD1-CG 4.16Å; L263-L283 HydrophobicContact CD2-CD1 4.29Å; L263-L283 HydrophobicContact CD2-CG 4.26Å; L263-L283 HydrophobicContact CG-CG 4.47Å; L283-F285 HydrophobicContact CB-CE1 4.44Å; L283-F285 HydrophobicContact CB-CE2 3.68Å; L283-F285 HydrophobicContact CB-CZ 3.64Å; L283-F285 HydrophobicContact CD1-CE2 4.49Å; L283-F285 HydrophobicContact CD1-CZ 3.85Å; L283-F285 HydrophobicContact CG-CZ 4.39Å; L283-I373 CarbonylContact C-O 3.6Å; L283-I373 VanDerWaalsContact CA-O 3.31Å; L283-I373 WeakPolarHBondContact CA-O 3.43Å; L283-A374 HydrophobicContact CD2-CB 3.53Å
284	Q	92.9	Very high	90.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.1	171.3	168.8	177.9	0.5	0	0	108.8	Y193 Y194 F260 Y282 P286 F372 I373	Y193-Q284 PolarHBondContact O-NE2 2.61Å; Y194-Q284 VanDerWaalsContact CB-NE2 3.3Å; F260-Q284 HydrophobicContact CD1-CB 3.76Å; F260-Q284 HydrophobicContact CD1-CG 3.99Å; F260-Q284 HydrophobicContact CE1-CB 3.62Å; F260-Q284 VanDerWaalsContact CE1-CD 3.46Å; F260-Q284 HydrophobicContact CE1-CG 3.41Å; F260-Q284 VanDerWaalsContact CE1-CG 3.41Å; F260-Q284 HydrophobicContact CZ-CG 3.87Å; Y282-Q284 HydrophobicContact CD2-CB 4.21Å; Y282-Q284 HydrophobicContact CE2-CB 4.28Å; Q284-P286 WeakPolarHBondContact O-CD 3.3Å; Q284-F372 WeakPolarHBondContact O-CA 3.38Å; Q284-F372 WeakPolarHBondContact O-CB 3.46Å; Q284-I373 HydrophobicContact CB-CB 4.24Å; Q284-I373 PolarHBondContact N-O 3.33Å; Q284-I373 PolarHBondContact O-N 2.9Å
285	F	92.5	Very high	90.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.153	C	C	.	.			trans	-114.5	98.2	179.4	-58.8	-71.2	0	0	0	108.1	L224 S258 P259 I261 L283 A287 L303 I351 W370 F372	L224-F285 HydrophobicContact CD1-CE1 4.29Å; S258-F285 VanDerWaalsContact CB-O 3.28Å; S258-F285 WeakPolarHBondContact CB-O 2.77Å; P259-F285 HydrophobicContact CB-CB 4.21Å; P259-F285 HydrophobicContact CB-CD2 4.24Å; P259-F285 WeakPolarHBondContact CD-O 3.34Å; P259-F285 HydrophobicContact CG-CB 3.81Å; P259-F285 PolarHBondContact O-N 3.45Å; I261-F285 HydrophobicContact CD1-CE2 3.58Å; I261-F285 HydrophobicContact CD1-CZ 4.13Å; I261-F285 HydrophobicContact CG1-CE2 3.81Å; L283-F285 HydrophobicContact CB-CE1 4.44Å; L283-F285 HydrophobicContact CB-CE2 3.68Å; L283-F285 HydrophobicContact CB-CZ 3.64Å; L283-F285 HydrophobicContact CD1-CE2 4.49Å; L283-F285 HydrophobicContact CD1-CZ 3.85Å; L283-F285 HydrophobicContact CG-CZ 4.39Å; F285-A287 PolarHBondContact O-N 3.4Å; F285-L303 HydrophobicContact CD2-CD2 3.72Å; F285-L303 HydrophobicContact CE2-CD2 3.8Å; F285-L303 HydrophobicContact CG-CD2 4.24Å; F285-L303 HydrophobicContact CZ-CD2 4.36Å; F285-I351 HydrophobicContact CD1-CD1 4.36Å; F285-I351 HydrophobicContact CE1-CD1 3.99Å; F285-I351 HydrophobicContact CZ-CD1 4.25Å; F285-W370 HydrophobicContact CD1-CH2 4.33Å; F285-W370 AromaticContact CD1-CZ2 3.54Å; F285-W370 HydrophobicContact CD1-CZ2 3.54Å; F285-W370 HydrophobicContact CE1-CH2 4.13Å; F285-W370 AromaticContact CE1-CZ2 3.8Å; F285-W370 HydrophobicContact CE1-CZ2 3.8Å; F285-F372 HydrophobicContact CD1-CB 3.64Å; F285-F372 HydrophobicContact CD1-CG 4.28Å; F285-F372 HydrophobicContact CE1-CB 4.03Å; F285-F372 HydrophobicContact CE1-CD2 4.17Å; F285-F372 HydrophobicContact CE1-CG 4.2Å
286	P	89.7	Confident	90.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.165	C	C	.	.			trans	-43.6	134.4	169.3	-31	37.2	0	0	0	111.1	M192 Y194 Q284 A288 V301 I371	M192-P286 HydrophobicContact SD-CB 4.38Å; Y194-P286 HydrophobicContact CD1-CB 4.22Å; Y194-P286 HydrophobicContact CD1-CG 3.53Å; Y194-P286 HydrophobicContact CE1-CG 4.07Å; Q284-P286 WeakPolarHBondContact O-CD 3.3Å; P286-A288 PolarHBondContact O-N 2.96Å; P286-V301 WeakPolarHBondContact O-CB 3.27Å; P286-I371 VanDerWaalsContact CD-O 3.26Å; P286-I371 WeakPolarHBondContact CD-O 3.45Å; P286-I371 HydrophobicContact CG-CG2 4.5Å
287	A	88.6	Confident	90.1	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.008	17%	0.167	C	C	.	.	S	Bend	trans	-65.4	-5.9	-174.3	0	0	0	0	0	114	Y193 I256 S258 F285 L300 V301	Y193-A287 HydrophobicContact CD2-CB 4.04Å; Y193-A287 HydrophobicContact CE2-CB 4.11Å; Y193-A287 HydrophobicContact CG-CB 4.45Å; I256-A287 HydrophobicContact CB-CB 3.99Å; I256-A287 HydrophobicContact CG2-CB 3.68Å; S258-A287 PolarHBondContact OG-N 3.33Å; F285-A287 PolarHBondContact O-N 3.4Å; A287-L300 WeakPolarHBondContact O-CA 3.39Å; A287-L300 WeakPolarHBondContact O-CD1 3.29Å; A287-V301 PolarHBondContact O-N 3.16Å
288	A	90.4	Very high	90.2	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	151.8	-178.5	0	0	0	0	0	112.9	Y193 P252 L253 P286 A298 Q299	Y193-A288 HydrophobicContact CD2-CB 4.32Å; Y193-A288 HydrophobicContact CE2-CB 3.79Å; P252-A288 HydrophobicContact CG-CB 3.97Å; L253-A288 HydrophobicContact CD1-CB 3.88Å; L253-A288 HydrophobicContact CG-CB 4.17Å; P286-A288 PolarHBondContact O-N 2.96Å; A288-A298 HydrophobicContact CB-CB 4.12Å; A288-Q299 CarbonylContact C-O 3.54Å; A288-Q299 WeakPolarHBondContact CA-O 3.33Å
289	Y	92.1	Very high	90.4	Very high	10 Å²	10	27.7 Å²	27.7	4%	0.039	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	153.6	168.9	79.3	-82.4	0	0	0	109.4	I291 A298 Q299 V301 L353 S369	Y289-I291 HydrophobicContact CD2-CG2 4.21Å; Y289-I291 HydrophobicContact CE2-CG2 3.45Å; Y289-I291 VanDerWaalsContact CE2-CG2 3.45Å; Y289-A298 CarbonylContact O-C 3.51Å; Y289-A298 WeakPolarHBondContact O-CA 3.37Å; Y289-A298 WeakPolarHBondContact O-CB 3.29Å; Y289-Q299 HydrophobicContact CD1-CB 3.93Å; Y289-Q299 WeakPolarHBondContact CD1-O 3.43Å; Y289-Q299 HydrophobicContact CE1-CB 3.23Å; Y289-Q299 HydrophobicContact CE1-CG 4.43Å; Y289-Q299 HydrophobicContact CE2-CB 4.49Å; Y289-Q299 PolarHBondContact N-O 3.44Å; Y289-Q299 PolarHBondContact O-N 2.97Å; Y289-V301 HydrophobicContact CD1-CG2 3.89Å; Y289-V301 HydrophobicContact CG-CG2 4.33Å; Y289-L353 HydrophobicContact CD1-CB 4.14Å; Y289-L353 HydrophobicContact CD1-CD2 3.98Å; Y289-L353 HydrophobicContact CE1-CB 3.68Å; Y289-L353 HydrophobicContact CE1-CD2 4.4Å; Y289-L353 HydrophobicContact CE2-CB 4.31Å; Y289-L353 HydrophobicContact CG-CD2 4.16Å; Y289-S369 WeakPolarHBondContact CB-O 3.41Å
290	W	92.6	Very high	90.6	Very high	10 Å²	10	28.4 Å²	28.4	4%	0.038	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	140.4	179.8	-60.5	122.4	0	0	0	111.1	M192 P252 N295 A298 S368 S369	M192-W290 HydrophobicContact CE-CD2 4.01Å; M192-W290 HydrophobicContact CE-CG 4.02Å; M192-W290 HydrophobicContact CE-CZ2 3.85Å; M192-W290 HydrophobicContact CG-CZ2 4.24Å; P252-W290 HydrophobicContact CB-CH2 3.57Å; P252-W290 HydrophobicContact CB-CZ3 3.63Å; P252-W290 HydrophobicContact CG-CH2 3.52Å; P252-W290 HydrophobicContact CG-CZ2 4.14Å; P252-W290 HydrophobicContact CG-CZ3 3.78Å; W290-N295 WeakPolarHBondContact CB-OD1 3.23Å; W290-N295 VanDerWaalsContact CD1-CG 3.41Å; W290-N295 HydrophobicContact CD2-CB 3.59Å; W290-N295 HydrophobicContact CE3-CB 3.96Å; W290-N295 HydrophobicContact CG-CB 3.92Å; W290-N295 VanDerWaalsContact CG-OD1 3.22Å; W290-N295 HydrophobicContact CH2-CB 4.37Å; W290-N295 WeakPolarHBondContact CH2-O 3.42Å; W290-N295 HydrophobicContact CZ2-CB 4.04Å; W290-N295 HydrophobicContact CZ3-CB 4.33Å; W290-N295 WeakPolarHBondContact CZ3-O 3.42Å; W290-A298 HydrophobicContact CE3-CB 3.83Å; W290-A298 HydrophobicContact CZ3-CB 3.92Å; W290-S368 CarbonylContact O-C 3.53Å; W290-S368 VanDerWaalsContact O-CA 3.3Å; W290-S368 WeakPolarHBondContact O-CA 3.2Å; W290-S369 PolarHBondContact N-O 3.17Å; W290-S369 PolarHBondContact O-N 3.31Å
291	I	92.3	Very high	90.6	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	15%	0.147	C	C	.	.	S	Bend	trans	-108.5	-1.4	176.7	57.8	163.8	0	0	0	113.1	Y289 Q297 Q299 Y361 T365	Y289-I291 HydrophobicContact CD2-CG2 4.21Å; Y289-I291 HydrophobicContact CE2-CG2 3.45Å; Y289-I291 VanDerWaalsContact CE2-CG2 3.45Å; I291-Q297 HydrophobicContact CD1-CB 3.74Å; I291-Q297 HydrophobicContact CG1-CB 3.58Å; I291-Q297 VanDerWaalsContact CG1-O 3.3Å; I291-Q297 WeakPolarHBondContact CG1-O 3.26Å; I291-Q297 PolarHBondContact N-O 2.89Å; I291-Q299 HydrophobicContact CD1-CG 4.32Å; I291-Q299 HydrophobicContact CG2-CB 4.06Å; I291-Q299 HydrophobicContact CG2-CG 3.73Å; I291-Y361 HydrophobicContact CD1-CD1 3.27Å; I291-Y361 HydrophobicContact CD1-CD2 4.42Å; I291-Y361 HydrophobicContact CD1-CE1 3.9Å; I291-Y361 HydrophobicContact CD1-CG 3.58Å; I291-T365 WeakPolarHBondContact O-CB 3.28Å; I291-T365 VanDerWaalsContact O-CG2 3.26Å; I291-T365 WeakPolarHBondContact O-CG2 3.44Å; I291-T365 PolarHBondContact O-OG1 3.42Å
292	D	90.3	Very high	90.5	Very high	14 Å²	14	31.4 Å²	31.4	8%	0.075	16%	0.157	C	C	.	.	S	Bend	trans	-135.5	153.4	175.7	70.5	94.5	0	0	0	112.2	Q294 N295 I296 Q297 Y367	D292-Q294 PolarHBondContact O-N 3.03Å; D292-Q294 VanDerWaalsContact O-N 3.17Å; D292-Q294 VanDerWaalsContact OD1-C 3.24Å; D292-Q294 VanDerWaalsContact OD1-CA 3.26Å; D292-Q294 WeakPolarHBondContact OD1-CA 2.98Å; D292-Q294 VanDerWaalsContact OD1-CB 3.32Å; D292-Q294 WeakPolarHBondContact OD1-CB 3.29Å; D292-Q294 PolarHBondContact OD1-N 3.46Å; D292-N295 PolarHBondContact O-N 3.28Å; D292-N295 VanDerWaalsContact O-N 3.12Å; D292-N295 PolarHBondContact O-OD1 3.5Å; D292-N295 PolarHBondContact OD1-N 3.05Å; D292-I296 PolarHBondContact OD1-N 2.83Å; D292-I296 VanDerWaalsContact OD1-N 3.09Å; D292-I296 PolarHBondContact OD2-N 3.38Å; D292-Q297 WeakPolarHBondContact OD2-CA 3.29Å; D292-Q297 WeakPolarHBondContact OD2-CB 3.1Å; D292-Q297 PolarHBondContact OD2-N 2.93Å; D292-Y367 VanDerWaalsContact O-CE1 3.25Å; D292-Y367 WeakPolarHBondContact O-CE1 3.3Å
293	P	87.8	Confident	90.4	Very high	71 Å²	71	33.3 Å²	33.3	46%	0.461	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-15.3	-177.9	-17.4	29.4	0	0	0	114.7	Y367	P293-Y367 HydrophobicContact CB-CD2 4.29Å; P293-Y367 HydrophobicContact CB-CE2 4.11Å; P293-Y367 HydrophobicContact CG-CD1 4.45Å; P293-Y367 HydrophobicContact CG-CD2 3.76Å; P293-Y367 HydrophobicContact CG-CE2 4.09Å; P293-Y367 HydrophobicContact CG-CG 3.94Å
294	Q	88	Confident	90.1	Very high	134 Å²	134	34.2 Å²	34.2	63%	0.626	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-1.4	179	-63	76.9	39.7	0	0	112	D292 I296	D292-Q294 PolarHBondContact O-N 3.03Å; D292-Q294 VanDerWaalsContact O-N 3.17Å; D292-Q294 VanDerWaalsContact OD1-C 3.24Å; D292-Q294 VanDerWaalsContact OD1-CA 3.26Å; D292-Q294 WeakPolarHBondContact OD1-CA 2.98Å; D292-Q294 VanDerWaalsContact OD1-CB 3.32Å; D292-Q294 WeakPolarHBondContact OD1-CB 3.29Å; D292-Q294 PolarHBondContact OD1-N 3.46Å; Q294-I296 VanDerWaalsContact C-N 3.33Å; Q294-I296 HydrophobicContact CB-CD1 3.59Å; Q294-I296 HydrophobicContact CB-CG1 3.75Å; Q294-I296 HydrophobicContact CG-CD1 4.42Å; Q294-I296 PolarHBondContact O-N 2.91Å
295	N	85.2	Confident	89.9	Confident	55 Å²	55	37.4 Å²	37.4	29%	0.294	20%	0.197	S	C	.	.	S	Bend	trans	55.2	45.4	-178.5	-61.9	-17.9	0	0	0	112.3	W290 D292	W290-N295 WeakPolarHBondContact CB-OD1 3.23Å; W290-N295 VanDerWaalsContact CD1-CG 3.41Å; W290-N295 HydrophobicContact CD2-CB 3.59Å; W290-N295 HydrophobicContact CE3-CB 3.96Å; W290-N295 HydrophobicContact CG-CB 3.92Å; W290-N295 VanDerWaalsContact CG-OD1 3.22Å; W290-N295 HydrophobicContact CH2-CB 4.37Å; W290-N295 WeakPolarHBondContact CH2-O 3.42Å; W290-N295 HydrophobicContact CZ2-CB 4.04Å; W290-N295 HydrophobicContact CZ3-CB 4.33Å; W290-N295 WeakPolarHBondContact CZ3-O 3.42Å; D292-N295 PolarHBondContact O-N 3.28Å; D292-N295 VanDerWaalsContact O-N 3.12Å; D292-N295 PolarHBondContact O-OD1 3.5Å; D292-N295 PolarHBondContact OD1-N 3.05Å
296	I	85	Confident	89.7	Confident	126 Å²	126	38.9 Å²	38.9	65%	0.646	21%	0.209	S	C	*	.			trans	-98.1	-33	-178.5	-61.1	173	0	0	0	111.1	D292 Q294	D292-I296 PolarHBondContact OD1-N 2.83Å; D292-I296 VanDerWaalsContact OD1-N 3.09Å; D292-I296 PolarHBondContact OD2-N 3.38Å; Q294-I296 VanDerWaalsContact C-N 3.33Å; Q294-I296 HydrophobicContact CB-CD1 3.59Å; Q294-I296 HydrophobicContact CB-CG1 3.75Å; Q294-I296 HydrophobicContact CG-CD1 4.42Å; Q294-I296 PolarHBondContact O-N 2.91Å
297	Q	88.1	Confident	89.5	Confident	104 Å²	104	40.8 Å²	40.8	49%	0.486	22%	0.216	S	C	.	.			trans	-122.4	136.9	-176	-60.5	-175.7	0.1	0	0	110.2	I291 D292	I291-Q297 HydrophobicContact CD1-CB 3.74Å; I291-Q297 HydrophobicContact CG1-CB 3.58Å; I291-Q297 VanDerWaalsContact CG1-O 3.3Å; I291-Q297 WeakPolarHBondContact CG1-O 3.26Å; I291-Q297 PolarHBondContact N-O 2.89Å; D292-Q297 WeakPolarHBondContact OD2-CA 3.29Å; D292-Q297 WeakPolarHBondContact OD2-CB 3.1Å; D292-Q297 PolarHBondContact OD2-N 2.93Å
298	A	89.7	Confident	89.4	Confident	9 Å²	9	42.9 Å²	42.9	7%	0.074	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	161.5	-179.1	0	0	0	0	0	112.1	P252 L253 A288 Y289 W290	P252-A298 HydrophobicContact CB-CB 3.75Å; P252-A298 HydrophobicContact CG-CB 3.63Å; L253-A298 HydrophobicContact CD2-CB 4.14Å; L253-A298 HydrophobicContact CG-CB 4.25Å; A288-A298 HydrophobicContact CB-CB 4.12Å; Y289-A298 CarbonylContact O-C 3.51Å; Y289-A298 WeakPolarHBondContact O-CA 3.37Å; Y289-A298 WeakPolarHBondContact O-CB 3.29Å; W290-A298 HydrophobicContact CE3-CB 3.83Å; W290-A298 HydrophobicContact CZ3-CB 3.92Å
299	Q	90.7	Very high	88.9	Confident	20 Å²	20	43.7 Å²	43.7	9%	0.093	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	160.2	176.1	-77.3	-59	-41.7	0	0	110.5	A288 Y289 I291 S355 Y361	A288-Q299 CarbonylContact C-O 3.54Å; A288-Q299 WeakPolarHBondContact CA-O 3.33Å; Y289-Q299 HydrophobicContact CD1-CB 3.93Å; Y289-Q299 WeakPolarHBondContact CD1-O 3.43Å; Y289-Q299 HydrophobicContact CE1-CB 3.23Å; Y289-Q299 HydrophobicContact CE1-CG 4.43Å; Y289-Q299 HydrophobicContact CE2-CB 4.49Å; Y289-Q299 PolarHBondContact N-O 3.44Å; Y289-Q299 PolarHBondContact O-N 2.97Å; I291-Q299 HydrophobicContact CD1-CG 4.32Å; I291-Q299 HydrophobicContact CG2-CB 4.06Å; I291-Q299 HydrophobicContact CG2-CG 3.73Å; Q299-S355 PolarHBondContact OE1-OG 3.03Å; Q299-Y361 HydrophobicContact CG-CD2 3.52Å; Q299-Y361 HydrophobicContact CG-CE2 3.75Å; Q299-Y361 HydrophobicContact CG-CG 4.16Å; Q299-Y361 VanDerWaalsContact NE2-CZ 3.26Å; Q299-Y361 PolarHBondContact NE2-OH 2.93Å
