A0A060WDV9_ONCMY Loading...

Hydroxysteroid (17-beta) dehydrogenase 2

AlphaFold DB , UniProt , Accession A0A060WDV9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene hsd17b2, Length 391 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	47.7	Very low	61	Low	211 Å²	211	127.5 Å²	127.5	100%	1.039	61%	0.614	S	S	*	*				0	-29.7	0	-137.5	161.8	74.5	0	0	111.6
2	E	52.3	Low	61.3	Low	163 Å²	163	119.2 Å²	119.2	76%	0.762	58%	0.579	S	S	*	*	H	α-helix	trans	-72.9	-25	-179.4	-69.2	174.8	146.7	0	0	116.3	V4	E2-V4 PolarHBondContact O-N 3.46Å
3	S	53.1	Low	61.9	Low	88 Å²	88	114.9 Å²	114.9	62%	0.615	57%	0.569	S	S	*	*	H	α-helix	trans	-73.4	-25.3	-176.7	62	0	0	0	0	114.1	E7	S3-E7 PolarHBondContact O-N 3.16Å
4	V	54.8	Low	62.3	Low	101 Å²	101	110.9 Å²	110.9	61%	0.612	55%	0.551	S	S	*	*	H	α-helix	trans	-76.1	-34.2	-178.6	178.3	0	0	0	0	110.9	E2 F8	E2-V4 PolarHBondContact O-N 3.46Å; V4-F8 WeakPolarHBondContact O-CB 3.4Å; V4-F8 PolarHBondContact O-N 3.49Å; V4-F8 VanDerWaalsContact O-N 3.16Å
5	D	58.6	Low	62.5	Low	93 Å²	93	105.1 Å²	105.1	50%	0.497	52%	0.52	S	S	.	.	H	α-helix	trans	-69.4	-39.8	177.6	-74.9	-38.9	0	0	0	111.5	F8 W9	D5-F8 PolarHBondContact O-N 2.9Å; D5-W9 WeakPolarHBondContact O-CB 3.24Å; D5-W9 PolarHBondContact O-N 2.93Å
6	I	66.5	Low	62.7	Low	123 Å²	123	103.9 Å²	103.9	63%	0.631	52%	0.52	S	S	*	.	H	α-helix	trans	-65.9	-44.3	-179	-64.2	170.9	0	0	0	111.5	Y10	I6-Y10 VanDerWaalsContact O-CB 3.24Å; I6-Y10 WeakPolarHBondContact O-CB 3.5Å; I6-Y10 PolarHBondContact O-N 2.93Å
7	E	66.3	Low	63	Low	126 Å²	126	103.6 Å²	103.6	59%	0.589	52%	0.519	S	S	*	.	H	α-helix	trans	-62.5	-44.1	174.8	-84.6	-162.5	152.2	0	0	111.4	S3 W9 Y10 F11	S3-E7 PolarHBondContact O-N 3.16Å; E7-W9 PolarHBondContact O-N 3.32Å; E7-Y10 PolarHBondContact O-N 3.47Å; E7-F11 HydrophobicContact CB-CD2 4.25Å; E7-F11 HydrophobicContact CB-CE2 4.24Å; E7-F11 HydrophobicContact CG-CE2 4.35Å; E7-F11 WeakPolarHBondContact O-CB 3.07Å; E7-F11 WeakPolarHBondContact O-CD2 3.5Å; E7-F11 PolarHBondContact O-N 3.3Å
8	F	67.3	Low	63	Low	109 Å²	109	99.6 Å²	99.6	48%	0.478	50%	0.501	S	S	.	.	H	α-helix	trans	-58.9	-48.9	178.6	178.9	-96.8	0	0	0	112	V4 D5 F11 S12	V4-F8 WeakPolarHBondContact O-CB 3.4Å; V4-F8 PolarHBondContact O-N 3.49Å; V4-F8 VanDerWaalsContact O-N 3.16Å; D5-F8 PolarHBondContact O-N 2.9Å; F8-F11 PolarHBondContact O-N 2.89Å; F8-S12 VanDerWaalsContact O-CB 3.24Å; F8-S12 WeakPolarHBondContact O-CB 3.37Å; F8-S12 PolarHBondContact O-N 3.49Å
9	W	68.1	Low	63	Low	163 Å²	163	96 Å²	96	62%	0.617	49%	0.485	S	S	*	.	H	α-helix	trans	-64.9	-40.4	177.8	-75.9	111.5	0	0	0	112.1	D5 E7 S12 S13	D5-W9 WeakPolarHBondContact O-CB 3.24Å; D5-W9 PolarHBondContact O-N 2.93Å; E7-W9 PolarHBondContact O-N 3.32Å; W9-S12 PolarHBondContact O-N 2.97Å; W9-S13 WeakPolarHBondContact O-CB 3.42Å; W9-S13 PolarHBondContact O-N 3.36Å; W9-S13 PolarHBondContact O-OG 2.9Å; W9-S13 VanDerWaalsContact O-OG 3.06Å
10	Y	71.7	Confident	63.1	Low	155 Å²	155	94.2 Å²	94.2	61%	0.608	49%	0.486	S	S	*	.	H	α-helix	trans	-62	-49.2	176.8	-176.9	-95	0	0	0	112.2	I6 E7 S13 L14	I6-Y10 VanDerWaalsContact O-CB 3.24Å; I6-Y10 WeakPolarHBondContact O-CB 3.5Å; I6-Y10 PolarHBondContact O-N 2.93Å; E7-Y10 PolarHBondContact O-N 3.47Å; Y10-S13 PolarHBondContact O-N 3.48Å; Y10-L14 WeakPolarHBondContact O-CB 3.37Å; Y10-L14 PolarHBondContact O-N 3.43Å
11	F	64.6	Low	63.1	Low	70 Å²	70	95.7 Å²	95.7	31%	0.307	49%	0.494	S	S	.	.	H	α-helix	trans	-67.3	-36.9	178.1	-75.6	-64.5	0	0	0	112.2	E7 F8 Y15	E7-F11 HydrophobicContact CB-CD2 4.25Å; E7-F11 HydrophobicContact CB-CE2 4.24Å; E7-F11 HydrophobicContact CG-CE2 4.35Å; E7-F11 WeakPolarHBondContact O-CB 3.07Å; E7-F11 WeakPolarHBondContact O-CD2 3.5Å; E7-F11 PolarHBondContact O-N 3.3Å; F8-F11 PolarHBondContact O-N 2.89Å; F11-Y15 WeakPolarHBondContact O-CB 3.24Å; F11-Y15 PolarHBondContact O-N 3.42Å
12	S	65.3	Low	63.7	Low	28 Å²	28	89 Å²	89	20%	0.196	46%	0.457	C	S	.	.	H	α-helix	trans	-63.8	-46.7	175.1	-172.5	0	0	0	0	111.5	F8 W9 Y15 T16	F8-S12 VanDerWaalsContact O-CB 3.24Å; F8-S12 WeakPolarHBondContact O-CB 3.37Å; F8-S12 PolarHBondContact O-N 3.49Å; W9-S12 PolarHBondContact O-N 2.97Å; S12-Y15 PolarHBondContact O-N 3.06Å; S12-T16 PolarHBondContact O-N 3.01Å; S12-T16 PolarHBondContact O-OG1 2.84Å
13	S	68.6	Low	64.1	Low	64 Å²	64	84.8 Å²	84.8	45%	0.448	44%	0.439	S	S	.	.	H	α-helix	trans	-64.4	-42.8	177.8	-63.6	0	0	0	0	112	W9 Y10 Y15 T16 I17	W9-S13 WeakPolarHBondContact O-CB 3.42Å; W9-S13 PolarHBondContact O-N 3.36Å; W9-S13 PolarHBondContact O-OG 2.9Å; W9-S13 VanDerWaalsContact O-OG 3.06Å; Y10-S13 PolarHBondContact O-N 3.48Å; S13-Y15 VanDerWaalsContact C-N 3.34Å; S13-Y15 PolarHBondContact O-N 3.46Å; S13-T16 PolarHBondContact O-N 2.92Å; S13-I17 WeakPolarHBondContact O-CD1 3.25Å; S13-I17 VanDerWaalsContact O-CG1 3.25Å; S13-I17 WeakPolarHBondContact O-CG1 3.49Å; S13-I17 PolarHBondContact O-N 3.16Å
14	L	67.3	Low	64.5	Low	59 Å²	59	82.2 Å²	82.2	31%	0.309	43%	0.426	S	S	.	.	H	α-helix	trans	-61.9	-42.6	175.9	-174.2	65.3	0	0	0	111.5	Y10 I17 V18 L61	Y10-L14 WeakPolarHBondContact O-CB 3.37Å; Y10-L14 PolarHBondContact O-N 3.43Å; L14-I17 PolarHBondContact O-N 2.93Å; L14-V18 HydrophobicContact CD1-CG2 4.43Å; L14-V18 WeakPolarHBondContact O-CB 3.3Å; L14-V18 VanDerWaalsContact O-CG2 3.3Å; L14-V18 WeakPolarHBondContact O-CG2 3.49Å; L14-V18 PolarHBondContact O-N 2.96Å; L14-L61 HydrophobicContact CD2-CD2 4.12Å
15	Y	66.1	Low	64.6	Low	24 Å²	24	79.3 Å²	79.3	9%	0.094	41%	0.413	C	S	.	.	H	α-helix	trans	-61	-46.1	176.7	-176.4	-86.4	0	0	0	111.9	F11 S12 S13 I17 T19 G48 F52 L64	F11-Y15 WeakPolarHBondContact O-CB 3.24Å; F11-Y15 PolarHBondContact O-N 3.42Å; S12-Y15 PolarHBondContact O-N 3.06Å; S13-Y15 VanDerWaalsContact C-N 3.34Å; S13-Y15 PolarHBondContact O-N 3.46Å; Y15-I17 PolarHBondContact O-N 2.9Å; Y15-T19 VanDerWaalsContact O-CB 3.26Å; Y15-T19 WeakPolarHBondContact O-CB 3.39Å; Y15-T19 PolarHBondContact O-N 2.93Å; Y15-T19 PolarHBondContact O-OG1 3.07Å; Y15-G48 WeakPolarHBondContact OH-CA 3.22Å; Y15-G48 PolarHBondContact OH-O 3.49Å; Y15-G48 VanDerWaalsContact OH-O 3.06Å; Y15-F52 HydrophobicContact CD1-CD2 4.43Å; Y15-F52 AromaticContact CD2-CD2 3.91Å; Y15-F52 HydrophobicContact CD2-CD2 3.91Å; Y15-F52 HydrophobicContact CD2-CE2 4.33Å; Y15-F52 HydrophobicContact CE2-CB 4.49Å; Y15-F52 HydrophobicContact CE2-CD2 4.04Å; Y15-F52 HydrophobicContact CG-CD2 4.12Å; Y15-F52 HydrophobicContact CG-CE2 4.24Å; Y15-L64 HydrophobicContact CD2-CD2 3.84Å; Y15-L64 HydrophobicContact CE2-CB 4.15Å; Y15-L64 HydrophobicContact CE2-CD2 3.45Å; Y15-L64 VanDerWaalsContact CE2-CD2 3.45Å; Y15-L64 HydrophobicContact CE2-CG 4.2Å
16	T	65.4	Low	64.5	Low	85 Å²	85	76 Å²	76	52%	0.521	40%	0.396	S	S	.	.	H	α-helix	trans	-63.1	-42.3	177.5	-53.1	0	0	0	0	111.8	S12 S13 T19 A20	S12-T16 PolarHBondContact O-N 3.01Å; S12-T16 PolarHBondContact O-OG1 2.84Å; S13-T16 PolarHBondContact O-N 2.92Å; T16-T19 PolarHBondContact O-N 2.88Å; T16-A20 VanDerWaalsContact O-CB 3.3Å; T16-A20 WeakPolarHBondContact O-CB 3.2Å; T16-A20 PolarHBondContact O-N 3.5Å
17	I	66.8	Low	64	Low	99 Å²	99	75.1 Å²	75.1	51%	0.508	39%	0.391	S	S	.	.	H	α-helix	trans	-65.3	-48.1	179.3	-68.3	165.7	0	0	0	111	S13 L14 Y15 T19 A20 L21	S13-I17 WeakPolarHBondContact O-CD1 3.25Å; S13-I17 VanDerWaalsContact O-CG1 3.25Å; S13-I17 WeakPolarHBondContact O-CG1 3.49Å; S13-I17 PolarHBondContact O-N 3.16Å; L14-I17 PolarHBondContact O-N 2.93Å; Y15-I17 PolarHBondContact O-N 2.9Å; I17-T19 VanDerWaalsContact C-N 3.32Å; I17-T19 PolarHBondContact O-N 3Å; I17-A20 PolarHBondContact O-N 2.99Å; I17-L21 HydrophobicContact CG2-CD1 3.91Å; I17-L21 HydrophobicContact CG2-CG 4.42Å; I17-L21 WeakPolarHBondContact O-CB 3.34Å; I17-L21 WeakPolarHBondContact O-CG 3.48Å; I17-L21 PolarHBondContact O-N 3.35Å
18	V	63.2	Low	63.5	Low	32 Å²	32	73.8 Å²	73.8	19%	0.194	39%	0.392	C	S	.	.	H	α-helix	trans	-61.6	-42.8	178.1	172	0	0	0	0	110.7	L14 Y22 L64 L68	L14-V18 HydrophobicContact CD1-CG2 4.43Å; L14-V18 WeakPolarHBondContact O-CB 3.3Å; L14-V18 VanDerWaalsContact O-CG2 3.3Å; L14-V18 WeakPolarHBondContact O-CG2 3.49Å; L14-V18 PolarHBondContact O-N 2.96Å; V18-Y22 HydrophobicContact CG1-CD2 4.1Å; V18-Y22 HydrophobicContact CG1-CE2 4.46Å; V18-Y22 WeakPolarHBondContact O-CB 3.39Å; V18-Y22 PolarHBondContact O-N 3.46Å; V18-L64 HydrophobicContact CG1-CD2 4.5Å; V18-L68 HydrophobicContact CG1-CD1 4.47Å
19	T	64.1	Low	62.8	Low	31 Å²	31	72.3 Å²	72.3	19%	0.19	39%	0.385	C	S	.	.	H	α-helix	trans	-62.6	-46.1	177	-57.3	0	0	0	0	111.2	Y15 T16 I17 Y22 I23 L64	Y15-T19 VanDerWaalsContact O-CB 3.26Å; Y15-T19 WeakPolarHBondContact O-CB 3.39Å; Y15-T19 PolarHBondContact O-N 2.93Å; Y15-T19 PolarHBondContact O-OG1 3.07Å; T16-T19 PolarHBondContact O-N 2.88Å; I17-T19 VanDerWaalsContact C-N 3.32Å; I17-T19 PolarHBondContact O-N 3Å; T19-Y22 PolarHBondContact O-N 2.88Å; T19-I23 HydrophobicContact CG2-CD1 3.63Å; T19-I23 HydrophobicContact CG2-CG1 4.28Å; T19-I23 WeakPolarHBondContact O-CB 3.3Å; T19-I23 WeakPolarHBondContact O-CG1 3.26Å; T19-I23 PolarHBondContact O-N 2.95Å; T19-L64 WeakPolarHBondContact OG1-CD2 3.39Å
20	A	63.8	Low	62	Low	60 Å²	60	65.2 Å²	65.2	50%	0.496	36%	0.361	S	S	.	.	H	α-helix	trans	-64.8	-43.6	179.8	0	0	0	0	0	112.7	T16 I17 Y22 I23 G24	T16-A20 VanDerWaalsContact O-CB 3.3Å; T16-A20 WeakPolarHBondContact O-CB 3.2Å; T16-A20 PolarHBondContact O-N 3.5Å; I17-A20 PolarHBondContact O-N 2.99Å; A20-Y22 PolarHBondContact O-N 2.71Å; A20-I23 PolarHBondContact O-N 3.44Å; A20-G24 PolarHBondContact O-N 3.33Å
21	L	63.3	Low	60.9	Low	125 Å²	125	68.5 Å²	68.5	65%	0.654	37%	0.372	S	S	*	.	H	α-helix	trans	-62.9	-42	177.1	-72	173.5	0	0	0	111.7	I17 G24 A25	I17-L21 HydrophobicContact CG2-CD1 3.91Å; I17-L21 HydrophobicContact CG2-CG 4.42Å; I17-L21 WeakPolarHBondContact O-CB 3.34Å; I17-L21 WeakPolarHBondContact O-CG 3.48Å; I17-L21 PolarHBondContact O-N 3.35Å; L21-G24 PolarHBondContact O-N 3.5Å; L21-A25 PolarHBondContact O-N 3.37Å
22	Y	60.5	Low	60	Low	70 Å²	70	69 Å²	69	28%	0.275	40%	0.396	S	S	.	.	H	α-helix	trans	-72.5	-39.7	177.4	-97.5	-86.9	0	0	0	113.1	V18 T19 A20 G24 A25 I26 L68	V18-Y22 HydrophobicContact CG1-CD2 4.1Å; V18-Y22 HydrophobicContact CG1-CE2 4.46Å; V18-Y22 WeakPolarHBondContact O-CB 3.39Å; V18-Y22 PolarHBondContact O-N 3.46Å; T19-Y22 PolarHBondContact O-N 2.88Å; A20-Y22 PolarHBondContact O-N 2.71Å; Y22-G24 VanDerWaalsContact C-N 3.27Å; Y22-G24 PolarHBondContact O-N 2.94Å; Y22-A25 PolarHBondContact O-N 3.3Å; Y22-I26 WeakPolarHBondContact O-CB 3.14Å; Y22-I26 WeakPolarHBondContact O-CG1 3.43Å; Y22-I26 PolarHBondContact O-N 3.05Å; Y22-L68 HydrophobicContact CD1-CB 3.63Å; Y22-L68 HydrophobicContact CD1-CD1 4.18Å; Y22-L68 HydrophobicContact CD1-CD2 4.23Å; Y22-L68 HydrophobicContact CD1-CG 4.23Å; Y22-L68 HydrophobicContact CD2-CB 4.42Å; Y22-L68 HydrophobicContact CD2-CD1 3.82Å; Y22-L68 HydrophobicContact CE1-CB 3.73Å; Y22-L68 HydrophobicContact CE2-CD1 4.47Å; Y22-L68 HydrophobicContact CG-CB 3.98Å; Y22-L68 HydrophobicContact CG-CD1 3.64Å; Y22-L68 HydrophobicContact CG-CD2 4.26Å; Y22-L68 HydrophobicContact CG-CG 4.18Å
23	I	61.5	Low	59	Low	76 Å²	76	69.3 Å²	69.3	39%	0.39	40%	0.399	S	S	.	.	H	α-helix	trans	-59	-42.7	172.6	-72.4	171.7	0	0	0	109.8	T19 A20 I26 I27	T19-I23 HydrophobicContact CG2-CD1 3.63Å; T19-I23 HydrophobicContact CG2-CG1 4.28Å; T19-I23 WeakPolarHBondContact O-CB 3.3Å; T19-I23 WeakPolarHBondContact O-CG1 3.26Å; T19-I23 PolarHBondContact O-N 2.95Å; A20-I23 PolarHBondContact O-N 3.44Å; I23-I26 PolarHBondContact O-N 3.47Å; I23-I27 HydrophobicContact CG2-CD1 3.51Å; I23-I27 HydrophobicContact CG2-CG1 4.19Å; I23-I27 WeakPolarHBondContact O-CB 3.39Å; I23-I27 VanDerWaalsContact O-CG1 3.23Å; I23-I27 WeakPolarHBondContact O-CG1 3.44Å; I23-I27 PolarHBondContact O-N 3.35Å
24	G	60	Low	58.3	Low	33 Å²	33	72.7 Å²	72.7	34%	0.34	41%	0.407	S	S	.	.	H	α-helix	trans	-60.2	-44.9	173.6	0	0	0	0	0	113.2	A20 L21 Y22 I26 I27 T28	A20-G24 PolarHBondContact O-N 3.33Å; L21-G24 PolarHBondContact O-N 3.5Å; Y22-G24 VanDerWaalsContact C-N 3.27Å; Y22-G24 PolarHBondContact O-N 2.94Å; G24-I26 VanDerWaalsContact C-N 3.34Å; G24-I26 PolarHBondContact O-N 3.42Å; G24-I27 PolarHBondContact O-N 3.46Å; G24-T28 WeakPolarHBondContact O-CB 3.48Å; G24-T28 VanDerWaalsContact O-CG2 3.28Å; G24-T28 WeakPolarHBondContact O-CG2 3.27Å; G24-T28 PolarHBondContact O-N 2.93Å; G24-T28 PolarHBondContact O-OG1 2.96Å
25	A	58.6	Low	57.5	Low	41 Å²	41	75.3 Å²	75.3	34%	0.339	42%	0.422	S	S	.	.	H	α-helix	trans	-65.4	-35	175.6	0	0	0	0	0	112.9	L21 Y22 T28 K29	L21-A25 PolarHBondContact O-N 3.37Å; Y22-A25 PolarHBondContact O-N 3.3Å; A25-T28 WeakPolarHBondContact CA-OG1 3.31Å; A25-T28 PolarHBondContact O-OG1 3.29Å; A25-T28 VanDerWaalsContact O-OG1 3.07Å; A25-K29 WeakPolarHBondContact O-CB 3.17Å; A25-K29 PolarHBondContact O-N 3.25Å
26	I	56	Low	56.6	Low	24 Å²	24	79.4 Å²	79.4	12%	0.123	44%	0.437	C	S	.	.	H	α-helix	trans	-69.9	-48.7	175.6	-69.6	169.4	0	0	0	110.2	Y22 I23 G24 T28 K29 A30 F41 L68 C71 L75	Y22-I26 WeakPolarHBondContact O-CB 3.14Å; Y22-I26 WeakPolarHBondContact O-CG1 3.43Å; Y22-I26 PolarHBondContact O-N 3.05Å; I23-I26 PolarHBondContact O-N 3.47Å; G24-I26 VanDerWaalsContact C-N 3.34Å; G24-I26 PolarHBondContact O-N 3.42Å; I26-T28 PolarHBondContact O-N 2.91Å; I26-K29 PolarHBondContact O-N 3.08Å; I26-A30 WeakPolarHBondContact O-CB 3.21Å; I26-A30 PolarHBondContact O-N 2.83Å; I26-F41 HydrophobicContact CG2-CD1 3.64Å; I26-F41 HydrophobicContact CG2-CE1 3.3Å; I26-F41 HydrophobicContact CG2-CZ 4.09Å; I26-L68 HydrophobicContact CD1-CD2 4.05Å; I26-C71 HydrophobicContact CD1-CB 4.44Å; I26-L75 HydrophobicContact CB-CD1 4.33Å; I26-L75 HydrophobicContact CD1-CD1 4.29Å; I26-L75 HydrophobicContact CG1-CD1 3.69Å; I26-L75 HydrophobicContact CG2-CD1 4.03Å
27	I	56.6	Low	56.1	Low	103 Å²	103	76.9 Å²	76.9	53%	0.528	42%	0.419	S	S	.	.	H	α-helix	trans	-62.5	-42.8	-179.3	-71	170.3	0	0	0	111.2	I23 G24 K29	I23-I27 HydrophobicContact CG2-CD1 3.51Å; I23-I27 HydrophobicContact CG2-CG1 4.19Å; I23-I27 WeakPolarHBondContact O-CB 3.39Å; I23-I27 VanDerWaalsContact O-CG1 3.23Å; I23-I27 WeakPolarHBondContact O-CG1 3.44Å; I23-I27 PolarHBondContact O-N 3.35Å; G24-I27 PolarHBondContact O-N 3.46Å; I27-K29 VanDerWaalsContact C-N 3.28Å; I27-K29 PolarHBondContact O-N 2.8Å
28	T	55.6	Low	55.4	Low	99 Å²	99	78.6 Å²	78.6	61%	0.607	42%	0.42	S	S	*	.	H	α-helix	trans	-65.1	-31.9	177.5	47.7	0	0	0	0	112.4	G24 A25 I26	G24-T28 WeakPolarHBondContact O-CB 3.48Å; G24-T28 VanDerWaalsContact O-CG2 3.28Å; G24-T28 WeakPolarHBondContact O-CG2 3.27Å; G24-T28 PolarHBondContact O-N 2.93Å; G24-T28 PolarHBondContact O-OG1 2.96Å; A25-T28 WeakPolarHBondContact CA-OG1 3.31Å; A25-T28 PolarHBondContact O-OG1 3.29Å; A25-T28 VanDerWaalsContact O-OG1 3.07Å; I26-T28 PolarHBondContact O-N 2.91Å
29	K	52.4	Low	54.9	Low	78 Å²	78	84.3 Å²	84.3	34%	0.339	44%	0.439	S	S	.	.	H	α-helix	trans	-88.5	-28.6	-179.5	-158.7	175.9	-169.6	-176.4	0	113.9	A25 I26 I27 R31 Y72 L75	A25-K29 WeakPolarHBondContact O-CB 3.17Å; A25-K29 PolarHBondContact O-N 3.25Å; I26-K29 PolarHBondContact O-N 3.08Å; I27-K29 VanDerWaalsContact C-N 3.28Å; I27-K29 PolarHBondContact O-N 2.8Å; K29-R31 PolarHBondContact O-N 3.45Å; K29-Y72 PolarHBondContact NZ-O 3.37Å; K29-L75 HydrophobicContact CD-CB 4.34Å; K29-L75 VanDerWaalsContact CE-O 3.24Å; K29-L75 WeakPolarHBondContact CE-O 3.22Å
30	A	50.5	Low	54.3	Low	14 Å²	14	86.1 Å²	86.1	12%	0.116	45%	0.449	C	S	.	.	S	Bend	trans	-76	-5.7	178.8	0	0	0	0	0	114	I26 G32 S33 F41	I26-A30 WeakPolarHBondContact O-CB 3.21Å; I26-A30 PolarHBondContact O-N 2.83Å; A30-G32 PolarHBondContact O-N 3.47Å; A30-S33 PolarHBondContact O-N 2.79Å; A30-F41 HydrophobicContact CB-CE2 4.04Å; A30-F41 HydrophobicContact CB-CZ 3.84Å
31	R	48.2	Very low	53.9	Low	224 Å²	224	85 Å²	85	85%	0.845	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	10.8	177.9	-90.7	-176.9	171	179.3	-2.3	115.9	K29	K29-R31 PolarHBondContact O-N 3.45Å
32	G	47.2	Very low	53.6	Low	79 Å²	79	80.7 Å²	80.7	81%	0.814	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.1	21.1	176.5	0	0	0	0	0	115.1	A30	A30-G32 PolarHBondContact O-N 3.47Å
33	S	43.8	Very low	53.3	Low	36 Å²	36	83.3 Å²	83.3	25%	0.252	43%	0.434	S	S	.	.			trans	-117.7	145.5	-171.4	-172.9	0	0	0	0	115.3	A30 E37	A30-S33 PolarHBondContact O-N 2.79Å; S33-E37 WeakPolarHBondContact CB-OE2 3.37Å; S33-E37 PolarHBondContact OG-OE1 3.01Å; S33-E37 PolarHBondContact OG-OE2 3.06Å
34	H	54.2	Low	53	Low	134 Å²	134	82.2 Å²	82.2	62%	0.62	43%	0.429	S	S	*	.			trans	-71.5	152.3	-179.5	-101	-54	0	0	0	114	R36 E37	H34-R36 PolarHBondContact O-N 3.31Å; H34-E37 PolarHBondContact O-N 3.27Å; H34-E37 VanDerWaalsContact O-N 3.13Å
35	D	49	Very low	52.9	Low	114 Å²	114	83.5 Å²	83.5	61%	0.61	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-37.3	-24.4	-174.4	-66.4	-19.8	0	0	0	118.7	E37 Y38	D35-E37 VanDerWaalsContact C-N 3.27Å; D35-E37 PolarHBondContact O-N 3.39Å; D35-Y38 PolarHBondContact O-N 2.85Å
36	R	48.7	Very low	52.8	Low	110 Å²	110	87.2 Å²	87.2	42%	0.415	45%	0.45	S	S	.	.	H	α-helix	trans	-66.3	-28.9	179.4	-163	177.2	-166.5	173.7	6.9	112.8	H34 Y38 T40 T343	H34-R36 PolarHBondContact O-N 3.31Å; R36-Y38 VanDerWaalsContact C-N 3.32Å; R36-T40 PolarHBondContact O-OG1 3.49Å; R36-T343 PolarHBondContact NH1-OG1 3.41Å
37	E	54.2	Low	52.9	Low	32 Å²	32	87.1 Å²	87.1	15%	0.15	46%	0.455	C	S	.	.	H	α-helix	trans	-74.4	-26.1	-178.7	-67.3	-177.6	-166.3	0	0	111.7	S33 H34 D35 W39 T40 F41 L75	S33-E37 WeakPolarHBondContact CB-OE2 3.37Å; S33-E37 PolarHBondContact OG-OE1 3.01Å; S33-E37 PolarHBondContact OG-OE2 3.06Å; H34-E37 PolarHBondContact O-N 3.27Å; H34-E37 VanDerWaalsContact O-N 3.13Å; D35-E37 VanDerWaalsContact C-N 3.27Å; D35-E37 PolarHBondContact O-N 3.39Å; E37-W39 PolarHBondContact O-N 3.45Å; E37-T40 WeakPolarHBondContact O-CB 3.37Å; E37-T40 PolarHBondContact O-N 3.04Å; E37-F41 HydrophobicContact CB-CD2 4.31Å; E37-F41 HydrophobicContact CB-CE2 3.46Å; E37-F41 VanDerWaalsContact CB-CE2 3.46Å; E37-F41 HydrophobicContact CB-CZ 3.65Å; E37-F41 WeakPolarHBondContact O-CD2 3.45Å; E37-F41 WeakPolarHBondContact O-CE2 3.17Å; E37-F41 WeakPolarHBondContact O-CG 3.21Å; E37-F41 PolarHBondContact O-N 2.99Å; E37-L75 WeakPolarHBondContact OE2-CD2 3.48Å
38	Y	52.9	Low	53.1	Low	135 Å²	135	82.6 Å²	82.6	53%	0.529	43%	0.433	S	S	.	.	H	α-helix	trans	-61.3	-39.3	178.3	-74.5	-87.9	0	0	0	115.8	D35 R36 F41 A42	D35-Y38 PolarHBondContact O-N 2.85Å; R36-Y38 VanDerWaalsContact C-N 3.32Å; Y38-F41 VanDerWaalsContact CA-CD2 3.44Å; Y38-F41 HydrophobicContact CD1-CD2 4.29Å; Y38-F41 HydrophobicContact CG-CD2 4.3Å; Y38-F41 WeakPolarHBondContact O-CB 3.49Å; Y38-F41 PolarHBondContact O-N 3.46Å; Y38-A42 PolarHBondContact O-N 2.95Å
39	W	51.4	Low	53.4	Low	153 Å²	153	81 Å²	81	58%	0.58	43%	0.425	S	S	*	.	H	α-helix	trans	-75.6	-34.5	177.3	-72.6	103.4	0	0	0	112.6	E37 F41 A42 L43 W349	E37-W39 PolarHBondContact O-N 3.45Å; W39-F41 VanDerWaalsContact C-N 3.28Å; W39-A42 HydrophobicContact CE3-CB 4.4Å; W39-A42 PolarHBondContact O-N 3.42Å; W39-L43 WeakPolarHBondContact O-CB 3.33Å; W39-L43 PolarHBondContact O-N 3.16Å; W39-W349 HydrophobicContact CB-CH2 4.37Å; W39-W349 HydrophobicContact CB-CZ2 4.19Å; W39-W349 AromaticContact CD1-CZ2 3.73Å; W39-W349 HydrophobicContact CG-CH2 4.36Å; W39-W349 AromaticContact CG-CZ2 3.89Å; W39-W349 HydrophobicContact CG-CZ2 3.89Å
40	T	52.5	Low	53.7	Low	68 Å²	68	82.9 Å²	82.9	42%	0.417	44%	0.438	S	S	.	.	H	α-helix	trans	-62.1	-40.1	169.8	-27.8	0	0	0	0	109.7	R36 E37 L44	R36-T40 PolarHBondContact O-OG1 3.49Å; E37-T40 WeakPolarHBondContact O-CB 3.37Å; E37-T40 PolarHBondContact O-N 3.04Å; T40-L44 HydrophobicContact CG2-CD1 3.79Å; T40-L44 WeakPolarHBondContact O-CB 3.33Å; T40-L44 WeakPolarHBondContact O-CD1 3.21Å; T40-L44 PolarHBondContact O-N 3.15Å
41	F	55.5	Low	54.1	Low	37 Å²	37	83.7 Å²	83.7	16%	0.162	44%	0.443	C	S	.	.	H	α-helix	trans	-61.8	-46.9	171.4	-60.2	-47.3	0	0	0	112.6	I26 A30 E37 Y38 W39 A45 L75	I26-F41 HydrophobicContact CG2-CD1 3.64Å; I26-F41 HydrophobicContact CG2-CE1 3.3Å; I26-F41 HydrophobicContact CG2-CZ 4.09Å; A30-F41 HydrophobicContact CB-CE2 4.04Å; A30-F41 HydrophobicContact CB-CZ 3.84Å; E37-F41 HydrophobicContact CB-CD2 4.31Å; E37-F41 HydrophobicContact CB-CE2 3.46Å; E37-F41 VanDerWaalsContact CB-CE2 3.46Å; E37-F41 HydrophobicContact CB-CZ 3.65Å; E37-F41 WeakPolarHBondContact O-CD2 3.45Å; E37-F41 WeakPolarHBondContact O-CE2 3.17Å; E37-F41 WeakPolarHBondContact O-CG 3.21Å; E37-F41 PolarHBondContact O-N 2.99Å; Y38-F41 VanDerWaalsContact CA-CD2 3.44Å; Y38-F41 HydrophobicContact CD1-CD2 4.29Å; Y38-F41 HydrophobicContact CG-CD2 4.3Å; Y38-F41 WeakPolarHBondContact O-CB 3.49Å; Y38-F41 PolarHBondContact O-N 3.46Å; W39-F41 VanDerWaalsContact C-N 3.28Å; F41-A45 WeakPolarHBondContact O-CB 3.38Å; F41-A45 PolarHBondContact O-N 2.85Å; F41-L75 HydrophobicContact CE1-CD1 3.81Å; F41-L75 HydrophobicContact CE1-CD2 3.22Å; F41-L75 HydrophobicContact CE1-CG 4.05Å; F41-L75 HydrophobicContact CZ-CD2 3.21Å; F41-L75 HydrophobicContact CZ-CG 4.45Å
42	A	55.7	Low	54.6	Low	34 Å²	34	75.9 Å²	75.9	28%	0.281	42%	0.415	S	S	.	.	H	α-helix	trans	-64.6	-43.9	-179.9	0	0	0	0	0	112	Y38 W39 L46	Y38-A42 PolarHBondContact O-N 2.95Å; W39-A42 HydrophobicContact CE3-CB 4.4Å; W39-A42 PolarHBondContact O-N 3.42Å; A42-L46 WeakPolarHBondContact O-CB 3.22Å; A42-L46 WeakPolarHBondContact O-CD1 3.39Å; A42-L46 WeakPolarHBondContact O-CG 3.09Å; A42-L46 PolarHBondContact O-N 2.84Å
43	L	55.7	Low	55.3	Low	125 Å²	125	79.1 Å²	79.1	65%	0.654	41%	0.413	S	S	*	.	H	α-helix	trans	-67.2	-39.3	178.9	-86.5	154.4	0	0	0	112.9	W39 G47	W39-L43 WeakPolarHBondContact O-CB 3.33Å; W39-L43 PolarHBondContact O-N 3.16Å; L43-G47 WeakPolarHBondContact O-CA 3.3Å; L43-G47 PolarHBondContact O-N 3.39Å
44	L	55.6	Low	56.1	Low	53 Å²	53	81 Å²	81	28%	0.277	43%	0.43	S	S	.	.	H	α-helix	trans	-76.7	-35.7	177.4	-78.7	138.8	0	0	0	112.7	T40 G48 C71	T40-L44 HydrophobicContact CG2-CD1 3.79Å; T40-L44 WeakPolarHBondContact O-CB 3.33Å; T40-L44 WeakPolarHBondContact O-CD1 3.21Å; T40-L44 PolarHBondContact O-N 3.15Å; L44-G48 PolarHBondContact O-N 2.9Å; L44-C71 WeakPolarHBondContact CD1-SG 3.35Å
45	A	56.7	Low	56.5	Low	60 Å²	60	78.2 Å²	78.2	50%	0.496	42%	0.419	S	S	.	.	H	α-helix	trans	-70.1	-32.7	175	0	0	0	0	0	112.8	F41 P49	F41-A45 WeakPolarHBondContact O-CB 3.38Å; F41-A45 PolarHBondContact O-N 2.85Å; A45-P49 WeakPolarHBondContact O-CD 3.05Å; A45-P49 WeakPolarHBondContact O-CG 3.24Å
46	L	57.4	Low	57.2	Low	119 Å²	119	78.5 Å²	78.5	62%	0.623	43%	0.427	S	S	*	.	H	α-helix	trans	-86.2	-30.5	175.5	-67.2	168.3	0	0	0	112.7	A42 P49 L50	A42-L46 WeakPolarHBondContact O-CB 3.22Å; A42-L46 WeakPolarHBondContact O-CD1 3.39Å; A42-L46 WeakPolarHBondContact O-CG 3.09Å; A42-L46 PolarHBondContact O-N 2.84Å; L46-P49 WeakPolarHBondContact O-CD 2.96Å; L46-L50 WeakPolarHBondContact O-CD1 3.39Å; L46-L50 PolarHBondContact O-N 3.26Å
47	G	58.4	Low	58.2	Low	23 Å²	23	74.9 Å²	74.9	24%	0.237	43%	0.425	C	S	.	.	H	α-helix	trans	-71.2	-35.2	-179.4	0	0	0	0	0	114.1	L43 L50 C51	L43-G47 WeakPolarHBondContact O-CA 3.3Å; L43-G47 PolarHBondContact O-N 3.39Å; G47-L50 PolarHBondContact O-N 3.47Å; G47-C51 WeakPolarHBondContact O-CB 3.17Å; G47-C51 PolarHBondContact O-N 2.89Å; G47-C51 PolarHBondContact O-SG 3.49Å
48	G	60.4	Low	58.8	Low	7 Å²	7	80.5 Å²	80.5	7%	0.072	45%	0.446	C	S	.	.	H	α-helix	trans	-57.8	-54.9	175.9	0	0	0	0	0	113.3	Y15 L44 L50 C51 F52	Y15-G48 WeakPolarHBondContact OH-CA 3.22Å; Y15-G48 PolarHBondContact OH-O 3.49Å; Y15-G48 VanDerWaalsContact OH-O 3.06Å; L44-G48 PolarHBondContact O-N 2.9Å; G48-L50 VanDerWaalsContact C-N 3.31Å; G48-L50 PolarHBondContact O-N 3.48Å; G48-C51 PolarHBondContact O-N 3.12Å; G48-C51 VanDerWaalsContact O-N 3.13Å; G48-F52 PolarHBondContact O-N 3.36Å
49	P	60.7	Low	59.5	Low	67 Å²	67	81.1 Å²	81.1	44%	0.435	45%	0.447	S	S	.	.	H	α-helix	trans	-57.2	-38.6	175.6	-25.9	33.4	0	0	0	114	A45 L46 F52 L53	A45-P49 WeakPolarHBondContact O-CD 3.05Å; A45-P49 WeakPolarHBondContact O-CG 3.24Å; L46-P49 WeakPolarHBondContact O-CD 2.96Å; P49-F52 PolarHBondContact O-N 3.38Å; P49-L53 PolarHBondContact O-N 3.13Å
50	L	59.1	Low	60.3	Low	117 Å²	117	74.2 Å²	74.2	61%	0.613	42%	0.422	S	S	*	.	H	α-helix	trans	-67.3	-36.1	175.8	-75.2	165.2	0	0	0	112.3	L46 G47 G48 L53 A54	L46-L50 WeakPolarHBondContact O-CD1 3.39Å; L46-L50 PolarHBondContact O-N 3.26Å; G47-L50 PolarHBondContact O-N 3.47Å; G48-L50 VanDerWaalsContact C-N 3.31Å; G48-L50 PolarHBondContact O-N 3.48Å; L50-L53 PolarHBondContact O-N 2.96Å; L50-A54 PolarHBondContact O-N 3.29Å
51	C	58.2	Low	61	Low	31 Å²	31	72.9 Å²	72.9	21%	0.209	41%	0.412	C	S	.	.	H	α-helix	trans	-71.7	-31.8	175.6	-67.5	0	0	0	0	112.7	G47 G48 L53 A54 L55 F63	G47-C51 WeakPolarHBondContact O-CB 3.17Å; G47-C51 PolarHBondContact O-N 2.89Å; G47-C51 PolarHBondContact O-SG 3.49Å; G48-C51 PolarHBondContact O-N 3.12Å; G48-C51 VanDerWaalsContact O-N 3.13Å; C51-L53 VanDerWaalsContact C-N 3.3Å; C51-A54 PolarHBondContact O-N 2.82Å; C51-L55 PolarHBondContact O-N 2.72Å; C51-F63 HydrophobicContact CB-CD1 4.29Å
52	F	60.6	Low	61.9	Low	59 Å²	59	76.3 Å²	76.3	26%	0.259	43%	0.432	S	S	.	.	H	α-helix	trans	-65.1	-34.8	173.6	-171.6	-96.9	0	0	0	112	Y15 G48 P49	Y15-F52 HydrophobicContact CD1-CD2 4.43Å; Y15-F52 AromaticContact CD2-CD2 3.91Å; Y15-F52 HydrophobicContact CD2-CD2 3.91Å; Y15-F52 HydrophobicContact CD2-CE2 4.33Å; Y15-F52 HydrophobicContact CE2-CB 4.49Å; Y15-F52 HydrophobicContact CE2-CD2 4.04Å; Y15-F52 HydrophobicContact CG-CD2 4.12Å; Y15-F52 HydrophobicContact CG-CE2 4.24Å; G48-F52 PolarHBondContact O-N 3.36Å; P49-F52 PolarHBondContact O-N 3.38Å
53	L	61.2	Low	62.6	Low	148 Å²	148	79.8 Å²	79.8	78%	0.775	44%	0.44	S	S	*	.	H	α-helix	trans	-73.8	-26.7	174.9	-70.6	166	0	0	0	113.3	P49 L50 C51	P49-L53 PolarHBondContact O-N 3.13Å; L50-L53 PolarHBondContact O-N 2.96Å; C51-L53 VanDerWaalsContact C-N 3.3Å
54	A	59.9	Low	63.4	Low	75 Å²	75	74.3 Å²	74.3	62%	0.62	41%	0.412	S	S	*	.	H	α-helix	trans	-97.5	-24.7	-175.1	0	0	0	0	0	114.8	L50 C51	L50-A54 PolarHBondContact O-N 3.29Å; C51-A54 PolarHBondContact O-N 2.82Å
55	L	62.2	Low	64.2	Low	75 Å²	75	74.1 Å²	74.1	39%	0.393	41%	0.413	S	S	.	.	S	Bend	trans	-131.2	101.6	-175.5	-66.9	171.3	0	0	0	111	C51 S60	C51-L55 PolarHBondContact O-N 2.72Å; L55-S60 WeakPolarHBondContact O-CB 3.17Å
56	P	65.2	Low	65.1	Low	120 Å²	120	74.7 Å²	74.7	78%	0.779	41%	0.413	S	S	*	.			trans	-69.7	144.1	178.2	24.3	-29.9	0	0	0	112.5
57	G	69.7	Low	65.7	Low	35 Å²	35	70.1 Å²	70.1	36%	0.361	39%	0.39	S	S	.	.	S	Bend	trans	84	-158.2	169.8	0	0	0	0	0	115.9	R59 S60	G57-R59 PolarHBondContact O-N 3Å; G57-S60 PolarHBondContact O-N 3.45Å; G57-S60 VanDerWaalsContact O-N 3.16Å; G57-S60 PolarHBondContact O-OG 2.77Å
58	Y	66.8	Low	66.2	Low	150 Å²	150	69.7 Å²	69.7	59%	0.588	38%	0.383	S	S	*	.	H	α-helix	trans	-55.1	-19.2	-170.6	72.5	-82.8	0	0	0	115.9	L61 L62	Y58-L61 PolarHBondContact O-N 3.17Å; Y58-L62 PolarHBondContact O-N 3.31Å
59	R	67.7	Low	66.8	Low	148 Å²	148	77 Å²	77	56%	0.558	41%	0.408	S	S	*	.	H	α-helix	trans	-69.9	-35.2	179.9	-63.7	179.4	179.8	176.4	-1.6	112.7	G57 L62 F63	G57-R59 PolarHBondContact O-N 3Å; R59-L62 PolarHBondContact O-N 3.25Å; R59-F63 PolarHBondContact O-N 2.92Å
60	S	67.1	Low	67	Low	7 Å²	7	78.7 Å²	78.7	5%	0.049	41%	0.413	C	S	.	.	H	α-helix	trans	-70.3	-35.7	175.7	60.9	0	0	0	0	111.7	L55 G57 F63 L64	L55-S60 WeakPolarHBondContact O-CB 3.17Å; G57-S60 PolarHBondContact O-N 3.45Å; G57-S60 VanDerWaalsContact O-N 3.16Å; G57-S60 PolarHBondContact O-OG 2.77Å; S60-F63 PolarHBondContact O-N 3.2Å; S60-L64 VanDerWaalsContact O-CB 3.31Å; S60-L64 WeakPolarHBondContact O-CB 3.39Å; S60-L64 PolarHBondContact O-N 2.83Å
61	L	68.5	Low	67.1	Low	41 Å²	41	73.7 Å²	73.7	22%	0.215	39%	0.387	C	S	.	.	H	α-helix	trans	-67	-41.2	174.4	-166.9	70.8	0	0	0	111.7	L14 Y58 L64 T65	L14-L61 HydrophobicContact CD2-CD2 4.12Å; Y58-L61 PolarHBondContact O-N 3.17Å; L61-L64 PolarHBondContact O-N 2.81Å; L61-T65 WeakPolarHBondContact O-CB 3.2Å; L61-T65 VanDerWaalsContact O-CG2 3.22Å; L61-T65 WeakPolarHBondContact O-CG2 3.23Å; L61-T65 PolarHBondContact O-N 3.49Å; L61-T65 PolarHBondContact O-OG1 3.28Å
62	L	73.3	Confident	67.3	Low	109 Å²	109	78.1 Å²	78.1	57%	0.571	40%	0.401	S	S	*	.	H	α-helix	trans	-63.9	-44.4	174.9	-171.5	70.7	0	0	0	111.6	Y58 R59 T65 C66	Y58-L62 PolarHBondContact O-N 3.31Å; R59-L62 PolarHBondContact O-N 3.25Å; L62-T65 WeakPolarHBondContact CA-OG1 3.4Å; L62-T65 PolarHBondContact O-N 3.15Å; L62-T65 PolarHBondContact O-OG1 3.05Å; L62-C66 WeakPolarHBondContact O-CB 3.35Å; L62-C66 PolarHBondContact O-N 3.07Å; L62-C66 PolarHBondContact O-SG 3.24Å; L62-C66 VanDerWaalsContact O-SG 3.33Å
63	F	70.6	Confident	67.4	Low	106 Å²	106	78.5 Å²	78.5	47%	0.465	41%	0.408	S	S	.	.	H	α-helix	trans	-62.9	-47.1	177.2	-169.1	-95.1	0	0	0	111.5	C51 R59 S60 T65 C66 S67	C51-F63 HydrophobicContact CB-CD1 4.29Å; R59-F63 PolarHBondContact O-N 2.92Å; S60-F63 PolarHBondContact O-N 3.2Å; F63-T65 PolarHBondContact O-N 3.33Å; F63-C66 PolarHBondContact O-N 3.42Å; F63-S67 VanDerWaalsContact O-CB 3.27Å; F63-S67 WeakPolarHBondContact O-CB 3.28Å; F63-S67 PolarHBondContact O-N 3Å; F63-S67 PolarHBondContact O-OG 3.48Å; F63-S67 VanDerWaalsContact O-OG 3.08Å
64	L	71.8	Confident	67.2	Low	11 Å²	11	75.6 Å²	75.6	6%	0.058	40%	0.396	C	S	.	.	H	α-helix	trans	-59.9	-46.8	176.7	-177.2	73.1	0	0	0	111.3	Y15 V18 T19 S60 L61 S67 L68	Y15-L64 HydrophobicContact CD2-CD2 3.84Å; Y15-L64 HydrophobicContact CE2-CB 4.15Å; Y15-L64 HydrophobicContact CE2-CD2 3.45Å; Y15-L64 VanDerWaalsContact CE2-CD2 3.45Å; Y15-L64 HydrophobicContact CE2-CG 4.2Å; V18-L64 HydrophobicContact CG1-CD2 4.5Å; T19-L64 WeakPolarHBondContact OG1-CD2 3.39Å; S60-L64 VanDerWaalsContact O-CB 3.31Å; S60-L64 WeakPolarHBondContact O-CB 3.39Å; S60-L64 PolarHBondContact O-N 2.83Å; L61-L64 PolarHBondContact O-N 2.81Å; L64-S67 PolarHBondContact O-N 2.75Å; L64-L68 HydrophobicContact CD1-CD1 3.88Å; L64-L68 HydrophobicContact CD1-CG 4.08Å; L64-L68 HydrophobicContact CD2-CD1 4Å; L64-L68 HydrophobicContact CG-CD1 3.58Å; L64-L68 HydrophobicContact CG-CG 4.13Å; L64-L68 WeakPolarHBondContact O-CB 3.42Å; L64-L68 WeakPolarHBondContact O-CG 3.49Å; L64-L68 PolarHBondContact O-N 3.41Å
65	T	73.3	Confident	66.8	Low	49 Å²	49	73.1 Å²	73.1	30%	0.301	37%	0.372	S	S	.	.	H	α-helix	trans	-64.6	-40.5	179.1	51.7	0	0	0	0	112.3	L61 L62 F63 L68 W69	L61-T65 WeakPolarHBondContact O-CB 3.2Å; L61-T65 VanDerWaalsContact O-CG2 3.22Å; L61-T65 WeakPolarHBondContact O-CG2 3.23Å; L61-T65 PolarHBondContact O-N 3.49Å; L61-T65 PolarHBondContact O-OG1 3.28Å; L62-T65 WeakPolarHBondContact CA-OG1 3.4Å; L62-T65 PolarHBondContact O-N 3.15Å; L62-T65 PolarHBondContact O-OG1 3.05Å; F63-T65 PolarHBondContact O-N 3.33Å; T65-L68 PolarHBondContact O-N 2.85Å; T65-W69 WeakPolarHBondContact O-CB 3.44Å; T65-W69 PolarHBondContact O-N 2.86Å
