A0A060Y7V4_ONCMY Loading...

Methyltransferase 9, His-X-His N1-histidine

AlphaFold DB , UniProt , Accession A0A060Y7V4, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 324 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	53.7	Low	63.7	Low	215 Å²	215	124.7 Å²	124.7	100%	1.059	62%	0.62	S	S	*	*				0	128.1	0	-71.6	170	73.7	0	0	107.9
2	C	51.3	Low	64.9	Low	83 Å²	83	120.3 Å²	120.3	56%	0.561	61%	0.605	S	S	*	*			trans	-71.3	138	-164.6	-158.5	0	0	0	0	110.8	L4 Q5 L6	C2-L4 PolarHBondContact O-N 3.37Å; C2-Q5 HydrophobicContact CB-CG 4.3Å; C2-Q5 WeakPolarHBondContact O-CB 3.22Å; C2-Q5 PolarHBondContact O-N 3.44Å; C2-L6 PolarHBondContact O-N 3.46Å
3	H	54.6	Low	65.6	Low	129 Å²	129	115.7 Å²	115.7	60%	0.597	60%	0.597	S	S	*	*	H	α-helix	trans	-54.5	-23.5	-177.6	-162.2	-53.3	0	0	0	113.2
4	L	57.1	Low	66.3	Low	129 Å²	129	119.2 Å²	119.2	68%	0.675	60%	0.599	S	S	*	*	H	α-helix	trans	-70.7	-40.4	174.3	-156.8	72.3	0	0	0	112.4	C2 L6 R7 T8	C2-L4 PolarHBondContact O-N 3.37Å; L4-L6 VanDerWaalsContact C-N 3.35Å; L4-L6 PolarHBondContact O-N 3.43Å; L4-R7 PolarHBondContact O-N 3.42Å; L4-T8 PolarHBondContact O-N 2.52Å; L4-T8 VanDerWaalsContact O-N 3.09Å; L4-T8 PolarHBondContact O-OG1 3.39Å
5	Q	62.8	Low	66.9	Low	114 Å²	114	114.3 Å²	114.3	53%	0.533	58%	0.577	S	S	.	*	H	α-helix	trans	-67.9	-34.3	-178.9	-67	175.9	-44.2	0	0	112.1	C2 L9	C2-Q5 HydrophobicContact CB-CG 4.3Å; C2-Q5 WeakPolarHBondContact O-CB 3.22Å; C2-Q5 PolarHBondContact O-N 3.44Å; Q5-L9 WeakPolarHBondContact O-CB 3.42Å; Q5-L9 PolarHBondContact O-N 3.21Å
6	L	68.4	Low	67.5	Low	107 Å²	107	113.9 Å²	113.9	56%	0.56	58%	0.577	S	S	*	*	H	α-helix	trans	-69.3	-39.8	176.6	-170.9	66.3	0	0	0	112	C2 L4 L9 L10	C2-L6 PolarHBondContact O-N 3.46Å; L4-L6 VanDerWaalsContact C-N 3.35Å; L4-L6 PolarHBondContact O-N 3.43Å; L6-L9 PolarHBondContact O-N 3.25Å; L6-L10 HydrophobicContact CG-CD1 4.38Å; L6-L10 WeakPolarHBondContact O-CG 3.29Å; L6-L10 PolarHBondContact O-N 3.16Å
7	R	62.5	Low	67.7	Low	166 Å²	166	109.8 Å²	109.8	63%	0.626	57%	0.569	S	S	*	*	H	α-helix	trans	-66.3	-40	176.2	-74.8	-176.5	172.8	179.5	0.9	111.9	L4 L10 F11	L4-R7 PolarHBondContact O-N 3.42Å; R7-L10 PolarHBondContact O-N 2.89Å; R7-F11 WeakPolarHBondContact O-CB 3.5Å; R7-F11 PolarHBondContact O-N 3.49Å
8	T	72.1	Confident	67.3	Low	80 Å²	80	110.5 Å²	110.5	49%	0.491	56%	0.564	S	S	.	*	H	α-helix	trans	-64.6	-40.6	174.7	-50.1	0	0	0	0	111.4	L4 F11 V12	L4-T8 PolarHBondContact O-N 2.52Å; L4-T8 VanDerWaalsContact O-N 3.09Å; L4-T8 PolarHBondContact O-OG1 3.39Å; T8-F11 PolarHBondContact O-N 3.32Å; T8-V12 HydrophobicContact CG2-CG2 4.39Å; T8-V12 WeakPolarHBondContact O-CB 3.34Å; T8-V12 WeakPolarHBondContact O-CG2 3.43Å; T8-V12 PolarHBondContact O-N 3.27Å
9	L	75.3	Confident	67.5	Low	111 Å²	111	108.8 Å²	108.8	58%	0.581	56%	0.555	S	S	*	*	H	α-helix	trans	-62.6	-45.2	175.6	-109.6	151.4	0	0	0	112.6	Q5 L6 V12 A13	Q5-L9 WeakPolarHBondContact O-CB 3.42Å; Q5-L9 PolarHBondContact O-N 3.21Å; L6-L9 PolarHBondContact O-N 3.25Å; L9-V12 PolarHBondContact O-N 3.24Å; L9-A13 VanDerWaalsContact O-CB 3.3Å; L9-A13 WeakPolarHBondContact O-CB 3.36Å; L9-A13 PolarHBondContact O-N 3.18Å
10	L	69.6	Low	67.7	Low	112 Å²	112	106.5 Å²	106.5	59%	0.586	55%	0.553	S	S	*	*	H	α-helix	trans	-64.8	-40	177	-71.6	169.7	0	0	0	111.9	L6 R7 A13 W14	L6-L10 HydrophobicContact CG-CD1 4.38Å; L6-L10 WeakPolarHBondContact O-CG 3.29Å; L6-L10 PolarHBondContact O-N 3.16Å; R7-L10 PolarHBondContact O-N 2.89Å; L10-A13 PolarHBondContact O-N 3.17Å; L10-W14 VanDerWaalsContact O-CB 3.3Å; L10-W14 WeakPolarHBondContact O-CB 3.49Å; L10-W14 PolarHBondContact O-N 2.73Å
11	F	72.9	Confident	67.7	Low	126 Å²	126	107.4 Å²	107.4	55%	0.553	55%	0.553	S	S	*	*	H	α-helix	trans	-66.1	-44.1	176.5	-177.6	-103.1	0	0	0	111.8	R7 T8 W14 V15	R7-F11 WeakPolarHBondContact O-CB 3.5Å; R7-F11 PolarHBondContact O-N 3.49Å; T8-F11 PolarHBondContact O-N 3.32Å; F11-W14 HydrophobicContact CD2-CE3 4.39Å; F11-W14 HydrophobicContact CE2-CE3 4.24Å; F11-W14 HydrophobicContact CE2-CZ3 4.3Å; F11-W14 PolarHBondContact O-N 3.15Å; F11-V15 HydrophobicContact CD1-CG2 4.19Å; F11-V15 HydrophobicContact CE1-CG2 3.8Å; F11-V15 HydrophobicContact CE2-CG2 4.19Å; F11-V15 HydrophobicContact CZ-CG2 3.8Å; F11-V15 VanDerWaalsContact O-CG2 3.32Å; F11-V15 WeakPolarHBondContact O-CG2 3.38Å; F11-V15 PolarHBondContact O-N 2.8Å
12	V	78.8	Confident	68.1	Low	72 Å²	72	100.7 Å²	100.7	44%	0.436	52%	0.521	S	S	.	.	H	α-helix	trans	-64.8	-42.2	176.9	171.5	0	0	0	0	110.9	T8 L9 W14 V15 L16	T8-V12 HydrophobicContact CG2-CG2 4.39Å; T8-V12 WeakPolarHBondContact O-CB 3.34Å; T8-V12 WeakPolarHBondContact O-CG2 3.43Å; T8-V12 PolarHBondContact O-N 3.27Å; L9-V12 PolarHBondContact O-N 3.24Å; V12-W14 VanDerWaalsContact C-N 3.32Å; V12-W14 PolarHBondContact O-N 3.44Å; V12-V15 PolarHBondContact O-N 3.33Å; V12-L16 HydrophobicContact CG1-CD1 3.84Å; V12-L16 HydrophobicContact CG1-CG 4.33Å; V12-L16 WeakPolarHBondContact O-CB 3.46Å; V12-L16 VanDerWaalsContact O-CG 3.24Å; V12-L16 WeakPolarHBondContact O-CG 3.42Å; V12-L16 PolarHBondContact O-N 3.03Å
13	A	74.1	Confident	68.7	Low	60 Å²	60	101.6 Å²	101.6	50%	0.496	52%	0.52	S	S	.	.	H	α-helix	trans	-62.1	-40	174.4	0	0	0	0	0	112	L9 L10 G17	L9-A13 VanDerWaalsContact O-CB 3.3Å; L9-A13 WeakPolarHBondContact O-CB 3.36Å; L9-A13 PolarHBondContact O-N 3.18Å; L10-A13 PolarHBondContact O-N 3.17Å; A13-G17 PolarHBondContact O-N 3.4Å
14	W	75.4	Confident	68.9	Low	165 Å²	165	97.2 Å²	97.2	63%	0.625	51%	0.51	S	S	*	.	H	α-helix	trans	-66	-44.7	175.8	-179	78.8	0	0	0	112.3	L10 F11 V12 G17 Y18	L10-W14 VanDerWaalsContact O-CB 3.3Å; L10-W14 WeakPolarHBondContact O-CB 3.49Å; L10-W14 PolarHBondContact O-N 2.73Å; F11-W14 HydrophobicContact CD2-CE3 4.39Å; F11-W14 HydrophobicContact CE2-CE3 4.24Å; F11-W14 HydrophobicContact CE2-CZ3 4.3Å; F11-W14 PolarHBondContact O-N 3.15Å; V12-W14 VanDerWaalsContact C-N 3.32Å; V12-W14 PolarHBondContact O-N 3.44Å; W14-G17 PolarHBondContact O-N 3.48Å; W14-Y18 WeakPolarHBondContact O-CB 3.43Å; W14-Y18 PolarHBondContact O-N 3.49Å
15	V	74.4	Confident	68.5	Low	46 Å²	46	92.3 Å²	92.3	28%	0.279	49%	0.485	S	S	.	.	H	α-helix	trans	-63.4	-43.3	176.5	170.8	0	0	0	0	111	F11 V12 Y18 I19	F11-V15 HydrophobicContact CD1-CG2 4.19Å; F11-V15 HydrophobicContact CE1-CG2 3.8Å; F11-V15 HydrophobicContact CE2-CG2 4.19Å; F11-V15 HydrophobicContact CZ-CG2 3.8Å; F11-V15 VanDerWaalsContact O-CG2 3.32Å; F11-V15 WeakPolarHBondContact O-CG2 3.38Å; F11-V15 PolarHBondContact O-N 2.8Å; V12-V15 PolarHBondContact O-N 3.33Å; V15-Y18 PolarHBondContact O-N 3.15Å; V15-I19 HydrophobicContact CG1-CD1 3.71Å; V15-I19 HydrophobicContact CG1-CG1 4.38Å; V15-I19 WeakPolarHBondContact O-CB 3.46Å; V15-I19 VanDerWaalsContact O-CG1 3.24Å; V15-I19 WeakPolarHBondContact O-CG1 3.33Å; V15-I19 PolarHBondContact O-N 3.02Å
16	L	76.4	Confident	67.7	Low	108 Å²	108	95.4 Å²	95.4	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-65.8	-40.2	176.9	-70.6	172.4	0	0	0	111.9	V12 I19 A20	V12-L16 HydrophobicContact CG1-CD1 3.84Å; V12-L16 HydrophobicContact CG1-CG 4.33Å; V12-L16 WeakPolarHBondContact O-CB 3.46Å; V12-L16 VanDerWaalsContact O-CG 3.24Å; V12-L16 WeakPolarHBondContact O-CG 3.42Å; V12-L16 PolarHBondContact O-N 3.03Å; L16-I19 PolarHBondContact O-N 3.23Å; L16-A20 WeakPolarHBondContact O-CB 3.42Å; L16-A20 PolarHBondContact O-N 2.75Å
17	G	71.4	Confident	66.6	Low	43 Å²	43	98.7 Å²	98.7	44%	0.443	50%	0.502	S	S	.	.	H	α-helix	trans	-62.5	-41.2	172.8	0	0	0	0	0	112.5	A13 W14 A20 F21	A13-G17 PolarHBondContact O-N 3.4Å; W14-G17 PolarHBondContact O-N 3.48Å; G17-A20 PolarHBondContact O-N 2.89Å; G17-F21 VanDerWaalsContact O-CB 3.31Å; G17-F21 WeakPolarHBondContact O-CB 3.36Å; G17-F21 PolarHBondContact O-N 3.42Å
18	Y	61	Low	65.7	Low	123 Å²	123	96 Å²	96	48%	0.482	50%	0.498	S	S	.	.	H	α-helix	trans	-67.6	-40.4	176.9	-175.4	-110.1	0	0	0	112.4	W14 V15 F21 L22	W14-Y18 WeakPolarHBondContact O-CB 3.43Å; W14-Y18 PolarHBondContact O-N 3.49Å; V15-Y18 PolarHBondContact O-N 3.15Å; Y18-F21 WeakPolarHBondContact O-CB 3.47Å; Y18-F21 PolarHBondContact O-N 3.2Å; Y18-L22 HydrophobicContact CD1-CD1 3.8Å; Y18-L22 HydrophobicContact CD1-CG 4.47Å; Y18-L22 HydrophobicContact CE1-CD1 3.35Å; Y18-L22 HydrophobicContact CE1-CG 4.17Å; Y18-L22 HydrophobicContact CE2-CD1 4.48Å; Y18-L22 HydrophobicContact CE2-CG 4.47Å; Y18-L22 WeakPolarHBondContact O-CB 3.34Å; Y18-L22 WeakPolarHBondContact O-CG 3.32Å; Y18-L22 PolarHBondContact O-N 2.93Å
19	I	71	Confident	64.3	Low	78 Å²	78	100.8 Å²	100.8	40%	0.4	51%	0.507	S	S	.	.	H	α-helix	trans	-67.5	-42.3	175.5	-68.6	168.8	0	0	0	110.8	V15 L16 F21 L22 L23	V15-I19 HydrophobicContact CG1-CD1 3.71Å; V15-I19 HydrophobicContact CG1-CG1 4.38Å; V15-I19 WeakPolarHBondContact O-CB 3.46Å; V15-I19 VanDerWaalsContact O-CG1 3.24Å; V15-I19 WeakPolarHBondContact O-CG1 3.33Å; V15-I19 PolarHBondContact O-N 3.02Å; L16-I19 PolarHBondContact O-N 3.23Å; I19-F21 VanDerWaalsContact C-N 3.32Å; I19-F21 PolarHBondContact O-N 2.9Å; I19-L22 PolarHBondContact O-N 3.22Å; I19-L23 HydrophobicContact CG2-CD1 3.85Å; I19-L23 HydrophobicContact CG2-CG 4.39Å; I19-L23 WeakPolarHBondContact O-CB 3.23Å; I19-L23 VanDerWaalsContact O-CG 3.32Å; I19-L23 WeakPolarHBondContact O-CG 3.16Å; I19-L23 PolarHBondContact O-N 2.83Å
20	A	70.4	Confident	62.7	Low	62 Å²	62	100.9 Å²	100.9	51%	0.512	51%	0.512	S	S	.	.	H	α-helix	trans	-62.6	-39.6	174.7	0	0	0	0	0	111.8	L16 G17 L23 G24	L16-A20 WeakPolarHBondContact O-CB 3.42Å; L16-A20 PolarHBondContact O-N 2.75Å; G17-A20 PolarHBondContact O-N 2.89Å; A20-L23 PolarHBondContact O-N 2.84Å; A20-G24 PolarHBondContact O-N 2.88Å
21	F	67.8	Low	61.2	Low	127 Å²	127	97 Å²	97	56%	0.557	50%	0.499	S	S	*	.	H	α-helix	trans	-60.4	-49.4	172.2	176	-100.2	0	0	0	111.5	G17 Y18 I19 L23 G24 T25	G17-F21 VanDerWaalsContact O-CB 3.31Å; G17-F21 WeakPolarHBondContact O-CB 3.36Å; G17-F21 PolarHBondContact O-N 3.42Å; Y18-F21 WeakPolarHBondContact O-CB 3.47Å; Y18-F21 PolarHBondContact O-N 3.2Å; I19-F21 VanDerWaalsContact C-N 3.32Å; I19-F21 PolarHBondContact O-N 2.9Å; F21-L23 VanDerWaalsContact C-N 3.34Å; F21-L23 PolarHBondContact O-N 2.77Å; F21-G24 PolarHBondContact O-N 2.9Å; F21-T25 HydrophobicContact CD1-CG2 4.45Å; F21-T25 HydrophobicContact CE1-CG2 4.12Å; F21-T25 HydrophobicContact CE2-CG2 4.24Å; F21-T25 HydrophobicContact CZ-CG2 4.01Å; F21-T25 WeakPolarHBondContact O-CG2 3.48Å; F21-T25 PolarHBondContact O-N 2.94Å; F21-T25 PolarHBondContact O-OG1 3.34Å
22	L	61.8	Low	59.7	Low	73 Å²	73	101.1 Å²	101.1	38%	0.382	52%	0.517	S	S	.	.	H	α-helix	trans	-64.4	-33.6	178.5	-73.8	176.2	0	0	0	113.7	Y18 I19 T25 R26	Y18-L22 HydrophobicContact CD1-CD1 3.8Å; Y18-L22 HydrophobicContact CD1-CG 4.47Å; Y18-L22 HydrophobicContact CE1-CD1 3.35Å; Y18-L22 HydrophobicContact CE1-CG 4.17Å; Y18-L22 HydrophobicContact CE2-CD1 4.48Å; Y18-L22 HydrophobicContact CE2-CG 4.47Å; Y18-L22 WeakPolarHBondContact O-CB 3.34Å; Y18-L22 WeakPolarHBondContact O-CG 3.32Å; Y18-L22 PolarHBondContact O-N 2.93Å; I19-L22 PolarHBondContact O-N 3.22Å; L22-T25 VanDerWaalsContact CA-OG1 3.31Å; L22-T25 WeakPolarHBondContact CA-OG1 3.25Å; L22-T25 PolarHBondContact O-OG1 3.13Å; L22-R26 WeakPolarHBondContact O-CB 3.48Å; L22-R26 PolarHBondContact O-N 3.49Å
23	L	64.4	Low	58.3	Low	102 Å²	102	107 Å²	107	53%	0.534	53%	0.532	S	S	.	.	H	α-helix	trans	-75.5	-35.3	175.8	-71.3	170.8	0	0	0	111.9	I19 A20 F21 R26 K27	I19-L23 HydrophobicContact CG2-CD1 3.85Å; I19-L23 HydrophobicContact CG2-CG 4.39Å; I19-L23 WeakPolarHBondContact O-CB 3.23Å; I19-L23 VanDerWaalsContact O-CG 3.32Å; I19-L23 WeakPolarHBondContact O-CG 3.16Å; I19-L23 PolarHBondContact O-N 2.83Å; A20-L23 PolarHBondContact O-N 2.84Å; F21-L23 VanDerWaalsContact C-N 3.34Å; F21-L23 PolarHBondContact O-N 2.77Å; L23-R26 PolarHBondContact O-N 3.36Å; L23-K27 PolarHBondContact O-N 2.85Å
24	G	58.5	Low	56.9	Low	38 Å²	38	108.3 Å²	108.3	39%	0.392	54%	0.535	S	S	.	.	H	α-helix	trans	-62.5	-44.6	170.6	0	0	0	0	0	112	A20 F21 K27 M28	A20-G24 PolarHBondContact O-N 2.88Å; F21-G24 PolarHBondContact O-N 2.9Å; G24-K27 PolarHBondContact O-N 3.21Å; G24-M28 PolarHBondContact O-N 3.48Å
25	T	48.5	Very low	55.9	Low	26 Å²	26	111 Å²	111	16%	0.16	55%	0.545	C	S	.	.	H	α-helix	trans	-67	-37.3	175.9	58.1	0	0	0	0	111.9	F21 L22 K27 M28 W29	F21-T25 HydrophobicContact CD1-CG2 4.45Å; F21-T25 HydrophobicContact CE1-CG2 4.12Å; F21-T25 HydrophobicContact CE2-CG2 4.24Å; F21-T25 HydrophobicContact CZ-CG2 4.01Å; F21-T25 WeakPolarHBondContact O-CG2 3.48Å; F21-T25 PolarHBondContact O-N 2.94Å; F21-T25 PolarHBondContact O-OG1 3.34Å; L22-T25 VanDerWaalsContact CA-OG1 3.31Å; L22-T25 WeakPolarHBondContact CA-OG1 3.25Å; L22-T25 PolarHBondContact O-OG1 3.13Å; T25-K27 VanDerWaalsContact C-N 3.34Å; T25-K27 PolarHBondContact O-N 3.05Å; T25-M28 CarbonylContact O-C 3.48Å; T25-M28 WeakPolarHBondContact O-CB 3.22Å; T25-M28 PolarHBondContact O-N 3.4Å; T25-M28 VanDerWaalsContact O-N 3.13Å; T25-W29 PolarHBondContact O-N 3.37Å