300	L	91.6	Very high	88.2	Confident	39 Å²	39	45.2 Å²	45.2	20%	0.204	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	142.3	-174.7	-170	74.7	0	0	0	112.2	I256 A287 R302 G354 S355	I256-L300 HydrophobicContact CD1-CD1 4.49Å; I256-L300 HydrophobicContact CG2-CD1 4.16Å; A287-L300 WeakPolarHBondContact O-CA 3.39Å; A287-L300 WeakPolarHBondContact O-CD1 3.29Å; L300-R302 HydrophobicContact CD2-CG 3.6Å; L300-R302 HydrophobicContact CG-CG 3.98Å; L300-G354 CarbonylContact O-C 3.56Å; L300-G354 PolarHBondContact O-N 2.83Å; L300-S355 WeakPolarHBondContact CB-OG 3.42Å; L300-S355 PolarHBondContact N-OG 3.07Å
301	V	92.4	Very high	87.3	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.024	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	134.2	166.5	177.3	0	0	0	0	109	P286 A287 Y289 I351 L353	P286-V301 WeakPolarHBondContact O-CB 3.27Å; A287-V301 PolarHBondContact O-N 3.16Å; Y289-V301 HydrophobicContact CD1-CG2 3.89Å; Y289-V301 HydrophobicContact CG-CG2 4.33Å; V301-I351 HydrophobicContact CG1-CG2 3.83Å; V301-L353 HydrophobicContact CG1-CD2 4.46Å; V301-L353 HydrophobicContact CG2-CD2 4.01Å
302	R	91.2	Very high	86.1	Confident	59 Å²	59	56.7 Å²	56.7	22%	0.223	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	145.4	176	-64.5	179.2	-72.2	156.6	3.8	110.8	E121 T122 L300 G304 N352 G354	E121-R302 PolarHBondContact O-NH2 2.82Å; T122-R302 PolarHBondContact O-NH2 3.15Å; T122-R302 PolarHBondContact OG1-NH2 2.93Å; L300-R302 HydrophobicContact CD2-CG 3.6Å; L300-R302 HydrophobicContact CG-CG 3.98Å; R302-G304 PolarHBondContact O-N 2.83Å; R302-N352 HydrophobicContact CB-CB 4.21Å; R302-N352 PolarHBondContact N-O 2.93Å; R302-N352 PolarHBondContact O-N 2.72Å; R302-G354 PolarHBondContact NE-O 2.96Å; R302-G354 PolarHBondContact NH2-O 3.34Å
303	L	92.1	Very high	85	Confident	42 Å²	42	62.4 Å²	62.4	22%	0.22	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	128.5	167.4	-64.8	-179	0	0	0	109.2	N240 P259 I261 F285 Q349 I351	N240-L303 HydrophobicContact CB-CD1 4.41Å; P259-L303 HydrophobicContact CB-CD1 3.61Å; P259-L303 HydrophobicContact CB-CD2 4.26Å; P259-L303 HydrophobicContact CB-CG 3.56Å; P259-L303 HydrophobicContact CG-CG 4.05Å; I261-L303 HydrophobicContact CD1-CD1 4.23Å; I261-L303 HydrophobicContact CD1-CD2 4.35Å; I261-L303 HydrophobicContact CG1-CD1 4.12Å; F285-L303 HydrophobicContact CD2-CD2 3.72Å; F285-L303 HydrophobicContact CE2-CD2 3.8Å; F285-L303 HydrophobicContact CG-CD2 4.24Å; F285-L303 HydrophobicContact CZ-CD2 4.36Å; L303-Q349 HydrophobicContact CD2-CG 4.38Å; L303-I351 HydrophobicContact CD2-CD1 3.66Å
304	G	90.2	Very high	84	Confident	19 Å²	19	59.3 Å²	59.3	20%	0.196	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-160.2	167.6	0	0	0	0	0	111.7	R302 Q349 I350 N352	R302-G304 PolarHBondContact O-N 2.83Å; G304-Q349 PolarHBondContact O-NE2 3.08Å; G304-I350 WeakPolarHBondContact CA-O 3.25Å; G304-I350 PolarHBondContact N-O 3.48Å; G304-N352 VanDerWaalsContact CA-ND2 3.28Å; G304-N352 WeakPolarHBondContact CA-ND2 3.47Å
305	T	87	Confident	83.3	Confident	68 Å²	68	60.9 Å²	60.9	42%	0.417	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	136.6	178.6	-45.2	0	0	0	0	111.4	D126 I350	D126-T305 PolarHBondContact OD1-OG1 2.97Å; T305-I350 PolarHBondContact O-N 2.96Å; T305-I350 VanDerWaalsContact O-N 3.09Å
306	A	89	Confident	82.7	Confident	30 Å²	30	59 Å²	59	25%	0.248	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.9	169.1	0	0	0	0	0	109.5	E348	A306-E348 CarbonylContact C-O 3.59Å; A306-E348 VanDerWaalsContact CA-O 3.28Å; A306-E348 WeakPolarHBondContact CA-O 3.41Å
307	R	86.5	Confident	82.4	Confident	41 Å²	41	60.2 Å²	60.2	16%	0.155	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	160.7	-176.7	62.6	-178.7	-175.7	-177.7	8.5	113.8	D126 R347 E348	D126-R307 IonicContact OD2-CZ 2.83Å; D126-R307 IonicContact OD2-NE 3.35Å; D126-R307 IonicContact OD2-NH1 3.55Å; D126-R307 PolarHBondContact OD2-NH1 2.94Å; R307-R347 CarbonylContact O-C 3.54Å; R307-R347 WeakPolarHBondContact O-CA 3.46Å; R307-E348 HydrophobicContact CG-CB 4.19Å; R307-E348 IonicContact CZ-OE2 2.73Å; R307-E348 VanDerWaalsContact CZ-OE2 3.25Å; R307-E348 PolarHBondContact N-O 3.2Å; R307-E348 IonicContact NE-OE2 2.59Å; R307-E348 PolarHBondContact NE-OE2 2.77Å; R307-E348 IonicContact NH2-OE2 3.79Å; R307-E348 PolarHBondContact NH2-OE2 3.2Å; R307-E348 PolarHBondContact O-N 3.35Å
308	P	84.9	Confident	82.2	Confident	45 Å²	45	55.6 Å²	55.6	29%	0.292	27%	0.266	S	S	.	.			trans	-58.9	155.2	164.4	-20.6	33.2	0	0	0	111.5	D234 D310	D234-P308 WeakPolarHBondContact O-CG 3.13Å; P308-D310 PolarHBondContact O-N 2.85Å
309	I	81.4	Confident	82.1	Confident	17 Å²	17	55.2 Å²	55.2	9%	0.087	26%	0.263	C	S	.	.			trans	-67.4	121.6	171.5	-68.7	174.3	0	0	0	108.4	L225 V314 Y319 Q334 V346	L225-I309 HydrophobicContact CD1-CD1 4.02Å; L225-I309 HydrophobicContact CD2-CD1 3.7Å; L225-I309 HydrophobicContact CD2-CG1 3.81Å; L225-I309 HydrophobicContact CG-CD1 4.39Å; I309-V314 HydrophobicContact CG2-CB 3.99Å; I309-V314 HydrophobicContact CG2-CG1 4.14Å; I309-Y319 HydrophobicContact CD1-CE1 4.13Å; I309-Y319 HydrophobicContact CG2-CE1 4.1Å; I309-Q334 HydrophobicContact CB-CB 4.45Å; I309-Q334 HydrophobicContact CB-CG 4.37Å; I309-Q334 HydrophobicContact CD1-CG 3.85Å; I309-V346 HydrophobicContact CD1-CB 3.87Å; I309-V346 HydrophobicContact CD1-CG1 3.37Å; I309-V346 HydrophobicContact CG1-CG1 4.17Å
310	D	76.1	Confident	81.8	Confident	41 Å²	41	54.9 Å²	54.9	22%	0.219	26%	0.261	C	S	.	.			trans	-99.4	105.3	172	-173.2	-18.1	0	0	0	109.5	P308 R312 Y313 V314	P308-D310 PolarHBondContact O-N 2.85Å; D310-R312 PolarHBondContact O-N 2.95Å; D310-R312 WeakPolarHBondContact OD1-CB 3.48Å; D310-R312 VanDerWaalsContact OD1-CG 3.28Å; D310-R312 WeakPolarHBondContact OD1-CG 3.25Å; D310-R312 IonicContact OD1-CZ 2.79Å; D310-R312 PolarHBondContact OD1-N 2.87Å; D310-R312 IonicContact OD1-NE 3.59Å; D310-R312 PolarHBondContact OD1-NE 2.86Å; D310-R312 IonicContact OD1-NH2 2.86Å; D310-R312 IonicContact OD2-CZ 2.77Å; D310-R312 VanDerWaalsContact OD2-CZ 3.3Å; D310-R312 IonicContact OD2-NE 3.25Å; D310-R312 PolarHBondContact OD2-NE 2.86Å; D310-R312 VanDerWaalsContact OD2-NE 3.08Å; D310-R312 IonicContact OD2-NH2 3.23Å; D310-R312 PolarHBondContact OD2-NH2 2.83Å; D310-Y313 HydrophobicContact CB-CD2 3.91Å; D310-Y313 PolarHBondContact O-N 2.8Å; D310-Y313 WeakPolarHBondContact OD2-CD2 3.33Å; D310-Y313 WeakPolarHBondContact OD2-CE2 3.48Å; D310-V314 PolarHBondContact O-N 2.89Å
311	N	73.4	Confident	81.7	Confident	60 Å²	60	54.9 Å²	54.9	32%	0.321	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-9.9	-177.9	-66.1	-39.4	0	0	0	113.7	Y313 V314 Y319 Q334	N311-Y313 VanDerWaalsContact C-N 3.29Å; N311-V314 WeakPolarHBondContact CA-O 3.34Å; N311-Y319 PolarHBondContact OD1-OH 2.58Å; N311-Q334 PolarHBondContact ND2-O 3.18Å
312	R	68.2	Low	81.7	Confident	193 Å²	193	54.7 Å²	54.7	73%	0.728	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-28.8	170.6	-61.7	178.1	-68.2	-177.3	-1.2	112.3	D310	D310-R312 PolarHBondContact O-N 2.95Å; D310-R312 WeakPolarHBondContact OD1-CB 3.48Å; D310-R312 VanDerWaalsContact OD1-CG 3.28Å; D310-R312 WeakPolarHBondContact OD1-CG 3.25Å; D310-R312 IonicContact OD1-CZ 2.79Å; D310-R312 PolarHBondContact OD1-N 2.87Å; D310-R312 IonicContact OD1-NE 3.59Å; D310-R312 PolarHBondContact OD1-NE 2.86Å; D310-R312 IonicContact OD1-NH2 2.86Å; D310-R312 IonicContact OD2-CZ 2.77Å; D310-R312 VanDerWaalsContact OD2-CZ 3.3Å; D310-R312 IonicContact OD2-NE 3.25Å; D310-R312 PolarHBondContact OD2-NE 2.86Å; D310-R312 VanDerWaalsContact OD2-NE 3.08Å; D310-R312 IonicContact OD2-NH2 3.23Å; D310-R312 PolarHBondContact OD2-NH2 2.83Å
313	Y	66.4	Low	82	Confident	134 Å²	134	51.9 Å²	51.9	53%	0.525	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-36.6	-175.9	-53.7	-68.3	0	0	0	112.2	T127 D310 N311	T127-Y313 HydrophobicContact CG2-CD1 4.33Å; T127-Y313 HydrophobicContact CG2-CG 4.38Å; D310-Y313 HydrophobicContact CB-CD2 3.91Å; D310-Y313 PolarHBondContact O-N 2.8Å; D310-Y313 WeakPolarHBondContact OD2-CD2 3.33Å; D310-Y313 WeakPolarHBondContact OD2-CE2 3.48Å; N311-Y313 VanDerWaalsContact C-N 3.29Å
314	V	67.1	Low	82.2	Confident	5 Å²	5	49.9 Å²	49.9	3%	0.03	24%	0.237	C	C	.	.	S	Bend	trans	-98.3	106.1	178.5	-176.8	0	0	0	0	108.6	H110 I309 D310 N311 T316 Y319	H110-V314 WeakPolarHBondContact CE1-CG1 3.15Å; H110-V314 WeakPolarHBondContact NE2-CG1 3.18Å; I309-V314 HydrophobicContact CG2-CB 3.99Å; I309-V314 HydrophobicContact CG2-CG1 4.14Å; D310-V314 PolarHBondContact O-N 2.89Å; N311-V314 WeakPolarHBondContact CA-O 3.34Å; V314-T316 PolarHBondContact O-N 2.76Å; V314-Y319 HydrophobicContact CG1-CD1 3.95Å; V314-Y319 HydrophobicContact CG1-CE1 3.78Å
315	K	73.4	Confident	82.4	Confident	168 Å²	168	49.1 Å²	49.1	73%	0.73	23%	0.229	S	C	*	.			trans	-69	130.1	175.7	-65.3	-179.2	-178.9	175.3	0	108.9	K317 S318	K315-K317 PolarHBondContact O-N 2.73Å; K315-S318 WeakPolarHBondContact O-CB 3.17Å; K315-S318 PolarHBondContact O-N 2.88Å; K315-S318 PolarHBondContact O-OG 2.83Å
316	T	72.7	Confident	82.8	Confident	16 Å²	16	45.9 Å²	45.9	10%	0.098	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-50.4	-38.7	179.4	52.7	0	0	0	0	113.3	V314 S318 Y319 H320 I335	V314-T316 PolarHBondContact O-N 2.76Å; T316-S318 PolarHBondContact O-N 2.87Å; T316-Y319 PolarHBondContact O-N 2.95Å; T316-H320 WeakPolarHBondContact O-CB 3.32Å; T316-H320 PolarHBondContact O-N 2.94Å; T316-I335 HydrophobicContact CG2-CD1 3.77Å; T316-I335 HydrophobicContact CG2-CG1 4.1Å
317	K	78.2	Confident	83.2	Confident	151 Å²	151	45.5 Å²	45.5	66%	0.657	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-51.7	-23.6	175.3	-69.7	-170.9	176.5	-173.2	0	114.5	K315 Y319	K315-K317 PolarHBondContact O-N 2.73Å; K317-Y319 PolarHBondContact O-N 3.36Å
318	S	83.7	Confident	83.6	Confident	6 Å²	6	44.6 Å²	44.6	4%	0.042	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-69.5	-21.3	178.8	68.9	0	0	0	0	113.6	H110 S137 K315 T316	H110-S318 PolarHBondContact CD2-OG 2.82Å; H110-S318 PolarHBondContact NE2-OG 2.9Å; S137-S318 WeakPolarHBondContact CB-O 3.34Å; S137-S318 WeakPolarHBondContact OG-CA 3.41Å; S137-S318 PolarHBondContact OG-O 3.25Å; K315-S318 WeakPolarHBondContact O-CB 3.17Å; K315-S318 PolarHBondContact O-N 2.88Å; K315-S318 PolarHBondContact O-OG 2.83Å; T316-S318 PolarHBondContact O-N 2.87Å
319	Y	87.2	Confident	84	Confident	1 Å²	1	42.5 Å²	42.5	0%	0.004	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.5	-8.9	-177.7	63.8	-101.6	0	0	0	114.6	L225 I309 N311 V314 T316 K317 F321 G322 F332	L225-Y319 HydrophobicContact CD1-CD1 3.9Å; L225-Y319 HydrophobicContact CD1-CG 3.89Å; I309-Y319 HydrophobicContact CD1-CE1 4.13Å; I309-Y319 HydrophobicContact CG2-CE1 4.1Å; N311-Y319 PolarHBondContact OD1-OH 2.58Å; V314-Y319 HydrophobicContact CG1-CD1 3.95Å; V314-Y319 HydrophobicContact CG1-CE1 3.78Å; T316-Y319 PolarHBondContact O-N 2.95Å; K317-Y319 PolarHBondContact O-N 3.36Å; Y319-F321 VanDerWaalsContact C-N 3.25Å; Y319-F321 PolarHBondContact O-N 2.77Å; Y319-G322 WeakPolarHBondContact O-CA 3.35Å; Y319-G322 PolarHBondContact O-N 2.82Å; Y319-F332 HydrophobicContact CD2-CD1 4.3Å; Y319-F332 AromaticContact CD2-CE1 3.66Å; Y319-F332 HydrophobicContact CD2-CE1 3.66Å; Y319-F332 HydrophobicContact CD2-CZ 4.46Å; Y319-F332 HydrophobicContact CE2-CE1 4.19Å
320	H	85	Confident	84.4	Confident	14 Å²	14	44.3 Å²	44.3	7%	0.065	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-31.2	-175.1	-147	120.8	0	0	0	113.1	T316 G322 F325	T316-H320 WeakPolarHBondContact O-CB 3.32Å; T316-H320 PolarHBondContact O-N 2.94Å; H320-G322 VanDerWaalsContact C-N 3.26Å; H320-G322 PolarHBondContact O-N 2.9Å; H320-F325 AromaticContact CD2-CD1 3.47Å; H320-F325 VanDerWaalsContact CD2-CD1 3.47Å; H320-F325 WeakPolarHBondContact CD2-CD1 3.46Å; H320-F325 AromaticContact CD2-CD2 3.85Å; H320-F325 AromaticContact CD2-CE1 3.17Å; H320-F325 WeakPolarHBondContact CD2-CE1 3.44Å; H320-F325 AromaticContact CD2-CE2 3.64Å; H320-F325 AromaticContact CD2-CG 3.77Å; H320-F325 AromaticContact CD2-CZ 3.31Å; H320-F325 WeakPolarHBondContact CD2-CZ 3.39Å; H320-F325 AromaticContact CE1-CE2 3.96Å; H320-F325 AromaticContact CE1-CZ 3.93Å; H320-F325 AromaticContact NE2-CD1 3.97Å; H320-F325 AromaticContact NE2-CD2 3.89Å; H320-F325 AromaticContact NE2-CE1 3.25Å; H320-F325 VanDerWaalsContact NE2-CE1 3.25Å; H320-F325 WeakPolarHBondContact NE2-CE1 3.3Å; H320-F325 AromaticContact NE2-CE2 3.21Å; H320-F325 WeakPolarHBondContact NE2-CE2 3.27Å; H320-F325 AromaticContact NE2-CZ 2.84Å; H320-F325 WeakPolarHBondContact NE2-CZ 3.37Å; H320-F325 WeakPolarHBondContact O-CB 3.43Å; H320-F325 WeakPolarHBondContact O-CD1 3.16Å; H320-F325 WeakPolarHBondContact O-CG 3.4Å
321	F	89	Confident	85.1	Confident	38 Å²	38	46.7 Å²	46.7	17%	0.167	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	14	174.2	-64.9	-77.7	0	0	0	113.1	H62 N87 A89 Y92 Y319	H62-F321 WeakPolarHBondContact CB-O 3.44Å; H62-F321 VanDerWaalsContact CD2-CB 3.46Å; H62-F321 WeakPolarHBondContact CD2-CB 3.43Å; H62-F321 VanDerWaalsContact CG-O 3.27Å; N87-F321 VanDerWaalsContact O-CZ 3.25Å; N87-F321 WeakPolarHBondContact O-CZ 3.39Å; A89-F321 HydrophobicContact CB-CE1 4.33Å; A89-F321 HydrophobicContact CB-CZ 4.16Å; Y92-F321 AromaticContact CD1-CD1 3.82Å; Y92-F321 HydrophobicContact CD1-CD1 3.82Å; Y92-F321 HydrophobicContact CE1-CB 4.34Å; Y92-F321 HydrophobicContact CE1-CD1 4.36Å; Y92-F321 AromaticContact CG-CD1 3.97Å; Y92-F321 HydrophobicContact CG-CD1 3.97Å; Y92-F321 HydrophobicContact CG-CE1 4.46Å; Y92-F321 PolarHBondContact OH-O 2.59Å; Y319-F321 VanDerWaalsContact C-N 3.25Å; Y319-F321 PolarHBondContact O-N 2.77Å
322	G	93.3	Very high	85.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	-70.6	156.9	171.9	0	0	0	0	0	112	Y92 Y319 H320 P324 F325 A326	Y92-G322 WeakPolarHBondContact CE1-O 3.48Å; Y92-G322 PolarHBondContact OH-O 2.95Å; Y319-G322 WeakPolarHBondContact O-CA 3.35Å; Y319-G322 PolarHBondContact O-N 2.82Å; H320-G322 VanDerWaalsContact C-N 3.26Å; H320-G322 PolarHBondContact O-N 2.9Å; G322-P324 VanDerWaalsContact C-N 3.3Å; G322-F325 PolarHBondContact O-N 2.8Å; G322-F325 VanDerWaalsContact O-N 3.14Å; G322-A326 PolarHBondContact O-N 3.44Å