66	C	75.7	Confident	66.2	Low	72 Å²	72	70.9 Å²	70.9	49%	0.486	37%	0.368	S	S	.	.	H	α-helix	trans	-64.1	-44.3	172.8	-72.2	0	0	0	0	112.1	L62 F63 W69 L70	L62-C66 WeakPolarHBondContact O-CB 3.35Å; L62-C66 PolarHBondContact O-N 3.07Å; L62-C66 PolarHBondContact O-SG 3.24Å; L62-C66 VanDerWaalsContact O-SG 3.33Å; F63-C66 PolarHBondContact O-N 3.42Å; C66-W69 PolarHBondContact O-N 3.34Å; C66-L70 WeakPolarHBondContact O-CB 3.4Å; C66-L70 PolarHBondContact O-N 3.39Å
67	S	69.6	Low	65.6	Low	22 Å²	22	73.4 Å²	73.4	15%	0.154	36%	0.361	C	S	.	.	H	α-helix	trans	-61.4	-43.6	175.8	-73.8	0	0	0	0	111.9	F63 L64 C71	F63-S67 VanDerWaalsContact O-CB 3.27Å; F63-S67 WeakPolarHBondContact O-CB 3.28Å; F63-S67 PolarHBondContact O-N 3Å; F63-S67 PolarHBondContact O-OG 3.48Å; F63-S67 VanDerWaalsContact O-OG 3.08Å; L64-S67 PolarHBondContact O-N 2.75Å; S67-C71 WeakPolarHBondContact O-CB 3.13Å; S67-C71 PolarHBondContact O-N 2.93Å; S67-C71 PolarHBondContact O-SG 2.93Å
68	L	69.4	Low	64.8	Low	14 Å²	14	81.7 Å²	81.7	7%	0.073	38%	0.382	C	S	.	.	H	α-helix	trans	-74	-33.9	179	-71	175.3	0	0	0	112.8	V18 Y22 I26 L64 T65 C71 Y72	V18-L68 HydrophobicContact CG1-CD1 4.47Å; Y22-L68 HydrophobicContact CD1-CB 3.63Å; Y22-L68 HydrophobicContact CD1-CD1 4.18Å; Y22-L68 HydrophobicContact CD1-CD2 4.23Å; Y22-L68 HydrophobicContact CD1-CG 4.23Å; Y22-L68 HydrophobicContact CD2-CB 4.42Å; Y22-L68 HydrophobicContact CD2-CD1 3.82Å; Y22-L68 HydrophobicContact CE1-CB 3.73Å; Y22-L68 HydrophobicContact CE2-CD1 4.47Å; Y22-L68 HydrophobicContact CG-CB 3.98Å; Y22-L68 HydrophobicContact CG-CD1 3.64Å; Y22-L68 HydrophobicContact CG-CD2 4.26Å; Y22-L68 HydrophobicContact CG-CG 4.18Å; I26-L68 HydrophobicContact CD1-CD2 4.05Å; L64-L68 HydrophobicContact CD1-CD1 3.88Å; L64-L68 HydrophobicContact CD1-CG 4.08Å; L64-L68 HydrophobicContact CD2-CD1 4Å; L64-L68 HydrophobicContact CG-CD1 3.58Å; L64-L68 HydrophobicContact CG-CG 4.13Å; L64-L68 WeakPolarHBondContact O-CB 3.42Å; L64-L68 WeakPolarHBondContact O-CG 3.49Å; L64-L68 PolarHBondContact O-N 3.41Å; T65-L68 PolarHBondContact O-N 2.85Å; L68-C71 WeakPolarHBondContact O-CB 3.05Å; L68-C71 PolarHBondContact O-N 2.81Å; L68-Y72 WeakPolarHBondContact O-CB 3.46Å; L68-Y72 PolarHBondContact O-N 3.01Å
69	W	72.6	Confident	64.7	Low	161 Å²	161	78.3 Å²	78.3	61%	0.61	38%	0.377	S	S	*	.	H	α-helix	trans	-67.4	-44	171	-179.7	81.9	0	0	0	111	T65 C66 C71 Y72 V73	T65-W69 WeakPolarHBondContact O-CB 3.44Å; T65-W69 PolarHBondContact O-N 2.86Å; C66-W69 PolarHBondContact O-N 3.34Å; W69-C71 VanDerWaalsContact C-N 3.33Å; W69-C71 PolarHBondContact O-N 3.26Å; W69-Y72 PolarHBondContact O-N 2.83Å; W69-Y72 VanDerWaalsContact O-N 3.12Å; W69-V73 HydrophobicContact CD2-CG2 4.13Å; W69-V73 HydrophobicContact CH2-CG2 4.44Å; W69-V73 HydrophobicContact CZ2-CG2 4.03Å; W69-V73 WeakPolarHBondContact O-CG2 3.49Å; W69-V73 PolarHBondContact O-N 3.14Å
70	L	65.3	Low	65.3	Low	103 Å²	103	75.6 Å²	75.6	54%	0.539	37%	0.373	S	S	.	.	H	α-helix	trans	-59.9	-45	172.9	-175.4	65.8	0	0	0	110.6	C66 V73 V74	C66-L70 WeakPolarHBondContact O-CB 3.4Å; C66-L70 PolarHBondContact O-N 3.39Å; L70-V73 PolarHBondContact O-N 3.47Å; L70-V74 HydrophobicContact CD1-CG2 4.36Å; L70-V74 HydrophobicContact CG-CG2 4.46Å; L70-V74 WeakPolarHBondContact O-CB 3.16Å; L70-V74 WeakPolarHBondContact O-CG2 3.2Å; L70-V74 PolarHBondContact O-N 3.36Å
71	C	61.4	Low	66.3	Low	11 Å²	11	79.9 Å²	79.9	7%	0.074	39%	0.394	C	S	.	.	H	α-helix	trans	-54.3	-53.8	169.5	-73.9	0	0	0	0	110.7	I26 L44 S67 L68 W69 V73 V74 L75	I26-C71 HydrophobicContact CD1-CB 4.44Å; L44-C71 WeakPolarHBondContact CD1-SG 3.35Å; S67-C71 WeakPolarHBondContact O-CB 3.13Å; S67-C71 PolarHBondContact O-N 2.93Å; S67-C71 PolarHBondContact O-SG 2.93Å; L68-C71 WeakPolarHBondContact O-CB 3.05Å; L68-C71 PolarHBondContact O-N 2.81Å; W69-C71 VanDerWaalsContact C-N 3.33Å; W69-C71 PolarHBondContact O-N 3.26Å; C71-V73 VanDerWaalsContact C-N 3.29Å; C71-V73 PolarHBondContact O-N 2.94Å; C71-V74 CarbonylContact O-C 3.6Å; C71-V74 PolarHBondContact O-N 2.91Å; C71-V74 VanDerWaalsContact O-N 3.15Å; C71-L75 HydrophobicContact CB-CD1 3.85Å; C71-L75 WeakPolarHBondContact O-CB 2.97Å; C71-L75 WeakPolarHBondContact O-CD1 3.36Å; C71-L75 WeakPolarHBondContact O-CG 3.09Å; C71-L75 PolarHBondContact O-N 3.2Å
72	Y	62.4	Low	67.3	Low	124 Å²	124	80.1 Å²	80.1	49%	0.486	40%	0.395	S	S	.	.	H	α-helix	trans	-58.7	-38.5	-176.8	178.9	-92.5	0	0	0	113.5	K29 L68 W69 G76	K29-Y72 PolarHBondContact NZ-O 3.37Å; L68-Y72 WeakPolarHBondContact O-CB 3.46Å; L68-Y72 PolarHBondContact O-N 3.01Å; W69-Y72 PolarHBondContact O-N 2.83Å; W69-Y72 VanDerWaalsContact O-N 3.12Å; Y72-G76 VanDerWaalsContact O-CA 3.3Å; Y72-G76 WeakPolarHBondContact O-CA 3.35Å; Y72-G76 PolarHBondContact O-N 3.44Å
73	V	61	Low	68.1	Low	68 Å²	68	80.3 Å²	80.3	41%	0.412	40%	0.401	S	S	.	.	H	α-helix	trans	-70.8	-42.4	176.6	172.8	0	0	0	0	111.1	W69 L70 C71 G76	W69-V73 HydrophobicContact CD2-CG2 4.13Å; W69-V73 HydrophobicContact CH2-CG2 4.44Å; W69-V73 HydrophobicContact CZ2-CG2 4.03Å; W69-V73 WeakPolarHBondContact O-CG2 3.49Å; W69-V73 PolarHBondContact O-N 3.14Å; L70-V73 PolarHBondContact O-N 3.47Å; C71-V73 VanDerWaalsContact C-N 3.29Å; C71-V73 PolarHBondContact O-N 2.94Å; V73-G76 PolarHBondContact O-N 3.42Å
74	V	57.2	Low	68.9	Low	87 Å²	87	75.7 Å²	75.7	53%	0.527	38%	0.381	S	S	.	.	H	α-helix	trans	-67.5	-40	176.1	172.3	0	0	0	0	111.2	L70 C71 G76	L70-V74 HydrophobicContact CD1-CG2 4.36Å; L70-V74 HydrophobicContact CG-CG2 4.46Å; L70-V74 WeakPolarHBondContact O-CB 3.16Å; L70-V74 WeakPolarHBondContact O-CG2 3.2Å; L70-V74 PolarHBondContact O-N 3.36Å; C71-V74 CarbonylContact O-C 3.6Å; C71-V74 PolarHBondContact O-N 2.91Å; C71-V74 VanDerWaalsContact O-N 3.15Å; V74-G76 PolarHBondContact O-N 3.28Å
75	L	52.8	Low	69.5	Low	22 Å²	22	82.4 Å²	82.4	12%	0.115	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-8.3	176.4	-66.7	165	0	0	0	113.8	I26 K29 E37 F41 C71	I26-L75 HydrophobicContact CB-CD1 4.33Å; I26-L75 HydrophobicContact CD1-CD1 4.29Å; I26-L75 HydrophobicContact CG1-CD1 3.69Å; I26-L75 HydrophobicContact CG2-CD1 4.03Å; K29-L75 HydrophobicContact CD-CB 4.34Å; K29-L75 VanDerWaalsContact CE-O 3.24Å; K29-L75 WeakPolarHBondContact CE-O 3.22Å; E37-L75 WeakPolarHBondContact OE2-CD2 3.48Å; F41-L75 HydrophobicContact CE1-CD1 3.81Å; F41-L75 HydrophobicContact CE1-CD2 3.22Å; F41-L75 HydrophobicContact CE1-CG 4.05Å; F41-L75 HydrophobicContact CZ-CD2 3.21Å; F41-L75 HydrophobicContact CZ-CG 4.45Å; C71-L75 HydrophobicContact CB-CD1 3.85Å; C71-L75 WeakPolarHBondContact O-CB 2.97Å; C71-L75 WeakPolarHBondContact O-CD1 3.36Å; C71-L75 WeakPolarHBondContact O-CG 3.09Å; C71-L75 PolarHBondContact O-N 3.2Å
76	G	48.1	Very low	70	Confident	29 Å²	29	83 Å²	83	30%	0.299	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-4.1	-164.8	0	0	0	0	0	116.4	Y72 V73 V74 R78	Y72-G76 VanDerWaalsContact O-CA 3.3Å; Y72-G76 WeakPolarHBondContact O-CA 3.35Å; Y72-G76 PolarHBondContact O-N 3.44Å; V73-G76 PolarHBondContact O-N 3.42Å; V74-G76 PolarHBondContact O-N 3.28Å; G76-R78 PolarHBondContact O-N 3.03Å
77	R	54.1	Low	71	Confident	172 Å²	172	82.7 Å²	82.7	65%	0.649	42%	0.416	S	S	*	.			trans	-73.3	97	175.5	-71.3	-171.1	177.5	-174.3	0.2	108.6	V79	R77-V79 PolarHBondContact O-N 2.98Å
78	R	53	Low	72.3	Confident	210 Å²	210	82 Å²	82	79%	0.792	41%	0.412	S	S	*	.			trans	-49.1	128	158.9	-77.9	-169.3	-178	-151.7	1.3	107.3	G76 D80	G76-R78 PolarHBondContact O-N 3.03Å; R78-D80 PolarHBondContact O-N 3.27Å
79	V	64.9	Low	73.7	Confident	79 Å²	79	81.3 Å²	81.3	48%	0.479	41%	0.409	S	S	.	.			trans	-79.1	73.8	172.8	-176.8	0	0	0	0	106.5	R77 M81	R77-V79 PolarHBondContact O-N 2.98Å; V79-M81 HydrophobicContact CG1-CE 3.74Å; V79-M81 HydrophobicContact CG1-CG 4.27Å; V79-M81 HydrophobicContact CG1-SD 3.86Å; V79-M81 PolarHBondContact O-N 3.33Å
80	D	79.6	Confident	75	Confident	90 Å²	90	73.7 Å²	73.7	48%	0.481	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-73	119	171.5	-65.2	-28.5	0	0	0	107.1	R78 V336	R78-D80 PolarHBondContact O-N 3.27Å; D80-V336 HydrophobicContact CB-CB 4.29Å; D80-V336 HydrophobicContact CB-CG2 3.81Å; D80-V336 WeakPolarHBondContact O-CG2 3.32Å; D80-V336 PolarHBondContact O-N 3.25Å
81	M	88.1	Confident	76.6	Confident	98 Å²	98	68.8 Å²	68.8	48%	0.483	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-96.6	137.4	177.6	-64.2	-63.1	-151.5	0	0	109.6	V79 M334	V79-M81 HydrophobicContact CG1-CE 3.74Å; V79-M81 HydrophobicContact CG1-CG 4.27Å; V79-M81 HydrophobicContact CG1-SD 3.86Å; V79-M81 PolarHBondContact O-N 3.33Å; M81-M334 CarbonylContact C-O 3.3Å; M81-M334 HydrophobicContact SD-CB 3.96Å
82	L	90.1	Very high	78.4	Confident	46 Å²	46	68.4 Å²	68.4	24%	0.241	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-75.4	143.9	173.2	-64.4	169.9	0	0	0	109.8	M84 W166 M334 V336	L82-M84 PolarHBondContact O-N 2.88Å; L82-W166 HydrophobicContact CD1-CH2 3.58Å; L82-W166 HydrophobicContact CD1-CZ2 3.61Å; L82-M334 VanDerWaalsContact CB-O 3.32Å; L82-M334 WeakPolarHBondContact CB-O 3.42Å; L82-M334 WeakPolarHBondContact CG-O 3.32Å; L82-M334 PolarHBondContact N-O 2.84Å; L82-V336 HydrophobicContact CD2-CG2 3.67Å; L82-V336 HydrophobicContact CG-CG2 3.93Å
83	T	88.4	Confident	80	Confident	112 Å²	112	63.4 Å²	63.4	69%	0.687	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-65.8	126.7	166.8	-51	0	0	0	0	109.1	H85 R87	T83-H85 HydrophobicContact CG2-CB 4.11Å; T83-R87 VanDerWaalsContact O-CZ 3.32Å; T83-R87 PolarHBondContact O-NE 3.38Å
84	M	88.5	Confident	81.8	Confident	10 Å²	10	60.1 Å²	60.1	5%	0.049	32%	0.318	C	S	.	.			trans	-102.1	-2.1	-175.5	-61	-67.9	-65.4	0	0	113.8	L82 G86 R87 V89 V111 W166 M334	L82-M84 PolarHBondContact O-N 2.88Å; M84-G86 PolarHBondContact O-N 3.43Å; M84-R87 HydrophobicContact CE-CB 4.49Å; M84-R87 WeakPolarHBondContact O-CB 3.41Å; M84-R87 PolarHBondContact O-N 2.57Å; M84-R87 VanDerWaalsContact O-N 3.09Å; M84-V89 HydrophobicContact CE-CG2 4.49Å; M84-V111 HydrophobicContact CB-CG2 3.54Å; M84-V111 HydrophobicContact CE-CG2 4.28Å; M84-V111 HydrophobicContact CG-CG2 4.47Å; M84-W166 HydrophobicContact CE-CG 4.39Å; M84-W166 VanDerWaalsContact CE-NE1 3.34Å; M84-M334 HydrophobicContact CE-CE 4.48Å; M84-M334 HydrophobicContact CE-CG 4.05Å; M84-M334 HydrophobicContact CG-CB 4.18Å; M84-M334 HydrophobicContact CG-CE 4.15Å; M84-M334 HydrophobicContact CG-CG 3.59Å; M84-M334 HydrophobicContact CG-SD 3.84Å; M84-M334 HydrophobicContact SD-CB 4.15Å; M84-M334 HydrophobicContact SD-CG 3.73Å
85	H	85.1	Confident	83.7	Confident	151 Å²	151	57.3 Å²	57.3	70%	0.699	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	131.1	176	-165.1	65.2	0	0	0	110.8	T83 R87	T83-H85 HydrophobicContact CG2-CB 4.11Å; H85-R87 PolarHBondContact O-N 3.36Å
86	G	83.8	Confident	85.7	Confident	63 Å²	63	59.2 Å²	59.2	65%	0.649	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	11.2	-177.2	0	0	0	0	0	114.7	M84	M84-G86 PolarHBondContact O-N 3.43Å
87	R	95.2	Very high	88	Confident	64 Å²	64	58.8 Å²	58.8	24%	0.242	31%	0.308	C	S	.	.			trans	-99.2	147.5	172.7	-59.7	-169.3	-174	-162.2	-5.8	110.6	T83 M84 H85 V111 T112 W166	T83-R87 VanDerWaalsContact O-CZ 3.32Å; T83-R87 PolarHBondContact O-NE 3.38Å; M84-R87 HydrophobicContact CE-CB 4.49Å; M84-R87 WeakPolarHBondContact O-CB 3.41Å; M84-R87 PolarHBondContact O-N 2.57Å; M84-R87 VanDerWaalsContact O-N 3.09Å; H85-R87 PolarHBondContact O-N 3.36Å; R87-V111 VanDerWaalsContact O-CG1 3.31Å; R87-V111 WeakPolarHBondContact O-CG1 3.4Å; R87-T112 PolarHBondContact O-N 3.13Å; R87-W166 HydrophobicContact CB-CB 3.79Å; R87-W166 HydrophobicContact CB-CG 4.03Å; R87-W166 HydrophobicContact CG-CB 4.37Å; R87-W166 HydrophobicContact CG-CG 4.36Å; R87-W166 VanDerWaalsContact NH1-CD2 3.35Å
88	A	98.1	Very high	90	Very high	8 Å²	8	51.8 Å²	51.8	7%	0.066	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	137.8	-179.8	0	0	0	0	0	113	T112 F114 V160 L165 W166 G167	A88-T112 CarbonylContact C-O 3.54Å; A88-T112 VanDerWaalsContact CA-O 3.22Å; A88-T112 WeakPolarHBondContact CA-O 3Å; A88-T112 HydrophobicContact CB-CG2 4.46Å; A88-F114 HydrophobicContact CB-CE2 3.85Å; A88-V160 HydrophobicContact CB-CG1 3.59Å; A88-L165 HydrophobicContact CB-CD1 3.9Å; A88-L165 WeakPolarHBondContact O-CD1 3.46Å; A88-W166 WeakPolarHBondContact O-CA 3.25Å; A88-W166 VanDerWaalsContact O-CB 3.3Å; A88-W166 WeakPolarHBondContact O-CB 3.26Å; A88-W166 PolarHBondContact O-N 2.89Å; A88-G167 PolarHBondContact O-N 3.49Å; A88-G167 VanDerWaalsContact O-N 3.15Å
89	V	98.7	Very high	92.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	129	179.4	179.5	0	0	0	0	110.5	M84 I91 I106 V111 T112 V113 F114 G167 V169 L333	M84-V89 HydrophobicContact CE-CG2 4.49Å; V89-I91 HydrophobicContact CG1-CG1 3.95Å; V89-I106 HydrophobicContact CB-CD1 4.09Å; V89-I106 HydrophobicContact CG1-CD1 4.09Å; V89-I106 HydrophobicContact CG2-CD1 4.35Å; V89-V111 HydrophobicContact CB-CG1 4.21Å; V89-V111 HydrophobicContact CG2-CG1 3.76Å; V89-T112 PolarHBondContact N-O 3.4Å; V89-V113 WeakPolarHBondContact O-CA 3.37Å; V89-F114 PolarHBondContact O-N 3.26Å; V89-G167 CarbonylContact C-O 3.54Å; V89-G167 VanDerWaalsContact CA-O 3.31Å; V89-G167 WeakPolarHBondContact CA-O 3.33Å; V89-V169 HydrophobicContact CG1-CG2 4.12Å; V89-L333 HydrophobicContact CG1-CD1 4.4Å; V89-L333 HydrophobicContact CG1-CD2 4.28Å
90	L	98.8	Very high	93.7	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	129.3	167.5	173.6	61.8	0	0	0	109.6	F114 L141 I156 L165 G167 I168 V169 V203 F207	L90-F114 WeakPolarHBondContact CA-O 3.1Å; L90-F114 HydrophobicContact CD1-CB 3.95Å; L90-F114 WeakPolarHBondContact CD1-O 3.44Å; L90-L141 HydrophobicContact CD1-CD2 4.2Å; L90-I156 HydrophobicContact CB-CD1 4.44Å; L90-I156 HydrophobicContact CD1-CD1 4.01Å; L90-I156 HydrophobicContact CD2-CD1 4.24Å; L90-I156 HydrophobicContact CG-CD1 4.46Å; L90-L165 HydrophobicContact CB-CD2 4Å; L90-G167 PolarHBondContact N-O 3.44Å; L90-I168 CarbonylContact O-C 3.49Å; L90-I168 WeakPolarHBondContact O-CA 3.39Å; L90-V169 PolarHBondContact O-N 3.19Å; L90-V203 HydrophobicContact CD2-CG1 4.22Å; L90-F207 HydrophobicContact CD2-CD1 4.13Å; L90-F207 HydrophobicContact CD2-CD2 4.1Å; L90-F207 HydrophobicContact CD2-CE1 3.81Å; L90-F207 HydrophobicContact CD2-CE2 3.76Å; L90-F207 HydrophobicContact CD2-CG 4.26Å; L90-F207 HydrophobicContact CD2-CZ 3.6Å
91	I	98.9	Very high	94.6	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	124.6	173.6	-52.1	170.3	0	0	0	107.7	V89 C94 L102 A103 I106 V113 F114 G116 V169	V89-I91 HydrophobicContact CG1-CG1 3.95Å; I91-C94 VanDerWaalsContact CB-SG 3.57Å; I91-C94 WeakPolarHBondContact CG2-SG 3.44Å; I91-C94 PolarHBondContact O-SG 2.91Å; I91-C94 VanDerWaalsContact O-SG 3.33Å; I91-L102 HydrophobicContact CD1-CB 4.3Å; I91-L102 HydrophobicContact CD1-CD2 3.87Å; I91-L102 HydrophobicContact CD1-CG 3.91Å; I91-L102 HydrophobicContact CG1-CD2 4.37Å; I91-A103 HydrophobicContact CD1-CB 3.95Å; I91-I106 HydrophobicContact CD1-CD1 3.87Å; I91-V113 HydrophobicContact CD1-CG1 3.89Å; I91-V113 HydrophobicContact CG1-CG1 4.46Å; I91-F114 PolarHBondContact N-O 3.17Å; I91-G116 WeakPolarHBondContact O-CA 3.41Å; I91-G116 PolarHBondContact O-N 3.36Å; I91-V169 HydrophobicContact CB-CB 4.39Å; I91-V169 HydrophobicContact CG1-CB 4.15Å; I91-V169 HydrophobicContact CG1-CG2 4.18Å; I91-V169 HydrophobicContact CG2-CB 4.13Å; I91-V169 HydrophobicContact CG2-CG1 4.4Å
92	T	98.8	Very high	95	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.018	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	147.2	176.2	64.3	0	0	0	0	111.3	G116 L141 V143 V169 N171 A172 V203	T92-G116 CarbonylContact C-O 3.6Å; T92-L141 HydrophobicContact CG2-CD2 4.22Å; T92-V143 HydrophobicContact CG2-CG1 3.81Å; T92-V169 PolarHBondContact N-O 3.3Å; T92-V169 VanDerWaalsContact N-O 3.08Å; T92-V169 PolarHBondContact OG1-O 3.37Å; T92-N171 VanDerWaalsContact O-CB 3.25Å; T92-N171 WeakPolarHBondContact O-CB 3.21Å; T92-N171 PolarHBondContact O-ND2 3.3Å; T92-N171 PolarHBondContact OG1-N 3.39Å; T92-A172 PolarHBondContact O-N 2.68Å; T92-A172 PolarHBondContact OG1-N 3.06Å; T92-V203 HydrophobicContact CG2-CG1 4.28Å
93	G	98	Very high	95.4	Very high	19 Å²	19	29.1 Å²	29.1	20%	0.196	18%	0.179	C	C	.	.			trans	73.2	49.7	176	0	0	0	0	0	112.4	G116 N171	G93-G116 PolarHBondContact N-O 3.47Å; G93-N171 PolarHBondContact O-ND2 2.88Å
94	C	98.1	Very high	95.7	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.161	C	C	.	.			trans	-91.2	3.8	-177.5	-70.6	0	0	0	0	114.3	I91 T96 H100 A115 G116 V117 L128	I91-C94 VanDerWaalsContact CB-SG 3.57Å; I91-C94 WeakPolarHBondContact CG2-SG 3.44Å; I91-C94 PolarHBondContact O-SG 2.91Å; I91-C94 VanDerWaalsContact O-SG 3.33Å; C94-T96 PolarHBondContact O-N 2.91Å; C94-H100 VanDerWaalsContact O-CB 3.29Å; C94-H100 WeakPolarHBondContact O-CB 3.43Å; C94-H100 PolarHBondContact O-ND1 3.23Å; C94-A115 HydrophobicContact CB-CB 3.91Å; C94-G116 PolarHBondContact N-O 3.31Å; C94-V117 HydrophobicContact CB-CG1 3.75Å; C94-L128 HydrophobicContact CB-CD1 3.87Å; C94-L128 WeakPolarHBondContact O-CD1 3.39Å
95	D	96.5	Very high	96.1	Very high	28 Å²	28	31.5 Å²	31.5	15%	0.15	18%	0.175	C	C	.	.	S	Bend	trans	-60.3	-37.1	179	-52.7	-111.5	0	0	0	110.8	V117 L118 D119 S122 G124	D95-V117 VanDerWaalsContact OD2-CA 3.27Å; D95-V117 WeakPolarHBondContact OD2-CA 3.37Å; D95-L118 PolarHBondContact OD1-N 3.05Å; D95-L118 VanDerWaalsContact OD1-N 3.16Å; D95-L118 PolarHBondContact OD2-N 3.38Å; D95-D119 PolarHBondContact OD1-N 3.16Å; D95-S122 PolarHBondContact OD1-OG 3.4Å; D95-G124 WeakPolarHBondContact O-CA 3.1Å
96	T	95.3	Very high	96.5	Very high	62 Å²	62	24.3 Å²	24.3	38%	0.38	14%	0.141	S	C	.	.	S	Bend	trans	-152.4	178.2	-178.6	64.5	0	0	0	0	112.1	C94 H100 N272	C94-T96 PolarHBondContact O-N 2.91Å; T96-H100 PolarHBondContact O-N 3.36Å; T96-N272 HydrophobicContact CG2-CB 4.28Å
97	G	95.6	Very high	97.1	Very high	20 Å²	20	21.4 Å²	21.4	21%	0.206	11%	0.111	C	C	.	.	H	α-helix	trans	64.6	-140.3	165.1	0	0	0	0	0	114.6	A101	G97-A101 WeakPolarHBondContact O-CB 3.36Å; G97-A101 PolarHBondContact O-N 3.4Å; G97-A101 VanDerWaalsContact O-N 3.1Å
98	F	97.2	Very high	96.9	Very high	25 Å²	25	23.6 Å²	23.6	11%	0.11	13%	0.128	C	C	.	.	H	α-helix	trans	-64.3	-43.2	-173.6	-54.8	-48.9	0	0	0	113	A101 L102 P266 F269 T271 L322 V325 M329	F98-A101 PolarHBondContact O-N 3.48Å; F98-L102 WeakPolarHBondContact O-CB 3.45Å; F98-L102 PolarHBondContact O-N 3.14Å; F98-P266 HydrophobicContact CE2-CB 4.17Å; F98-P266 HydrophobicContact CE2-CG 3.93Å; F98-P266 HydrophobicContact CZ-CB 4.08Å; F98-P266 HydrophobicContact CZ-CG 4.23Å; F98-F269 HydrophobicContact CE1-CB 3.93Å; F98-F269 HydrophobicContact CE1-CG 4.13Å; F98-F269 HydrophobicContact CZ-CB 3.63Å; F98-F269 HydrophobicContact CZ-CD2 4.06Å; F98-F269 AromaticContact CZ-CG 3.94Å; F98-F269 HydrophobicContact CZ-CG 3.94Å; F98-T271 HydrophobicContact CD1-CG2 4.32Å; F98-T271 HydrophobicContact CE1-CG2 4.01Å; F98-T271 HydrophobicContact CE2-CG2 4.26Å; F98-T271 HydrophobicContact CZ-CG2 3.99Å; F98-L322 HydrophobicContact CD1-CB 4.49Å; F98-L322 HydrophobicContact CD1-CD1 4.39Å; F98-L322 HydrophobicContact CD1-CD2 4.24Å; F98-L322 HydrophobicContact CE1-CD2 3.78Å; F98-V325 HydrophobicContact CD1-CB 4.03Å; F98-V325 HydrophobicContact CD1-CG1 3.73Å; F98-V325 HydrophobicContact CD1-CG2 4.33Å; F98-V325 HydrophobicContact CD2-CG1 4.3Å; F98-V325 HydrophobicContact CE1-CB 3.84Å; F98-V325 HydrophobicContact CE1-CG1 3.8Å; F98-V325 HydrophobicContact CE1-CG2 3.63Å; F98-V325 HydrophobicContact CE2-CG1 4.37Å; F98-V325 HydrophobicContact CG-CG1 3.97Å; F98-V325 HydrophobicContact CZ-CB 4.41Å; F98-V325 HydrophobicContact CZ-CG1 4.12Å; F98-V325 HydrophobicContact CZ-CG2 3.9Å; F98-M329 HydrophobicContact CB-CE 3.9Å; F98-M329 HydrophobicContact CB-SD 4.37Å; F98-M329 HydrophobicContact CG-CE 4.38Å
99	G	97.8	Very high	96.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.1	-47.8	179.7	0	0	0	0	0	111.7	L102 A103 N171	G99-L102 PolarHBondContact O-N 2.96Å; G99-A103 VanDerWaalsContact O-CB 3.31Å; G99-A103 WeakPolarHBondContact O-CB 3.41Å; G99-A103 PolarHBondContact O-N 2.87Å; G99-N171 WeakPolarHBondContact CA-ND2 3.49Å; G99-N171 PolarHBondContact N-ND2 2.89Å
100	H	97.7	Very high	96.1	Very high	21 Å²	21	29.4 Å²	29.4	10%	0.097	17%	0.165	C	C	.	.	H	α-helix	trans	-57.9	-51.7	176.1	-174.9	98.1	0	0	0	112	C94 T96 L102 A103 R104 G124 E127	C94-H100 VanDerWaalsContact O-CB 3.29Å; C94-H100 WeakPolarHBondContact O-CB 3.43Å; C94-H100 PolarHBondContact O-ND1 3.23Å; T96-H100 PolarHBondContact O-N 3.36Å; H100-L102 PolarHBondContact O-N 3.2Å; H100-A103 PolarHBondContact O-N 2.93Å; H100-R104 WeakPolarHBondContact NE2-CD 3.45Å; H100-R104 PolarHBondContact O-N 3.24Å; H100-G124 PolarHBondContact CE1-O 3.39Å; H100-E127 IonicContact NE2-OE2 3.02Å
101	A	97.1	Very high	95.9	Very high	25 Å²	25	29.5 Å²	29.5	21%	0.207	17%	0.165	C	C	.	.	H	α-helix	trans	-66.9	-36.7	-177.1	0	0	0	0	0	112.3	G97 F98 R105 L322 L326	G97-A101 WeakPolarHBondContact O-CB 3.36Å; G97-A101 PolarHBondContact O-N 3.4Å; G97-A101 VanDerWaalsContact O-N 3.1Å; F98-A101 PolarHBondContact O-N 3.48Å; A101-R105 VanDerWaalsContact O-CB 3.29Å; A101-R105 WeakPolarHBondContact O-CB 3.07Å; A101-R105 PolarHBondContact O-N 2.94Å; A101-R105 VanDerWaalsContact O-N 3.08Å; A101-L322 HydrophobicContact CB-CD1 4.45Å; A101-L326 HydrophobicContact CB-CD1 3.9Å; A101-L326 HydrophobicContact CB-CD2 3.95Å
102	L	97.9	Very high	95.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.3	-45.3	174.8	-176.9	68.1	0	0	0	111.3	I91 F98 G99 H100 R104 R105 I106 V169 L326 M329 L333	I91-L102 HydrophobicContact CD1-CB 4.3Å; I91-L102 HydrophobicContact CD1-CD2 3.87Å; I91-L102 HydrophobicContact CD1-CG 3.91Å; I91-L102 HydrophobicContact CG1-CD2 4.37Å; F98-L102 WeakPolarHBondContact O-CB 3.45Å; F98-L102 PolarHBondContact O-N 3.14Å; G99-L102 PolarHBondContact O-N 2.96Å; H100-L102 PolarHBondContact O-N 3.2Å; L102-R104 VanDerWaalsContact C-N 3.33Å; L102-R104 PolarHBondContact O-N 3.43Å; L102-R105 PolarHBondContact O-N 3.13Å; L102-I106 HydrophobicContact CD1-CG2 3.68Å; L102-I106 HydrophobicContact CG-CD1 4.49Å; L102-I106 HydrophobicContact CG-CG2 4.27Å; L102-I106 WeakPolarHBondContact O-CG1 2.97Å; L102-I106 PolarHBondContact O-N 3Å; L102-V169 HydrophobicContact CD2-CB 4.38Å; L102-V169 HydrophobicContact CD2-CG1 4.04Å; L102-V169 HydrophobicContact CD2-CG2 3.94Å; L102-L326 HydrophobicContact CB-CD2 3.93Å; L102-L326 HydrophobicContact CD1-CD2 4.45Å; L102-M329 HydrophobicContact CB-SD 4.42Å; L102-M329 HydrophobicContact CD1-CB 3.86Å; L102-M329 HydrophobicContact CD1-SD 4.5Å; L102-M329 HydrophobicContact CD2-CB 4.11Å; L102-M329 HydrophobicContact CD2-CG 4.46Å; L102-M329 HydrophobicContact CD2-SD 3.84Å; L102-M329 HydrophobicContact CG-SD 4.49Å; L102-L333 HydrophobicContact CD2-CD1 4.3Å
103	A	97.9	Very high	95.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-55.6	-49	-179.2	0	0	0	0	0	111.3	I91 G99 H100 S107 V113 A115 L128 L136	I91-A103 HydrophobicContact CD1-CB 3.95Å; G99-A103 VanDerWaalsContact O-CB 3.31Å; G99-A103 WeakPolarHBondContact O-CB 3.41Å; G99-A103 PolarHBondContact O-N 2.87Å; H100-A103 PolarHBondContact O-N 2.93Å; A103-S107 VanDerWaalsContact O-CB 3.25Å; A103-S107 WeakPolarHBondContact O-CB 3.48Å; A103-S107 PolarHBondContact O-N 2.87Å; A103-S107 VanDerWaalsContact O-N 3.09Å; A103-S107 PolarHBondContact O-OG 3.41Å; A103-V113 HydrophobicContact CB-CG1 3.92Å; A103-A115 HydrophobicContact CB-CB 4.25Å; A103-L128 HydrophobicContact CB-CD2 4.39Å; A103-L136 HydrophobicContact CB-CD1 4.22Å
104	R	95.7	Very high	95.9	Very high	84 Å²	84	30.5 Å²	30.5	32%	0.317	17%	0.168	S	C	.	.	H	α-helix	trans	-60.3	-51.8	174.5	-68.1	-177.6	58.5	-178	-2.6	111.9	H100 L102 I106 S107 D108 E127 L128	H100-R104 WeakPolarHBondContact NE2-CD 3.45Å; H100-R104 PolarHBondContact O-N 3.24Å; L102-R104 VanDerWaalsContact C-N 3.33Å; L102-R104 PolarHBondContact O-N 3.43Å; R104-I106 PolarHBondContact O-N 3.05Å; R104-S107 PolarHBondContact O-N 2.77Å; R104-S107 PolarHBondContact O-OG 3.35Å; R104-D108 VanDerWaalsContact O-CG 3.29Å; R104-D108 PolarHBondContact O-N 3.5Å; R104-D108 VanDerWaalsContact O-N 3.14Å; R104-E127 IonicContact CZ-OE1 3.25Å; R104-E127 IonicContact NH1-OE1 3.64Å; R104-E127 PolarHBondContact NH1-OE1 3.49Å; R104-L128 HydrophobicContact CG-CD2 3.45Å; R104-L128 VanDerWaalsContact CG-CD2 3.45Å
105	R	95.1	Very high	95.9	Very high	88 Å²	88	30.5 Å²	30.5	33%	0.332	17%	0.168	S	C	.	.	H	α-helix	trans	-59.6	-43.9	-173.5	-177	173.7	-177.1	179.1	-2.2	112.8	A101 L102 L326 D327	A101-R105 VanDerWaalsContact O-CB 3.29Å; A101-R105 WeakPolarHBondContact O-CB 3.07Å; A101-R105 PolarHBondContact O-N 2.94Å; A101-R105 VanDerWaalsContact O-N 3.08Å; L102-R105 PolarHBondContact O-N 3.13Å; R105-L326 VanDerWaalsContact NH1-CB 3.28Å; R105-D327 IonicContact CZ-OD1 3.76Å; R105-D327 IonicContact NH1-OD1 3.94Å; R105-D327 PolarHBondContact NH1-OD1 2.73Å; R105-D327 IonicContact NH2-OD1 3.89Å; R105-D327 PolarHBondContact NH2-OD1 2.99Å
106	I	95.2	Very high	96	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-82.8	-25.4	-177.8	75.3	179.3	0	0	0	111.9	V89 I91 L102 R104 D108 L109 V111 V113 L333 M334	V89-I106 HydrophobicContact CB-CD1 4.09Å; V89-I106 HydrophobicContact CG1-CD1 4.09Å; V89-I106 HydrophobicContact CG2-CD1 4.35Å; I91-I106 HydrophobicContact CD1-CD1 3.87Å; L102-I106 HydrophobicContact CD1-CG2 3.68Å; L102-I106 HydrophobicContact CG-CD1 4.49Å; L102-I106 HydrophobicContact CG-CG2 4.27Å; L102-I106 WeakPolarHBondContact O-CG1 2.97Å; L102-I106 PolarHBondContact O-N 3Å; R104-I106 PolarHBondContact O-N 3.05Å; I106-D108 VanDerWaalsContact C-N 3.29Å; I106-D108 PolarHBondContact O-N 3.21Å; I106-L109 WeakPolarHBondContact O-CB 3.48Å; I106-L109 PolarHBondContact O-N 3.41Å; I106-L109 VanDerWaalsContact O-N 3.1Å; I106-V111 HydrophobicContact CB-CB 4.41Å; I106-V111 HydrophobicContact CB-CG2 4.24Å; I106-V111 HydrophobicContact CD1-CG1 4.28Å; I106-V111 HydrophobicContact CG1-CB 4.32Å; I106-V111 HydrophobicContact CG1-CG1 4.43Å; I106-V111 VanDerWaalsContact O-CB 3.26Å; I106-V111 WeakPolarHBondContact O-CB 3.48Å; I106-V111 VanDerWaalsContact O-CG2 3.25Å; I106-V111 WeakPolarHBondContact O-CG2 3.43Å; I106-V111 PolarHBondContact O-N 2.81Å; I106-V113 HydrophobicContact CD1-CG2 3.9Å; I106-V113 HydrophobicContact CG1-CG2 3.46Å; I106-V113 VanDerWaalsContact CG1-CG2 3.46Å; I106-L333 HydrophobicContact CD1-CD1 4.21Å; I106-M334 HydrophobicContact CB-CE 4.05Å; I106-M334 HydrophobicContact CG2-CE 3.6Å
107	S	94.6	Very high	96.2	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.014	14%	0.143	C	C	.	.	H	α-helix	trans	-63.9	-38.4	173.1	76.3	0	0	0	0	111.4	A103 R104 L109 G110 S133	A103-S107 VanDerWaalsContact O-CB 3.25Å; A103-S107 WeakPolarHBondContact O-CB 3.48Å; A103-S107 PolarHBondContact O-N 2.87Å; A103-S107 VanDerWaalsContact O-N 3.09Å; A103-S107 PolarHBondContact O-OG 3.41Å; R104-S107 PolarHBondContact O-N 2.77Å; R104-S107 PolarHBondContact O-OG 3.35Å; S107-L109 PolarHBondContact O-N 2.94Å; S107-L109 VanDerWaalsContact O-N 3.1Å; S107-G110 PolarHBondContact O-N 3.5Å; S107-S133 WeakPolarHBondContact CB-OG 3.48Å; S107-S133 PolarHBondContact O-OG 3.46Å; S107-S133 PolarHBondContact OG-OG 3.29Å
108	D	91.3	Very high	96.2	Very high	111 Å²	111	30.1 Å²	30.1	59%	0.594	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-16	175.4	-63.9	-13.9	0	0	0	113.1	R104 I106 G110	R104-D108 VanDerWaalsContact O-CG 3.29Å; R104-D108 PolarHBondContact O-N 3.5Å; R104-D108 VanDerWaalsContact O-N 3.14Å; I106-D108 VanDerWaalsContact C-N 3.29Å; I106-D108 PolarHBondContact O-N 3.21Å; D108-G110 VanDerWaalsContact C-N 3.32Å
109	L	90.6	Very high	96.2	Very high	98 Å²	98	32.1 Å²	32.1	51%	0.513	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	10.1	174.9	-60.3	172.8	0	0	0	112.8	I106 S107 M334	I106-L109 WeakPolarHBondContact O-CB 3.48Å; I106-L109 PolarHBondContact O-N 3.41Å; I106-L109 VanDerWaalsContact O-N 3.1Å; S107-L109 PolarHBondContact O-N 2.94Å; S107-L109 VanDerWaalsContact O-N 3.1Å; L109-M334 HydrophobicContact CD1-CE 3.83Å; L109-M334 HydrophobicContact CD1-SD 4.26Å
110	G	90.5	Very high	96.1	Very high	32 Å²	32	36.2 Å²	36.2	33%	0.33	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	22.6	178.7	0	0	0	0	0	114.1	S107 D108	S107-G110 PolarHBondContact O-N 3.5Å; D108-G110 VanDerWaalsContact C-N 3.32Å
111	V	95.1	Very high	96	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.006	21%	0.213	C	C	.	.			trans	-84.3	136.1	172.1	-174	0	0	0	0	109.1	M84 R87 V89 I106 V113	M84-V111 HydrophobicContact CB-CG2 3.54Å; M84-V111 HydrophobicContact CE-CG2 4.28Å; M84-V111 HydrophobicContact CG-CG2 4.47Å; R87-V111 VanDerWaalsContact O-CG1 3.31Å; R87-V111 WeakPolarHBondContact O-CG1 3.4Å; V89-V111 HydrophobicContact CB-CG1 4.21Å; V89-V111 HydrophobicContact CG2-CG1 3.76Å; I106-V111 HydrophobicContact CB-CB 4.41Å; I106-V111 HydrophobicContact CB-CG2 4.24Å; I106-V111 HydrophobicContact CD1-CG1 4.28Å; I106-V111 HydrophobicContact CG1-CB 4.32Å; I106-V111 HydrophobicContact CG1-CG1 4.43Å; I106-V111 VanDerWaalsContact O-CB 3.26Å; I106-V111 WeakPolarHBondContact O-CB 3.48Å; I106-V111 VanDerWaalsContact O-CG2 3.25Å; I106-V111 WeakPolarHBondContact O-CG2 3.43Å; I106-V111 PolarHBondContact O-N 2.81Å; V111-V113 HydrophobicContact CB-CG2 4.27Å; V111-V113 HydrophobicContact CG1-CG2 4.23Å; V111-V113 PolarHBondContact O-N 2.74Å
112	T	97.4	Very high	96	Very high	44 Å²	44	39.4 Å²	39.4	27%	0.27	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	114.6	166.7	-56.5	0	0	0	0	108.5	R87 A88 V89 F114 G135	R87-T112 PolarHBondContact O-N 3.13Å; A88-T112 CarbonylContact C-O 3.54Å; A88-T112 VanDerWaalsContact CA-O 3.22Å; A88-T112 WeakPolarHBondContact CA-O 3Å; A88-T112 HydrophobicContact CB-CG2 4.46Å; V89-T112 PolarHBondContact N-O 3.4Å; T112-F114 HydrophobicContact CG2-CE1 4.49Å; T112-F114 HydrophobicContact CG2-CE2 4.28Å; T112-F114 HydrophobicContact CG2-CZ 4.03Å; T112-G135 CarbonylContact C-O 3.57Å; T112-G135 VanDerWaalsContact CA-O 3.32Å; T112-G135 WeakPolarHBondContact CA-O 3.49Å
113	V	98.4	Very high	95.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	119.5	-175.9	-178.8	0	0	0	0	109.7	V89 I91 A103 I106 V111 A115 G135 L136 Q137	V89-V113 WeakPolarHBondContact O-CA 3.37Å; I91-V113 HydrophobicContact CD1-CG1 3.89Å; I91-V113 HydrophobicContact CG1-CG1 4.46Å; A103-V113 HydrophobicContact CB-CG1 3.92Å; I106-V113 HydrophobicContact CD1-CG2 3.9Å; I106-V113 HydrophobicContact CG1-CG2 3.46Å; I106-V113 VanDerWaalsContact CG1-CG2 3.46Å; V111-V113 HydrophobicContact CB-CG2 4.27Å; V111-V113 HydrophobicContact CG1-CG2 4.23Å; V111-V113 PolarHBondContact O-N 2.74Å; V113-A115 HydrophobicContact CG1-CB 4.41Å; V113-G135 PolarHBondContact N-O 2.9Å; V113-L136 HydrophobicContact CB-CG 4.29Å; V113-L136 HydrophobicContact CG1-CG 4.49Å; V113-Q137 PolarHBondContact O-N 2.95Å