26	R	47.2	Very low	54.8	Low	179 Å²	179	111.3 Å²	111.3	68%	0.675	55%	0.549	S	S	*	.	H	α-helix	trans	-60.8	-38.3	176.1	-168.7	176.9	176.5	177	-0.6	113.1	L22 L23 M28 W29 T30	L22-R26 WeakPolarHBondContact O-CB 3.48Å; L22-R26 PolarHBondContact O-N 3.49Å; L23-R26 PolarHBondContact O-N 3.36Å; R26-M28 VanDerWaalsContact C-N 3.34Å; R26-W29 PolarHBondContact O-N 2.88Å; R26-T30 PolarHBondContact O-N 3.2Å; R26-T30 PolarHBondContact O-OG1 3.12Å
27	K	45.8	Very low	53.7	Low	175 Å²	175	111.4 Å²	111.4	76%	0.761	56%	0.556	S	S	*	*	H	α-helix	trans	-70.8	-30.8	176.4	-151.1	178	-174.4	-178.7	0	112.1	L23 G24 T25 T30	L23-K27 PolarHBondContact O-N 2.85Å; G24-K27 PolarHBondContact O-N 3.21Å; T25-K27 VanDerWaalsContact C-N 3.34Å; T25-K27 PolarHBondContact O-N 3.05Å; K27-T30 PolarHBondContact O-OG1 3.47Å
28	M	42.2	Very low	52.7	Low	111 Å²	111	115.4 Å²	115.4	55%	0.547	57%	0.566	S	S	.	*	H	α-helix	trans	-72.5	-30.3	171.2	-70.8	173.3	66.5	0	0	112.8	G24 T25 R26 T30 F103	G24-M28 PolarHBondContact O-N 3.48Å; T25-M28 CarbonylContact O-C 3.48Å; T25-M28 WeakPolarHBondContact O-CB 3.22Å; T25-M28 PolarHBondContact O-N 3.4Å; T25-M28 VanDerWaalsContact O-N 3.13Å; R26-M28 VanDerWaalsContact C-N 3.34Å; M28-T30 VanDerWaalsContact C-N 3.34Å; M28-F103 HydrophobicContact CE-CE1 4.11Å
29	W	43.2	Very low	52.2	Low	180 Å²	180	112 Å²	112	68%	0.682	56%	0.563	S	S	*	*	H	α-helix	trans	-75.2	-19.6	178.9	-78.9	36.6	0	0	0	113.7	T25 R26	T25-W29 PolarHBondContact O-N 3.37Å; R26-W29 PolarHBondContact O-N 2.88Å
30	T	41.1	Very low	51.3	Low	113 Å²	113	112.2 Å²	112.2	69%	0.693	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-12.1	-179.9	46.1	0	0	0	0	114.7	R26 K27 M28	R26-T30 PolarHBondContact O-N 3.2Å; R26-T30 PolarHBondContact O-OG1 3.12Å; K27-T30 PolarHBondContact O-OG1 3.47Å; M28-T30 VanDerWaalsContact C-N 3.34Å
31	G	39.9	Very low	50.2	Low	30 Å²	30	111.8 Å²	111.8	31%	0.309	55%	0.552	S	S	.	*	S	Bend	trans	-96.5	124.9	175.1	0	0	0	0	0	110.2	Y33	G31-Y33 WeakPolarHBondContact O-CB 3.49Å; G31-Y33 WeakPolarHBondContact O-CD2 3.33Å; G31-Y33 PolarHBondContact O-N 2.85Å
32	K	41.3	Very low	49.4	Very low	213 Å²	213	110.6 Å²	110.6	93%	0.926	55%	0.552	S	S	*	*	S	Bend	trans	17.6	10.9	156.3	-73.9	-175.3	176	-179	0	122.8
33	Y	48.7	Very low	48.8	Very low	194 Å²	194	112.5 Å²	112.5	76%	0.761	56%	0.557	S	S	*	*			trans	-120.7	11.7	-161.8	-67.7	-72.7	0	0	0	113.9	G31	G31-Y33 WeakPolarHBondContact O-CB 3.49Å; G31-Y33 WeakPolarHBondContact O-CD2 3.33Å; G31-Y33 PolarHBondContact O-N 2.85Å
34	V	44	Very low	48	Very low	89 Å²	89	110 Å²	110	54%	0.539	54%	0.543	S	S	.	.			trans	-112.3	83.6	169.8	-172.9	0	0	0	0	108.1	S36	V34-S36 PolarHBondContact O-N 2.94Å
35	R	54.2	Low	47.5	Very low	222 Å²	222	112.7 Å²	112.7	84%	0.838	55%	0.548	S	S	*	.			trans	-69.8	118.4	158.2	-81.5	-174.2	167.2	-180	-4.1	106.3
36	S	52.8	Low	47.2	Very low	52 Å²	52	117.2 Å²	117.2	36%	0.364	57%	0.569	S	S	.	*			trans	-62	145.6	-168.5	87.3	0	0	0	0	111.7	V34 L38 A39 R40	V34-S36 PolarHBondContact O-N 2.94Å; S36-L38 PolarHBondContact O-N 2.88Å; S36-L38 VanDerWaalsContact O-N 3.16Å; S36-A39 PolarHBondContact O-N 2.78Å; S36-A39 WeakPolarHBondContact OG-CB 3.45Å; S36-A39 PolarHBondContact OG-N 3.21Å; S36-R40 PolarHBondContact O-N 2.81Å
37	P	51.8	Low	47.2	Very low	110 Å²	110	111.6 Å²	111.6	71%	0.714	55%	0.552	S	S	*	*	H	α-helix	trans	-54.1	-33.1	175.7	-26.8	34.3	0	0	0	113.2	R40 S41	P37-R40 PolarHBondContact O-N 3.4Å; P37-S41 PolarHBondContact O-N 3.11Å
38	L	50.4	Low	47.1	Very low	127 Å²	127	107.6 Å²	107.6	67%	0.665	55%	0.546	S	S	*	.	H	α-helix	trans	-67.6	-46.7	175	-88.1	159	0	0	0	112.2	S36 R40 S41 L42	S36-L38 PolarHBondContact O-N 2.88Å; S36-L38 VanDerWaalsContact O-N 3.16Å; L38-R40 PolarHBondContact O-N 2.89Å; L38-S41 PolarHBondContact O-N 3.3Å; L38-S41 PolarHBondContact O-OG 3.46Å; L38-L42 WeakPolarHBondContact O-CG 3.38Å; L38-L42 PolarHBondContact O-N 2.98Å
39	A	50.4	Low	47.1	Very low	51 Å²	51	110 Å²	110	42%	0.421	56%	0.556	S	S	.	*	H	α-helix	trans	-62.7	-33.6	175.9	0	0	0	0	0	111.6	S36 F43	S36-A39 PolarHBondContact O-N 2.78Å; S36-A39 WeakPolarHBondContact OG-CB 3.45Å; S36-A39 PolarHBondContact OG-N 3.21Å; A39-F43 WeakPolarHBondContact O-CB 3.44Å; A39-F43 PolarHBondContact O-N 2.71Å
40	R	52.4	Low	46.9	Very low	82 Å²	82	103.4 Å²	103.4	31%	0.309	54%	0.537	S	S	.	.	H	α-helix	trans	-73.8	-37.8	175.1	-156.4	175.5	-177.1	176.8	-2.8	112.3	S36 P37 L38 L42 F43 M44 S96 D308	S36-R40 PolarHBondContact O-N 2.81Å; P37-R40 PolarHBondContact O-N 3.4Å; L38-R40 PolarHBondContact O-N 2.89Å; R40-L42 VanDerWaalsContact C-N 3.34Å; R40-F43 PolarHBondContact O-N 3.48Å; R40-M44 HydrophobicContact CG-CE 4.45Å; R40-M44 HydrophobicContact CG-CG 4.44Å; R40-M44 VanDerWaalsContact O-CB 3.29Å; R40-M44 WeakPolarHBondContact O-CB 3.31Å; R40-M44 WeakPolarHBondContact O-CG 3.46Å; R40-M44 PolarHBondContact O-N 2.81Å; R40-S96 PolarHBondContact NH2-OG 3.35Å; R40-D308 IonicContact NH2-OD1 3.14Å; R40-D308 PolarHBondContact NH2-OD1 2.96Å; R40-D308 VanDerWaalsContact NH2-OD1 3.14Å
41	S	48.7	Very low	47.1	Very low	53 Å²	53	106.8 Å²	106.8	37%	0.371	55%	0.545	S	S	.	.	H	α-helix	trans	-65.8	-37.5	173.2	77.8	0	0	0	0	112.1	P37 L38 N45	P37-S41 PolarHBondContact O-N 3.11Å; L38-S41 PolarHBondContact O-N 3.3Å; L38-S41 PolarHBondContact O-OG 3.46Å; S41-N45 VanDerWaalsContact O-CB 3.29Å; S41-N45 WeakPolarHBondContact O-CB 3.49Å; S41-N45 VanDerWaalsContact O-CG 3.23Å; S41-N45 PolarHBondContact O-N 3.47Å; S41-N45 PolarHBondContact O-OD1 2.99Å
42	L	50.3	Low	47.2	Very low	103 Å²	103	112.3 Å²	112.3	54%	0.539	56%	0.563	S	S	.	*	H	α-helix	trans	-69.4	-37.7	174.6	-69.8	170.5	0	0	0	111.4	L38 R40 M46	L38-L42 WeakPolarHBondContact O-CG 3.38Å; L38-L42 PolarHBondContact O-N 2.98Å; R40-L42 VanDerWaalsContact C-N 3.34Å; L42-M46 WeakPolarHBondContact O-CB 2.84Å; L42-M46 PolarHBondContact O-N 3.27Å
43	F	49.8	Very low	47.5	Very low	113 Å²	113	104.3 Å²	104.3	50%	0.496	53%	0.534	S	S	.	.	H	α-helix	trans	-70.1	-40.1	174.6	-171.1	-111.1	0	0	0	112.3	A39 R40 M46 I47	A39-F43 WeakPolarHBondContact O-CB 3.44Å; A39-F43 PolarHBondContact O-N 2.71Å; R40-F43 PolarHBondContact O-N 3.48Å; F43-M46 PolarHBondContact O-N 2.94Å; F43-I47 HydrophobicContact CD1-CD1 3.39Å; F43-I47 HydrophobicContact CD1-CG1 4.37Å; F43-I47 HydrophobicContact CE1-CD1 3.13Å; F43-I47 HydrophobicContact CE1-CG1 4.21Å; F43-I47 HydrophobicContact CE2-CD1 4.32Å; F43-I47 HydrophobicContact CG-CD1 4.12Å; F43-I47 HydrophobicContact CZ-CD1 3.64Å; F43-I47 HydrophobicContact CZ-CG1 4.34Å; F43-I47 WeakPolarHBondContact O-CB 3.45Å; F43-I47 VanDerWaalsContact O-CG1 3.25Å; F43-I47 WeakPolarHBondContact O-CG1 3.01Å; F43-I47 PolarHBondContact O-N 3.41Å
44	M	46.9	Very low	47.6	Very low	48 Å²	48	96.7 Å²	96.7	24%	0.236	51%	0.514	C	S	.	.	H	α-helix	trans	-67.8	-39.2	175.4	-72.5	-66.2	166.4	0	0	111.6	R40 I47 S48 I93	R40-M44 HydrophobicContact CG-CE 4.45Å; R40-M44 HydrophobicContact CG-CG 4.44Å; R40-M44 VanDerWaalsContact O-CB 3.29Å; R40-M44 WeakPolarHBondContact O-CB 3.31Å; R40-M44 WeakPolarHBondContact O-CG 3.46Å; R40-M44 PolarHBondContact O-N 2.81Å; M44-I47 PolarHBondContact O-N 3.45Å; M44-S48 WeakPolarHBondContact O-CB 3.4Å; M44-S48 PolarHBondContact O-N 2.96Å; M44-S48 PolarHBondContact O-OG 3.17Å; M44-I93 HydrophobicContact CE-CG2 3.31Å; M44-I93 HydrophobicContact SD-CG2 3.86Å
45	N	48.3	Very low	48.1	Very low	95 Å²	95	99.3 Å²	99.3	51%	0.508	52%	0.521	S	S	.	.	H	α-helix	trans	-65.6	-38.6	171.8	-74.6	0.2	0	0	0	111.4	S41 S48 E49	S41-N45 VanDerWaalsContact O-CB 3.29Å; S41-N45 WeakPolarHBondContact O-CB 3.49Å; S41-N45 VanDerWaalsContact O-CG 3.23Å; S41-N45 PolarHBondContact O-N 3.47Å; S41-N45 PolarHBondContact O-OD1 2.99Å; N45-S48 WeakPolarHBondContact CA-OG 3.23Å; N45-S48 PolarHBondContact O-N 2.75Å; N45-S48 PolarHBondContact O-OG 2.84Å; N45-E49 WeakPolarHBondContact O-CB 3.39Å; N45-E49 WeakPolarHBondContact O-CG 3.39Å; N45-E49 PolarHBondContact O-N 2.84Å; N45-E49 VanDerWaalsContact O-N 3.16Å
46	M	42.6	Very low	48.7	Very low	121 Å²	121	95.6 Å²	95.6	60%	0.596	51%	0.513	S	S	*	.	H	α-helix	trans	-66.1	-35.9	172.7	-111.5	179.7	-75.5	0	0	113.2	L42 F43 E49 S50	L42-M46 WeakPolarHBondContact O-CB 2.84Å; L42-M46 PolarHBondContact O-N 3.27Å; F43-M46 PolarHBondContact O-N 2.94Å; M46-E49 PolarHBondContact O-N 2.76Å; M46-S50 WeakPolarHBondContact O-CB 3.36Å; M46-S50 PolarHBondContact O-N 2.6Å; M46-S50 VanDerWaalsContact O-N 3.08Å
47	I	46.2	Very low	49.7	Very low	61 Å²	61	93.9 Å²	93.9	31%	0.313	50%	0.5	S	S	.	.	H	α-helix	trans	-73.1	-36.4	176.7	-74.1	167.5	0	0	0	111.2	F43 M44 E49	F43-I47 HydrophobicContact CD1-CD1 3.39Å; F43-I47 HydrophobicContact CD1-CG1 4.37Å; F43-I47 HydrophobicContact CE1-CD1 3.13Å; F43-I47 HydrophobicContact CE1-CG1 4.21Å; F43-I47 HydrophobicContact CE2-CD1 4.32Å; F43-I47 HydrophobicContact CG-CD1 4.12Å; F43-I47 HydrophobicContact CZ-CD1 3.64Å; F43-I47 HydrophobicContact CZ-CG1 4.34Å; F43-I47 WeakPolarHBondContact O-CB 3.45Å; F43-I47 VanDerWaalsContact O-CG1 3.25Å; F43-I47 WeakPolarHBondContact O-CG1 3.01Å; F43-I47 PolarHBondContact O-N 3.41Å; M44-I47 PolarHBondContact O-N 3.45Å; I47-E49 PolarHBondContact O-N 3.47Å
48	S	43.6	Very low	50.9	Low	92 Å²	92	92.4 Å²	92.4	64%	0.643	48%	0.483	S	S	*	.	H	α-helix	trans	-69.1	-19.3	173.4	58.9	0	0	0	0	112.9	M44 N45	M44-S48 WeakPolarHBondContact O-CB 3.4Å; M44-S48 PolarHBondContact O-N 2.96Å; M44-S48 PolarHBondContact O-OG 3.17Å; N45-S48 WeakPolarHBondContact CA-OG 3.23Å; N45-S48 PolarHBondContact O-N 2.75Å; N45-S48 PolarHBondContact O-OG 2.84Å
49	E	42.9	Very low	52.6	Low	162 Å²	162	91.1 Å²	91.1	76%	0.757	47%	0.474	S	S	*	.	H	α-helix	trans	-100.9	-7.3	179.3	-73.9	-180	169.4	0	0	113.9	N45 M46 I47	N45-E49 WeakPolarHBondContact O-CB 3.39Å; N45-E49 WeakPolarHBondContact O-CG 3.39Å; N45-E49 PolarHBondContact O-N 2.84Å; N45-E49 VanDerWaalsContact O-N 3.16Å; M46-E49 PolarHBondContact O-N 2.76Å; I47-E49 PolarHBondContact O-N 3.47Å
50	S	39.7	Very low	54.6	Low	41 Å²	41	91 Å²	91	29%	0.287	46%	0.463	S	S	.	.			trans	-93.1	109	-179.6	68	0	0	0	0	112.8	M46 E52 S53	M46-S50 WeakPolarHBondContact O-CB 3.36Å; M46-S50 PolarHBondContact O-N 2.6Å; M46-S50 VanDerWaalsContact O-N 3.08Å; S50-E52 PolarHBondContact O-N 2.83Å; S50-S53 PolarHBondContact O-N 2.99Å; S50-S53 PolarHBondContact O-OG 3.3Å
51	E	44.3	Very low	56.6	Low	183 Å²	183	87 Å²	87	86%	0.855	45%	0.448	S	S	*	.	H	α-helix	trans	-53	-17.4	168.7	-67	179.4	151.4	0	0	113.2	G54 Q55	E51-G54 PolarHBondContact O-N 2.83Å; E51-Q55 PolarHBondContact O-N 2.98Å
52	E	41.6	Very low	58.8	Low	147 Å²	147	89.3 Å²	89.3	69%	0.687	45%	0.451	S	S	*	.	H	α-helix	trans	-67.7	-35.8	176.7	-69.3	-179.7	159.5	0	0	113.8	S50 G54 Q55 E56	S50-E52 PolarHBondContact O-N 2.83Å; E52-G54 VanDerWaalsContact C-N 3.32Å; E52-G54 PolarHBondContact O-N 2.96Å; E52-Q55 PolarHBondContact O-N 2.95Å; E52-E56 PolarHBondContact O-N 2.91Å; E52-E56 VanDerWaalsContact O-N 3.13Å
53	S	47.1	Very low	60.9	Low	45 Å²	45	85 Å²	85	32%	0.315	43%	0.429	S	S	.	.	H	α-helix	trans	-71.4	-30.4	177.2	69.2	0	0	0	0	112.3	S50 T57	S50-S53 PolarHBondContact O-N 2.99Å; S50-S53 PolarHBondContact O-OG 3.3Å; S53-T57 WeakPolarHBondContact O-CB 3.26Å; S53-T57 VanDerWaalsContact O-CG2 3.31Å; S53-T57 WeakPolarHBondContact O-CG2 3.49Å; S53-T57 PolarHBondContact O-N 3.12Å; S53-T57 VanDerWaalsContact O-N 3.1Å; S53-T57 PolarHBondContact O-OG1 2.88Å
54	G	52.3	Low	63	Low	33 Å²	33	81.9 Å²	81.9	34%	0.34	42%	0.422	S	S	.	.	H	α-helix	trans	-65.1	-38	172.4	0	0	0	0	0	112.2	E51 E52 T57 Q58	E51-G54 PolarHBondContact O-N 2.83Å; E52-G54 VanDerWaalsContact C-N 3.32Å; E52-G54 PolarHBondContact O-N 2.96Å; G54-T57 PolarHBondContact O-OG1 2.9Å; G54-T57 VanDerWaalsContact O-OG1 3.12Å; G54-Q58 WeakPolarHBondContact O-CG 3.41Å; G54-Q58 PolarHBondContact O-N 2.68Å
55	Q	54.9	Low	65	Low	145 Å²	145	82.4 Å²	82.4	68%	0.678	43%	0.429	S	S	*	.	H	α-helix	trans	-70.6	-43.9	175.3	-78.1	-176.6	-16.6	0	0	112.5	E51 E52 T57 Q58 E59	E51-Q55 PolarHBondContact O-N 2.98Å; E52-Q55 PolarHBondContact O-N 2.95Å; Q55-T57 VanDerWaalsContact C-N 3.32Å; Q55-T57 PolarHBondContact O-N 2.8Å; Q55-Q58 PolarHBondContact O-N 2.76Å; Q55-E59 PolarHBondContact O-N 3.31Å
56	E	65.1	Low	67.1	Low	144 Å²	144	84.2 Å²	84.2	67%	0.673	44%	0.438	S	S	*	.	H	α-helix	trans	-62.9	-36.5	178.2	-74.6	-170.8	161.2	0	0	113	E52 E59	E52-E56 PolarHBondContact O-N 2.91Å; E52-E56 VanDerWaalsContact O-N 3.13Å; E56-E59 PolarHBondContact O-N 3.15Å