323	L	96.5	Very high	86.5	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-55.4	-35.1	178.3	-174.5	56.4	0	0	0	114.3	L40 L55 S65 I67 F84 V96 F325 A326 L327	L40-L323 HydrophobicContact CD1-CD1 3.57Å; L40-L323 HydrophobicContact CD1-CD2 3.67Å; L40-L323 HydrophobicContact CD1-CG 4.28Å; L55-L323 HydrophobicContact CB-CD2 3.8Å; L55-L323 WeakPolarHBondContact O-CD2 3.02Å; S65-L323 VanDerWaalsContact CB-CB 3.46Å; S65-L323 PolarHBondContact OG-N 3.09Å; I67-L323 HydrophobicContact CD1-CB 4.32Å; I67-L323 HydrophobicContact CD1-CD2 4.21Å; I67-L323 HydrophobicContact CD1-CG 3.75Å; I67-L323 HydrophobicContact CG1-CB 4.48Å; I67-L323 HydrophobicContact CG1-CD2 3.87Å; I67-L323 HydrophobicContact CG1-CG 3.96Å; F84-L323 HydrophobicContact CE2-CD1 4.03Å; F84-L323 HydrophobicContact CZ-CD1 4.24Å; V96-L323 HydrophobicContact CG2-CD1 4.14Å; L323-F325 VanDerWaalsContact C-N 3.26Å; L323-F325 PolarHBondContact O-N 2.94Å; L323-A326 HydrophobicContact CD1-CB 4.45Å; L323-A326 WeakPolarHBondContact O-CB 3.4Å; L323-A326 PolarHBondContact O-N 3.34Å; L323-L327 PolarHBondContact O-N 3.2Å; L323-L327 VanDerWaalsContact O-N 3.11Å
324	P	96.1	Very high	87.1	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.5	-33.5	178.4	-26.6	38.6	0	0	0	113.1	I67 I108 F227 G322 L327 Y328 F332	I67-P324 HydrophobicContact CD1-CB 4.37Å; I67-P324 HydrophobicContact CD1-CG 4.15Å; I108-P324 HydrophobicContact CD1-CG 3.9Å; I108-P324 HydrophobicContact CG1-CG 4.01Å; F227-P324 HydrophobicContact CD1-CG 3.98Å; F227-P324 HydrophobicContact CE1-CB 4.1Å; F227-P324 HydrophobicContact CE1-CG 3.24Å; F227-P324 HydrophobicContact CE2-CB 4.3Å; F227-P324 HydrophobicContact CE2-CG 4.16Å; F227-P324 HydrophobicContact CZ-CB 4Å; F227-P324 HydrophobicContact CZ-CG 3.37Å; G322-P324 VanDerWaalsContact C-N 3.3Å; P324-L327 PolarHBondContact O-N 2.98Å; P324-Y328 HydrophobicContact CB-CD2 4.12Å; P324-Y328 HydrophobicContact CB-CE2 4.31Å; P324-Y328 WeakPolarHBondContact O-CB 3.18Å; P324-Y328 WeakPolarHBondContact O-CD2 3.28Å; P324-Y328 PolarHBondContact O-N 2.99Å; P324-F332 HydrophobicContact CB-CD1 4.13Å; P324-F332 HydrophobicContact CB-CD2 3.64Å; P324-F332 HydrophobicContact CB-CE1 3.96Å; P324-F332 HydrophobicContact CB-CE2 3.48Å; P324-F332 VanDerWaalsContact CB-CE2 3.48Å; P324-F332 HydrophobicContact CB-CG 3.97Å; P324-F332 HydrophobicContact CB-CZ 3.66Å; P324-F332 HydrophobicContact CG-CE2 4.16Å; P324-F332 HydrophobicContact CG-CZ 4.05Å
325	F	95	Very high	87.5	Confident	3 Å²	3	34.6 Å²	34.6	1%	0.013	16%	0.159	C	C	.	.	H	α-helix	trans	-73.6	-35.5	176.6	-173.4	-99.7	0	0	0	112	A89 Y92 R93 H320 G322 L323 L327 G329 F332	A89-F325 HydrophobicContact CB-CE1 4.42Å; A89-F325 WeakPolarHBondContact O-CE1 3.3Å; Y92-F325 AromaticContact CD1-CD1 3.68Å; Y92-F325 HydrophobicContact CD1-CD1 3.68Å; Y92-F325 HydrophobicContact CD1-CE1 4.27Å; Y92-F325 HydrophobicContact CE1-CB 4.49Å; Y92-F325 HydrophobicContact CE1-CD1 4.1Å; R93-F325 HydrophobicContact CB-CD1 4.04Å; R93-F325 HydrophobicContact CB-CE1 3.3Å; R93-F325 HydrophobicContact CB-CE2 4.25Å; R93-F325 HydrophobicContact CB-CZ 3.39Å; R93-F325 HydrophobicContact CG-CZ 4.47Å; H320-F325 AromaticContact CD2-CD1 3.47Å; H320-F325 VanDerWaalsContact CD2-CD1 3.47Å; H320-F325 WeakPolarHBondContact CD2-CD1 3.46Å; H320-F325 AromaticContact CD2-CD2 3.85Å; H320-F325 AromaticContact CD2-CE1 3.17Å; H320-F325 WeakPolarHBondContact CD2-CE1 3.44Å; H320-F325 AromaticContact CD2-CE2 3.64Å; H320-F325 AromaticContact CD2-CG 3.77Å; H320-F325 AromaticContact CD2-CZ 3.31Å; H320-F325 WeakPolarHBondContact CD2-CZ 3.39Å; H320-F325 AromaticContact CE1-CE2 3.96Å; H320-F325 AromaticContact CE1-CZ 3.93Å; H320-F325 AromaticContact NE2-CD1 3.97Å; H320-F325 AromaticContact NE2-CD2 3.89Å; H320-F325 AromaticContact NE2-CE1 3.25Å; H320-F325 VanDerWaalsContact NE2-CE1 3.25Å; H320-F325 WeakPolarHBondContact NE2-CE1 3.3Å; H320-F325 AromaticContact NE2-CE2 3.21Å; H320-F325 WeakPolarHBondContact NE2-CE2 3.27Å; H320-F325 AromaticContact NE2-CZ 2.84Å; H320-F325 WeakPolarHBondContact NE2-CZ 3.37Å; H320-F325 WeakPolarHBondContact O-CB 3.43Å; H320-F325 WeakPolarHBondContact O-CD1 3.16Å; H320-F325 WeakPolarHBondContact O-CG 3.4Å; G322-F325 PolarHBondContact O-N 2.8Å; G322-F325 VanDerWaalsContact O-N 3.14Å; L323-F325 VanDerWaalsContact C-N 3.26Å; L323-F325 PolarHBondContact O-N 2.94Å; F325-L327 PolarHBondContact O-N 3.14Å; F325-G329 VanDerWaalsContact CD2-O 3.24Å; F325-G329 WeakPolarHBondContact CD2-O 3.06Å; F325-G329 VanDerWaalsContact CE2-C 3.49Å; F325-G329 WeakPolarHBondContact CE2-O 3.41Å; F325-G329 WeakPolarHBondContact O-CA 3.4Å; F325-G329 PolarHBondContact O-N 2.85Å; F325-F332 HydrophobicContact CB-CD1 3.88Å; F325-F332 HydrophobicContact CD2-CB 4.29Å; F325-F332 HydrophobicContact CD2-CD1 4.43Å
326	A	96.2	Very high	87.3	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-60.4	-30.1	169.7	0	0	0	0	0	113	F84 Y92 N94 S95 V96 G322 L323	F84-A326 HydrophobicContact CD2-CB 3.94Å; F84-A326 HydrophobicContact CE2-CB 3.85Å; Y92-A326 HydrophobicContact CE1-CB 3.83Å; Y92-A326 HydrophobicContact CE2-CB 3.99Å; N94-A326 CarbonylContact C-O 3.55Å; N94-A326 WeakPolarHBondContact CA-O 3.49Å; N94-A326 PolarHBondContact N-O 3.17Å; N94-A326 VanDerWaalsContact N-O 3.08Å; S95-A326 PolarHBondContact N-O 2.94Å; S95-A326 WeakPolarHBondContact OG-CB 3.5Å; V96-A326 HydrophobicContact CB-CB 4.43Å; V96-A326 HydrophobicContact CG2-CB 3.99Å; V96-A326 PolarHBondContact N-O 3.34Å; G322-A326 PolarHBondContact O-N 3.44Å; L323-A326 HydrophobicContact CD1-CB 4.45Å; L323-A326 WeakPolarHBondContact O-CB 3.4Å; L323-A326 PolarHBondContact O-N 3.34Å
327	L	97.1	Very high	86.7	Confident	21 Å²	21	35.9 Å²	35.9	11%	0.11	17%	0.171	C	C	.	.	H	α-helix	trans	-87.9	-47.1	-179.7	-177.9	65.9	0	0	0	113.6	I67 I69 V96 I98 L323 P324 F325	I67-L327 HydrophobicContact CD1-CB 4.18Å; I67-L327 HydrophobicContact CD1-CD2 3.69Å; I67-L327 HydrophobicContact CG2-CD2 4.22Å; I69-L327 HydrophobicContact CD1-CD2 3.65Å; V96-L327 HydrophobicContact CG1-CD1 4.18Å; I98-L327 HydrophobicContact CG2-CD1 4.04Å; L323-L327 PolarHBondContact O-N 3.2Å; L323-L327 VanDerWaalsContact O-N 3.11Å; P324-L327 PolarHBondContact O-N 2.98Å; F325-L327 PolarHBondContact O-N 3.14Å
328	Y	95.4	Very high	85.8	Confident	23 Å²	23	37.6 Å²	37.6	9%	0.09	18%	0.181	C	C	.	.	H	α-helix	trans	-102.3	-13.3	-171.7	-57.8	-64.2	0	0	0	114	S104 F227 N229 P324 D330 R331 V344	S104-Y328 WeakPolarHBondContact CB-OH 3.18Å; S104-Y328 PolarHBondContact OG-OH 3.36Å; F227-Y328 HydrophobicContact CD2-CE2 4.28Å; F227-Y328 AromaticContact CE2-CE2 4Å; F227-Y328 HydrophobicContact CE2-CE2 4Å; N229-Y328 HydrophobicContact CB-CE1 4.21Å; P324-Y328 HydrophobicContact CB-CD2 4.12Å; P324-Y328 HydrophobicContact CB-CE2 4.31Å; P324-Y328 WeakPolarHBondContact O-CB 3.18Å; P324-Y328 WeakPolarHBondContact O-CD2 3.28Å; P324-Y328 PolarHBondContact O-N 2.99Å; Y328-D330 PolarHBondContact O-N 3.04Å; Y328-R331 PolarHBondContact O-N 3.36Å; Y328-V344 HydrophobicContact CD1-CG2 4.01Å; Y328-V344 HydrophobicContact CD2-CG1 4.3Å; Y328-V344 HydrophobicContact CD2-CG2 3.63Å; Y328-V344 HydrophobicContact CE1-CG2 4.45Å; Y328-V344 HydrophobicContact CE2-CG1 4.21Å; Y328-V344 HydrophobicContact CE2-CG2 4.1Å; Y328-V344 HydrophobicContact CG-CG2 3.56Å
329	G	93.1	Very high	85.1	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	52.1	-133	-173.3	0	0	0	0	0	112.9	N94 F325 R331 F332	N94-G329 PolarHBondContact OD1-N 2.96Å; F325-G329 VanDerWaalsContact CD2-O 3.24Å; F325-G329 WeakPolarHBondContact CD2-O 3.06Å; F325-G329 VanDerWaalsContact CE2-C 3.49Å; F325-G329 WeakPolarHBondContact CE2-O 3.41Å; F325-G329 WeakPolarHBondContact O-CA 3.4Å; F325-G329 PolarHBondContact O-N 2.85Å; G329-R331 PolarHBondContact O-N 2.86Å; G329-F332 WeakPolarHBondContact O-CB 3.38Å; G329-F332 PolarHBondContact O-N 3.21Å
330	D	89.4	Confident	84.5	Confident	56 Å²	56	41.4 Å²	41.4	30%	0.299	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-56.3	-23.3	-174.5	-57	-10.4	0	0	0	113.5	R93 Y328 F332 D333	R93-D330 VanDerWaalsContact CD-OD1 3.24Å; R93-D330 WeakPolarHBondContact CD-OD1 3.32Å; R93-D330 IonicContact CZ-OD1 3.12Å; R93-D330 IonicContact NE-OD1 3.94Å; R93-D330 IonicContact NH1-OD1 3.78Å; R93-D330 PolarHBondContact NH1-OD1 3.18Å; R93-D330 IonicContact NH1-OD2 3.05Å; R93-D330 PolarHBondContact NH1-OD2 2.86Å; R93-D330 VanDerWaalsContact NH1-OD2 3.12Å; Y328-D330 PolarHBondContact O-N 3.04Å; D330-F332 PolarHBondContact O-N 3.5Å; D330-D333 WeakPolarHBondContact O-CB 3.46Å; D330-D333 PolarHBondContact O-N 3.43Å
331	R	89.9	Confident	84.1	Confident	91 Å²	91	47 Å²	47	34%	0.343	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-64.1	-23.8	174.8	-65.5	-177.5	63.3	-149.7	-11	113	N229 Y328 G329 N342 H343 V344	N229-R331 PolarHBondContact O-NH2 3.46Å; Y328-R331 PolarHBondContact O-N 3.36Å; G329-R331 PolarHBondContact O-N 2.86Å; R331-N342 PolarHBondContact NE-O 3.2Å; R331-N342 PolarHBondContact NH2-O 3.19Å; R331-H343 CarbonylContact O-C 3.51Å; R331-H343 WeakPolarHBondContact O-CA 3.37Å; R331-V344 HydrophobicContact CB-CG2 4.12Å; R331-V344 PolarHBondContact O-N 2.96Å
332	F	90.9	Very high	83.8	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-85.3	-18.2	175.4	-170.7	-109.6	0	0	0	112.4	I108 F227 Y319 P324 F325 G329 D330 Q334 V344 V346	I108-F332 HydrophobicContact CD1-CE1 3.99Å; I108-F332 HydrophobicContact CD1-CZ 3.68Å; F227-F332 HydrophobicContact CB-CE2 4.28Å; F227-F332 HydrophobicContact CD1-CE2 4.24Å; F227-F332 HydrophobicContact CG-CE2 4.17Å; Y319-F332 HydrophobicContact CD2-CD1 4.3Å; Y319-F332 AromaticContact CD2-CE1 3.66Å; Y319-F332 HydrophobicContact CD2-CE1 3.66Å; Y319-F332 HydrophobicContact CD2-CZ 4.46Å; Y319-F332 HydrophobicContact CE2-CE1 4.19Å; P324-F332 HydrophobicContact CB-CD1 4.13Å; P324-F332 HydrophobicContact CB-CD2 3.64Å; P324-F332 HydrophobicContact CB-CE1 3.96Å; P324-F332 HydrophobicContact CB-CE2 3.48Å; P324-F332 VanDerWaalsContact CB-CE2 3.48Å; P324-F332 HydrophobicContact CB-CG 3.97Å; P324-F332 HydrophobicContact CB-CZ 3.66Å; P324-F332 HydrophobicContact CG-CE2 4.16Å; P324-F332 HydrophobicContact CG-CZ 4.05Å; F325-F332 HydrophobicContact CB-CD1 3.88Å; F325-F332 HydrophobicContact CD2-CB 4.29Å; F325-F332 HydrophobicContact CD2-CD1 4.43Å; G329-F332 WeakPolarHBondContact O-CB 3.38Å; G329-F332 PolarHBondContact O-N 3.21Å; D330-F332 PolarHBondContact O-N 3.5Å; F332-Q334 PolarHBondContact O-N 3.3Å; F332-Q334 PolarHBondContact O-NE2 2.73Å; F332-V344 HydrophobicContact CD2-CB 4.04Å; F332-V344 HydrophobicContact CD2-CG1 3.84Å; F332-V344 HydrophobicContact CE2-CG1 4.33Å; F332-V346 HydrophobicContact CD2-CG2 3.92Å; F332-V346 HydrophobicContact CE2-CG2 3.43Å; F332-V346 VanDerWaalsContact CE2-CG2 3.43Å; F332-V346 HydrophobicContact CZ-CG2 4.13Å
333	D	81.6	Confident	83.5	Confident	31 Å²	31	51.8 Å²	51.8	17%	0.166	26%	0.259	C	S	.	.			trans	-66.3	118.8	177.3	-159.5	-1	0	0	0	109	D330 I335 H343	D330-D333 WeakPolarHBondContact O-CB 3.46Å; D330-D333 PolarHBondContact O-N 3.43Å; D333-I335 PolarHBondContact O-N 3.12Å; D333-I335 VanDerWaalsContact O-N 3.16Å; D333-I335 WeakPolarHBondContact OD1-CG1 3.36Å; D333-H343 PolarHBondContact O-CD2 2.87Å
334	Q	78.6	Confident	83.3	Confident	18 Å²	18	51.8 Å²	51.8	8%	0.084	26%	0.259	C	S	.	.			trans	-85.9	24.1	-175.2	-57.3	-64.2	-72	0	0	111.7	I309 N311 F332 V344 V346	I309-Q334 HydrophobicContact CB-CB 4.45Å; I309-Q334 HydrophobicContact CB-CG 4.37Å; I309-Q334 HydrophobicContact CD1-CG 3.85Å; N311-Q334 PolarHBondContact ND2-O 3.18Å; F332-Q334 PolarHBondContact O-N 3.3Å; F332-Q334 PolarHBondContact O-NE2 2.73Å; Q334-V344 PolarHBondContact NE2-O 3.38Å; Q334-V346 HydrophobicContact CG-CB 4.32Å; Q334-V346 HydrophobicContact CG-CG2 4.25Å; Q334-V346 VanDerWaalsContact NE2-CG2 3.35Å
335	I	74.5	Confident	83.1	Confident	89 Å²	89	52 Å²	52	46%	0.456	26%	0.26	S	S	.	.			trans	-98.6	94.7	176.9	-57.5	174.1	0	0	0	107.6	T316 D333	T316-I335 HydrophobicContact CG2-CD1 3.77Å; T316-I335 HydrophobicContact CG2-CG1 4.1Å; D333-I335 PolarHBondContact O-N 3.12Å; D333-I335 VanDerWaalsContact O-N 3.16Å; D333-I335 WeakPolarHBondContact OD1-CG1 3.36Å
336	H	68.8	Low	83	Confident	53 Å²	53	51.8 Å²	51.8	25%	0.245	26%	0.26	C	S	.	.			trans	-135.8	137.2	175.4	53.6	70.9	0	0	0	111.2	D234 T340	D234-H336 IonicContact OD1-CE1 2.85Å; H336-T340 VanDerWaalsContact CE1-CG2 3.42Å; H336-T340 WeakPolarHBondContact CE1-CG2 3.44Å
337	D	61	Low	82.8	Confident	157 Å²	157	52.4 Å²	52.4	84%	0.84	26%	0.262	S	S	*	.	S	Bend	trans	-78.2	-29.3	-172.1	-76.1	-25.7	0	0	0	113.3
338	Q	58.8	Low	82.5	Confident	188 Å²	188	51.5 Å²	51.5	88%	0.879	26%	0.257	S	S	*	.	S	Bend	trans	-155.1	-14.3	-168.3	-62.5	-176.5	0.4	0	0	116.4
339	S	70.6	Confident	82.5	Confident	58 Å²	58	50.6 Å²	50.6	41%	0.406	25%	0.254	S	S	.	.			trans	-144.5	130.4	-176.5	-176.9	0	0	0	0	110.9	E341	S339-E341 WeakPolarHBondContact OG-CB 3.28Å; S339-E341 PolarHBondContact OG-N 3.1Å; S339-E341 VanDerWaalsContact OG-N 3.09Å
340	T	74	Confident	82.5	Confident	28 Å²	28	50.7 Å²	50.7	17%	0.172	25%	0.254	C	S	.	.			trans	-81	-4.1	169.6	55.5	0	0	0	0	112	S231 L232 D234 H336 N342 H343	S231-T340 WeakPolarHBondContact CB-O 3.48Å; S231-T340 PolarHBondContact OG-O 3.31Å; L232-T340 VanDerWaalsContact O-CB 3.28Å; L232-T340 WeakPolarHBondContact O-CB 3.37Å; L232-T340 WeakPolarHBondContact O-CG2 3.41Å; L232-T340 PolarHBondContact O-OG1 3.49Å; D234-T340 WeakPolarHBondContact OD1-CG2 3.37Å; H336-T340 VanDerWaalsContact CE1-CG2 3.42Å; H336-T340 WeakPolarHBondContact CE1-CG2 3.44Å; T340-N342 PolarHBondContact O-N 2.8Å; T340-H343 WeakPolarHBondContact O-CB 3.46Å; T340-H343 PolarHBondContact O-N 3.38Å; T340-H343 PolarHBondContact O-ND1 2.86Å
341	E	76.5	Confident	82.8	Confident	132 Å²	132	48 Å²	48	62%	0.617	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.6	133.7	-178.9	-166.2	-179.3	178.8	0	0	110.5	S339 H343	S339-E341 WeakPolarHBondContact OG-CB 3.28Å; S339-E341 PolarHBondContact OG-N 3.1Å; S339-E341 VanDerWaalsContact OG-N 3.09Å; E341-H343 PolarHBondContact O-N 2.79Å; E341-H343 PolarHBondContact O-ND1 2.82Å