114	F	98.7	Very high	95.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	100.7	164.8	-57.5	-71.5	0	0	0	108.1	A88 V89 L90 I91 T112 G116 Q137 L139 Y155 I156 Q159 V160 L165	A88-F114 HydrophobicContact CB-CE2 3.85Å; V89-F114 PolarHBondContact O-N 3.26Å; L90-F114 WeakPolarHBondContact CA-O 3.1Å; L90-F114 HydrophobicContact CD1-CB 3.95Å; L90-F114 WeakPolarHBondContact CD1-O 3.44Å; I91-F114 PolarHBondContact N-O 3.17Å; T112-F114 HydrophobicContact CG2-CE1 4.49Å; T112-F114 HydrophobicContact CG2-CE2 4.28Å; T112-F114 HydrophobicContact CG2-CZ 4.03Å; F114-G116 PolarHBondContact O-N 3.4Å; F114-Q137 CarbonylContact C-O 3.59Å; F114-Q137 WeakPolarHBondContact CA-O 3.19Å; F114-Q137 HydrophobicContact CD1-CB 4.23Å; F114-Q137 VanDerWaalsContact CE1-OE1 3.27Å; F114-L139 HydrophobicContact CB-CD1 3.84Å; F114-L139 HydrophobicContact CD1-CD1 4.07Å; F114-L139 HydrophobicContact CG-CD1 4.3Å; F114-Y155 HydrophobicContact CD1-CE1 4.3Å; F114-Y155 HydrophobicContact CE1-CD1 4.47Å; F114-Y155 HydrophobicContact CE1-CE1 4.04Å; F114-I156 HydrophobicContact CB-CD1 3.9Å; F114-I156 HydrophobicContact CB-CG1 4.33Å; F114-I156 HydrophobicContact CD1-CD1 4.35Å; F114-I156 HydrophobicContact CD1-CG1 3.84Å; F114-I156 HydrophobicContact CD2-CD1 3.92Å; F114-I156 HydrophobicContact CD2-CG1 3.77Å; F114-I156 HydrophobicContact CD2-CG2 4.13Å; F114-I156 HydrophobicContact CE1-CG1 4.03Å; F114-I156 HydrophobicContact CE2-CB 4.35Å; F114-I156 HydrophobicContact CE2-CG1 3.94Å; F114-I156 HydrophobicContact CE2-CG2 3.8Å; F114-I156 HydrophobicContact CG-CD1 3.8Å; F114-I156 HydrophobicContact CG-CG1 3.71Å; F114-I156 HydrophobicContact CZ-CG1 4.09Å; F114-I156 HydrophobicContact CZ-CG2 4.32Å; F114-Q159 HydrophobicContact CE1-CB 4.09Å; F114-Q159 HydrophobicContact CE1-CG 4.02Å; F114-Q159 HydrophobicContact CZ-CB 3.65Å; F114-Q159 HydrophobicContact CZ-CG 4.11Å; F114-V160 HydrophobicContact CE2-CG1 3.88Å; F114-V160 HydrophobicContact CZ-CG1 4.22Å; F114-L165 HydrophobicContact CD2-CD1 4.21Å; F114-L165 HydrophobicContact CE2-CD1 4.31Å
115	A	98.7	Very high	95.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	96.2	-180	0	0	0	0	0	110	C94 A103 V113 V117 L128 L136 Q137 V138 L139	C94-A115 HydrophobicContact CB-CB 3.91Å; A103-A115 HydrophobicContact CB-CB 4.25Å; V113-A115 HydrophobicContact CG1-CB 4.41Å; A115-V117 PolarHBondContact O-N 2.77Å; A115-L128 HydrophobicContact CB-CD1 4.01Å; A115-L136 HydrophobicContact CB-CD2 4.27Å; A115-Q137 PolarHBondContact N-O 3.38Å; A115-V138 HydrophobicContact CB-CG2 4.43Å; A115-V138 WeakPolarHBondContact O-CA 3.47Å; A115-L139 PolarHBondContact O-N 3Å
116	G	98.6	Very high	96	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	118.4	173.8	0	0	0	0	0	111.3	I91 T92 G93 C94 F114 L139	I91-G116 WeakPolarHBondContact O-CA 3.41Å; I91-G116 PolarHBondContact O-N 3.36Å; T92-G116 CarbonylContact C-O 3.6Å; G93-G116 PolarHBondContact N-O 3.47Å; C94-G116 PolarHBondContact N-O 3.31Å; F114-G116 PolarHBondContact O-N 3.4Å; G116-L139 CarbonylContact C-O 3.57Å; G116-L139 WeakPolarHBondContact CA-O 3.38Å
117	V	98.5	Very high	96	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	145.4	179.1	-63.8	0	0	0	0	110.2	C94 D95 A115 D119 E120 A125 V138 L139 L141	C94-V117 HydrophobicContact CB-CG1 3.75Å; D95-V117 VanDerWaalsContact OD2-CA 3.27Å; D95-V117 WeakPolarHBondContact OD2-CA 3.37Å; A115-V117 PolarHBondContact O-N 2.77Å; V117-D119 VanDerWaalsContact C-N 3.32Å; V117-E120 HydrophobicContact CG2-CB 4.24Å; V117-A125 HydrophobicContact CB-CB 4.28Å; V117-A125 HydrophobicContact CG1-CB 4.11Å; V117-A125 HydrophobicContact CG2-CB 3.97Å; V117-V138 HydrophobicContact CB-CG1 4.46Å; V117-V138 HydrophobicContact CG1-CG1 4.07Å; V117-V138 HydrophobicContact CG2-CG1 3.49Å; V117-V138 VanDerWaalsContact CG2-CG1 3.49Å; V117-L139 WeakPolarHBondContact CG2-O 3.4Å; V117-L139 PolarHBondContact N-O 2.94Å; V117-L141 CarbonylContact O-C 3.53Å; V117-L141 PolarHBondContact O-N 3.36Å
118	L	97.3	Very high	96.2	Very high	101 Å²	101	43.9 Å²	43.9	53%	0.529	25%	0.254	S	S	.	.	S	Bend	trans	-69.5	-34.1	176.1	-179.6	62.9	0	0	0	111.2	D95 Q140 D142	D95-L118 PolarHBondContact OD1-N 3.05Å; D95-L118 VanDerWaalsContact OD1-N 3.16Å; D95-L118 PolarHBondContact OD2-N 3.38Å; L118-Q140 PolarHBondContact O-NE2 3.12Å; L118-D142 HydrophobicContact CD1-CB 3.75Å
119	D	96.3	Very high	96.3	Very high	68 Å²	68	43.9 Å²	43.9	36%	0.364	25%	0.248	S	C	.	.			trans	-134.9	112.8	175.3	175.1	8.3	0	0	0	110	D95 V117 T121 S122 A125	D95-D119 PolarHBondContact OD1-N 3.16Å; V117-D119 VanDerWaalsContact C-N 3.32Å; D119-T121 VanDerWaalsContact CG-OG1 3.29Å; D119-T121 PolarHBondContact O-N 3.4Å; D119-T121 VanDerWaalsContact O-N 3.15Å; D119-T121 WeakPolarHBondContact OD1-CA 3.5Å; D119-T121 WeakPolarHBondContact OD1-CB 3.28Å; D119-T121 PolarHBondContact OD1-N 2.98Å; D119-T121 PolarHBondContact OD1-OG1 2.84Å; D119-T121 PolarHBondContact OD2-OG1 3.33Å; D119-S122 VanDerWaalsContact O-CB 3.23Å; D119-S122 WeakPolarHBondContact O-CB 3.24Å; D119-S122 PolarHBondContact O-N 3.16Å; D119-S122 PolarHBondContact O-OG 3.18Å; D119-A125 WeakPolarHBondContact O-CB 3.48Å
120	E	95.7	Very high	96.4	Very high	86 Å²	86	47.7 Å²	47.7	40%	0.402	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-12.1	179.1	70.3	167.3	-174.3	0	0	115	V117 A125 K129 Q140	V117-E120 HydrophobicContact CG2-CB 4.24Å; E120-A125 WeakPolarHBondContact O-CB 3.48Å; E120-K129 PolarHBondContact O-NZ 3.21Å; E120-K129 IonicContact OE2-NZ 3.09Å; E120-Q140 HydrophobicContact CB-CB 4.4Å
121	T	96.1	Very high	96.3	Very high	98 Å²	98	49.2 Å²	49.2	60%	0.601	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-4.7	175.7	74.6	0	0	0	0	112.7	D119	D119-T121 VanDerWaalsContact CG-OG1 3.29Å; D119-T121 PolarHBondContact O-N 3.4Å; D119-T121 VanDerWaalsContact O-N 3.15Å; D119-T121 WeakPolarHBondContact OD1-CA 3.5Å; D119-T121 WeakPolarHBondContact OD1-CB 3.28Å; D119-T121 PolarHBondContact OD1-N 2.98Å; D119-T121 PolarHBondContact OD1-OG1 2.84Å; D119-T121 PolarHBondContact OD2-OG1 3.33Å
122	S	96.1	Very high	95.6	Very high	15 Å²	15	50.2 Å²	50.2	11%	0.105	27%	0.267	C	S	.	.	S	Bend	trans	-59.3	151.3	177.4	69.6	0	0	0	0	111.6	D95 D119 G124 A125 V126	D95-S122 PolarHBondContact OD1-OG 3.4Å; D119-S122 VanDerWaalsContact O-CB 3.23Å; D119-S122 WeakPolarHBondContact O-CB 3.24Å; D119-S122 PolarHBondContact O-N 3.16Å; D119-S122 PolarHBondContact O-OG 3.18Å; S122-G124 PolarHBondContact O-N 2.96Å; S122-G124 VanDerWaalsContact O-N 3.16Å; S122-A125 PolarHBondContact O-N 3.45Å; S122-A125 VanDerWaalsContact OG-CB 3.28Å; S122-A125 WeakPolarHBondContact OG-CB 3.35Å; S122-A125 PolarHBondContact OG-N 3.05Å; S122-V126 WeakPolarHBondContact O-CG2 3.18Å; S122-V126 PolarHBondContact O-N 2.86Å
123	P	96.1	Very high	95	Very high	113 Å²	113	49.9 Å²	49.9	73%	0.734	27%	0.266	S	S	*	.	H	α-helix	trans	-53.7	-39	179	-28.1	35.3	0	0	0	113.3	E127	P123-E127 WeakPolarHBondContact O-CB 3.27Å; P123-E127 PolarHBondContact O-N 3.23Å
124	G	96.3	Very high	94.4	Very high	10 Å²	10	59.5 Å²	59.5	10%	0.103	31%	0.312	C	S	.	.	H	α-helix	trans	-71.1	-38.1	177.8	0	0	0	0	0	113.3	D95 H100 S122 E127 L128	D95-G124 WeakPolarHBondContact O-CA 3.1Å; H100-G124 PolarHBondContact CE1-O 3.39Å; S122-G124 PolarHBondContact O-N 2.96Å; S122-G124 VanDerWaalsContact O-N 3.16Å; G124-E127 PolarHBondContact O-N 3.27Å; G124-L128 WeakPolarHBondContact O-CG 3.4Å; G124-L128 PolarHBondContact O-N 3.05Å
125	A	96.9	Very high	93.9	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-63.4	-42.3	173.4	0	0	0	0	0	111.9	V117 D119 E120 S122 L128 K129 V138	V117-A125 HydrophobicContact CB-CB 4.28Å; V117-A125 HydrophobicContact CG1-CB 4.11Å; V117-A125 HydrophobicContact CG2-CB 3.97Å; D119-A125 WeakPolarHBondContact O-CB 3.48Å; E120-A125 WeakPolarHBondContact O-CB 3.48Å; S122-A125 PolarHBondContact O-N 3.45Å; S122-A125 VanDerWaalsContact OG-CB 3.28Å; S122-A125 WeakPolarHBondContact OG-CB 3.35Å; S122-A125 PolarHBondContact OG-N 3.05Å; A125-L128 PolarHBondContact O-N 2.97Å; A125-K129 WeakPolarHBondContact O-CG 3.19Å; A125-K129 PolarHBondContact O-N 2.6Å; A125-V138 HydrophobicContact CB-CG1 4.16Å
126	V	97.2	Very high	93.8	Very high	76 Å²	76	61.5 Å²	61.5	46%	0.461	33%	0.327	S	S	.	.	H	α-helix	trans	-63.4	-41.8	175.1	174.5	0	0	0	0	111.1	S122 K129 R130	S122-V126 WeakPolarHBondContact O-CG2 3.18Å; S122-V126 PolarHBondContact O-N 2.86Å; V126-K129 PolarHBondContact O-N 3.21Å; V126-R130 WeakPolarHBondContact O-CB 3.37Å; V126-R130 PolarHBondContact O-N 3.24Å
127	E	96.5	Very high	93.7	Very high	67 Å²	67	63.7 Å²	63.7	31%	0.313	34%	0.337	S	S	.	.	H	α-helix	trans	-61.5	-45.4	174.7	-175.4	-178.8	171.5	0	0	111.6	H100 R104 P123 G124 K129 R130 L131	H100-E127 IonicContact NE2-OE2 3.02Å; R104-E127 IonicContact CZ-OE1 3.25Å; R104-E127 IonicContact NH1-OE1 3.64Å; R104-E127 PolarHBondContact NH1-OE1 3.49Å; P123-E127 WeakPolarHBondContact O-CB 3.27Å; P123-E127 PolarHBondContact O-N 3.23Å; G124-E127 PolarHBondContact O-N 3.27Å; E127-K129 VanDerWaalsContact C-N 3.35Å; E127-K129 PolarHBondContact O-N 3.33Å; E127-R130 PolarHBondContact O-N 3.22Å; E127-R130 VanDerWaalsContact O-N 3.13Å; E127-L131 HydrophobicContact CG-CD1 3.7Å; E127-L131 HydrophobicContact CG-CG 4.21Å; E127-L131 WeakPolarHBondContact O-CB 3.42Å; E127-L131 PolarHBondContact O-N 2.9Å
128	L	97	Very high	93.7	Very high	1 Å²	1	64.8 Å²	64.8	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-60.3	-42.3	176.5	-72.2	-179.6	0	0	0	112.1	C94 A103 R104 A115 G124 A125 R130 G132 L136 V138	C94-L128 HydrophobicContact CB-CD1 3.87Å; C94-L128 WeakPolarHBondContact O-CD1 3.39Å; A103-L128 HydrophobicContact CB-CD2 4.39Å; R104-L128 HydrophobicContact CG-CD2 3.45Å; R104-L128 VanDerWaalsContact CG-CD2 3.45Å; A115-L128 HydrophobicContact CB-CD1 4.01Å; G124-L128 WeakPolarHBondContact O-CG 3.4Å; G124-L128 PolarHBondContact O-N 3.05Å; A125-L128 PolarHBondContact O-N 2.97Å; L128-R130 VanDerWaalsContact C-N 3.28Å; L128-R130 PolarHBondContact O-N 3.49Å; L128-G132 VanDerWaalsContact O-CA 3.26Å; L128-G132 WeakPolarHBondContact O-CA 3.48Å; L128-G132 PolarHBondContact O-N 3.43Å; L128-L136 HydrophobicContact CB-CD2 3.98Å; L128-L136 HydrophobicContact CD2-CD1 4.09Å; L128-V138 HydrophobicContact CB-CG2 3.64Å; L128-V138 HydrophobicContact CD1-CG2 4.4Å
129	K	95.2	Very high	93.7	Very high	111 Å²	111	61 Å²	61	48%	0.483	32%	0.324	S	S	.	.	H	α-helix	trans	-62.7	-34.5	175.3	-72	171	179.7	171.1	0	112.3	E120 A125 V126 E127 V138	E120-K129 PolarHBondContact O-NZ 3.21Å; E120-K129 IonicContact OE2-NZ 3.09Å; A125-K129 WeakPolarHBondContact O-CG 3.19Å; A125-K129 PolarHBondContact O-N 2.6Å; V126-K129 PolarHBondContact O-N 3.21Å; E127-K129 VanDerWaalsContact C-N 3.35Å; E127-K129 PolarHBondContact O-N 3.33Å; K129-V138 HydrophobicContact CD-CB 4.47Å; K129-V138 HydrophobicContact CG-CB 3.91Å; K129-V138 HydrophobicContact CG-CG2 3.73Å
130	R	92.6	Very high	93.8	Very high	178 Å²	178	61 Å²	61	67%	0.672	32%	0.322	S	S	*	.	H	α-helix	trans	-85.7	-40.1	-175.6	-171.5	-174.3	69.1	84	-3.6	113.7	V126 E127 L128	V126-R130 WeakPolarHBondContact O-CB 3.37Å; V126-R130 PolarHBondContact O-N 3.24Å; E127-R130 PolarHBondContact O-N 3.22Å; E127-R130 VanDerWaalsContact O-N 3.13Å; L128-R130 VanDerWaalsContact C-N 3.28Å; L128-R130 PolarHBondContact O-N 3.49Å
131	L	87.9	Confident	94	Very high	64 Å²	64	57.1 Å²	57.1	34%	0.335	30%	0.304	S	S	.	.	H	α-helix	trans	-106.1	-11.1	-172.6	-68	-174.2	0	0	0	113.5	E127	E127-L131 HydrophobicContact CG-CD1 3.7Å; E127-L131 HydrophobicContact CG-CG 4.21Å; E127-L131 WeakPolarHBondContact O-CB 3.42Å; E127-L131 PolarHBondContact O-N 2.9Å
132	G	79.5	Confident	94.1	Very high	23 Å²	23	54.6 Å²	54.6	24%	0.237	29%	0.287	C	S	.	.	S	Bend	trans	-63.3	148.2	176.2	0	0	0	0	0	111.5	L128	L128-G132 VanDerWaalsContact O-CA 3.26Å; L128-G132 WeakPolarHBondContact O-CA 3.48Å; L128-G132 PolarHBondContact O-N 3.43Å
133	S	86.1	Confident	94.2	Very high	36 Å²	36	54.3 Å²	54.3	25%	0.252	29%	0.285	S	S	.	.			trans	-62.6	166.9	167.6	73.3	0	0	0	0	111.2	S107 G135 L136	S107-S133 WeakPolarHBondContact CB-OG 3.48Å; S107-S133 PolarHBondContact O-OG 3.46Å; S107-S133 PolarHBondContact OG-OG 3.29Å; S133-G135 PolarHBondContact O-N 2.95Å; S133-G135 PolarHBondContact OG-N 3.15Å; S133-L136 WeakPolarHBondContact O-CB 3.47Å; S133-L136 PolarHBondContact O-N 3.34Å
134	E	84.6	Confident	94.3	Very high	203 Å²	203	52.2 Å²	52.2	95%	0.949	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-26	175.2	-67.1	-173.9	162.9	0	0	113.7	L136	E134-L136 VanDerWaalsContact C-N 3.33Å
135	G	88.1	Confident	94.4	Very high	22 Å²	22	54.3 Å²	54.3	23%	0.227	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-7.7	177.3	0	0	0	0	0	114.9	T112 V113 S133	T112-G135 CarbonylContact C-O 3.57Å; T112-G135 VanDerWaalsContact CA-O 3.32Å; T112-G135 WeakPolarHBondContact CA-O 3.49Å; V113-G135 PolarHBondContact N-O 2.9Å; S133-G135 PolarHBondContact O-N 2.95Å; S133-G135 PolarHBondContact OG-N 3.15Å
136	L	96.9	Very high	94.4	Very high	19 Å²	19	56.6 Å²	56.6	10%	0.099	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	121.2	-177.3	-166.3	156.3	0	0	0	111.1	A103 V113 A115 L128 S133 E134 V138	A103-L136 HydrophobicContact CB-CD1 4.22Å; V113-L136 HydrophobicContact CB-CG 4.29Å; V113-L136 HydrophobicContact CG1-CG 4.49Å; A115-L136 HydrophobicContact CB-CD2 4.27Å; L128-L136 HydrophobicContact CB-CD2 3.98Å; L128-L136 HydrophobicContact CD2-CD1 4.09Å; S133-L136 WeakPolarHBondContact O-CB 3.47Å; S133-L136 PolarHBondContact O-N 3.34Å; E134-L136 VanDerWaalsContact C-N 3.33Å; L136-V138 HydrophobicContact CD2-CG2 3.79Å
137	Q	97.4	Very high	94.5	Very high	46 Å²	46	55.2 Å²	55.2	22%	0.215	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	121.8	178.7	-57.9	-178.5	13.2	0	0	109.9	V113 F114 A115 Y155	V113-Q137 PolarHBondContact O-N 2.95Å; F114-Q137 CarbonylContact C-O 3.59Å; F114-Q137 WeakPolarHBondContact CA-O 3.19Å; F114-Q137 HydrophobicContact CD1-CB 4.23Å; F114-Q137 VanDerWaalsContact CE1-OE1 3.27Å; A115-Q137 PolarHBondContact N-O 3.38Å; Q137-Y155 VanDerWaalsContact OE1-CE1 3.29Å; Q137-Y155 PolarHBondContact OE1-OH 3.44Å
138	V	98.3	Very high	94.6	Very high	23 Å²	23	53.2 Å²	53.2	14%	0.139	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	129.9	177.1	176.6	0	0	0	0	109.8	A115 V117 A125 L128 K129 L136	A115-V138 HydrophobicContact CB-CG2 4.43Å; A115-V138 WeakPolarHBondContact O-CA 3.47Å; V117-V138 HydrophobicContact CB-CG1 4.46Å; V117-V138 HydrophobicContact CG1-CG1 4.07Å; V117-V138 HydrophobicContact CG2-CG1 3.49Å; V117-V138 VanDerWaalsContact CG2-CG1 3.49Å; A125-V138 HydrophobicContact CB-CG1 4.16Å; L128-V138 HydrophobicContact CB-CG2 3.64Å; L128-V138 HydrophobicContact CD1-CG2 4.4Å; K129-V138 HydrophobicContact CD-CB 4.47Å; K129-V138 HydrophobicContact CG-CB 3.91Å; K129-V138 HydrophobicContact CG-CG2 3.73Å; L136-V138 HydrophobicContact CD2-CG2 3.79Å
139	L	97.9	Very high	94.7	Very high	22 Å²	22	53.1 Å²	53.1	12%	0.115	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	130.7	-179.8	-56.7	-178	0	0	0	110.6	F114 A115 G116 V117 L141 A152 Y155 I156	F114-L139 HydrophobicContact CB-CD1 3.84Å; F114-L139 HydrophobicContact CD1-CD1 4.07Å; F114-L139 HydrophobicContact CG-CD1 4.3Å; A115-L139 PolarHBondContact O-N 3Å; G116-L139 CarbonylContact C-O 3.57Å; G116-L139 WeakPolarHBondContact CA-O 3.38Å; V117-L139 WeakPolarHBondContact CG2-O 3.4Å; V117-L139 PolarHBondContact N-O 2.94Å; L139-L141 PolarHBondContact O-N 3.1Å; L139-A152 HydrophobicContact CD1-CB 4.45Å; L139-Y155 HydrophobicContact CD1-CD1 4.23Å; L139-Y155 HydrophobicContact CD2-CD1 3.71Å; L139-Y155 HydrophobicContact CD2-CE1 3.64Å; L139-I156 HydrophobicContact CD1-CD1 3.93Å; L139-I156 HydrophobicContact CD1-CG1 4.18Å
140	Q	98.2	Very high	94.8	Very high	69 Å²	69	52.6 Å²	52.6	32%	0.322	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	113.3	165.8	179	57.3	52.7	0	0	109.3	L118 E120	L118-Q140 PolarHBondContact O-NE2 3.12Å; E120-Q140 HydrophobicContact CB-CB 4.4Å
141	L	98.6	Very high	95.1	Very high	4 Å²	4	51 Å²	51	2%	0.021	28%	0.278	C	S	.	.			trans	-150.3	88.6	-174.6	-177	60.4	0	0	0	111.3	L90 T92 V117 L139 V143 Q148 I149 A152	L90-L141 HydrophobicContact CD1-CD2 4.2Å; T92-L141 HydrophobicContact CG2-CD2 4.22Å; V117-L141 CarbonylContact O-C 3.53Å; V117-L141 PolarHBondContact O-N 3.36Å; L139-L141 PolarHBondContact O-N 3.1Å; L141-V143 HydrophobicContact CG-CG1 4.26Å; L141-V143 PolarHBondContact O-N 2.91Å; L141-Q148 HydrophobicContact CD1-CB 4.26Å; L141-I149 HydrophobicContact CD1-CB 4.48Å; L141-I149 HydrophobicContact CD1-CG1 3.99Å; L141-A152 HydrophobicContact CD1-CB 4.08Å
142	D	98.4	Very high	95.6	Very high	44 Å²	44	48.3 Å²	48.3	24%	0.235	26%	0.264	C	S	.	.			trans	-71.8	112.6	156.4	-172.3	-20.3	0	0	0	108.9	L118 T144 D145	L118-D142 HydrophobicContact CD1-CB 3.75Å; D142-T144 PolarHBondContact O-N 2.84Å; D142-T144 VanDerWaalsContact O-N 3.14Å; D142-T144 WeakPolarHBondContact OD1-CB 3.25Å; D142-T144 PolarHBondContact OD1-N 2.93Å; D142-T144 PolarHBondContact OD1-OG1 2.9Å; D142-T144 PolarHBondContact OD2-OG1 2.91Å; D142-D145 HydrophobicContact CB-CB 4.08Å; D142-D145 PolarHBondContact O-N 2.73Å
143	V	98.3	Very high	96.5	Very high	10 Å²	10	49.1 Å²	49.1	6%	0.061	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-3.9	-178.3	-59.6	0	0	0	0	113.6	T92 L141 A172 V195 A199 V203	T92-V143 HydrophobicContact CG2-CG1 3.81Å; L141-V143 HydrophobicContact CG-CG1 4.26Å; L141-V143 PolarHBondContact O-N 2.91Å; V143-A172 HydrophobicContact CG1-CB 4.01Å; V143-A172 HydrophobicContact CG2-CB 3.82Å; V143-V195 HydrophobicContact CG2-CG1 4.38Å; V143-A199 HydrophobicContact CB-CB 3.79Å; V143-A199 HydrophobicContact CG2-CB 3.55Å; V143-A199 WeakPolarHBondContact O-CA 3.24Å; V143-A199 WeakPolarHBondContact O-CB 3.33Å; V143-V203 HydrophobicContact CB-CG2 4.42Å; V143-V203 HydrophobicContact CG1-CG2 4.38Å
144	T	98.1	Very high	97.1	Very high	68 Å²	68	53.7 Å²	53.7	42%	0.417	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-3.9	172.4	68.3	0	0	0	0	113.2	D142 V195	D142-T144 PolarHBondContact O-N 2.84Å; D142-T144 VanDerWaalsContact O-N 3.14Å; D142-T144 WeakPolarHBondContact OD1-CB 3.25Å; D142-T144 PolarHBondContact OD1-N 2.93Å; D142-T144 PolarHBondContact OD1-OG1 2.9Å; D142-T144 PolarHBondContact OD2-OG1 2.91Å; T144-V195 HydrophobicContact CG2-CB 4.47Å; T144-V195 HydrophobicContact CG2-CG2 3.74Å
145	D	98.6	Very high	97.8	Very high	55 Å²	55	48.3 Å²	48.3	29%	0.294	25%	0.25	S	S	.	.			trans	-103.5	101.8	175.8	179.6	-9.6	0	0	0	110.1	D142 A147 Q148 I149	D142-D145 HydrophobicContact CB-CB 4.08Å; D142-D145 PolarHBondContact O-N 2.73Å; D145-A147 PolarHBondContact O-N 3.08Å; D145-A147 VanDerWaalsContact O-N 3.12Å; D145-A147 WeakPolarHBondContact OD1-CA 3.34Å; D145-A147 VanDerWaalsContact OD1-CB 3.32Å; D145-A147 WeakPolarHBondContact OD1-CB 3.4Å; D145-A147 PolarHBondContact OD1-N 3.3Å; D145-Q148 HydrophobicContact CB-CB 4.05Å; D145-Q148 HydrophobicContact CB-CG 4.15Å; D145-Q148 WeakPolarHBondContact O-CA 3.3Å; D145-Q148 WeakPolarHBondContact O-CB 3.41Å; D145-Q148 PolarHBondContact O-N 3.15Å; D145-Q148 PolarHBondContact OD1-N 2.83Å; D145-Q148 WeakPolarHBondContact OD2-CG 3.3Å; D145-Q148 PolarHBondContact OD2-NE2 3.1Å; D145-I149 PolarHBondContact O-N 2.85Å
146	A	98	Very high	98.3	Very high	47 Å²	47	47.2 Å²	47.2	39%	0.388	24%	0.24	S	C	.	.	H	α-helix	trans	-51	-36.6	177.4	0	0	0	0	0	113.1	I149 E150 E202	A146-I149 PolarHBondContact O-N 3.32Å; A146-E150 WeakPolarHBondContact O-CG 3.24Å; A146-E150 PolarHBondContact O-N 2.79Å; A146-E202 VanDerWaalsContact CA-OE1 3.29Å; A146-E202 WeakPolarHBondContact CA-OE1 3.33Å; A146-E202 WeakPolarHBondContact CB-OE1 3.3Å
147	A	98.3	Very high	98.3	Very high	48 Å²	48	48.3 Å²	48.3	40%	0.397	25%	0.248	S	C	.	.	H	α-helix	trans	-72.1	-32.4	-179.8	0	0	0	0	0	111.8	D145 R151	D145-A147 PolarHBondContact O-N 3.08Å; D145-A147 VanDerWaalsContact O-N 3.12Å; D145-A147 WeakPolarHBondContact OD1-CA 3.34Å; D145-A147 VanDerWaalsContact OD1-CB 3.32Å; D145-A147 WeakPolarHBondContact OD1-CB 3.4Å; D145-A147 PolarHBondContact OD1-N 3.3Å; A147-R151 VanDerWaalsContact C-NH1 3.29Å; A147-R151 WeakPolarHBondContact O-CB 3.4Å; A147-R151 VanDerWaalsContact O-CG 3.29Å; A147-R151 WeakPolarHBondContact O-CG 3.34Å; A147-R151 PolarHBondContact O-N 3.2Å; A147-R151 VanDerWaalsContact O-N 3.08Å; A147-R151 PolarHBondContact O-NH1 3.42Å
148	Q	98.6	Very high	98.3	Very high	24 Å²	24	50.3 Å²	50.3	11%	0.112	26%	0.264	C	S	.	.	H	α-helix	trans	-69.4	-41.3	171.7	-78.2	-179.3	63.3	0	0	111.7	L141 D145 E150 R151 A152	L141-Q148 HydrophobicContact CD1-CB 4.26Å; D145-Q148 HydrophobicContact CB-CB 4.05Å; D145-Q148 HydrophobicContact CB-CG 4.15Å; D145-Q148 WeakPolarHBondContact O-CA 3.3Å; D145-Q148 WeakPolarHBondContact O-CB 3.41Å; D145-Q148 PolarHBondContact O-N 3.15Å; D145-Q148 PolarHBondContact OD1-N 2.83Å; D145-Q148 WeakPolarHBondContact OD2-CG 3.3Å; D145-Q148 PolarHBondContact OD2-NE2 3.1Å; Q148-E150 PolarHBondContact O-N 3.38Å; Q148-R151 PolarHBondContact O-N 3.29Å; Q148-A152 WeakPolarHBondContact O-CB 3.48Å; Q148-A152 PolarHBondContact O-N 2.9Å
149	I	98.8	Very high	98.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.2	-47.9	175.4	-61.4	170.8	0	0	0	110.4	L141 D145 A146 A152 H153 E202 V203 V206 F207	L141-I149 HydrophobicContact CD1-CB 4.48Å; L141-I149 HydrophobicContact CD1-CG1 3.99Å; D145-I149 PolarHBondContact O-N 2.85Å; A146-I149 PolarHBondContact O-N 3.32Å; I149-A152 PolarHBondContact O-N 3.09Å; I149-H153 WeakPolarHBondContact O-CB 3.4Å; I149-H153 PolarHBondContact O-N 3.14Å; I149-E202 HydrophobicContact CD1-CB 4.21Å; I149-E202 HydrophobicContact CD1-CG 3.77Å; I149-V203 HydrophobicContact CD1-CG2 3.94Å; I149-V203 HydrophobicContact CG1-CG2 4.14Å; I149-V203 HydrophobicContact CG2-CG2 4.37Å; I149-V206 HydrophobicContact CG2-CB 4Å; I149-V206 HydrophobicContact CG2-CG1 4.06Å; I149-V206 HydrophobicContact CG2-CG2 3.87Å; I149-F207 HydrophobicContact CG2-CE2 4.15Å
150	E	98.4	Very high	98.1	Very high	99 Å²	99	53.6 Å²	53.6	46%	0.463	28%	0.278	S	S	.	.	H	α-helix	trans	-65	-39.5	178.8	-75	-61.1	158.9	0	0	113	A146 Q148 H153 H154	A146-E150 WeakPolarHBondContact O-CG 3.24Å; A146-E150 PolarHBondContact O-N 2.79Å; Q148-E150 PolarHBondContact O-N 3.38Å; E150-H153 PolarHBondContact O-N 2.87Å; E150-H153 IonicContact OE2-ND1 3.81Å; E150-H154 PolarHBondContact O-N 3Å
151	R	98.5	Very high	97.9	Very high	146 Å²	146	52.3 Å²	52.3	55%	0.551	28%	0.283	S	S	*	.	H	α-helix	trans	-62.7	-44.9	174	-77.2	-169.4	-57	-87	15.1	111.7	A147 Q148 H153 H154 Y155	A147-R151 VanDerWaalsContact C-NH1 3.29Å; A147-R151 WeakPolarHBondContact O-CB 3.4Å; A147-R151 VanDerWaalsContact O-CG 3.29Å; A147-R151 WeakPolarHBondContact O-CG 3.34Å; A147-R151 PolarHBondContact O-N 3.2Å; A147-R151 VanDerWaalsContact O-N 3.08Å; A147-R151 PolarHBondContact O-NH1 3.42Å; Q148-R151 PolarHBondContact O-N 3.29Å; R151-H153 VanDerWaalsContact C-N 3.3Å; R151-H153 PolarHBondContact O-N 3.2Å; R151-H154 PolarHBondContact O-N 2.93Å; R151-Y155 WeakPolarHBondContact O-CB 3.31Å; R151-Y155 PolarHBondContact O-N 3.18Å
152	A	98.5	Very high	97.7	Very high	7 Å²	7	60.2 Å²	60.2	6%	0.058	33%	0.326	C	S	.	.	H	α-helix	trans	-62.2	-41	175.9	0	0	0	0	0	111	L139 L141 Q148 I149 Y155 I156 F207	L139-A152 HydrophobicContact CD1-CB 4.45Å; L141-A152 HydrophobicContact CD1-CB 4.08Å; Q148-A152 WeakPolarHBondContact O-CB 3.48Å; Q148-A152 PolarHBondContact O-N 2.9Å; I149-A152 PolarHBondContact O-N 3.09Å; A152-Y155 PolarHBondContact O-N 2.95Å; A152-I156 WeakPolarHBondContact O-CB 3.43Å; A152-I156 VanDerWaalsContact O-CG1 3.22Å; A152-I156 WeakPolarHBondContact O-CG1 3.49Å; A152-I156 PolarHBondContact O-N 3.07Å; A152-F207 HydrophobicContact CB-CZ 4.32Å
153	H	98.6	Very high	97.4	Very high	39 Å²	39	61.5 Å²	61.5	18%	0.181	34%	0.343	C	S	.	.	H	α-helix	trans	-61.7	-50.2	176.2	172.9	-114.1	0	0	0	112.3	I149 E150 R151 Y155 I156 C157 V206 F207	I149-H153 WeakPolarHBondContact O-CB 3.4Å; I149-H153 PolarHBondContact O-N 3.14Å; E150-H153 PolarHBondContact O-N 2.87Å; E150-H153 IonicContact OE2-ND1 3.81Å; R151-H153 VanDerWaalsContact C-N 3.3Å; R151-H153 PolarHBondContact O-N 3.2Å; H153-Y155 VanDerWaalsContact C-N 3.33Å; H153-Y155 PolarHBondContact O-N 3.4Å; H153-I156 PolarHBondContact O-N 2.85Å; H153-C157 PolarHBondContact NE2-SG 2.94Å; H153-C157 VanDerWaalsContact NE2-SG 3.37Å; H153-C157 WeakPolarHBondContact O-CB 3.36Å; H153-C157 PolarHBondContact O-N 2.71Å; H153-C157 PolarHBondContact O-SG 3.06Å; H153-V206 HydrophobicContact CB-CG1 3.47Å; H153-V206 VanDerWaalsContact CB-CG1 3.47Å; H153-V206 VanDerWaalsContact CG-CG1 3.44Å; H153-F207 VanDerWaalsContact CA-CZ 3.44Å; H153-F207 HydrophobicContact CB-CE1 4.11Å; H153-F207 HydrophobicContact CB-CE2 4.01Å; H153-F207 HydrophobicContact CB-CZ 3.72Å
154	H	98.3	Very high	97.4	Very high	133 Å²	133	61.3 Å²	61.3	62%	0.616	34%	0.342	S	S	*	.	H	α-helix	trans	-58.4	-46.3	176.6	-178.9	-85	0	0	0	111.3	E150 R151 C157 T158	E150-H154 PolarHBondContact O-N 3Å; R151-H154 PolarHBondContact O-N 2.93Å; H154-C157 WeakPolarHBondContact O-CB 3.31Å; H154-C157 PolarHBondContact O-N 2.81Å; H154-T158 WeakPolarHBondContact O-CG2 3.39Å; H154-T158 PolarHBondContact O-N 3.42Å
155	Y	98.4	Very high	97.4	Very high	89 Å²	89	58 Å²	58	35%	0.349	32%	0.322	S	S	.	.	H	α-helix	trans	-58.4	-52.7	176.8	179.8	-105.6	0	0	0	111.5	F114 Q137 L139 R151 A152 H153 C157 T158 Q159	F114-Y155 HydrophobicContact CD1-CE1 4.3Å; F114-Y155 HydrophobicContact CE1-CD1 4.47Å; F114-Y155 HydrophobicContact CE1-CE1 4.04Å; Q137-Y155 VanDerWaalsContact OE1-CE1 3.29Å; Q137-Y155 PolarHBondContact OE1-OH 3.44Å; L139-Y155 HydrophobicContact CD1-CD1 4.23Å; L139-Y155 HydrophobicContact CD2-CD1 3.71Å; L139-Y155 HydrophobicContact CD2-CE1 3.64Å; R151-Y155 WeakPolarHBondContact O-CB 3.31Å; R151-Y155 PolarHBondContact O-N 3.18Å; A152-Y155 PolarHBondContact O-N 2.95Å; H153-Y155 VanDerWaalsContact C-N 3.33Å; H153-Y155 PolarHBondContact O-N 3.4Å; Y155-C157 VanDerWaalsContact C-N 3.32Å; Y155-C157 PolarHBondContact O-N 2.94Å; Y155-T158 PolarHBondContact O-N 2.82Å; Y155-T158 VanDerWaalsContact O-N 3.07Å; Y155-T158 PolarHBondContact O-OG1 3.41Å; Y155-Q159 HydrophobicContact CD1-CG 4.33Å; Y155-Q159 HydrophobicContact CE1-CG 3.95Å; Y155-Q159 HydrophobicContact CE2-CG 4.36Å; Y155-Q159 WeakPolarHBondContact O-CG 3.33Å; Y155-Q159 PolarHBondContact O-N 3.27Å
156	I	98.3	Very high	97.4	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.5	-40.8	-178.5	-71.3	168.4	0	0	0	111.2	L90 F114 L139 A152 H153 T158 Q159 V160 L165 F207 L210	L90-I156 HydrophobicContact CB-CD1 4.44Å; L90-I156 HydrophobicContact CD1-CD1 4.01Å; L90-I156 HydrophobicContact CD2-CD1 4.24Å; L90-I156 HydrophobicContact CG-CD1 4.46Å; F114-I156 HydrophobicContact CB-CD1 3.9Å; F114-I156 HydrophobicContact CB-CG1 4.33Å; F114-I156 HydrophobicContact CD1-CD1 4.35Å; F114-I156 HydrophobicContact CD1-CG1 3.84Å; F114-I156 HydrophobicContact CD2-CD1 3.92Å; F114-I156 HydrophobicContact CD2-CG1 3.77Å; F114-I156 HydrophobicContact CD2-CG2 4.13Å; F114-I156 HydrophobicContact CE1-CG1 4.03Å; F114-I156 HydrophobicContact CE2-CB 4.35Å; F114-I156 HydrophobicContact CE2-CG1 3.94Å; F114-I156 HydrophobicContact CE2-CG2 3.8Å; F114-I156 HydrophobicContact CG-CD1 3.8Å; F114-I156 HydrophobicContact CG-CG1 3.71Å; F114-I156 HydrophobicContact CZ-CG1 4.09Å; F114-I156 HydrophobicContact CZ-CG2 4.32Å; L139-I156 HydrophobicContact CD1-CD1 3.93Å; L139-I156 HydrophobicContact CD1-CG1 4.18Å; A152-I156 WeakPolarHBondContact O-CB 3.43Å; A152-I156 VanDerWaalsContact O-CG1 3.22Å; A152-I156 WeakPolarHBondContact O-CG1 3.49Å; A152-I156 PolarHBondContact O-N 3.07Å; H153-I156 PolarHBondContact O-N 2.85Å; I156-T158 VanDerWaalsContact C-N 3.28Å; I156-T158 PolarHBondContact O-N 3.38Å; I156-Q159 PolarHBondContact O-N 3.4Å; I156-V160 HydrophobicContact CG2-CG1 4.01Å; I156-V160 HydrophobicContact CG2-CG2 4.46Å; I156-V160 WeakPolarHBondContact O-CG2 3.35Å; I156-V160 PolarHBondContact O-N 2.69Å; I156-L165 HydrophobicContact CG2-CD1 4.12Å; I156-F207 HydrophobicContact CB-CE1 4.04Å; I156-F207 HydrophobicContact CD1-CE1 3.52Å; I156-F207 HydrophobicContact CD1-CZ 3.88Å; I156-F207 HydrophobicContact CG1-CE1 4.34Å; I156-F207 HydrophobicContact CG2-CE1 4.13Å; I156-L210 HydrophobicContact CG2-CD1 4.13Å
157	C	97.7	Very high	97.4	Very high	42 Å²	42	54.2 Å²	54.2	28%	0.284	29%	0.294	S	S	.	.	H	α-helix	trans	-52.8	-44.9	173.8	-80.1	0	0	0	0	112.1	H153 H154 Y155 Q159 G161	H153-C157 PolarHBondContact NE2-SG 2.94Å; H153-C157 VanDerWaalsContact NE2-SG 3.37Å; H153-C157 WeakPolarHBondContact O-CB 3.36Å; H153-C157 PolarHBondContact O-N 2.71Å; H153-C157 PolarHBondContact O-SG 3.06Å; H154-C157 WeakPolarHBondContact O-CB 3.31Å; H154-C157 PolarHBondContact O-N 2.81Å; Y155-C157 VanDerWaalsContact C-N 3.32Å; Y155-C157 PolarHBondContact O-N 2.94Å; C157-Q159 VanDerWaalsContact C-N 3.28Å; C157-Q159 PolarHBondContact O-N 3.1Å; C157-G161 PolarHBondContact O-N 3.49Å; C157-G161 VanDerWaalsContact O-N 3.1Å
158	T	97.4	Very high	97.4	Very high	87 Å²	87	51.9 Å²	51.9	53%	0.534	28%	0.275	S	S	.	.	H	α-helix	trans	-66.6	-29.3	177.9	67.9	0	0	0	0	113.4	H154 Y155 I156	H154-T158 WeakPolarHBondContact O-CG2 3.39Å; H154-T158 PolarHBondContact O-N 3.42Å; Y155-T158 PolarHBondContact O-N 2.82Å; Y155-T158 VanDerWaalsContact O-N 3.07Å; Y155-T158 PolarHBondContact O-OG1 3.41Å; I156-T158 VanDerWaalsContact C-N 3.28Å; I156-T158 PolarHBondContact O-N 3.38Å
159	Q	96.5	Very high	97.4	Very high	96 Å²	96	50.8 Å²	50.8	45%	0.449	27%	0.269	S	S	.	.	H	α-helix	trans	-82.4	-39.5	-178	-62.5	-56.2	-64.8	0	0	112.5	F114 Y155 I156 C157	F114-Q159 HydrophobicContact CE1-CB 4.09Å; F114-Q159 HydrophobicContact CE1-CG 4.02Å; F114-Q159 HydrophobicContact CZ-CB 3.65Å; F114-Q159 HydrophobicContact CZ-CG 4.11Å; Y155-Q159 HydrophobicContact CD1-CG 4.33Å; Y155-Q159 HydrophobicContact CE1-CG 3.95Å; Y155-Q159 HydrophobicContact CE2-CG 4.36Å; Y155-Q159 WeakPolarHBondContact O-CG 3.33Å; Y155-Q159 PolarHBondContact O-N 3.27Å; I156-Q159 PolarHBondContact O-N 3.4Å; C157-Q159 VanDerWaalsContact C-N 3.28Å; C157-Q159 PolarHBondContact O-N 3.1Å
160	V	96.4	Very high	97.5	Very high	18 Å²	18	51.1 Å²	51.1	11%	0.109	27%	0.271	C	S	.	.	H	α-helix	trans	-90.3	-24.3	-174.3	-54.6	0	0	0	0	113.6	A88 F114 I156 D162 A163 G164 L210	A88-V160 HydrophobicContact CB-CG1 3.59Å; F114-V160 HydrophobicContact CE2-CG1 3.88Å; F114-V160 HydrophobicContact CZ-CG1 4.22Å; I156-V160 HydrophobicContact CG2-CG1 4.01Å; I156-V160 HydrophobicContact CG2-CG2 4.46Å; I156-V160 WeakPolarHBondContact O-CG2 3.35Å; I156-V160 PolarHBondContact O-N 2.69Å; V160-D162 PolarHBondContact O-N 3.32Å; V160-A163 WeakPolarHBondContact O-CB 3.35Å; V160-A163 PolarHBondContact O-N 2.87Å; V160-G164 WeakPolarHBondContact CB-O 3.31Å; V160-L210 HydrophobicContact CG2-CD1 4.44Å; V160-L210 HydrophobicContact CG2-CD2 4.28Å