57	T	73.9	Confident	69.6	Low	16 Å²	16	81.5 Å²	81.5	10%	0.098	43%	0.426	C	S	.	.	H	α-helix	trans	-75.2	-27	178.7	49.9	0	0	0	0	113.1	S53 G54 Q55 E59 W60 Y61	S53-T57 WeakPolarHBondContact O-CB 3.26Å; S53-T57 VanDerWaalsContact O-CG2 3.31Å; S53-T57 WeakPolarHBondContact O-CG2 3.49Å; S53-T57 PolarHBondContact O-N 3.12Å; S53-T57 VanDerWaalsContact O-N 3.1Å; S53-T57 PolarHBondContact O-OG1 2.88Å; G54-T57 PolarHBondContact O-OG1 2.9Å; G54-T57 VanDerWaalsContact O-OG1 3.12Å; Q55-T57 VanDerWaalsContact C-N 3.32Å; Q55-T57 PolarHBondContact O-N 2.8Å; T57-E59 VanDerWaalsContact C-N 3.33Å; T57-W60 HydrophobicContact CG2-CE3 4.29Å; T57-W60 HydrophobicContact CG2-CH2 3.7Å; T57-W60 HydrophobicContact CG2-CZ2 4Å; T57-W60 HydrophobicContact CG2-CZ3 3.85Å; T57-W60 WeakPolarHBondContact O-CB 3.36Å; T57-W60 PolarHBondContact O-N 3.39Å; T57-Y61 WeakPolarHBondContact O-CD2 3.45Å
58	Q	77.5	Confident	72	Confident	78 Å²	78	78.7 Å²	78.7	36%	0.364	41%	0.412	S	S	.	.	H	α-helix	trans	-72	-27.7	173.2	-69.3	-69.1	-14.2	0	0	112.2	G54 Q55 W60 Y61	G54-Q58 WeakPolarHBondContact O-CG 3.41Å; G54-Q58 PolarHBondContact O-N 2.68Å; Q55-Q58 PolarHBondContact O-N 2.76Å; Q58-W60 PolarHBondContact O-N 3.45Å; Q58-Y61 PolarHBondContact O-N 2.84Å; Q58-Y61 VanDerWaalsContact O-N 3.14Å
59	E	86.1	Confident	74.4	Confident	101 Å²	101	75.3 Å²	75.3	47%	0.472	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-62.4	-23.9	175	-69	-69.1	133.8	0	0	112.4	Q55 E56 T57 Y61 K62	Q55-E59 PolarHBondContact O-N 3.31Å; E56-E59 PolarHBondContact O-N 3.15Å; T57-E59 VanDerWaalsContact C-N 3.33Å; E59-Y61 PolarHBondContact O-N 3.44Å; E59-K62 VanDerWaalsContact CD-NZ 3.27Å; E59-K62 WeakPolarHBondContact O-CB 3.48Å; E59-K62 PolarHBondContact O-N 3.49Å; E59-K62 IonicContact OE1-NZ 3.15Å; E59-K62 PolarHBondContact OE1-NZ 3.01Å; E59-K62 WeakPolarHBondContact OE2-CD 3.36Å; E59-K62 IonicContact OE2-NZ 3.77Å; E59-K62 PolarHBondContact OE2-NZ 2.85Å
60	W	92.9	Very high	76.8	Confident	47 Å²	47	75.8 Å²	75.8	18%	0.178	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-62.3	-28.1	175.4	-59.9	-16.3	0	0	0	113.5	T57 Q58 L89 R296 P298 L300 Y309 V311	T57-W60 HydrophobicContact CG2-CE3 4.29Å; T57-W60 HydrophobicContact CG2-CH2 3.7Å; T57-W60 HydrophobicContact CG2-CZ2 4Å; T57-W60 HydrophobicContact CG2-CZ3 3.85Å; T57-W60 WeakPolarHBondContact O-CB 3.36Å; T57-W60 PolarHBondContact O-N 3.39Å; Q58-W60 PolarHBondContact O-N 3.45Å; W60-L89 HydrophobicContact CH2-CD1 4.4Å; W60-L89 HydrophobicContact CH2-CD2 4.44Å; W60-L89 HydrophobicContact CZ3-CD1 4.21Å; W60-R296 WeakPolarHBondContact O-CG 3.42Å; W60-P298 HydrophobicContact CB-CB 4.18Å; W60-P298 HydrophobicContact CB-CG 4.47Å; W60-P298 HydrophobicContact CD2-CB 4.04Å; W60-P298 HydrophobicContact CE3-CB 3.71Å; W60-P298 HydrophobicContact CE3-CG 3.79Å; W60-P298 HydrophobicContact CG-CB 4.28Å; W60-P298 HydrophobicContact CZ3-CB 4.37Å; W60-P298 HydrophobicContact CZ3-CG 4.44Å; W60-L300 HydrophobicContact CH2-CD2 4.31Å; W60-L300 HydrophobicContact CZ3-CD2 4.22Å; W60-Y309 AromaticContact CH2-CE2 3.87Å; W60-Y309 HydrophobicContact CH2-CE2 3.87Å; W60-Y309 HydrophobicContact CZ2-CE2 4.25Å; W60-V311 HydrophobicContact CD2-CG2 4.25Å; W60-V311 HydrophobicContact CZ2-CB 4.45Å; W60-V311 HydrophobicContact CZ2-CG1 4.24Å; W60-V311 HydrophobicContact CZ2-CG2 4.3Å
61	Y	94.8	Very high	79.3	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-99.5	-5.4	-176.5	-58.8	-87.1	0	0	0	112.8	T57 Q58 E59 C63 Q78 S79 L81 L297 P298	T57-Y61 WeakPolarHBondContact O-CD2 3.45Å; Q58-Y61 PolarHBondContact O-N 2.84Å; Q58-Y61 VanDerWaalsContact O-N 3.14Å; E59-Y61 PolarHBondContact O-N 3.44Å; Y61-C63 PolarHBondContact O-N 3.23Å; Y61-Q78 PolarHBondContact O-NE2 3.26Å; Y61-S79 VanDerWaalsContact CB-O 3.25Å; Y61-S79 WeakPolarHBondContact CB-O 3.3Å; Y61-L81 HydrophobicContact CE2-CB 3.95Å; Y61-L297 HydrophobicContact CD1-CD2 3.91Å; Y61-L297 HydrophobicContact CE1-CD2 3.59Å; Y61-P298 HydrophobicContact CE1-CG 4.35Å; Y61-P298 HydrophobicContact CE2-CG 4.48Å
62	K	94.1	Very high	81.8	Confident	101 Å²	101	68.6 Å²	68.6	44%	0.439	36%	0.36	S	S	.	.			trans	-72	126.1	-171.4	-172.4	178.9	-175.5	173	0	110.8	E59 R296	E59-K62 VanDerWaalsContact CD-NZ 3.27Å; E59-K62 WeakPolarHBondContact O-CB 3.48Å; E59-K62 PolarHBondContact O-N 3.49Å; E59-K62 IonicContact OE1-NZ 3.15Å; E59-K62 PolarHBondContact OE1-NZ 3.01Å; E59-K62 WeakPolarHBondContact OE2-CD 3.36Å; E59-K62 IonicContact OE2-NZ 3.77Å; E59-K62 PolarHBondContact OE2-NZ 2.85Å; K62-R296 VanDerWaalsContact O-CD 3.25Å; K62-R296 WeakPolarHBondContact O-CD 3.37Å; K62-R296 PolarHBondContact O-NH1 3.47Å
63	C	93.7	Very high	84.4	Confident	12 Å²	12	66.4 Å²	66.4	8%	0.081	35%	0.345	C	S	.	.			trans	-117.4	149.2	170.1	179.5	0	0	0	0	109.1	Y61 P65 L68 F76 W272	Y61-C63 PolarHBondContact O-N 3.23Å; C63-P65 VanDerWaalsContact O-CD 3.29Å; C63-P65 WeakPolarHBondContact O-CD 3.28Å; C63-L68 VanDerWaalsContact SG-CD1 3.55Å; C63-F76 HydrophobicContact CB-CD1 4.32Å; C63-F76 HydrophobicContact CB-CD2 4.4Å; C63-F76 HydrophobicContact CB-CE1 3.58Å; C63-F76 HydrophobicContact CB-CE2 3.68Å; C63-F76 HydrophobicContact CB-CZ 3.22Å; C63-W272 HydrophobicContact CB-CZ3 4.45Å
64	S	94.8	Very high	86.8	Confident	48 Å²	48	68.8 Å²	68.8	34%	0.336	36%	0.36	S	S	.	.			trans	-101.1	91.8	170	-49.1	0	0	0	0	109.1	D66 L67 E273	S64-D66 PolarHBondContact O-N 3.49Å; S64-L67 PolarHBondContact O-N 3.43Å; S64-E273 VanDerWaalsContact CB-OE1 3.29Å; S64-E273 WeakPolarHBondContact CB-OE1 3.39Å; S64-E273 PolarHBondContact N-OE1 2.89Å; S64-E273 PolarHBondContact OG-OE1 3.47Å
65	P	89.6	Confident	89	Confident	59 Å²	59	69 Å²	69	38%	0.383	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-57.7	-28.7	-171.3	-25	36.1	0	0	0	113.5	C63 L67 L68 R73	C63-P65 VanDerWaalsContact O-CD 3.29Å; C63-P65 WeakPolarHBondContact O-CD 3.28Å; P65-L67 PolarHBondContact O-N 2.67Å; P65-L68 WeakPolarHBondContact O-CB 3.37Å; P65-L68 PolarHBondContact O-N 2.95Å; P65-L68 VanDerWaalsContact O-N 3.11Å; P65-R73 HydrophobicContact CB-CG 4.22Å; P65-R73 PolarHBondContact O-NE 2.97Å; P65-R73 PolarHBondContact O-NH2 3.41Å
66	D	92.2	Very high	91	Very high	133 Å²	133	63.7 Å²	63.7	71%	0.711	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-62.6	-25.9	177.6	-59.3	-46.8	0	0	0	113.7	S64 R73	S64-D66 PolarHBondContact O-N 3.49Å; D66-R73 PolarHBondContact O-NH2 2.93Å; D66-R73 VanDerWaalsContact O-NH2 3.08Å
67	L	95.2	Very high	92.6	Very high	63 Å²	63	57.8 Å²	57.8	33%	0.33	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-90.4	-14.6	177.8	-60.2	178.1	0	0	0	112.8	S64 P65 K271 E273	S64-L67 PolarHBondContact O-N 3.43Å; P65-L67 PolarHBondContact O-N 2.67Å; L67-K271 HydrophobicContact CD1-CD 3.58Å; L67-E273 HydrophobicContact CB-CB 3.69Å; L67-E273 HydrophobicContact CB-CG 4Å
68	L	95.9	Very high	93.7	Very high	3 Å²	3	60.4 Å²	60.4	2%	0.016	31%	0.312	C	S	.	.	S	Bend	trans	-71.7	138.1	169	-70	174	0	0	0	109.3	C63 P65 V72 R73 F76 W272 E273 V276	C63-L68 VanDerWaalsContact SG-CD1 3.55Å; P65-L68 WeakPolarHBondContact O-CB 3.37Å; P65-L68 PolarHBondContact O-N 2.95Å; P65-L68 VanDerWaalsContact O-N 3.11Å; L68-V72 HydrophobicContact CD2-CG1 4.42Å; L68-R73 HydrophobicContact CB-CB 4.09Å; L68-R73 PolarHBondContact O-NH2 3.08Å; L68-R73 VanDerWaalsContact O-NH2 3.12Å; L68-F76 HydrophobicContact CD1-CB 3.76Å; L68-F76 HydrophobicContact CD1-CD2 4.23Å; L68-F76 HydrophobicContact CD1-CG 4Å; L68-W272 HydrophobicContact CD2-CZ3 4.22Å; L68-E273 HydrophobicContact CD2-CB 3.77Å; L68-E273 HydrophobicContact CD2-CG 4.08Å; L68-E273 HydrophobicContact CG-CB 4.06Å; L68-E273 HydrophobicContact CG-CG 4.05Å; L68-V276 HydrophobicContact CD2-CB 4.3Å; L68-V276 HydrophobicContact CD2-CG1 3.91Å
69	G	93.2	Very high	94.6	Very high	20 Å²	20	56.8 Å²	56.8	21%	0.206	30%	0.296	C	S	.	.			trans	-60.7	151.7	172.6	0	0	0	0	0	111.7	V71 V72 R73 T277	G69-V71 PolarHBondContact O-N 2.85Å; G69-V71 VanDerWaalsContact O-N 3.08Å; G69-V72 PolarHBondContact O-N 2.95Å; G69-R73 PolarHBondContact O-N 2.75Å; G69-T277 PolarHBondContact N-OG1 2.84Å
70	E	93.9	Very high	95	Very high	172 Å²	172	57 Å²	57	80%	0.804	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-34.8	-172.4	-62.8	-175.8	164.4	0	0	113.6	P74	E70-P74 WeakPolarHBondContact O-CD 3.22Å
71	V	92.8	Very high	95	Very high	73 Å²	73	56.4 Å²	56.4	44%	0.442	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-38.2	178.6	179	0	0	0	0	112.2	G69	G69-V71 PolarHBondContact O-N 2.85Å; G69-V71 VanDerWaalsContact O-N 3.08Å
72	V	96.1	Very high	95	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.006	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-30.5	-171.6	-175.3	0	0	0	0	111.9	L68 G69 L75 F76 V276 S280 V294	L68-V72 HydrophobicContact CD2-CG1 4.42Å; G69-V72 PolarHBondContact O-N 2.95Å; V72-L75 WeakPolarHBondContact O-CA 3.41Å; V72-L75 WeakPolarHBondContact O-CB 3.43Å; V72-L75 PolarHBondContact O-N 2.95Å; V72-F76 PolarHBondContact O-N 2.88Å; V72-V276 HydrophobicContact CG1-CG1 3.9Å; V72-S280 VanDerWaalsContact CG2-CB 3.44Å; V72-V294 HydrophobicContact CG1-CG1 3.68Å
73	R	96.9	Very high	95	Very high	100 Å²	100	61 Å²	61	38%	0.377	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-47.7	-49.3	178.6	-174.7	-176.5	-60.7	174.9	3.8	114.3	P65 D66 L68 G69 L75 F76	P65-R73 HydrophobicContact CB-CG 4.22Å; P65-R73 PolarHBondContact O-NE 2.97Å; P65-R73 PolarHBondContact O-NH2 3.41Å; D66-R73 PolarHBondContact O-NH2 2.93Å; D66-R73 VanDerWaalsContact O-NH2 3.08Å; L68-R73 HydrophobicContact CB-CB 4.09Å; L68-R73 PolarHBondContact O-NH2 3.08Å; L68-R73 VanDerWaalsContact O-NH2 3.12Å; G69-R73 PolarHBondContact O-N 2.75Å; R73-L75 PolarHBondContact O-N 2.65Å; R73-F76 PolarHBondContact O-N 2.88Å
74	P	97.1	Very high	95	Very high	96 Å²	96	64 Å²	64	62%	0.623	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-72.6	-12.6	179.4	30.4	-37.1	0	0	0	113.9	E70	E70-P74 WeakPolarHBondContact O-CD 3.22Å
75	L	97.6	Very high	95	Very high	38 Å²	38	61.8 Å²	61.8	20%	0.199	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-91.9	-10.1	179.3	-50.1	178	0	0	0	112	V72 R73 V77 V291 A293 V294	V72-L75 WeakPolarHBondContact O-CA 3.41Å; V72-L75 WeakPolarHBondContact O-CB 3.43Å; V72-L75 PolarHBondContact O-N 2.95Å; R73-L75 PolarHBondContact O-N 2.65Å; L75-V77 PolarHBondContact O-N 3.37Å; L75-V291 HydrophobicContact CD1-CB 4.03Å; L75-V291 HydrophobicContact CD1-CG1 4.04Å; L75-V291 VanDerWaalsContact CD1-O 3.29Å; L75-V291 WeakPolarHBondContact CD1-O 3.32Å; L75-A293 WeakPolarHBondContact O-CA 3.3Å; L75-V294 PolarHBondContact O-N 3.26Å
76	F	98	Very high	95.1	Very high	32 Å²	32	62.3 Å²	62.3	14%	0.14	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-70.8	128.1	179.9	-179.9	-100.2	0	0	0	111.3	C63 L68 V72 R73 Q78 W272 V294 R296	C63-F76 HydrophobicContact CB-CD1 4.32Å; C63-F76 HydrophobicContact CB-CD2 4.4Å; C63-F76 HydrophobicContact CB-CE1 3.58Å; C63-F76 HydrophobicContact CB-CE2 3.68Å; C63-F76 HydrophobicContact CB-CZ 3.22Å; L68-F76 HydrophobicContact CD1-CB 3.76Å; L68-F76 HydrophobicContact CD1-CD2 4.23Å; L68-F76 HydrophobicContact CD1-CG 4Å; V72-F76 PolarHBondContact O-N 2.88Å; R73-F76 PolarHBondContact O-N 2.88Å; F76-Q78 HydrophobicContact CE1-CB 4.04Å; F76-W272 HydrophobicContact CD2-CH2 4.15Å; F76-W272 HydrophobicContact CD2-CZ3 4.4Å; F76-W272 AromaticContact CE2-CH2 3.81Å; F76-W272 HydrophobicContact CE2-CH2 3.81Å; F76-W272 HydrophobicContact CE2-CZ3 4.14Å; F76-V294 CarbonylContact C-O 3.57Å; F76-V294 VanDerWaalsContact CA-O 3.32Å; F76-V294 WeakPolarHBondContact CA-O 3.15Å; F76-V294 HydrophobicContact CB-CG1 4.4Å; F76-V294 HydrophobicContact CD2-CG1 4.35Å; F76-R296 HydrophobicContact CE2-CB 4.22Å
77	V	97.8	Very high	95.2	Very high	20 Å²	20	57.4 Å²	57.4	12%	0.121	30%	0.296	C	S	.	.			trans	-109	112.7	177	-178.4	0	0	0	0	108.1	L75 S79 Q140 L141 A293 V294 T295	L75-V77 PolarHBondContact O-N 3.37Å; V77-S79 PolarHBondContact O-N 3.37Å; V77-Q140 HydrophobicContact CG1-CG 3.89Å; V77-Q140 VanDerWaalsContact CG1-NE2 3.28Å; V77-L141 HydrophobicContact CB-CD1 4.37Å; V77-L141 HydrophobicContact CG2-CD1 4.32Å; V77-A293 HydrophobicContact CG2-CB 4.15Å; V77-V294 PolarHBondContact N-O 2.91Å; V77-T295 VanDerWaalsContact O-CB 3.23Å; V77-T295 WeakPolarHBondContact O-CB 3.41Å; V77-T295 PolarHBondContact O-OG1 3.4Å
78	Q	96.8	Very high	95	Very high	71 Å²	71	54.8 Å²	54.8	33%	0.332	28%	0.282	S	S	.	.			trans	-69.4	122.9	175.6	-176	62.5	60.5	0	0	109.8	Y61 F76 Q140	Y61-Q78 PolarHBondContact O-NE2 3.26Å; F76-Q78 HydrophobicContact CE1-CB 4.04Å; Q78-Q140 PolarHBondContact O-NE2 3.12Å