342	N	81.5	Confident	82.9	Confident	99 Å²	99	44.1 Å²	44.1	53%	0.529	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	1.5	-174.3	-53.5	-58.4	0	0	0	116.1	S231 R331 T340	S231-N342 PolarHBondContact OG-N 2.94Å; S231-N342 VanDerWaalsContact OG-N 3.14Å; R331-N342 PolarHBondContact NE-O 3.2Å; R331-N342 PolarHBondContact NH2-O 3.19Å; T340-N342 PolarHBondContact O-N 2.8Å
343	H	88.9	Confident	83	Confident	40 Å²	40	44.4 Å²	44.4	19%	0.185	23%	0.227	C	C	.	.	S	Bend	trans	-86.4	151.4	172.9	-63.6	74.9	0	0	0	111.1	S231 R331 D333 T340 E341 A345	S231-H343 VanDerWaalsContact CA-O 3.29Å; S231-H343 WeakPolarHBondContact CA-O 3.24Å; S231-H343 WeakPolarHBondContact CB-O 3.44Å; S231-H343 PolarHBondContact N-O 3.38Å; S231-H343 PolarHBondContact OG-N 3.29Å; S231-H343 PolarHBondContact OG-O 3.21Å; R331-H343 CarbonylContact O-C 3.51Å; R331-H343 WeakPolarHBondContact O-CA 3.37Å; D333-H343 PolarHBondContact O-CD2 2.87Å; T340-H343 WeakPolarHBondContact O-CB 3.46Å; T340-H343 PolarHBondContact O-N 3.38Å; T340-H343 PolarHBondContact O-ND1 2.86Å; E341-H343 PolarHBondContact O-N 2.79Å; E341-H343 PolarHBondContact O-ND1 2.82Å; H343-A345 PolarHBondContact O-N 3.01Å
344	V	92.2	Very high	83.4	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-68.1	125.5	166.7	179.4	0	0	0	0	106.6	F227 S228 Y328 R331 F332 Q334 V346	F227-V344 HydrophobicContact CB-CG1 4.04Å; F227-V344 HydrophobicContact CD2-CG1 4Å; F227-V344 HydrophobicContact CG-CG1 4.36Å; S228-V344 WeakPolarHBondContact O-CG1 3.37Å; Y328-V344 HydrophobicContact CD1-CG2 4.01Å; Y328-V344 HydrophobicContact CD2-CG1 4.3Å; Y328-V344 HydrophobicContact CD2-CG2 3.63Å; Y328-V344 HydrophobicContact CE1-CG2 4.45Å; Y328-V344 HydrophobicContact CE2-CG1 4.21Å; Y328-V344 HydrophobicContact CE2-CG2 4.1Å; Y328-V344 HydrophobicContact CG-CG2 3.56Å; R331-V344 HydrophobicContact CB-CG2 4.12Å; R331-V344 PolarHBondContact O-N 2.96Å; F332-V344 HydrophobicContact CD2-CB 4.04Å; F332-V344 HydrophobicContact CD2-CG1 3.84Å; F332-V344 HydrophobicContact CE2-CG1 4.33Å; Q334-V344 PolarHBondContact NE2-O 3.38Å; V344-V346 HydrophobicContact CG1-CG2 4.45Å; V344-V346 PolarHBondContact O-N 3.01Å
345	A	91.6	Very high	83.7	Confident	4 Å²	4	43.5 Å²	43.5	3%	0.033	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	128.8	177.1	0	0	0	0	0	110.4	F227 S228 H230 L232 Y238 H343	F227-A345 WeakPolarHBondContact CA-O 3.33Å; F227-A345 WeakPolarHBondContact CB-O 3.48Å; S228-A345 PolarHBondContact N-O 2.79Å; S228-A345 VanDerWaalsContact N-O 3.1Å; S228-A345 PolarHBondContact O-N 3.46Å; H230-A345 WeakPolarHBondContact O-CB 3.46Å; H230-A345 PolarHBondContact O-N 3.37Å; H230-A345 VanDerWaalsContact O-N 3.08Å; L232-A345 HydrophobicContact CB-CB 3.74Å; L232-A345 HydrophobicContact CD1-CB 3.73Å; L232-A345 HydrophobicContact CG-CB 3.38Å; Y238-A345 WeakPolarHBondContact OH-CB 3.46Å; Y238-A345 PolarHBondContact OH-O 3.13Å; H343-A345 PolarHBondContact O-N 3.01Å
346	V	92.3	Very high	84.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	136.9	175.8	-168.7	0	0	0	0	110.1	L225 I226 F227 I309 F332 Q334 V344	L225-V346 HydrophobicContact CB-CG1 3.91Å; L225-V346 HydrophobicContact CD2-CG1 4.24Å; L225-V346 HydrophobicContact CG-CG1 4.47Å; I226-V346 CarbonylContact O-C 3.56Å; I226-V346 WeakPolarHBondContact O-CA 3.35Å; F227-V346 HydrophobicContact CB-CB 4.48Å; F227-V346 HydrophobicContact CB-CG1 4.48Å; F227-V346 HydrophobicContact CB-CG2 3.93Å; I309-V346 HydrophobicContact CD1-CB 3.87Å; I309-V346 HydrophobicContact CD1-CG1 3.37Å; I309-V346 HydrophobicContact CG1-CG1 4.17Å; F332-V346 HydrophobicContact CD2-CG2 3.92Å; F332-V346 HydrophobicContact CE2-CG2 3.43Å; F332-V346 VanDerWaalsContact CE2-CG2 3.43Å; F332-V346 HydrophobicContact CZ-CG2 4.13Å; Q334-V346 HydrophobicContact CG-CB 4.32Å; Q334-V346 HydrophobicContact CG-CG2 4.25Å; Q334-V346 VanDerWaalsContact NE2-CG2 3.35Å; V344-V346 HydrophobicContact CG1-CG2 4.45Å; V344-V346 PolarHBondContact O-N 3.01Å
347	R	91.4	Very high	84.7	Confident	13 Å²	13	47.2 Å²	47.2	5%	0.049	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	132	173.4	-65.5	-65.5	179.8	-94.5	3.5	109.9	L225 I226 L232 M233 S236 Y238 R307	L225-R347 CarbonylContact C-O 3.59Å; L225-R347 WeakPolarHBondContact CA-O 3.39Å; I226-R347 PolarHBondContact N-O 3.5Å; I226-R347 PolarHBondContact O-N 3.26Å; L232-R347 HydrophobicContact CD1-CG 4.33Å; M233-R347 PolarHBondContact O-NH2 3.04Å; S236-R347 PolarHBondContact O-NE 3.46Å; S236-R347 VanDerWaalsContact O-NE 3.13Å; S236-R347 PolarHBondContact O-NH2 2.96Å; Y238-R347 HydrophobicContact CD2-CB 4.28Å; Y238-R347 HydrophobicContact CD2-CG 4.02Å; Y238-R347 HydrophobicContact CE2-CB 4Å; Y238-R347 HydrophobicContact CE2-CG 3.74Å; R307-R347 CarbonylContact O-C 3.54Å; R307-R347 WeakPolarHBondContact O-CA 3.46Å
348	E	91.8	Very high	85.3	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	123.7	168.3	-172.5	174.8	-127.9	0	0	108.6	H110 R111 V223 L224 L225 A306 R307	H110-E348 IonicContact CE1-OE1 3.74Å; H110-E348 IonicContact ND1-OE1 3.58Å; H110-E348 PolarHBondContact ND1-OE1 2.93Å; R111-E348 IonicContact CZ-OE1 3.01Å; R111-E348 VanDerWaalsContact CZ-OE1 3.3Å; R111-E348 IonicContact NE-OE1 3.54Å; R111-E348 PolarHBondContact NE-OE1 3.28Å; R111-E348 VanDerWaalsContact NH2-CD 3.34Å; R111-E348 IonicContact NH2-OE1 3.05Å; R111-E348 PolarHBondContact NH2-OE1 2.96Å; R111-E348 IonicContact NH2-OE2 3.59Å; R111-E348 PolarHBondContact NH2-OE2 3.1Å; V223-E348 HydrophobicContact CG1-CG 3.31Å; V223-E348 WeakPolarHBondContact CG1-OE1 3.26Å; L224-E348 WeakPolarHBondContact O-CA 3.2Å; L225-E348 HydrophobicContact CD2-CB 3.81Å; L225-E348 HydrophobicContact CD2-CG 4.13Å; A306-E348 CarbonylContact C-O 3.59Å; A306-E348 VanDerWaalsContact CA-O 3.28Å; A306-E348 WeakPolarHBondContact CA-O 3.41Å; R307-E348 HydrophobicContact CG-CB 4.19Å; R307-E348 IonicContact CZ-OE2 2.73Å; R307-E348 VanDerWaalsContact CZ-OE2 3.25Å; R307-E348 PolarHBondContact N-O 3.2Å; R307-E348 IonicContact NE-OE2 2.59Å; R307-E348 PolarHBondContact NE-OE2 2.77Å; R307-E348 IonicContact NH2-OE2 3.79Å; R307-E348 PolarHBondContact NH2-OE2 3.2Å; R307-E348 PolarHBondContact O-N 3.35Å
349	Q	94.2	Very high	86	Confident	5 Å²	5	39 Å²	39	2%	0.023	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	116.4	178.4	177.5	64.6	71.6	0	0	109.7	V223 L224 I226 I261 L303 G304 I351	V223-Q349 WeakPolarHBondContact CA-O 3.36Å; L224-Q349 PolarHBondContact N-O 2.8Å; L224-Q349 PolarHBondContact O-N 3.04Å; I226-Q349 HydrophobicContact CD1-CB 3.46Å; I226-Q349 VanDerWaalsContact CD1-CB 3.46Å; I226-Q349 HydrophobicContact CD1-CG 3.84Å; I226-Q349 HydrophobicContact CG1-CB 4.17Å; I261-Q349 HydrophobicContact CD1-CG 4.3Å; L303-Q349 HydrophobicContact CD2-CG 4.38Å; G304-Q349 PolarHBondContact O-NE2 3.08Å; Q349-I351 HydrophobicContact CG-CD1 3.85Å
350	I	93.9	Very high	86.1	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	139.4	172.6	-61.5	178.4	0	0	0	109.1	A124 D126 S221 V223 G304 T305	A124-I350 HydrophobicContact CB-CG2 3.94Å; D126-I350 WeakPolarHBondContact OD1-CD1 3.47Å; S221-I350 WeakPolarHBondContact OG-CG2 3.3Å; V223-I350 HydrophobicContact CG1-CG1 4.36Å; V223-I350 HydrophobicContact CG2-CG1 4.15Å; G304-I350 WeakPolarHBondContact CA-O 3.25Å; G304-I350 PolarHBondContact N-O 3.48Å; T305-I350 PolarHBondContact O-N 2.96Å; T305-I350 VanDerWaalsContact O-N 3.09Å
351	I	95.1	Very high	86.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	115	175	-52.1	-64.2	0	0	0	109.2	S221 P222 F285 V301 L303 Q349 L353 W370	S221-I351 WeakPolarHBondContact CB-O 3.35Å; S221-I351 PolarHBondContact OG-O 3.27Å; P222-I351 WeakPolarHBondContact CD-O 3.47Å; P222-I351 HydrophobicContact CG-CB 4.01Å; P222-I351 HydrophobicContact CG-CG2 4.45Å; P222-I351 PolarHBondContact O-N 2.84Å; F285-I351 HydrophobicContact CD1-CD1 4.36Å; F285-I351 HydrophobicContact CE1-CD1 3.99Å; F285-I351 HydrophobicContact CZ-CD1 4.25Å; V301-I351 HydrophobicContact CG1-CG2 3.83Å; L303-I351 HydrophobicContact CD2-CD1 3.66Å; Q349-I351 HydrophobicContact CG-CD1 3.85Å; I351-L353 HydrophobicContact CG2-CD2 4.02Å; I351-W370 HydrophobicContact CB-CH2 4.25Å; I351-W370 HydrophobicContact CB-CZ2 4.25Å; I351-W370 HydrophobicContact CD1-CH2 4.34Å; I351-W370 HydrophobicContact CD1-CZ2 4.26Å; I351-W370 HydrophobicContact CG1-CH2 3.66Å; I351-W370 HydrophobicContact CG1-CZ2 3.89Å; I351-W370 HydrophobicContact CG1-CZ3 4.47Å; I351-W370 HydrophobicContact CG2-CH2 4.12Å; I351-W370 HydrophobicContact CG2-CZ2 3.63Å
352	N	93.5	Very high	86.8	Confident	8 Å²	8	33.8 Å²	33.8	4%	0.043	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	119.5	179.9	-70	-39.7	0	0	0	109.7	T122 A124 R302 G304	T122-N352 WeakPolarHBondContact O-CB 3.18Å; A124-N352 PolarHBondContact N-OD1 2.93Å; R302-N352 HydrophobicContact CB-CB 4.21Å; R302-N352 PolarHBondContact N-O 2.93Å; R302-N352 PolarHBondContact O-N 2.72Å; G304-N352 VanDerWaalsContact CA-ND2 3.28Å; G304-N352 WeakPolarHBondContact CA-ND2 3.47Å
353	L	92.7	Very high	86.9	Confident	6 Å²	6	30.4 Å²	30.4	3%	0.031	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	104.8	177.4	-59.3	-176	0	0	0	109.1	P222 Y289 V301 I351 W370	P222-L353 HydrophobicContact CG-CD1 4.28Å; Y289-L353 HydrophobicContact CD1-CB 4.14Å; Y289-L353 HydrophobicContact CD1-CD2 3.98Å; Y289-L353 HydrophobicContact CE1-CB 3.68Å; Y289-L353 HydrophobicContact CE1-CD2 4.4Å; Y289-L353 HydrophobicContact CE2-CB 4.31Å; Y289-L353 HydrophobicContact CG-CD2 4.16Å; V301-L353 HydrophobicContact CG1-CD2 4.46Å; V301-L353 HydrophobicContact CG2-CD2 4.01Å; I351-L353 HydrophobicContact CG2-CD2 4.02Å; L353-W370 HydrophobicContact CD1-CB 4.4Å; L353-W370 HydrophobicContact CD2-CB 4.22Å; L353-W370 HydrophobicContact CD2-CD2 4.44Å; L353-W370 HydrophobicContact CD2-CG 3.96Å
354	G	89	Confident	86.7	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.01	17%	0.17	C	C	.	.	S	Bend	trans	142.9	159.8	175.9	0	0	0	0	0	113.5	T122 L300 R302	T122-G354 PolarHBondContact OG1-O 3.44Å; T122-G354 VanDerWaalsContact OG1-O 3.08Å; L300-G354 CarbonylContact O-C 3.56Å; L300-G354 PolarHBondContact O-N 2.83Å; R302-G354 PolarHBondContact NE-O 2.96Å; R302-G354 PolarHBondContact NH2-O 3.34Å
355	S	85.1	Confident	86.6	Confident	29 Å²	29	36 Å²	36	20%	0.203	18%	0.183	C	C	.	.			trans	-95.7	139	173.6	-47.3	0	0	0	0	109.7	T122 Q299 L300 S358	T122-S355 PolarHBondContact OG1-O 2.84Å; Q299-S355 PolarHBondContact OE1-OG 3.03Å; L300-S355 WeakPolarHBondContact CB-OG 3.42Å; L300-S355 PolarHBondContact N-OG 3.07Å; S355-S358 WeakPolarHBondContact O-CB 2.99Å; S355-S358 PolarHBondContact O-N 3.43Å; S355-S358 PolarHBondContact O-OG 3.02Å
356	P	83.8	Confident	86.6	Confident	56 Å²	56	38.8 Å²	38.8	36%	0.364	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	142.5	172	-25.3	34.7	0	0	0	112.1	G120 S358	G120-P356 CarbonylContact O-C 3.59Å; P356-S358 PolarHBondContact O-N 2.93Å
357	H	80.4	Confident	86.7	Confident	164 Å²	164	39.8 Å²	39.8	76%	0.759	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.7	14.7	-179.7	-46.4	-60	0	0	0	114.8	G120	G120-H357 WeakPolarHBondContact O-CA 3.46Å; G120-H357 PolarHBondContact O-N 3.47Å
358	S	74.8	Confident	86.9	Confident	23 Å²	23	39.4 Å²	39.4	16%	0.161	20%	0.201	C	C	.	.			trans	-87.1	163.8	175.6	78.9	0	0	0	0	111.4	S355 P356	S355-S358 WeakPolarHBondContact O-CB 2.99Å; S355-S358 PolarHBondContact O-N 3.43Å; S355-S358 PolarHBondContact O-OG 3.02Å; P356-S358 PolarHBondContact O-N 2.93Å
359	K	72.2	Confident	87.1	Confident	151 Å²	151	39.4 Å²	39.4	66%	0.657	20%	0.201	S	C	*	.			trans	-64.2	154.9	178	-69.6	-179.5	178.3	179.1	0	110.6	Y361	K359-Y361 VanDerWaalsContact C-N 3.28Å; K359-Y361 HydrophobicContact CB-CE1 4.25Å; K359-Y361 HydrophobicContact CB-CE2 4.35Å; K359-Y361 WeakPolarHBondContact O-CD2 3.16Å; K359-Y361 VanDerWaalsContact O-CE2 3.28Å; K359-Y361 WeakPolarHBondContact O-CE2 3.02Å; K359-Y361 PolarHBondContact O-N 2.89Å
360	H	73.8	Confident	87.1	Confident	48 Å²	48	39.2 Å²	39.2	22%	0.222	20%	0.2	C	C	.	.			trans	-70.6	82.9	171.9	-51.1	-65.2	0	0	0	110.2	D117 N217 Y362 N364	D117-H360 PolarHBondContact O-CE1 3.04Å; N217-H360 VanDerWaalsContact CB-CD2 3.46Å; N217-H360 WeakPolarHBondContact CB-CD2 3.24Å; N217-H360 VanDerWaalsContact CB-NE2 3.33Å; N217-H360 WeakPolarHBondContact CB-NE2 3.37Å; H360-Y362 PolarHBondContact O-N 3.42Å; H360-N364 PolarHBondContact O-ND2 2.93Å
361	Y	77.7	Confident	87.1	Confident	53 Å²	53	39.3 Å²	39.3	21%	0.208	20%	0.201	C	C	.	.	H	α-helix	trans	-67.1	-37.7	-169.9	-70.1	-75.7	0	0	0	113.3	I291 Q299 K359 T363 N364 T365	I291-Y361 HydrophobicContact CD1-CD1 3.27Å; I291-Y361 HydrophobicContact CD1-CD2 4.42Å; I291-Y361 HydrophobicContact CD1-CE1 3.9Å; I291-Y361 HydrophobicContact CD1-CG 3.58Å; Q299-Y361 HydrophobicContact CG-CD2 3.52Å; Q299-Y361 HydrophobicContact CG-CE2 3.75Å; Q299-Y361 HydrophobicContact CG-CG 4.16Å; Q299-Y361 VanDerWaalsContact NE2-CZ 3.26Å; Q299-Y361 PolarHBondContact NE2-OH 2.93Å; K359-Y361 VanDerWaalsContact C-N 3.28Å; K359-Y361 HydrophobicContact CB-CE1 4.25Å; K359-Y361 HydrophobicContact CB-CE2 4.35Å; K359-Y361 WeakPolarHBondContact O-CD2 3.16Å; K359-Y361 VanDerWaalsContact O-CE2 3.28Å; K359-Y361 WeakPolarHBondContact O-CE2 3.02Å; K359-Y361 PolarHBondContact O-N 2.89Å; Y361-T363 VanDerWaalsContact C-N 3.33Å; Y361-T363 PolarHBondContact O-N 2.81Å; Y361-N364 WeakPolarHBondContact O-CA 2.86Å; Y361-N364 WeakPolarHBondContact O-CB 3.48Å; Y361-N364 PolarHBondContact O-N 2.88Å; Y361-T365 PolarHBondContact O-N 3.17Å; Y361-T365 PolarHBondContact O-OG1 3.25Å; Y361-T365 VanDerWaalsContact O-OG1 3.14Å