161	G	94.2	Very high	97.5	Very high	42 Å²	42	47.3 Å²	47.3	43%	0.433	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	49.8	-138.4	-178.1	0	0	0	0	0	112.9	C157 A163 G164	C157-G161 PolarHBondContact O-N 3.49Å; C157-G161 VanDerWaalsContact O-N 3.1Å; G161-A163 PolarHBondContact O-N 3.15Å; G161-G164 PolarHBondContact O-N 3.49Å
162	D	92.9	Very high	97.4	Very high	171 Å²	171	41.3 Å²	41.3	91%	0.914	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-69	-16.3	-177.2	-64.7	-29.7	0	0	0	114.1	V160 G164	V160-D162 PolarHBondContact O-N 3.32Å; D162-G164 PolarHBondContact O-N 3.45Å
163	A	93.7	Very high	97.3	Very high	71 Å²	71	42.2 Å²	42.2	59%	0.587	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-67.8	-24	175.8	0	0	0	0	0	112	V160 G161	V160-A163 WeakPolarHBondContact O-CB 3.35Å; V160-A163 PolarHBondContact O-N 2.87Å; G161-A163 PolarHBondContact O-N 3.15Å
164	G	97	Very high	97.2	Very high	5 Å²	5	42.4 Å²	42.4	5%	0.052	25%	0.25	C	C	.	.			trans	67.3	-175.3	-176.4	0	0	0	0	0	113.2	V160 G161 D162	V160-G164 WeakPolarHBondContact CB-O 3.31Å; G161-G164 PolarHBondContact O-N 3.49Å; D162-G164 PolarHBondContact O-N 3.45Å
165	L	98.4	Very high	96.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.223	C	C	.	.			trans	-98	120.4	-178.9	-177.7	70.1	0	0	0	108.9	A88 L90 F114 I156 I168 F207 L210 L211 S214	A88-L165 HydrophobicContact CB-CD1 3.9Å; A88-L165 WeakPolarHBondContact O-CD1 3.46Å; L90-L165 HydrophobicContact CB-CD2 4Å; F114-L165 HydrophobicContact CD2-CD1 4.21Å; F114-L165 HydrophobicContact CE2-CD1 4.31Å; I156-L165 HydrophobicContact CG2-CD1 4.12Å; L165-I168 HydrophobicContact CD2-CD1 4.47Å; L165-I168 HydrophobicContact CD2-CG1 3.75Å; L165-F207 HydrophobicContact CD2-CB 4.38Å; L165-F207 HydrophobicContact CD2-CD1 3.7Å; L165-F207 HydrophobicContact CD2-CE1 4.42Å; L165-F207 HydrophobicContact CD2-CG 4.39Å; L165-L210 HydrophobicContact CB-CB 3.68Å; L165-L210 HydrophobicContact CB-CD1 4.15Å; L165-L210 PolarHBondContact N-O 3.2Å; L165-L211 HydrophobicContact CB-CD1 3.9Å; L165-L211 HydrophobicContact CD2-CD1 3.81Å; L165-L211 HydrophobicContact CG-CD1 3.96Å; L165-L211 WeakPolarHBondContact O-CD1 3.29Å; L165-S214 WeakPolarHBondContact O-CB 3.29Å; L165-S214 PolarHBondContact O-OG 3.31Å
166	W	98.4	Very high	96.4	Very high	21 Å²	21	32.9 Å²	32.9	8%	0.08	21%	0.212	C	C	.	.			trans	-70.5	-38.2	-178	171.5	-105.3	0	0	0	112.4	L82 M84 R87 A88 G216 R217 L333	L82-W166 HydrophobicContact CD1-CH2 3.58Å; L82-W166 HydrophobicContact CD1-CZ2 3.61Å; M84-W166 HydrophobicContact CE-CG 4.39Å; M84-W166 VanDerWaalsContact CE-NE1 3.34Å; R87-W166 HydrophobicContact CB-CB 3.79Å; R87-W166 HydrophobicContact CB-CG 4.03Å; R87-W166 HydrophobicContact CG-CB 4.37Å; R87-W166 HydrophobicContact CG-CG 4.36Å; R87-W166 VanDerWaalsContact NH1-CD2 3.35Å; A88-W166 WeakPolarHBondContact O-CA 3.25Å; A88-W166 VanDerWaalsContact O-CB 3.3Å; A88-W166 WeakPolarHBondContact O-CB 3.26Å; A88-W166 PolarHBondContact O-N 2.89Å; W166-G216 CarbonylContact O-C 3.49Å; W166-G216 VanDerWaalsContact O-C 3.3Å; W166-G216 WeakPolarHBondContact O-CA 3.48Å; W166-R217 HydrophobicContact CH2-CG 4.41Å; W166-R217 HydrophobicContact CZ2-CG 3.61Å; W166-R217 VanDerWaalsContact CZ2-CZ 3.42Å; W166-R217 PolarHBondContact O-N 3.33Å; W166-L333 WeakPolarHBondContact CZ2-O 3.45Å; W166-L333 PolarHBondContact NE1-O 3.24Å
167	G	98.4	Very high	95.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	146.2	-173.3	0	0	0	0	0	114.3	A88 V89 L90 R217	A88-G167 PolarHBondContact O-N 3.49Å; A88-G167 VanDerWaalsContact O-N 3.15Å; V89-G167 CarbonylContact C-O 3.54Å; V89-G167 VanDerWaalsContact CA-O 3.31Å; V89-G167 WeakPolarHBondContact CA-O 3.33Å; L90-G167 PolarHBondContact N-O 3.44Å; G167-R217 CarbonylContact C-O 3.6Å; G167-R217 VanDerWaalsContact CA-O 3.25Å; G167-R217 WeakPolarHBondContact CA-O 3.33Å
168	I	98.8	Very high	95.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	133.7	160.5	-59.4	160	0	0	0	107.8	L90 L165 N170 V203 F207 L211 R217 L218 V219	L90-I168 CarbonylContact O-C 3.49Å; L90-I168 WeakPolarHBondContact O-CA 3.39Å; L165-I168 HydrophobicContact CD2-CD1 4.47Å; L165-I168 HydrophobicContact CD2-CG1 3.75Å; I168-N170 WeakPolarHBondContact CG2-OD1 3.18Å; I168-V203 HydrophobicContact CG2-CG1 4.07Å; I168-F207 HydrophobicContact CD1-CB 3.39Å; I168-F207 HydrophobicContact CD1-CG 4.3Å; I168-F207 HydrophobicContact CG1-CB 4.22Å; I168-L211 HydrophobicContact CD1-CD1 3.63Å; I168-L211 HydrophobicContact CD1-CD2 3.65Å; I168-L211 HydrophobicContact CD1-CG 4.29Å; I168-L211 HydrophobicContact CG1-CD1 3.75Å; I168-L211 HydrophobicContact CG1-CD2 4.09Å; I168-R217 PolarHBondContact N-O 3.02Å; I168-L218 HydrophobicContact CB-CD1 4.08Å; I168-L218 HydrophobicContact CD1-CD1 4.44Å; I168-L218 HydrophobicContact CG2-CD1 4.32Å; I168-V219 PolarHBondContact O-N 2.8Å
169	V	98.9	Very high	95	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	98.2	169.2	-172.7	0	0	0	0	108.4	V89 L90 I91 T92 L102 N171 V219 V221 L333	V89-V169 HydrophobicContact CG1-CG2 4.12Å; L90-V169 PolarHBondContact O-N 3.19Å; I91-V169 HydrophobicContact CB-CB 4.39Å; I91-V169 HydrophobicContact CG1-CB 4.15Å; I91-V169 HydrophobicContact CG1-CG2 4.18Å; I91-V169 HydrophobicContact CG2-CB 4.13Å; I91-V169 HydrophobicContact CG2-CG1 4.4Å; T92-V169 PolarHBondContact N-O 3.3Å; T92-V169 VanDerWaalsContact N-O 3.08Å; T92-V169 PolarHBondContact OG1-O 3.37Å; L102-V169 HydrophobicContact CD2-CB 4.38Å; L102-V169 HydrophobicContact CD2-CG1 4.04Å; L102-V169 HydrophobicContact CD2-CG2 3.94Å; V169-N171 VanDerWaalsContact C-N 3.28Å; V169-N171 HydrophobicContact CG1-CB 4.1Å; V169-N171 PolarHBondContact O-N 3.07Å; V169-V219 CarbonylContact C-O 3.56Å; V169-V219 WeakPolarHBondContact CA-O 3.47Å; V169-V219 HydrophobicContact CG1-CB 4.46Å; V169-V219 HydrophobicContact CG1-CG1 4.43Å; V169-V219 HydrophobicContact CG2-CB 4.24Å; V169-V221 HydrophobicContact CG1-CG2 4.12Å; V169-L333 HydrophobicContact CG2-CD1 3.99Å; V169-L333 HydrophobicContact CG2-CD2 4Å; V169-L333 HydrophobicContact CG2-CG 4.36Å
170	N	98.8	Very high	94.8	Very high	7 Å²	7	24.2 Å²	24.2	4%	0.037	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	85.1	172.5	-68.7	-41.8	0	0	0	108.8	I168 A200 V203 S204 V219 N220 V221	I168-N170 WeakPolarHBondContact CG2-OD1 3.18Å; N170-A200 HydrophobicContact CB-CB 3.89Å; N170-A200 PolarHBondContact ND2-O 3.04Å; N170-V203 WeakPolarHBondContact OD1-CG1 3.06Å; N170-S204 PolarHBondContact ND2-OG 3.25Å; N170-V219 PolarHBondContact N-O 3.35Å; N170-N220 WeakPolarHBondContact CB-OD1 3.47Å; N170-N220 PolarHBondContact ND2-OD1 2.92Å; N170-V221 PolarHBondContact O-N 3.44Å
171	N	98.6	Very high	94.6	Very high	20 Å²	20	25 Å²	25	11%	0.107	17%	0.174	C	C	.	.			trans	-102	-23.2	-178.9	162.9	85.4	0	0	0	113.5	T92 G93 G99 V169 G173 V221	T92-N171 VanDerWaalsContact O-CB 3.25Å; T92-N171 WeakPolarHBondContact O-CB 3.21Å; T92-N171 PolarHBondContact O-ND2 3.3Å; T92-N171 PolarHBondContact OG1-N 3.39Å; G93-N171 PolarHBondContact O-ND2 2.88Å; G99-N171 WeakPolarHBondContact CA-ND2 3.49Å; G99-N171 PolarHBondContact N-ND2 2.89Å; V169-N171 VanDerWaalsContact C-N 3.28Å; V169-N171 HydrophobicContact CG1-CB 4.1Å; V169-N171 PolarHBondContact O-N 3.07Å; N171-G173 PolarHBondContact O-N 2.81Å; N171-V221 HydrophobicContact CB-CB 4.43Å; N171-V221 HydrophobicContact CB-CG2 3.72Å
172	A	97.8	Very high	94.6	Very high	19 Å²	19	29.2 Å²	29.2	16%	0.157	18%	0.182	C	C	.	.			trans	-54.6	134.4	-179.4	0	0	0	0	0	110.6	T92 V143	T92-A172 PolarHBondContact O-N 2.68Å; T92-A172 PolarHBondContact OG1-N 3.06Å; V143-A172 HydrophobicContact CG1-CB 4.01Å; V143-A172 HydrophobicContact CG2-CB 3.82Å
173	G	96.6	Very high	94.6	Very high	27 Å²	27	21.1 Å²	21.1	28%	0.278	14%	0.139	S	C	.	.			trans	-173.3	150.7	-176.5	0	0	0	0	0	113.7	N171 N196	N171-G173 PolarHBondContact O-N 2.81Å; G173-N196 WeakPolarHBondContact CA-OD1 3.3Å
174	V	95.2	Very high	94.6	Very high	43 Å²	43	18.1 Å²	18.1	26%	0.261	11%	0.113	S	C	.	.			trans	-123.9	142.2	175.9	-64.5	0	0	0	0	109.6	V195 N196 Y236	V174-V195 HydrophobicContact CG1-CG1 4.19Å; V174-V195 HydrophobicContact CG2-CB 4Å; V174-V195 HydrophobicContact CG2-CG1 4.37Å; V174-V195 HydrophobicContact CG2-CG2 4.25Å; V174-N196 PolarHBondContact N-OD1 2.93Å; V174-N196 PolarHBondContact O-ND2 3.14Å; V174-N196 PolarHBondContact O-OD1 2.86Å; V174-Y236 VanDerWaalsContact O-CD2 3.26Å; V174-Y236 WeakPolarHBondContact O-CD2 3.37Å
175	L	91.8	Very high	94.3	Very high	10 Å²	10	18.5 Å²	18.5	5%	0.052	12%	0.115	C	C	.	.			trans	-81.9	-31.8	173.6	177.8	55.1	0	0	0	112.1	V178 F233 Y236 I273 F274 F311	L175-V178 HydrophobicContact CD2-CG2 4.38Å; L175-F233 HydrophobicContact CD1-CD1 3.65Å; L175-F233 HydrophobicContact CD1-CE1 3.35Å; L175-F233 HydrophobicContact CD1-CZ 4.38Å; L175-F233 HydrophobicContact CD2-CE1 4.32Å; L175-F233 HydrophobicContact CG-CE1 4.44Å; L175-Y236 HydrophobicContact CD1-CD1 3.93Å; L175-Y236 HydrophobicContact CD1-CD2 3.84Å; L175-Y236 HydrophobicContact CD1-CE1 4.4Å; L175-Y236 HydrophobicContact CD1-CE2 4.34Å; L175-Y236 HydrophobicContact CD1-CG 3.6Å; L175-I273 HydrophobicContact CB-CD1 4.41Å; L175-I273 HydrophobicContact CB-CG1 4.02Å; L175-I273 WeakPolarHBondContact CB-O 3.49Å; L175-F274 HydrophobicContact CD2-CD1 3.75Å; L175-F274 HydrophobicContact CD2-CE1 4.07Å; L175-F311 HydrophobicContact CD2-CD1 4.37Å; L175-F311 HydrophobicContact CD2-CE1 3.6Å; L175-F311 HydrophobicContact CD2-CZ 4.45Å; L175-F311 HydrophobicContact CG-CE1 4.24Å
176	G	88.6	Confident	94	Very high	11 Å²	11	22.7 Å²	22.7	11%	0.113	14%	0.14	C	C	.	.			trans	76.9	-134	-171.2	0	0	0	0	0	111.1
177	Y	87.3	Confident	93.7	Very high	6 Å²	6	27.2 Å²	27.2	2%	0.024	16%	0.157	C	C	.	.			trans	-121.9	133.6	178.1	-164.7	-104	0	0	0	111.1	A179 L184 W280 Y283 I287 L307 F311	Y177-A179 HydrophobicContact CD1-CB 3.77Å; Y177-A179 HydrophobicContact CE1-CB 4.1Å; Y177-A179 PolarHBondContact O-N 2.8Å; Y177-L184 WeakPolarHBondContact O-CD1 3.38Å; Y177-W280 HydrophobicContact CE2-CB 4.4Å; Y177-Y283 AromaticContact CD2-CD2 3.72Å; Y177-Y283 HydrophobicContact CD2-CD2 3.72Å; Y177-Y283 AromaticContact CD2-CG 3.7Å; Y177-Y283 HydrophobicContact CD2-CG 3.7Å; Y177-Y283 HydrophobicContact CG-CD2 4.31Å; Y177-Y283 AromaticContact CG-CG 3.98Å; Y177-Y283 HydrophobicContact CG-CG 3.98Å; Y177-I287 HydrophobicContact CD1-CD1 3.39Å; Y177-I287 HydrophobicContact CE1-CD1 3.37Å; Y177-I287 HydrophobicContact CG-CD1 4.4Å; Y177-L307 HydrophobicContact CE1-CB 4.24Å; Y177-L307 HydrophobicContact CE1-CD1 4.42Å; Y177-F311 HydrophobicContact CD2-CD2 4.49Å; Y177-F311 AromaticContact CD2-CE2 3.58Å; Y177-F311 HydrophobicContact CD2-CE2 3.58Å; Y177-F311 HydrophobicContact CD2-CZ 4.18Å; Y177-F311 HydrophobicContact CE2-CD2 4.34Å; Y177-F311 AromaticContact CE2-CE2 3.83Å; Y177-F311 HydrophobicContact CE2-CE2 3.83Å; Y177-F311 HydrophobicContact CG-CE2 4.09Å
178	V	87.7	Confident	93.5	Very high	3 Å²	3	27.3 Å²	27.3	2%	0.018	16%	0.158	C	C	.	.			trans	-81.7	98	177.8	176	0	0	0	0	108.6	L175 G232 F233 R310 F311	L175-V178 HydrophobicContact CD2-CG2 4.38Å; V178-G232 VanDerWaalsContact CA-O 3.3Å; V178-G232 WeakPolarHBondContact CA-O 3.46Å; V178-F233 HydrophobicContact CG1-CE2 4.17Å; V178-F233 HydrophobicContact CG2-CE1 4.25Å; V178-F233 HydrophobicContact CG2-CE2 4.04Å; V178-F233 HydrophobicContact CG2-CZ 3.76Å; V178-R310 HydrophobicContact CG1-CB 4.2Å; V178-F311 HydrophobicContact CB-CD2 4.13Å; V178-F311 HydrophobicContact CB-CE1 4.43Å; V178-F311 HydrophobicContact CB-CE2 3.55Å; V178-F311 HydrophobicContact CB-CZ 3.73Å; V178-F311 HydrophobicContact CG2-CD1 4.37Å; V178-F311 HydrophobicContact CG2-CD2 4.41Å; V178-F311 HydrophobicContact CG2-CE1 3.75Å; V178-F311 HydrophobicContact CG2-CE2 3.82Å; V178-F311 HydrophobicContact CG2-CZ 3.44Å; V178-F311 VanDerWaalsContact CG2-CZ 3.44Å
179	A	89.8	Confident	93.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.168	C	C	.	.			trans	-145.3	166.5	177.6	0	0	0	0	0	111	Y177 I183 L184 G232 I287 L307	Y177-A179 HydrophobicContact CD1-CB 3.77Å; Y177-A179 HydrophobicContact CE1-CB 4.1Å; Y177-A179 PolarHBondContact O-N 2.8Å; A179-I183 HydrophobicContact CB-CD1 4.23Å; A179-I183 HydrophobicContact CB-CG1 4.15Å; A179-L184 HydrophobicContact CB-CB 4.48Å; A179-L184 HydrophobicContact CB-CD1 4.14Å; A179-G232 PolarHBondContact N-O 3.41Å; A179-G232 WeakPolarHBondContact O-CA 3.33Å; A179-I287 HydrophobicContact CB-CD1 4.21Å; A179-L307 HydrophobicContact CB-CD1 3.87Å
180	D	91.6	Very high	93.2	Very high	35 Å²	35	37.9 Å²	37.9	19%	0.187	20%	0.198	C	C	.	.			trans	-67	148.4	175.2	-56.1	-4.5	0	0	0	109.5	E182 I183 L184 Y299 Y303 R310	D180-E182 VanDerWaalsContact C-N 3.3Å; D180-E182 PolarHBondContact O-N 2.93Å; D180-I183 HydrophobicContact CB-CD1 4.35Å; D180-I183 HydrophobicContact CB-CG1 4.13Å; D180-I183 VanDerWaalsContact O-CG1 3.28Å; D180-I183 WeakPolarHBondContact O-CG1 3.31Å; D180-I183 PolarHBondContact O-N 3.31Å; D180-L184 PolarHBondContact O-N 3.05Å; D180-L184 VanDerWaalsContact O-N 3.16Å; D180-Y299 HydrophobicContact CB-CE1 4.32Å; D180-Y303 VanDerWaalsContact CG-OH 3.25Å; D180-Y303 PolarHBondContact OD1-OH 2.59Å; D180-Y303 WeakPolarHBondContact OD2-CE1 3.46Å; D180-Y303 PolarHBondContact OD2-OH 2.74Å; D180-R310 IonicContact OD1-CZ 3Å; D180-R310 IonicContact OD1-NH1 2.59Å; D180-R310 PolarHBondContact OD1-NH1 3.46Å; D180-R310 IonicContact OD1-NH2 3.85Å
181	G	92.3	Very high	93.1	Very high	34 Å²	34	40.6 Å²	40.6	35%	0.351	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-28.9	-166.5	0	0	0	0	0	115.5	Y189	G181-Y189 WeakPolarHBondContact CA-OH 3.42Å; G181-Y189 PolarHBondContact O-OH 3.11Å
182	E	93.9	Very high	93.1	Very high	131 Å²	131	39.7 Å²	39.7	61%	0.612	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-38.5	176.3	-178.9	173.6	-166.4	0	0	112.4	D180 Y299	D180-E182 VanDerWaalsContact C-N 3.3Å; D180-E182 PolarHBondContact O-N 2.93Å; E182-Y299 HydrophobicContact CG-CE2 4.4Å; E182-Y299 PolarHBondContact OE2-OH 3.14Å; E182-Y299 VanDerWaalsContact OE2-OH 3.13Å
183	I	93.1	Very high	93.1	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-8.3	-174.8	62	172.5	0	0	0	113.7	A179 D180 P185 I287 L291 V295 Y299 Y303 I304 L307	A179-I183 HydrophobicContact CB-CD1 4.23Å; A179-I183 HydrophobicContact CB-CG1 4.15Å; D180-I183 HydrophobicContact CB-CD1 4.35Å; D180-I183 HydrophobicContact CB-CG1 4.13Å; D180-I183 VanDerWaalsContact O-CG1 3.28Å; D180-I183 WeakPolarHBondContact O-CG1 3.31Å; D180-I183 PolarHBondContact O-N 3.31Å; I183-P185 WeakPolarHBondContact O-CD 3.33Å; I183-I287 HydrophobicContact CB-CG2 4.4Å; I183-L291 HydrophobicContact CB-CD1 4.23Å; I183-L291 HydrophobicContact CB-CD2 3.9Å; I183-L291 HydrophobicContact CG2-CD1 4.05Å; I183-L291 HydrophobicContact CG2-CD2 3.89Å; I183-V295 HydrophobicContact CG2-CG1 3.85Å; I183-Y299 HydrophobicContact CD1-CD1 4.18Å; I183-Y299 HydrophobicContact CD1-CE1 4.26Å; I183-Y299 HydrophobicContact CG2-CD1 3.97Å; I183-Y299 HydrophobicContact CG2-CD2 3.5Å; I183-Y299 VanDerWaalsContact CG2-CD2 3.5Å; I183-Y299 HydrophobicContact CG2-CE1 3.92Å; I183-Y299 HydrophobicContact CG2-CE2 3.45Å; I183-Y299 VanDerWaalsContact CG2-CE2 3.45Å; I183-Y299 HydrophobicContact CG2-CG 3.74Å; I183-Y303 HydrophobicContact CD1-CE1 4.42Å; I183-I304 HydrophobicContact CD1-CG1 4.48Å; I183-L307 HydrophobicContact CD1-CD1 3.64Å
184	L	92.5	Very high	93.2	Very high	8 Å²	8	42.1 Å²	42.1	4%	0.042	22%	0.216	C	C	.	.	S	Bend	trans	-77.3	125.1	-179.8	-172.5	67.2	0	0	0	110	Y177 A179 D180 V186 V188 Y189 V234 A235	Y177-L184 WeakPolarHBondContact O-CD1 3.38Å; A179-L184 HydrophobicContact CB-CB 4.48Å; A179-L184 HydrophobicContact CB-CD1 4.14Å; D180-L184 PolarHBondContact O-N 3.05Å; D180-L184 VanDerWaalsContact O-N 3.16Å; L184-V186 PolarHBondContact O-N 3.01Å; L184-V188 HydrophobicContact CD1-CB 4.13Å; L184-V188 HydrophobicContact CD1-CG1 4.06Å; L184-V188 HydrophobicContact CD1-CG2 4.21Å; L184-V188 HydrophobicContact CD2-CG1 4.31Å; L184-V188 HydrophobicContact CG-CB 4.18Å; L184-V188 HydrophobicContact CG-CG1 4.36Å; L184-Y189 HydrophobicContact CB-CE2 3.85Å; L184-Y189 HydrophobicContact CD2-CD2 4.19Å; L184-Y189 HydrophobicContact CD2-CE2 3.71Å; L184-Y189 HydrophobicContact CG-CD2 4.35Å; L184-Y189 HydrophobicContact CG-CE2 3.83Å; L184-Y189 WeakPolarHBondContact O-CE2 3.45Å; L184-V234 HydrophobicContact CD2-CG1 3.87Å; L184-A235 HydrophobicContact CD2-CB 3.57Å
185	P	91.9	Very high	93.4	Very high	13 Å²	13	41.1 Å²	41.1	8%	0.084	21%	0.209	C	C	.	.			trans	-64.1	137.7	-178.1	-24.7	36.1	0	0	0	112	I183 R187 V188 E286 I287	I183-P185 WeakPolarHBondContact O-CD 3.33Å; P185-R187 HydrophobicContact CB-CG 4.24Å; P185-R187 PolarHBondContact O-N 2.9Å; P185-V188 HydrophobicContact CB-CG2 4.36Å; P185-V188 WeakPolarHBondContact O-CB 3.27Å; P185-V188 PolarHBondContact O-N 3.24Å; P185-E286 VanDerWaalsContact CB-OE1 3.26Å; P185-E286 WeakPolarHBondContact CB-OE1 3.43Å; P185-E286 HydrophobicContact CG-CG 4.49Å; P185-I287 HydrophobicContact CG-CG1 4.05Å
186	V	92.8	Very high	93.7	Very high	88 Å²	88	40.7 Å²	40.7	53%	0.533	21%	0.207	S	C	.	.	H	α-helix	trans	-56.7	-29.3	-178.5	179.6	0	0	0	0	112.5	L184 V188 Y189 R190	L184-V186 PolarHBondContact O-N 3.01Å; V186-V188 PolarHBondContact O-N 3.1Å; V186-Y189 WeakPolarHBondContact O-CB 3.35Å; V186-Y189 PolarHBondContact O-N 3.4Å; V186-Y189 VanDerWaalsContact O-N 3.16Å; V186-R190 PolarHBondContact O-N 3.12Å
187	R	92	Very high	94.1	Very high	115 Å²	115	42.3 Å²	42.3	43%	0.434	21%	0.211	S	C	.	.	H	α-helix	trans	-59.6	-32.1	175	76.3	166.3	-169.5	127.3	-4.3	112.6	P185 R190 N191 E286	P185-R187 HydrophobicContact CB-CG 4.24Å; P185-R187 PolarHBondContact O-N 2.9Å; R187-R190 PolarHBondContact O-N 3.21Å; R187-N191 WeakPolarHBondContact O-CB 3.36Å; R187-N191 PolarHBondContact O-N 3.47Å; R187-E286 WeakPolarHBondContact CD-OE1 3.21Å; R187-E286 WeakPolarHBondContact CG-OE1 3.38Å; R187-E286 VanDerWaalsContact CZ-CD 3.48Å; R187-E286 IonicContact CZ-OE1 3.79Å; R187-E286 IonicContact CZ-OE2 3.8Å; R187-E286 IonicContact NE-OE1 2.78Å; R187-E286 PolarHBondContact NE-OE1 3.41Å; R187-E286 IonicContact NE-OE2 3.59Å; R187-E286 PolarHBondContact NE-OE2 3.13Å; R187-E286 IonicContact NH2-OE1 2.64Å; R187-E286 IonicContact NH2-OE2 2.84Å; R187-E286 PolarHBondContact NH2-OE2 3.03Å
188	V	93.1	Very high	94.7	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.018	23%	0.234	C	C	.	.	H	α-helix	trans	-69.4	-39	178.7	-177.3	0	0	0	0	110	L184 P185 V186 N191 C192 A235 Y283	L184-V188 HydrophobicContact CD1-CB 4.13Å; L184-V188 HydrophobicContact CD1-CG1 4.06Å; L184-V188 HydrophobicContact CD1-CG2 4.21Å; L184-V188 HydrophobicContact CD2-CG1 4.31Å; L184-V188 HydrophobicContact CG-CB 4.18Å; L184-V188 HydrophobicContact CG-CG1 4.36Å; P185-V188 HydrophobicContact CB-CG2 4.36Å; P185-V188 WeakPolarHBondContact O-CB 3.27Å; P185-V188 PolarHBondContact O-N 3.24Å; V186-V188 PolarHBondContact O-N 3.1Å; V188-N191 PolarHBondContact O-N 3.14Å; V188-C192 WeakPolarHBondContact O-CB 3.38Å; V188-C192 PolarHBondContact O-N 2.81Å; V188-C192 PolarHBondContact O-SG 2.96Å; V188-A235 HydrophobicContact CG1-CB 4.49Å; V188-Y283 HydrophobicContact CG2-CD1 4.37Å; V188-Y283 HydrophobicContact CG2-CE1 4.15Å
189	Y	95.6	Very high	95.2	Very high	52 Å²	52	46.5 Å²	46.5	20%	0.204	23%	0.234	C	C	.	.	H	α-helix	trans	-60.6	-48.2	171.1	-66.8	-102.3	0	0	0	111.5	G181 L184 V186 N191 C192 L193 V234 A235	G181-Y189 WeakPolarHBondContact CA-OH 3.42Å; G181-Y189 PolarHBondContact O-OH 3.11Å; L184-Y189 HydrophobicContact CB-CE2 3.85Å; L184-Y189 HydrophobicContact CD2-CD2 4.19Å; L184-Y189 HydrophobicContact CD2-CE2 3.71Å; L184-Y189 HydrophobicContact CG-CD2 4.35Å; L184-Y189 HydrophobicContact CG-CE2 3.83Å; L184-Y189 WeakPolarHBondContact O-CE2 3.45Å; V186-Y189 WeakPolarHBondContact O-CB 3.35Å; V186-Y189 PolarHBondContact O-N 3.4Å; V186-Y189 VanDerWaalsContact O-N 3.16Å; Y189-N191 VanDerWaalsContact C-N 3.32Å; Y189-N191 PolarHBondContact O-N 3.01Å; Y189-C192 PolarHBondContact O-N 3.02Å; Y189-L193 WeakPolarHBondContact O-CB 3.48Å; Y189-L193 WeakPolarHBondContact O-CG 3.43Å; Y189-L193 PolarHBondContact O-N 3.25Å; Y189-V234 HydrophobicContact CE1-CB 4.46Å; Y189-V234 HydrophobicContact CE1-CG1 3.87Å; Y189-V234 HydrophobicContact CE1-CG2 3.96Å; Y189-V234 WeakPolarHBondContact OH-CG1 3.43Å; Y189-A235 HydrophobicContact CD1-CB 3.72Å; Y189-A235 HydrophobicContact CD2-CB 4.29Å; Y189-A235 HydrophobicContact CE1-CB 4.08Å; Y189-A235 HydrophobicContact CG-CB 3.86Å
190	R	97.2	Very high	95.6	Very high	170 Å²	170	46.9 Å²	46.9	64%	0.642	24%	0.237	S	C	*	.	H	α-helix	trans	-58.4	-45.2	177.6	-68.9	-175.8	-179.8	116	0.5	111.5	V186 R187 L193 A194	V186-R190 PolarHBondContact O-N 3.12Å; R187-R190 PolarHBondContact O-N 3.21Å; R190-L193 PolarHBondContact O-N 3.18Å; R190-A194 VanDerWaalsContact O-CB 3.26Å; R190-A194 WeakPolarHBondContact O-CB 3.48Å; R190-A194 PolarHBondContact O-N 2.81Å
191	N	96.4	Very high	96	Very high	64 Å²	64	46.2 Å²	46.2	34%	0.342	23%	0.234	S	C	.	.	H	α-helix	trans	-63.6	-46.6	178	-170.9	47.2	0	0	0	112.2	R187 V188 Y189 L193 A194 V195	R187-N191 WeakPolarHBondContact O-CB 3.36Å; R187-N191 PolarHBondContact O-N 3.47Å; V188-N191 PolarHBondContact O-N 3.14Å; Y189-N191 VanDerWaalsContact C-N 3.32Å; Y189-N191 PolarHBondContact O-N 3.01Å; N191-L193 VanDerWaalsContact C-N 3.31Å; N191-L193 PolarHBondContact O-N 2.96Å; N191-A194 PolarHBondContact O-N 2.73Å; N191-V195 WeakPolarHBondContact O-CG2 3.44Å; N191-V195 PolarHBondContact O-N 3.48Å
192	C	97.4	Very high	96.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.8	-40.4	177	-69.8	0	0	0	0	111.8	V188 Y189 N196 A235 S239	V188-C192 WeakPolarHBondContact O-CB 3.38Å; V188-C192 PolarHBondContact O-N 2.81Å; V188-C192 PolarHBondContact O-SG 2.96Å; Y189-C192 PolarHBondContact O-N 3.02Å; C192-N196 WeakPolarHBondContact O-CB 3.4Å; C192-N196 VanDerWaalsContact O-CG 3.27Å; C192-N196 PolarHBondContact O-N 2.71Å; C192-A235 HydrophobicContact CB-CB 4.29Å; C192-S239 WeakPolarHBondContact O-CB 3.46Å; C192-S239 PolarHBondContact O-OG 2.97Å
193	L	98.5	Very high	96.5	Very high	66 Å²	66	41.5 Å²	41.5	35%	0.346	20%	0.203	S	C	.	.	H	α-helix	trans	-69.7	-41.4	176.4	-75	165.4	0	0	0	112.1	Y189 R190 N191 F197 L198	Y189-L193 WeakPolarHBondContact O-CB 3.48Å; Y189-L193 WeakPolarHBondContact O-CG 3.43Å; Y189-L193 PolarHBondContact O-N 3.25Å; R190-L193 PolarHBondContact O-N 3.18Å; N191-L193 VanDerWaalsContact C-N 3.31Å; N191-L193 PolarHBondContact O-N 2.96Å; L193-F197 WeakPolarHBondContact O-CB 3.37Å; L193-F197 PolarHBondContact O-N 3.25Å; L193-L198 PolarHBondContact O-N 3.48Å
194	A	98.6	Very high	96.8	Very high	32 Å²	32	41.5 Å²	41.5	26%	0.264	20%	0.203	S	C	.	.	I	π-helix	trans	-60.7	-54	178.1	0	0	0	0	0	111.1	R190 N191 A199	R190-A194 VanDerWaalsContact O-CB 3.26Å; R190-A194 WeakPolarHBondContact O-CB 3.48Å; R190-A194 PolarHBondContact O-N 2.81Å; N191-A194 PolarHBondContact O-N 2.73Å; A194-A199 VanDerWaalsContact O-CB 3.25Å; A194-A199 WeakPolarHBondContact O-CB 3.44Å; A194-A199 PolarHBondContact O-N 3.27Å
195	V	98.3	Very high	97	Very high	21 Å²	21	46.9 Å²	46.9	13%	0.127	23%	0.228	C	C	.	.	I	π-helix	trans	-79.6	-44.6	-174.3	-177.3	0	0	0	0	112.6	V143 T144 V174 N191 A199	V143-V195 HydrophobicContact CG2-CG1 4.38Å; T144-V195 HydrophobicContact CG2-CB 4.47Å; T144-V195 HydrophobicContact CG2-CG2 3.74Å; V174-V195 HydrophobicContact CG1-CG1 4.19Å; V174-V195 HydrophobicContact CG2-CB 4Å; V174-V195 HydrophobicContact CG2-CG1 4.37Å; V174-V195 HydrophobicContact CG2-CG2 4.25Å; N191-V195 WeakPolarHBondContact O-CG2 3.44Å; N191-V195 PolarHBondContact O-N 3.48Å; V195-A199 WeakPolarHBondContact O-CB 3.49Å
196	N	98.4	Very high	97.4	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	23%	0.231	C	C	.	.	I	π-helix	trans	-85.8	-18.7	-170.7	-54.9	-9.7	0	0	0	113.1	G173 V174 C192 Y236 S239 K240	G173-N196 WeakPolarHBondContact CA-OD1 3.3Å; V174-N196 PolarHBondContact N-OD1 2.93Å; V174-N196 PolarHBondContact O-ND2 3.14Å; V174-N196 PolarHBondContact O-OD1 2.86Å; C192-N196 WeakPolarHBondContact O-CB 3.4Å; C192-N196 VanDerWaalsContact O-CG 3.27Å; C192-N196 PolarHBondContact O-N 2.71Å; N196-Y236 WeakPolarHBondContact ND2-CD2 3.44Å; N196-S239 WeakPolarHBondContact CB-OG 3.45Å; N196-S239 PolarHBondContact ND2-OG 3.28Å; N196-K240 HydrophobicContact CB-CD 4.29Å
197	F	98.8	Very high	97.6	Very high	45 Å²	45	43.1 Å²	43.1	20%	0.197	21%	0.205	C	C	.	.	I	π-helix	trans	-124.4	-66.3	-174.8	171.5	-120.3	0	0	0	112.4	L193 A199 A200 V201 A242 L243 F246	L193-F197 WeakPolarHBondContact O-CB 3.37Å; L193-F197 PolarHBondContact O-N 3.25Å; F197-A199 VanDerWaalsContact C-N 3.34Å; F197-A199 PolarHBondContact O-N 2.83Å; F197-A200 WeakPolarHBondContact O-CB 3.28Å; F197-A200 PolarHBondContact O-N 2.8Å; F197-A200 VanDerWaalsContact O-N 3.07Å; F197-V201 HydrophobicContact CD2-CG2 4.05Å; F197-V201 HydrophobicContact CE2-CG2 3.56Å; F197-V201 HydrophobicContact CZ-CG2 3.9Å; F197-V201 WeakPolarHBondContact O-CG2 3.19Å; F197-V201 PolarHBondContact O-N 2.89Å; F197-A242 HydrophobicContact CB-CB 4.33Å; F197-A242 HydrophobicContact CD1-CB 3.94Å; F197-A242 HydrophobicContact CD2-CB 3.83Å; F197-A242 HydrophobicContact CE1-CB 4.21Å; F197-A242 HydrophobicContact CE2-CB 4.12Å; F197-A242 HydrophobicContact CG-CB 3.74Å; F197-A242 HydrophobicContact CZ-CB 4.29Å; F197-L243 HydrophobicContact CD2-CB 4.38Å; F197-F246 HydrophobicContact CE2-CB 3.8Å; F197-F246 HydrophobicContact CE2-CG 4.19Å
198	L	98.8	Very high	97.9	Very high	94 Å²	94	38.6 Å²	38.6	49%	0.492	19%	0.19	S	C	.	.	I	π-helix	trans	-60.7	-43.1	-173.4	-67.8	174.8	0	0	0	112.1	L193 A200 V201 E202	L193-L198 PolarHBondContact O-N 3.48Å; L198-A200 VanDerWaalsContact C-N 3.32Å; L198-A200 PolarHBondContact O-N 3.17Å; L198-V201 WeakPolarHBondContact O-CA 3.31Å; L198-V201 WeakPolarHBondContact O-CB 3.45Å; L198-V201 PolarHBondContact O-N 3.31Å; L198-E202 PolarHBondContact O-N 2.84Å
199	A	98.6	Very high	98.2	Very high	3 Å²	3	40.8 Å²	40.8	3%	0.025	20%	0.204	C	C	.	.	H	α-helix	trans	-56.3	-43.6	173.8	0	0	0	0	0	113	V143 A194 V195 F197 V201 E202 V203	V143-A199 HydrophobicContact CB-CB 3.79Å; V143-A199 HydrophobicContact CG2-CB 3.55Å; V143-A199 WeakPolarHBondContact O-CA 3.24Å; V143-A199 WeakPolarHBondContact O-CB 3.33Å; A194-A199 VanDerWaalsContact O-CB 3.25Å; A194-A199 WeakPolarHBondContact O-CB 3.44Å; A194-A199 PolarHBondContact O-N 3.27Å; V195-A199 WeakPolarHBondContact O-CB 3.49Å; F197-A199 VanDerWaalsContact C-N 3.34Å; F197-A199 PolarHBondContact O-N 2.83Å; A199-V201 VanDerWaalsContact C-N 3.3Å; A199-V201 PolarHBondContact O-N 2.8Å; A199-E202 PolarHBondContact O-N 3.03Å; A199-V203 WeakPolarHBondContact O-CB 3.47Å; A199-V203 VanDerWaalsContact O-CG2 3.3Å; A199-V203 WeakPolarHBondContact O-CG2 3.34Å; A199-V203 PolarHBondContact O-N 3.11Å
200	A	98.6	Very high	98.3	Very high	8 Å²	8	39 Å²	39	7%	0.066	20%	0.198	C	C	.	.	H	α-helix	trans	-66.3	-33.8	176.4	0	0	0	0	0	111.9	N170 F197 L198 S204 L243	N170-A200 HydrophobicContact CB-CB 3.89Å; N170-A200 PolarHBondContact ND2-O 3.04Å; F197-A200 WeakPolarHBondContact O-CB 3.28Å; F197-A200 PolarHBondContact O-N 2.8Å; F197-A200 VanDerWaalsContact O-N 3.07Å; L198-A200 VanDerWaalsContact C-N 3.32Å; L198-A200 PolarHBondContact O-N 3.17Å; A200-S204 WeakPolarHBondContact O-CB 3.22Å; A200-S204 PolarHBondContact O-N 3.09Å; A200-S204 PolarHBondContact O-OG 3.06Å; A200-L243 HydrophobicContact CB-CD1 3.7Å
201	V	98.8	Very high	98.3	Very high	22 Å²	22	31 Å²	31	13%	0.133	17%	0.167	C	C	.	.	H	α-helix	trans	-63.7	-50.7	172.6	175.9	0	0	0	0	110.1	F197 L198 A199 S204 Q205 F246	F197-V201 HydrophobicContact CD2-CG2 4.05Å; F197-V201 HydrophobicContact CE2-CG2 3.56Å; F197-V201 HydrophobicContact CZ-CG2 3.9Å; F197-V201 WeakPolarHBondContact O-CG2 3.19Å; F197-V201 PolarHBondContact O-N 2.89Å; L198-V201 WeakPolarHBondContact O-CA 3.31Å; L198-V201 WeakPolarHBondContact O-CB 3.45Å; L198-V201 PolarHBondContact O-N 3.31Å; A199-V201 VanDerWaalsContact C-N 3.3Å; A199-V201 PolarHBondContact O-N 2.8Å; V201-S204 PolarHBondContact O-N 2.84Å; V201-Q205 HydrophobicContact CG1-CG 4.38Å; V201-Q205 WeakPolarHBondContact O-CB 3.32Å; V201-Q205 WeakPolarHBondContact O-CG 3.38Å; V201-Q205 PolarHBondContact O-N 2.95Å; V201-F246 HydrophobicContact CB-CE2 4.4Å; V201-F246 HydrophobicContact CB-CZ 4.34Å; V201-F246 HydrophobicContact CG1-CE2 4.18Å; V201-F246 HydrophobicContact CG1-CZ 4.41Å; V201-F246 HydrophobicContact CG2-CD1 4.37Å; V201-F246 HydrophobicContact CG2-CD2 3.95Å; V201-F246 HydrophobicContact CG2-CE1 4.24Å; V201-F246 HydrophobicContact CG2-CE2 3.81Å; V201-F246 HydrophobicContact CG2-CG 4.22Å; V201-F246 HydrophobicContact CG2-CZ 3.95Å
202	E	98.7	Very high	98.4	Very high	65 Å²	65	32.5 Å²	32.5	30%	0.304	17%	0.168	S	C	.	.	H	α-helix	trans	-63.9	-50.5	-176.5	-170.1	170.1	169.9	0	0	111.9	A146 I149 L198 A199 S204 Q205 V206	A146-E202 VanDerWaalsContact CA-OE1 3.29Å; A146-E202 WeakPolarHBondContact CA-OE1 3.33Å; A146-E202 WeakPolarHBondContact CB-OE1 3.3Å; I149-E202 HydrophobicContact CD1-CB 4.21Å; I149-E202 HydrophobicContact CD1-CG 3.77Å; L198-E202 PolarHBondContact O-N 2.84Å; A199-E202 PolarHBondContact O-N 3.03Å; E202-S204 VanDerWaalsContact C-N 3.29Å; E202-S204 PolarHBondContact O-N 3.36Å; E202-Q205 PolarHBondContact O-N 3.33Å; E202-Q205 VanDerWaalsContact O-N 3.15Å; E202-V206 WeakPolarHBondContact O-CG2 3.47Å; E202-V206 PolarHBondContact O-N 3.18Å
203	V	98.8	Very high	98.3	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.006	20%	0.2	C	C	.	.	H	α-helix	trans	-57.4	-43.6	174.1	173.1	0	0	0	0	110.7	L90 T92 V143 I149 I168 N170 A199 Q205 F207	L90-V203 HydrophobicContact CD2-CG1 4.22Å; T92-V203 HydrophobicContact CG2-CG1 4.28Å; V143-V203 HydrophobicContact CB-CG2 4.42Å; V143-V203 HydrophobicContact CG1-CG2 4.38Å; I149-V203 HydrophobicContact CD1-CG2 3.94Å; I149-V203 HydrophobicContact CG1-CG2 4.14Å; I149-V203 HydrophobicContact CG2-CG2 4.37Å; I168-V203 HydrophobicContact CG2-CG1 4.07Å; N170-V203 WeakPolarHBondContact OD1-CG1 3.06Å; A199-V203 WeakPolarHBondContact O-CB 3.47Å; A199-V203 VanDerWaalsContact O-CG2 3.3Å; A199-V203 WeakPolarHBondContact O-CG2 3.34Å; A199-V203 PolarHBondContact O-N 3.11Å; V203-Q205 PolarHBondContact O-N 3.39Å; V203-F207 HydrophobicContact CG1-CD2 4.15Å; V203-F207 HydrophobicContact CG1-CE2 4.47Å; V203-F207 VanDerWaalsContact O-CD2 3.27Å; V203-F207 WeakPolarHBondContact O-CD2 3.22Å; V203-F207 PolarHBondContact O-N 3.09Å