79	S	96.4	Very high	94.7	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.021	29%	0.285	C	S	.	.			trans	-106.6	167.6	174.1	-69.5	0	0	0	0	110.5	Y61 V77 T295 L297	Y61-S79 VanDerWaalsContact CB-O 3.25Å; Y61-S79 WeakPolarHBondContact CB-O 3.3Å; V77-S79 PolarHBondContact O-N 3.37Å; S79-T295 WeakPolarHBondContact CB-OG1 3.24Å; S79-T295 PolarHBondContact OG-OG1 3.15Å; S79-L297 VanDerWaalsContact CB-CD2 3.5Å
80	H	95	Very high	94.4	Very high	106 Å²	106	61.8 Å²	61.8	49%	0.491	30%	0.303	S	S	.	.			trans	-144.2	164.5	179.4	-61.4	-73.7	0	0	0	110.9	D82 Q137	H80-D82 PolarHBondContact O-N 3.33Å; H80-Q137 PolarHBondContact O-NE2 3.5Å
81	L	94.2	Very high	94.1	Very high	34 Å²	34	59.6 Å²	59.6	18%	0.178	29%	0.287	C	S	.	.			trans	-61.3	118.6	170	-176.6	72.5	0	0	0	110	Y61 T85 Q86 L89	Y61-L81 HydrophobicContact CE2-CB 3.95Å; L81-T85 HydrophobicContact CD1-CG2 3.56Å; L81-Q86 HydrophobicContact CD1-CG 4.21Å; L81-Q86 HydrophobicContact CD2-CG 3.97Å; L81-Q86 HydrophobicContact CG-CG 3.97Å; L81-L89 HydrophobicContact CD1-CD1 4.4Å
82	D	93.6	Very high	93.6	Very high	29 Å²	29	56.2 Å²	56.2	16%	0.155	27%	0.267	C	S	.	.			trans	-114.9	-179.6	-179.8	63.7	20.7	0	0	0	112.8	H80 D84 T85 Q86 S134 Q137	H80-D82 PolarHBondContact O-N 3.33Å; D82-D84 PolarHBondContact O-N 2.85Å; D82-D84 PolarHBondContact OD1-N 2.79Å; D82-T85 PolarHBondContact O-N 2.94Å; D82-T85 VanDerWaalsContact OD1-CB 3.24Å; D82-T85 WeakPolarHBondContact OD1-CB 3.32Å; D82-T85 PolarHBondContact OD1-N 2.98Å; D82-T85 PolarHBondContact OD1-OG1 2.83Å; D82-Q86 VanDerWaalsContact O-CG 3.31Å; D82-Q86 WeakPolarHBondContact O-CG 3.31Å; D82-Q86 PolarHBondContact O-N 3.43Å; D82-S134 WeakPolarHBondContact OD2-CB 3.42Å; D82-S134 PolarHBondContact OD2-OG 3.27Å; D82-Q137 VanDerWaalsContact OD2-CD 3.26Å; D82-Q137 WeakPolarHBondContact OD2-CG 3.37Å; D82-Q137 PolarHBondContact OD2-NE2 3.49Å
83	Q	94.4	Very high	92.9	Very high	168 Å²	168	58.2 Å²	58.2	79%	0.785	28%	0.277	S	S	*	.	H	α-helix	trans	-65	-38.3	-175.6	-63.1	-176.6	15.2	0	0	112.4	Q86 A87	Q83-Q86 PolarHBondContact O-N 3Å; Q83-A87 WeakPolarHBondContact O-CB 3.44Å; Q83-A87 PolarHBondContact O-N 3.29Å
84	D	94.5	Very high	91.9	Very high	76 Å²	76	59.2 Å²	59.2	41%	0.406	29%	0.286	S	S	.	.	H	α-helix	trans	-69.3	-41.2	-179.9	-79.1	-3.8	0	0	0	111.4	D82 A87 F88 F131	D82-D84 PolarHBondContact O-N 2.85Å; D82-D84 PolarHBondContact OD1-N 2.79Å; D84-A87 PolarHBondContact O-N 3.01Å; D84-F88 PolarHBondContact O-N 3.44Å; D84-F131 HydrophobicContact CB-CE2 4.27Å; D84-F131 HydrophobicContact CB-CZ 4.38Å
85	T	93.1	Very high	90.8	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-47.3	173.3	-50.5	0	0	0	0	109.9	L81 D82 A87 F88 L89 F131 L300	L81-T85 HydrophobicContact CD1-CG2 3.56Å; D82-T85 PolarHBondContact O-N 2.94Å; D82-T85 VanDerWaalsContact OD1-CB 3.24Å; D82-T85 WeakPolarHBondContact OD1-CB 3.32Å; D82-T85 PolarHBondContact OD1-N 2.98Å; D82-T85 PolarHBondContact OD1-OG1 2.83Å; T85-A87 VanDerWaalsContact C-N 3.31Å; T85-A87 PolarHBondContact O-N 3.09Å; T85-F88 PolarHBondContact O-N 2.6Å; T85-L89 WeakPolarHBondContact O-CG 3.32Å; T85-L89 PolarHBondContact O-N 2.81Å; T85-F131 HydrophobicContact CG2-CE1 4.05Å; T85-F131 WeakPolarHBondContact OG1-CE1 3.43Å; T85-F131 WeakPolarHBondContact OG1-CZ 3.46Å; T85-L300 HydrophobicContact CG2-CD1 3.75Å
86	Q	93.3	Very high	89.2	Confident	71 Å²	71	57 Å²	57	33%	0.332	27%	0.267	S	S	.	.	H	α-helix	trans	-59.8	-40.3	175.3	-72.7	179.4	12.1	0	0	112.3	L81 D82 Q83 L89 R90	L81-Q86 HydrophobicContact CD1-CG 4.21Å; L81-Q86 HydrophobicContact CD2-CG 3.97Å; L81-Q86 HydrophobicContact CG-CG 3.97Å; D82-Q86 VanDerWaalsContact O-CG 3.31Å; D82-Q86 WeakPolarHBondContact O-CG 3.31Å; D82-Q86 PolarHBondContact O-N 3.43Å; Q83-Q86 PolarHBondContact O-N 3Å; Q86-L89 PolarHBondContact O-N 2.9Å; Q86-R90 WeakPolarHBondContact O-CG 3.4Å; Q86-R90 PolarHBondContact O-N 3.35Å
87	A	92.9	Very high	87.3	Confident	30 Å²	30	56.8 Å²	56.8	25%	0.248	27%	0.274	C	S	.	.	H	α-helix	trans	-64.4	-41.2	177.1	0	0	0	0	0	111.6	Q83 D84 T85 R90 R91	Q83-A87 WeakPolarHBondContact O-CB 3.44Å; Q83-A87 PolarHBondContact O-N 3.29Å; D84-A87 PolarHBondContact O-N 3.01Å; T85-A87 VanDerWaalsContact C-N 3.31Å; T85-A87 PolarHBondContact O-N 3.09Å; A87-R90 PolarHBondContact O-N 2.9Å; A87-R91 WeakPolarHBondContact O-CB 3.42Å; A87-R91 WeakPolarHBondContact O-CG 3.3Å; A87-R91 PolarHBondContact O-N 2.92Å
88	F	90.9	Very high	85.4	Confident	8 Å²	8	64.1 Å²	64.1	4%	0.035	30%	0.3	C	S	.	.	H	α-helix	trans	-61.3	-45.3	174.1	-177.4	-88.4	0	0	0	112	D84 T85 R91 S92 S129 F131 L300 E302	D84-F88 PolarHBondContact O-N 3.44Å; T85-F88 PolarHBondContact O-N 2.6Å; F88-R91 PolarHBondContact O-N 3.27Å; F88-S92 WeakPolarHBondContact CE1-OG 3.44Å; F88-S92 WeakPolarHBondContact O-CB 3.36Å; F88-S92 PolarHBondContact O-N 2.94Å; F88-S92 PolarHBondContact O-OG 2.77Å; F88-S129 WeakPolarHBondContact CZ-O 3.36Å; F88-F131 HydrophobicContact CB-CB 4.44Å; F88-F131 HydrophobicContact CB-CD2 4.01Å; F88-F131 HydrophobicContact CB-CG 4.21Å; F88-F131 HydrophobicContact CD1-CB 3.91Å; F88-F131 HydrophobicContact CD1-CG 4.41Å; F88-F131 HydrophobicContact CD2-CB 3.53Å; F88-F131 HydrophobicContact CD2-CD2 4.09Å; F88-F131 HydrophobicContact CD2-CG 4.11Å; F88-F131 HydrophobicContact CE1-CB 4.02Å; F88-F131 HydrophobicContact CE2-CB 3.63Å; F88-F131 HydrophobicContact CG-CB 3.67Å; F88-F131 HydrophobicContact CG-CD2 4.11Å; F88-F131 AromaticContact CG-CG 3.97Å; F88-F131 HydrophobicContact CG-CG 3.97Å; F88-F131 HydrophobicContact CZ-CB 3.87Å; F88-L300 HydrophobicContact CD1-CB 3.97Å; F88-L300 HydrophobicContact CD1-CD1 4.09Å; F88-L300 HydrophobicContact CE1-CB 3.62Å; F88-L300 HydrophobicContact CZ-CB 4.45Å; F88-E302 HydrophobicContact CE2-CG 4.32Å; F88-E302 HydrophobicContact CZ-CG 3.94Å
89	L	89.4	Confident	83	Confident	17 Å²	17	65.5 Å²	65.5	9%	0.089	31%	0.307	C	S	.	.	H	α-helix	trans	-61.7	-46.4	177.4	-66	175	0	0	0	111.6	W60 L81 T85 Q86 R91 S92 I93 L300 Y309	W60-L89 HydrophobicContact CH2-CD1 4.4Å; W60-L89 HydrophobicContact CH2-CD2 4.44Å; W60-L89 HydrophobicContact CZ3-CD1 4.21Å; L81-L89 HydrophobicContact CD1-CD1 4.4Å; T85-L89 WeakPolarHBondContact O-CG 3.32Å; T85-L89 PolarHBondContact O-N 2.81Å; Q86-L89 PolarHBondContact O-N 2.9Å; L89-R91 PolarHBondContact O-N 2.93Å; L89-S92 WeakPolarHBondContact O-CB 3.49Å; L89-S92 PolarHBondContact O-N 3.1Å; L89-I93 WeakPolarHBondContact O-CD1 3.36Å; L89-I93 VanDerWaalsContact O-CG1 3.28Å; L89-I93 WeakPolarHBondContact O-CG1 3.41Å; L89-I93 PolarHBondContact O-N 2.84Å; L89-L300 HydrophobicContact CD2-CD1 3.88Å; L89-L300 HydrophobicContact CD2-CD2 4.09Å; L89-L300 HydrophobicContact CG-CD1 4.35Å; L89-Y309 HydrophobicContact CD2-CD1 3.89Å; L89-Y309 HydrophobicContact CD2-CD2 3.84Å; L89-Y309 HydrophobicContact CD2-CE1 3.83Å; L89-Y309 HydrophobicContact CD2-CE2 3.77Å; L89-Y309 HydrophobicContact CD2-CG 3.9Å
90	R	88.1	Confident	80.5	Confident	152 Å²	152	74.2 Å²	74.2	57%	0.574	35%	0.345	S	S	*	.	H	α-helix	trans	-59.1	-47.9	176.3	-72.1	177.3	-166.6	159.3	8.6	111.6	Q86 A87 S92 I93 E94	Q86-R90 WeakPolarHBondContact O-CG 3.4Å; Q86-R90 PolarHBondContact O-N 3.35Å; A87-R90 PolarHBondContact O-N 2.9Å; R90-S92 VanDerWaalsContact C-N 3.3Å; R90-S92 PolarHBondContact O-N 2.9Å; R90-I93 PolarHBondContact O-N 3.44Å; R90-E94 WeakPolarHBondContact O-CG 3.4Å; R90-E94 PolarHBondContact O-N 2.92Å
91	R	86.3	Confident	78.1	Confident	126 Å²	126	71.3 Å²	71.3	48%	0.475	34%	0.335	S	S	.	.	H	α-helix	trans	-60.3	-39.7	176.6	-74.3	-172	-56.9	-121.5	0.6	112.4	A87 F88 L89 E94 K95	A87-R91 WeakPolarHBondContact O-CB 3.42Å; A87-R91 WeakPolarHBondContact O-CG 3.3Å; A87-R91 PolarHBondContact O-N 2.92Å; F88-R91 PolarHBondContact O-N 3.27Å; L89-R91 PolarHBondContact O-N 2.93Å; R91-E94 PolarHBondContact O-N 3.15Å; R91-K95 WeakPolarHBondContact O-CB 3.43Å; R91-K95 WeakPolarHBondContact O-CG 3.33Å; R91-K95 PolarHBondContact O-N 2.79Å
92	S	83.4	Confident	75.9	Confident	2 Å²	2	70.9 Å²	70.9	1%	0.014	33%	0.332	C	S	.	.	H	α-helix	trans	-63.7	-44.9	178.2	-59.8	0	0	0	0	111.2	F88 L89 R90 K95 S96 D308	F88-S92 WeakPolarHBondContact CE1-OG 3.44Å; F88-S92 WeakPolarHBondContact O-CB 3.36Å; F88-S92 PolarHBondContact O-N 2.94Å; F88-S92 PolarHBondContact O-OG 2.77Å; L89-S92 WeakPolarHBondContact O-CB 3.49Å; L89-S92 PolarHBondContact O-N 3.1Å; R90-S92 VanDerWaalsContact C-N 3.3Å; R90-S92 PolarHBondContact O-N 2.9Å; S92-K95 PolarHBondContact O-N 2.89Å; S92-S96 WeakPolarHBondContact O-CB 3.14Å; S92-S96 PolarHBondContact O-N 3.04Å; S92-D308 WeakPolarHBondContact CB-O 3.43Å
93	I	80.3	Confident	73.5	Confident	43 Å²	43	73.7 Å²	73.7	22%	0.221	34%	0.343	C	S	.	.	H	α-helix	trans	-63.3	-43.6	175.3	-66.9	163.4	0	0	0	111.6	M44 L89 R90 S96 G97 D308 Y309	M44-I93 HydrophobicContact CE-CG2 3.31Å; M44-I93 HydrophobicContact SD-CG2 3.86Å; L89-I93 WeakPolarHBondContact O-CD1 3.36Å; L89-I93 VanDerWaalsContact O-CG1 3.28Å; L89-I93 WeakPolarHBondContact O-CG1 3.41Å; L89-I93 PolarHBondContact O-N 2.84Å; R90-I93 PolarHBondContact O-N 3.44Å; I93-S96 PolarHBondContact O-N 3.25Å; I93-S96 PolarHBondContact O-OG 3.46Å; I93-G97 PolarHBondContact O-N 2.9Å; I93-D308 HydrophobicContact CB-CB 4.48Å; I93-D308 HydrophobicContact CG1-CB 3.77Å; I93-Y309 HydrophobicContact CG1-CD1 4.48Å
94	E	77.7	Confident	71	Confident	121 Å²	121	71 Å²	71	57%	0.565	33%	0.326	S	S	*	.	H	α-helix	trans	-62.9	-47.7	177.5	-74.6	174.2	-172.5	0	0	111.3	R90 R91 S96 G97 W98	R90-E94 WeakPolarHBondContact O-CG 3.4Å; R90-E94 PolarHBondContact O-N 2.92Å; R91-E94 PolarHBondContact O-N 3.15Å; E94-S96 PolarHBondContact O-N 3.17Å; E94-G97 CarbonylContact O-C 3.57Å; E94-G97 WeakPolarHBondContact O-CA 3.29Å; E94-G97 PolarHBondContact O-N 2.86Å; E94-W98 PolarHBondContact O-N 2.9Å
95	K	71.9	Confident	68.5	Low	73 Å²	73	68.5 Å²	68.5	32%	0.317	31%	0.312	S	S	.	.	H	α-helix	trans	-64.2	-37	178.9	-80.3	-176.3	174.6	-174.1	0	112.7	R91 S92 G97 W98 G126 R127 E302	R91-K95 WeakPolarHBondContact O-CB 3.43Å; R91-K95 WeakPolarHBondContact O-CG 3.33Å; R91-K95 PolarHBondContact O-N 2.79Å; S92-K95 PolarHBondContact O-N 2.89Å; K95-G97 PolarHBondContact O-N 3.06Å; K95-W98 PolarHBondContact O-N 2.88Å; K95-G126 PolarHBondContact NZ-O 3.41Å; K95-R127 PolarHBondContact O-NH2 3.45Å; K95-E302 VanDerWaalsContact CD-OE1 3.23Å; K95-E302 WeakPolarHBondContact CD-OE1 3.32Å; K95-E302 WeakPolarHBondContact CE-OE1 3.44Å; K95-E302 IonicContact NZ-OE1 2.67Å; K95-E302 PolarHBondContact NZ-OE1 2.9Å; K95-E302 IonicContact NZ-OE2 3.3Å; K95-E302 PolarHBondContact NZ-OE2 3.13Å
96	S	65.7	Low	66	Low	15 Å²	15	71.6 Å²	71.6	11%	0.105	33%	0.334	C	S	.	.	H	α-helix	trans	-65	-32.7	172.9	86.9	0	0	0	0	110.9	R40 S92 I93 E94 W98 D308	R40-S96 PolarHBondContact NH2-OG 3.35Å; S92-S96 WeakPolarHBondContact O-CB 3.14Å; S92-S96 PolarHBondContact O-N 3.04Å; I93-S96 PolarHBondContact O-N 3.25Å; I93-S96 PolarHBondContact O-OG 3.46Å; E94-S96 PolarHBondContact O-N 3.17Å; S96-W98 VanDerWaalsContact C-N 3.33Å; S96-W98 PolarHBondContact O-N 3.34Å; S96-D308 WeakPolarHBondContact CB-OD1 3.31Å; S96-D308 PolarHBondContact OG-OD1 3.31Å
97	G	56.7	Low	63.4	Low	28 Å²	28	74.7 Å²	74.7	29%	0.289	35%	0.346	S	S	.	.	H	α-helix	trans	-70.6	-18.3	177.7	0	0	0	0	0	115.6	I93 E94 K95 M99	I93-G97 PolarHBondContact O-N 2.9Å; E94-G97 CarbonylContact O-C 3.57Å; E94-G97 WeakPolarHBondContact O-CA 3.29Å; E94-G97 PolarHBondContact O-N 2.86Å; K95-G97 PolarHBondContact O-N 3.06Å; G97-M99 VanDerWaalsContact C-N 3.27Å; G97-M99 PolarHBondContact O-N 3.21Å
98	W	59.3	Low	60.9	Low	174 Å²	174	74.4 Å²	74.4	66%	0.659	34%	0.34	S	S	*	.			trans	-74.3	81.8	177.5	-73	25.7	0	0	0	110.7	E94 K95 S96 F100 T101	E94-W98 PolarHBondContact O-N 2.9Å; K95-W98 PolarHBondContact O-N 2.88Å; S96-W98 VanDerWaalsContact C-N 3.33Å; S96-W98 PolarHBondContact O-N 3.34Å; W98-F100 PolarHBondContact O-N 2.87Å; W98-T101 VanDerWaalsContact CB-OG1 3.31Å; W98-T101 WeakPolarHBondContact CB-OG1 3.47Å; W98-T101 PolarHBondContact O-N 2.95Å; W98-T101 VanDerWaalsContact O-N 3.15Å; W98-T101 PolarHBondContact O-OG1 2.96Å
99	M	46.8	Very low	58.4	Low	99 Å²	99	75.7 Å²	75.7	49%	0.488	35%	0.351	S	S	.	.	H	α-helix	trans	-50.8	-28.9	179.4	-71.9	-80.2	-75.1	0	0	113.8	G97 Q102 F103	G97-M99 VanDerWaalsContact C-N 3.27Å; G97-M99 PolarHBondContact O-N 3.21Å; M99-Q102 PolarHBondContact O-N 3.1Å; M99-F103 WeakPolarHBondContact O-CD2 3.45Å
100	F	42.9	Very low	56.1	Low	186 Å²	186	80.1 Å²	80.1	82%	0.816	38%	0.378	S	S	*	.	H	α-helix	trans	-75.9	-33.8	-179.5	-92.7	-87.5	0	0	0	114.2	W98 Q102 F103 Y104	W98-F100 PolarHBondContact O-N 2.87Å; F100-Q102 VanDerWaalsContact C-N 3.26Å; F100-Q102 PolarHBondContact O-N 3.35Å; F100-F103 PolarHBondContact O-N 3.35Å; F100-Y104 PolarHBondContact O-N 3.25Å