362	Y	86.2	Confident	87	Confident	6 Å²	6	39.5 Å²	39.5	2%	0.024	20%	0.201	C	C	.	.	H	α-helix	trans	-58.5	-47.1	-179.8	-167.7	-85.9	0	0	0	111.2	L208 V211 V213 F220 H360 N364 T365 N366 S368	L208-Y362 HydrophobicContact CB-CE2 3.74Å; L208-Y362 HydrophobicContact CD1-CE2 4.47Å; L208-Y362 WeakPolarHBondContact O-CE2 3.41Å; L208-Y362 PolarHBondContact O-OH 2.91Å; V211-Y362 WeakPolarHBondContact CB-OH 3.21Å; V211-Y362 PolarHBondContact N-OH 2.88Å; V213-Y362 HydrophobicContact CG1-CD1 3.79Å; V213-Y362 HydrophobicContact CG1-CE1 4.03Å; F220-Y362 AromaticContact CD2-CD1 3.54Å; F220-Y362 HydrophobicContact CD2-CD1 3.54Å; F220-Y362 AromaticContact CD2-CD2 3.98Å; F220-Y362 HydrophobicContact CD2-CD2 3.98Å; F220-Y362 AromaticContact CD2-CE1 3.73Å; F220-Y362 HydrophobicContact CD2-CE1 3.73Å; F220-Y362 HydrophobicContact CD2-CE2 4.17Å; F220-Y362 AromaticContact CD2-CG 3.66Å; F220-Y362 HydrophobicContact CD2-CG 3.66Å; F220-Y362 AromaticContact CE2-CD1 3.28Å; F220-Y362 HydrophobicContact CE2-CD1 3.28Å; F220-Y362 HydrophobicContact CE2-CD2 4.46Å; F220-Y362 AromaticContact CE2-CE1 3.22Å; F220-Y362 HydrophobicContact CE2-CE1 3.22Å; F220-Y362 HydrophobicContact CE2-CE2 4.43Å; F220-Y362 AromaticContact CE2-CG 3.93Å; F220-Y362 HydrophobicContact CE2-CG 3.93Å; F220-Y362 AromaticContact CE2-CZ 3.85Å; F220-Y362 HydrophobicContact CZ-CD1 4.46Å; F220-Y362 HydrophobicContact CZ-CE1 4.07Å; H360-Y362 PolarHBondContact O-N 3.42Å; Y362-N364 PolarHBondContact O-N 3.28Å; Y362-N364 VanDerWaalsContact O-N 3.17Å; Y362-T365 PolarHBondContact O-N 3.2Å; Y362-N366 WeakPolarHBondContact O-CA 3.21Å; Y362-N366 PolarHBondContact O-N 2.9Å; Y362-S368 WeakPolarHBondContact CE2-OG 3.26Å
363	T	84.2	Confident	87	Confident	29 Å²	29	39.1 Å²	39.1	18%	0.178	20%	0.2	C	C	.	.	H	α-helix	trans	-59.6	-29.6	176.5	-40	0	0	0	0	113.1	V213 S216 D218 Y361	V213-T363 HydrophobicContact CG2-CG2 4.16Å; S216-T363 VanDerWaalsContact O-CB 3.29Å; S216-T363 WeakPolarHBondContact O-CB 3.16Å; S216-T363 VanDerWaalsContact O-CG2 3.3Å; S216-T363 WeakPolarHBondContact O-CG2 3.4Å; S216-T363 PolarHBondContact O-OG1 2.93Å; D218-T363 PolarHBondContact O-OG1 3.39Å; Y361-T363 VanDerWaalsContact C-N 3.33Å; Y361-T363 PolarHBondContact O-N 2.81Å
364	N	84.8	Confident	87.1	Confident	109 Å²	109	38.9 Å²	38.9	58%	0.583	20%	0.198	S	C	*	.	H	α-helix	trans	-79.8	-34.6	-178.7	-64.8	-35.5	0	0	0	112.5	H360 Y361 Y362	H360-N364 PolarHBondContact O-ND2 2.93Å; Y361-N364 WeakPolarHBondContact O-CA 2.86Å; Y361-N364 WeakPolarHBondContact O-CB 3.48Å; Y361-N364 PolarHBondContact O-N 2.88Å; Y362-N364 PolarHBondContact O-N 3.28Å; Y362-N364 VanDerWaalsContact O-N 3.17Å
365	T	89.3	Confident	87.3	Confident	47 Å²	47	38.9 Å²	38.9	29%	0.288	20%	0.198	S	C	.	.	H	α-helix	trans	-108.2	-17.3	-173.5	62.7	0	0	0	0	113.4	I291 Y361 Y362 Y367	I291-T365 WeakPolarHBondContact O-CB 3.28Å; I291-T365 VanDerWaalsContact O-CG2 3.26Å; I291-T365 WeakPolarHBondContact O-CG2 3.44Å; I291-T365 PolarHBondContact O-OG1 3.42Å; Y361-T365 PolarHBondContact O-N 3.17Å; Y361-T365 PolarHBondContact O-OG1 3.25Å; Y361-T365 VanDerWaalsContact O-OG1 3.14Å; Y362-T365 PolarHBondContact O-N 3.2Å; T365-Y367 PolarHBondContact O-N 3.18Å; T365-Y367 PolarHBondContact OG1-N 3.38Å; T365-Y367 PolarHBondContact OG1-O 3.35Å; T365-Y367 VanDerWaalsContact OG1-O 3.11Å
366	N	92.6	Very high	87.6	Confident	63 Å²	63	38.1 Å²	38.1	34%	0.337	19%	0.192	S	C	.	.	S	Bend	trans	49.1	32.2	-166	-70.6	-32.9	0	0	0	112.5	K210 Y362	K210-N366 HydrophobicContact CG-CB 4.16Å; K210-N366 PolarHBondContact N-O 2.86Å; Y362-N366 WeakPolarHBondContact O-CA 3.21Å; Y362-N366 PolarHBondContact O-N 2.9Å
367	Y	94.9	Very high	87.8	Confident	22 Å²	22	36.5 Å²	36.5	9%	0.086	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	137.7	-173.9	-172.9	-89	0	0	0	111.7	T207 L208 D209 D292 P293 T365 S369	T207-Y367 HydrophobicContact CG2-CD2 4.28Å; T207-Y367 HydrophobicContact CG2-CE2 3.44Å; T207-Y367 VanDerWaalsContact CG2-CE2 3.44Å; L208-Y367 CarbonylContact O-C 3.51Å; L208-Y367 VanDerWaalsContact O-CA 3.3Å; L208-Y367 WeakPolarHBondContact O-CA 3.19Å; D209-Y367 HydrophobicContact CB-CD2 4.07Å; D209-Y367 HydrophobicContact CB-CE2 4.38Å; D292-Y367 VanDerWaalsContact O-CE1 3.25Å; D292-Y367 WeakPolarHBondContact O-CE1 3.3Å; P293-Y367 HydrophobicContact CB-CD2 4.29Å; P293-Y367 HydrophobicContact CB-CE2 4.11Å; P293-Y367 HydrophobicContact CG-CD1 4.45Å; P293-Y367 HydrophobicContact CG-CD2 3.76Å; P293-Y367 HydrophobicContact CG-CE2 4.09Å; P293-Y367 HydrophobicContact CG-CG 3.94Å; T365-Y367 PolarHBondContact O-N 3.18Å; T365-Y367 PolarHBondContact OG1-N 3.38Å; T365-Y367 PolarHBondContact OG1-O 3.35Å; T365-Y367 VanDerWaalsContact OG1-O 3.11Å; Y367-S369 WeakPolarHBondContact OH-CB 3.39Å
368	S	94.8	Very high	88	Confident	5 Å²	5	31.5 Å²	31.5	4%	0.035	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	140.2	160.4	57	0	0	0	0	110	T207 L208 W290 Y362	T207-S368 CarbonylContact C-O 3.59Å; T207-S368 VanDerWaalsContact CA-O 3.29Å; T207-S368 WeakPolarHBondContact CA-O 3.28Å; L208-S368 PolarHBondContact N-O 2.82Å; L208-S368 PolarHBondContact O-N 2.86Å; W290-S368 CarbonylContact O-C 3.53Å; W290-S368 VanDerWaalsContact O-CA 3.3Å; W290-S368 WeakPolarHBondContact O-CA 3.2Å; Y362-S368 WeakPolarHBondContact CE2-OG 3.26Å
369	S	95.4	Very high	88.2	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	119.1	167.6	-164.8	0	0	0	0	110.1	E205 L206 T207 Y289 W290 Y367	E205-S369 WeakPolarHBondContact CG-OG 3.39Å; E205-S369 PolarHBondContact OE1-OG 3.39Å; L206-S369 WeakPolarHBondContact O-CA 3.3Å; T207-S369 PolarHBondContact OG1-OG 3.38Å; Y289-S369 WeakPolarHBondContact CB-O 3.41Å; W290-S369 PolarHBondContact N-O 3.17Å; W290-S369 PolarHBondContact O-N 3.31Å; Y367-S369 WeakPolarHBondContact OH-CB 3.39Å
370	W	94.6	Very high	88.5	Confident	2 Å²	2	27 Å²	27	1%	0.008	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	130.2	-178.9	169.3	57.5	0	0	0	110.4	E205 L206 P222 L224 F285 I351 L353 F372	E205-W370 CarbonylContact C-O 3.59Å; E205-W370 WeakPolarHBondContact CA-O 3.43Å; L206-W370 HydrophobicContact CB-CE3 4.24Å; L206-W370 HydrophobicContact CD2-CE3 4.28Å; L206-W370 PolarHBondContact N-O 3.08Å; L206-W370 PolarHBondContact O-N 2.8Å; P222-W370 HydrophobicContact CB-CE3 4.35Å; P222-W370 HydrophobicContact CB-CZ3 4.03Å; P222-W370 HydrophobicContact CG-CD2 4.38Å; P222-W370 HydrophobicContact CG-CE3 3.58Å; P222-W370 HydrophobicContact CG-CH2 4.32Å; P222-W370 HydrophobicContact CG-CZ3 3.56Å; L224-W370 HydrophobicContact CD1-CH2 4Å; F285-W370 HydrophobicContact CD1-CH2 4.33Å; F285-W370 AromaticContact CD1-CZ2 3.54Å; F285-W370 HydrophobicContact CD1-CZ2 3.54Å; F285-W370 HydrophobicContact CE1-CH2 4.13Å; F285-W370 AromaticContact CE1-CZ2 3.8Å; F285-W370 HydrophobicContact CE1-CZ2 3.8Å; I351-W370 HydrophobicContact CB-CH2 4.25Å; I351-W370 HydrophobicContact CB-CZ2 4.25Å; I351-W370 HydrophobicContact CD1-CH2 4.34Å; I351-W370 HydrophobicContact CD1-CZ2 4.26Å; I351-W370 HydrophobicContact CG1-CH2 3.66Å; I351-W370 HydrophobicContact CG1-CZ2 3.89Å; I351-W370 HydrophobicContact CG1-CZ3 4.47Å; I351-W370 HydrophobicContact CG2-CH2 4.12Å; I351-W370 HydrophobicContact CG2-CZ2 3.63Å; L353-W370 HydrophobicContact CD1-CB 4.4Å; L353-W370 HydrophobicContact CD2-CB 4.22Å; L353-W370 HydrophobicContact CD2-CD2 4.44Å; L353-W370 HydrophobicContact CD2-CG 3.96Å; W370-F372 HydrophobicContact CD2-CD1 4.06Å; W370-F372 AromaticContact CE2-CD1 3.91Å; W370-F372 AromaticContact CE3-CD1 3.81Å; W370-F372 HydrophobicContact CE3-CD1 3.81Å; W370-F372 HydrophobicContact CE3-CE1 4.05Å; W370-F372 HydrophobicContact CH2-CB 4.38Å; W370-F372 AromaticContact CH2-CD1 3.32Å; W370-F372 HydrophobicContact CH2-CD1 3.32Å; W370-F372 AromaticContact CH2-CE1 3.63Å; W370-F372 HydrophobicContact CH2-CE1 3.63Å; W370-F372 AromaticContact CH2-CG 3.88Å; W370-F372 HydrophobicContact CH2-CG 3.88Å; W370-F372 HydrophobicContact CH2-CZ 4.4Å; W370-F372 HydrophobicContact CZ2-CB 3.88Å; W370-F372 AromaticContact CZ2-CD1 3.6Å; W370-F372 HydrophobicContact CZ2-CD1 3.6Å; W370-F372 HydrophobicContact CZ2-CE1 4.36Å; W370-F372 AromaticContact CZ2-CG 3.89Å; W370-F372 HydrophobicContact CZ2-CG 3.89Å; W370-F372 AromaticContact CZ3-CD1 3.44Å; W370-F372 HydrophobicContact CZ3-CD1 3.44Å; W370-F372 VanDerWaalsContact CZ3-CD1 3.44Å; W370-F372 AromaticContact CZ3-CE1 3.44Å; W370-F372 HydrophobicContact CZ3-CE1 3.44Å; W370-F372 VanDerWaalsContact CZ3-CE1 3.44Å; W370-F372 HydrophobicContact CZ3-CG 4.42Å; W370-F372 HydrophobicContact CZ3-CZ 4.43Å
371	I	93.4	Very high	88.6	Confident	3 Å²	3	26.3 Å²	26.3	2%	0.015	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	141.8	-179.2	-65	177.9	0	0	0	108.9	M192 Y194 L203 I204 E205 P286	M192-I371 HydrophobicContact CE-CD1 4Å; M192-I371 HydrophobicContact SD-CD1 4.32Å; Y194-I371 HydrophobicContact CE1-CG2 3.97Å; L203-I371 HydrophobicContact CD1-CG2 3.57Å; L203-I371 HydrophobicContact CD2-CG2 4.4Å; L203-I371 HydrophobicContact CG-CG2 3.66Å; I204-I371 CarbonylContact O-C 3.54Å; I204-I371 VanDerWaalsContact O-CA 3.3Å; I204-I371 WeakPolarHBondContact O-CA 3.3Å; E205-I371 HydrophobicContact CB-CG1 4.03Å; E205-I371 HydrophobicContact CG-CD1 4.49Å; E205-I371 HydrophobicContact CG-CG1 3.85Å; P286-I371 VanDerWaalsContact CD-O 3.26Å; P286-I371 WeakPolarHBondContact CD-O 3.45Å; P286-I371 HydrophobicContact CG-CG2 4.5Å
372	F	94.3	Very high	88.2	Confident	4 Å²	4	25.9 Å²	25.9	2%	0.018	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	162.1	166.5	66.7	-81.9	0	0	0	110.6	L107 I204 L224 Q284 F285 W370	L107-F372 HydrophobicContact CD1-CE2 4.41Å; L107-F372 HydrophobicContact CD1-CZ 4.23Å; L107-F372 HydrophobicContact CD2-CE2 3.59Å; L107-F372 HydrophobicContact CD2-CZ 4.23Å; I204-F372 HydrophobicContact CB-CD1 4.14Å; I204-F372 HydrophobicContact CB-CD2 4.31Å; I204-F372 HydrophobicContact CB-CE1 3.72Å; I204-F372 HydrophobicContact CB-CE2 3.89Å; I204-F372 HydrophobicContact CB-CG 4.42Å; I204-F372 HydrophobicContact CB-CZ 3.59Å; I204-F372 HydrophobicContact CD1-CD2 4.05Å; I204-F372 HydrophobicContact CD1-CE2 3.7Å; I204-F372 HydrophobicContact CD1-CZ 4.23Å; I204-F372 HydrophobicContact CG1-CE2 4.09Å; I204-F372 HydrophobicContact CG1-CZ 4.1Å; I204-F372 HydrophobicContact CG2-CD1 4.33Å; I204-F372 HydrophobicContact CG2-CE1 3.5Å; I204-F372 VanDerWaalsContact CG2-CE1 3.5Å; I204-F372 HydrophobicContact CG2-CE2 4.27Å; I204-F372 HydrophobicContact CG2-CZ 3.47Å; I204-F372 VanDerWaalsContact CG2-CZ 3.47Å; I204-F372 PolarHBondContact N-O 3.5Å; I204-F372 PolarHBondContact O-N 2.91Å; I204-F372 VanDerWaalsContact O-O 3.1Å; L224-F372 HydrophobicContact CD1-CE2 4.15Å; L224-F372 HydrophobicContact CD1-CZ 4.13Å; L224-F372 HydrophobicContact CD2-CZ 4.47Å; Q284-F372 WeakPolarHBondContact O-CA 3.38Å; Q284-F372 WeakPolarHBondContact O-CB 3.46Å; F285-F372 HydrophobicContact CD1-CB 3.64Å; F285-F372 HydrophobicContact CD1-CG 4.28Å; F285-F372 HydrophobicContact CE1-CB 4.03Å; F285-F372 HydrophobicContact CE1-CD2 4.17Å; F285-F372 HydrophobicContact CE1-CG 4.2Å; W370-F372 HydrophobicContact CD2-CD1 4.06Å; W370-F372 AromaticContact CE2-CD1 3.91Å; W370-F372 AromaticContact CE3-CD1 3.81Å; W370-F372 HydrophobicContact CE3-CD1 3.81Å; W370-F372 HydrophobicContact CE3-CE1 4.05Å; W370-F372 HydrophobicContact CH2-CB 4.38Å; W370-F372 AromaticContact CH2-CD1 3.32Å; W370-F372 HydrophobicContact CH2-CD1 3.32Å; W370-F372 AromaticContact CH2-CE1 3.63Å; W370-F372 HydrophobicContact CH2-CE1 3.63Å; W370-F372 AromaticContact CH2-CG 3.88Å; W370-F372 HydrophobicContact CH2-CG 3.88Å; W370-F372 HydrophobicContact CH2-CZ 4.4Å; W370-F372 HydrophobicContact CZ2-CB 3.88Å; W370-F372 AromaticContact CZ2-CD1 3.6Å; W370-F372 HydrophobicContact CZ2-CD1 3.6Å; W370-F372 HydrophobicContact CZ2-CE1 4.36Å; W370-F372 AromaticContact CZ2-CG 3.89Å; W370-F372 HydrophobicContact CZ2-CG 3.89Å; W370-F372 AromaticContact CZ3-CD1 3.44Å; W370-F372 HydrophobicContact CZ3-CD1 3.44Å; W370-F372 VanDerWaalsContact CZ3-CD1 3.44Å; W370-F372 AromaticContact CZ3-CE1 3.44Å; W370-F372 HydrophobicContact CZ3-CE1 3.44Å; W370-F372 VanDerWaalsContact CZ3-CE1 3.44Å; W370-F372 HydrophobicContact CZ3-CG 4.42Å; W370-F372 HydrophobicContact CZ3-CZ 4.43Å
373	I	93.3	Very high	87	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	136.2	-174	-60.5	162.5	0	0	0	108.6	Y194 I196 I202 L203 Y282 L283 Q284	Y194-I373 HydrophobicContact CD1-CD1 4.07Å; Y194-I373 HydrophobicContact CD2-CD1 3.65Å; Y194-I373 HydrophobicContact CE2-CD1 4.41Å; Y194-I373 HydrophobicContact CG-CD1 3.49Å; Y194-I373 VanDerWaalsContact CG-CD1 3.49Å; I196-I373 HydrophobicContact CG1-CD1 4.45Å; I202-I373 WeakPolarHBondContact O-CA 3.24Å; L203-I373 HydrophobicContact CB-CG1 4.06Å; Y282-I373 HydrophobicContact CE2-CG2 4.27Å; L283-I373 CarbonylContact C-O 3.6Å; L283-I373 VanDerWaalsContact CA-O 3.31Å; L283-I373 WeakPolarHBondContact CA-O 3.43Å; Q284-I373 HydrophobicContact CB-CB 4.24Å; Q284-I373 PolarHBondContact N-O 3.33Å; Q284-I373 PolarHBondContact O-N 2.9Å
374	A	95.6	Very high	85.6	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	133.4	165.8	0	0	0	0	0	109.3	L66 L68 S201 I202 I204 Y282 L283	L66-A374 HydrophobicContact CD2-CB 4.1Å; L68-A374 HydrophobicContact CD1-CB 4.05Å; L68-A374 HydrophobicContact CD2-CB 4.33Å; S201-A374 CarbonylContact C-O 3.55Å; S201-A374 VanDerWaalsContact CA-O 3.28Å; S201-A374 WeakPolarHBondContact CA-O 3.5Å; I202-A374 HydrophobicContact CG2-CB 3.91Å; I202-A374 WeakPolarHBondContact CG2-O 3.36Å; I202-A374 PolarHBondContact N-O 2.95Å; I202-A374 PolarHBondContact O-N 2.96Å; I202-A374 VanDerWaalsContact O-N 3.08Å; I204-A374 HydrophobicContact CD1-CB 3.99Å; Y282-A374 WeakPolarHBondContact O-CA 3.28Å; L283-A374 HydrophobicContact CD2-CB 3.53Å
375	G	92.8	Very high	83.8	Confident	1 Å²	1	33 Å²	33	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	160.7	-178.5	0	0	0	0	0	113.4	L200 A281 Y282	L200-G375 WeakPolarHBondContact O-CA 3.08Å; A281-G375 CarbonylContact C-O 3.6Å; A281-G375 WeakPolarHBondContact CA-O 3.32Å; A281-G375 WeakPolarHBondContact CB-O 3.44Å; Y282-G375 PolarHBondContact N-O 2.91Å; Y282-G375 PolarHBondContact O-N 3.44Å
376	I	90.9	Very high	81.7	Confident	14 Å²	14	36.3 Å²	36.3	7%	0.072	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	138.4	172.4	-68.3	-74.3	0	0	0	109.3	L52 L68 Y105 L200 P279 A281	L52-I376 HydrophobicContact CD1-CD1 4.31Å; L52-I376 HydrophobicContact CD1-CG1 3.59Å; L52-I376 HydrophobicContact CD2-CB 4.24Å; L52-I376 HydrophobicContact CD2-CG1 3.96Å; L52-I376 HydrophobicContact CG-CG1 4.43Å; L68-I376 HydrophobicContact CB-CD1 4.04Å; L68-I376 HydrophobicContact CB-CG1 4.26Å; L68-I376 HydrophobicContact CD2-CD1 4.49Å; L68-I376 HydrophobicContact CD2-CG1 4.07Å; Y105-I376 HydrophobicContact CD2-CD1 4Å; Y105-I376 HydrophobicContact CE2-CD1 4.4Å; L200-I376 PolarHBondContact O-N 3.48Å; P279-I376 HydrophobicContact CB-CG2 4.01Å; P279-I376 HydrophobicContact CG-CG2 4.21Å; A281-I376 HydrophobicContact CB-CD1 3.97Å