204	S	98.6	Very high	98.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.4	-47.9	177.1	-60	0	0	0	0	111.3	N170 A200 V201 E202 F207 L208	N170-S204 PolarHBondContact ND2-OG 3.25Å; A200-S204 WeakPolarHBondContact O-CB 3.22Å; A200-S204 PolarHBondContact O-N 3.09Å; A200-S204 PolarHBondContact O-OG 3.06Å; V201-S204 PolarHBondContact O-N 2.84Å; E202-S204 VanDerWaalsContact C-N 3.29Å; E202-S204 PolarHBondContact O-N 3.36Å; S204-F207 PolarHBondContact O-N 3.26Å; S204-L208 WeakPolarHBondContact O-CA 3.45Å; S204-L208 WeakPolarHBondContact O-CB 3.25Å; S204-L208 WeakPolarHBondContact O-CG 3.19Å; S204-L208 PolarHBondContact O-N 3.1Å
205	Q	98.3	Very high	98.1	Very high	122 Å²	122	44.1 Å²	44.1	57%	0.57	21%	0.21	S	C	*	.	H	α-helix	trans	-62.3	-45	-177.4	-76.2	179.1	-17	0	0	112.6	V201 E202 V203 F207	V201-Q205 HydrophobicContact CG1-CG 4.38Å; V201-Q205 WeakPolarHBondContact O-CB 3.32Å; V201-Q205 WeakPolarHBondContact O-CG 3.38Å; V201-Q205 PolarHBondContact O-N 2.95Å; E202-Q205 PolarHBondContact O-N 3.33Å; E202-Q205 VanDerWaalsContact O-N 3.15Å; V203-Q205 PolarHBondContact O-N 3.39Å; Q205-F207 PolarHBondContact O-N 3.47Å
206	V	98.7	Very high	98.1	Very high	22 Å²	22	43.1 Å²	43.1	13%	0.133	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-44.2	179.9	171.2	0	0	0	0	111.2	I149 H153 E202 P209	I149-V206 HydrophobicContact CG2-CB 4Å; I149-V206 HydrophobicContact CG2-CG1 4.06Å; I149-V206 HydrophobicContact CG2-CG2 3.87Å; H153-V206 HydrophobicContact CB-CG1 3.47Å; H153-V206 VanDerWaalsContact CB-CG1 3.47Å; H153-V206 VanDerWaalsContact CG-CG1 3.44Å; E202-V206 WeakPolarHBondContact O-CG2 3.47Å; E202-V206 PolarHBondContact O-N 3.18Å; V206-P209 WeakPolarHBondContact O-CD 3.44Å
207	F	98.7	Very high	98.1	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-92.1	-7.8	-174.1	-73.4	-95.2	0	0	0	114.5	L90 I149 A152 H153 I156 L165 I168 V203 S204 Q205 P209 L210 L211	L90-F207 HydrophobicContact CD2-CD1 4.13Å; L90-F207 HydrophobicContact CD2-CD2 4.1Å; L90-F207 HydrophobicContact CD2-CE1 3.81Å; L90-F207 HydrophobicContact CD2-CE2 3.76Å; L90-F207 HydrophobicContact CD2-CG 4.26Å; L90-F207 HydrophobicContact CD2-CZ 3.6Å; I149-F207 HydrophobicContact CG2-CE2 4.15Å; A152-F207 HydrophobicContact CB-CZ 4.32Å; H153-F207 VanDerWaalsContact CA-CZ 3.44Å; H153-F207 HydrophobicContact CB-CE1 4.11Å; H153-F207 HydrophobicContact CB-CE2 4.01Å; H153-F207 HydrophobicContact CB-CZ 3.72Å; I156-F207 HydrophobicContact CB-CE1 4.04Å; I156-F207 HydrophobicContact CD1-CE1 3.52Å; I156-F207 HydrophobicContact CD1-CZ 3.88Å; I156-F207 HydrophobicContact CG1-CE1 4.34Å; I156-F207 HydrophobicContact CG2-CE1 4.13Å; L165-F207 HydrophobicContact CD2-CB 4.38Å; L165-F207 HydrophobicContact CD2-CD1 3.7Å; L165-F207 HydrophobicContact CD2-CE1 4.42Å; L165-F207 HydrophobicContact CD2-CG 4.39Å; I168-F207 HydrophobicContact CD1-CB 3.39Å; I168-F207 HydrophobicContact CD1-CG 4.3Å; I168-F207 HydrophobicContact CG1-CB 4.22Å; V203-F207 HydrophobicContact CG1-CD2 4.15Å; V203-F207 HydrophobicContact CG1-CE2 4.47Å; V203-F207 VanDerWaalsContact O-CD2 3.27Å; V203-F207 WeakPolarHBondContact O-CD2 3.22Å; V203-F207 PolarHBondContact O-N 3.09Å; S204-F207 PolarHBondContact O-N 3.26Å; Q205-F207 PolarHBondContact O-N 3.47Å; F207-P209 VanDerWaalsContact C-CD 3.41Å; F207-L210 HydrophobicContact CD1-CD1 4.05Å; F207-L210 WeakPolarHBondContact O-CB 3.44Å; F207-L210 PolarHBondContact O-N 3.14Å; F207-L211 PolarHBondContact O-N 3.37Å
208	L	98.3	Very high	98.1	Very high	20 Å²	20	41.4 Å²	41.4	11%	0.105	20%	0.196	C	C	.	.	H	α-helix	trans	-55.4	-38.1	-179.4	-100.9	169.6	0	0	0	114.9	S204 L210 L211 R212 M250 L254	S204-L208 WeakPolarHBondContact O-CA 3.45Å; S204-L208 WeakPolarHBondContact O-CB 3.25Å; S204-L208 WeakPolarHBondContact O-CG 3.19Å; S204-L208 PolarHBondContact O-N 3.1Å; L208-L210 VanDerWaalsContact C-N 3.3Å; L208-L210 PolarHBondContact O-N 3.01Å; L208-L211 PolarHBondContact O-N 3.4Å; L208-R212 WeakPolarHBondContact O-CG 3.45Å; L208-R212 PolarHBondContact O-N 2.98Å; L208-M250 HydrophobicContact CD1-CE 3.57Å; L208-L254 HydrophobicContact CD1-CD2 4.38Å; L208-L254 HydrophobicContact CD2-CD1 3.66Å; L208-L254 HydrophobicContact CD2-CD2 3.56Å; L208-L254 HydrophobicContact CD2-CG 4.28Å
209	P	97.7	Very high	98.1	Very high	49 Å²	49	37 Å²	37	32%	0.318	17%	0.173	S	C	.	.	H	α-helix	trans	-52.9	-46.8	172.1	-27.2	36.6	0	0	0	112.6	V206 F207 L211 R212 H213	V206-P209 WeakPolarHBondContact O-CD 3.44Å; F207-P209 VanDerWaalsContact C-CD 3.41Å; P209-L211 PolarHBondContact O-N 3.08Å; P209-R212 PolarHBondContact O-N 3.36Å; P209-H213 PolarHBondContact O-CD2 2.91Å; P209-H213 PolarHBondContact O-N 3.02Å
210	L	98.4	Very high	98.1	Very high	15 Å²	15	36.9 Å²	36.9	8%	0.079	17%	0.172	C	C	.	.	H	α-helix	trans	-64.8	-37.7	178.5	-61.7	178.4	0	0	0	112.6	I156 V160 L165 F207 L208 H213 S214	I156-L210 HydrophobicContact CG2-CD1 4.13Å; V160-L210 HydrophobicContact CG2-CD1 4.44Å; V160-L210 HydrophobicContact CG2-CD2 4.28Å; L165-L210 HydrophobicContact CB-CB 3.68Å; L165-L210 HydrophobicContact CB-CD1 4.15Å; L165-L210 PolarHBondContact N-O 3.2Å; F207-L210 HydrophobicContact CD1-CD1 4.05Å; F207-L210 WeakPolarHBondContact O-CB 3.44Å; F207-L210 PolarHBondContact O-N 3.14Å; L208-L210 VanDerWaalsContact C-N 3.3Å; L208-L210 PolarHBondContact O-N 3.01Å; L210-H213 PolarHBondContact O-N 2.89Å; L210-S214 PolarHBondContact O-N 2.89Å; L210-S214 PolarHBondContact O-OG 3.27Å
211	L	98.1	Very high	98.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-67.6	-36.2	176.8	-94.7	61	0	0	0	112.3	L165 I168 F207 L208 P209 H213 S214 R215 G216 L218 V259	L165-L211 HydrophobicContact CB-CD1 3.9Å; L165-L211 HydrophobicContact CD2-CD1 3.81Å; L165-L211 HydrophobicContact CG-CD1 3.96Å; L165-L211 WeakPolarHBondContact O-CD1 3.29Å; I168-L211 HydrophobicContact CD1-CD1 3.63Å; I168-L211 HydrophobicContact CD1-CD2 3.65Å; I168-L211 HydrophobicContact CD1-CG 4.29Å; I168-L211 HydrophobicContact CG1-CD1 3.75Å; I168-L211 HydrophobicContact CG1-CD2 4.09Å; F207-L211 PolarHBondContact O-N 3.37Å; L208-L211 PolarHBondContact O-N 3.4Å; P209-L211 PolarHBondContact O-N 3.08Å; L211-H213 VanDerWaalsContact C-N 3.33Å; L211-S214 PolarHBondContact O-N 2.68Å; L211-S214 PolarHBondContact O-OG 3.02Å; L211-S214 VanDerWaalsContact O-OG 3.13Å; L211-R215 WeakPolarHBondContact O-CA 3.19Å; L211-R215 PolarHBondContact O-N 2.8Å; L211-G216 PolarHBondContact O-N 3.06Å; L211-L218 HydrophobicContact CD2-CB 4.21Å; L211-V259 HydrophobicContact CB-CG1 4.44Å; L211-V259 HydrophobicContact CB-CG2 4.18Å; L211-V259 HydrophobicContact CD2-CG1 4.26Å; L211-V259 WeakPolarHBondContact O-CG2 3.4Å
212	R	96.8	Very high	97.9	Very high	97 Å²	97	35.9 Å²	35.9	37%	0.366	17%	0.165	S	C	.	.	H	α-helix	trans	-65.9	-37.7	176.7	-71.6	-175.3	-64.3	164.7	-0.3	111.5	L208 P209 R215 W257 V259	L208-R212 WeakPolarHBondContact O-CG 3.45Å; L208-R212 PolarHBondContact O-N 2.98Å; P209-R212 PolarHBondContact O-N 3.36Å; R212-R215 PolarHBondContact O-N 3.07Å; R212-W257 HydrophobicContact CG-CB 3.99Å; R212-W257 HydrophobicContact CG-CD2 4.31Å; R212-W257 HydrophobicContact CG-CE3 4.33Å; R212-W257 HydrophobicContact CG-CG 4.19Å; R212-V259 HydrophobicContact CG-CG2 4.32Å
213	H	95.6	Very high	97.7	Very high	142 Å²	142	33.5 Å²	33.5	66%	0.657	16%	0.156	S	C	*	.	H	α-helix	trans	-62.7	-44.5	174.8	-72.1	-61.5	0	0	0	112	P209 L210 L211	P209-H213 PolarHBondContact O-CD2 2.91Å; P209-H213 PolarHBondContact O-N 3.02Å; L210-H213 PolarHBondContact O-N 2.89Å; L211-H213 VanDerWaalsContact C-N 3.33Å
214	S	96.6	Very high	97.3	Very high	23 Å²	23	34.5 Å²	34.5	16%	0.161	16%	0.161	C	C	.	.	H	α-helix	trans	-82.4	-10.3	-178.4	71.9	0	0	0	0	114.5	L165 L210 L211 G216	L165-S214 WeakPolarHBondContact O-CB 3.29Å; L165-S214 PolarHBondContact O-OG 3.31Å; L210-S214 PolarHBondContact O-N 2.89Å; L210-S214 PolarHBondContact O-OG 3.27Å; L211-S214 PolarHBondContact O-N 2.68Å; L211-S214 PolarHBondContact O-OG 3.02Å; L211-S214 VanDerWaalsContact O-OG 3.13Å; S214-G216 PolarHBondContact O-N 3.44Å; S214-G216 WeakPolarHBondContact OG-CA 3.13Å; S214-G216 PolarHBondContact OG-N 2.96Å
215	R	97.1	Very high	96.9	Very high	176 Å²	176	35 Å²	35	66%	0.664	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	46.9	-166.1	-57.8	180	-178.5	178.9	0.6	111.4	L211 R212 R217 G258	L211-R215 WeakPolarHBondContact O-CA 3.19Å; L211-R215 PolarHBondContact O-N 2.8Å; R212-R215 PolarHBondContact O-N 3.07Å; R215-R217 PolarHBondContact O-NH1 3.43Å; R215-G258 CarbonylContact C-O 3.54Å
216	G	97.8	Very high	96.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.142	C	C	.	.			trans	-76.9	-149.2	-164.7	0	0	0	0	0	116.2	W166 L211 S214 N260	W166-G216 CarbonylContact O-C 3.49Å; W166-G216 VanDerWaalsContact O-C 3.3Å; W166-G216 WeakPolarHBondContact O-CA 3.48Å; L211-G216 PolarHBondContact O-N 3.06Å; S214-G216 PolarHBondContact O-N 3.44Å; S214-G216 WeakPolarHBondContact OG-CA 3.13Å; S214-G216 PolarHBondContact OG-N 2.96Å; G216-N260 PolarHBondContact O-N 3.37Å; G216-N260 VanDerWaalsContact O-N 3.14Å
217	R	98.4	Very high	96.1	Very high	11 Å²	11	31.1 Å²	31.1	4%	0.042	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	128.2	-171.7	-57.8	-63.8	-178	-104.7	7.6	110.3	W166 G167 I168 R215 N260 A332 L333 S335	W166-R217 HydrophobicContact CH2-CG 4.41Å; W166-R217 HydrophobicContact CZ2-CG 3.61Å; W166-R217 VanDerWaalsContact CZ2-CZ 3.42Å; W166-R217 PolarHBondContact O-N 3.33Å; G167-R217 CarbonylContact C-O 3.6Å; G167-R217 VanDerWaalsContact CA-O 3.25Å; G167-R217 WeakPolarHBondContact CA-O 3.33Å; I168-R217 PolarHBondContact N-O 3.02Å; R215-R217 PolarHBondContact O-NH1 3.43Å; R217-N260 WeakPolarHBondContact CA-O 3.07Å; R217-N260 PolarHBondContact NH1-ND2 3.15Å; R217-A332 WeakPolarHBondContact CD-O 3.47Å; R217-L333 HydrophobicContact CB-CD2 4.1Å; R217-S335 PolarHBondContact NH2-O 3.4Å
218	L	98.8	Very high	95.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	112.9	168.1	178.1	61.1	0	0	0	108.5	I168 L211 L254 N260 V261 S262	I168-L218 HydrophobicContact CB-CD1 4.08Å; I168-L218 HydrophobicContact CD1-CD1 4.44Å; I168-L218 HydrophobicContact CG2-CD1 4.32Å; L211-L218 HydrophobicContact CD2-CB 4.21Å; L218-L254 HydrophobicContact CD2-CD1 4.27Å; L218-N260 PolarHBondContact N-O 3.01Å; L218-V261 HydrophobicContact CB-CG1 4.34Å; L218-V261 HydrophobicContact CB-CG2 4.16Å; L218-V261 HydrophobicContact CD2-CG1 4.19Å; L218-V261 HydrophobicContact CD2-CG2 4.26Å; L218-V261 HydrophobicContact CG-CG1 4.27Å; L218-V261 CarbonylContact O-C 3.49Å; L218-V261 VanDerWaalsContact O-CA 3.27Å; L218-V261 WeakPolarHBondContact O-CA 3.29Å; L218-S262 PolarHBondContact O-N 3.25Å
219	V	98.9	Very high	95.5	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.006	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	117.5	-178.2	-175.2	0	0	0	0	108.6	I168 V169 N170 S262 I264 A332 L333	I168-V219 PolarHBondContact O-N 2.8Å; V169-V219 CarbonylContact C-O 3.56Å; V169-V219 WeakPolarHBondContact CA-O 3.47Å; V169-V219 HydrophobicContact CG1-CB 4.46Å; V169-V219 HydrophobicContact CG1-CG1 4.43Å; V169-V219 HydrophobicContact CG2-CB 4.24Å; N170-V219 PolarHBondContact N-O 3.35Å; V219-S262 WeakPolarHBondContact CA-O 3.43Å; V219-I264 HydrophobicContact CG1-CD1 4.11Å; V219-I264 HydrophobicContact CG1-CG1 3.65Å; V219-A332 HydrophobicContact CG1-CB 4.24Å; V219-A332 HydrophobicContact CG2-CB 3.88Å; V219-L333 HydrophobicContact CG2-CD2 3.92Å; V219-L333 HydrophobicContact CG2-CG 4.26Å
220	N	98.8	Very high	95.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	120	180	-69.7	-29.1	0	0	0	109.9	N170 C222 L243 S247 S262 T263 I264	N170-N220 WeakPolarHBondContact CB-OD1 3.47Å; N170-N220 PolarHBondContact ND2-OD1 2.92Å; N220-C222 PolarHBondContact O-N 3.42Å; N220-C222 VanDerWaalsContact O-N 3.14Å; N220-L243 HydrophobicContact CB-CD1 4.19Å; N220-L243 HydrophobicContact CB-CD2 4.2Å; N220-L243 HydrophobicContact CB-CG 4.2Å; N220-S247 WeakPolarHBondContact CB-OG 3.25Å; N220-S247 PolarHBondContact ND2-OG 3.47Å; N220-S262 PolarHBondContact N-O 3.26Å; N220-T263 WeakPolarHBondContact O-CA 3.14Å; N220-I264 PolarHBondContact O-N 2.98Å
221	V	98.3	Very high	94.7	Very high	7 Å²	7	34.5 Å²	34.5	4%	0.042	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	98	176.6	-170.4	0	0	0	0	108.5	V169 N170 N171 K240 P266 M329	V169-V221 HydrophobicContact CG1-CG2 4.12Å; N170-V221 PolarHBondContact O-N 3.44Å; N171-V221 HydrophobicContact CB-CB 4.43Å; N171-V221 HydrophobicContact CB-CG2 3.72Å; V221-K240 PolarHBondContact O-NZ 3.34Å; V221-P266 HydrophobicContact CG1-CG 4.32Å; V221-M329 HydrophobicContact CB-CE 4.41Å; V221-M329 HydrophobicContact CG1-CE 4.07Å; V221-M329 HydrophobicContact CG2-CE 3.41Å; V221-M329 VanDerWaalsContact CG2-CE 3.41Å
222	C	95.3	Very high	94.3	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.014	18%	0.177	C	C	.	.			trans	-87.7	-145.4	177	-62.4	0	0	0	0	109.8	N220 N244 I264 Q265	N220-C222 PolarHBondContact O-N 3.42Å; N220-C222 VanDerWaalsContact O-N 3.14Å; C222-N244 VanDerWaalsContact CB-OD1 3.24Å; C222-N244 WeakPolarHBondContact CB-OD1 3.44Å; C222-N244 PolarHBondContact SG-OD1 2.78Å; C222-I264 CarbonylContact C-O 3.6Å; C222-I264 WeakPolarHBondContact CA-O 3.39Å; C222-I264 PolarHBondContact N-O 3.06Å; C222-Q265 HydrophobicContact CB-CG 4.01Å
223	S	93.2	Very high	94.1	Very high	15 Å²	15	31.2 Å²	31.2	11%	0.105	16%	0.164	C	C	.	.			trans	-160.8	156.9	172.5	-178.2	0	0	0	0	109.3	A225 G226 Y236	S223-A225 PolarHBondContact O-N 3.04Å; S223-A225 PolarHBondContact OG-N 3.36Å; S223-G226 PolarHBondContact O-N 2.85Å; S223-Y236 WeakPolarHBondContact CB-OH 3.37Å
224	M	90.8	Very high	94.1	Very high	23 Å²	23	27.3 Å²	27.3	11%	0.113	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-51.8	-37.3	164.8	-175	-171.1	72.6	0	0	111.8	G226 D227 V228 P266 I351 P352 F371	M224-G226 PolarHBondContact O-N 2.86Å; M224-G226 VanDerWaalsContact O-N 3.14Å; M224-D227 PolarHBondContact O-N 3.42Å; M224-V228 PolarHBondContact O-N 3.3Å; M224-P266 PolarHBondContact N-O 3.48Å; M224-I351 HydrophobicContact CE-CG1 4.49Å; M224-I351 HydrophobicContact SD-CB 3.8Å; M224-I351 HydrophobicContact SD-CG1 4.02Å; M224-I351 HydrophobicContact SD-CG2 4.33Å; M224-P352 HydrophobicContact CG-CG 3.97Å; M224-F371 HydrophobicContact CE-CZ 4.42Å
225	A	90.3	Very high	94	Very high	11 Å²	11	26.3 Å²	26.3	9%	0.091	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-67.4	-9.7	177.9	0	0	0	0	0	114.2	S223 V230 Y236 G237	S223-A225 PolarHBondContact O-N 3.04Å; S223-A225 PolarHBondContact OG-N 3.36Å; A225-V230 HydrophobicContact CB-CG2 4.17Å; A225-Y236 HydrophobicContact CB-CD1 4.05Å; A225-Y236 HydrophobicContact CB-CE1 4.08Å; A225-G237 WeakPolarHBondContact O-CA 3.23Å
226	G	91	Very high	94	Very high	8 Å²	8	19 Å²	19	8%	0.082	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-87	-10.4	171	0	0	0	0	0	113.9	S223 M224 A241 N244	S223-G226 PolarHBondContact O-N 2.85Å; M224-G226 PolarHBondContact O-N 2.86Å; M224-G226 VanDerWaalsContact O-N 3.14Å; G226-A241 VanDerWaalsContact O-CA 3.27Å; G226-A241 WeakPolarHBondContact O-CA 3.41Å; G226-A241 WeakPolarHBondContact O-CB 3.3Å; G226-N244 PolarHBondContact O-ND2 3.42Å
227	D	89.9	Confident	93.9	Very high	53 Å²	53	19.5 Å²	19.5	28%	0.283	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-22.1	179.7	-89.5	17.9	0	0	0	112.8	M224 N244 Q265	M224-D227 PolarHBondContact O-N 3.42Å; D227-N244 PolarHBondContact OD1-ND2 3.33Å; D227-Q265 PolarHBondContact OD1-NE2 2.96Å; D227-Q265 PolarHBondContact OD2-NE2 2.86Å; D227-Q265 VanDerWaalsContact OD2-NE2 3.12Å; D227-Q265 PolarHBondContact OD2-OE1 3.42Å; D227-Q265 VanDerWaalsContact OD2-OE1 3.1Å
228	V	90.9	Very high	93.9	Very high	10 Å²	10	21.4 Å²	21.4	6%	0.061	14%	0.138	C	C	.	.	S	Bend	trans	-143.7	149.6	-171.7	-54.6	0	0	0	0	111.4	M224 V230 I351 P352 H355 Y363	M224-V228 PolarHBondContact O-N 3.3Å; V228-V230 HydrophobicContact CG2-CG2 3.86Å; V228-V230 PolarHBondContact O-N 3.25Å; V228-I351 HydrophobicContact CG2-CG2 3.85Å; V228-P352 HydrophobicContact CG1-CB 4.15Å; V228-P352 HydrophobicContact CG1-CG 4.27Å; V228-H355 HydrophobicContact CB-CB 4.17Å; V228-H355 HydrophobicContact CG1-CB 3.51Å; V228-Y363 VanDerWaalsContact CB-OH 3.28Å; V228-Y363 WeakPolarHBondContact CB-OH 3.5Å; V228-Y363 VanDerWaalsContact CG2-OH 3.3Å; V228-Y363 WeakPolarHBondContact CG2-OH 3.47Å
229	P	92.5	Very high	93.8	Very high	77 Å²	77	21.4 Å²	21.4	50%	0.5	14%	0.138	S	C	.	.			trans	-67.1	120.8	173.4	-17.7	31.1	0	0	0	111.5	H355 Y363	P229-H355 VanDerWaalsContact CD-NE2 3.31Å; P229-H355 WeakPolarHBondContact CD-NE2 3.37Å; P229-Y363 PolarHBondContact O-OH 3.44Å
230	V	90.7	Very high	93.8	Very high	18 Å²	18	21.6 Å²	21.6	11%	0.109	14%	0.139	C	C	.	.			trans	-118.9	122.5	174.6	-174.8	0	0	0	0	109.4	A225 V228 G232 F233 F371	A225-V230 HydrophobicContact CB-CG2 4.17Å; V228-V230 HydrophobicContact CG2-CG2 3.86Å; V228-V230 PolarHBondContact O-N 3.25Å; V230-G232 PolarHBondContact O-N 2.64Å; V230-F233 HydrophobicContact CB-CB 4.16Å; V230-F233 HydrophobicContact CB-CD2 4.2Å; V230-F233 HydrophobicContact CB-CG 4.37Å; V230-F233 HydrophobicContact CG1-CD2 3.65Å; V230-F233 HydrophobicContact CG1-CE2 4.28Å; V230-F233 HydrophobicContact CG1-CG 4.26Å; V230-F233 WeakPolarHBondContact O-CB 3.27Å; V230-F233 PolarHBondContact O-N 3.07Å; V230-F233 VanDerWaalsContact O-N 3.11Å; V230-F371 HydrophobicContact CG1-CD1 3.73Å; V230-F371 HydrophobicContact CG1-CD2 4.07Å; V230-F371 HydrophobicContact CG1-CE1 3.83Å; V230-F371 HydrophobicContact CG1-CE2 4.18Å; V230-F371 HydrophobicContact CG1-CG 3.86Å; V230-F371 HydrophobicContact CG1-CZ 4.06Å
231	P	90.2	Very high	93.7	Very high	50 Å²	50	23.3 Å²	23.3	33%	0.325	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	134.3	178.1	-27.2	35.3	0	0	0	112.6	F233 I367	P231-F233 VanDerWaalsContact C-N 3.28Å; P231-F233 WeakPolarHBondContact O-CD2 3.22Å; P231-F233 PolarHBondContact O-N 2.98Å; P231-I367 HydrophobicContact CG-CG2 4.44Å
232	G	89.6	Confident	93.7	Very high	9 Å²	9	24.3 Å²	24.3	9%	0.093	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	-9.7	-178.2	0	0	0	0	0	115.2	V178 A179 V230	V178-G232 VanDerWaalsContact CA-O 3.3Å; V178-G232 WeakPolarHBondContact CA-O 3.46Å; A179-G232 PolarHBondContact N-O 3.41Å; A179-G232 WeakPolarHBondContact O-CA 3.33Å; V230-G232 PolarHBondContact O-N 2.64Å
233	F	92.1	Very high	93.9	Very high	20 Å²	20	24.3 Å²	24.3	9%	0.088	16%	0.162	C	C	.	.			trans	-104.9	20.5	-176.1	-76.1	-100	0	0	0	113.3	L175 V178 V230 P231 A235 Y236 G237 M314	L175-F233 HydrophobicContact CD1-CD1 3.65Å; L175-F233 HydrophobicContact CD1-CE1 3.35Å; L175-F233 HydrophobicContact CD1-CZ 4.38Å; L175-F233 HydrophobicContact CD2-CE1 4.32Å; L175-F233 HydrophobicContact CG-CE1 4.44Å; V178-F233 HydrophobicContact CG1-CE2 4.17Å; V178-F233 HydrophobicContact CG2-CE1 4.25Å; V178-F233 HydrophobicContact CG2-CE2 4.04Å; V178-F233 HydrophobicContact CG2-CZ 3.76Å; V230-F233 HydrophobicContact CB-CB 4.16Å; V230-F233 HydrophobicContact CB-CD2 4.2Å; V230-F233 HydrophobicContact CB-CG 4.37Å; V230-F233 HydrophobicContact CG1-CD2 3.65Å; V230-F233 HydrophobicContact CG1-CE2 4.28Å; V230-F233 HydrophobicContact CG1-CG 4.26Å; V230-F233 WeakPolarHBondContact O-CB 3.27Å; V230-F233 PolarHBondContact O-N 3.07Å; V230-F233 VanDerWaalsContact O-N 3.11Å; P231-F233 VanDerWaalsContact C-N 3.28Å; P231-F233 WeakPolarHBondContact O-CD2 3.22Å; P231-F233 PolarHBondContact O-N 2.98Å; F233-A235 PolarHBondContact O-N 3.34Å; F233-Y236 AromaticContact CD1-CD1 3.76Å; F233-Y236 HydrophobicContact CD1-CD1 3.76Å; F233-Y236 HydrophobicContact CD1-CE1 4.48Å; F233-Y236 HydrophobicContact CD1-CG 4.38Å; F233-Y236 HydrophobicContact CE1-CD1 4.49Å; F233-Y236 PolarHBondContact O-N 3.23Å; F233-G237 WeakPolarHBondContact O-CA 3.45Å; F233-G237 PolarHBondContact O-N 3.44Å; F233-M314 HydrophobicContact CE1-CE 4.19Å; F233-M314 HydrophobicContact CE2-CE 3.8Å; F233-M314 HydrophobicContact CE2-SD 3.62Å; F233-M314 HydrophobicContact CZ-CE 3.25Å; F233-M314 HydrophobicContact CZ-SD 3.41Å; F233-M314 WeakPolarHBondContact CZ-SD 3.18Å
234	V	94.3	Very high	94.1	Very high	59 Å²	59	24.5 Å²	24.5	36%	0.358	16%	0.162	S	C	.	.	H	α-helix	trans	-55.9	-47.1	-167.4	64	0	0	0	0	114.2	L184 Y189 A238	L184-V234 HydrophobicContact CD2-CG1 3.87Å; Y189-V234 HydrophobicContact CE1-CB 4.46Å; Y189-V234 HydrophobicContact CE1-CG1 3.87Å; Y189-V234 HydrophobicContact CE1-CG2 3.96Å; Y189-V234 WeakPolarHBondContact OH-CG1 3.43Å; V234-A238 WeakPolarHBondContact O-CB 3.44Å; V234-A238 PolarHBondContact O-N 2.88Å
235	A	95.8	Very high	94.4	Very high	3 Å²	3	28.1 Å²	28.1	3%	0.025	19%	0.185	C	C	.	.	H	α-helix	trans	-69.4	-44.9	-179.8	0	0	0	0	0	112.1	L184 V188 Y189 C192 F233 S239	L184-A235 HydrophobicContact CD2-CB 3.57Å; V188-A235 HydrophobicContact CG1-CB 4.49Å; Y189-A235 HydrophobicContact CD1-CB 3.72Å; Y189-A235 HydrophobicContact CD2-CB 4.29Å; Y189-A235 HydrophobicContact CE1-CB 4.08Å; Y189-A235 HydrophobicContact CG-CB 3.86Å; C192-A235 HydrophobicContact CB-CB 4.29Å; F233-A235 PolarHBondContact O-N 3.34Å; A235-S239 PolarHBondContact O-N 2.77Å; A235-S239 VanDerWaalsContact O-N 3.15Å
236	Y	96.1	Very high	94.8	Very high	23 Å²	23	29.1 Å²	29.1	9%	0.09	19%	0.188	C	C	.	.	H	α-helix	trans	-67.3	-48.1	179.4	177.4	-101.7	0	0	0	112.6	V174 L175 N196 S223 A225 F233 A238 S239 K240 I273	V174-Y236 VanDerWaalsContact O-CD2 3.26Å; V174-Y236 WeakPolarHBondContact O-CD2 3.37Å; L175-Y236 HydrophobicContact CD1-CD1 3.93Å; L175-Y236 HydrophobicContact CD1-CD2 3.84Å; L175-Y236 HydrophobicContact CD1-CE1 4.4Å; L175-Y236 HydrophobicContact CD1-CE2 4.34Å; L175-Y236 HydrophobicContact CD1-CG 3.6Å; N196-Y236 WeakPolarHBondContact ND2-CD2 3.44Å; S223-Y236 WeakPolarHBondContact CB-OH 3.37Å; A225-Y236 HydrophobicContact CB-CD1 4.05Å; A225-Y236 HydrophobicContact CB-CE1 4.08Å; F233-Y236 AromaticContact CD1-CD1 3.76Å; F233-Y236 HydrophobicContact CD1-CD1 3.76Å; F233-Y236 HydrophobicContact CD1-CE1 4.48Å; F233-Y236 HydrophobicContact CD1-CG 4.38Å; F233-Y236 HydrophobicContact CE1-CD1 4.49Å; F233-Y236 PolarHBondContact O-N 3.23Å; Y236-A238 VanDerWaalsContact C-N 3.35Å; Y236-S239 PolarHBondContact O-N 2.95Å; Y236-S239 PolarHBondContact O-OG 3.08Å; Y236-K240 HydrophobicContact CD1-CG 4.32Å; Y236-K240 HydrophobicContact CD2-CG 4.37Å; Y236-K240 HydrophobicContact CE1-CG 3.91Å; Y236-K240 HydrophobicContact CE2-CD 4.39Å; Y236-K240 HydrophobicContact CE2-CG 3.96Å; Y236-K240 WeakPolarHBondContact O-CG 3.49Å; Y236-K240 PolarHBondContact O-N 2.99Å; Y236-K240 WeakPolarHBondContact OH-CE 3.5Å; Y236-I273 HydrophobicContact CE2-CD1 4.29Å
237	G	96.3	Very high	95.2	Very high	10 Å²	10	28.8 Å²	28.8	10%	0.103	18%	0.184	C	C	.	.	H	α-helix	trans	-61.5	-43.3	177.8	0	0	0	0	0	111.1	A225 F233 S239 K240 A241	A225-G237 WeakPolarHBondContact O-CA 3.23Å; F233-G237 WeakPolarHBondContact O-CA 3.45Å; F233-G237 PolarHBondContact O-N 3.44Å; G237-S239 PolarHBondContact O-N 3.25Å; G237-K240 PolarHBondContact O-N 3.09Å; G237-A241 VanDerWaalsContact O-CB 3.23Å; G237-A241 WeakPolarHBondContact O-CB 3.43Å; G237-A241 PolarHBondContact O-N 3.39Å
238	A	97.6	Very high	95.6	Very high	50 Å²	50	27.6 Å²	27.6	41%	0.413	18%	0.184	S	C	.	.	H	α-helix	trans	-58.8	-45	174	0	0	0	0	0	112.3	V234 Y236 A241 A242	V234-A238 WeakPolarHBondContact O-CB 3.44Å; V234-A238 PolarHBondContact O-N 2.88Å; Y236-A238 VanDerWaalsContact C-N 3.35Å; A238-A241 PolarHBondContact O-N 2.97Å; A238-A242 PolarHBondContact O-N 2.85Å
239	S	98.4	Very high	95.9	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-69.7	-37.3	179.4	71	0	0	0	0	113.1	C192 N196 A235 Y236 G237 A242 L243	C192-S239 WeakPolarHBondContact O-CB 3.46Å; C192-S239 PolarHBondContact O-OG 2.97Å; N196-S239 WeakPolarHBondContact CB-OG 3.45Å; N196-S239 PolarHBondContact ND2-OG 3.28Å; A235-S239 PolarHBondContact O-N 2.77Å; A235-S239 VanDerWaalsContact O-N 3.15Å; Y236-S239 PolarHBondContact O-N 2.95Å; Y236-S239 PolarHBondContact O-OG 3.08Å; G237-S239 PolarHBondContact O-N 3.25Å; S239-A242 PolarHBondContact O-N 3.2Å; S239-L243 PolarHBondContact O-N 2.64Å
240	K	97.5	Very high	96.2	Very high	6 Å²	6	27.5 Å²	27.5	3%	0.026	18%	0.181	C	C	.	.	H	α-helix	trans	-71.3	-30.9	174	-65.7	-55.7	-167.8	179.1	0	112.8	N196 V221 Y236 G237 L243 N244	N196-K240 HydrophobicContact CB-CD 4.29Å; V221-K240 PolarHBondContact O-NZ 3.34Å; Y236-K240 HydrophobicContact CD1-CG 4.32Å; Y236-K240 HydrophobicContact CD2-CG 4.37Å; Y236-K240 HydrophobicContact CE1-CG 3.91Å; Y236-K240 HydrophobicContact CE2-CD 4.39Å; Y236-K240 HydrophobicContact CE2-CG 3.96Å; Y236-K240 WeakPolarHBondContact O-CG 3.49Å; Y236-K240 PolarHBondContact O-N 2.99Å; Y236-K240 WeakPolarHBondContact OH-CE 3.5Å; G237-K240 PolarHBondContact O-N 3.09Å; K240-L243 HydrophobicContact CD-CD2 4.48Å; K240-L243 PolarHBondContact O-N 2.99Å; K240-N244 WeakPolarHBondContact O-CB 3.05Å; K240-N244 PolarHBondContact O-N 3.43Å
241	A	97.8	Very high	96.6	Very high	36 Å²	36	31.5 Å²	31.5	30%	0.298	19%	0.194	S	C	.	.	H	α-helix	trans	-67.3	-40.2	172.2	0	0	0	0	0	112.1	G226 G237 A238 N244 T245	G226-A241 VanDerWaalsContact O-CA 3.27Å; G226-A241 WeakPolarHBondContact O-CA 3.41Å; G226-A241 WeakPolarHBondContact O-CB 3.3Å; G237-A241 VanDerWaalsContact O-CB 3.23Å; G237-A241 WeakPolarHBondContact O-CB 3.43Å; G237-A241 PolarHBondContact O-N 3.39Å; A238-A241 PolarHBondContact O-N 2.97Å; A241-N244 PolarHBondContact O-N 3.33Å; A241-T245 PolarHBondContact O-N 3.02Å; A241-T245 PolarHBondContact O-OG1 3.41Å; A241-T245 VanDerWaalsContact O-OG1 3.06Å
242	A	98.6	Very high	97	Very high	28 Å²	28	34.7 Å²	34.7	23%	0.231	21%	0.208	C	C	.	.	H	α-helix	trans	-60.3	-47.2	171.8	0	0	0	0	0	111.2	F197 A238 S239 N244 T245 F246	F197-A242 HydrophobicContact CB-CB 4.33Å; F197-A242 HydrophobicContact CD1-CB 3.94Å; F197-A242 HydrophobicContact CD2-CB 3.83Å; F197-A242 HydrophobicContact CE1-CB 4.21Å; F197-A242 HydrophobicContact CE2-CB 4.12Å; F197-A242 HydrophobicContact CG-CB 3.74Å; F197-A242 HydrophobicContact CZ-CB 4.29Å; A238-A242 PolarHBondContact O-N 2.85Å; S239-A242 PolarHBondContact O-N 3.2Å; A242-N244 PolarHBondContact O-N 2.97Å; A242-T245 PolarHBondContact O-N 3.12Å; A242-F246 WeakPolarHBondContact O-CB 3.43Å; A242-F246 PolarHBondContact O-N 2.78Å
243	L	98.6	Very high	97.4	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-40.4	176.9	-175.1	63.9	0	0	0	112.8	F197 A200 N220 S239 K240 F246 S247	F197-L243 HydrophobicContact CD2-CB 4.38Å; A200-L243 HydrophobicContact CB-CD1 3.7Å; N220-L243 HydrophobicContact CB-CD1 4.19Å; N220-L243 HydrophobicContact CB-CD2 4.2Å; N220-L243 HydrophobicContact CB-CG 4.2Å; S239-L243 PolarHBondContact O-N 2.64Å; K240-L243 HydrophobicContact CD-CD2 4.48Å; K240-L243 PolarHBondContact O-N 2.99Å; L243-F246 HydrophobicContact CD1-CD1 4.14Å; L243-F246 PolarHBondContact O-N 2.89Å; L243-S247 WeakPolarHBondContact O-CB 3.36Å; L243-S247 PolarHBondContact O-N 3.43Å; L243-S247 PolarHBondContact O-OG 2.93Å
244	N	97.3	Very high	97.7	Very high	19 Å²	19	38.4 Å²	38.4	10%	0.102	22%	0.224	C	C	.	.	H	α-helix	trans	-58.9	-49.8	175.4	-92.3	-28.3	0	0	0	111.3	C222 G226 D227 K240 A241 A242 S247 G248 Q265	C222-N244 VanDerWaalsContact CB-OD1 3.24Å; C222-N244 WeakPolarHBondContact CB-OD1 3.44Å; C222-N244 PolarHBondContact SG-OD1 2.78Å; G226-N244 PolarHBondContact O-ND2 3.42Å; D227-N244 PolarHBondContact OD1-ND2 3.33Å; K240-N244 WeakPolarHBondContact O-CB 3.05Å; K240-N244 PolarHBondContact O-N 3.43Å; A241-N244 PolarHBondContact O-N 3.33Å; A242-N244 PolarHBondContact O-N 2.97Å; N244-S247 PolarHBondContact O-N 2.84Å; N244-G248 PolarHBondContact O-N 3.38Å; N244-Q265 PolarHBondContact ND2-NE2 3.31Å; N244-Q265 PolarHBondContact OD1-NE2 2.92Å
245	T	98.1	Very high	97.8	Very high	99 Å²	99	38.7 Å²	38.7	61%	0.607	23%	0.232	S	C	*	.	H	α-helix	trans	-62.7	-47.4	-180	-57.6	0	0	0	0	110.8	A241 A242 S247 G248 V249	A241-T245 PolarHBondContact O-N 3.02Å; A241-T245 PolarHBondContact O-OG1 3.41Å; A241-T245 VanDerWaalsContact O-OG1 3.06Å; A242-T245 PolarHBondContact O-N 3.12Å; T245-S247 VanDerWaalsContact C-N 3.34Å; T245-S247 PolarHBondContact O-N 2.92Å; T245-G248 PolarHBondContact O-N 2.79Å; T245-G248 VanDerWaalsContact O-N 3.16Å; T245-V249 WeakPolarHBondContact O-CG2 3.47Å; T245-V249 PolarHBondContact O-N 3.1Å
246	F	98.6	Very high	97.9	Very high	31 Å²	31	47.9 Å²	47.9	14%	0.136	27%	0.266	C	S	.	.	H	α-helix	trans	-54.5	-49	174.3	168.8	-101.5	0	0	0	111.9	F197 V201 A242 L243 G248 V249 M250	F197-F246 HydrophobicContact CE2-CB 3.8Å; F197-F246 HydrophobicContact CE2-CG 4.19Å; V201-F246 HydrophobicContact CB-CE2 4.4Å; V201-F246 HydrophobicContact CB-CZ 4.34Å; V201-F246 HydrophobicContact CG1-CE2 4.18Å; V201-F246 HydrophobicContact CG1-CZ 4.41Å; V201-F246 HydrophobicContact CG2-CD1 4.37Å; V201-F246 HydrophobicContact CG2-CD2 3.95Å; V201-F246 HydrophobicContact CG2-CE1 4.24Å; V201-F246 HydrophobicContact CG2-CE2 3.81Å; V201-F246 HydrophobicContact CG2-CG 4.22Å; V201-F246 HydrophobicContact CG2-CZ 3.95Å; A242-F246 WeakPolarHBondContact O-CB 3.43Å; A242-F246 PolarHBondContact O-N 2.78Å; L243-F246 HydrophobicContact CD1-CD1 4.14Å; L243-F246 PolarHBondContact O-N 2.89Å; F246-G248 VanDerWaalsContact C-N 3.29Å; F246-G248 PolarHBondContact O-N 3.15Å; F246-V249 PolarHBondContact O-N 2.91Å; F246-V249 VanDerWaalsContact O-N 3.16Å; F246-M250 HydrophobicContact CD1-CG 4.12Å; F246-M250 HydrophobicContact CD2-CG 3.85Å; F246-M250 HydrophobicContact CD2-SD 4.34Å; F246-M250 HydrophobicContact CE1-CG 3.78Å; F246-M250 HydrophobicContact CE2-CG 3.46Å; F246-M250 VanDerWaalsContact CE2-CG 3.46Å; F246-M250 HydrophobicContact CE2-SD 3.62Å; F246-M250 HydrophobicContact CG-CG 4.17Å; F246-M250 HydrophobicContact CZ-CE 4.37Å; F246-M250 HydrophobicContact CZ-CG 3.43Å; F246-M250 VanDerWaalsContact CZ-CG 3.43Å; F246-M250 HydrophobicContact CZ-SD 3.88Å; F246-M250 WeakPolarHBondContact O-CB 3.33Å; F246-M250 VanDerWaalsContact O-CG 3.28Å; F246-M250 WeakPolarHBondContact O-CG 3.49Å; F246-M250 PolarHBondContact O-N 3.23Å
247	S	98.5	Very high	97.9	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.014	28%	0.282	C	S	.	.	H	α-helix	trans	-60.8	-39.3	179	-55.4	0	0	0	0	112.4	N220 L243 N244 T245 R251 T263	N220-S247 WeakPolarHBondContact CB-OG 3.25Å; N220-S247 PolarHBondContact ND2-OG 3.47Å; L243-S247 WeakPolarHBondContact O-CB 3.36Å; L243-S247 PolarHBondContact O-N 3.43Å; L243-S247 PolarHBondContact O-OG 2.93Å; N244-S247 PolarHBondContact O-N 2.84Å; T245-S247 VanDerWaalsContact C-N 3.34Å; T245-S247 PolarHBondContact O-N 2.92Å; S247-R251 WeakPolarHBondContact O-CB 3.42Å; S247-R251 PolarHBondContact O-N 3.29Å; S247-T263 WeakPolarHBondContact OG-CG2 3.38Å
248	G	98.1	Very high	98	Very high	27 Å²	27	53 Å²	53	28%	0.278	29%	0.291	S	S	.	.	H	α-helix	trans	-61.2	-42.6	175.6	0	0	0	0	0	112.8	N244 T245 F246	N244-G248 PolarHBondContact O-N 3.38Å; T245-G248 PolarHBondContact O-N 2.79Å; T245-G248 VanDerWaalsContact O-N 3.16Å; F246-G248 VanDerWaalsContact C-N 3.29Å; F246-G248 PolarHBondContact O-N 3.15Å