101	T	44.8	Very low	53.8	Low	46 Å²	46	77.3 Å²	77.3	28%	0.282	38%	0.378	S	S	.	.	H	α-helix	trans	-70.2	-23.3	173.1	32.9	0	0	0	0	112.9	W98 Y104 H105 R127	W98-T101 VanDerWaalsContact CB-OG1 3.31Å; W98-T101 WeakPolarHBondContact CB-OG1 3.47Å; W98-T101 PolarHBondContact O-N 2.95Å; W98-T101 VanDerWaalsContact O-N 3.15Å; W98-T101 PolarHBondContact O-OG1 2.96Å; T101-Y104 PolarHBondContact O-N 3.12Å; T101-H105 PolarHBondContact O-CD2 2.78Å; T101-H105 PolarHBondContact O-N 3.26Å; T101-R127 VanDerWaalsContact CB-NH2 3.31Å; T101-R127 PolarHBondContact OG1-NH2 3.21Å
102	Q	48.2	Very low	51.3	Low	24 Å²	24	74.1 Å²	74.1	11%	0.112	37%	0.37	C	S	.	.	H	α-helix	trans	-70.4	-38.5	175.5	-69.6	-70.1	-2	0	0	112.7	M99 F100 Y104 H105 S106 M305	M99-Q102 PolarHBondContact O-N 3.1Å; F100-Q102 VanDerWaalsContact C-N 3.26Å; F100-Q102 PolarHBondContact O-N 3.35Å; Q102-Y104 VanDerWaalsContact C-N 3.35Å; Q102-H105 PolarHBondContact O-N 3.33Å; Q102-S106 PolarHBondContact O-N 3.08Å; Q102-M305 VanDerWaalsContact OE1-CE 3.31Å
103	F	43	Very low	49.4	Very low	88 Å²	88	77.1 Å²	77.1	39%	0.386	39%	0.391	S	S	.	.	H	α-helix	trans	-67.1	-36.3	172.6	-72.5	-72.7	0	0	0	112.2	M28 M99 F100 F107	M28-F103 HydrophobicContact CE-CE1 4.11Å; M99-F103 WeakPolarHBondContact O-CD2 3.45Å; F100-F103 PolarHBondContact O-N 3.35Å; F103-F107 WeakPolarHBondContact O-CB 3.43Å; F103-F107 PolarHBondContact O-N 3.07Å; F103-F107 VanDerWaalsContact O-N 3.11Å
104	Y	41.9	Very low	47.7	Very low	111 Å²	111	80.3 Å²	80.3	44%	0.435	41%	0.414	S	S	.	.	H	α-helix	trans	-66.1	-41.3	175	-173.2	-113.8	0	0	0	112.2	F100 T101 Q102 F107 I108 L125	F100-Y104 PolarHBondContact O-N 3.25Å; T101-Y104 PolarHBondContact O-N 3.12Å; Q102-Y104 VanDerWaalsContact C-N 3.35Å; Y104-F107 PolarHBondContact O-N 3.11Å; Y104-I108 HydrophobicContact CD1-CG1 4.06Å; Y104-I108 HydrophobicContact CD2-CD1 4.49Å; Y104-I108 HydrophobicContact CD2-CG1 3.92Å; Y104-I108 HydrophobicContact CE1-CD1 4.28Å; Y104-I108 HydrophobicContact CE1-CG1 3.82Å; Y104-I108 HydrophobicContact CE2-CD1 3.74Å; Y104-I108 HydrophobicContact CE2-CG1 3.63Å; Y104-I108 HydrophobicContact CG-CG1 4.11Å; Y104-I108 VanDerWaalsContact O-CB 3.25Å; Y104-I108 WeakPolarHBondContact O-CB 3.39Å; Y104-I108 WeakPolarHBondContact O-CG1 3.25Å; Y104-I108 PolarHBondContact O-N 3.2Å; Y104-L125 HydrophobicContact CD1-CD2 3.55Å; Y104-L125 HydrophobicContact CE1-CD2 3.22Å
105	H	41.8	Very low	45.7	Very low	25 Å²	25	81.8 Å²	81.8	12%	0.116	43%	0.425	C	S	.	.	H	α-helix	trans	-62.3	-42.7	174.8	-97.6	-97	0	0	0	113.4	T101 Q102 F107 S109 L125 R127	T101-H105 PolarHBondContact O-CD2 2.78Å; T101-H105 PolarHBondContact O-N 3.26Å; Q102-H105 PolarHBondContact O-N 3.33Å; H105-F107 VanDerWaalsContact C-N 3.34Å; H105-S109 WeakPolarHBondContact O-CA 3.33Å; H105-S109 WeakPolarHBondContact O-CB 3.49Å; H105-S109 PolarHBondContact O-N 3.21Å; H105-L125 WeakPolarHBondContact CE1-CD1 3.34Å; H105-L125 VanDerWaalsContact ND1-CD1 3.31Å; H105-L125 WeakPolarHBondContact ND1-CD1 3.46Å; H105-L125 WeakPolarHBondContact NE2-CB 3.25Å; H105-L125 VanDerWaalsContact NE2-CD1 3.3Å; H105-L125 WeakPolarHBondContact NE2-CD1 3.33Å; H105-R127 PolarHBondContact CD2-NH1 3.4Å; H105-R127 VanDerWaalsContact NE2-CD 3.33Å; H105-R127 WeakPolarHBondContact NE2-CD 3.33Å; H105-R127 PolarHBondContact NE2-NH1 3.03Å; H105-R127 VanDerWaalsContact NE2-NH1 3.19Å
106	S	41	Very low	44.1	Very low	64 Å²	64	80.8 Å²	80.8	45%	0.448	43%	0.425	S	S	.	.	H	α-helix	trans	-67.6	-37.5	178	-165.3	0	0	0	0	111.4	Q102 T110	Q102-S106 PolarHBondContact O-N 3.08Å; S106-T110 VanDerWaalsContact O-CB 3.3Å; S106-T110 WeakPolarHBondContact O-CB 3.39Å; S106-T110 PolarHBondContact O-N 3.38Å; S106-T110 VanDerWaalsContact O-N 3.13Å; S106-T110 PolarHBondContact O-OG1 3.4Å
107	F	39	Very low	43.4	Very low	136 Å²	136	82.8 Å²	82.8	60%	0.596	44%	0.439	S	S	*	.	H	α-helix	trans	-69.4	-48	175.9	-172.3	-104.6	0	0	0	112.7	F103 Y104 H105 T110 V111	F103-F107 WeakPolarHBondContact O-CB 3.43Å; F103-F107 PolarHBondContact O-N 3.07Å; F103-F107 VanDerWaalsContact O-N 3.11Å; Y104-F107 PolarHBondContact O-N 3.11Å; H105-F107 VanDerWaalsContact C-N 3.34Å; F107-T110 PolarHBondContact O-N 2.73Å; F107-V111 VanDerWaalsContact O-CG2 3.27Å; F107-V111 WeakPolarHBondContact O-CG2 3.47Å; F107-V111 PolarHBondContact O-N 3.1Å; F107-V111 VanDerWaalsContact O-N 3.15Å
108	I	39.7	Very low	43.1	Very low	24 Å²	24	91.1 Å²	91.1	12%	0.123	46%	0.462	C	S	.	.	H	α-helix	trans	-68.4	-42.8	179.1	-69.3	-78.7	0	0	0	111.3	Y104 T110 V111 L112 I121 L125	Y104-I108 HydrophobicContact CD1-CG1 4.06Å; Y104-I108 HydrophobicContact CD2-CD1 4.49Å; Y104-I108 HydrophobicContact CD2-CG1 3.92Å; Y104-I108 HydrophobicContact CE1-CD1 4.28Å; Y104-I108 HydrophobicContact CE1-CG1 3.82Å; Y104-I108 HydrophobicContact CE2-CD1 3.74Å; Y104-I108 HydrophobicContact CE2-CG1 3.63Å; Y104-I108 HydrophobicContact CG-CG1 4.11Å; Y104-I108 VanDerWaalsContact O-CB 3.25Å; Y104-I108 WeakPolarHBondContact O-CB 3.39Å; Y104-I108 WeakPolarHBondContact O-CG1 3.25Å; Y104-I108 PolarHBondContact O-N 3.2Å; I108-T110 VanDerWaalsContact C-N 3.34Å; I108-T110 PolarHBondContact O-N 3.4Å; I108-V111 PolarHBondContact O-N 2.97Å; I108-L112 HydrophobicContact CG2-CD1 3.54Å; I108-L112 HydrophobicContact CG2-CG 4.13Å; I108-L112 VanDerWaalsContact O-CB 3.28Å; I108-L112 WeakPolarHBondContact O-CB 3.32Å; I108-L112 WeakPolarHBondContact O-CG 3.36Å; I108-L112 PolarHBondContact O-N 3.42Å; I108-I121 HydrophobicContact CG2-CG2 4.37Å; I108-L125 HydrophobicContact CG2-CD1 4.44Å
109	S	39.5	Very low	42.6	Very low	36 Å²	36	86.5 Å²	86.5	25%	0.252	45%	0.453	S	S	.	.	H	α-helix	trans	-63.1	-40.2	177	-172.6	0	0	0	0	111.2	H105 V111 S113	H105-S109 WeakPolarHBondContact O-CA 3.33Å; H105-S109 WeakPolarHBondContact O-CB 3.49Å; H105-S109 PolarHBondContact O-N 3.21Å; S109-V111 VanDerWaalsContact C-N 3.32Å; S109-V111 PolarHBondContact O-N 3.41Å; S109-S113 WeakPolarHBondContact O-CA 3.2Å; S109-S113 WeakPolarHBondContact O-CB 2.69Å; S109-S113 PolarHBondContact O-N 3.24Å; S109-S113 PolarHBondContact O-OG 3.33Å; S109-S113 PolarHBondContact OG-OG 3.35Å
110	T	39.6	Very low	42.7	Very low	110 Å²	110	82.7 Å²	82.7	68%	0.675	44%	0.436	S	S	*	.	H	α-helix	trans	-68.4	-30.4	177.4	-54.9	0	0	0	0	112.8	S106 F107 I108	S106-T110 VanDerWaalsContact O-CB 3.3Å; S106-T110 WeakPolarHBondContact O-CB 3.39Å; S106-T110 PolarHBondContact O-N 3.38Å; S106-T110 VanDerWaalsContact O-N 3.13Å; S106-T110 PolarHBondContact O-OG1 3.4Å; F107-T110 PolarHBondContact O-N 2.73Å; I108-T110 VanDerWaalsContact C-N 3.34Å; I108-T110 PolarHBondContact O-N 3.4Å
111	V	39.9	Very low	43	Very low	92 Å²	92	74.2 Å²	74.2	56%	0.558	40%	0.399	S	S	*	.	H	α-helix	trans	-87.7	-30.9	179.9	175.7	0	0	0	0	112.8	F107 I108 S109	F107-V111 VanDerWaalsContact O-CG2 3.27Å; F107-V111 WeakPolarHBondContact O-CG2 3.47Å; F107-V111 PolarHBondContact O-N 3.1Å; F107-V111 VanDerWaalsContact O-N 3.15Å; I108-V111 PolarHBondContact O-N 2.97Å; S109-V111 VanDerWaalsContact C-N 3.32Å; S109-V111 PolarHBondContact O-N 3.41Å
112	L	35.2	Very low	43.5	Very low	60 Å²	60	75.2 Å²	75.2	31%	0.314	40%	0.403	S	S	.	.	H	α-helix	trans	-105.9	-11.8	-175.1	-60.8	-176.5	0	0	0	115.2	I108 P114 L115 V116 I121	I108-L112 HydrophobicContact CG2-CD1 3.54Å; I108-L112 HydrophobicContact CG2-CG 4.13Å; I108-L112 VanDerWaalsContact O-CB 3.28Å; I108-L112 WeakPolarHBondContact O-CB 3.32Å; I108-L112 WeakPolarHBondContact O-CG 3.36Å; I108-L112 PolarHBondContact O-N 3.42Å; L112-P114 VanDerWaalsContact C-N 3.3Å; L112-L115 PolarHBondContact O-N 3.49Å; L112-V116 PolarHBondContact O-N 3.04Å; L112-V116 VanDerWaalsContact O-N 3.17Å; L112-I121 HydrophobicContact CB-CD1 4.48Å
113	S	43.2	Very low	43.5	Very low	65 Å²	65	74.1 Å²	74.1	46%	0.455	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-30.4	178.7	-79.5	0	0	0	0	116	S109 L115	S109-S113 WeakPolarHBondContact O-CA 3.2Å; S109-S113 WeakPolarHBondContact O-CB 2.69Å; S109-S113 PolarHBondContact O-N 3.24Å; S109-S113 PolarHBondContact O-OG 3.33Å; S109-S113 PolarHBondContact OG-OG 3.35Å; S113-L115 PolarHBondContact O-N 2.99Å
114	P	43	Very low	43.7	Very low	109 Å²	109	76.5 Å²	76.5	71%	0.708	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-16.7	177.7	-17.6	30.4	0	0	0	114	L112	L112-P114 VanDerWaalsContact C-N 3.3Å
115	L	37	Very low	44	Very low	153 Å²	153	72.8 Å²	72.8	80%	0.801	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.3	-10.5	-167.1	-67	170.3	0	0	0	114.2	L112 S113	L112-L115 PolarHBondContact O-N 3.49Å; S113-L115 PolarHBondContact O-N 2.99Å
116	V	38.8	Very low	44.6	Very low	52 Å²	52	73.3 Å²	73.3	32%	0.315	41%	0.408	S	S	.	.	S	Bend	trans	-143.6	129.2	-168	-173.7	0	0	0	0	111	L112 I121	L112-V116 PolarHBondContact O-N 3.04Å; L112-V116 VanDerWaalsContact O-N 3.17Å; V116-I121 HydrophobicContact CB-CG1 4.23Å; V116-I121 HydrophobicContact CG1-CG1 3.87Å
117	S	50.4	Low	45.4	Very low	57 Å²	57	71.6 Å²	71.6	40%	0.399	39%	0.392	S	S	.	.			trans	-64	151.2	176.7	67.3	0	0	0	0	111.6	T119 S120 I121	S117-T119 PolarHBondContact O-N 3.14Å; S117-T119 VanDerWaalsContact O-N 3.13Å; S117-S120 WeakPolarHBondContact O-CB 3.43Å; S117-S120 PolarHBondContact O-N 3.43Å; S117-S120 PolarHBondContact OG-OG 3.05Å; S117-I121 PolarHBondContact O-N 3.14Å; S117-I121 VanDerWaalsContact O-N 3.12Å
118	R	49.8	Very low	46.6	Very low	202 Å²	202	66.2 Å²	66.2	76%	0.762	38%	0.375	S	S	*	.	H	α-helix	trans	-54.8	-33.8	179.7	-72.7	-178.3	175.2	179.6	-1.5	112.8	I121 N122	R118-I121 PolarHBondContact O-N 3.37Å; R118-N122 PolarHBondContact O-N 3.1Å
119	T	48.5	Very low	48.6	Very low	78 Å²	78	66.1 Å²	66.1	48%	0.479	38%	0.376	S	S	.	.	H	α-helix	trans	-63.9	-38.9	175.1	-43	0	0	0	0	112.4	S117 G123	S117-T119 PolarHBondContact O-N 3.14Å; S117-T119 VanDerWaalsContact O-N 3.13Å; T119-G123 PolarHBondContact O-N 2.74Å
120	S	48.7	Very low	50.9	Low	19 Å²	19	66.9 Å²	66.9	13%	0.133	38%	0.377	C	S	.	.	H	α-helix	trans	-73.1	-32.4	177.2	-64	0	0	0	0	112.2	S117 F124	S117-S120 WeakPolarHBondContact O-CB 3.43Å; S117-S120 PolarHBondContact O-N 3.43Å; S117-S120 PolarHBondContact OG-OG 3.05Å; S120-F124 WeakPolarHBondContact O-CB 3.37Å; S120-F124 PolarHBondContact O-N 3.01Å
121	I	50.2	Low	53.4	Low	7 Å²	7	62.5 Å²	62.5	4%	0.036	35%	0.348	C	S	.	.	H	α-helix	trans	-67.9	-44.7	173.4	-64.3	172.7	0	0	0	110.7	I108 L112 V116 S117 R118 F124 L125	I108-I121 HydrophobicContact CG2-CG2 4.37Å; L112-I121 HydrophobicContact CB-CD1 4.48Å; V116-I121 HydrophobicContact CB-CG1 4.23Å; V116-I121 HydrophobicContact CG1-CG1 3.87Å; S117-I121 PolarHBondContact O-N 3.14Å; S117-I121 VanDerWaalsContact O-N 3.12Å; R118-I121 PolarHBondContact O-N 3.37Å; I121-F124 PolarHBondContact O-N 2.97Å; I121-L125 HydrophobicContact CG2-CD1 3.58Å; I121-L125 WeakPolarHBondContact O-CB 3.36Å; I121-L125 WeakPolarHBondContact O-CD1 3.2Å; I121-L125 WeakPolarHBondContact O-CG 3.31Å; I121-L125 PolarHBondContact O-N 3.36Å; I121-L125 VanDerWaalsContact O-N 3.1Å
122	N	54	Low	56	Low	67 Å²	67	58.2 Å²	58.2	36%	0.358	32%	0.322	S	S	.	.	H	α-helix	trans	-63.9	-42.1	176.1	-74.7	-9.7	0	0	0	111.9	R118 F124 L125 G126 R127	R118-N122 PolarHBondContact O-N 3.1Å; N122-F124 PolarHBondContact O-N 2.84Å; N122-L125 CarbonylContact O-C 3.59Å; N122-L125 PolarHBondContact O-N 2.99Å; N122-L125 VanDerWaalsContact O-N 3.1Å; N122-G126 PolarHBondContact O-N 3.49Å; N122-G126 VanDerWaalsContact O-N 3.14Å; N122-R127 CarbonylContact C-O 3.4Å; N122-R127 PolarHBondContact O-N 2.74Å; N122-R127 VanDerWaalsContact O-N 3.14Å; N122-R127 VanDerWaalsContact O-O 3.12Å
123	G	49.9	Very low	59	Low	2 Å²	2	55.5 Å²	55.5	2%	0.021	31%	0.308	C	S	.	.	H	α-helix	trans	-59.8	-40.9	172.9	0	0	0	0	0	113.3	T119 L125 G126 H186	T119-G123 PolarHBondContact O-N 2.74Å; G123-L125 PolarHBondContact O-N 3.35Å; G123-G126 PolarHBondContact O-N 2.93Å; G123-H186 PolarHBondContact O-NE2 3.12Å
124	F	45.7	Very low	61.6	Low	138 Å²	138	52.4 Å²	52.4	61%	0.605	29%	0.287	S	S	*	.	H	α-helix	trans	-65.3	-29.4	175.5	-170	-99.4	0	0	0	113	S120 I121 N122	S120-F124 WeakPolarHBondContact O-CB 3.37Å; S120-F124 PolarHBondContact O-N 3.01Å; I121-F124 PolarHBondContact O-N 2.97Å; N122-F124 PolarHBondContact O-N 2.84Å