377	G	87.5	Confident	79.5	Confident	21 Å²	21	35.1 Å²	35.1	22%	0.216	20%	0.201	C	C	.	.	S	Bend	trans	111.6	-166.6	-176.1	0	0	0	0	0	112.3	N280	N280-G377 CarbonylContact C-O 3.57Å; N280-G377 PolarHBondContact O-N 3.16Å
378	D	84.2	Confident	77	Confident	60 Å²	60	40.6 Å²	40.6	32%	0.321	23%	0.232	S	C	.	.			trans	-93.7	136.9	169.6	-67.5	-42	0	0	0	108.1	Q262 R278 N280	Q262-D378 PolarHBondContact NE2-OD1 2.97Å; R278-D378 IonicContact CZ-OD1 3.19Å; R278-D378 IonicContact CZ-OD2 3.96Å; R278-D378 IonicContact NH1-OD1 2.68Å; R278-D378 IonicContact NH1-OD2 3.78Å; R278-D378 PolarHBondContact NH1-OD2 2.9Å; R278-D378 IonicContact NH2-OD1 2.84Å; R278-D378 IonicContact NH2-OD2 3.99Å; R278-D378 PolarHBondContact NH2-OD2 3.19Å; N280-D378 PolarHBondContact ND2-OD1 2.91Å
379	P	80.2	Confident	74.3	Confident	8 Å²	8	45.1 Å²	45.1	5%	0.052	26%	0.256	C	S	.	.			trans	-68.4	141.5	178.4	30.2	-32.9	0	0	0	109.8	F260 Q262 Y282 I381	F260-P379 HydrophobicContact CD1-CB 3.92Å; F260-P379 HydrophobicContact CD1-CG 4.2Å; F260-P379 HydrophobicContact CE1-CB 4.15Å; Q262-P379 HydrophobicContact CG-CG 4.45Å; Y282-P379 HydrophobicContact CD1-CB 4.02Å; Y282-P379 HydrophobicContact CD2-CB 3.91Å; Y282-P379 HydrophobicContact CE1-CB 4.35Å; Y282-P379 HydrophobicContact CE2-CB 4.26Å; Y282-P379 HydrophobicContact CG-CB 3.77Å; Y282-P379 HydrophobicContact CG-CG 4.19Å; P379-I381 VanDerWaalsContact C-N 3.28Å; P379-I381 HydrophobicContact CB-CG2 4.05Å; P379-I381 HydrophobicContact CG-CD1 4.44Å; P379-I381 HydrophobicContact CG-CG2 4.11Å; P379-I381 PolarHBondContact O-N 3.47Å
380	D	77.4	Confident	71.8	Confident	70 Å²	70	52.3 Å²	52.3	37%	0.374	29%	0.294	S	S	.	.			trans	-69.2	79.4	174.4	-99.8	-11.1	0	0	0	111.1	Q245 K246	Q245-D380 WeakPolarHBondContact CG-O 3.33Å; K246-D380 HydrophobicContact CB-CB 4.25Å; K246-D380 VanDerWaalsContact CB-O 3.29Å; K246-D380 WeakPolarHBondContact CB-O 3.35Å; K246-D380 PolarHBondContact N-O 3.48Å
381	I	76.7	Confident	69.2	Low	34 Å²	34	59 Å²	59	17%	0.174	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-110.5	153.2	-178.3	59.8	175.6	0	0	0	112.5	W239 T243 F260 P379	W239-I381 HydrophobicContact CH2-CD1 4.05Å; W239-I381 HydrophobicContact CZ3-CD1 4.41Å; T243-I381 HydrophobicContact CG2-CB 3.73Å; T243-I381 HydrophobicContact CG2-CD1 4.17Å; T243-I381 HydrophobicContact CG2-CG1 4.48Å; T243-I381 HydrophobicContact CG2-CG2 3.81Å; F260-I381 HydrophobicContact CD1-CG2 3.94Å; F260-I381 HydrophobicContact CD2-CG2 4.05Å; F260-I381 HydrophobicContact CE1-CG2 3.69Å; F260-I381 HydrophobicContact CE2-CG2 3.84Å; F260-I381 HydrophobicContact CG-CG2 4.11Å; F260-I381 HydrophobicContact CZ-CG2 3.66Å; P379-I381 VanDerWaalsContact C-N 3.28Å; P379-I381 HydrophobicContact CB-CG2 4.05Å; P379-I381 HydrophobicContact CG-CD1 4.44Å; P379-I381 HydrophobicContact CG-CG2 4.11Å; P379-I381 PolarHBondContact O-N 3.47Å
382	I	68.7	Low	66.7	Low	44 Å²	44	64.2 Å²	64.2	23%	0.226	36%	0.358	C	S	.	.			trans	-68.1	130.5	173	-60.5	-179.5	0	0	0	109.4	K241 I244 D386	K241-I382 PolarHBondContact NZ-O 3.45Å; I244-I382 HydrophobicContact CB-CD1 4.09Å; I244-I382 HydrophobicContact CG2-CD1 4.31Å; I244-I382 PolarHBondContact O-N 2.96Å; I382-D386 HydrophobicContact CG2-CB 3.69Å
383	P	60.5	Low	64.3	Low	84 Å²	84	67.3 Å²	67.3	55%	0.545	38%	0.377	S	S	.	.			trans	-56.7	143	175.8	-22.7	32.4	0	0	0	111.8	N385 D386	P383-N385 PolarHBondContact O-N 3.48Å; P383-D386 PolarHBondContact O-N 3.07Å; P383-D386 VanDerWaalsContact O-N 3.08Å
384	S	55.5	Low	62.1	Low	70 Å²	70	71.7 Å²	71.7	49%	0.49	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-53.6	-26.3	-172.8	-39.9	0	0	0	0	115.4	K241 D386	K241-S384 VanDerWaalsContact NZ-CA 3.29Å; K241-S384 PolarHBondContact NZ-OG 2.85Å; S384-D386 VanDerWaalsContact C-N 3.28Å; S384-D386 PolarHBondContact O-N 2.86Å
385	N	47.5	Very low	59.8	Low	139 Å²	139	76.9 Å²	76.9	74%	0.743	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-76.3	-14.8	-176.6	-69.4	-11.8	0	0	0	113.8	P383	P383-N385 PolarHBondContact O-N 3.48Å
386	D	44.6	Very low	57.6	Low	117 Å²	117	83 Å²	83	63%	0.626	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-92.4	-13	-180	-68	-27.8	0	0	0	112.6	I382 P383 S384	I382-D386 HydrophobicContact CG2-CB 3.69Å; P383-D386 PolarHBondContact O-N 3.07Å; P383-D386 VanDerWaalsContact O-N 3.08Å; S384-D386 VanDerWaalsContact C-N 3.28Å; S384-D386 PolarHBondContact O-N 2.86Å
387	D	47	Very low	55.6	Low	39 Å²	39	87.8 Å²	87.8	21%	0.209	49%	0.488	C	S	.	.	S	Bend	trans	-76.9	-21.1	-178.7	-89.3	-24.5	0	0	0	113.4	T243 K257	T243-D387 PolarHBondContact OG1-OD2 2.8Å; K257-D387 IonicContact NZ-OD1 3.79Å; K257-D387 IonicContact NZ-OD2 3.61Å
388	D	43.2	Very low	54.1	Low	137 Å²	137	90.3 Å²	90.3	73%	0.733	50%	0.502	S	S	*	.	S	Bend	trans	-109.5	6.3	-171.3	-81.1	-8.9	0	0	0	115.1
389	N	37.8	Very low	52.8	Low	100 Å²	100	92.5 Å²	92.5	54%	0.535	51%	0.513	S	S	.	.			trans	-107.1	78.7	174.9	-83.3	-44.3	0	0	0	111.7	N391 T393	N389-N391 PolarHBondContact O-N 2.91Å; N389-T393 PolarHBondContact ND2-OG1 3.45Å
390	D	42.4	Very low	51.8	Low	151 Å²	151	96.7 Å²	96.7	81%	0.807	53%	0.534	S	S	*	.			trans	-41.9	106.5	138	-84.2	-34.8	0	0	0	109.3
391	N	38.8	Very low	50.9	Low	142 Å²	142	96.6 Å²	96.6	76%	0.759	54%	0.538	S	S	*	.	S	Bend	trans	38	88.2	154.4	-64.8	-34.1	0	0	0	117.7	N389	N389-N391 PolarHBondContact O-N 2.91Å
392	N	42.3	Very low	50.5	Low	113 Å²	113	97.8 Å²	97.8	60%	0.604	55%	0.554	S	S	*	*	S	Bend	trans	173.9	-14.6	130.9	-98.5	-45	0	0	0	117	K396	N392-K396 WeakPolarHBondContact O-CG 3.4Å
393	T	42.6	Very low	50.4	Low	69 Å²	69	102.7 Å²	102.7	42%	0.423	57%	0.574	S	S	.	*	H	α-helix	trans	-87.6	-37.9	-171.4	45.4	0	0	0	0	114	N389 N395 K396 N397	N389-T393 PolarHBondContact ND2-OG1 3.45Å; T393-N395 PolarHBondContact O-N 3.24Å; T393-K396 PolarHBondContact O-N 3.12Å; T393-N397 PolarHBondContact O-N 2.94Å; T393-N397 VanDerWaalsContact O-N 3.09Å
394	S	47.5	Very low	50.9	Low	92 Å²	92	103.2 Å²	103.2	64%	0.643	57%	0.571	S	S	*	*	H	α-helix	trans	-63.4	-41.5	179.5	65.1	0	0	0	0	112.4	K396 N397 S398	S394-K396 PolarHBondContact O-N 3.17Å; S394-N397 PolarHBondContact O-N 2.94Å; S394-S398 WeakPolarHBondContact O-CB 3.38Å; S394-S398 PolarHBondContact O-N 3.41Å
395	N	48.3	Very low	51.4	Low	109 Å²	109	103.1 Å²	103.1	58%	0.583	57%	0.569	S	S	*	*	H	α-helix	trans	-65.2	-36.4	174.3	-86.3	-8.7	0	0	0	112.2	T393 I399	T393-N395 PolarHBondContact O-N 3.24Å; N395-I399 WeakPolarHBondContact O-CB 3.26Å; N395-I399 VanDerWaalsContact O-CD1 3.31Å; N395-I399 WeakPolarHBondContact O-CD1 3.49Å; N395-I399 WeakPolarHBondContact O-CG1 3.49Å; N395-I399 PolarHBondContact O-N 3.11Å
396	K	47.1	Very low	52.1	Low	129 Å²	129	97.9 Å²	97.9	56%	0.561	55%	0.548	S	S	*	.	H	α-helix	trans	-64.9	-44.3	176	-80.1	-179.3	179.8	176.9	0	112.1	N392 T393 S394 I399 I400	N392-K396 WeakPolarHBondContact O-CG 3.4Å; T393-K396 PolarHBondContact O-N 3.12Å; S394-K396 PolarHBondContact O-N 3.17Å; K396-I399 PolarHBondContact O-N 2.69Å; K396-I400 WeakPolarHBondContact O-CB 3.32Å; K396-I400 WeakPolarHBondContact O-CD1 3.39Å; K396-I400 WeakPolarHBondContact O-CG1 3.33Å; K396-I400 PolarHBondContact O-N 3.01Å
397	N	46.9	Very low	53.3	Low	115 Å²	115	96.8 Å²	96.8	62%	0.615	54%	0.542	S	S	*	.	H	α-helix	trans	-69.2	-37.9	-179.2	-71.4	-9	0	0	0	112.3	T393 S394 S401	T393-N397 PolarHBondContact O-N 2.94Å; T393-N397 VanDerWaalsContact O-N 3.09Å; S394-N397 PolarHBondContact O-N 2.94Å; N397-S401 VanDerWaalsContact O-CB 3.28Å; N397-S401 WeakPolarHBondContact O-CB 3.47Å; N397-S401 PolarHBondContact O-N 3.23Å
398	S	56.6	Low	54.3	Low	75 Å²	75	100.5 Å²	100.5	52%	0.524	56%	0.561	S	S	.	*	H	α-helix	trans	-63.5	-45.5	173.3	174.3	0	0	0	0	112	S394 I400 S401 A402	S394-S398 WeakPolarHBondContact O-CB 3.38Å; S394-S398 PolarHBondContact O-N 3.41Å; S398-I400 PolarHBondContact O-N 2.92Å; S398-S401 PolarHBondContact O-N 2.69Å; S398-A402 WeakPolarHBondContact O-CB 3.3Å; S398-A402 PolarHBondContact O-N 3.14Å
399	I	57.7	Low	55.5	Low	106 Å²	106	99.9 Å²	99.9	54%	0.544	56%	0.557	S	S	.	*	H	α-helix	trans	-65.4	-41.8	178.5	-67.1	165.4	0	0	0	110.9	N395 K396 A402 F403	N395-I399 WeakPolarHBondContact O-CB 3.26Å; N395-I399 VanDerWaalsContact O-CD1 3.31Å; N395-I399 WeakPolarHBondContact O-CD1 3.49Å; N395-I399 WeakPolarHBondContact O-CG1 3.49Å; N395-I399 PolarHBondContact O-N 3.11Å; K396-I399 PolarHBondContact O-N 2.69Å; I399-A402 PolarHBondContact O-N 3.37Å; I399-F403 WeakPolarHBondContact O-CB 3.3Å; I399-F403 PolarHBondContact O-N 3.17Å
400	I	58.8	Low	57.1	Low	96 Å²	96	99.7 Å²	99.7	49%	0.492	56%	0.555	S	S	.	*	H	α-helix	trans	-64	-44.2	176.7	-68.5	164.7	0	0	0	110.8	K396 S398 F403 I404	K396-I400 WeakPolarHBondContact O-CB 3.32Å; K396-I400 WeakPolarHBondContact O-CD1 3.39Å; K396-I400 WeakPolarHBondContact O-CG1 3.33Å; K396-I400 PolarHBondContact O-N 3.01Å; S398-I400 PolarHBondContact O-N 2.92Å; I400-F403 PolarHBondContact O-N 3.5Å; I400-I404 HydrophobicContact CG2-CD1 3.77Å; I400-I404 HydrophobicContact CG2-CG1 4.45Å; I400-I404 VanDerWaalsContact O-CG1 3.29Å; I400-I404 WeakPolarHBondContact O-CG1 3.4Å; I400-I404 PolarHBondContact O-N 2.92Å
401	S	59.6	Low	58.4	Low	67 Å²	67	97 Å²	97	47%	0.469	54%	0.543	S	S	.	.	H	α-helix	trans	-60.1	-47.9	176.3	166.1	0	0	0	0	111.9	N397 S398 F403 I404 C405	N397-S401 VanDerWaalsContact O-CB 3.28Å; N397-S401 WeakPolarHBondContact O-CB 3.47Å; N397-S401 PolarHBondContact O-N 3.23Å; S398-S401 PolarHBondContact O-N 2.69Å; S401-F403 VanDerWaalsContact C-N 3.3Å; S401-F403 PolarHBondContact O-N 2.91Å; S401-I404 PolarHBondContact O-N 2.96Å; S401-C405 PolarHBondContact O-N 3.46Å
402	A	66.4	Low	59.5	Low	60 Å²	60	92.3 Å²	92.3	50%	0.496	53%	0.529	S	S	.	.	H	α-helix	trans	-62.1	-38.2	177.4	0	0	0	0	0	111.9	S398 I399 G406	S398-A402 WeakPolarHBondContact O-CB 3.3Å; S398-A402 PolarHBondContact O-N 3.14Å; I399-A402 PolarHBondContact O-N 3.37Å; A402-G406 PolarHBondContact O-N 3.25Å
403	F	67	Low	60.6	Low	147 Å²	147	89.7 Å²	89.7	65%	0.645	52%	0.519	S	S	*	.	H	α-helix	trans	-66.8	-40.2	176.6	-133.3	-90	0	0	0	112.4	I399 I400 S401 G406 L407	I399-F403 WeakPolarHBondContact O-CB 3.3Å; I399-F403 PolarHBondContact O-N 3.17Å; I400-F403 PolarHBondContact O-N 3.5Å; S401-F403 VanDerWaalsContact C-N 3.3Å; S401-F403 PolarHBondContact O-N 2.91Å; F403-G406 PolarHBondContact O-N 3.08Å; F403-L407 HydrophobicContact CD1-CD1 4.08Å; F403-L407 WeakPolarHBondContact O-CB 3.35Å; F403-L407 PolarHBondContact O-N 3.16Å
404	I	70.8	Confident	61.8	Low	94 Å²	94	91.8 Å²	91.8	48%	0.482	53%	0.526	S	S	.	.	H	α-helix	trans	-67	-44.5	176.7	-67.7	167.5	0	0	0	110.6	I400 S401 L407 L408	I400-I404 HydrophobicContact CG2-CD1 3.77Å; I400-I404 HydrophobicContact CG2-CG1 4.45Å; I400-I404 VanDerWaalsContact O-CG1 3.29Å; I400-I404 WeakPolarHBondContact O-CG1 3.4Å; I400-I404 PolarHBondContact O-N 2.92Å; S401-I404 PolarHBondContact O-N 2.96Å; I404-L407 PolarHBondContact O-N 3.34Å; I404-L408 HydrophobicContact CG2-CD1 4.12Å; I404-L408 WeakPolarHBondContact O-CG 3.49Å; I404-L408 PolarHBondContact O-N 2.88Å
405	C	67.2	Low	62.5	Low	68 Å²	68	89 Å²	89	46%	0.459	51%	0.512	S	S	.	.	H	α-helix	trans	-63	-41.9	175.5	-73	0	0	0	0	111.8	S401 L408 I409	S401-C405 PolarHBondContact O-N 3.46Å; C405-L408 PolarHBondContact O-N 2.85Å; C405-I409 WeakPolarHBondContact O-CG1 3.3Å; C405-I409 PolarHBondContact O-N 3.21Å
406	G	61.2	Low	63.2	Low	29 Å²	29	86.6 Å²	86.6	30%	0.299	50%	0.504	S	S	.	.	H	α-helix	trans	-60.2	-44.8	174.9	0	0	0	0	0	112.7	A402 F403 I409 I410	A402-G406 PolarHBondContact O-N 3.25Å; F403-G406 PolarHBondContact O-N 3.08Å; G406-I409 PolarHBondContact O-N 3.08Å; G406-I410 WeakPolarHBondContact O-CG1 3.45Å; G406-I410 PolarHBondContact O-N 3.46Å; G406-I410 VanDerWaalsContact O-N 3.11Å
407	L	69.8	Low	64.4	Low	95 Å²	95	83.9 Å²	83.9	50%	0.497	50%	0.498	S	S	.	.	H	α-helix	trans	-63.4	-40.7	175.8	-88.3	162.5	0	0	0	112.5	F403 I404 I409 I410 V411	F403-L407 HydrophobicContact CD1-CD1 4.08Å; F403-L407 WeakPolarHBondContact O-CB 3.35Å; F403-L407 PolarHBondContact O-N 3.16Å; I404-L407 PolarHBondContact O-N 3.34Å; L407-I409 VanDerWaalsContact C-N 3.33Å; L407-I409 PolarHBondContact O-N 3.44Å; L407-I410 PolarHBondContact O-N 2.85Å; L407-V411 VanDerWaalsContact O-CG2 3.3Å; L407-V411 WeakPolarHBondContact O-CG2 3.29Å; L407-V411 PolarHBondContact O-N 2.94Å
408	L	68.6	Low	65.4	Low	117 Å²	117	85.3 Å²	85.3	61%	0.613	50%	0.499	S	S	*	.	H	α-helix	trans	-64.9	-36	177.4	-73.8	170.4	0	0	0	112.4	I404 C405 G412	I404-L408 HydrophobicContact CG2-CD1 4.12Å; I404-L408 WeakPolarHBondContact O-CG 3.49Å; I404-L408 PolarHBondContact O-N 2.88Å; C405-L408 PolarHBondContact O-N 2.85Å; L408-G412 PolarHBondContact O-N 2.79Å
409	I	69.1	Low	65.9	Low	124 Å²	124	85.7 Å²	85.7	64%	0.636	50%	0.498	S	S	*	.	H	α-helix	trans	-66.9	-41	174.7	-66.7	166.1	0	0	0	110.8	C405 G406 L407 S413	C405-I409 WeakPolarHBondContact O-CG1 3.3Å; C405-I409 PolarHBondContact O-N 3.21Å; G406-I409 PolarHBondContact O-N 3.08Å; L407-I409 VanDerWaalsContact C-N 3.33Å; L407-I409 PolarHBondContact O-N 3.44Å; I409-S413 WeakPolarHBondContact O-CB 3.43Å; I409-S413 PolarHBondContact O-N 3.27Å; I409-S413 PolarHBondContact O-OG 2.99Å
410	I	70.8	Confident	66.4	Low	96 Å²	96	85 Å²	85	49%	0.492	50%	0.495	S	S	.	.	H	α-helix	trans	-66.8	-45.3	177.3	-66	169.4	0	0	0	110.8	G406 L407 S413 I414	G406-I410 WeakPolarHBondContact O-CG1 3.45Å; G406-I410 PolarHBondContact O-N 3.46Å; G406-I410 VanDerWaalsContact O-N 3.11Å; L407-I410 PolarHBondContact O-N 2.85Å; I410-S413 WeakPolarHBondContact CA-OG 3.49Å; I410-S413 PolarHBondContact O-N 2.93Å; I410-S413 PolarHBondContact O-OG 3.44Å; I410-I414 HydrophobicContact CG2-CD1 3.81Å; I410-I414 VanDerWaalsContact O-CG1 3.26Å; I410-I414 WeakPolarHBondContact O-CG1 3.31Å; I410-I414 PolarHBondContact O-N 3.42Å