249	V	98.4	Very high	98	Very high	68 Å²	68	50.7 Å²	50.7	41%	0.412	27%	0.272	S	S	.	.	H	α-helix	trans	-70.3	-50.1	176.9	175.5	0	0	0	0	111	T245 F246 R251 L252 E253	T245-V249 WeakPolarHBondContact O-CG2 3.47Å; T245-V249 PolarHBondContact O-N 3.1Å; F246-V249 PolarHBondContact O-N 2.91Å; F246-V249 VanDerWaalsContact O-N 3.16Å; V249-R251 PolarHBondContact O-N 3.35Å; V249-L252 WeakPolarHBondContact O-CB 3.46Å; V249-L252 PolarHBondContact O-N 2.95Å; V249-E253 HydrophobicContact CG1-CG 4.23Å; V249-E253 WeakPolarHBondContact CG1-OE1 3.46Å; V249-E253 PolarHBondContact O-N 3.19Å
250	M	98.4	Very high	98	Very high	18 Å²	18	53.7 Å²	53.7	9%	0.089	29%	0.288	C	S	.	.	H	α-helix	trans	-56.8	-36.5	178.9	-68	-56.9	-66.9	0	0	111.7	L208 F246 L252 E253 L254 V261	L208-M250 HydrophobicContact CD1-CE 3.57Å; F246-M250 HydrophobicContact CD1-CG 4.12Å; F246-M250 HydrophobicContact CD2-CG 3.85Å; F246-M250 HydrophobicContact CD2-SD 4.34Å; F246-M250 HydrophobicContact CE1-CG 3.78Å; F246-M250 HydrophobicContact CE2-CG 3.46Å; F246-M250 VanDerWaalsContact CE2-CG 3.46Å; F246-M250 HydrophobicContact CE2-SD 3.62Å; F246-M250 HydrophobicContact CG-CG 4.17Å; F246-M250 HydrophobicContact CZ-CE 4.37Å; F246-M250 HydrophobicContact CZ-CG 3.43Å; F246-M250 VanDerWaalsContact CZ-CG 3.43Å; F246-M250 HydrophobicContact CZ-SD 3.88Å; F246-M250 WeakPolarHBondContact O-CB 3.33Å; F246-M250 VanDerWaalsContact O-CG 3.28Å; F246-M250 WeakPolarHBondContact O-CG 3.49Å; F246-M250 PolarHBondContact O-N 3.23Å; M250-L252 VanDerWaalsContact C-N 3.26Å; M250-L252 PolarHBondContact O-N 3.21Å; M250-E253 PolarHBondContact O-N 2.88Å; M250-L254 HydrophobicContact CB-CD1 4.24Å; M250-L254 HydrophobicContact CE-CD1 3.73Å; M250-L254 HydrophobicContact CE-CD2 4.21Å; M250-L254 HydrophobicContact CE-CG 3.97Å; M250-L254 WeakPolarHBondContact O-CB 3.43Å; M250-L254 WeakPolarHBondContact O-CG 3.31Å; M250-L254 PolarHBondContact O-N 2.89Å; M250-V261 HydrophobicContact CB-CG2 4.32Å
251	R	98.4	Very high	98.1	Very high	102 Å²	102	53.7 Å²	53.7	39%	0.385	29%	0.288	S	S	.	.	H	α-helix	trans	-56.6	-39.8	174.2	-173.2	176.8	52.4	70.8	6.7	112.9	S247 V249 A255 V261	S247-R251 WeakPolarHBondContact O-CB 3.42Å; S247-R251 PolarHBondContact O-N 3.29Å; V249-R251 PolarHBondContact O-N 3.35Å; R251-A255 WeakPolarHBondContact O-CB 3.4Å; R251-A255 PolarHBondContact O-N 2.9Å; R251-V261 HydrophobicContact CB-CB 3.84Å; R251-V261 HydrophobicContact CB-CG2 4.29Å; R251-V261 HydrophobicContact CG-CB 4.27Å
252	L	98.3	Very high	98.1	Very high	116 Å²	116	52.1 Å²	52.1	61%	0.607	28%	0.275	S	S	*	.	H	α-helix	trans	-75.6	-45.5	-180	-60.5	175.8	0	0	0	110.8	V249 M250 L254	V249-L252 WeakPolarHBondContact O-CB 3.46Å; V249-L252 PolarHBondContact O-N 2.95Å; M250-L252 VanDerWaalsContact C-N 3.26Å; M250-L252 PolarHBondContact O-N 3.21Å; L252-L254 VanDerWaalsContact C-N 3.35Å; L252-L254 PolarHBondContact O-N 2.81Å
253	E	98.1	Very high	98.1	Very high	98 Å²	98	51.1 Å²	51.1	46%	0.458	27%	0.266	S	S	.	.	H	α-helix	trans	-68.2	-34.6	-177.4	-65.8	-173	177.6	0	0	113.3	V249 M250 R256	V249-E253 HydrophobicContact CG1-CG 4.23Å; V249-E253 WeakPolarHBondContact CG1-OE1 3.46Å; V249-E253 PolarHBondContact O-N 3.19Å; M250-E253 PolarHBondContact O-N 2.88Å; E253-R256 WeakPolarHBondContact O-CG 3.43Å; E253-R256 PolarHBondContact O-NE 2.88Å
254	L	98.4	Very high	98	Very high	10 Å²	10	51 Å²	51	5%	0.052	27%	0.266	C	S	.	.	H	α-helix	trans	-86.9	-15	-177	-65	-178.7	0	0	0	114	L208 L218 M250 L252 R256 W257 G258 V259 V261	L208-L254 HydrophobicContact CD1-CD2 4.38Å; L208-L254 HydrophobicContact CD2-CD1 3.66Å; L208-L254 HydrophobicContact CD2-CD2 3.56Å; L208-L254 HydrophobicContact CD2-CG 4.28Å; L218-L254 HydrophobicContact CD2-CD1 4.27Å; M250-L254 HydrophobicContact CB-CD1 4.24Å; M250-L254 HydrophobicContact CE-CD1 3.73Å; M250-L254 HydrophobicContact CE-CD2 4.21Å; M250-L254 HydrophobicContact CE-CG 3.97Å; M250-L254 WeakPolarHBondContact O-CB 3.43Å; M250-L254 WeakPolarHBondContact O-CG 3.31Å; M250-L254 PolarHBondContact O-N 2.89Å; L252-L254 VanDerWaalsContact C-N 3.35Å; L252-L254 PolarHBondContact O-N 2.81Å; L254-R256 VanDerWaalsContact C-N 3.28Å; L254-R256 PolarHBondContact O-N 3.3Å; L254-W257 WeakPolarHBondContact O-CA 3.48Å; L254-W257 WeakPolarHBondContact O-CB 3.26Å; L254-W257 PolarHBondContact O-N 3.23Å; L254-G258 PolarHBondContact O-N 3.49Å; L254-V259 HydrophobicContact CB-CB 4.11Å; L254-V259 HydrophobicContact CB-CG1 4.47Å; L254-V259 HydrophobicContact CD1-CB 4.49Å; L254-V259 HydrophobicContact CD1-CG1 4.06Å; L254-V259 PolarHBondContact O-N 3.38Å; L254-V261 HydrophobicContact CB-CG2 4.36Å; L254-V261 HydrophobicContact CD1-CG2 3.77Å
255	A	97.4	Very high	97.9	Very high	65 Å²	65	50.4 Å²	50.4	54%	0.537	26%	0.262	S	S	.	.	H	α-helix	trans	-56.1	-41.4	179.8	0	0	0	0	0	112.7	R251 W257 G258	R251-A255 WeakPolarHBondContact O-CB 3.4Å; R251-A255 PolarHBondContact O-N 2.9Å; A255-W257 PolarHBondContact O-N 3.08Å; A255-G258 PolarHBondContact O-N 3.35Å
256	R	96.4	Very high	97.6	Very high	196 Å²	196	46 Å²	46	74%	0.74	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-20.4	176.7	65.9	-175.8	161.4	167.7	-1.4	113.9	E253 L254	E253-R256 WeakPolarHBondContact O-CG 3.43Å; E253-R256 PolarHBondContact O-NE 2.88Å; L254-R256 VanDerWaalsContact C-N 3.28Å; L254-R256 PolarHBondContact O-N 3.3Å
257	W	97.3	Very high	97	Very high	112 Å²	112	45.9 Å²	45.9	42%	0.424	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	0.1	177.2	-56.8	96	0	0	0	112.5	R212 L254 A255 V259	R212-W257 HydrophobicContact CG-CB 3.99Å; R212-W257 HydrophobicContact CG-CD2 4.31Å; R212-W257 HydrophobicContact CG-CE3 4.33Å; R212-W257 HydrophobicContact CG-CG 4.19Å; L254-W257 WeakPolarHBondContact O-CA 3.48Å; L254-W257 WeakPolarHBondContact O-CB 3.26Å; L254-W257 PolarHBondContact O-N 3.23Å; A255-W257 PolarHBondContact O-N 3.08Å; W257-V259 PolarHBondContact O-N 2.96Å
258	G	97.1	Very high	96.3	Very high	29 Å²	29	47.8 Å²	47.8	30%	0.299	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	9.6	-177.7	0	0	0	0	0	114.5	R215 L254 A255	R215-G258 CarbonylContact C-O 3.54Å; L254-G258 PolarHBondContact O-N 3.49Å; A255-G258 PolarHBondContact O-N 3.35Å
259	V	98.4	Very high	95.7	Very high	1 Å²	1	47 Å²	47	1%	0.006	25%	0.249	C	C	.	.			trans	-88.3	123.6	176.7	176.2	0	0	0	0	109.1	L211 R212 L254 W257	L211-V259 HydrophobicContact CB-CG1 4.44Å; L211-V259 HydrophobicContact CB-CG2 4.18Å; L211-V259 HydrophobicContact CD2-CG1 4.26Å; L211-V259 WeakPolarHBondContact O-CG2 3.4Å; R212-V259 HydrophobicContact CG-CG2 4.32Å; L254-V259 HydrophobicContact CB-CB 4.11Å; L254-V259 HydrophobicContact CB-CG1 4.47Å; L254-V259 HydrophobicContact CD1-CB 4.49Å; L254-V259 HydrophobicContact CD1-CG1 4.06Å; L254-V259 PolarHBondContact O-N 3.38Å; W257-V259 PolarHBondContact O-N 2.96Å
260	N	98.4	Very high	95	Very high	62 Å²	62	48.5 Å²	48.5	33%	0.332	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	135.5	177.5	-71.4	-75.8	0	0	0	110.6	G216 R217 L218 P338	G216-N260 PolarHBondContact O-N 3.37Å; G216-N260 VanDerWaalsContact O-N 3.14Å; R217-N260 WeakPolarHBondContact CA-O 3.07Å; R217-N260 PolarHBondContact NH1-ND2 3.15Å; L218-N260 PolarHBondContact N-O 3.01Å; N260-P338 HydrophobicContact CB-CG 3.67Å
261	V	98.7	Very high	94.3	Very high	6 Å²	6	48.7 Å²	48.7	4%	0.036	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	132.6	177.7	-171.8	0	0	0	0	109.7	L218 M250 R251 L254	L218-V261 HydrophobicContact CB-CG1 4.34Å; L218-V261 HydrophobicContact CB-CG2 4.16Å; L218-V261 HydrophobicContact CD2-CG1 4.19Å; L218-V261 HydrophobicContact CD2-CG2 4.26Å; L218-V261 HydrophobicContact CG-CG1 4.27Å; L218-V261 CarbonylContact O-C 3.49Å; L218-V261 VanDerWaalsContact O-CA 3.27Å; L218-V261 WeakPolarHBondContact O-CA 3.29Å; M250-V261 HydrophobicContact CB-CG2 4.32Å; R251-V261 HydrophobicContact CB-CB 3.84Å; R251-V261 HydrophobicContact CB-CG2 4.29Å; R251-V261 HydrophobicContact CG-CB 4.27Å; L254-V261 HydrophobicContact CB-CG2 4.36Å; L254-V261 HydrophobicContact CD1-CG2 3.77Å
262	S	98.6	Very high	93.5	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.021	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	139.7	179.8	-63	0	0	0	0	110.9	L218 V219 N220 R339 P340	L218-S262 PolarHBondContact O-N 3.25Å; V219-S262 WeakPolarHBondContact CA-O 3.43Å; N220-S262 PolarHBondContact N-O 3.26Å; S262-R339 PolarHBondContact OG-O 3.42Å; S262-P340 WeakPolarHBondContact CA-O 3.39Å
263	T	98	Very high	92.8	Very high	8 Å²	8	46.4 Å²	46.4	5%	0.049	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	135.1	167.4	57.3	0	0	0	0	110.7	N220 S247 P340 V341 Y342	N220-T263 WeakPolarHBondContact O-CA 3.14Å; S247-T263 WeakPolarHBondContact OG-CG2 3.38Å; T263-P340 PolarHBondContact N-O 3.42Å; T263-P340 PolarHBondContact OG1-O 3.19Å; T263-V341 WeakPolarHBondContact O-CA 3.28Å; T263-Y342 PolarHBondContact O-N 2.98Å
264	I	97.1	Very high	91.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	125.7	169	-47.5	-58.9	0	0	0	107	V219 N220 C222 P266 V325 D328 M329 A332 Y342 P344	V219-I264 HydrophobicContact CG1-CD1 4.11Å; V219-I264 HydrophobicContact CG1-CG1 3.65Å; N220-I264 PolarHBondContact O-N 2.98Å; C222-I264 CarbonylContact C-O 3.6Å; C222-I264 WeakPolarHBondContact CA-O 3.39Å; C222-I264 PolarHBondContact N-O 3.06Å; I264-P266 VanDerWaalsContact C-CD 3.49Å; I264-P266 HydrophobicContact CG2-CG 4.13Å; I264-P266 WeakPolarHBondContact O-CD 3.33Å; I264-V325 HydrophobicContact CG2-CG1 4.28Å; I264-D328 HydrophobicContact CD1-CB 4.4Å; I264-M329 HydrophobicContact CD1-CG 4.45Å; I264-M329 HydrophobicContact CG1-CG 4Å; I264-A332 HydrophobicContact CD1-CB 4.14Å; I264-Y342 HydrophobicContact CD1-CD2 3.49Å; I264-Y342 VanDerWaalsContact CD1-CD2 3.49Å; I264-Y342 HydrophobicContact CD1-CE2 4.2Å; I264-Y342 HydrophobicContact CD1-CG 3.77Å; I264-P344 HydrophobicContact CG2-CG 3.79Å
265	Q	94.4	Very high	91.1	Very high	5 Å²	5	44.1 Å²	44.1	2%	0.023	25%	0.247	C	C	.	.			trans	-120.1	78.5	-178.3	-64.2	175.8	-21.2	0	0	110.2	C222 D227 N244 V341 Y342 T343	C222-Q265 HydrophobicContact CB-CG 4.01Å; D227-Q265 PolarHBondContact OD1-NE2 2.96Å; D227-Q265 PolarHBondContact OD2-NE2 2.86Å; D227-Q265 VanDerWaalsContact OD2-NE2 3.12Å; D227-Q265 PolarHBondContact OD2-OE1 3.42Å; D227-Q265 VanDerWaalsContact OD2-OE1 3.1Å; N244-Q265 PolarHBondContact ND2-NE2 3.31Å; N244-Q265 PolarHBondContact OD1-NE2 2.92Å; Q265-V341 HydrophobicContact CG-CG1 4.38Å; Q265-Y342 WeakPolarHBondContact CB-O 3.47Å; Q265-Y342 PolarHBondContact N-O 3.18Å; Q265-T343 HydrophobicContact CB-CG2 4.36Å
266	P	91.9	Very high	90.3	Very high	6 Å²	6	43.4 Å²	43.4	4%	0.039	24%	0.238	C	C	.	.			trans	-64.7	146.6	177	-17.1	31.4	0	0	0	111.8	F98 V221 M224 I264 F269 V325 P344	F98-P266 HydrophobicContact CE2-CB 4.17Å; F98-P266 HydrophobicContact CE2-CG 3.93Å; F98-P266 HydrophobicContact CZ-CB 4.08Å; F98-P266 HydrophobicContact CZ-CG 4.23Å; V221-P266 HydrophobicContact CG1-CG 4.32Å; M224-P266 PolarHBondContact N-O 3.48Å; I264-P266 VanDerWaalsContact C-CD 3.49Å; I264-P266 HydrophobicContact CG2-CG 4.13Å; I264-P266 WeakPolarHBondContact O-CD 3.33Å; P266-F269 HydrophobicContact CB-CD2 3.72Å; P266-F269 HydrophobicContact CB-CE2 3.86Å; P266-V325 HydrophobicContact CB-CG2 4.19Å; P266-V325 HydrophobicContact CG-CG1 4.16Å; P266-V325 HydrophobicContact CG-CG2 4.42Å; P266-P344 HydrophobicContact CB-CG 4.33Å; P266-P344 HydrophobicContact CG-CG 4.31Å
267	A	85.8	Confident	89.6	Confident	30 Å²	30	37.2 Å²	37.2	25%	0.248	23%	0.225	C	C	.	.			trans	-84.1	-150.3	163.5	0	0	0	0	0	111.1	F269 P344 A348	A267-F269 WeakPolarHBondContact O-CD2 3.19Å; A267-F269 PolarHBondContact O-N 3.11Å; A267-F269 VanDerWaalsContact O-N 3.15Å; A267-P344 PolarHBondContact N-O 2.81Å; A267-A348 HydrophobicContact CB-CB 3.71Å
268	G	83.8	Confident	88.9	Confident	42 Å²	42	37.6 Å²	37.6	43%	0.433	24%	0.235	S	C	.	.	S	Bend	trans	-72.4	101.5	-179	0	0	0	0	0	112.9	S318 S319	G268-S318 WeakPolarHBondContact O-CA 3.11Å; G268-S319 PolarHBondContact O-N 3.48Å
269	F	86.1	Confident	88.2	Confident	9 Å²	9	38.3 Å²	38.3	4%	0.039	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-121.8	140.7	173.8	-69.5	-89.4	0	0	0	110.7	F98 P266 A267 T271 S318 S319 D321 L322 V325 P344	F98-F269 HydrophobicContact CE1-CB 3.93Å; F98-F269 HydrophobicContact CE1-CG 4.13Å; F98-F269 HydrophobicContact CZ-CB 3.63Å; F98-F269 HydrophobicContact CZ-CD2 4.06Å; F98-F269 AromaticContact CZ-CG 3.94Å; F98-F269 HydrophobicContact CZ-CG 3.94Å; P266-F269 HydrophobicContact CB-CD2 3.72Å; P266-F269 HydrophobicContact CB-CE2 3.86Å; A267-F269 WeakPolarHBondContact O-CD2 3.19Å; A267-F269 PolarHBondContact O-N 3.11Å; A267-F269 VanDerWaalsContact O-N 3.15Å; F269-T271 PolarHBondContact O-N 2.7Å; F269-T271 VanDerWaalsContact O-N 3.14Å; F269-S318 VanDerWaalsContact C-CB 3.49Å; F269-S319 CarbonylContact C-O 3.51Å; F269-S319 WeakPolarHBondContact CA-O 3.43Å; F269-D321 WeakPolarHBondContact CD1-O 3.49Å; F269-D321 VanDerWaalsContact CE1-O 3.29Å; F269-D321 WeakPolarHBondContact CE1-O 3.39Å; F269-L322 HydrophobicContact CB-CD2 4.25Å; F269-L322 HydrophobicContact CD1-CD2 4.32Å; F269-V325 HydrophobicContact CD1-CG2 4.06Å; F269-V325 HydrophobicContact CD2-CG2 3.8Å; F269-V325 HydrophobicContact CE1-CG2 3.75Å; F269-V325 HydrophobicContact CE2-CG2 3.48Å; F269-V325 VanDerWaalsContact CE2-CG2 3.48Å; F269-V325 HydrophobicContact CG-CG2 4.09Å; F269-V325 HydrophobicContact CZ-CG2 3.44Å; F269-V325 VanDerWaalsContact CZ-CG2 3.44Å; F269-P344 WeakPolarHBondContact CE2-O 3.28Å; F269-P344 HydrophobicContact CZ-CB 4.41Å
270	K	83.8	Confident	87.4	Confident	101 Å²	101	40.1 Å²	40.1	44%	0.439	24%	0.239	S	C	.	.			trans	-76.7	105.2	-176.4	-166.9	176.7	-179.1	176.5	0	108.8	S319 E320	K270-S319 PolarHBondContact N-O 3.13Å; K270-E320 HydrophobicContact CB-CG 4.47Å; K270-E320 HydrophobicContact CD-CG 3.82Å; K270-E320 WeakPolarHBondContact CD-OE1 3.25Å; K270-E320 IonicContact NZ-OE1 3.8Å; K270-E320 PolarHBondContact NZ-OE1 3.26Å
271	T	84	Confident	86.8	Confident	21 Å²	21	40.2 Å²	40.2	13%	0.129	24%	0.244	C	C	.	.			trans	-137.1	169.4	175.6	64.3	0	0	0	0	108.9	F98 F269 I273 F274 L322	F98-T271 HydrophobicContact CD1-CG2 4.32Å; F98-T271 HydrophobicContact CE1-CG2 4.01Å; F98-T271 HydrophobicContact CE2-CG2 4.26Å; F98-T271 HydrophobicContact CZ-CG2 3.99Å; F269-T271 PolarHBondContact O-N 2.7Å; F269-T271 VanDerWaalsContact O-N 3.14Å; T271-I273 PolarHBondContact O-N 3.31Å; T271-I273 VanDerWaalsContact O-N 3.08Å; T271-I273 WeakPolarHBondContact OG1-CB 3.1Å; T271-I273 WeakPolarHBondContact OG1-CG2 3.41Å; T271-I273 PolarHBondContact OG1-N 3.26Å; T271-F274 WeakPolarHBondContact O-CD2 3.42Å; T271-L322 HydrophobicContact CG2-CD2 4.36Å
272	N	81.6	Confident	86.2	Confident	116 Å²	116	46.4 Å²	46.4	62%	0.62	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-72.5	2.6	178.1	-70	23.7	0	0	0	113.3	T96 F274 G275	T96-N272 HydrophobicContact CG2-CB 4.28Å; N272-F274 PolarHBondContact O-N 2.83Å; N272-F274 VanDerWaalsContact O-N 3.11Å; N272-G275 PolarHBondContact O-N 3.44Å
273	I	83.3	Confident	85.5	Confident	55 Å²	55	47.8 Å²	47.8	28%	0.282	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-61	-21.2	178.1	-152.9	178.3	0	0	0	112.9	L175 Y236 T271 G275	L175-I273 HydrophobicContact CB-CD1 4.41Å; L175-I273 HydrophobicContact CB-CG1 4.02Å; L175-I273 WeakPolarHBondContact CB-O 3.49Å; Y236-I273 HydrophobicContact CE2-CD1 4.29Å; T271-I273 PolarHBondContact O-N 3.31Å; T271-I273 VanDerWaalsContact O-N 3.08Å; T271-I273 WeakPolarHBondContact OG1-CB 3.1Å; T271-I273 WeakPolarHBondContact OG1-CG2 3.41Å; T271-I273 PolarHBondContact OG1-N 3.26Å; I273-G275 PolarHBondContact O-N 2.78Å
274	F	80.2	Confident	85	Confident	20 Å²	20	49.1 Å²	49.1	9%	0.088	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-73	-12.2	176.5	-63.7	-67.5	0	0	0	113.5	L175 T271 N272 W280 F311 M314 A315	L175-F274 HydrophobicContact CD2-CD1 3.75Å; L175-F274 HydrophobicContact CD2-CE1 4.07Å; T271-F274 WeakPolarHBondContact O-CD2 3.42Å; N272-F274 PolarHBondContact O-N 2.83Å; N272-F274 VanDerWaalsContact O-N 3.11Å; F274-W280 PolarHBondContact O-NE1 3.14Å; F274-F311 HydrophobicContact CB-CD1 4.42Å; F274-F311 HydrophobicContact CD1-CD1 4.13Å; F274-M314 HydrophobicContact CE1-CB 4.08Å; F274-M314 HydrophobicContact CE1-CE 4.41Å; F274-A315 HydrophobicContact CD2-CB 4.18Å; F274-A315 HydrophobicContact CG-CB 4.4Å
275	G	80.9	Confident	84.5	Confident	39 Å²	39	55.4 Å²	55.4	40%	0.402	31%	0.307	S	S	.	.			trans	73.2	-174.9	-179.9	0	0	0	0	0	114	N272 I273	N272-G275 PolarHBondContact O-N 3.44Å; I273-G275 PolarHBondContact O-N 2.78Å
276	S	81.3	Confident	84.2	Confident	50 Å²	50	56.9 Å²	56.9	35%	0.35	31%	0.314	S	S	.	.			trans	-99.8	168.2	179.4	67.1	0	0	0	0	112.8	D278 D279 W280	S276-D278 PolarHBondContact O-N 3.23Å; S276-D278 PolarHBondContact OG-N 3.2Å; S276-D279 PolarHBondContact N-OD2 2.93Å; S276-D279 WeakPolarHBondContact O-CB 3.42Å; S276-D279 PolarHBondContact O-N 2.8Å; S276-D279 VanDerWaalsContact OG-CG 3.32Å; S276-D279 PolarHBondContact OG-N 3.4Å; S276-D279 PolarHBondContact OG-OD2 2.9Å; S276-W280 VanDerWaalsContact O-CD1 3.29Å; S276-W280 VanDerWaalsContact O-CG 3.25Å; S276-W280 PolarHBondContact O-N 3.44Å; S276-W280 VanDerWaalsContact O-N 3.15Å; S276-W280 PolarHBondContact O-NE1 3.47Å
277	S	80.8	Confident	84.1	Confident	66 Å²	66	56.6 Å²	56.6	46%	0.462	31%	0.312	S	S	.	.	H	α-helix	trans	-56.3	-33.8	171.4	49.9	0	0	0	0	113	W280 S281	S277-W280 PolarHBondContact O-N 2.87Å; S277-S281 PolarHBondContact O-N 3.33Å; S277-S281 PolarHBondContact O-OG 3.34Å
278	D	83.3	Confident	84.2	Confident	120 Å²	120	56.9 Å²	56.9	64%	0.642	31%	0.308	S	S	*	.	H	α-helix	trans	-73.4	-39.2	-177.7	-60.7	-7.5	0	0	0	110.2	S276 W280 S281 R282	S276-D278 PolarHBondContact O-N 3.23Å; S276-D278 PolarHBondContact OG-N 3.2Å; D278-W280 VanDerWaalsContact C-N 3.31Å; D278-W280 PolarHBondContact O-N 3.48Å; D278-S281 PolarHBondContact O-N 3.3Å; D278-R282 WeakPolarHBondContact O-CB 3.5Å; D278-R282 PolarHBondContact O-N 2.86Å
279	D	82	Confident	84.4	Confident	45 Å²	45	59.5 Å²	59.5	24%	0.241	32%	0.316	C	S	.	.	H	α-helix	trans	-58.7	-45.7	171.8	-68	-55.1	0	0	0	111.3	S276 S281 R282 Y283	S276-D279 PolarHBondContact N-OD2 2.93Å; S276-D279 WeakPolarHBondContact O-CB 3.42Å; S276-D279 PolarHBondContact O-N 2.8Å; S276-D279 VanDerWaalsContact OG-CG 3.32Å; S276-D279 PolarHBondContact OG-N 3.4Å; S276-D279 PolarHBondContact OG-OD2 2.9Å; D279-S281 VanDerWaalsContact C-N 3.34Å; D279-S281 PolarHBondContact O-N 2.98Å; D279-R282 PolarHBondContact O-N 3.45Å; D279-R282 IonicContact OD1-CZ 3.72Å; D279-R282 IonicContact OD1-NH2 2.8Å; D279-R282 PolarHBondContact OD1-NH2 3.36Å; D279-Y283 HydrophobicContact CB-CD2 4.5Å; D279-Y283 HydrophobicContact CB-CE2 4.34Å; D279-Y283 WeakPolarHBondContact O-CD2 3.26Å; D279-Y283 PolarHBondContact O-N 3.45Å
280	W	82.5	Confident	84.5	Confident	38 Å²	38	62.1 Å²	62.1	14%	0.144	34%	0.335	C	S	.	.	H	α-helix	trans	-62.4	-42.3	-179.6	-56.4	-18.6	0	0	0	112.1	Y177 F274 S276 S277 D278 Y283 Q284 Q308 F311	Y177-W280 HydrophobicContact CE2-CB 4.4Å; F274-W280 PolarHBondContact O-NE1 3.14Å; S276-W280 VanDerWaalsContact O-CD1 3.29Å; S276-W280 VanDerWaalsContact O-CG 3.25Å; S276-W280 PolarHBondContact O-N 3.44Å; S276-W280 VanDerWaalsContact O-N 3.15Å; S276-W280 PolarHBondContact O-NE1 3.47Å; S277-W280 PolarHBondContact O-N 2.87Å; D278-W280 VanDerWaalsContact C-N 3.31Å; D278-W280 PolarHBondContact O-N 3.48Å; W280-Y283 PolarHBondContact O-N 2.98Å; W280-Q284 WeakPolarHBondContact O-CB 3.42Å; W280-Q284 PolarHBondContact O-N 2.69Å; W280-Q308 HydrophobicContact CB-CG 3.95Å; W280-Q308 HydrophobicContact CD2-CG 4.14Å; W280-Q308 HydrophobicContact CE3-CG 3.63Å; W280-Q308 HydrophobicContact CG-CG 4.31Å; W280-Q308 HydrophobicContact CZ3-CG 4.48Å; W280-F311 HydrophobicContact CD2-CB 4.32Å; W280-F311 HydrophobicContact CH2-CB 4.24Å; W280-F311 HydrophobicContact CZ2-CB 3.78Å; W280-F311 HydrophobicContact CZ2-CG 4.43Å; W280-F311 AromaticContact NE1-CD1 3.92Å; W280-F311 AromaticContact NE1-CG 3.89Å
281	S	84.5	Confident	84.8	Confident	64 Å²	64	58.2 Å²	58.2	45%	0.448	32%	0.319	S	S	.	.	H	α-helix	trans	-63.3	-43.9	178.4	-56.5	0	0	0	0	111.2	S277 D278 D279 Q284 E285	S277-S281 PolarHBondContact O-N 3.33Å; S277-S281 PolarHBondContact O-OG 3.34Å; D278-S281 PolarHBondContact O-N 3.3Å; D279-S281 VanDerWaalsContact C-N 3.34Å; D279-S281 PolarHBondContact O-N 2.98Å; S281-Q284 PolarHBondContact O-N 3.15Å; S281-E285 PolarHBondContact O-N 3.4Å
282	R	86	Confident	85.2	Confident	136 Å²	136	60.2 Å²	60.2	51%	0.513	33%	0.334	S	S	.	.	H	α-helix	trans	-61.8	-43.8	175.9	179.4	176.9	60.2	171.8	-6.1	112.5	D278 D279 E286	D278-R282 WeakPolarHBondContact O-CB 3.5Å; D278-R282 PolarHBondContact O-N 2.86Å; D279-R282 PolarHBondContact O-N 3.45Å; D279-R282 IonicContact OD1-CZ 3.72Å; D279-R282 IonicContact OD1-NH2 2.8Å; D279-R282 PolarHBondContact OD1-NH2 3.36Å; R282-E286 WeakPolarHBondContact O-CB 3.14Å; R282-E286 PolarHBondContact O-N 2.88Å
283	Y	85.1	Confident	85.6	Confident	33 Å²	33	62.8 Å²	62.8	13%	0.129	34%	0.342	C	S	.	.	H	α-helix	trans	-65.8	-39.2	176.4	-76.5	-60.1	0	0	0	112.4	Y177 V188 D279 W280 E286 I287	Y177-Y283 AromaticContact CD2-CD2 3.72Å; Y177-Y283 HydrophobicContact CD2-CD2 3.72Å; Y177-Y283 AromaticContact CD2-CG 3.7Å; Y177-Y283 HydrophobicContact CD2-CG 3.7Å; Y177-Y283 HydrophobicContact CG-CD2 4.31Å; Y177-Y283 AromaticContact CG-CG 3.98Å; Y177-Y283 HydrophobicContact CG-CG 3.98Å; V188-Y283 HydrophobicContact CG2-CD1 4.37Å; V188-Y283 HydrophobicContact CG2-CE1 4.15Å; D279-Y283 HydrophobicContact CB-CD2 4.5Å; D279-Y283 HydrophobicContact CB-CE2 4.34Å; D279-Y283 WeakPolarHBondContact O-CD2 3.26Å; D279-Y283 PolarHBondContact O-N 3.45Å; W280-Y283 PolarHBondContact O-N 2.98Å; Y283-E286 PolarHBondContact O-N 3.3Å; Y283-I287 WeakPolarHBondContact O-CG1 3.1Å; Y283-I287 PolarHBondContact O-N 2.69Å
284	Q	86.3	Confident	86	Confident	36 Å²	36	65.9 Å²	65.9	17%	0.168	36%	0.359	C	S	.	.	H	α-helix	trans	-62.7	-47.9	177.2	177.2	173	-41.7	0	0	111.4	W280 S281 E286 I287 F288 I304 S305	W280-Q284 WeakPolarHBondContact O-CB 3.42Å; W280-Q284 PolarHBondContact O-N 2.69Å; S281-Q284 PolarHBondContact O-N 3.15Å; Q284-E286 VanDerWaalsContact C-N 3.27Å; Q284-E286 PolarHBondContact O-N 3.42Å; Q284-I287 PolarHBondContact O-N 2.86Å; Q284-F288 HydrophobicContact CG-CD2 3.78Å; Q284-F288 HydrophobicContact CG-CE2 3.52Å; Q284-F288 WeakPolarHBondContact O-CD2 3.49Å; Q284-F288 PolarHBondContact O-N 3.38Å; Q284-I304 HydrophobicContact CG-CG2 4.3Å; Q284-S305 PolarHBondContact NE2-OG 2.84Å
285	E	87.8	Confident	86.7	Confident	132 Å²	132	66.1 Å²	66.1	62%	0.617	36%	0.362	S	S	*	.	H	α-helix	trans	-59.5	-40.5	175.8	-176.7	176.5	-167.5	0	0	111.7	S281 F288 T289	S281-E285 PolarHBondContact O-N 3.4Å; E285-F288 PolarHBondContact O-N 2.83Å; E285-T289 HydrophobicContact CG-CG2 4.48Å; E285-T289 WeakPolarHBondContact O-CG2 3.42Å; E285-T289 PolarHBondContact O-N 3.02Å; E285-T289 PolarHBondContact O-OG1 3.12Å
286	E	88.5	Confident	87.1	Confident	35 Å²	35	68.7 Å²	68.7	16%	0.164	36%	0.36	C	S	.	.	H	α-helix	trans	-66.5	-40.8	177.3	-165.6	-139.1	170.1	0	0	112.7	P185 R187 R282 Y283 Q284 F288 T289 S290	P185-E286 VanDerWaalsContact CB-OE1 3.26Å; P185-E286 WeakPolarHBondContact CB-OE1 3.43Å; P185-E286 HydrophobicContact CG-CG 4.49Å; R187-E286 WeakPolarHBondContact CD-OE1 3.21Å; R187-E286 WeakPolarHBondContact CG-OE1 3.38Å; R187-E286 VanDerWaalsContact CZ-CD 3.48Å; R187-E286 IonicContact CZ-OE1 3.79Å; R187-E286 IonicContact CZ-OE2 3.8Å; R187-E286 IonicContact NE-OE1 2.78Å; R187-E286 PolarHBondContact NE-OE1 3.41Å; R187-E286 IonicContact NE-OE2 3.59Å; R187-E286 PolarHBondContact NE-OE2 3.13Å; R187-E286 IonicContact NH2-OE1 2.64Å; R187-E286 IonicContact NH2-OE2 2.84Å; R187-E286 PolarHBondContact NH2-OE2 3.03Å; R282-E286 WeakPolarHBondContact O-CB 3.14Å; R282-E286 PolarHBondContact O-N 2.88Å; Y283-E286 PolarHBondContact O-N 3.3Å; Q284-E286 VanDerWaalsContact C-N 3.27Å; Q284-E286 PolarHBondContact O-N 3.42Å; E286-F288 VanDerWaalsContact C-N 3.33Å; E286-T289 WeakPolarHBondContact CA-OG1 3.41Å; E286-T289 PolarHBondContact O-N 3.28Å; E286-T289 PolarHBondContact O-OG1 2.8Å; E286-T289 VanDerWaalsContact O-OG1 3.13Å; E286-S290 WeakPolarHBondContact O-CB 3.21Å; E286-S290 PolarHBondContact O-N 3.31Å; E286-S290 PolarHBondContact O-OG 3.05Å
287	I	88.8	Confident	87.6	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.005	38%	0.376	C	S	.	.	H	α-helix	trans	-57.6	-51.8	171.4	-72.2	165.9	0	0	0	108.6	Y177 A179 I183 P185 Y283 Q284 T289 S290 L291 I304	Y177-I287 HydrophobicContact CD1-CD1 3.39Å; Y177-I287 HydrophobicContact CE1-CD1 3.37Å; Y177-I287 HydrophobicContact CG-CD1 4.4Å; A179-I287 HydrophobicContact CB-CD1 4.21Å; I183-I287 HydrophobicContact CB-CG2 4.4Å; P185-I287 HydrophobicContact CG-CG1 4.05Å; Y283-I287 WeakPolarHBondContact O-CG1 3.1Å; Y283-I287 PolarHBondContact O-N 2.69Å; Q284-I287 PolarHBondContact O-N 2.86Å; I287-T289 VanDerWaalsContact C-N 3.31Å; I287-T289 PolarHBondContact O-N 2.89Å; I287-S290 PolarHBondContact O-N 2.95Å; I287-S290 PolarHBondContact O-OG 3.04Å; I287-L291 HydrophobicContact CG2-CD1 3.72Å; I287-L291 HydrophobicContact CG2-CG 4.18Å; I287-L291 WeakPolarHBondContact O-CG 3.49Å; I287-L291 PolarHBondContact O-N 3.26Å; I287-I304 HydrophobicContact CG2-CD1 4.33Å; I287-I304 HydrophobicContact CG2-CG2 3.92Å
288	F	87	Confident	88.3	Confident	35 Å²	35	75.1 Å²	75.1	15%	0.154	38%	0.378	C	S	.	.	H	α-helix	trans	-54.4	-47.5	179.7	-82.6	-61	0	0	0	112.9	Q284 E285 E286 R296 E301 I304	Q284-F288 HydrophobicContact CG-CD2 3.78Å; Q284-F288 HydrophobicContact CG-CE2 3.52Å; Q284-F288 WeakPolarHBondContact O-CD2 3.49Å; Q284-F288 PolarHBondContact O-N 3.38Å; E285-F288 PolarHBondContact O-N 2.83Å; E286-F288 VanDerWaalsContact C-N 3.33Å; F288-R296 PolarHBondContact O-NE 2.89Å; F288-R296 VanDerWaalsContact O-NE 3.09Å; F288-R296 PolarHBondContact O-NH2 3.33Å; F288-E301 HydrophobicContact CE1-CB 3.82Å; F288-E301 HydrophobicContact CE1-CG 3.69Å; F288-E301 HydrophobicContact CZ-CB 3.86Å; F288-E301 HydrophobicContact CZ-CG 4.21Å; F288-I304 HydrophobicContact CD1-CD1 4.05Å; F288-I304 HydrophobicContact CD2-CG2 4.18Å; F288-I304 HydrophobicContact CE1-CB 3.97Å; F288-I304 HydrophobicContact CE1-CD1 3.6Å; F288-I304 HydrophobicContact CE1-CG1 4.37Å; F288-I304 HydrophobicContact CE1-CG2 4Å; F288-I304 HydrophobicContact CE2-CB 4.23Å; F288-I304 HydrophobicContact CE2-CG2 3.62Å; F288-I304 HydrophobicContact CZ-CB 3.61Å; F288-I304 HydrophobicContact CZ-CD1 4.18Å; F288-I304 HydrophobicContact CZ-CG1 4.49Å; F288-I304 HydrophobicContact CZ-CG2 3.52Å
289	T	88.5	Confident	88.7	Confident	98 Å²	98	70.9 Å²	70.9	60%	0.601	35%	0.353	S	S	*	.	H	α-helix	trans	-74.1	-30	-176	51.6	0	0	0	0	113.8	E285 E286 I287	E285-T289 HydrophobicContact CG-CG2 4.48Å; E285-T289 WeakPolarHBondContact O-CG2 3.42Å; E285-T289 PolarHBondContact O-N 3.02Å; E285-T289 PolarHBondContact O-OG1 3.12Å; E286-T289 WeakPolarHBondContact CA-OG1 3.41Å; E286-T289 PolarHBondContact O-N 3.28Å; E286-T289 PolarHBondContact O-OG1 2.8Å; E286-T289 VanDerWaalsContact O-OG1 3.13Å; I287-T289 VanDerWaalsContact C-N 3.31Å; I287-T289 PolarHBondContact O-N 2.89Å
290	S	88.1	Confident	89.2	Confident	64 Å²	64	69.3 Å²	69.3	45%	0.448	35%	0.347	S	S	.	.	H	α-helix	trans	-84.7	-21.1	-177.5	61.2	0	0	0	0	114.6	E286 I287	E286-S290 WeakPolarHBondContact O-CB 3.21Å; E286-S290 PolarHBondContact O-N 3.31Å; E286-S290 PolarHBondContact O-OG 3.05Å; I287-S290 PolarHBondContact O-N 2.95Å; I287-S290 PolarHBondContact O-OG 3.04Å
291	L	90.9	Very high	89.5	Confident	18 Å²	18	73.7 Å²	73.7	9%	0.094	37%	0.37	C	S	.	.	S	Bend	trans	-72.4	141.6	-179.8	-68.3	176.9	0	0	0	112.8	I183 I287 V295 R296 I304	I183-L291 HydrophobicContact CB-CD1 4.23Å; I183-L291 HydrophobicContact CB-CD2 3.9Å; I183-L291 HydrophobicContact CG2-CD1 4.05Å; I183-L291 HydrophobicContact CG2-CD2 3.89Å; I287-L291 HydrophobicContact CG2-CD1 3.72Å; I287-L291 HydrophobicContact CG2-CG 4.18Å; I287-L291 WeakPolarHBondContact O-CG 3.49Å; I287-L291 PolarHBondContact O-N 3.26Å; L291-V295 HydrophobicContact CD1-CG1 4.44Å; L291-V295 HydrophobicContact CD2-CB 4.49Å; L291-V295 HydrophobicContact CD2-CG1 3.82Å; L291-R296 HydrophobicContact CB-CB 4.34Å; L291-R296 PolarHBondContact O-NH2 2.87Å; L291-I304 HydrophobicContact CD1-CD1 3.74Å
292	S	91.3	Very high	89.7	Confident	63 Å²	63	73.9 Å²	73.9	44%	0.441	38%	0.375	S	S	.	.			trans	-63.1	158	166.8	70.8	0	0	0	0	110.8	D294 V295 R296	S292-D294 VanDerWaalsContact C-N 3.27Å; S292-D294 PolarHBondContact O-N 3.39Å; S292-V295 PolarHBondContact O-N 2.91Å; S292-V295 VanDerWaalsContact OG-CG2 3.3Å; S292-V295 WeakPolarHBondContact OG-CG2 3.44Å; S292-V295 PolarHBondContact OG-N 3.21Å; S292-R296 WeakPolarHBondContact O-CB 3.27Å; S292-R296 PolarHBondContact O-N 3.42Å
293	Q	90.4	Very high	89.9	Confident	170 Å²	170	68.1 Å²	68.1	79%	0.794	35%	0.353	S	S	*	.	H	α-helix	trans	-60.6	-38.5	-178.4	-171.5	173.3	0.8	0	0	112.3	K297	Q293-K297 WeakPolarHBondContact O-CB 3.28Å; Q293-K297 PolarHBondContact O-N 2.7Å
294	D	92.8	Very high	90.1	Very high	120 Å²	120	66.6 Å²	66.6	64%	0.642	35%	0.347	S	S	*	.	H	α-helix	trans	-64.8	-50.2	178.9	-62.4	-32.2	0	0	0	111.3	S292 R296 K297 D298	S292-D294 VanDerWaalsContact C-N 3.27Å; S292-D294 PolarHBondContact O-N 3.39Å; D294-R296 VanDerWaalsContact C-N 3.34Å; D294-R296 PolarHBondContact O-N 3.41Å; D294-K297 WeakPolarHBondContact O-CB 3.24Å; D294-K297 PolarHBondContact O-N 3.44Å; D294-K297 VanDerWaalsContact O-N 3.13Å; D294-D298 PolarHBondContact O-N 2.84Å
295	V	93.3	Very high	90.1	Very high	25 Å²	25	67.2 Å²	67.2	15%	0.152	36%	0.355	C	S	.	.	H	α-helix	trans	-64.5	-40.1	179.4	179.5	0	0	0	0	110.9	I183 L291 S292 K297 D298 Y299	I183-V295 HydrophobicContact CG2-CG1 3.85Å; L291-V295 HydrophobicContact CD1-CG1 4.44Å; L291-V295 HydrophobicContact CD2-CB 4.49Å; L291-V295 HydrophobicContact CD2-CG1 3.82Å; S292-V295 PolarHBondContact O-N 2.91Å; S292-V295 VanDerWaalsContact OG-CG2 3.3Å; S292-V295 WeakPolarHBondContact OG-CG2 3.44Å; S292-V295 PolarHBondContact OG-N 3.21Å; V295-K297 VanDerWaalsContact C-N 3.27Å; V295-K297 PolarHBondContact O-N 3.32Å; V295-D298 PolarHBondContact O-N 2.92Å; V295-Y299 HydrophobicContact CG1-CD2 3.63Å; V295-Y299 HydrophobicContact CG1-CE2 3.89Å; V295-Y299 WeakPolarHBondContact O-CD2 3.47Å; V295-Y299 PolarHBondContact O-N 2.96Å