125	L	49.6	Very low	64.1	Low	33 Å²	33	48.6 Å²	48.6	17%	0.173	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	2.1	-175	-64.6	168.8	0	0	0	113.3	Y104 H105 I108 I121 N122 G123 R127	Y104-L125 HydrophobicContact CD1-CD2 3.55Å; Y104-L125 HydrophobicContact CE1-CD2 3.22Å; H105-L125 WeakPolarHBondContact CE1-CD1 3.34Å; H105-L125 VanDerWaalsContact ND1-CD1 3.31Å; H105-L125 WeakPolarHBondContact ND1-CD1 3.46Å; H105-L125 WeakPolarHBondContact NE2-CB 3.25Å; H105-L125 VanDerWaalsContact NE2-CD1 3.3Å; H105-L125 WeakPolarHBondContact NE2-CD1 3.33Å; I108-L125 HydrophobicContact CG2-CD1 4.44Å; I121-L125 HydrophobicContact CG2-CD1 3.58Å; I121-L125 WeakPolarHBondContact O-CB 3.36Å; I121-L125 WeakPolarHBondContact O-CD1 3.2Å; I121-L125 WeakPolarHBondContact O-CG 3.31Å; I121-L125 PolarHBondContact O-N 3.36Å; I121-L125 VanDerWaalsContact O-N 3.1Å; N122-L125 CarbonylContact O-C 3.59Å; N122-L125 PolarHBondContact O-N 2.99Å; N122-L125 VanDerWaalsContact O-N 3.1Å; G123-L125 PolarHBondContact O-N 3.35Å; L125-R127 PolarHBondContact O-N 2.51Å
126	G	53	Low	66.9	Low	35 Å²	35	46.5 Å²	46.5	36%	0.361	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	34	-179.4	0	0	0	0	0	112.5	K95 N122 G123	K95-G126 PolarHBondContact NZ-O 3.41Å; N122-G126 PolarHBondContact O-N 3.49Å; N122-G126 VanDerWaalsContact O-N 3.14Å; G123-G126 PolarHBondContact O-N 2.93Å
127	R	58.4	Low	69.7	Low	28 Å²	28	44.4 Å²	44.4	11%	0.106	24%	0.24	C	C	.	.			trans	-120.4	154.3	177.8	-72.6	-156.8	-179.9	164.5	-23	110.7	K95 T101 H105 N122 L125	K95-R127 PolarHBondContact O-NH2 3.45Å; T101-R127 VanDerWaalsContact CB-NH2 3.31Å; T101-R127 PolarHBondContact OG1-NH2 3.21Å; H105-R127 PolarHBondContact CD2-NH1 3.4Å; H105-R127 VanDerWaalsContact NE2-CD 3.33Å; H105-R127 WeakPolarHBondContact NE2-CD 3.33Å; H105-R127 PolarHBondContact NE2-NH1 3.03Å; H105-R127 VanDerWaalsContact NE2-NH1 3.19Å; N122-R127 CarbonylContact C-O 3.4Å; N122-R127 PolarHBondContact O-N 2.74Å; N122-R127 VanDerWaalsContact O-N 3.14Å; N122-R127 VanDerWaalsContact O-O 3.12Å; L125-R127 PolarHBondContact O-N 2.51Å
128	G	64.8	Low	72	Confident	24 Å²	24	41.8 Å²	41.8	25%	0.247	22%	0.222	C	C	.	.			trans	86.9	25.4	-176.5	0	0	0	0	0	111.9	E302	G128-E302 PolarHBondContact N-OE2 3.18Å
129	S	80.8	Confident	74.2	Confident	21 Å²	21	33.4 Å²	33.4	15%	0.147	19%	0.192	C	C	.	.			trans	-57.8	143.7	168.3	-64.3	0	0	0	0	109.5	F88 D160 E302	F88-S129 WeakPolarHBondContact CZ-O 3.36Å; S129-D160 WeakPolarHBondContact CA-OD2 3.36Å; S129-D160 VanDerWaalsContact CB-OD2 3.31Å; S129-D160 WeakPolarHBondContact CB-OD2 3.39Å; S129-D160 PolarHBondContact OG-OD2 3.28Å; S129-E302 PolarHBondContact N-OE2 2.99Å; S129-E302 PolarHBondContact O-N 3.03Å
130	M	87.6	Confident	76.5	Confident	53 Å²	53	34.5 Å²	34.5	26%	0.261	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	149.3	-173.7	-61.9	178	-51.9	0	0	109.5	V163 Y299 L300	M130-V163 HydrophobicContact CB-CG2 4.47Å; M130-V163 WeakPolarHBondContact O-CG2 3.2Å; M130-Y299 HydrophobicContact CB-CE2 4Å; M130-Y299 HydrophobicContact CG-CE2 4.28Å; M130-Y299 HydrophobicContact SD-CE2 4.29Å; M130-Y299 PolarHBondContact SD-OH 3.44Å; M130-L300 CarbonylContact C-O 3.56Å; M130-L300 WeakPolarHBondContact CA-O 3.48Å
131	F	92.8	Very high	78.8	Confident	17 Å²	17	33.8 Å²	33.8	8%	0.075	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	131.2	175.7	179.6	-80.2	0	0	0	108.9	D84 T85 F88 F133 L300	D84-F131 HydrophobicContact CB-CE2 4.27Å; D84-F131 HydrophobicContact CB-CZ 4.38Å; T85-F131 HydrophobicContact CG2-CE1 4.05Å; T85-F131 WeakPolarHBondContact OG1-CE1 3.43Å; T85-F131 WeakPolarHBondContact OG1-CZ 3.46Å; F88-F131 HydrophobicContact CB-CB 4.44Å; F88-F131 HydrophobicContact CB-CD2 4.01Å; F88-F131 HydrophobicContact CB-CG 4.21Å; F88-F131 HydrophobicContact CD1-CB 3.91Å; F88-F131 HydrophobicContact CD1-CG 4.41Å; F88-F131 HydrophobicContact CD2-CB 3.53Å; F88-F131 HydrophobicContact CD2-CD2 4.09Å; F88-F131 HydrophobicContact CD2-CG 4.11Å; F88-F131 HydrophobicContact CE1-CB 4.02Å; F88-F131 HydrophobicContact CE2-CB 3.63Å; F88-F131 HydrophobicContact CG-CB 3.67Å; F88-F131 HydrophobicContact CG-CD2 4.11Å; F88-F131 AromaticContact CG-CG 3.97Å; F88-F131 HydrophobicContact CG-CG 3.97Å; F88-F131 HydrophobicContact CZ-CB 3.87Å; F131-F133 VanDerWaalsContact CZ-C 3.48Å; F131-L300 HydrophobicContact CB-CB 4.18Å; F131-L300 HydrophobicContact CD1-CD1 4.04Å; F131-L300 PolarHBondContact N-O 2.88Å; F131-L300 PolarHBondContact O-N 2.99Å
132	V	95.3	Very high	81	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.018	19%	0.192	C	C	.	.			trans	-119.2	-50.2	179.9	-178.5	0	0	0	0	109.5	V163 A243 L297 Y299 V316	V132-V163 HydrophobicContact CB-CG1 4.31Å; V132-V163 HydrophobicContact CG2-CG1 4.41Å; V132-V163 HydrophobicContact CG2-CG2 4.14Å; V132-A243 HydrophobicContact CG1-CB 4.17Å; V132-L297 WeakPolarHBondContact O-CD1 3.41Å; V132-Y299 HydrophobicContact CG2-CD2 3.86Å; V132-Y299 HydrophobicContact CG2-CE2 4.09Å; V132-V316 HydrophobicContact CG1-CG2 3.74Å
133	F	97.6	Very high	83	Confident	3 Å²	3	40 Å²	40	1%	0.013	21%	0.206	C	C	.	.			trans	-145.5	156.4	178.2	43.8	-105.8	0	0	0	111.7	F131 Q137 L138 V163 V166 M167 L213 I241 L297 V316	F131-F133 VanDerWaalsContact CZ-C 3.48Å; F133-Q137 VanDerWaalsContact CA-OE1 3.27Å; F133-Q137 HydrophobicContact CB-CB 3.96Å; F133-L138 HydrophobicContact CD2-CB 3.75Å; F133-L138 HydrophobicContact CD2-CD1 4.2Å; F133-L138 HydrophobicContact CD2-CG 4.37Å; F133-L138 HydrophobicContact CE2-CB 4.01Å; F133-L138 HydrophobicContact CE2-CD1 3.74Å; F133-L138 HydrophobicContact CE2-CD2 4Å; F133-L138 HydrophobicContact CE2-CG 4.13Å; F133-L138 HydrophobicContact CG-CB 4.46Å; F133-L138 HydrophobicContact CZ-CD1 3.92Å; F133-V163 HydrophobicContact CE1-CG1 4.4Å; F133-V163 HydrophobicContact CE2-CG1 4.01Å; F133-V163 HydrophobicContact CZ-CG1 3.85Å; F133-V166 HydrophobicContact CD2-CG1 4.05Å; F133-V166 HydrophobicContact CE2-CB 4.41Å; F133-V166 HydrophobicContact CE2-CG1 4.14Å; F133-M167 HydrophobicContact CE2-CG 3.76Å; F133-M167 HydrophobicContact CE2-SD 4.36Å; F133-M167 HydrophobicContact CZ-CG 3.79Å; F133-M167 HydrophobicContact CZ-SD 3.77Å; F133-L213 HydrophobicContact CE1-CD1 4.21Å; F133-L213 HydrophobicContact CE1-CD2 4.21Å; F133-L213 HydrophobicContact CZ-CD1 4.15Å; F133-I241 HydrophobicContact CD1-CD1 4.3Å; F133-I241 HydrophobicContact CE1-CD1 3.51Å; F133-I241 HydrophobicContact CE1-CG1 4.35Å; F133-I241 HydrophobicContact CZ-CD1 3.73Å; F133-L297 HydrophobicContact CB-CD1 3.75Å; F133-L297 HydrophobicContact CD1-CD1 4.48Å; F133-V316 HydrophobicContact CD1-CG1 4.27Å; F133-V316 HydrophobicContact CE1-CG1 4.36Å
134	S	97.3	Very high	85.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.213	C	C	.	.			trans	-78.7	173.5	166.1	70.7	0	0	0	0	112.5	D82 D136 Q137 L138	D82-S134 WeakPolarHBondContact OD2-CB 3.42Å; D82-S134 PolarHBondContact OD2-OG 3.27Å; S134-D136 VanDerWaalsContact C-N 3.33Å; S134-D136 PolarHBondContact OG-N 2.97Å; S134-Q137 WeakPolarHBondContact OG-CB 3.33Å; S134-Q137 WeakPolarHBondContact OG-CG 3.44Å; S134-Q137 PolarHBondContact OG-N 3.35Å; S134-L138 WeakPolarHBondContact O-CB 3.44Å; S134-L138 PolarHBondContact O-N 2.91Å
135	A	96	Very high	87.5	Confident	29 Å²	29	37.2 Å²	37.2	24%	0.24	21%	0.205	C	C	.	.	H	α-helix	trans	-61.6	-41.3	172.9	0	0	0	0	0	112	L138 Q139 V166	A135-L138 PolarHBondContact O-N 3.33Å; A135-Q139 WeakPolarHBondContact O-CB 3.39Å; A135-Q139 WeakPolarHBondContact O-CG 3.25Å; A135-Q139 PolarHBondContact O-N 3.44Å; A135-Q139 PolarHBondContact O-NE2 3.29Å; A135-V166 HydrophobicContact CB-CG1 4.19Å
136	D	96.6	Very high	89.5	Confident	108 Å²	108	38.8 Å²	38.8	58%	0.578	22%	0.217	S	C	*	.	H	α-helix	trans	-68.3	-43.1	-179	-68.6	-12.8	0	0	0	111.3	S134 L138 Q139 Q140	S134-D136 VanDerWaalsContact C-N 3.33Å; S134-D136 PolarHBondContact OG-N 2.97Å; D136-L138 VanDerWaalsContact C-N 3.35Å; D136-L138 PolarHBondContact O-N 2.95Å; D136-Q139 PolarHBondContact O-N 3.42Å; D136-Q140 WeakPolarHBondContact O-CB 3.48Å; D136-Q140 PolarHBondContact O-N 3.37Å
137	Q	97.6	Very high	91.5	Very high	8 Å²	8	43.9 Å²	43.9	4%	0.037	23%	0.231	C	C	.	.	H	α-helix	trans	-62.1	-42.6	175.6	-73.6	168.3	-14.4	0	0	111.3	H80 D82 F133 S134 L141	H80-Q137 PolarHBondContact O-NE2 3.5Å; D82-Q137 VanDerWaalsContact OD2-CD 3.26Å; D82-Q137 WeakPolarHBondContact OD2-CG 3.37Å; D82-Q137 PolarHBondContact OD2-NE2 3.49Å; F133-Q137 VanDerWaalsContact CA-OE1 3.27Å; F133-Q137 HydrophobicContact CB-CB 3.96Å; S134-Q137 WeakPolarHBondContact OG-CB 3.33Å; S134-Q137 WeakPolarHBondContact OG-CG 3.44Å; S134-Q137 PolarHBondContact OG-N 3.35Å; Q137-L141 WeakPolarHBondContact O-CB 3.46Å; Q137-L141 PolarHBondContact O-N 2.85Å
138	L	97.4	Very high	93.3	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-61.3	-47.9	175.3	178.9	66	0	0	0	111.7	F133 S134 A135 D136 L141 L142 V166 M167 I241	F133-L138 HydrophobicContact CD2-CB 3.75Å; F133-L138 HydrophobicContact CD2-CD1 4.2Å; F133-L138 HydrophobicContact CD2-CG 4.37Å; F133-L138 HydrophobicContact CE2-CB 4.01Å; F133-L138 HydrophobicContact CE2-CD1 3.74Å; F133-L138 HydrophobicContact CE2-CD2 4Å; F133-L138 HydrophobicContact CE2-CG 4.13Å; F133-L138 HydrophobicContact CG-CB 4.46Å; F133-L138 HydrophobicContact CZ-CD1 3.92Å; S134-L138 WeakPolarHBondContact O-CB 3.44Å; S134-L138 PolarHBondContact O-N 2.91Å; A135-L138 PolarHBondContact O-N 3.33Å; D136-L138 VanDerWaalsContact C-N 3.35Å; D136-L138 PolarHBondContact O-N 2.95Å; L138-L141 PolarHBondContact O-N 2.86Å; L138-L142 HydrophobicContact CD1-CD1 3.66Å; L138-L142 HydrophobicContact CD1-CG 4.02Å; L138-L142 HydrophobicContact CG-CD1 3.92Å; L138-L142 HydrophobicContact CG-CG 4.49Å; L138-L142 WeakPolarHBondContact O-CB 3.49Å; L138-L142 WeakPolarHBondContact O-CG 3.46Å; L138-L142 PolarHBondContact O-N 3.41Å; L138-V166 HydrophobicContact CD2-CG1 4.23Å; L138-M167 HydrophobicContact CD1-CG 4.34Å; L138-M167 HydrophobicContact CD2-CB 4.19Å; L138-M167 HydrophobicContact CD2-CG 3.73Å; L138-I241 HydrophobicContact CD1-CD1 3.41Å; L138-I241 VanDerWaalsContact CD1-CD1 3.41Å
139	Q	96.9	Very high	94.8	Very high	27 Å²	27	52 Å²	52	13%	0.126	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-44.1	-179.4	-74.4	168.1	39.5	0	0	111.8	A135 D136 L141 R143 V144	A135-Q139 WeakPolarHBondContact O-CB 3.39Å; A135-Q139 WeakPolarHBondContact O-CG 3.25Å; A135-Q139 PolarHBondContact O-N 3.44Å; A135-Q139 PolarHBondContact O-NE2 3.29Å; D136-Q139 PolarHBondContact O-N 3.42Å; Q139-L141 VanDerWaalsContact C-N 3.33Å; Q139-L141 PolarHBondContact O-N 2.93Å; Q139-R143 WeakPolarHBondContact O-CA 3.3Å; Q139-R143 PolarHBondContact O-N 3.22Å; Q139-V144 HydrophobicContact CB-CG2 4.4Å; Q139-V144 HydrophobicContact CG-CG2 4.28Å; Q139-V144 PolarHBondContact O-N 3.45Å
140	Q	97.1	Very high	95.5	Very high	101 Å²	101	51.3 Å²	51.3	47%	0.472	25%	0.25	S	S	.	.	H	α-helix	trans	-61.9	-42.5	175.7	-173.8	-177.5	-13.4	0	0	111.3	V77 Q78 D136 R143	V77-Q140 HydrophobicContact CG1-CG 3.89Å; V77-Q140 VanDerWaalsContact CG1-NE2 3.28Å; Q78-Q140 PolarHBondContact O-NE2 3.12Å; D136-Q140 WeakPolarHBondContact O-CB 3.48Å; D136-Q140 PolarHBondContact O-N 3.37Å; Q140-R143 PolarHBondContact O-N 3.21Å
141	L	97	Very high	96	Very high	4 Å²	4	52.3 Å²	52.3	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-69	-43.1	-178.6	-170.8	67.1	0	0	0	112.2	V77 Q137 L138 Q139 R143 I241 A293 T295 V316 V318	V77-L141 HydrophobicContact CB-CD1 4.37Å; V77-L141 HydrophobicContact CG2-CD1 4.32Å; Q137-L141 WeakPolarHBondContact O-CB 3.46Å; Q137-L141 PolarHBondContact O-N 2.85Å; L138-L141 PolarHBondContact O-N 2.86Å; Q139-L141 VanDerWaalsContact C-N 3.33Å; Q139-L141 PolarHBondContact O-N 2.93Å; L141-R143 VanDerWaalsContact C-N 3.28Å; L141-R143 PolarHBondContact O-N 3Å; L141-I241 HydrophobicContact CD2-CD1 4.33Å; L141-A293 HydrophobicContact CD1-CB 3.75Å; L141-A293 HydrophobicContact CG-CB 4.47Å; L141-T295 HydrophobicContact CD1-CG2 3.76Å; L141-T295 HydrophobicContact CD2-CG2 3.96Å; L141-T295 HydrophobicContact CG-CG2 4.4Å; L141-V316 HydrophobicContact CD2-CB 4.28Å; L141-V316 HydrophobicContact CD2-CG1 3.69Å; L141-V318 HydrophobicContact CD1-CG2 4.45Å; L141-V318 HydrophobicContact CD2-CG2 3.87Å; L141-V318 HydrophobicContact CG-CG2 3.62Å
142	L	96.6	Very high	96.3	Very high	30 Å²	30	55 Å²	55	16%	0.157	26%	0.264	C	S	.	.	H	α-helix	trans	-78.1	-10.9	175.6	-68.2	177.8	0	0	0	113.3	L138 V144 L209 V318	L138-L142 HydrophobicContact CD1-CD1 3.66Å; L138-L142 HydrophobicContact CD1-CG 4.02Å; L138-L142 HydrophobicContact CG-CD1 3.92Å; L138-L142 HydrophobicContact CG-CG 4.49Å; L138-L142 WeakPolarHBondContact O-CB 3.49Å; L138-L142 WeakPolarHBondContact O-CG 3.46Å; L138-L142 PolarHBondContact O-N 3.41Å; L142-V144 VanDerWaalsContact C-N 3.29Å; L142-V144 HydrophobicContact CB-CG1 4.04Å; L142-V144 HydrophobicContact CB-CG2 3.91Å; L142-V144 PolarHBondContact O-N 2.68Å; L142-L209 HydrophobicContact CD1-CD2 4.23Å; L142-L209 HydrophobicContact CD2-CD1 4.23Å; L142-V318 HydrophobicContact CD2-CG1 4.08Å; L142-V318 HydrophobicContact CD2-CG2 3.73Å