411	V	68.9	Low	66.7	Low	93 Å²	93	88.7 Å²	88.7	56%	0.564	50%	0.503	S	S	*	.	H	α-helix	trans	-65.7	-41	177.7	174.8	0	0	0	0	111.1	L407 I414 G415	L407-V411 VanDerWaalsContact O-CG2 3.3Å; L407-V411 WeakPolarHBondContact O-CG2 3.29Å; L407-V411 PolarHBondContact O-N 2.94Å; V411-I414 PolarHBondContact O-N 3.29Å; V411-G415 PolarHBondContact O-N 2.79Å
412	G	62.2	Low	67.3	Low	45 Å²	45	92.7 Å²	92.7	46%	0.464	51%	0.507	S	S	.	.	H	α-helix	trans	-64.1	-41.5	176.7	0	0	0	0	0	113	L408 G415 S416	L408-G412 PolarHBondContact O-N 2.79Å; G412-G415 PolarHBondContact O-N 3Å; G412-S416 WeakPolarHBondContact O-CB 3.28Å; G412-S416 PolarHBondContact O-N 3.38Å
413	S	66.6	Low	67.3	Low	57 Å²	57	94.2 Å²	94.2	40%	0.399	51%	0.506	S	S	.	.	H	α-helix	trans	-67.1	-44.2	176.6	48.5	0	0	0	0	111.8	I409 I410 G415 S416 V417	I409-S413 WeakPolarHBondContact O-CB 3.43Å; I409-S413 PolarHBondContact O-N 3.27Å; I409-S413 PolarHBondContact O-OG 2.99Å; I410-S413 WeakPolarHBondContact CA-OG 3.49Å; I410-S413 PolarHBondContact O-N 2.93Å; I410-S413 PolarHBondContact O-OG 3.44Å; S413-G415 PolarHBondContact O-N 2.91Å; S413-S416 PolarHBondContact O-N 2.98Å; S413-S416 PolarHBondContact O-OG 3.07Å; S413-V417 WeakPolarHBondContact O-CG2 3.41Å; S413-V417 PolarHBondContact O-N 2.99Å; S413-V417 VanDerWaalsContact O-N 3.1Å
414	I	67.7	Low	67.4	Low	113 Å²	113	92.2 Å²	92.2	58%	0.579	50%	0.499	S	S	*	.	H	α-helix	trans	-61.5	-43.6	174.3	-65.9	167.9	0	0	0	111.2	I410 V411 V417 F418	I410-I414 HydrophobicContact CG2-CD1 3.81Å; I410-I414 VanDerWaalsContact O-CG1 3.26Å; I410-I414 WeakPolarHBondContact O-CG1 3.31Å; I410-I414 PolarHBondContact O-N 3.42Å; V411-I414 PolarHBondContact O-N 3.29Å; I414-V417 PolarHBondContact O-N 3.1Å; I414-F418 PolarHBondContact O-N 3.46Å
415	G	61.5	Low	67.1	Low	33 Å²	33	97.2 Å²	97.2	34%	0.34	51%	0.511	S	S	.	.	H	α-helix	trans	-61.4	-44.4	176.8	0	0	0	0	0	112.6	V411 G412 S413 V417 F418 V419	V411-G415 PolarHBondContact O-N 2.79Å; G412-G415 PolarHBondContact O-N 3Å; S413-G415 PolarHBondContact O-N 2.91Å; G415-V417 PolarHBondContact O-N 3.39Å; G415-F418 PolarHBondContact O-N 3.47Å; G415-V419 WeakPolarHBondContact O-CG2 3.17Å; G415-V419 PolarHBondContact O-N 3.33Å
416	S	63.3	Low	67.2	Low	59 Å²	59	101 Å²	101	41%	0.413	52%	0.516	S	S	.	.	H	α-helix	trans	-62.5	-42.1	178.3	82.4	0	0	0	0	112.1	G412 S413 F418 V419 I420	G412-S416 WeakPolarHBondContact O-CB 3.28Å; G412-S416 PolarHBondContact O-N 3.38Å; S413-S416 PolarHBondContact O-N 2.98Å; S413-S416 PolarHBondContact O-OG 3.07Å; S416-F418 VanDerWaalsContact C-N 3.32Å; S416-F418 PolarHBondContact O-N 2.81Å; S416-V419 PolarHBondContact O-N 3.03Å; S416-I420 WeakPolarHBondContact O-CB 3.41Å; S416-I420 VanDerWaalsContact O-CG1 3.24Å; S416-I420 WeakPolarHBondContact O-CG1 3.3Å; S416-I420 PolarHBondContact O-N 3.24Å
417	V	71.2	Confident	67.1	Low	73 Å²	73	104.7 Å²	104.7	44%	0.442	53%	0.525	S	S	.	.	H	α-helix	trans	-65.2	-38.4	177.8	173.4	0	0	0	0	110.6	S413 I414 G415 R421	S413-V417 WeakPolarHBondContact O-CG2 3.41Å; S413-V417 PolarHBondContact O-N 2.99Å; S413-V417 VanDerWaalsContact O-N 3.1Å; I414-V417 PolarHBondContact O-N 3.1Å; G415-V417 PolarHBondContact O-N 3.39Å; V417-R421 WeakPolarHBondContact O-CB 2.93Å; V417-R421 PolarHBondContact O-N 3.46Å
418	F	68.5	Low	66.6	Low	144 Å²	144	108.4 Å²	108.4	63%	0.632	53%	0.534	S	S	*	.	H	α-helix	trans	-66.8	-42.8	176.9	-161.9	-91.7	0	0	0	112.2	I414 G415 S416 R421 R422	I414-F418 PolarHBondContact O-N 3.46Å; G415-F418 PolarHBondContact O-N 3.47Å; S416-F418 VanDerWaalsContact C-N 3.32Å; S416-F418 PolarHBondContact O-N 2.81Å; F418-R421 PolarHBondContact O-N 2.93Å; F418-R422 WeakPolarHBondContact O-CB 3.29Å; F418-R422 PolarHBondContact O-N 3.43Å
419	V	67.6	Low	66.4	Low	84 Å²	84	108.8 Å²	108.8	51%	0.509	53%	0.533	S	S	.	.	H	α-helix	trans	-65.2	-45.1	176.9	173.3	0	0	0	0	110.9	G415 S416 R421 R422 I423	G415-V419 WeakPolarHBondContact O-CG2 3.17Å; G415-V419 PolarHBondContact O-N 3.33Å; S416-V419 PolarHBondContact O-N 3.03Å; V419-R421 PolarHBondContact O-N 2.76Å; V419-R422 PolarHBondContact O-N 2.93Å; V419-R422 VanDerWaalsContact O-N 3.16Å; V419-I423 HydrophobicContact CG1-CD1 3.8Å; V419-I423 HydrophobicContact CG1-CG1 4.42Å; V419-I423 WeakPolarHBondContact O-CG1 3.21Å; V419-I423 PolarHBondContact O-N 3.01Å
420	I	68.1	Low	65.9	Low	91 Å²	91	110.6 Å²	110.6	47%	0.467	53%	0.532	S	S	.	.	H	α-helix	trans	-61.2	-46.1	177.2	-69.3	167.2	0	0	0	110.6	S416 R422 I423 Q424	S416-I420 WeakPolarHBondContact O-CB 3.41Å; S416-I420 VanDerWaalsContact O-CG1 3.24Å; S416-I420 WeakPolarHBondContact O-CG1 3.3Å; S416-I420 PolarHBondContact O-N 3.24Å; I420-R422 VanDerWaalsContact C-N 3.28Å; I420-R422 PolarHBondContact O-N 3.34Å; I420-I423 PolarHBondContact O-N 3.06Å; I420-Q424 HydrophobicContact CG2-CG 4.4Å; I420-Q424 WeakPolarHBondContact O-CB 3.33Å; I420-Q424 WeakPolarHBondContact O-CG 3.46Å; I420-Q424 PolarHBondContact O-N 3.48Å
421	R	65.2	Low	65.1	Low	174 Å²	174	110.3 Å²	110.3	66%	0.657	53%	0.53	S	S	*	.	H	α-helix	trans	-61	-36.6	175.6	-83.7	-176.9	170.5	173	-0.7	112.4	V417 F418 V419 R425	V417-R421 WeakPolarHBondContact O-CB 2.93Å; V417-R421 PolarHBondContact O-N 3.46Å; F418-R421 PolarHBondContact O-N 2.93Å; V419-R421 PolarHBondContact O-N 2.76Å; R421-R425 PolarHBondContact O-N 2.71Å; R421-R425 VanDerWaalsContact O-N 3.08Å
422	R	71	Confident	64.3	Low	151 Å²	151	109.4 Å²	109.4	57%	0.57	53%	0.528	S	S	*	.	H	α-helix	trans	-69.1	-39.9	177.2	-167.5	175.7	-173.9	167.9	2.3	112.1	F418 V419 I420 R426	F418-R422 WeakPolarHBondContact O-CB 3.29Å; F418-R422 PolarHBondContact O-N 3.43Å; V419-R422 PolarHBondContact O-N 2.93Å; V419-R422 VanDerWaalsContact O-N 3.16Å; I420-R422 VanDerWaalsContact C-N 3.28Å; I420-R422 PolarHBondContact O-N 3.34Å; R422-R426 PolarHBondContact O-N 3.09Å
423	I	67.1	Low	64	Low	91 Å²	91	113.4 Å²	113.4	47%	0.467	53%	0.534	S	S	.	.	H	α-helix	trans	-67.4	-43.8	176	-67.4	169.2	0	0	0	110.3	V419 I420 R425 R426 H427	V419-I423 HydrophobicContact CG1-CD1 3.8Å; V419-I423 HydrophobicContact CG1-CG1 4.42Å; V419-I423 WeakPolarHBondContact O-CG1 3.21Å; V419-I423 PolarHBondContact O-N 3.01Å; I420-I423 PolarHBondContact O-N 3.06Å; I423-R425 PolarHBondContact O-N 3.26Å; I423-R426 PolarHBondContact O-N 3.11Å; I423-R426 VanDerWaalsContact O-N 3.17Å; I423-H427 PolarHBondContact O-N 2.88Å
424	Q	68.2	Low	63.3	Low	106 Å²	106	116.2 Å²	116.2	50%	0.495	54%	0.544	S	S	.	.	H	α-helix	trans	-60	-42.7	177.1	-75.7	177.8	-16.8	0	0	111.9	I420 R426 H427 Y428	I420-Q424 HydrophobicContact CG2-CG 4.4Å; I420-Q424 WeakPolarHBondContact O-CB 3.33Å; I420-Q424 WeakPolarHBondContact O-CG 3.46Å; I420-Q424 PolarHBondContact O-N 3.48Å; Q424-R426 VanDerWaalsContact C-N 3.33Å; Q424-R426 PolarHBondContact O-N 3.15Å; Q424-H427 PolarHBondContact O-N 3.31Å; Q424-Y428 WeakPolarHBondContact O-CD2 3.38Å; Q424-Y428 PolarHBondContact O-N 2.96Å
425	R	65.8	Low	62.3	Low	198 Å²	198	115.6 Å²	115.6	75%	0.747	55%	0.546	S	S	*	.	H	α-helix	trans	-59.7	-40.5	175.1	-79.6	-174.8	-178	-176.6	1	113	R421 I423 Q429	R421-R425 PolarHBondContact O-N 2.71Å; R421-R425 VanDerWaalsContact O-N 3.08Å; I423-R425 PolarHBondContact O-N 3.26Å; R425-Q429 WeakPolarHBondContact O-CG 3.37Å; R425-Q429 PolarHBondContact O-N 3Å; R425-Q429 VanDerWaalsContact O-N 3.17Å
426	R	67.9	Low	61.6	Low	148 Å²	148	118.6 Å²	118.6	56%	0.558	56%	0.562	S	S	*	*	H	α-helix	trans	-68.2	-37.1	176	-72.9	-177.2	173.1	179.9	-2.7	112.3	R422 I423 Q424 Q429 R430	R422-R426 PolarHBondContact O-N 3.09Å; I423-R426 PolarHBondContact O-N 3.11Å; I423-R426 VanDerWaalsContact O-N 3.17Å; Q424-R426 VanDerWaalsContact C-N 3.33Å; Q424-R426 PolarHBondContact O-N 3.15Å; R426-Q429 PolarHBondContact O-N 3.18Å; R426-R430 PolarHBondContact O-N 2.89Å; R426-R430 VanDerWaalsContact O-N 3.1Å
427	H	59.6	Low	60.8	Low	106 Å²	106	122.7 Å²	122.7	49%	0.491	58%	0.578	S	S	.	*	H	α-helix	trans	-66.4	-43.1	175.7	-104.9	-75.2	0	0	0	112	I423 Q424 Q429 R430 I431	I423-H427 PolarHBondContact O-N 2.88Å; Q424-H427 PolarHBondContact O-N 3.31Å; H427-Q429 VanDerWaalsContact C-N 3.32Å; H427-Q429 PolarHBondContact O-N 2.97Å; H427-R430 PolarHBondContact O-N 3.35Å; H427-I431 WeakPolarHBondContact O-CB 3.48Å; H427-I431 VanDerWaalsContact O-CG1 3.27Å; H427-I431 WeakPolarHBondContact O-CG1 3.31Å; H427-I431 PolarHBondContact O-N 2.88Å
428	Y	60.5	Low	59.2	Low	174 Å²	174	121.9 Å²	121.9	68%	0.682	58%	0.584	S	S	*	*	H	α-helix	trans	-62.5	-38.3	176.4	-88.9	-76	0	0	0	112.5	Q424 I431 S432	Q424-Y428 WeakPolarHBondContact O-CD2 3.38Å; Q424-Y428 PolarHBondContact O-N 2.96Å; Y428-I431 PolarHBondContact O-N 3.08Å; Y428-S432 PolarHBondContact O-N 2.66Å; Y428-S432 PolarHBondContact O-OG 3.47Å
429	Q	64.2	Low	57.5	Low	124 Å²	124	122.3 Å²	122.3	58%	0.579	59%	0.593	S	S	*	*	H	α-helix	trans	-63.7	-44.9	174.5	-74.7	176.8	-33.6	0	0	112.3	R425 R426 H427 S432 E433	R425-Q429 WeakPolarHBondContact O-CG 3.37Å; R425-Q429 PolarHBondContact O-N 3Å; R425-Q429 VanDerWaalsContact O-N 3.17Å; R426-Q429 PolarHBondContact O-N 3.18Å; H427-Q429 VanDerWaalsContact C-N 3.32Å; H427-Q429 PolarHBondContact O-N 2.97Å; Q429-S432 PolarHBondContact O-N 3.24Å; Q429-S432 PolarHBondContact O-OG 3.4Å; Q429-E433 PolarHBondContact O-N 3.05Å; Q429-E433 VanDerWaalsContact O-N 3.12Å
430	R	58.9	Low	55.9	Low	163 Å²	163	125 Å²	125	62%	0.615	60%	0.604	S	S	*	*	H	α-helix	trans	-65.8	-39.6	176.2	-75.4	-174.3	-172.4	175.5	0.6	112.6	R426 H427 E433 L434	R426-R430 PolarHBondContact O-N 2.89Å; R426-R430 VanDerWaalsContact O-N 3.1Å; H427-R430 PolarHBondContact O-N 3.35Å; R430-E433 PolarHBondContact O-N 3.46Å; R430-L434 WeakPolarHBondContact O-CB 3.1Å; R430-L434 WeakPolarHBondContact O-CD1 3.32Å; R430-L434 PolarHBondContact O-N 2.94Å
431	I	53.1	Low	54.3	Low	89 Å²	89	126.6 Å²	126.6	46%	0.456	61%	0.613	S	S	.	*	H	α-helix	trans	-67.1	-39.9	178.4	-67.8	168.7	0	0	0	110.1	H427 Y428 E433 L434 T435	H427-I431 WeakPolarHBondContact O-CB 3.48Å; H427-I431 VanDerWaalsContact O-CG1 3.27Å; H427-I431 WeakPolarHBondContact O-CG1 3.31Å; H427-I431 PolarHBondContact O-N 2.88Å; Y428-I431 PolarHBondContact O-N 3.08Å; I431-E433 VanDerWaalsContact C-N 3.28Å; I431-E433 PolarHBondContact O-N 3.49Å; I431-L434 PolarHBondContact O-N 2.95Å; I431-T435 HydrophobicContact CG2-CG2 4.48Å; I431-T435 PolarHBondContact O-N 3.41Å; I431-T435 PolarHBondContact O-OG1 2.9Å
432	S	51.7	Low	52.8	Low	74 Å²	74	125 Å²	125	52%	0.517	62%	0.618	S	S	.	*	H	α-helix	trans	-64.4	-30.7	174.8	59.6	0	0	0	0	113.6	Y428 Q429	Y428-S432 PolarHBondContact O-N 2.66Å; Y428-S432 PolarHBondContact O-OG 3.47Å; Q429-S432 PolarHBondContact O-N 3.24Å; Q429-S432 PolarHBondContact O-OG 3.4Å
433	E	55.6	Low	50.9	Low	129 Å²	129	122.2 Å²	122.2	60%	0.603	62%	0.622	S	S	*	*	H	α-helix	trans	-71.3	-41.4	172.1	-73.9	174.1	174.5	0	0	111.3	Q429 R430 I431 S436	Q429-E433 PolarHBondContact O-N 3.05Å; Q429-E433 VanDerWaalsContact O-N 3.12Å; R430-E433 PolarHBondContact O-N 3.46Å; I431-E433 VanDerWaalsContact C-N 3.28Å; I431-E433 PolarHBondContact O-N 3.49Å; E433-S436 PolarHBondContact O-N 3.35Å; E433-S436 PolarHBondContact O-OG 2.92Å
434	L	52.2	Low	49.4	Very low	116 Å²	116	124.6 Å²	124.6	61%	0.607	64%	0.635	S	S	*	*	H	α-helix	trans	-74.3	-33.6	-177.9	-84.9	150.5	0	0	0	113.7	R430 I431 S436 I437 G438	R430-L434 WeakPolarHBondContact O-CB 3.1Å; R430-L434 WeakPolarHBondContact O-CD1 3.32Å; R430-L434 PolarHBondContact O-N 2.94Å; I431-L434 PolarHBondContact O-N 2.95Å; L434-S436 PolarHBondContact O-N 2.94Å; L434-I437 PolarHBondContact O-N 3.39Å; L434-G438 PolarHBondContact O-N 3.29Å
435	T	48.1	Very low	47.6	Very low	100 Å²	100	125.9 Å²	125.9	61%	0.613	65%	0.646	S	S	*	*	H	α-helix	trans	-71.7	-15.1	173.2	39.8	0	0	0	0	113.3	I431 I437	I431-T435 HydrophobicContact CG2-CG2 4.48Å; I431-T435 PolarHBondContact O-N 3.41Å; I431-T435 PolarHBondContact O-OG1 2.9Å; T435-I437 VanDerWaalsContact C-N 3.28Å
436	S	46.4	Very low	45.9	Very low	97 Å²	97	123.8 Å²	123.8	68%	0.678	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-18.8	167.1	82.5	0	0	0	0	113.2	E433 L434	E433-S436 PolarHBondContact O-N 3.35Å; E433-S436 PolarHBondContact O-OG 2.92Å; L434-S436 PolarHBondContact O-N 2.94Å
437	I	46.4	Very low	44.2	Very low	145 Å²	145	121 Å²	121	74%	0.744	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	-17.9	-173	-68	165.3	0	0	0	112.3	L434 T435	L434-I437 PolarHBondContact O-N 3.39Å; T435-I437 VanDerWaalsContact C-N 3.28Å
438	G	37.4	Very low	42.7	Very low	55 Å²	55	121.4 Å²	121.4	57%	0.567	66%	0.663	S	S	*	*			trans	-119.3	39.9	-166.9	0	0	0	0	0	115.9	L434 N440	L434-G438 PolarHBondContact O-N 3.29Å; G438-N440 VanDerWaalsContact C-N 3.26Å; G438-N440 PolarHBondContact O-N 2.95Å; G438-N440 VanDerWaalsContact O-N 3.14Å
439	N	33.1	Very low	41.2	Very low	154 Å²	154	120 Å²	120	82%	0.824	67%	0.667	S	S	*	*			trans	-82.5	75.5	166.5	-124.2	11.7	0	0	0	108.6
440	N	34.1	Very low	39.5	Very low	140 Å²	140	118.1 Å²	118.1	75%	0.749	67%	0.667	S	S	*	*			trans	-167.8	122.4	156.8	-99.5	-21.1	0	0	0	111.6	G438	G438-N440 VanDerWaalsContact C-N 3.26Å; G438-N440 PolarHBondContact O-N 2.95Å; G438-N440 VanDerWaalsContact O-N 3.14Å
441	N	35	Very low	38.2	Very low	124 Å²	124	120.5 Å²	120.5	66%	0.663	68%	0.678	S	S	*	*			trans	84.2	103.5	148.2	-58.2	-21.4	0	0	0	118.8
442	N	33.5	Very low	37	Very low	141 Å²	141	121.5 Å²	121.5	75%	0.754	69%	0.693	S	S	*	*				67.5	92.4	127	-58.1	-9.3	0	0	0	116.2
443	S	31.2	Very low	36.7	Very low	93 Å²	93	123.2 Å²	123.2	65%	0.65	70%	0.702	S	S	*	*				67.6	111.9	65	86.6	0	0	0	0	114.7
444	N	33.9	Very low	35.4	Very low	140 Å²	140	125.5 Å²	125.5	75%	0.749	72%	0.717	S	S	*	*			trans	131.8	93.6	145	-62.5	-8	0	0	0	109.9
445	N	31.2	Very low	34.1	Very low	133 Å²	133	126 Å²	126	71%	0.711	72%	0.724	S	S	*	*				61.2	133.4	77.2	-76.8	19.1	0	0	0	111
446	E	30.6	Very low	33.1	Very low	155 Å²	155	125.2 Å²	125.2	72%	0.724	73%	0.728	S	S	*	*			cis	-160.9	142.5	20.1	-97.8	138.1	-159.2	0	0	104.8
447	A	31.4	Very low	32.1	Very low	90 Å²	90	129.3 Å²	129.3	74%	0.744	74%	0.736	S	S	*	*				67.7	152.6	56.9	0	0	0	0	0	114.9
448	V	28.7	Very low	31.2	Very low	114 Å²	114	131 Å²	131	69%	0.691	74%	0.741	S	S	*	*			trans	105.4	97.5	158	-174.5	0	0	0	0	114.6
449	N	28.1	Very low	30.7	Very low	145 Å²	145	136.3 Å²	136.3	78%	0.775	76%	0.756	S	S	*	*				80.1	150.3	89.1	-60.6	-24.7	0	0	0	111.2