296	R	90.7	Very high	90.1	Very high	93 Å²	93	61.7 Å²	61.7	35%	0.351	33%	0.331	S	S	.	.	H	α-helix	trans	-61.4	-37.6	176.1	-167.4	-175.5	-58.6	163.9	9.2	111.7	F288 L291 S292 D294 G300	F288-R296 PolarHBondContact O-NE 2.89Å; F288-R296 VanDerWaalsContact O-NE 3.09Å; F288-R296 PolarHBondContact O-NH2 3.33Å; L291-R296 HydrophobicContact CB-CB 4.34Å; L291-R296 PolarHBondContact O-NH2 2.87Å; S292-R296 WeakPolarHBondContact O-CB 3.27Å; S292-R296 PolarHBondContact O-N 3.42Å; D294-R296 VanDerWaalsContact C-N 3.34Å; D294-R296 PolarHBondContact O-N 3.41Å; R296-G300 VanDerWaalsContact O-CA 3.32Å; R296-G300 WeakPolarHBondContact O-CA 3.48Å; R296-G300 PolarHBondContact O-N 3.36Å
297	K	92.1	Very high	89.9	Confident	159 Å²	159	60 Å²	60	69%	0.691	32%	0.324	S	S	*	.	H	α-helix	trans	-68.9	-41.9	176.8	-174.9	-176.2	176.1	-171.9	0	111.9	Q293 D294 V295	Q293-K297 WeakPolarHBondContact O-CB 3.28Å; Q293-K297 PolarHBondContact O-N 2.7Å; D294-K297 WeakPolarHBondContact O-CB 3.24Å; D294-K297 PolarHBondContact O-N 3.44Å; D294-K297 VanDerWaalsContact O-N 3.13Å; V295-K297 VanDerWaalsContact C-N 3.27Å; V295-K297 PolarHBondContact O-N 3.32Å
298	D	93.8	Very high	89.4	Confident	92 Å²	92	62.7 Å²	62.7	49%	0.492	34%	0.336	S	S	.	.	H	α-helix	trans	-71	-39.2	-178.2	-74.1	-16.6	0	0	0	112.7	D294 V295 P378 A379 G380	D294-D298 PolarHBondContact O-N 2.84Å; V295-D298 PolarHBondContact O-N 2.92Å; D298-P378 CarbonylContact O-C 3.52Å; D298-A379 PolarHBondContact O-N 3.09Å; D298-G380 PolarHBondContact O-N 3.27Å
299	Y	92.6	Very high	89.1	Confident	32 Å²	32	63.6 Å²	63.6	13%	0.125	35%	0.35	C	S	.	.	H	α-helix	trans	-78.4	-46.1	175.4	-80.9	-89.9	0	0	0	111.9	D180 E182 I183 V295 Y303 P378 A379	D180-Y299 HydrophobicContact CB-CE1 4.32Å; E182-Y299 HydrophobicContact CG-CE2 4.4Å; E182-Y299 PolarHBondContact OE2-OH 3.14Å; E182-Y299 VanDerWaalsContact OE2-OH 3.13Å; I183-Y299 HydrophobicContact CD1-CD1 4.18Å; I183-Y299 HydrophobicContact CD1-CE1 4.26Å; I183-Y299 HydrophobicContact CG2-CD1 3.97Å; I183-Y299 HydrophobicContact CG2-CD2 3.5Å; I183-Y299 VanDerWaalsContact CG2-CD2 3.5Å; I183-Y299 HydrophobicContact CG2-CE1 3.92Å; I183-Y299 HydrophobicContact CG2-CE2 3.45Å; I183-Y299 VanDerWaalsContact CG2-CE2 3.45Å; I183-Y299 HydrophobicContact CG2-CG 3.74Å; V295-Y299 HydrophobicContact CG1-CD2 3.63Å; V295-Y299 HydrophobicContact CG1-CE2 3.89Å; V295-Y299 WeakPolarHBondContact O-CD2 3.47Å; V295-Y299 PolarHBondContact O-N 2.96Å; Y299-Y303 AromaticContact CD1-CD1 3.59Å; Y299-Y303 HydrophobicContact CD1-CD1 3.59Å; Y299-Y303 AromaticContact CD1-CE1 3.57Å; Y299-Y303 HydrophobicContact CD1-CE1 3.57Å; Y299-Y303 HydrophobicContact CE1-CD1 4.38Å; Y299-Y303 AromaticContact CE1-CE1 3.9Å; Y299-Y303 HydrophobicContact CE1-CE1 3.9Å; Y299-Y303 WeakPolarHBondContact O-CB 3.29Å; Y299-P378 HydrophobicContact CD1-CB 4.46Å; Y299-P378 HydrophobicContact CD1-CG 4.4Å; Y299-P378 WeakPolarHBondContact O-CA 3.32Å; Y299-A379 PolarHBondContact O-N 3.35Å
300	G	91.6	Very high	88.6	Confident	12 Å²	12	59.5 Å²	59.5	12%	0.124	32%	0.324	C	S	.	.			trans	76.3	151.1	-178.3	0	0	0	0	0	113.9	R296 A302 Y303 I304	R296-G300 VanDerWaalsContact O-CA 3.32Å; R296-G300 WeakPolarHBondContact O-CA 3.48Å; R296-G300 PolarHBondContact O-N 3.36Å; G300-A302 VanDerWaalsContact C-N 3.34Å; G300-A302 PolarHBondContact O-N 3.07Å; G300-Y303 PolarHBondContact O-N 3Å; G300-I304 PolarHBondContact O-N 3.22Å
301	E	89.1	Confident	88	Confident	130 Å²	130	56.6 Å²	56.6	61%	0.607	30%	0.303	S	S	*	.	H	α-helix	trans	-66.4	-34.8	-173.8	-53.5	-171.4	165.7	0	0	113.4	F288 Y303 I304 S305	F288-E301 HydrophobicContact CE1-CB 3.82Å; F288-E301 HydrophobicContact CE1-CG 3.69Å; F288-E301 HydrophobicContact CZ-CB 3.86Å; F288-E301 HydrophobicContact CZ-CG 4.21Å; E301-Y303 VanDerWaalsContact C-N 3.32Å; E301-Y303 PolarHBondContact O-N 3.24Å; E301-I304 PolarHBondContact O-N 3.17Å; E301-S305 VanDerWaalsContact O-CB 3.32Å; E301-S305 WeakPolarHBondContact O-CB 3.46Å; E301-S305 PolarHBondContact O-N 2.78Å; E301-S305 PolarHBondContact O-OG 3.03Å
302	A	89.5	Confident	87.3	Confident	68 Å²	68	57.8 Å²	57.8	56%	0.562	32%	0.316	S	S	*	.	H	α-helix	trans	-61.5	-40.9	177.1	0	0	0	0	0	111.8	G300 S306	G300-A302 VanDerWaalsContact C-N 3.34Å; G300-A302 PolarHBondContact O-N 3.07Å; A302-S306 WeakPolarHBondContact O-CB 3.34Å; A302-S306 PolarHBondContact O-N 3.33Å; A302-S306 VanDerWaalsContact O-N 3.08Å
303	Y	90.3	Very high	86.8	Confident	15 Å²	15	59.6 Å²	59.6	6%	0.059	32%	0.315	C	S	.	.	H	α-helix	trans	-65.9	-51.6	177.6	-178.4	-98	0	0	0	111.4	D180 I183 Y299 G300 E301 S305 S306 L307 R310 N374 S376 P378	D180-Y303 VanDerWaalsContact CG-OH 3.25Å; D180-Y303 PolarHBondContact OD1-OH 2.59Å; D180-Y303 WeakPolarHBondContact OD2-CE1 3.46Å; D180-Y303 PolarHBondContact OD2-OH 2.74Å; I183-Y303 HydrophobicContact CD1-CE1 4.42Å; Y299-Y303 AromaticContact CD1-CD1 3.59Å; Y299-Y303 HydrophobicContact CD1-CD1 3.59Å; Y299-Y303 AromaticContact CD1-CE1 3.57Å; Y299-Y303 HydrophobicContact CD1-CE1 3.57Å; Y299-Y303 HydrophobicContact CE1-CD1 4.38Å; Y299-Y303 AromaticContact CE1-CE1 3.9Å; Y299-Y303 HydrophobicContact CE1-CE1 3.9Å; Y299-Y303 WeakPolarHBondContact O-CB 3.29Å; G300-Y303 PolarHBondContact O-N 3Å; E301-Y303 VanDerWaalsContact C-N 3.32Å; E301-Y303 PolarHBondContact O-N 3.24Å; Y303-S305 VanDerWaalsContact C-N 3.3Å; Y303-S305 PolarHBondContact O-N 3.4Å; Y303-S306 WeakPolarHBondContact O-CB 3.34Å; Y303-S306 PolarHBondContact O-N 2.82Å; Y303-S306 PolarHBondContact O-OG 3.04Å; Y303-L307 HydrophobicContact CE1-CD2 3.98Å; Y303-L307 PolarHBondContact O-N 3.36Å; Y303-R310 PolarHBondContact OH-NH2 3.11Å; Y303-R310 VanDerWaalsContact OH-NH2 3.1Å; Y303-N374 WeakPolarHBondContact CE2-ND2 3.38Å; Y303-S376 WeakPolarHBondContact CA-OG 3.32Å; Y303-S376 VanDerWaalsContact CD2-O 3.28Å; Y303-S376 WeakPolarHBondContact CD2-O 3.22Å; Y303-P378 HydrophobicContact CD2-CG 4Å; Y303-P378 HydrophobicContact CE1-CG 4.44Å; Y303-P378 HydrophobicContact CE2-CG 3.84Å; Y303-P378 HydrophobicContact CG-CG 4.34Å
304	I	89.1	Confident	86.3	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-59.1	-44.4	-178.4	-65.8	167.4	0	0	0	110.2	I183 Q284 I287 F288 L291 G300 E301 S306 L307	I183-I304 HydrophobicContact CD1-CG1 4.48Å; Q284-I304 HydrophobicContact CG-CG2 4.3Å; I287-I304 HydrophobicContact CG2-CD1 4.33Å; I287-I304 HydrophobicContact CG2-CG2 3.92Å; F288-I304 HydrophobicContact CD1-CD1 4.05Å; F288-I304 HydrophobicContact CD2-CG2 4.18Å; F288-I304 HydrophobicContact CE1-CB 3.97Å; F288-I304 HydrophobicContact CE1-CD1 3.6Å; F288-I304 HydrophobicContact CE1-CG1 4.37Å; F288-I304 HydrophobicContact CE1-CG2 4Å; F288-I304 HydrophobicContact CE2-CB 4.23Å; F288-I304 HydrophobicContact CE2-CG2 3.62Å; F288-I304 HydrophobicContact CZ-CB 3.61Å; F288-I304 HydrophobicContact CZ-CD1 4.18Å; F288-I304 HydrophobicContact CZ-CG1 4.49Å; F288-I304 HydrophobicContact CZ-CG2 3.52Å; L291-I304 HydrophobicContact CD1-CD1 3.74Å; G300-I304 PolarHBondContact O-N 3.22Å; E301-I304 PolarHBondContact O-N 3.17Å; I304-S306 VanDerWaalsContact C-N 3.27Å; I304-S306 PolarHBondContact O-N 2.97Å; I304-L307 VanDerWaalsContact O-CB 3.28Å; I304-L307 WeakPolarHBondContact O-CB 3.39Å; I304-L307 WeakPolarHBondContact O-CG 3.32Å; I304-L307 PolarHBondContact O-N 3.15Å; I304-L307 VanDerWaalsContact O-N 3.14Å
305	S	86.8	Confident	85.6	Confident	49 Å²	49	48 Å²	48	34%	0.343	26%	0.262	S	S	.	.	H	α-helix	trans	-64.6	-31.6	177.2	-53.7	0	0	0	0	112.5	Q284 E301 Y303 L307	Q284-S305 PolarHBondContact NE2-OG 2.84Å; E301-S305 VanDerWaalsContact O-CB 3.32Å; E301-S305 WeakPolarHBondContact O-CB 3.46Å; E301-S305 PolarHBondContact O-N 2.78Å; E301-S305 PolarHBondContact O-OG 3.03Å; Y303-S305 VanDerWaalsContact C-N 3.3Å; Y303-S305 PolarHBondContact O-N 3.4Å; S305-L307 PolarHBondContact O-N 2.94Å
306	S	86.8	Confident	85.1	Confident	16 Å²	16	52.6 Å²	52.6	11%	0.112	29%	0.29	C	S	.	.	H	α-helix	trans	-69.9	-17.2	177.2	81	0	0	0	0	113.8	A302 Y303 I304 Q308 A309 S376	A302-S306 WeakPolarHBondContact O-CB 3.34Å; A302-S306 PolarHBondContact O-N 3.33Å; A302-S306 VanDerWaalsContact O-N 3.08Å; Y303-S306 WeakPolarHBondContact O-CB 3.34Å; Y303-S306 PolarHBondContact O-N 2.82Å; Y303-S306 PolarHBondContact O-OG 3.04Å; I304-S306 VanDerWaalsContact C-N 3.27Å; I304-S306 PolarHBondContact O-N 2.97Å; S306-Q308 PolarHBondContact O-N 2.81Å; S306-A309 VanDerWaalsContact O-CB 3.31Å; S306-A309 WeakPolarHBondContact O-CB 3.47Å; S306-A309 PolarHBondContact O-N 3.15Å; S306-A309 VanDerWaalsContact O-N 3.1Å; S306-S376 WeakPolarHBondContact CB-OG 3.14Å; S306-S376 PolarHBondContact OG-OG 3.16Å
307	L	84.9	Confident	84.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.7	-31.2	179.3	-61	175.1	0	0	0	112.1	Y177 A179 I183 Y303 I304 S305 A309 R310	Y177-L307 HydrophobicContact CE1-CB 4.24Å; Y177-L307 HydrophobicContact CE1-CD1 4.42Å; A179-L307 HydrophobicContact CB-CD1 3.87Å; I183-L307 HydrophobicContact CD1-CD1 3.64Å; Y303-L307 HydrophobicContact CE1-CD2 3.98Å; Y303-L307 PolarHBondContact O-N 3.36Å; I304-L307 VanDerWaalsContact O-CB 3.28Å; I304-L307 WeakPolarHBondContact O-CB 3.39Å; I304-L307 WeakPolarHBondContact O-CG 3.32Å; I304-L307 PolarHBondContact O-N 3.15Å; I304-L307 VanDerWaalsContact O-N 3.14Å; S305-L307 PolarHBondContact O-N 2.94Å; L307-A309 PolarHBondContact O-N 3.42Å; L307-R310 WeakPolarHBondContact O-CB 3.39Å; L307-R310 WeakPolarHBondContact O-CG 3.26Å; L307-R310 PolarHBondContact O-N 2.91Å
308	Q	78.9	Confident	84.3	Confident	57 Å²	57	47.4 Å²	47.4	27%	0.266	27%	0.274	S	S	.	.	H	α-helix	trans	-59.5	-33.7	175	-171.7	-179.5	33.5	0	0	112.2	W280 S306 R310 F311 A312	W280-Q308 HydrophobicContact CB-CG 3.95Å; W280-Q308 HydrophobicContact CD2-CG 4.14Å; W280-Q308 HydrophobicContact CE3-CG 3.63Å; W280-Q308 HydrophobicContact CG-CG 4.31Å; W280-Q308 HydrophobicContact CZ3-CG 4.48Å; S306-Q308 PolarHBondContact O-N 2.81Å; Q308-R310 PolarHBondContact O-N 3.39Å; Q308-F311 PolarHBondContact O-N 3.33Å; Q308-F311 VanDerWaalsContact O-N 3.15Å; Q308-A312 PolarHBondContact O-N 2.96Å
309	A	79.1	Confident	83.9	Confident	54 Å²	54	45.5 Å²	45.5	45%	0.446	27%	0.269	S	S	.	.	H	α-helix	trans	-64	-24.6	177.4	0	0	0	0	0	112.5	S306 L307 K313	S306-A309 VanDerWaalsContact O-CB 3.31Å; S306-A309 WeakPolarHBondContact O-CB 3.47Å; S306-A309 PolarHBondContact O-N 3.15Å; S306-A309 VanDerWaalsContact O-N 3.1Å; L307-A309 PolarHBondContact O-N 3.42Å; A309-K313 WeakPolarHBondContact O-CB 3.46Å; A309-K313 PolarHBondContact O-N 3.26Å
310	R	78.1	Confident	83.7	Confident	13 Å²	13	50.5 Å²	50.5	5%	0.049	29%	0.293	C	S	.	.	H	α-helix	trans	-60.8	-46.6	174	-58.3	-173.9	171.2	171.4	1.4	110.5	V178 D180 Y303 L307 Q308 K313 M314 F373 N374	V178-R310 HydrophobicContact CG1-CB 4.2Å; D180-R310 IonicContact OD1-CZ 3Å; D180-R310 IonicContact OD1-NH1 2.59Å; D180-R310 PolarHBondContact OD1-NH1 3.46Å; D180-R310 IonicContact OD1-NH2 3.85Å; Y303-R310 PolarHBondContact OH-NH2 3.11Å; Y303-R310 VanDerWaalsContact OH-NH2 3.1Å; L307-R310 WeakPolarHBondContact O-CB 3.39Å; L307-R310 WeakPolarHBondContact O-CG 3.26Å; L307-R310 PolarHBondContact O-N 2.91Å; Q308-R310 PolarHBondContact O-N 3.39Å; R310-K313 PolarHBondContact O-N 3.11Å; R310-M314 WeakPolarHBondContact O-CB 3.47Å; R310-M314 VanDerWaalsContact O-CG 3.24Å; R310-M314 WeakPolarHBondContact O-CG 3.36Å; R310-M314 PolarHBondContact O-N 3.08Å; R310-F373 HydrophobicContact CB-CD2 4.25Å; R310-F373 HydrophobicContact CG-CB 4.17Å; R310-F373 HydrophobicContact CG-CD2 4.34Å; R310-N374 PolarHBondContact NE-OD1 3.02Å; R310-N374 VanDerWaalsContact NH2-CG 3.31Å; R310-N374 PolarHBondContact NH2-ND2 3.22Å; R310-N374 PolarHBondContact NH2-OD1 3.05Å
311	F	75.1	Confident	83.7	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.009	30%	0.301	C	S	.	.	H	α-helix	trans	-61.3	-49.6	178.8	-83.9	-80.4	0	0	0	112.6	L175 Y177 V178 F274 W280 Q308 K313 M314 A315	L175-F311 HydrophobicContact CD2-CD1 4.37Å; L175-F311 HydrophobicContact CD2-CE1 3.6Å; L175-F311 HydrophobicContact CD2-CZ 4.45Å; L175-F311 HydrophobicContact CG-CE1 4.24Å; Y177-F311 HydrophobicContact CD2-CD2 4.49Å; Y177-F311 AromaticContact CD2-CE2 3.58Å; Y177-F311 HydrophobicContact CD2-CE2 3.58Å; Y177-F311 HydrophobicContact CD2-CZ 4.18Å; Y177-F311 HydrophobicContact CE2-CD2 4.34Å; Y177-F311 AromaticContact CE2-CE2 3.83Å; Y177-F311 HydrophobicContact CE2-CE2 3.83Å; Y177-F311 HydrophobicContact CG-CE2 4.09Å; V178-F311 HydrophobicContact CB-CD2 4.13Å; V178-F311 HydrophobicContact CB-CE1 4.43Å; V178-F311 HydrophobicContact CB-CE2 3.55Å; V178-F311 HydrophobicContact CB-CZ 3.73Å; V178-F311 HydrophobicContact CG2-CD1 4.37Å; V178-F311 HydrophobicContact CG2-CD2 4.41Å; V178-F311 HydrophobicContact CG2-CE1 3.75Å; V178-F311 HydrophobicContact CG2-CE2 3.82Å; V178-F311 HydrophobicContact CG2-CZ 3.44Å; V178-F311 VanDerWaalsContact CG2-CZ 3.44Å; F274-F311 HydrophobicContact CB-CD1 4.42Å; F274-F311 HydrophobicContact CD1-CD1 4.13Å; W280-F311 HydrophobicContact CD2-CB 4.32Å; W280-F311 HydrophobicContact CH2-CB 4.24Å; W280-F311 HydrophobicContact CZ2-CB 3.78Å; W280-F311 HydrophobicContact CZ2-CG 4.43Å; W280-F311 AromaticContact NE1-CD1 3.92Å; W280-F311 AromaticContact NE1-CG 3.89Å; Q308-F311 PolarHBondContact O-N 3.33Å; Q308-F311 VanDerWaalsContact O-N 3.15Å; F311-K313 VanDerWaalsContact C-N 3.31Å; F311-K313 PolarHBondContact O-N 3.33Å; F311-M314 PolarHBondContact O-N 2.91Å; F311-A315 WeakPolarHBondContact O-CB 3.5Å; F311-A315 PolarHBondContact O-N 3.16Å
312	A	77.8	Confident	83.9	Confident	44 Å²	44	47.9 Å²	47.9	36%	0.364	28%	0.28	S	S	.	.	H	α-helix	trans	-58.6	-45.7	179.6	0	0	0	0	0	111.2	Q308 A315 V316	Q308-A312 PolarHBondContact O-N 2.96Å; A312-A315 PolarHBondContact O-N 2.96Å; A312-V316 VanDerWaalsContact O-CG2 3.32Å; A312-V316 WeakPolarHBondContact O-CG2 3.29Å; A312-V316 PolarHBondContact O-N 3.33Å; A312-V316 VanDerWaalsContact O-N 3.13Å
313	K	80.4	Confident	84.1	Confident	100 Å²	100	52.3 Å²	52.3	44%	0.435	28%	0.282	S	S	.	.	H	α-helix	trans	-65.8	-41	179.1	-172.1	164	174.2	-179.7	0	112.3	A309 R310 F311 V316 M317 F373	A309-K313 WeakPolarHBondContact O-CB 3.46Å; A309-K313 PolarHBondContact O-N 3.26Å; R310-K313 PolarHBondContact O-N 3.11Å; F311-K313 VanDerWaalsContact C-N 3.31Å; F311-K313 PolarHBondContact O-N 3.33Å; K313-V316 PolarHBondContact O-N 3.29Å; K313-M317 HydrophobicContact CG-SD 4.03Å; K313-M317 WeakPolarHBondContact O-CG 3.17Å; K313-M317 PolarHBondContact O-N 3.41Å; K313-F373 HydrophobicContact CD-CB 4.15Å; K313-F373 HydrophobicContact CD-CD1 3.42Å; K313-F373 VanDerWaalsContact CD-CD1 3.42Å; K313-F373 HydrophobicContact CD-CE1 3.99Å; K313-F373 HydrophobicContact CD-CG 3.98Å; K313-F373 VanDerWaalsContact CE-CD1 3.42Å; K313-F373 HydrophobicContact CG-CD1 4.09Å; K313-F373 HydrophobicContact CG-CE1 4.28Å
314	M	78.9	Confident	84.2	Confident	24 Å²	24	53.6 Å²	53.6	12%	0.118	29%	0.293	C	S	.	.	H	α-helix	trans	-65.1	-41	176.6	-74.1	-169.3	67.2	0	0	112.9	F233 F274 R310 F311 V316 M317 S318 F371 F373	F233-M314 HydrophobicContact CE1-CE 4.19Å; F233-M314 HydrophobicContact CE2-CE 3.8Å; F233-M314 HydrophobicContact CE2-SD 3.62Å; F233-M314 HydrophobicContact CZ-CE 3.25Å; F233-M314 HydrophobicContact CZ-SD 3.41Å; F233-M314 WeakPolarHBondContact CZ-SD 3.18Å; F274-M314 HydrophobicContact CE1-CB 4.08Å; F274-M314 HydrophobicContact CE1-CE 4.41Å; R310-M314 WeakPolarHBondContact O-CB 3.47Å; R310-M314 VanDerWaalsContact O-CG 3.24Å; R310-M314 WeakPolarHBondContact O-CG 3.36Å; R310-M314 PolarHBondContact O-N 3.08Å; F311-M314 PolarHBondContact O-N 2.91Å; M314-V316 VanDerWaalsContact C-N 3.27Å; M314-V316 PolarHBondContact O-N 3.13Å; M314-M317 PolarHBondContact O-N 2.93Å; M314-S318 WeakPolarHBondContact O-CB 3.46Å; M314-S318 PolarHBondContact O-N 3.06Å; M314-S318 VanDerWaalsContact O-N 3.15Å; M314-S318 PolarHBondContact O-OG 3.16Å; M314-F371 HydrophobicContact CE-CE1 4.34Å; M314-F373 HydrophobicContact CG-CD2 4.46Å; M314-F373 HydrophobicContact CG-CE2 3.76Å; M314-F373 HydrophobicContact CG-CZ 4.29Å; M314-F373 HydrophobicContact SD-CE2 4.22Å
315	A	79.6	Confident	84.5	Confident	23 Å²	23	53.6 Å²	53.6	19%	0.19	29%	0.293	C	S	.	.	H	α-helix	trans	-61.6	-36.9	175.5	0	0	0	0	0	111.8	F274 F311 A312	F274-A315 HydrophobicContact CD2-CB 4.18Å; F274-A315 HydrophobicContact CG-CB 4.4Å; F311-A315 WeakPolarHBondContact O-CB 3.5Å; F311-A315 PolarHBondContact O-N 3.16Å; A312-A315 PolarHBondContact O-N 2.96Å
316	V	82.3	Confident	84.9	Confident	122 Å²	122	52 Å²	52	74%	0.739	28%	0.28	S	S	*	.	H	α-helix	trans	-71.2	-38	176.4	171.9	0	0	0	0	112.6	A312 K313 M314 S318	A312-V316 VanDerWaalsContact O-CG2 3.32Å; A312-V316 WeakPolarHBondContact O-CG2 3.29Å; A312-V316 PolarHBondContact O-N 3.33Å; A312-V316 VanDerWaalsContact O-N 3.13Å; K313-V316 PolarHBondContact O-N 3.29Å; M314-V316 VanDerWaalsContact C-N 3.27Å; M314-V316 PolarHBondContact O-N 3.13Å; V316-S318 VanDerWaalsContact C-N 3.25Å; V316-S318 PolarHBondContact O-N 3.26Å
317	M	81.3	Confident	85.3	Confident	131 Å²	131	53.9 Å²	53.9	65%	0.645	29%	0.289	S	S	*	.	H	α-helix	trans	-78.5	-8.6	-179.8	-69.4	179.5	66.5	0	0	113.8	K313 M314 F373	K313-M317 HydrophobicContact CG-SD 4.03Å; K313-M317 WeakPolarHBondContact O-CG 3.17Å; K313-M317 PolarHBondContact O-N 3.41Å; M314-M317 PolarHBondContact O-N 2.93Å; M317-F373 HydrophobicContact SD-CE1 4.03Å; M317-F373 HydrophobicContact SD-CZ 4.35Å
318	S	84.8	Confident	85.8	Confident	11 Å²	11	55.4 Å²	55.4	8%	0.077	30%	0.297	C	S	.	.	S	Bend	trans	-82.3	142	-175.8	-67.6	0	0	0	0	112.1	G268 F269 M314 V316	G268-S318 WeakPolarHBondContact O-CA 3.11Å; F269-S318 VanDerWaalsContact C-CB 3.49Å; M314-S318 WeakPolarHBondContact O-CB 3.46Å; M314-S318 PolarHBondContact O-N 3.06Å; M314-S318 VanDerWaalsContact O-N 3.15Å; M314-S318 PolarHBondContact O-OG 3.16Å; V316-S318 VanDerWaalsContact C-N 3.25Å; V316-S318 PolarHBondContact O-N 3.26Å
319	S	85.8	Confident	86.7	Confident	53 Å²	53	52.7 Å²	52.7	37%	0.371	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-68	133.3	177.5	-179.2	0	0	0	0	111.4	G268 F269 K270 D321	G268-S319 PolarHBondContact O-N 3.48Å; F269-S319 CarbonylContact C-O 3.51Å; F269-S319 WeakPolarHBondContact CA-O 3.43Å; K270-S319 PolarHBondContact N-O 3.13Å; S319-D321 VanDerWaalsContact C-N 3.33Å; S319-D321 PolarHBondContact OG-N 3.19Å
320	E	88.6	Confident	87.5	Confident	136 Å²	136	50.6 Å²	50.6	64%	0.636	27%	0.266	S	S	*	.	S	Bend	trans	-78.8	-21.1	171.8	-51.4	-162	143.4	0	0	112.3	K270 L322	K270-E320 HydrophobicContact CB-CG 4.47Å; K270-E320 HydrophobicContact CD-CG 3.82Å; K270-E320 WeakPolarHBondContact CD-OE1 3.25Å; K270-E320 IonicContact NZ-OE1 3.8Å; K270-E320 PolarHBondContact NZ-OE1 3.26Å; E320-L322 PolarHBondContact O-N 2.86Å
321	D	90.8	Very high	88.3	Confident	54 Å²	54	51.1 Å²	51.1	29%	0.289	27%	0.269	S	S	.	.			trans	-78.9	103.1	-179.4	-177.8	13.9	0	0	0	111.2	F269 S319 R323 P324	F269-D321 WeakPolarHBondContact CD1-O 3.49Å; F269-D321 VanDerWaalsContact CE1-O 3.29Å; F269-D321 WeakPolarHBondContact CE1-O 3.39Å; S319-D321 VanDerWaalsContact C-N 3.33Å; S319-D321 PolarHBondContact OG-N 3.19Å; D321-R323 VanDerWaalsContact C-N 3.32Å; D321-R323 WeakPolarHBondContact OD1-CB 3.46Å; D321-R323 WeakPolarHBondContact OD1-CG 3.36Å; D321-R323 IonicContact OD1-CZ 2.71Å; D321-R323 PolarHBondContact OD1-N 2.83Å; D321-R323 IonicContact OD1-NE 2.68Å; D321-R323 PolarHBondContact OD1-NE 2.55Å; D321-R323 IonicContact OD1-NH2 2.69Å; D321-R323 IonicContact OD2-CZ 2.69Å; D321-R323 VanDerWaalsContact OD2-CZ 3.25Å; D321-R323 IonicContact OD2-NE 2.86Å; D321-R323 PolarHBondContact OD2-NE 3.16Å; D321-R323 IonicContact OD2-NH2 3.14Å; D321-R323 PolarHBondContact OD2-NH2 3.1Å; D321-P324 WeakPolarHBondContact O-CD 3.3Å
322	L	93.6	Very high	89.4	Confident	34 Å²	34	51 Å²	51	18%	0.178	27%	0.269	C	S	.	.			trans	-81.8	-8.1	178.4	-48.8	-175.2	0	0	0	113.2	F98 A101 F269 T271 E320 P324 V325 L326	F98-L322 HydrophobicContact CD1-CB 4.49Å; F98-L322 HydrophobicContact CD1-CD1 4.39Å; F98-L322 HydrophobicContact CD1-CD2 4.24Å; F98-L322 HydrophobicContact CE1-CD2 3.78Å; A101-L322 HydrophobicContact CB-CD1 4.45Å; F269-L322 HydrophobicContact CB-CD2 4.25Å; F269-L322 HydrophobicContact CD1-CD2 4.32Å; T271-L322 HydrophobicContact CG2-CD2 4.36Å; E320-L322 PolarHBondContact O-N 2.86Å; L322-P324 VanDerWaalsContact C-CD 3.44Å; L322-V325 PolarHBondContact O-N 3.14Å; L322-L326 HydrophobicContact CB-CD1 4.4Å; L322-L326 HydrophobicContact CB-CG 4.49Å; L322-L326 WeakPolarHBondContact O-CG 3.49Å; L322-L326 PolarHBondContact O-N 3.32Å; L322-L326 VanDerWaalsContact O-N 3.09Å
323	R	92.8	Very high	90.3	Very high	160 Å²	160	49 Å²	49	60%	0.604	25%	0.252	S	S	*	.	H	α-helix	trans	-52	-44.8	-174.9	-67.4	174.2	-64.1	174.9	2.4	113.4	D321 V325 L326 D327	D321-R323 VanDerWaalsContact C-N 3.32Å; D321-R323 WeakPolarHBondContact OD1-CB 3.46Å; D321-R323 WeakPolarHBondContact OD1-CG 3.36Å; D321-R323 IonicContact OD1-CZ 2.71Å; D321-R323 PolarHBondContact OD1-N 2.83Å; D321-R323 IonicContact OD1-NE 2.68Å; D321-R323 PolarHBondContact OD1-NE 2.55Å; D321-R323 IonicContact OD1-NH2 2.69Å; D321-R323 IonicContact OD2-CZ 2.69Å; D321-R323 VanDerWaalsContact OD2-CZ 3.25Å; D321-R323 IonicContact OD2-NE 2.86Å; D321-R323 PolarHBondContact OD2-NE 3.16Å; D321-R323 IonicContact OD2-NH2 3.14Å; D321-R323 PolarHBondContact OD2-NH2 3.1Å; R323-V325 VanDerWaalsContact C-N 3.27Å; R323-V325 PolarHBondContact O-N 3.37Å; R323-L326 PolarHBondContact O-N 2.68Å; R323-L326 VanDerWaalsContact O-N 3.11Å; R323-D327 WeakPolarHBondContact O-CB 3.29Å; R323-D327 PolarHBondContact O-N 2.97Å
324	P	92.3	Very high	91.1	Very high	42 Å²	42	44.9 Å²	44.9	27%	0.273	23%	0.234	S	C	.	.	H	α-helix	trans	-59.3	-38	-179.9	-24.7	35.5	0	0	0	113.2	D321 L322 D328 P344	D321-P324 WeakPolarHBondContact O-CD 3.3Å; L322-P324 VanDerWaalsContact C-CD 3.44Å; P324-D328 PolarHBondContact O-N 3.19Å; P324-P344 HydrophobicContact CB-CB 4.19Å
325	V	95.1	Very high	91.8	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-69.8	-43.4	178	-176.8	0	0	0	0	110.4	F98 I264 P266 F269 L322 R323 D328 M329 P344	F98-V325 HydrophobicContact CD1-CB 4.03Å; F98-V325 HydrophobicContact CD1-CG1 3.73Å; F98-V325 HydrophobicContact CD1-CG2 4.33Å; F98-V325 HydrophobicContact CD2-CG1 4.3Å; F98-V325 HydrophobicContact CE1-CB 3.84Å; F98-V325 HydrophobicContact CE1-CG1 3.8Å; F98-V325 HydrophobicContact CE1-CG2 3.63Å; F98-V325 HydrophobicContact CE2-CG1 4.37Å; F98-V325 HydrophobicContact CG-CG1 3.97Å; F98-V325 HydrophobicContact CZ-CB 4.41Å; F98-V325 HydrophobicContact CZ-CG1 4.12Å; F98-V325 HydrophobicContact CZ-CG2 3.9Å; I264-V325 HydrophobicContact CG2-CG1 4.28Å; P266-V325 HydrophobicContact CB-CG2 4.19Å; P266-V325 HydrophobicContact CG-CG1 4.16Å; P266-V325 HydrophobicContact CG-CG2 4.42Å; F269-V325 HydrophobicContact CD1-CG2 4.06Å; F269-V325 HydrophobicContact CD2-CG2 3.8Å; F269-V325 HydrophobicContact CE1-CG2 3.75Å; F269-V325 HydrophobicContact CE2-CG2 3.48Å; F269-V325 VanDerWaalsContact CE2-CG2 3.48Å; F269-V325 HydrophobicContact CG-CG2 4.09Å; F269-V325 HydrophobicContact CZ-CG2 3.44Å; F269-V325 VanDerWaalsContact CZ-CG2 3.44Å; L322-V325 PolarHBondContact O-N 3.14Å; R323-V325 VanDerWaalsContact C-N 3.27Å; R323-V325 PolarHBondContact O-N 3.37Å; V325-D328 PolarHBondContact O-N 2.65Å; V325-M329 HydrophobicContact CG1-CE 3.72Å; V325-M329 HydrophobicContact CG1-CG 4.48Å; V325-M329 HydrophobicContact CG1-SD 4.11Å; V325-M329 WeakPolarHBondContact O-CB 3.34Å; V325-M329 VanDerWaalsContact O-CG 3.3Å; V325-M329 WeakPolarHBondContact O-CG 3.23Å; V325-M329 PolarHBondContact O-N 3.32Å; V325-P344 HydrophobicContact CB-CB 4.36Å; V325-P344 HydrophobicContact CB-CG 4.27Å; V325-P344 HydrophobicContact CG1-CG 4.38Å; V325-P344 HydrophobicContact CG2-CB 3.83Å; V325-P344 HydrophobicContact CG2-CG 3.81Å
326	L	96.3	Very high	92.4	Very high	15 Å²	15	46.6 Å²	46.6	8%	0.079	24%	0.244	C	C	.	.	H	α-helix	trans	-66	-38.7	179.1	-62.3	177	0	0	0	112	A101 L102 R105 L322 R323 M329 C330	A101-L326 HydrophobicContact CB-CD1 3.9Å; A101-L326 HydrophobicContact CB-CD2 3.95Å; L102-L326 HydrophobicContact CB-CD2 3.93Å; L102-L326 HydrophobicContact CD1-CD2 4.45Å; R105-L326 VanDerWaalsContact NH1-CB 3.28Å; L322-L326 HydrophobicContact CB-CD1 4.4Å; L322-L326 HydrophobicContact CB-CG 4.49Å; L322-L326 WeakPolarHBondContact O-CG 3.49Å; L322-L326 PolarHBondContact O-N 3.32Å; L322-L326 VanDerWaalsContact O-N 3.09Å; R323-L326 PolarHBondContact O-N 2.68Å; R323-L326 VanDerWaalsContact O-N 3.11Å; L326-M329 PolarHBondContact O-N 3.41Å; L326-C330 VanDerWaalsContact O-CB 3.31Å; L326-C330 WeakPolarHBondContact O-CB 3.36Å; L326-C330 PolarHBondContact O-N 3.22Å; L326-C330 PolarHBondContact O-SG 3.04Å
327	D	94.1	Very high	92.7	Very high	57 Å²	57	43 Å²	43	31%	0.305	23%	0.227	S	C	.	.	H	α-helix	trans	-63.7	-43.7	176.6	-68.4	-24	0	0	0	111	R105 R323 C330 H331	R105-D327 IonicContact CZ-OD1 3.76Å; R105-D327 IonicContact NH1-OD1 3.94Å; R105-D327 PolarHBondContact NH1-OD1 2.73Å; R105-D327 IonicContact NH2-OD1 3.89Å; R105-D327 PolarHBondContact NH2-OD1 2.99Å; R323-D327 WeakPolarHBondContact O-CB 3.29Å; R323-D327 PolarHBondContact O-N 2.97Å; D327-C330 PolarHBondContact O-N 3.01Å; D327-H331 WeakPolarHBondContact O-CB 3.41Å; D327-H331 PolarHBondContact O-N 3.27Å
328	D	95.3	Very high	93.3	Very high	31 Å²	31	37.5 Å²	37.5	17%	0.166	20%	0.201	C	C	.	.	H	α-helix	trans	-66.4	-40.3	176.1	-82.4	-12.8	0	0	0	112.2	I264 P324 V325 H331 A332 Y342 P344	I264-D328 HydrophobicContact CD1-CB 4.4Å; P324-D328 PolarHBondContact O-N 3.19Å; V325-D328 PolarHBondContact O-N 2.65Å; D328-H331 PolarHBondContact O-N 2.83Å; D328-A332 WeakPolarHBondContact O-CB 3.39Å; D328-A332 PolarHBondContact O-N 3.1Å; D328-Y342 HydrophobicContact CB-CD1 3.78Å; D328-Y342 HydrophobicContact CB-CG 4.06Å; D328-Y342 WeakPolarHBondContact OD1-CD1 3.36Å; D328-P344 WeakPolarHBondContact OD2-CB 3.41Å; D328-P344 WeakPolarHBondContact OD2-CD 3.27Å
329	M	97.8	Very high	93.7	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-63.4	-45.1	173.6	-74.5	177.2	173.8	0	0	111.8	F98 L102 V221 I264 V325 L326 A332 L333	F98-M329 HydrophobicContact CB-CE 3.9Å; F98-M329 HydrophobicContact CB-SD 4.37Å; F98-M329 HydrophobicContact CG-CE 4.38Å; L102-M329 HydrophobicContact CB-SD 4.42Å; L102-M329 HydrophobicContact CD1-CB 3.86Å; L102-M329 HydrophobicContact CD1-SD 4.5Å; L102-M329 HydrophobicContact CD2-CB 4.11Å; L102-M329 HydrophobicContact CD2-CG 4.46Å; L102-M329 HydrophobicContact CD2-SD 3.84Å; L102-M329 HydrophobicContact CG-SD 4.49Å; V221-M329 HydrophobicContact CB-CE 4.41Å; V221-M329 HydrophobicContact CG1-CE 4.07Å; V221-M329 HydrophobicContact CG2-CE 3.41Å; V221-M329 VanDerWaalsContact CG2-CE 3.41Å; I264-M329 HydrophobicContact CD1-CG 4.45Å; I264-M329 HydrophobicContact CG1-CG 4Å; V325-M329 HydrophobicContact CG1-CE 3.72Å; V325-M329 HydrophobicContact CG1-CG 4.48Å; V325-M329 HydrophobicContact CG1-SD 4.11Å; V325-M329 WeakPolarHBondContact O-CB 3.34Å; V325-M329 VanDerWaalsContact O-CG 3.3Å; V325-M329 WeakPolarHBondContact O-CG 3.23Å; V325-M329 PolarHBondContact O-N 3.32Å; L326-M329 PolarHBondContact O-N 3.41Å; M329-A332 PolarHBondContact O-N 2.76Å; M329-L333 WeakPolarHBondContact O-CG 3.37Å; M329-L333 PolarHBondContact O-N 3.36Å
330	C	96.6	Very high	94.1	Very high	9 Å²	9	42.1 Å²	42.1	6%	0.061	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-44.8	174.3	-75.7	0	0	0	0	111	L326 D327 A332 L333 M334	L326-C330 VanDerWaalsContact O-CB 3.31Å; L326-C330 WeakPolarHBondContact O-CB 3.36Å; L326-C330 PolarHBondContact O-N 3.22Å; L326-C330 PolarHBondContact O-SG 3.04Å; D327-C330 PolarHBondContact O-N 3.01Å; C330-A332 VanDerWaalsContact C-N 3.33Å; C330-A332 PolarHBondContact O-N 3.27Å; C330-L333 PolarHBondContact O-N 2.97Å; C330-M334 HydrophobicContact CB-CE 4.46Å; C330-M334 HydrophobicContact CB-SD 4.4Å; C330-M334 VanDerWaalsContact O-CB 3.24Å; C330-M334 WeakPolarHBondContact O-CB 3.28Å; C330-M334 WeakPolarHBondContact O-CG 3.5Å; C330-M334 PolarHBondContact O-N 2.71Å
331	H	95.6	Very high	94.3	Very high	25 Å²	25	38.6 Å²	38.6	12%	0.116	20%	0.204	C	C	.	.	H	α-helix	trans	-61.5	-41.9	176.2	-175	-72.1	0	0	0	111.5	D327 D328 L333 M334 S335 Y342	D327-H331 WeakPolarHBondContact O-CB 3.41Å; D327-H331 PolarHBondContact O-N 3.27Å; D328-H331 PolarHBondContact O-N 2.83Å; H331-L333 VanDerWaalsContact C-N 3.3Å; H331-L333 PolarHBondContact O-N 3.46Å; H331-M334 PolarHBondContact O-N 2.59Å; H331-S335 VanDerWaalsContact CE1-CB 3.49Å; H331-S335 WeakPolarHBondContact CE1-CB 3.44Å; H331-S335 PolarHBondContact CE1-OG 3.35Å; H331-S335 WeakPolarHBondContact O-CB 3.38Å; H331-S335 PolarHBondContact O-N 2.64Å; H331-Y342 HydrophobicContact CB-CE1 4.11Å; H331-Y342 AromaticContact CG-CE1 3.96Å; H331-Y342 AromaticContact ND1-CE1 3.43Å; H331-Y342 WeakPolarHBondContact ND1-CE1 3.43Å; H331-Y342 AromaticContact ND1-CZ 3.5Å; H331-Y342 PolarHBondContact ND1-OH 3.29Å
332	A	97.4	Very high	94.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.3	-37.8	175.8	0	0	0	0	0	112.8	R217 V219 I264 D328 M329 C330 Y342	R217-A332 WeakPolarHBondContact CD-O 3.47Å; V219-A332 HydrophobicContact CG1-CB 4.24Å; V219-A332 HydrophobicContact CG2-CB 3.88Å; I264-A332 HydrophobicContact CD1-CB 4.14Å; D328-A332 WeakPolarHBondContact O-CB 3.39Å; D328-A332 PolarHBondContact O-N 3.1Å; M329-A332 PolarHBondContact O-N 2.76Å; C330-A332 VanDerWaalsContact C-N 3.33Å; C330-A332 PolarHBondContact O-N 3.27Å; A332-Y342 WeakPolarHBondContact CA-OH 3.5Å; A332-Y342 HydrophobicContact CB-CD2 4.45Å; A332-Y342 HydrophobicContact CB-CE2 3.7Å; A332-Y342 PolarHBondContact N-OH 2.97Å
333	L	97.6	Very high	94.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-79	-36.8	179.5	-72.5	171.8	0	0	0	113.6	V89 L102 I106 W166 V169 R217 V219 M329 C330 H331	V89-L333 HydrophobicContact CG1-CD1 4.4Å; V89-L333 HydrophobicContact CG1-CD2 4.28Å; L102-L333 HydrophobicContact CD2-CD1 4.3Å; I106-L333 HydrophobicContact CD1-CD1 4.21Å; W166-L333 WeakPolarHBondContact CZ2-O 3.45Å; W166-L333 PolarHBondContact NE1-O 3.24Å; V169-L333 HydrophobicContact CG2-CD1 3.99Å; V169-L333 HydrophobicContact CG2-CD2 4Å; V169-L333 HydrophobicContact CG2-CG 4.36Å; R217-L333 HydrophobicContact CB-CD2 4.1Å; V219-L333 HydrophobicContact CG2-CD2 3.92Å; V219-L333 HydrophobicContact CG2-CG 4.26Å; M329-L333 WeakPolarHBondContact O-CG 3.37Å; M329-L333 PolarHBondContact O-N 3.36Å; C330-L333 PolarHBondContact O-N 2.97Å; H331-L333 VanDerWaalsContact C-N 3.3Å; H331-L333 PolarHBondContact O-N 3.46Å