143	R	95.8	Very high	96.4	Very high	175 Å²	175	54.9 Å²	54.9	66%	0.66	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	42.1	-174.2	-53.5	179.7	-178.2	175.7	3.1	112.7	Q139 Q140 L141	Q139-R143 WeakPolarHBondContact O-CA 3.3Å; Q139-R143 PolarHBondContact O-N 3.22Å; Q140-R143 PolarHBondContact O-N 3.21Å; L141-R143 VanDerWaalsContact C-N 3.28Å; L141-R143 PolarHBondContact O-N 3Å
144	V	95.1	Very high	96.5	Very high	29 Å²	29	54.7 Å²	54.7	18%	0.176	26%	0.263	C	S	.	.			trans	-113.4	149.3	-179.8	-62.1	0	0	0	0	111.2	Q139 L142 W148	Q139-V144 HydrophobicContact CB-CG2 4.4Å; Q139-V144 HydrophobicContact CG-CG2 4.28Å; Q139-V144 PolarHBondContact O-N 3.45Å; L142-V144 VanDerWaalsContact C-N 3.29Å; L142-V144 HydrophobicContact CB-CG1 4.04Å; L142-V144 HydrophobicContact CB-CG2 3.91Å; L142-V144 PolarHBondContact O-N 2.68Å; V144-W148 HydrophobicContact CB-CB 3.81Å; V144-W148 HydrophobicContact CB-CD2 4.06Å; V144-W148 HydrophobicContact CB-CE3 4.32Å; V144-W148 HydrophobicContact CB-CG 3.83Å; V144-W148 HydrophobicContact CG1-CB 4.42Å; V144-W148 HydrophobicContact CG1-CD2 3.81Å; V144-W148 HydrophobicContact CG1-CE3 4.2Å; V144-W148 HydrophobicContact CG1-CG 3.89Å; V144-W148 HydrophobicContact CG2-CB 4.48Å; V144-W148 HydrophobicContact CG2-CE3 4.33Å
145	A	93.9	Very high	96.6	Very high	51 Å²	51	54.9 Å²	54.9	42%	0.421	26%	0.264	S	S	.	.			trans	-76	156.9	173.5	0	0	0	0	0	111.1	E147 W148	A145-E147 WeakPolarHBondContact CB-OE2 3.32Å; A145-E147 PolarHBondContact O-N 2.79Å; A145-W148 WeakPolarHBondContact O-CB 3.36Å; A145-W148 PolarHBondContact O-N 3.35Å
146	P	92.9	Very high	96.6	Very high	67 Å²	67	53.7 Å²	53.7	44%	0.435	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-29.7	175.4	-23.2	29.1	0	0	0	113.9	R149	P146-R149 PolarHBondContact O-NH1 2.78Å
147	E	94.1	Very high	96.5	Very high	141 Å²	141	49.8 Å²	49.8	66%	0.659	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-10.6	-179	-55.5	72.9	-158.8	0	0	113.2	A145 R149	A145-E147 WeakPolarHBondContact CB-OE2 3.32Å; A145-E147 PolarHBondContact O-N 2.79Å; E147-R149 VanDerWaalsContact C-NH1 3.28Å; E147-R149 PolarHBondContact O-N 2.83Å; E147-R149 PolarHBondContact O-NH1 3.02Å
148	W	95.8	Very high	96.2	Very high	98 Å²	98	49.7 Å²	49.7	37%	0.371	24%	0.239	S	C	.	.			trans	-61.8	134.4	179.9	179.2	88.4	0	0	0	110.6	V144 A145 H170 F171	V144-W148 HydrophobicContact CB-CB 3.81Å; V144-W148 HydrophobicContact CB-CD2 4.06Å; V144-W148 HydrophobicContact CB-CE3 4.32Å; V144-W148 HydrophobicContact CB-CG 3.83Å; V144-W148 HydrophobicContact CG1-CB 4.42Å; V144-W148 HydrophobicContact CG1-CD2 3.81Å; V144-W148 HydrophobicContact CG1-CE3 4.2Å; V144-W148 HydrophobicContact CG1-CG 3.89Å; V144-W148 HydrophobicContact CG2-CB 4.48Å; V144-W148 HydrophobicContact CG2-CE3 4.33Å; A145-W148 WeakPolarHBondContact O-CB 3.36Å; A145-W148 PolarHBondContact O-N 3.35Å; W148-H170 HydrophobicContact CE3-CB 3.93Å; W148-H170 HydrophobicContact CZ3-CB 3.93Å; W148-H170 PolarHBondContact O-ND1 3.34Å; W148-H170 VanDerWaalsContact O-ND1 3.14Å; W148-F171 AromaticContact CH2-CE1 3.68Å; W148-F171 HydrophobicContact CH2-CE1 3.68Å; W148-F171 HydrophobicContact CH2-CE2 4.42Å; W148-F171 AromaticContact CH2-CZ 3.53Å; W148-F171 HydrophobicContact CH2-CZ 3.53Å; W148-F171 AromaticContact CZ3-CE1 3.99Å; W148-F171 HydrophobicContact CZ3-CE1 3.99Å; W148-F171 AromaticContact CZ3-CE2 3.97Å; W148-F171 HydrophobicContact CZ3-CE2 3.97Å; W148-F171 AromaticContact CZ3-CZ 3.53Å; W148-F171 HydrophobicContact CZ3-CZ 3.53Å
149	R	96.1	Very high	95.9	Very high	126 Å²	126	49.9 Å²	49.9	48%	0.475	24%	0.242	S	C	.	.			trans	-132.2	125.8	177.9	-63.9	-64.4	177.2	-84.4	4.4	110.8	P146 E147 A169 H170	P146-R149 PolarHBondContact O-NH1 2.78Å; E147-R149 VanDerWaalsContact C-NH1 3.28Å; E147-R149 PolarHBondContact O-N 2.83Å; E147-R149 PolarHBondContact O-NH1 3.02Å; R149-A169 PolarHBondContact NE-O 3.21Å; R149-H170 CarbonylContact C-O 3.53Å; R149-H170 WeakPolarHBondContact CA-O 3.43Å
150	G	96.3	Very high	95.4	Very high	5 Å²	5	49.9 Å²	49.9	5%	0.052	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	169.8	167.2	0	0	0	0	0	112	H170 F171 R172	G150-H170 PolarHBondContact N-O 2.93Å; G150-F171 WeakPolarHBondContact O-CA 3.46Å; G150-R172 PolarHBondContact O-N 3.13Å; G150-R172 VanDerWaalsContact O-N 3.15Å
151	E	98.1	Very high	95.2	Very high	75 Å²	75	45.1 Å²	45.1	35%	0.35	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	-54.2	178.6	-61.1	-65.2	141.6	0	0	110.7	R172 E173 D208	E151-R172 PolarHBondContact O-N 2.93Å; E151-R172 IonicContact OE1-CZ 3.54Å; E151-R172 IonicContact OE1-NE 2.76Å; E151-R172 IonicContact OE1-NH1 2.68Å; E151-R172 PolarHBondContact OE1-NH1 2.98Å; E151-R172 IonicContact OE1-NH2 3.31Å; E151-R172 WeakPolarHBondContact OE2-CD 3.43Å; E151-R172 IonicContact OE2-CZ 2.76Å; E151-R172 IonicContact OE2-NE 3.36Å; E151-R172 IonicContact OE2-NH1 3.6Å; E151-R172 PolarHBondContact OE2-NH1 2.99Å; E151-E173 PolarHBondContact O-N 3.41Å; E151-D208 WeakPolarHBondContact CA-OD2 3.34Å; E151-D208 VanDerWaalsContact CB-OD2 3.28Å; E151-D208 WeakPolarHBondContact CB-OD2 3.46Å; E151-D208 PolarHBondContact N-OD2 3.46Å
152	R	98.6	Very high	94.9	Very high	73 Å²	73	46 Å²	46	28%	0.275	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	122.6	-169.7	-53.5	-171.8	-171.9	105.4	2.8	113.6	E173 Y175 F205 Q206 Y207 D208 L209	R152-E173 WeakPolarHBondContact CA-O 3.5Å; R152-E173 HydrophobicContact CG-CB 4.32Å; R152-Y175 HydrophobicContact CB-CE2 4.43Å; R152-Y175 HydrophobicContact CG-CE2 4.38Å; R152-F205 VanDerWaalsContact CD-CD2 3.42Å; R152-Q206 PolarHBondContact NH1-O 3.45Å; R152-Y207 HydrophobicContact CB-CD1 4.01Å; R152-D208 PolarHBondContact N-OD2 3.1Å; R152-D208 PolarHBondContact O-N 2.83Å; R152-L209 PolarHBondContact O-N 3.13Å
153	L	98.7	Very high	94.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	137.2	167.1	167.8	64	0	0	0	109.9	M167 F171 E173 V174 Y175 L209	L153-M167 HydrophobicContact CD2-CB 3.62Å; L153-F171 HydrophobicContact CB-CB 3.89Å; L153-F171 HydrophobicContact CB-CD1 3.95Å; L153-F171 HydrophobicContact CB-CD2 3.67Å; L153-F171 HydrophobicContact CB-CE1 4.43Å; L153-F171 HydrophobicContact CB-CE2 4.2Å; L153-F171 HydrophobicContact CB-CG 3.54Å; L153-F171 HydrophobicContact CD2-CD2 4.08Å; L153-F171 HydrophobicContact CG-CD2 4.38Å; L153-E173 PolarHBondContact N-O 3.02Å; L153-V174 HydrophobicContact CD2-CG1 4.12Å; L153-V174 HydrophobicContact CD2-CG2 4.39Å; L153-V174 HydrophobicContact CG-CG1 4.49Å; L153-Y175 WeakPolarHBondContact O-CB 3.39Å; L153-Y175 PolarHBondContact O-N 3.48Å; L153-L209 WeakPolarHBondContact CA-O 3.36Å; L153-L209 HydrophobicContact CD1-CB 4.11Å; L153-L209 HydrophobicContact CD1-CD2 3.99Å; L153-L209 HydrophobicContact CD1-CG 4.02Å
154	L	98.8	Very high	94.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	124.6	163.1	171.6	65	0	0	0	110.4	L156 Y175 T177 L195 W200 Y207 L209 I210 S211	L154-L156 HydrophobicContact CD2-CD2 4.02Å; L154-L156 HydrophobicContact CD2-CG 4.31Å; L154-L156 HydrophobicContact CG-CD2 4.23Å; L154-L156 HydrophobicContact CG-CG 4.27Å; L154-Y175 CarbonylContact C-O 3.56Å; L154-Y175 WeakPolarHBondContact CA-O 3.22Å; L154-T177 HydrophobicContact CD1-CG2 4.27Å; L154-L195 HydrophobicContact CD1-CD1 4.13Å; L154-W200 HydrophobicContact CD1-CB 4.29Å; L154-W200 HydrophobicContact CD2-CB 3.92Å; L154-W200 HydrophobicContact CD2-CD2 4.16Å; L154-W200 HydrophobicContact CD2-CE3 3.71Å; L154-W200 HydrophobicContact CD2-CG 4.28Å; L154-Y207 HydrophobicContact CB-CD1 3.53Å; L154-Y207 HydrophobicContact CB-CD2 4.23Å; L154-Y207 HydrophobicContact CB-CE1 3.59Å; L154-Y207 HydrophobicContact CB-CE2 4.31Å; L154-Y207 HydrophobicContact CB-CG 3.86Å; L154-Y207 HydrophobicContact CD2-CD2 4.05Å; L154-Y207 HydrophobicContact CD2-CE1 4.33Å; L154-Y207 HydrophobicContact CD2-CE2 3.7Å; L154-Y207 HydrophobicContact CG-CE1 4.37Å; L154-L209 PolarHBondContact N-O 2.81Å; L154-I210 HydrophobicContact CB-CG1 4.17Å; L154-I210 HydrophobicContact CB-CG2 4.47Å; L154-I210 HydrophobicContact CD2-CD1 4.31Å; L154-I210 HydrophobicContact CD2-CG1 4.32Å; L154-I210 HydrophobicContact CD2-CG2 4.24Å; L154-I210 HydrophobicContact CG-CG2 4.38Å; L154-I210 CarbonylContact O-C 3.56Å; L154-I210 VanDerWaalsContact O-CA 3.3Å; L154-I210 WeakPolarHBondContact O-CA 3.4Å; L154-S211 PolarHBondContact O-N 3.38Å; L154-S211 PolarHBondContact O-OG 3.19Å
155	D	98.5	Very high	95	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.021	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	113.2	173	-164.3	8.2	0	0	0	112.1	A158 T164 Y175 A176 T177 S211	D155-A158 HydrophobicContact CB-CB 4.01Å; D155-T164 HydrophobicContact CB-CG2 3.9Å; D155-T164 VanDerWaalsContact OD2-CB 3.31Å; D155-T164 WeakPolarHBondContact OD2-CB 3.46Å; D155-T164 PolarHBondContact OD2-OG1 2.98Å; D155-Y175 PolarHBondContact N-O 3.05Å; D155-A176 CarbonylContact O-C 3.49Å; D155-A176 WeakPolarHBondContact O-CA 3.33Å; D155-T177 PolarHBondContact O-N 2.99Å; D155-S211 WeakPolarHBondContact CA-OG 3.47Å; D155-S211 VanDerWaalsContact CB-OG 3.31Å; D155-S211 WeakPolarHBondContact CB-OG 3.25Å; D155-S211 PolarHBondContact OD1-OG 3.01Å
156	L	97	Very high	95.1	Very high	3 Å²	3	40 Å²	40	2%	0.016	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	119	-179.1	-64.2	165.3	0	0	0	110	L154 T177 W200 I210 S211 L215 L225 I229	L154-L156 HydrophobicContact CD2-CD2 4.02Å; L154-L156 HydrophobicContact CD2-CG 4.31Å; L154-L156 HydrophobicContact CG-CD2 4.23Å; L154-L156 HydrophobicContact CG-CG 4.27Å; L156-T177 WeakPolarHBondContact CA-OG1 3.43Å; L156-T177 HydrophobicContact CD2-CG2 4.18Å; L156-W200 HydrophobicContact CD2-CD2 3.86Å; L156-W200 HydrophobicContact CD2-CE3 4.33Å; L156-W200 HydrophobicContact CD2-CG 4.05Å; L156-W200 HydrophobicContact CD2-CZ2 4.46Å; L156-I210 HydrophobicContact CD1-CG2 3.56Å; L156-I210 HydrophobicContact CG-CG2 4.09Å; L156-S211 WeakPolarHBondContact CB-O 3.39Å; L156-S211 PolarHBondContact N-O 2.93Å; L156-L215 HydrophobicContact CB-CD2 3.73Å; L156-L225 HydrophobicContact CD1-CD1 4.18Å; L156-I229 HydrophobicContact CD1-CD1 3.65Å; L156-I229 HydrophobicContact CD1-CG1 3.69Å
157	G	93.4	Very high	95.3	Very high	26 Å²	26	36.9 Å²	36.9	27%	0.268	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	47.9	-176.3	0	0	0	0	0	112.5	G159 T177	G157-G159 PolarHBondContact O-N 3.13Å; G157-T177 WeakPolarHBondContact CA-O 3.49Å; G157-T177 PolarHBondContact N-O 2.87Å; G157-T177 VanDerWaalsContact N-O 3.09Å; G157-T177 PolarHBondContact N-OG1 2.82Å
158	A	93.3	Very high	95.4	Very high	6 Å²	6	30.7 Å²	30.7	5%	0.05	16%	0.156	C	C	.	.			trans	-64.9	-12	-169.2	0	0	0	0	0	114.8	D155 D160 G161 A176 T177 L187	D155-A158 HydrophobicContact CB-CB 4.01Å; A158-D160 PolarHBondContact O-N 3.33Å; A158-G161 PolarHBondContact O-N 3.41Å; A158-A176 HydrophobicContact CB-CB 3.8Å; A158-T177 PolarHBondContact N-O 3.24Å; A158-L187 HydrophobicContact CB-CD1 3.98Å; A158-L187 HydrophobicContact CB-CD2 3.76Å
159	G	89.3	Confident	95.3	Very high	7 Å²	7	29 Å²	29	7%	0.072	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	-130.8	-177.7	0	0	0	0	0	111.6	G157 G161 E178 M183	G157-G159 PolarHBondContact O-N 3.13Å; G159-G161 PolarHBondContact O-N 3.17Å; G159-E178 WeakPolarHBondContact CA-OE2 3.39Å; G159-E178 PolarHBondContact N-OE2 2.77Å; G159-M183 WeakPolarHBondContact O-CB 3.4Å
160	D	87.6	Confident	95.4	Very high	27 Å²	27	23.4 Å²	23.4	14%	0.144	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-4.2	177.8	71.6	-10.3	0	0	0	114	S129 A158 G162 M183 K190	S129-D160 WeakPolarHBondContact CA-OD2 3.36Å; S129-D160 VanDerWaalsContact CB-OD2 3.31Å; S129-D160 WeakPolarHBondContact CB-OD2 3.39Å; S129-D160 PolarHBondContact OG-OD2 3.28Å; A158-D160 PolarHBondContact O-N 3.33Å; D160-G162 PolarHBondContact OD1-N 3.21Å; D160-M183 HydrophobicContact CB-SD 3.92Å; D160-K190 WeakPolarHBondContact O-CE 3.42Å
161	G	92.4	Very high	95.4	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	81	14.5	-180	0	0	0	0	0	114.9	A158 G159 T164 E165 L187	A158-G161 PolarHBondContact O-N 3.41Å; G159-G161 PolarHBondContact O-N 3.17Å; G161-T164 WeakPolarHBondContact CA-OG1 3.35Å; G161-E165 PolarHBondContact O-N 3Å; G161-E165 VanDerWaalsContact O-N 3.13Å; G161-L187 VanDerWaalsContact CA-CD2 3.46Å
162	G	91.7	Very high	95.4	Very high	23 Å²	23	28.8 Å²	28.8	24%	0.237	16%	0.158	C	C	.	.	H	α-helix	trans	-64	-49.2	178.4	0	0	0	0	0	112.6	D160 E165	D160-G162 PolarHBondContact OD1-N 3.21Å; G162-E165 WeakPolarHBondContact O-CB 3.37Å; G162-E165 PolarHBondContact O-N 3.23Å