450	S	29.9	Very low	30.3	Very low	83 Å²	83	133.1 Å²	133.1	58%	0.58	75%	0.745	S	S	*	*			cis	-170.5	160	26.1	27.2	0	0	0	0	105.6
451	Y	30.1	Very low	29.9	Very low	214 Å²	214	131.8 Å²	131.8	84%	0.839	75%	0.747	S	S	*	*				-179.4	152.8	93.7	-99	-83.7	0	0	0	110.7
452	S	29.1	Very low	29.8	Very low	109 Å²	109	133.3 Å²	133.3	76%	0.762	75%	0.754	S	S	*	*			trans	-100	-150.6	-157.2	-54.7	0	0	0	0	113.2
453	P	44.7	Very low	29.5	Very low	111 Å²	111	133.1 Å²	133.1	72%	0.721	75%	0.753	S	S	*	*				-113.6	164	-116.1	34	-13.8	0	0	0	114.2
454	I	29	Very low	29.6	Very low	177 Å²	177	136 Å²	136	91%	0.908	76%	0.761	S	S	*	*			trans	-110.4	129.8	165.7	-64.3	178.3	0	0	0	109.3
455	V	25.6	Very low	29.4	Very low	126 Å²	126	136.4 Å²	136.4	76%	0.764	76%	0.763	S	S	*	*			trans	-95.1	153.3	-168.3	169.1	0	0	0	0	110.5
456	A	26.2	Very low	29.2	Very low	83 Å²	83	141.2 Å²	141.2	69%	0.686	77%	0.771	S	S	*	*			trans	-49.1	157.8	174.1	0	0	0	0	0	117.5
457	Q	26.1	Very low	29	Very low	184 Å²	184	141.5 Å²	141.5	86%	0.86	78%	0.776	S	S	*	*			trans	175.6	117	132	-102	169.7	-26.9	0	0	108.5
458	E	25.9	Very low	28.7	Very low	181 Å²	181	143.2 Å²	143.2	85%	0.846	78%	0.776	S	S	*	*				53.2	109.4	77.8	-100.4	-169.2	175.8	0	0	116
459	L	27	Very low	28.4	Very low	166 Å²	166	145.7 Å²	145.7	87%	0.869	78%	0.78	S	S	*	*			trans	-162.9	100.7	151.7	-93.5	124.1	0	0	0	106.5
460	S	25.1	Very low	28.4	Very low	86 Å²	86	144.5 Å²	144.5	60%	0.601	78%	0.781	S	S	*	*				86	103.5	79.1	71.8	0	0	0	0	114.2
461	S	27	Very low	28.1	Very low	113 Å²	113	150.9 Å²	150.9	79%	0.79	79%	0.794	S	S	*	*			trans	27.1	120.8	137.4	61.7	0	0	0	0	120.3
462	I	31.2	Very low	27.9	Very low	156 Å²	156	150 Å²	150	80%	0.8	80%	0.797	S	S	*	*			trans	-120.2	113.9	153	-65.5	176.4	0	0	0	107.6
463	N	28.5	Very low	27.8	Very low	137 Å²	137	155.7 Å²	155.7	73%	0.733	80%	0.804	S	S	*	*			trans	-73	132	164.9	-98	-24.6	0	0	0	108.7
464	D	33.6	Very low	27.1	Very low	153 Å²	153	159.7 Å²	159.7	82%	0.818	81%	0.813	S	S	*	*			trans	-139.2	93	154.2	-91.8	-35.6	0	0	0	109.7	R466	D464-R466 PolarHBondContact O-N 3.45Å
465	N	27.9	Very low	27.1	Very low	148 Å²	148	160.4 Å²	160.4	79%	0.791	81%	0.809	S	S	*	*			trans	-74.2	105.3	166.5	-78.2	-26.4	0	0	0	108.8
466	R	28.1	Very low	27.2	Very low	235 Å²	235	162.6 Å²	162.6	89%	0.887	82%	0.816	S	S	*	*			trans	-131.9	102.9	159.4	-118.2	-177.4	-173.1	-173.1	2.7	109.6	D464 V468	D464-R466 PolarHBondContact O-N 3.45Å; R466-V468 PolarHBondContact O-N 3.25Å
467	I	26.1	Very low	27.3	Very low	161 Å²	161	165.3 Å²	165.3	83%	0.826	82%	0.824	S	S	*	*			trans	-77.4	114.3	172.5	-62	168	0	0	0	106.5
468	V	25	Very low	27.4	Very low	125 Å²	125	161.5 Å²	161.5	76%	0.758	82%	0.817	S	S	*	*			trans	-105.4	117.2	169.7	179.7	0	0	0	0	106.6	R466	R466-V468 PolarHBondContact O-N 3.25Å
469	E	22.9	Very low	27.4	Very low	166 Å²	166	161.5 Å²	161.5	78%	0.776	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-67.4	125.4	179.5	-70.4	-178.8	161.8	0	0	110.5	Y471	E469-Y471 PolarHBondContact O-N 2.95Å
470	P	27.2	Very low	27.5	Very low	121 Å²	121	159 Å²	159	79%	0.786	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-78	117.9	177	28.6	-30.5	0	0	0	110.5	Q472	P470-Q472 PolarHBondContact O-N 3.06Å
471	Y	24.2	Very low	27.6	Very low	217 Å²	217	162.6 Å²	162.6	85%	0.851	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-62.1	119	168.6	-78.9	-90.5	0	0	0	109.8	E469 Y473	E469-Y471 PolarHBondContact O-N 2.95Å; Y471-Y473 PolarHBondContact O-N 3Å
472	Q	24.9	Very low	27.7	Very low	194 Å²	194	165.7 Å²	165.7	91%	0.907	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-64.3	124.7	173.9	-95.9	176.9	-48.5	0	0	110.5	P470 E474	P470-Q472 PolarHBondContact O-N 3.06Å; Q472-E474 PolarHBondContact O-N 2.69Å
473	Y	28.4	Very low	27.5	Very low	230 Å²	230	166.7 Å²	166.7	90%	0.902	83%	0.826	S	S	*	*			trans	-67	111.8	168.4	-80.3	-97.3	0	0	0	110	Y471 K475	Y471-Y473 PolarHBondContact O-N 3Å; Y473-K475 PolarHBondContact O-N 2.97Å
474	E	29.5	Very low	27.5	Very low	194 Å²	194	168.3 Å²	168.3	91%	0.907	83%	0.834	S	S	*	*			trans	-69.1	100.1	164.3	-82.9	-173.2	158	0	0	109.7	Q472 L476	Q472-E474 PolarHBondContact O-N 2.69Å; E474-L476 PolarHBondContact O-N 2.99Å
475	K	27.7	Very low	27.3	Very low	192 Å²	192	168 Å²	168	84%	0.835	83%	0.831	S	S	*	*			trans	9	101.2	148.1	-150.9	173.7	-172.7	179.5	0	115.6	Y473 V477	Y473-K475 PolarHBondContact O-N 2.97Å; K475-V477 PolarHBondContact O-N 3.42Å; K475-V477 VanDerWaalsContact O-N 3.1Å
476	L	28.7	Very low	27.1	Very low	173 Å²	173	165.5 Å²	165.5	91%	0.906	83%	0.825	S	S	*	*			trans	-38.1	111	163	-69.1	159	0	0	0	111.2	E474 S478	E474-L476 PolarHBondContact O-N 2.99Å; L476-S478 PolarHBondContact O-N 3.46Å
477	V	28.2	Very low	27.1	Very low	140 Å²	140	161 Å²	161	85%	0.848	82%	0.818	S	S	*	*			trans	-69.5	122.3	166.3	179.4	0	0	0	0	107.2	K475	K475-V477 PolarHBondContact O-N 3.42Å; K475-V477 VanDerWaalsContact O-N 3.1Å
478	S	27.4	Very low	27	Very low	104 Å²	104	160.3 Å²	160.3	73%	0.727	82%	0.817	S	S	*	*			trans	-42.9	132.6	-179.7	47	0	0	0	0	114.2	L476	L476-S478 PolarHBondContact O-N 3.46Å
479	Q	27.4	Very low	27.1	Very low	181 Å²	181	164.9 Å²	164.9	85%	0.846	82%	0.822	S	S	*	*			trans	-47.2	138	170	-74.5	174.7	-41	0	0	112
480	P	28.9	Very low	27.2	Very low	113 Å²	113	165.6 Å²	165.6	73%	0.734	82%	0.824	S	S	*	*			trans	-72.7	131.7	171.6	24.5	-21.8	0	0	0	109.9	H482	P480-H482 PolarHBondContact O-N 3.17Å
481	N	26.8	Very low	27.1	Very low	161 Å²	161	165.6 Å²	165.6	86%	0.861	82%	0.823	S	S	*	*			trans	-42.5	102.4	173.5	-64.5	-36.2	0	0	0	112
482	H	29.9	Very low	27.2	Very low	178 Å²	178	162.3 Å²	162.3	82%	0.824	82%	0.818	S	S	*	*			trans	-86.9	105.4	154.8	-89.9	-58.2	0	0	0	107.7	P480 L484	P480-H482 PolarHBondContact O-N 3.17Å; H482-L484 PolarHBondContact O-N 2.84Å
483	E	26.7	Very low	27.2	Very low	178 Å²	178	158.4 Å²	158.4	83%	0.832	81%	0.808	S	S	*	*			trans	-48.1	109.3	170.3	-71	177.4	148.9	0	0	109.9	I485	E483-I485 PolarHBondContact O-N 3.09Å
484	L	28.9	Very low	27.1	Very low	170 Å²	170	154.8 Å²	154.8	89%	0.89	80%	0.804	S	S	*	*			trans	-63	98.1	164.1	-87	146.4	0	0	0	108	H482 S486	H482-L484 PolarHBondContact O-N 2.84Å; L484-S486 VanDerWaalsContact C-N 3.3Å; L484-S486 PolarHBondContact O-N 2.65Å
485	I	28.3	Very low	26.8	Very low	147 Å²	147	153.4 Å²	153.4	75%	0.754	80%	0.798	S	S	*	*			trans	-68.6	99.2	160.3	-63.3	177.1	0	0	0	106.5	E483 N487	E483-I485 PolarHBondContact O-N 3.09Å; I485-N487 PolarHBondContact O-N 3.23Å
486	S	24.4	Very low	26.8	Very low	96 Å²	96	150.2 Å²	150.2	67%	0.671	79%	0.789	S	S	*	*			trans	-57.3	109.4	174.3	57.1	0	0	0	0	110.9	L484	L484-S486 VanDerWaalsContact C-N 3.3Å; L484-S486 PolarHBondContact O-N 2.65Å
487	N	27.1	Very low	26.7	Very low	139 Å²	139	149.3 Å²	149.3	74%	0.743	79%	0.786	S	S	*	*			trans	-106.2	110.3	158.6	-83.6	-18.3	0	0	0	108.8	I485 Y489	I485-N487 PolarHBondContact O-N 3.23Å; N487-Y489 PolarHBondContact O-N 3.07Å
488	N	24.8	Very low	26.6	Very low	148 Å²	148	153.3 Å²	153.3	79%	0.791	79%	0.787	S	S	*	*			trans	-43.7	117.5	176.7	-69.1	-38.4	0	0	0	112.9
489	Y	26.3	Very low	26.6	Very low	221 Å²	221	156.1 Å²	156.1	87%	0.867	79%	0.793	S	S	*	*			trans	-121.9	118.3	149.8	-80.3	-81.7	0	0	0	108.7	N487 T491	N487-Y489 PolarHBondContact O-N 3.07Å; Y489-T491 PolarHBondContact O-N 3.32Å
490	H	25.5	Very low	26.9	Very low	180 Å²	180	152.4 Å²	152.4	83%	0.833	79%	0.785	S	S	*	*			trans	-51.2	119.1	179.5	-88.4	-84.9	0	0	0	111.6	I492	H490-I492 PolarHBondContact O-N 3.45Å
491	T	25.1	Very low	26.8	Very low	122 Å²	122	154.6 Å²	154.6	75%	0.748	79%	0.79	S	S	*	*			trans	-61.7	100.2	163.8	-37.2	0	0	0	0	108.6	Y489 T493	Y489-T491 PolarHBondContact O-N 3.32Å; T491-T493 HydrophobicContact CG2-CG2 4.03Å; T491-T493 PolarHBondContact O-N 3.19Å
492	I	26.6	Very low	26.8	Very low	148 Å²	148	153.7 Å²	153.7	76%	0.759	79%	0.786	S	S	*	*			trans	-80.8	93.8	161.5	-61.2	176.3	0	0	0	105.7	H490 N494	H490-I492 PolarHBondContact O-N 3.45Å; I492-N494 PolarHBondContact O-N 2.72Å
493	T	24.8	Very low	26.6	Very low	112 Å²	112	151.8 Å²	151.8	69%	0.687	78%	0.781	S	S	*	*			trans	-70.5	105	165.5	43.9	0	0	0	0	108.5	T491	T491-T493 HydrophobicContact CG2-CG2 4.03Å; T491-T493 PolarHBondContact O-N 3.19Å
494	N	26.2	Very low	26.6	Very low	153 Å²	153	152.8 Å²	152.8	82%	0.818	79%	0.788	S	S	*	*			trans	-123.9	96.8	153.3	-96.6	-11.5	0	0	0	107.4	I492	I492-N494 PolarHBondContact O-N 2.72Å
495	E	23.6	Very low	26.5	Very low	166 Å²	166	149.3 Å²	149.3	78%	0.776	78%	0.779	S	S	*	*			trans	-65.9	149.1	160.9	-71.5	179.7	147.9	0	0	109.6
496	N	26.8	Very low	26.4	Very low	124 Å²	124	148.8 Å²	148.8	66%	0.663	78%	0.782	S	S	*	*			trans	81.5	85.1	165.7	-48	-44.4	0	0	0	116.4
497	D	27.9	Very low	26.5	Very low	155 Å²	155	151.6 Å²	151.6	83%	0.829	79%	0.787	S	S	*	*			trans	-141.2	90.2	136.6	-89.8	-36.6	0	0	0	109.2	L499	D497-L499 PolarHBondContact O-N 3.36Å; D497-L499 VanDerWaalsContact O-N 3.09Å
498	Y	25.3	Very low	26.3	Very low	224 Å²	224	152.2 Å²	152.2	88%	0.878	79%	0.79	S	S	*	*			trans	-61.6	99.9	157.9	-88.7	-96.7	0	0	0	107.7	P500	Y498-P500 WeakPolarHBondContact O-CD 3.4Å
499	L	27.8	Very low	26.4	Very low	162 Å²	162	155 Å²	155	85%	0.848	79%	0.789	S	S	*	*			trans	-89.2	116.1	166.7	-87.7	159	0	0	0	109.1	D497	D497-L499 PolarHBondContact O-N 3.36Å; D497-L499 VanDerWaalsContact O-N 3.09Å
500	P	32.6	Very low	26.2	Very low	104 Å²	104	151.2 Å²	151.2	68%	0.675	78%	0.784	S	S	*	*			trans	-81.2	151.4	-174.7	33.1	-33.1	0	0	0	111.4	Y498 N502	Y498-P500 WeakPolarHBondContact O-CD 3.4Å; P500-N502 PolarHBondContact O-N 3.37Å
501	N	27.5	Very low	26.5	Very low	159 Å²	159	148.8 Å²	148.8	85%	0.85	78%	0.778	S	S	*	*			trans	-29	117.4	158.4	-85	-22.2	0	0	0	112
502	N	26.6	Very low	26.5	Very low	142 Å²	142	152.4 Å²	152.4	76%	0.759	78%	0.779	S	S	*	*			trans	-162.5	115.1	146.4	-95.1	-27.7	0	0	0	111.2	P500	P500-N502 PolarHBondContact O-N 3.37Å
503	N	26.5	Very low	26.7	Very low	137 Å²	137	149.3 Å²	149.3	73%	0.733	77%	0.769	S	S	*	*			trans	49.8	88.1	146.3	-61	-20	0	0	0	116.7	S505	N503-S505 PolarHBondContact O-N 3.44Å
504	M	25.6	Very low	26.8	Very low	199 Å²	199	148.5 Å²	148.5	98%	0.98	77%	0.765	S	S	*	*			trans	-59.8	82	150.6	-77.7	179.6	88.6	0	0	108.5	T506	M504-T506 PolarHBondContact O-N 3.28Å
505	S	27.6	Very low	26.8	Very low	98 Å²	98	147.4 Å²	147.4	69%	0.685	77%	0.766	S	S	*	*			trans	-67.1	125.2	158.7	46.3	0	0	0	0	106.8	N503 M507	N503-S505 PolarHBondContact O-N 3.44Å; S505-M507 PolarHBondContact O-N 3.02Å
506	T	27	Very low	27.4	Very low	136 Å²	136	147.1 Å²	147.1	83%	0.834	76%	0.759	S	S	*	*			trans	-33.7	89.2	174.8	47.1	0	0	0	0	113	M504 N508	M504-T506 PolarHBondContact O-N 3.28Å; T506-N508 PolarHBondContact O-N 3.37Å; T506-N508 VanDerWaalsContact O-N 3.16Å
507	M	24.8	Very low	27.2	Very low	154 Å²	154	151.2 Å²	151.2	76%	0.759	77%	0.771	S	S	*	*			trans	-71.2	103.9	158.3	-89.7	-170.7	174.1	0	0	106.1	S505 W509	S505-M507 PolarHBondContact O-N 3.02Å; M507-W509 VanDerWaalsContact C-N 3.26Å; M507-W509 PolarHBondContact O-N 3.1Å
508	N	23.9	Very low	27.2	Very low	153 Å²	153	147.6 Å²	147.6	82%	0.818	76%	0.758	S	S	*	*			trans	-59.5	95.1	163.3	-101.5	-13.3	0	0	0	107.4	T506 N510	T506-N508 PolarHBondContact O-N 3.37Å; T506-N508 VanDerWaalsContact O-N 3.16Å; N508-N510 VanDerWaalsContact C-N 3.3Å; N508-N510 PolarHBondContact O-N 3.48Å
509	W	26.3	Very low	27.3	Very low	205 Å²	205	144.8 Å²	144.8	78%	0.777	76%	0.757	S	S	*	*			trans	-66.1	95.8	165.6	-69.7	86.9	0	0	0	106.9	M507 N511	M507-W509 VanDerWaalsContact C-N 3.26Å; M507-W509 PolarHBondContact O-N 3.1Å; W509-N511 PolarHBondContact O-N 3.36Å
510	N	22.9	Very low	27.3	Very low	142 Å²	142	141.6 Å²	141.6	76%	0.759	74%	0.744	S	S	*	*			trans	-65.3	91.1	163	-102.5	-6.9	0	0	0	106.8	N508 Y512	N508-N510 VanDerWaalsContact C-N 3.3Å; N508-N510 PolarHBondContact O-N 3.48Å; N510-Y512 PolarHBondContact O-N 3.44Å
511	N	31.8	Very low	27	Very low	130 Å²	130	145.3 Å²	145.3	70%	0.695	75%	0.75	S	S	*	*			trans	-70	26.6	-178	-78.1	-17.8	0	0	0	114	W509 P513	W509-N511 PolarHBondContact O-N 3.36Å; N511-P513 WeakPolarHBondContact O-CD 3.48Å
512	Y	24	Very low	27.1	Very low	197 Å²	197	145.3 Å²	145.3	77%	0.773	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-79.3	121.9	167.8	-76.6	-79.4	0	0	0	108.1	N510	N510-Y512 PolarHBondContact O-N 3.44Å
513	P	31	Very low	27.4	Very low	84 Å²	84	148.8 Å²	148.8	55%	0.545	75%	0.753	S	S	.	*	P	Polyproline II helix	trans	-57.5	134.6	177.4	21.5	-30.1	0	0	0	109.7	N511	N511-P513 WeakPolarHBondContact O-CD 3.48Å
514	P	27.2	Very low	27.5	Very low	95 Å²	95	149.4 Å²	149.4	62%	0.617	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-63.6	149.9	-178.8	23.9	-31.6	0	0	0	111.3	Y516	P514-Y516 PolarHBondContact O-N 3.24Å
515	P	26.7	Very low	27.6	Very low	129 Å²	129	146.7 Å²	146.7	84%	0.838	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-64.8	133.8	-175.3	23.7	-31.5	0	0	0	112.9
516	Y	35.2	Very low	27.6	Very low	160 Å²	160	149.4 Å²	149.4	63%	0.627	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-69.7	144	-164.3	-63.6	-93.4	0	0	0	115.8	P514	P514-Y516 PolarHBondContact O-N 3.24Å
517	K	23	Very low	27.6	Very low	210 Å²	210	150.2 Å²	150.2	91%	0.913	74%	0.741	S	S	*	*			trans	-113.2	105.3	146.7	-76.5	-175.9	178.3	178.7	0	107.6
518	S	28.4	Very low	27.8	Very low	80 Å²	80	150 Å²	150	56%	0.559	74%	0.739	S	S	*	*			trans	-79.2	132.9	173.3	56.3	0	0	0	0	110
519	I	26.2	Very low	28	Very low	164 Å²	164	149.8 Å²	149.8	84%	0.841	73%	0.734	S	S	*	*			trans	-100.3	104.9	163	-59.6	174.1	0	0	0	106.1
520	T	27.6	Very low	28.1	Very low	96 Å²	96	145.9 Å²	145.9	59%	0.589	73%	0.731	S	S	*	*			trans	-77.6	130.5	169	11.6	0	0	0	0	108.8
521	K	27.1	Very low	28.5	Very low	182 Å²	182	146.2 Å²	146.2	79%	0.791	73%	0.729	S	S	*	*			trans	-121.2	115.4	167.3	-155.2	177.1	-173.1	177.5	0	107.3
522	D	29.3	Very low	28.3	Very low	158 Å²	158	147.5 Å²	147.5	85%	0.845	73%	0.732	S	S	*	*			trans	-67.1	131.6	175.8	-64.3	-34.6	0	0	0	109.1
523	Y	33.4	Very low	28.7	Very low	215 Å²	215	143 Å²	143	84%	0.843	73%	0.728	S	S	*	*			trans	-85.7	0	-180	-82	-73.1	0	0	0	113

Retrieved 523 of 523 residues in 1217.8 ms (Link to these results)

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