334	M	95.8	Very high	94.1	Very high	15 Å²	15	28.1 Å²	28.1	7%	0.074	16%	0.161	C	C	.	.	H	α-helix	trans	-110.8	-18.5	-163.3	-52.8	-176.8	-176.4	0	0	113.2	M81 L82 M84 I106 L109 C330 H331	M81-M334 CarbonylContact C-O 3.3Å; M81-M334 HydrophobicContact SD-CB 3.96Å; L82-M334 VanDerWaalsContact CB-O 3.32Å; L82-M334 WeakPolarHBondContact CB-O 3.42Å; L82-M334 WeakPolarHBondContact CG-O 3.32Å; L82-M334 PolarHBondContact N-O 2.84Å; M84-M334 HydrophobicContact CE-CE 4.48Å; M84-M334 HydrophobicContact CE-CG 4.05Å; M84-M334 HydrophobicContact CG-CB 4.18Å; M84-M334 HydrophobicContact CG-CE 4.15Å; M84-M334 HydrophobicContact CG-CG 3.59Å; M84-M334 HydrophobicContact CG-SD 3.84Å; M84-M334 HydrophobicContact SD-CB 4.15Å; M84-M334 HydrophobicContact SD-CG 3.73Å; I106-M334 HydrophobicContact CB-CE 4.05Å; I106-M334 HydrophobicContact CG2-CE 3.6Å; L109-M334 HydrophobicContact CD1-CE 3.83Å; L109-M334 HydrophobicContact CD1-SD 4.26Å; C330-M334 HydrophobicContact CB-CE 4.46Å; C330-M334 HydrophobicContact CB-SD 4.4Å; C330-M334 VanDerWaalsContact O-CB 3.24Å; C330-M334 WeakPolarHBondContact O-CB 3.28Å; C330-M334 WeakPolarHBondContact O-CG 3.5Å; C330-M334 PolarHBondContact O-N 2.71Å; H331-M334 PolarHBondContact O-N 2.59Å
335	S	94.4	Very high	93.5	Very high	4 Å²	4	27.3 Å²	27.3	3%	0.028	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-66.8	142.7	-179.8	-174.5	0	0	0	0	111.9	R217 H331 A337	R217-S335 PolarHBondContact NH2-O 3.4Å; H331-S335 VanDerWaalsContact CE1-CB 3.49Å; H331-S335 WeakPolarHBondContact CE1-CB 3.44Å; H331-S335 PolarHBondContact CE1-OG 3.35Å; H331-S335 WeakPolarHBondContact O-CB 3.38Å; H331-S335 PolarHBondContact O-N 2.64Å; S335-A337 PolarHBondContact O-N 3.18Å; S335-A337 PolarHBondContact OG-N 3.31Å; S335-A337 VanDerWaalsContact OG-N 3.14Å; S335-A337 PolarHBondContact OG-O 2.82Å
336	V	91.5	Very high	92.3	Very high	78 Å²	78	36 Å²	36	47%	0.473	20%	0.201	S	C	.	.	S	Bend	trans	-60.5	-36.7	166.5	173.7	0	0	0	0	110.5	D80 L82	D80-V336 HydrophobicContact CB-CB 4.29Å; D80-V336 HydrophobicContact CB-CG2 3.81Å; D80-V336 WeakPolarHBondContact O-CG2 3.32Å; D80-V336 PolarHBondContact O-N 3.25Å; L82-V336 HydrophobicContact CD2-CG2 3.67Å; L82-V336 HydrophobicContact CG-CG2 3.93Å
337	A	89.6	Confident	91.1	Very high	48 Å²	48	38.2 Å²	38.2	40%	0.397	22%	0.218	S	C	.	.	S	Bend	trans	-130.4	73.3	-178	0	0	0	0	0	111	S335	S335-A337 PolarHBondContact O-N 3.18Å; S335-A337 PolarHBondContact OG-N 3.31Å; S335-A337 VanDerWaalsContact OG-N 3.14Å; S335-A337 PolarHBondContact OG-O 2.82Å
338	P	93.9	Very high	90.2	Very high	14 Å²	14	35.8 Å²	35.8	9%	0.091	21%	0.206	C	C	.	.			trans	-63.3	147.9	-178.2	28.9	-35	0	0	0	111.2	N260 Y342	N260-P338 HydrophobicContact CB-CG 3.67Å; P338-Y342 WeakPolarHBondContact CA-OH 3.43Å
339	R	92.7	Very high	89.5	Confident	97 Å²	97	37.4 Å²	37.4	37%	0.366	21%	0.21	S	C	.	.			trans	-73.8	148.3	174.1	-58.4	175	-179.2	178.3	-4.9	109.7	S262 V341 Y342	S262-R339 PolarHBondContact OG-O 3.42Å; R339-V341 VanDerWaalsContact C-N 3.32Å; R339-V341 PolarHBondContact O-N 3.18Å; R339-Y342 HydrophobicContact CB-CD1 4.49Å; R339-Y342 HydrophobicContact CB-CD2 4.43Å; R339-Y342 HydrophobicContact CB-CE1 3.94Å; R339-Y342 HydrophobicContact CB-CE2 3.9Å; R339-Y342 HydrophobicContact CG-CE1 4.14Å; R339-Y342 PolarHBondContact N-OH 3.25Å; R339-Y342 WeakPolarHBondContact O-CE2 3.43Å
340	P	93.6	Very high	88.7	Confident	65 Å²	65	40.6 Å²	40.6	42%	0.422	23%	0.227	S	C	.	.	S	Bend	trans	-70.7	-29.3	177	28.5	-35.1	0	0	0	112.8	S262 T263	S262-P340 WeakPolarHBondContact CA-O 3.39Å; T263-P340 PolarHBondContact N-O 3.42Å; T263-P340 PolarHBondContact OG1-O 3.19Å
341	V	93.3	Very high	88.2	Confident	61 Å²	61	41.3 Å²	41.3	37%	0.37	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	130.8	-176.2	-175.2	0	0	0	0	109.8	T263 Q265 R339 T343	T263-V341 WeakPolarHBondContact O-CA 3.28Å; Q265-V341 HydrophobicContact CG-CG1 4.38Å; R339-V341 VanDerWaalsContact C-N 3.32Å; R339-V341 PolarHBondContact O-N 3.18Å; V341-T343 HydrophobicContact CG1-CG2 4.37Å
342	Y	92.5	Very high	87.7	Confident	3 Å²	3	40.2 Å²	40.2	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	141.4	174.2	-60.2	-100.4	0	0	0	109.6	T263 I264 Q265 D328 H331 A332 P338 R339 P344	T263-Y342 PolarHBondContact O-N 2.98Å; I264-Y342 HydrophobicContact CD1-CD2 3.49Å; I264-Y342 VanDerWaalsContact CD1-CD2 3.49Å; I264-Y342 HydrophobicContact CD1-CE2 4.2Å; I264-Y342 HydrophobicContact CD1-CG 3.77Å; Q265-Y342 WeakPolarHBondContact CB-O 3.47Å; Q265-Y342 PolarHBondContact N-O 3.18Å; D328-Y342 HydrophobicContact CB-CD1 3.78Å; D328-Y342 HydrophobicContact CB-CG 4.06Å; D328-Y342 WeakPolarHBondContact OD1-CD1 3.36Å; H331-Y342 HydrophobicContact CB-CE1 4.11Å; H331-Y342 AromaticContact CG-CE1 3.96Å; H331-Y342 AromaticContact ND1-CE1 3.43Å; H331-Y342 WeakPolarHBondContact ND1-CE1 3.43Å; H331-Y342 AromaticContact ND1-CZ 3.5Å; H331-Y342 PolarHBondContact ND1-OH 3.29Å; A332-Y342 WeakPolarHBondContact CA-OH 3.5Å; A332-Y342 HydrophobicContact CB-CD2 4.45Å; A332-Y342 HydrophobicContact CB-CE2 3.7Å; A332-Y342 PolarHBondContact N-OH 2.97Å; P338-Y342 WeakPolarHBondContact CA-OH 3.43Å; R339-Y342 HydrophobicContact CB-CD1 4.49Å; R339-Y342 HydrophobicContact CB-CD2 4.43Å; R339-Y342 HydrophobicContact CB-CE1 3.94Å; R339-Y342 HydrophobicContact CB-CE2 3.9Å; R339-Y342 HydrophobicContact CG-CE1 4.14Å; R339-Y342 PolarHBondContact N-OH 3.25Å; R339-Y342 WeakPolarHBondContact O-CE2 3.43Å; Y342-P344 VanDerWaalsContact C-CD 3.48Å
343	T	91.3	Very high	87	Confident	21 Å²	21	42 Å²	42	13%	0.129	24%	0.237	C	C	.	.			trans	-129.8	69.3	-176.8	56.1	0	0	0	0	109.5	R36 Q265 V341	R36-T343 PolarHBondContact NH1-OG1 3.41Å; Q265-T343 HydrophobicContact CB-CG2 4.36Å; V341-T343 HydrophobicContact CG1-CG2 4.37Å
344	P	88.9	Confident	86.4	Confident	4 Å²	4	44.2 Å²	44.2	3%	0.026	25%	0.248	C	C	.	.			trans	-68.1	142.3	-177.3	24.5	-31.2	0	0	0	111.4	I264 P266 A267 F269 P324 V325 D328 Y342	I264-P344 HydrophobicContact CG2-CG 3.79Å; P266-P344 HydrophobicContact CB-CG 4.33Å; P266-P344 HydrophobicContact CG-CG 4.31Å; A267-P344 PolarHBondContact N-O 2.81Å; F269-P344 WeakPolarHBondContact CE2-O 3.28Å; F269-P344 HydrophobicContact CZ-CB 4.41Å; P324-P344 HydrophobicContact CB-CB 4.19Å; V325-P344 HydrophobicContact CB-CB 4.36Å; V325-P344 HydrophobicContact CB-CG 4.27Å; V325-P344 HydrophobicContact CG1-CG 4.38Å; V325-P344 HydrophobicContact CG2-CB 3.83Å; V325-P344 HydrophobicContact CG2-CG 3.81Å; D328-P344 WeakPolarHBondContact OD2-CB 3.41Å; D328-P344 WeakPolarHBondContact OD2-CD 3.27Å; Y342-P344 VanDerWaalsContact C-CD 3.48Å
345	G	79.8	Confident	86.1	Confident	25 Å²	25	46.9 Å²	46.9	26%	0.258	26%	0.26	S	S	.	.	S	Bend	trans	119.3	143.8	-179.3	0	0	0	0	0	112.6	S347 A348	G345-S347 PolarHBondContact O-N 3.02Å; G345-A348 VanDerWaalsContact O-CB 3.31Å; G345-A348 WeakPolarHBondContact O-CB 3.41Å; G345-A348 PolarHBondContact O-N 3.48Å; G345-A348 VanDerWaalsContact O-N 3.14Å
346	Q	71	Confident	85.7	Confident	183 Å²	183	54.7 Å²	54.7	86%	0.855	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	124.8	179.4	-168.6	176.8	13.3	0	0	109.3	A348	Q346-A348 PolarHBondContact O-N 2.96Å
347	S	70.1	Confident	85.4	Confident	61 Å²	61	57.5 Å²	57.5	43%	0.427	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	15.1	179.8	-60.6	0	0	0	0	115.6	G345 W349 L350	G345-S347 PolarHBondContact O-N 3.02Å; S347-W349 PolarHBondContact O-N 3.38Å; S347-L350 WeakPolarHBondContact O-CB 2.92Å; S347-L350 PolarHBondContact O-N 3.26Å
348	A	76.6	Confident	85.1	Confident	6 Å²	6	56.8 Å²	56.8	5%	0.05	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-26.9	179.2	0	0	0	0	0	113	A267 G345 Q346 P352	A267-A348 HydrophobicContact CB-CB 3.71Å; G345-A348 VanDerWaalsContact O-CB 3.31Å; G345-A348 WeakPolarHBondContact O-CB 3.41Å; G345-A348 PolarHBondContact O-N 3.48Å; G345-A348 VanDerWaalsContact O-N 3.14Å; Q346-A348 PolarHBondContact O-N 2.96Å; A348-P352 WeakPolarHBondContact O-CD 3.38Å
349	W	79	Confident	85.1	Confident	65 Å²	65	60.9 Å²	60.9	25%	0.246	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-19.3	178	68.3	-90.4	0	0	0	113.9	W39 S347 C353	W39-W349 HydrophobicContact CB-CH2 4.37Å; W39-W349 HydrophobicContact CB-CZ2 4.19Å; W39-W349 AromaticContact CD1-CZ2 3.73Å; W39-W349 HydrophobicContact CG-CH2 4.36Å; W39-W349 AromaticContact CG-CZ2 3.89Å; W39-W349 HydrophobicContact CG-CZ2 3.89Å; S347-W349 PolarHBondContact O-N 3.38Å; W349-C353 HydrophobicContact CE3-CB 3.96Å; W349-C353 HydrophobicContact CZ3-CB 4.15Å; W349-C353 VanDerWaalsContact O-CB 3.24Å; W349-C353 WeakPolarHBondContact O-CB 3.19Å; W349-C353 PolarHBondContact O-N 2.86Å; W349-C353 VanDerWaalsContact O-N 3.1Å
350	L	81.4	Confident	85.1	Confident	69 Å²	69	61.1 Å²	61.1	36%	0.361	33%	0.332	S	S	.	.	H	α-helix	trans	-65.8	-46.9	-174.5	-74.7	178.7	0	0	0	111.7	S347 C353 L354	S347-L350 WeakPolarHBondContact O-CB 2.92Å; S347-L350 PolarHBondContact O-N 3.26Å; L350-C353 WeakPolarHBondContact O-CA 3.28Å; L350-C353 VanDerWaalsContact O-CB 3.3Å; L350-C353 WeakPolarHBondContact O-CB 3.39Å; L350-C353 PolarHBondContact O-N 3.26Å; L350-C353 VanDerWaalsContact O-N 3.08Å; L350-L354 WeakPolarHBondContact O-CG 3.03Å; L350-L354 PolarHBondContact O-N 3.3Å
351	I	85.4	Confident	85.1	Confident	23 Å²	23	68.6 Å²	68.6	12%	0.118	35%	0.352	C	S	.	.	H	α-helix	trans	-63.7	-47.8	-176.2	-55.9	-64.3	0	0	0	111.3	M224 V228 C353 L354 H355 Y363 I367 L370	M224-I351 HydrophobicContact CE-CG1 4.49Å; M224-I351 HydrophobicContact SD-CB 3.8Å; M224-I351 HydrophobicContact SD-CG1 4.02Å; M224-I351 HydrophobicContact SD-CG2 4.33Å; V228-I351 HydrophobicContact CG2-CG2 3.85Å; I351-C353 PolarHBondContact O-N 2.91Å; I351-L354 HydrophobicContact CD1-CD1 4.48Å; I351-L354 PolarHBondContact O-N 2.94Å; I351-H355 PolarHBondContact O-N 2.98Å; I351-Y363 HydrophobicContact CG2-CE2 3.9Å; I351-I367 HydrophobicContact CD1-CD1 4.44Å; I351-I367 HydrophobicContact CG2-CD1 3.78Å; I351-L370 HydrophobicContact CD1-CD1 3.85Å
352	P	85.2	Confident	84.9	Confident	3 Å²	3	70.4 Å²	70.4	2%	0.019	36%	0.355	C	S	.	.	H	α-helix	trans	-61.9	-28.1	171.7	-24.8	35.9	0	0	0	114.6	M224 V228 A348 R356	M224-P352 HydrophobicContact CG-CG 3.97Å; V228-P352 HydrophobicContact CG1-CB 4.15Å; V228-P352 HydrophobicContact CG1-CG 4.27Å; A348-P352 WeakPolarHBondContact O-CD 3.38Å; P352-R356 WeakPolarHBondContact O-CB 3.43Å; P352-R356 WeakPolarHBondContact O-CG 3.31Å; P352-R356 PolarHBondContact O-N 2.75Å; P352-R356 PolarHBondContact O-NE 3.25Å
353	C	83.3	Confident	84.9	Confident	37 Å²	37	70.4 Å²	70.4	25%	0.25	35%	0.354	C	S	.	.	H	α-helix	trans	-70.8	-48.5	175.5	-170.2	0	0	0	0	110.9	W349 L350 I351 H355 R356 L357	W349-C353 HydrophobicContact CE3-CB 3.96Å; W349-C353 HydrophobicContact CZ3-CB 4.15Å; W349-C353 VanDerWaalsContact O-CB 3.24Å; W349-C353 WeakPolarHBondContact O-CB 3.19Å; W349-C353 PolarHBondContact O-N 2.86Å; W349-C353 VanDerWaalsContact O-N 3.1Å; L350-C353 WeakPolarHBondContact O-CA 3.28Å; L350-C353 VanDerWaalsContact O-CB 3.3Å; L350-C353 WeakPolarHBondContact O-CB 3.39Å; L350-C353 PolarHBondContact O-N 3.26Å; L350-C353 VanDerWaalsContact O-N 3.08Å; I351-C353 PolarHBondContact O-N 2.91Å; C353-H355 VanDerWaalsContact C-N 3.35Å; C353-H355 PolarHBondContact O-N 2.78Å; C353-R356 PolarHBondContact O-N 3.44Å; C353-R356 VanDerWaalsContact O-N 3.15Å; C353-L357 WeakPolarHBondContact O-CB 3.38Å; C353-L357 WeakPolarHBondContact O-CG 3.46Å; C353-L357 PolarHBondContact O-N 3.08Å; C353-L357 WeakPolarHBondContact SG-CD1 3.3Å
354	L	84.3	Confident	85	Confident	47 Å²	47	72.8 Å²	72.8	25%	0.246	37%	0.366	C	S	.	.	H	α-helix	trans	-58.7	-45.5	176.6	-69.7	172.8	0	0	0	111.4	L350 I351 R356 L357 C358 Y363 I366	L350-L354 WeakPolarHBondContact O-CG 3.03Å; L350-L354 PolarHBondContact O-N 3.3Å; I351-L354 HydrophobicContact CD1-CD1 4.48Å; I351-L354 PolarHBondContact O-N 2.94Å; L354-R356 PolarHBondContact O-N 3.34Å; L354-L357 PolarHBondContact O-N 3.37Å; L354-C358 WeakPolarHBondContact O-CB 3.42Å; L354-C358 PolarHBondContact O-N 3.38Å; L354-Y363 HydrophobicContact CB-CD2 4.24Å; L354-I366 HydrophobicContact CD1-CD1 4.33Å; L354-I366 HydrophobicContact CD1-CG2 4.48Å
355	H	89.3	Confident	85.1	Confident	70 Å²	70	79 Å²	79	32%	0.324	40%	0.397	S	S	.	.	H	α-helix	trans	-60.1	-35.1	177.8	-178.1	-114.3	0	0	0	112.9	V228 P229 I351 C353 Y363	V228-H355 HydrophobicContact CB-CB 4.17Å; V228-H355 HydrophobicContact CG1-CB 3.51Å; P229-H355 VanDerWaalsContact CD-NE2 3.31Å; P229-H355 WeakPolarHBondContact CD-NE2 3.37Å; I351-H355 PolarHBondContact O-N 2.98Å; C353-H355 VanDerWaalsContact C-N 3.35Å; C353-H355 PolarHBondContact O-N 2.78Å; H355-Y363 HydrophobicContact CB-CD2 3.75Å; H355-Y363 HydrophobicContact CB-CE2 3.61Å; H355-Y363 HydrophobicContact CB-CG 4.32Å; H355-Y363 AromaticContact CD2-CD1 3.76Å; H355-Y363 AromaticContact CD2-CE1 3.72Å; H355-Y363 AromaticContact CD2-CZ 3.99Å
356	R	87.9	Confident	85.5	Confident	169 Å²	169	80 Å²	80	64%	0.638	40%	0.396	S	S	*	.	H	α-helix	trans	-82.8	-32.8	-178	-78.9	-177.8	-87.7	-170.5	-17.4	113.9	P352 C353 L354	P352-R356 WeakPolarHBondContact O-CB 3.43Å; P352-R356 WeakPolarHBondContact O-CG 3.31Å; P352-R356 PolarHBondContact O-N 2.75Å; P352-R356 PolarHBondContact O-NE 3.25Å; C353-R356 PolarHBondContact O-N 3.44Å; C353-R356 VanDerWaalsContact O-N 3.15Å; L354-R356 PolarHBondContact O-N 3.34Å
357	L	83.9	Confident	86.4	Confident	136 Å²	136	71.5 Å²	71.5	71%	0.712	36%	0.356	S	S	*	.	H	α-helix	trans	-104.7	-28	-170.5	-61.8	-178.3	0	0	0	113.6	C353 L354	C353-L357 WeakPolarHBondContact O-CB 3.38Å; C353-L357 WeakPolarHBondContact O-CG 3.46Å; C353-L357 PolarHBondContact O-N 3.08Å; C353-L357 WeakPolarHBondContact SG-CD1 3.3Å; L354-L357 PolarHBondContact O-N 3.37Å
358	C	84.2	Confident	87.2	Confident	34 Å²	34	70.8 Å²	70.8	23%	0.23	35%	0.349	C	S	.	.	S	Bend	trans	-92.2	152.3	-176.8	-60.5	0	0	0	0	111.7	L354 F362	L354-C358 WeakPolarHBondContact O-CB 3.42Å; L354-C358 PolarHBondContact O-N 3.38Å; C358-F362 HydrophobicContact CB-CB 4.39Å; C358-F362 HydrophobicContact CB-CD1 3.68Å; C358-F362 HydrophobicContact CB-CE1 4.5Å; C358-F362 HydrophobicContact CB-CG 4.48Å
359	P	93.1	Very high	87.6	Confident	100 Å²	100	74.9 Å²	74.9	65%	0.649	38%	0.378	S	S	*	.			trans	-55.8	142.6	168	-23.4	33.7	0	0	0	111.3	R361 F362 Y363	P359-R361 VanDerWaalsContact C-N 3.25Å; P359-R361 PolarHBondContact O-N 3.44Å; P359-R361 VanDerWaalsContact O-N 3.12Å; P359-F362 WeakPolarHBondContact O-CB 3.19Å; P359-F362 PolarHBondContact O-N 3.46Å; P359-Y363 PolarHBondContact O-N 2.92Å
360	T	92.6	Very high	87.8	Confident	102 Å²	102	76 Å²	76	63%	0.626	39%	0.388	S	S	*	.	H	α-helix	trans	-49.9	-43.5	-176.4	-49.4	0	0	0	0	112.7	F362 Y363 D364	T360-F362 VanDerWaalsContact C-N 3.29Å; T360-F362 PolarHBondContact O-N 3.07Å; T360-Y363 WeakPolarHBondContact O-CB 3.39Å; T360-Y363 PolarHBondContact O-N 3.15Å; T360-D364 WeakPolarHBondContact O-CB 3.26Å; T360-D364 PolarHBondContact O-N 3.34Å
361	R	93.1	Very high	87.6	Confident	222 Å²	222	74.4 Å²	74.4	84%	0.838	38%	0.378	S	S	*	.	H	α-helix	trans	-58.2	-37.1	178	-70.4	-174.1	175.3	168.4	-1.2	114.1	P359 M365	P359-R361 VanDerWaalsContact C-N 3.25Å; P359-R361 PolarHBondContact O-N 3.44Å; P359-R361 VanDerWaalsContact O-N 3.12Å; R361-M365 WeakPolarHBondContact O-CB 3.16Å; R361-M365 PolarHBondContact O-N 3.02Å; R361-M365 VanDerWaalsContact O-N 3.11Å
362	F	91.1	Very high	86.9	Confident	99 Å²	99	79.5 Å²	79.5	43%	0.434	40%	0.402	S	S	.	.	H	α-helix	trans	-73.4	-42.4	179.7	-176.6	-102.6	0	0	0	110.8	C358 P359 T360 M365 I366	C358-F362 HydrophobicContact CB-CB 4.39Å; C358-F362 HydrophobicContact CB-CD1 3.68Å; C358-F362 HydrophobicContact CB-CE1 4.5Å; C358-F362 HydrophobicContact CB-CG 4.48Å; P359-F362 WeakPolarHBondContact O-CB 3.19Å; P359-F362 PolarHBondContact O-N 3.46Å; T360-F362 VanDerWaalsContact C-N 3.29Å; T360-F362 PolarHBondContact O-N 3.07Å; F362-M365 PolarHBondContact O-N 3.35Å; F362-I366 HydrophobicContact CD1-CD1 3.76Å; F362-I366 HydrophobicContact CE1-CD1 3.27Å; F362-I366 HydrophobicContact CE1-CG1 4.46Å; F362-I366 HydrophobicContact CE2-CD1 4.25Å; F362-I366 HydrophobicContact CG-CD1 4.46Å; F362-I366 HydrophobicContact CZ-CD1 3.56Å; F362-I366 WeakPolarHBondContact O-CG1 3.43Å; F362-I366 PolarHBondContact O-N 3.4Å; F362-I366 VanDerWaalsContact O-N 3.17Å
363	Y	91.5	Very high	85.8	Confident	2 Å²	2	81 Å²	81	1%	0.008	41%	0.407	C	S	.	.	H	α-helix	trans	-59.1	-50.1	172.5	175.2	-97.5	0	0	0	111.4	V228 P229 I351 L354 H355 P359 T360 M365 I366 I367	V228-Y363 VanDerWaalsContact CB-OH 3.28Å; V228-Y363 WeakPolarHBondContact CB-OH 3.5Å; V228-Y363 VanDerWaalsContact CG2-OH 3.3Å; V228-Y363 WeakPolarHBondContact CG2-OH 3.47Å; P229-Y363 PolarHBondContact O-OH 3.44Å; I351-Y363 HydrophobicContact CG2-CE2 3.9Å; L354-Y363 HydrophobicContact CB-CD2 4.24Å; H355-Y363 HydrophobicContact CB-CD2 3.75Å; H355-Y363 HydrophobicContact CB-CE2 3.61Å; H355-Y363 HydrophobicContact CB-CG 4.32Å; H355-Y363 AromaticContact CD2-CD1 3.76Å; H355-Y363 AromaticContact CD2-CE1 3.72Å; H355-Y363 AromaticContact CD2-CZ 3.99Å; P359-Y363 PolarHBondContact O-N 2.92Å; T360-Y363 WeakPolarHBondContact O-CB 3.39Å; T360-Y363 PolarHBondContact O-N 3.15Å; Y363-M365 VanDerWaalsContact C-N 3.31Å; Y363-M365 PolarHBondContact O-N 3.22Å; Y363-I366 PolarHBondContact O-N 3.03Å; Y363-I366 VanDerWaalsContact O-N 3.12Å; Y363-I367 HydrophobicContact CD1-CG2 4.23Å; Y363-I367 HydrophobicContact CE1-CB 4.11Å; Y363-I367 HydrophobicContact CE1-CG1 4.43Å; Y363-I367 HydrophobicContact CE1-CG2 3.81Å; Y363-I367 HydrophobicContact CE2-CB 4.37Å; Y363-I367 HydrophobicContact CE2-CD1 4.45Å; Y363-I367 WeakPolarHBondContact O-CG2 3.44Å; Y363-I367 PolarHBondContact O-N 3.25Å
364	D	92.8	Very high	84.7	Confident	71 Å²	71	81.2 Å²	81.2	38%	0.38	41%	0.407	S	S	.	.	H	α-helix	trans	-57.8	-43.1	-179.2	-68	-9.1	0	0	0	111.4	T360 T368	T360-D364 WeakPolarHBondContact O-CB 3.26Å; T360-D364 PolarHBondContact O-N 3.34Å; D364-T368 WeakPolarHBondContact O-CB 3.15Å; D364-T368 PolarHBondContact O-N 3.34Å; D364-T368 PolarHBondContact O-OG1 3.34Å
365	M	90.8	Very high	83.7	Confident	136 Å²	136	85 Å²	85	67%	0.67	44%	0.436	S	S	*	.	H	α-helix	trans	-60	-48	175.6	-174.8	-173.7	-63	0	0	112.1	R361 F362 Y363 S369	R361-M365 WeakPolarHBondContact O-CB 3.16Å; R361-M365 PolarHBondContact O-N 3.02Å; R361-M365 VanDerWaalsContact O-N 3.11Å; F362-M365 PolarHBondContact O-N 3.35Å; Y363-M365 VanDerWaalsContact C-N 3.31Å; Y363-M365 PolarHBondContact O-N 3.22Å; M365-S369 WeakPolarHBondContact O-CB 3.35Å; M365-S369 PolarHBondContact O-N 3.23Å; M365-S369 VanDerWaalsContact O-N 3.09Å
366	I	89.9	Confident	83	Confident	46 Å²	46	82.6 Å²	82.6	24%	0.236	43%	0.428	C	S	.	.	H	α-helix	trans	-66.4	-51.2	-179.1	-69	173.4	0	0	0	110.8	L354 F362 Y363 T368 S369 L370	L354-I366 HydrophobicContact CD1-CD1 4.33Å; L354-I366 HydrophobicContact CD1-CG2 4.48Å; F362-I366 HydrophobicContact CD1-CD1 3.76Å; F362-I366 HydrophobicContact CE1-CD1 3.27Å; F362-I366 HydrophobicContact CE1-CG1 4.46Å; F362-I366 HydrophobicContact CE2-CD1 4.25Å; F362-I366 HydrophobicContact CG-CD1 4.46Å; F362-I366 HydrophobicContact CZ-CD1 3.56Å; F362-I366 WeakPolarHBondContact O-CG1 3.43Å; F362-I366 PolarHBondContact O-N 3.4Å; F362-I366 VanDerWaalsContact O-N 3.17Å; Y363-I366 PolarHBondContact O-N 3.03Å; Y363-I366 VanDerWaalsContact O-N 3.12Å; I366-T368 VanDerWaalsContact C-N 3.28Å; I366-T368 PolarHBondContact O-N 2.98Å; I366-S369 PolarHBondContact O-N 2.91Å; I366-L370 HydrophobicContact CG2-CD1 3.75Å; I366-L370 HydrophobicContact CG2-CG 4.34Å; I366-L370 WeakPolarHBondContact O-CG 3.42Å; I366-L370 PolarHBondContact O-N 3.49Å
367	I	88.9	Confident	83	Confident	4 Å²	4	79.4 Å²	79.4	2%	0.021	42%	0.423	C	S	.	.	H	α-helix	trans	-66.3	-36.6	-174.5	-158.9	70.9	0	0	0	111	P231 I351 Y363 L370 F371	P231-I367 HydrophobicContact CG-CG2 4.44Å; I351-I367 HydrophobicContact CD1-CD1 4.44Å; I351-I367 HydrophobicContact CG2-CD1 3.78Å; Y363-I367 HydrophobicContact CD1-CG2 4.23Å; Y363-I367 HydrophobicContact CE1-CB 4.11Å; Y363-I367 HydrophobicContact CE1-CG1 4.43Å; Y363-I367 HydrophobicContact CE1-CG2 3.81Å; Y363-I367 HydrophobicContact CE2-CB 4.37Å; Y363-I367 HydrophobicContact CE2-CD1 4.45Å; Y363-I367 WeakPolarHBondContact O-CG2 3.44Å; Y363-I367 PolarHBondContact O-N 3.25Å; I367-L370 PolarHBondContact O-N 3.37Å; I367-F371 HydrophobicContact CD1-CD2 3.58Å; I367-F371 HydrophobicContact CD1-CE2 3.44Å; I367-F371 VanDerWaalsContact CD1-CE2 3.44Å; I367-F371 HydrophobicContact CG1-CD2 3.88Å; I367-F371 HydrophobicContact CG1-CE2 4.25Å; I367-F371 WeakPolarHBondContact O-CB 3.41Å; I367-F371 WeakPolarHBondContact O-CD2 3.39Å; I367-F371 PolarHBondContact O-N 3.42Å
368	T	87.6	Confident	83.3	Confident	45 Å²	45	73.9 Å²	73.9	28%	0.276	40%	0.395	S	S	.	.	H	α-helix	trans	-65.2	-43.9	175.8	-59.6	0	0	0	0	110.3	D364 I366 L370 F371 Q372	D364-T368 WeakPolarHBondContact O-CB 3.15Å; D364-T368 PolarHBondContact O-N 3.34Å; D364-T368 PolarHBondContact O-OG1 3.34Å; I366-T368 VanDerWaalsContact C-N 3.28Å; I366-T368 PolarHBondContact O-N 2.98Å; T368-L370 VanDerWaalsContact C-N 3.32Å; T368-L370 PolarHBondContact O-N 3.13Å; T368-F371 PolarHBondContact O-N 3.03Å; T368-Q372 HydrophobicContact CG2-CG 3.67Å; T368-Q372 WeakPolarHBondContact O-CA 3.43Å; T368-Q372 WeakPolarHBondContact O-CB 3.37Å; T368-Q372 WeakPolarHBondContact O-CG 3.46Å; T368-Q372 PolarHBondContact O-N 3.4Å
369	S	85.3	Confident	83.7	Confident	93 Å²	93	74 Å²	74	65%	0.65	40%	0.399	S	S	*	.	H	α-helix	trans	-65.2	-32.5	176.2	-175.3	0	0	0	0	113.7	M365 I366	M365-S369 WeakPolarHBondContact O-CB 3.35Å; M365-S369 PolarHBondContact O-N 3.23Å; M365-S369 VanDerWaalsContact O-N 3.09Å; I366-S369 PolarHBondContact O-N 2.91Å
370	L	82.6	Confident	83.5	Confident	87 Å²	87	71.1 Å²	71.1	46%	0.455	39%	0.387	S	S	.	.	H	α-helix	trans	-77	-34.1	-179.9	-72.9	173.3	0	0	0	112.7	I351 I366 I367 T368 F373	I351-L370 HydrophobicContact CD1-CD1 3.85Å; I366-L370 HydrophobicContact CG2-CD1 3.75Å; I366-L370 HydrophobicContact CG2-CG 4.34Å; I366-L370 WeakPolarHBondContact O-CG 3.42Å; I366-L370 PolarHBondContact O-N 3.49Å; I367-L370 PolarHBondContact O-N 3.37Å; T368-L370 VanDerWaalsContact C-N 3.32Å; T368-L370 PolarHBondContact O-N 3.13Å; L370-F373 VanDerWaalsContact O-CE1 3.28Å; L370-F373 WeakPolarHBondContact O-CE1 3.42Å; L370-F373 VanDerWaalsContact O-CZ 3.27Å; L370-F373 WeakPolarHBondContact O-CZ 3.41Å
371	F	77.8	Confident	83.3	Confident	37 Å²	37	71.5 Å²	71.5	16%	0.162	38%	0.384	C	S	.	.	H	α-helix	trans	-112.3	-2.7	-172.4	-69.8	-90	0	0	0	114.4	M224 V230 M314 I367 T368 F373	M224-F371 HydrophobicContact CE-CZ 4.42Å; V230-F371 HydrophobicContact CG1-CD1 3.73Å; V230-F371 HydrophobicContact CG1-CD2 4.07Å; V230-F371 HydrophobicContact CG1-CE1 3.83Å; V230-F371 HydrophobicContact CG1-CE2 4.18Å; V230-F371 HydrophobicContact CG1-CG 3.86Å; V230-F371 HydrophobicContact CG1-CZ 4.06Å; M314-F371 HydrophobicContact CE-CE1 4.34Å; I367-F371 HydrophobicContact CD1-CD2 3.58Å; I367-F371 HydrophobicContact CD1-CE2 3.44Å; I367-F371 VanDerWaalsContact CD1-CE2 3.44Å; I367-F371 HydrophobicContact CG1-CD2 3.88Å; I367-F371 HydrophobicContact CG1-CE2 4.25Å; I367-F371 WeakPolarHBondContact O-CB 3.41Å; I367-F371 WeakPolarHBondContact O-CD2 3.39Å; I367-F371 PolarHBondContact O-N 3.42Å; T368-F371 PolarHBondContact O-N 3.03Å; F371-F373 HydrophobicContact CB-CE2 4.42Å; F371-F373 HydrophobicContact CD1-CE2 4.09Å; F371-F373 HydrophobicContact CD1-CZ 4.33Å; F371-F373 VanDerWaalsContact O-CD2 3.29Å; F371-F373 WeakPolarHBondContact O-CD2 3.48Å; F371-F373 PolarHBondContact O-N 2.94Å; F371-F373 VanDerWaalsContact O-N 3.11Å
372	Q	69.6	Low	82.8	Confident	130 Å²	130	65.4 Å²	65.4	61%	0.607	37%	0.366	S	S	*	.			trans	-74.4	97.6	164.8	-84.5	-177.6	-15.8	0	0	109.5	T368	T368-Q372 HydrophobicContact CG2-CG 3.67Å; T368-Q372 WeakPolarHBondContact O-CA 3.43Å; T368-Q372 WeakPolarHBondContact O-CB 3.37Å; T368-Q372 WeakPolarHBondContact O-CG 3.46Å; T368-Q372 PolarHBondContact O-N 3.4Å
373	F	61.5	Low	81.3	Confident	33 Å²	33	63.7 Å²	63.7	15%	0.145	37%	0.37	C	S	.	.			trans	-100	10.5	175.7	-54.7	-62.1	0	0	0	113.5	R310 K313 M314 M317 L370 F371	R310-F373 HydrophobicContact CB-CD2 4.25Å; R310-F373 HydrophobicContact CG-CB 4.17Å; R310-F373 HydrophobicContact CG-CD2 4.34Å; K313-F373 HydrophobicContact CD-CB 4.15Å; K313-F373 HydrophobicContact CD-CD1 3.42Å; K313-F373 VanDerWaalsContact CD-CD1 3.42Å; K313-F373 HydrophobicContact CD-CE1 3.99Å; K313-F373 HydrophobicContact CD-CG 3.98Å; K313-F373 VanDerWaalsContact CE-CD1 3.42Å; K313-F373 HydrophobicContact CG-CD1 4.09Å; K313-F373 HydrophobicContact CG-CE1 4.28Å; M314-F373 HydrophobicContact CG-CD2 4.46Å; M314-F373 HydrophobicContact CG-CE2 3.76Å; M314-F373 HydrophobicContact CG-CZ 4.29Å; M314-F373 HydrophobicContact SD-CE2 4.22Å; M317-F373 HydrophobicContact SD-CE1 4.03Å; M317-F373 HydrophobicContact SD-CZ 4.35Å; L370-F373 VanDerWaalsContact O-CE1 3.28Å; L370-F373 WeakPolarHBondContact O-CE1 3.42Å; L370-F373 VanDerWaalsContact O-CZ 3.27Å; L370-F373 WeakPolarHBondContact O-CZ 3.41Å; F371-F373 HydrophobicContact CB-CE2 4.42Å; F371-F373 HydrophobicContact CD1-CE2 4.09Å; F371-F373 HydrophobicContact CD1-CZ 4.33Å; F371-F373 VanDerWaalsContact O-CD2 3.29Å; F371-F373 WeakPolarHBondContact O-CD2 3.48Å; F371-F373 PolarHBondContact O-N 2.94Å; F371-F373 VanDerWaalsContact O-N 3.11Å
374	N	61.6	Low	79.6	Confident	43 Å²	43	65.9 Å²	65.9	23%	0.23	39%	0.393	C	S	.	.			trans	-87	130.8	-171	-74.5	21.3	0	0	0	112.4	Y303 R310 S376	Y303-N374 WeakPolarHBondContact CE2-ND2 3.38Å; R310-N374 PolarHBondContact NE-OD1 3.02Å; R310-N374 VanDerWaalsContact NH2-CG 3.31Å; R310-N374 PolarHBondContact NH2-ND2 3.22Å; R310-N374 PolarHBondContact NH2-OD1 3.05Å; N374-S376 VanDerWaalsContact C-N 3.31Å; N374-S376 WeakPolarHBondContact CB-O 3.38Å
375	S	62.5	Low	77.6	Confident	125 Å²	125	65.9 Å²	65.9	87%	0.874	40%	0.402	S	S	*	.	S	Bend	trans	-80.1	-14.3	162.3	52	0	0	0	0	112.7
376	S	75.8	Confident	75.4	Confident	21 Å²	21	63.2 Å²	63.2	15%	0.147	40%	0.397	C	S	.	.			trans	-123.9	139.4	-175.7	72.1	0	0	0	0	112.5	Y303 S306 N374	Y303-S376 WeakPolarHBondContact CA-OG 3.32Å; Y303-S376 VanDerWaalsContact CD2-O 3.28Å; Y303-S376 WeakPolarHBondContact CD2-O 3.22Å; S306-S376 WeakPolarHBondContact CB-OG 3.14Å; S306-S376 PolarHBondContact OG-OG 3.16Å; N374-S376 VanDerWaalsContact C-N 3.31Å; N374-S376 WeakPolarHBondContact CB-O 3.38Å
377	L	87.1	Confident	73.2	Confident	101 Å²	101	66.4 Å²	66.4	53%	0.529	42%	0.419	S	S	.	.			trans	-90.2	155.7	172.2	-71.1	168	0	0	0	110.1	A379 Q382	L377-A379 PolarHBondContact O-N 3.17Å; L377-Q382 HydrophobicContact CB-CG 3.92Å; L377-Q382 PolarHBondContact O-NE2 3.13Å
378	P	90.5	Very high	70.8	Confident	21 Å²	21	69.2 Å²	69.2	14%	0.136	45%	0.449	C	S	.	.			trans	-49.4	138.6	165.8	-27.8	35.4	0	0	0	111.7	D298 Y299 Y303 G380 L381 Q382	D298-P378 CarbonylContact O-C 3.52Å; Y299-P378 HydrophobicContact CD1-CB 4.46Å; Y299-P378 HydrophobicContact CD1-CG 4.4Å; Y299-P378 WeakPolarHBondContact O-CA 3.32Å; Y303-P378 HydrophobicContact CD2-CG 4Å; Y303-P378 HydrophobicContact CE1-CG 4.44Å; Y303-P378 HydrophobicContact CE2-CG 3.84Å; Y303-P378 HydrophobicContact CG-CG 4.34Å; P378-G380 VanDerWaalsContact C-N 3.28Å; P378-G380 PolarHBondContact O-N 2.91Å; P378-L381 HydrophobicContact CB-CD1 4.35Å; P378-L381 HydrophobicContact CB-CG 4.32Å; P378-L381 HydrophobicContact CG-CD1 4.1Å; P378-L381 WeakPolarHBondContact O-CB 3.37Å; P378-L381 PolarHBondContact O-N 3.25Å; P378-Q382 PolarHBondContact O-N 2.9Å
379	A	91.1	Very high	68.2	Low	36 Å²	36	72 Å²	72	30%	0.298	47%	0.47	S	S	.	.	H	α-helix	trans	-55.8	-38.8	-175.8	0	0	0	0	0	113.5	D298 Y299 L377 L381 Q382 A383	D298-A379 PolarHBondContact O-N 3.09Å; Y299-A379 PolarHBondContact O-N 3.35Å; L377-A379 PolarHBondContact O-N 3.17Å; A379-L381 PolarHBondContact O-N 3.39Å; A379-Q382 PolarHBondContact O-N 2.7Å; A379-A383 PolarHBondContact O-N 2.92Å
380	G	89.4	Confident	65.8	Low	39 Å²	39	76.2 Å²	76.2	40%	0.402	48%	0.477	S	S	.	.	H	α-helix	trans	-61.3	-30.2	176.2	0	0	0	0	0	113.5	D298 P378	D298-G380 PolarHBondContact O-N 3.27Å; P378-G380 VanDerWaalsContact C-N 3.28Å; P378-G380 PolarHBondContact O-N 2.91Å
381	L	88.6	Confident	63.4	Low	110 Å²	110	81.9 Å²	81.9	58%	0.576	52%	0.515	S	S	*	.	H	α-helix	trans	-82.7	-30.3	176.6	-62	-177.9	0	0	0	112.6	P378 A379 A383 G384 A385	P378-L381 HydrophobicContact CB-CD1 4.35Å; P378-L381 HydrophobicContact CB-CG 4.32Å; P378-L381 HydrophobicContact CG-CD1 4.1Å; P378-L381 WeakPolarHBondContact O-CB 3.37Å; P378-L381 PolarHBondContact O-N 3.25Å; A379-L381 PolarHBondContact O-N 3.39Å; L381-A383 VanDerWaalsContact C-N 3.34Å; L381-G384 PolarHBondContact O-N 2.94Å; L381-A385 PolarHBondContact O-N 2.76Å
382	Q	82.4	Confident	62.7	Low	95 Å²	95	84.1 Å²	84.1	44%	0.444	53%	0.533	S	S	.	.	H	α-helix	trans	-66.1	-38.1	175	-62.6	-177.4	16.2	0	0	111.8	L377 P378 A379 G384 A385	L377-Q382 HydrophobicContact CB-CG 3.92Å; L377-Q382 PolarHBondContact O-NE2 3.13Å; P378-Q382 PolarHBondContact O-N 2.9Å; A379-Q382 PolarHBondContact O-N 2.7Å; Q382-G384 VanDerWaalsContact C-N 3.32Å; Q382-G384 PolarHBondContact O-N 3.4Å; Q382-A385 PolarHBondContact O-N 3.34Å
383	A	60.8	Low	62.3	Low	63 Å²	63	81.7 Å²	81.7	52%	0.521	53%	0.529	S	S	.	.	H	α-helix	trans	-60.3	-40.8	176.5	0	0	0	0	0	112.1	A379 L381 S386	A379-A383 PolarHBondContact O-N 2.92Å; L381-A383 VanDerWaalsContact C-N 3.34Å; A383-S386 PolarHBondContact O-OG 3.27Å
384	G	54.1	Low	62.4	Low	47 Å²	47	84.4 Å²	84.4	49%	0.485	55%	0.55	S	S	.	.	H	α-helix	trans	-71.1	-32.9	178	0	0	0	0	0	114.8	L381 Q382 S386 V387	L381-G384 PolarHBondContact O-N 2.94Å; Q382-G384 VanDerWaalsContact C-N 3.32Å; Q382-G384 PolarHBondContact O-N 3.4Å; G384-S386 VanDerWaalsContact C-N 3.26Å; G384-S386 PolarHBondContact O-N 3.06Å; G384-V387 PolarHBondContact O-N 2.97Å
385	A	52	Low	62.4	Low	71 Å²	71	86.8 Å²	86.8	59%	0.587	57%	0.569	S	S	*	*	H	α-helix	trans	-66.1	-26.3	180	0	0	0	0	0	113.5	L381 Q382 V387	L381-A385 PolarHBondContact O-N 2.76Å; Q382-A385 PolarHBondContact O-N 3.34Å; A385-V387 VanDerWaalsContact C-N 3.32Å
386	S	43.4	Very low	62.4	Low	81 Å²	81	84.4 Å²	84.4	57%	0.566	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-15.8	176	68.1	0	0	0	0	114.7	A383 G384	A383-S386 PolarHBondContact O-OG 3.27Å; G384-S386 VanDerWaalsContact C-N 3.26Å; G384-S386 PolarHBondContact O-N 3.06Å
387	V	43.7	Very low	61.5	Low	112 Å²	112	88.7 Å²	88.7	68%	0.679	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-23.5	-179.3	-177	0	0	0	0	111.5	G384 A385	G384-V387 PolarHBondContact O-N 2.97Å; A385-V387 VanDerWaalsContact C-N 3.32Å
388	G	38.5	Very low	59.7	Low	64 Å²	64	87.8 Å²	87.8	66%	0.66	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-2.3	-178	0	0	0	0	0	116.9
389	S	33.8	Very low	57.4	Low	102 Å²	102	92.9 Å²	92.9	71%	0.713	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	10.4	178	76.9	0	0	0	0	114.4
390	K	34.1	Very low	54.5	Low	183 Å²	183	97.7 Å²	97.7	80%	0.796	64%	0.64	S	S	*	*			trans	-122	66.1	173.7	-71.3	-173.1	177.9	-179.9	0	111.2
391	T	33.6	Very low	51.4	Low	205 Å²	205	103 Å²	103	100%	1.258	66%	0.662	S	S	*	*			trans	-151.4	0	153.7	45.9	0	0	0	0	109.7

Retrieved 391 of 391 residues in 2378.6 ms (Link to these results)

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