163	V	94.2	Very high	95.4	Very high	14 Å²	14	27.5 Å²	27.5	9%	0.085	16%	0.155	C	C	.	.	H	α-helix	trans	-72.1	-34.5	177	-169.6	0	0	0	0	111.1	M130 V132 F133 E165 V166 M167 L213	M130-V163 HydrophobicContact CB-CG2 4.47Å; M130-V163 WeakPolarHBondContact O-CG2 3.2Å; V132-V163 HydrophobicContact CB-CG1 4.31Å; V132-V163 HydrophobicContact CG2-CG1 4.41Å; V132-V163 HydrophobicContact CG2-CG2 4.14Å; F133-V163 HydrophobicContact CE1-CG1 4.4Å; F133-V163 HydrophobicContact CE2-CG1 4.01Å; F133-V163 HydrophobicContact CZ-CG1 3.85Å; V163-E165 PolarHBondContact O-N 3.36Å; V163-V166 WeakPolarHBondContact O-CB 3.49Å; V163-V166 PolarHBondContact O-N 3.43Å; V163-V166 VanDerWaalsContact O-N 3.13Å; V163-M167 HydrophobicContact CG1-CE 4.38Å; V163-M167 PolarHBondContact O-N 3.13Å; V163-L213 HydrophobicContact CB-CD1 4.23Å; V163-L213 HydrophobicContact CG1-CD1 3.47Å; V163-L213 VanDerWaalsContact CG1-CD1 3.47Å
164	T	97.3	Very high	95.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-56.8	-33.8	173.7	-35.8	0	0	0	0	112.5	D155 G161 V166 M167 G168 V174 Y192	D155-T164 HydrophobicContact CB-CG2 3.9Å; D155-T164 VanDerWaalsContact OD2-CB 3.31Å; D155-T164 WeakPolarHBondContact OD2-CB 3.46Å; D155-T164 PolarHBondContact OD2-OG1 2.98Å; G161-T164 WeakPolarHBondContact CA-OG1 3.35Å; T164-V166 VanDerWaalsContact C-N 3.33Å; T164-V166 PolarHBondContact O-N 2.69Å; T164-M167 PolarHBondContact O-N 3.07Å; T164-G168 WeakPolarHBondContact O-CA 3.31Å; T164-G168 PolarHBondContact O-N 3.45Å; T164-V174 HydrophobicContact CG2-CG1 3.69Å; T164-Y192 HydrophobicContact CG2-CD2 4.09Å; T164-Y192 HydrophobicContact CG2-CE2 3.66Å
165	E	96.4	Very high	95.4	Very high	113 Å²	113	28.9 Å²	28.9	53%	0.528	16%	0.162	S	C	.	.	H	α-helix	trans	-65.3	-36.5	179.2	-175.1	164.5	-150	0	0	112.4	G161 G162 V163 A169 K190 Y192	G161-E165 PolarHBondContact O-N 3Å; G161-E165 VanDerWaalsContact O-N 3.13Å; G162-E165 WeakPolarHBondContact O-CB 3.37Å; G162-E165 PolarHBondContact O-N 3.23Å; V163-E165 PolarHBondContact O-N 3.36Å; E165-A169 PolarHBondContact O-N 3.17Å; E165-K190 IonicContact OE1-NZ 3.58Å; E165-K190 IonicContact OE2-NZ 3.29Å; E165-K190 PolarHBondContact OE2-NZ 3.45Å; E165-Y192 VanDerWaalsContact CA-OH 3.31Å; E165-Y192 WeakPolarHBondContact CA-OH 3.31Å; E165-Y192 PolarHBondContact N-OH 2.98Å
166	V	96.3	Very high	95.4	Very high	33 Å²	33	28.7 Å²	28.7	20%	0.2	16%	0.161	C	C	.	.	H	α-helix	trans	-64.2	-47.5	176.1	-176.9	0	0	0	0	110.4	F133 A135 L138 V163 T164	F133-V166 HydrophobicContact CD2-CG1 4.05Å; F133-V166 HydrophobicContact CE2-CB 4.41Å; F133-V166 HydrophobicContact CE2-CG1 4.14Å; A135-V166 HydrophobicContact CB-CG1 4.19Å; L138-V166 HydrophobicContact CD2-CG1 4.23Å; V163-V166 WeakPolarHBondContact O-CB 3.49Å; V163-V166 PolarHBondContact O-N 3.43Å; V163-V166 VanDerWaalsContact O-N 3.13Å; T164-V166 VanDerWaalsContact C-N 3.33Å; T164-V166 PolarHBondContact O-N 2.69Å
167	M	96.9	Very high	95.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-71.7	-44.5	179	-62.6	-180	-70.3	0	0	112.1	F133 L138 L153 V163 T164 A169 H170 F171 S211 L213 I241	F133-M167 HydrophobicContact CE2-CG 3.76Å; F133-M167 HydrophobicContact CE2-SD 4.36Å; F133-M167 HydrophobicContact CZ-CG 3.79Å; F133-M167 HydrophobicContact CZ-SD 3.77Å; L138-M167 HydrophobicContact CD1-CG 4.34Å; L138-M167 HydrophobicContact CD2-CB 4.19Å; L138-M167 HydrophobicContact CD2-CG 3.73Å; L153-M167 HydrophobicContact CD2-CB 3.62Å; V163-M167 HydrophobicContact CG1-CE 4.38Å; V163-M167 PolarHBondContact O-N 3.13Å; T164-M167 PolarHBondContact O-N 3.07Å; M167-A169 PolarHBondContact O-N 3.12Å; M167-A169 VanDerWaalsContact O-N 3.14Å; M167-H170 WeakPolarHBondContact O-CB 3.34Å; M167-H170 PolarHBondContact O-N 3.13Å; M167-F171 WeakPolarHBondContact O-CD2 3.35Å; M167-S211 VanDerWaalsContact CE-OG 3.25Å; M167-S211 WeakPolarHBondContact CE-OG 3.46Å; M167-S211 VanDerWaalsContact SD-CB 3.58Å; M167-L213 HydrophobicContact CE-CD1 3.9Å; M167-L213 HydrophobicContact SD-CD1 4.39Å; M167-I241 HydrophobicContact SD-CG2 3.9Å
168	G	96.8	Very high	95.3	Very high	12 Å²	12	28.5 Å²	28.5	12%	0.124	15%	0.153	C	C	.	.	H	α-helix	trans	-62.3	-23.3	-172.4	0	0	0	0	0	114.1	T164 H170 F171	T164-G168 WeakPolarHBondContact O-CA 3.31Å; T164-G168 PolarHBondContact O-N 3.45Å; G168-H170 PolarHBondContact O-N 3.31Å; G168-H170 VanDerWaalsContact O-N 3.1Å; G168-F171 PolarHBondContact O-N 3.05Å
169	A	94.9	Very high	95	Very high	61 Å²	61	33.4 Å²	33.4	50%	0.504	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-22.7	172.4	0	0	0	0	0	113.3	R149 E165 M167	R149-A169 PolarHBondContact NE-O 3.21Å; E165-A169 PolarHBondContact O-N 3.17Å; M167-A169 PolarHBondContact O-N 3.12Å; M167-A169 VanDerWaalsContact O-N 3.14Å
170	H	96.4	Very high	94.6	Very high	10 Å²	10	33.6 Å²	33.6	5%	0.046	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	2.3	179.1	-66.2	-80.2	0	0	0	114.3	W148 R149 G150 M167 G168	W148-H170 HydrophobicContact CE3-CB 3.93Å; W148-H170 HydrophobicContact CZ3-CB 3.93Å; W148-H170 PolarHBondContact O-ND1 3.34Å; W148-H170 VanDerWaalsContact O-ND1 3.14Å; R149-H170 CarbonylContact C-O 3.53Å; R149-H170 WeakPolarHBondContact CA-O 3.43Å; G150-H170 PolarHBondContact N-O 2.93Å; M167-H170 WeakPolarHBondContact O-CB 3.34Å; M167-H170 PolarHBondContact O-N 3.13Å; G168-H170 PolarHBondContact O-N 3.31Å; G168-H170 VanDerWaalsContact O-N 3.1Å
171	F	97.8	Very high	94.6	Very high	17 Å²	17	36.9 Å²	36.9	8%	0.075	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	146.6	-174.9	-65.5	-92.2	0	0	0	112.8	W148 G150 L153 M167 G168 V174 D208 L209	W148-F171 AromaticContact CH2-CE1 3.68Å; W148-F171 HydrophobicContact CH2-CE1 3.68Å; W148-F171 HydrophobicContact CH2-CE2 4.42Å; W148-F171 AromaticContact CH2-CZ 3.53Å; W148-F171 HydrophobicContact CH2-CZ 3.53Å; W148-F171 AromaticContact CZ3-CE1 3.99Å; W148-F171 HydrophobicContact CZ3-CE1 3.99Å; W148-F171 AromaticContact CZ3-CE2 3.97Å; W148-F171 HydrophobicContact CZ3-CE2 3.97Å; W148-F171 AromaticContact CZ3-CZ 3.53Å; W148-F171 HydrophobicContact CZ3-CZ 3.53Å; G150-F171 WeakPolarHBondContact O-CA 3.46Å; L153-F171 HydrophobicContact CB-CB 3.89Å; L153-F171 HydrophobicContact CB-CD1 3.95Å; L153-F171 HydrophobicContact CB-CD2 3.67Å; L153-F171 HydrophobicContact CB-CE1 4.43Å; L153-F171 HydrophobicContact CB-CE2 4.2Å; L153-F171 HydrophobicContact CB-CG 3.54Å; L153-F171 HydrophobicContact CD2-CD2 4.08Å; L153-F171 HydrophobicContact CG-CD2 4.38Å; M167-F171 WeakPolarHBondContact O-CD2 3.35Å; G168-F171 PolarHBondContact O-N 3.05Å; F171-V174 HydrophobicContact CB-CG2 4.43Å; F171-D208 HydrophobicContact CE1-CB 3.95Å; F171-L209 HydrophobicContact CE1-CB 3.77Å; F171-L209 HydrophobicContact CE2-CB 4.15Å; F171-L209 HydrophobicContact CE2-CD2 3.65Å; F171-L209 HydrophobicContact CZ-CB 3.33Å; F171-L209 HydrophobicContact CZ-CD2 3.57Å; F171-L209 HydrophobicContact CZ-CG 4.08Å
172	R	97.4	Very high	94.2	Very high	176 Å²	176	38.3 Å²	38.3	66%	0.664	21%	0.214	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	-39.4	176.4	-68.5	-177.3	178.8	160.1	6.6	112.2	G150 E151	G150-R172 PolarHBondContact O-N 3.13Å; G150-R172 VanDerWaalsContact O-N 3.15Å; E151-R172 PolarHBondContact O-N 2.93Å; E151-R172 IonicContact OE1-CZ 3.54Å; E151-R172 IonicContact OE1-NE 2.76Å; E151-R172 IonicContact OE1-NH1 2.68Å; E151-R172 PolarHBondContact OE1-NH1 2.98Å; E151-R172 IonicContact OE1-NH2 3.31Å; E151-R172 WeakPolarHBondContact OE2-CD 3.43Å; E151-R172 IonicContact OE2-CZ 2.76Å; E151-R172 IonicContact OE2-NE 3.36Å; E151-R172 IonicContact OE2-NH1 3.6Å; E151-R172 PolarHBondContact OE2-NH1 2.99Å
173	E	98.3	Very high	93.9	Very high	46 Å²	46	38.2 Å²	38.2	22%	0.215	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	124.8	179	-59.6	-176.1	-142.7	0	0	110.1	E151 R152 L153 Y175 R193	E151-E173 PolarHBondContact O-N 3.41Å; R152-E173 WeakPolarHBondContact CA-O 3.5Å; R152-E173 HydrophobicContact CG-CB 4.32Å; L153-E173 PolarHBondContact N-O 3.02Å; E173-Y175 HydrophobicContact CB-CD2 4.41Å; E173-Y175 HydrophobicContact CB-CE2 3.68Å; E173-Y175 PolarHBondContact OE2-OH 3.41Å; E173-R193 IonicContact OE2-CZ 2.75Å; E173-R193 VanDerWaalsContact OE2-CZ 3.29Å; E173-R193 IonicContact OE2-NH1 2.78Å; E173-R193 PolarHBondContact OE2-NH1 3.03Å; E173-R193 IonicContact OE2-NH2 2.84Å
174	V	98.6	Very high	93.8	Very high	18 Å²	18	41 Å²	41	11%	0.109	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	118.9	177.9	-178.7	0	0	0	0	108.9	L153 T164 F171 Y192 R193	L153-V174 HydrophobicContact CD2-CG1 4.12Å; L153-V174 HydrophobicContact CD2-CG2 4.39Å; L153-V174 HydrophobicContact CG-CG1 4.49Å; T164-V174 HydrophobicContact CG2-CG1 3.69Å; F171-V174 HydrophobicContact CB-CG2 4.43Å; V174-Y192 HydrophobicContact CB-CD1 3.8Å; V174-Y192 HydrophobicContact CB-CE1 4.24Å; V174-Y192 HydrophobicContact CB-CG 4.42Å; V174-Y192 HydrophobicContact CG1-CD1 3.63Å; V174-Y192 HydrophobicContact CG1-CD2 4.44Å; V174-Y192 HydrophobicContact CG1-CE1 3.96Å; V174-Y192 HydrophobicContact CG1-CG 3.9Å; V174-R193 PolarHBondContact O-N 2.64Å
175	Y	98.6	Very high	93.4	Very high	10 Å²	10	47.5 Å²	47.5	4%	0.039	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	146.1	173.7	-63	-94.5	0	0	0	109.4	R152 L153 L154 D155 E173 R193 L195 F205 Y207	R152-Y175 HydrophobicContact CB-CE2 4.43Å; R152-Y175 HydrophobicContact CG-CE2 4.38Å; L153-Y175 WeakPolarHBondContact O-CB 3.39Å; L153-Y175 PolarHBondContact O-N 3.48Å; L154-Y175 CarbonylContact C-O 3.56Å; L154-Y175 WeakPolarHBondContact CA-O 3.22Å; D155-Y175 PolarHBondContact N-O 3.05Å; E173-Y175 HydrophobicContact CB-CD2 4.41Å; E173-Y175 HydrophobicContact CB-CE2 3.68Å; E173-Y175 PolarHBondContact OE2-OH 3.41Å; Y175-R193 VanDerWaalsContact CA-O 3.25Å; Y175-R193 WeakPolarHBondContact CA-O 3.47Å; Y175-R193 HydrophobicContact CD1-CB 3.54Å; Y175-R193 HydrophobicContact CD1-CG 4.47Å; Y175-R193 HydrophobicContact CE1-CB 3.75Å; Y175-R193 VanDerWaalsContact CE1-CD 3.47Å; Y175-R193 HydrophobicContact CE1-CG 4.26Å; Y175-R193 HydrophobicContact CG-CB 4.23Å; Y175-R193 PolarHBondContact OH-NH1 2.82Å; Y175-L195 HydrophobicContact CD1-CD1 3.69Å; Y175-L195 HydrophobicContact CD1-CD2 4.06Å; Y175-L195 HydrophobicContact CD1-CG 3.92Å; Y175-L195 HydrophobicContact CG-CD1 4.14Å; Y175-F205 HydrophobicContact CD1-CZ 4.41Å; Y175-F205 HydrophobicContact CE1-CE2 4.4Å; Y175-F205 AromaticContact CE1-CZ 3.66Å; Y175-F205 HydrophobicContact CE1-CZ 3.66Å; Y175-F205 HydrophobicContact CE2-CE2 4.02Å; Y175-F205 AromaticContact CE2-CZ 3.98Å; Y175-F205 HydrophobicContact CE2-CZ 3.98Å; Y175-F205 AromaticContact CZ-CE2 3.95Å; Y175-F205 AromaticContact CZ-CZ 3.41Å; Y175-F205 VanDerWaalsContact CZ-CZ 3.41Å; Y175-F205 WeakPolarHBondContact OH-CZ 3.42Å; Y175-Y207 HydrophobicContact CD2-CD1 4.46Å; Y175-Y207 AromaticContact CD2-CE1 3.81Å; Y175-Y207 HydrophobicContact CD2-CE1 3.81Å; Y175-Y207 HydrophobicContact CE2-CE1 4.44Å; Y175-Y207 HydrophobicContact CG-CE1 4.01Å
176	A	98.2	Very high	93.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	147.7	177.8	0	0	0	0	0	111.1	D155 A158 L187 R193 L194 L195	D155-A176 CarbonylContact O-C 3.49Å; D155-A176 WeakPolarHBondContact O-CA 3.33Å; A158-A176 HydrophobicContact CB-CB 3.8Å; A176-L187 HydrophobicContact CB-CD1 4.15Å; A176-L187 HydrophobicContact CB-CD2 4.37Å; A176-R193 PolarHBondContact N-O 3.3Å; A176-L194 HydrophobicContact CB-CD2 4.2Å; A176-L194 WeakPolarHBondContact O-CA 3.43Å; A176-L195 PolarHBondContact O-N 3.23Å
177	T	96.6	Very high	93	Very high	4 Å²	4	42.3 Å²	42.3	3%	0.025	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	146.8	168.8	64.8	0	0	0	0	109.5	L154 D155 L156 G157 A158 L195 W200	L154-T177 HydrophobicContact CD1-CG2 4.27Å; D155-T177 PolarHBondContact O-N 2.99Å; L156-T177 WeakPolarHBondContact CA-OG1 3.43Å; L156-T177 HydrophobicContact CD2-CG2 4.18Å; G157-T177 WeakPolarHBondContact CA-O 3.49Å; G157-T177 PolarHBondContact N-O 2.87Å; G157-T177 VanDerWaalsContact N-O 3.09Å; G157-T177 PolarHBondContact N-OG1 2.82Å; A158-T177 PolarHBondContact N-O 3.24Å; T177-L195 HydrophobicContact CG2-CB 4.08Å; T177-W200 HydrophobicContact CG2-CB 4.07Å; T177-W200 HydrophobicContact CG2-CG 4.23Å
178	E	92.1	Very high	92.8	Very high	22 Å²	22	47.9 Å²	47.9	10%	0.103	24%	0.243	C	C	.	.			trans	-159.6	152.8	178.1	179.9	44.3	-115.2	0	0	108.4	G159 S180 M183 K184 L187	G159-E178 WeakPolarHBondContact CA-OE2 3.39Å; G159-E178 PolarHBondContact N-OE2 2.77Å; E178-S180 WeakPolarHBondContact OE1-CB 3.47Å; E178-S180 PolarHBondContact OE1-N 3.48Å; E178-M183 HydrophobicContact CG-CB 3.44Å; E178-M183 VanDerWaalsContact CG-CB 3.44Å; E178-M183 HydrophobicContact CG-CG 4.43Å; E178-K184 HydrophobicContact CB-CG 4.08Å; E178-K184 HydrophobicContact CG-CG 4.32Å; E178-K184 WeakPolarHBondContact O-CE 3.23Å; E178-K184 PolarHBondContact O-NZ 3.1Å; E178-L187 HydrophobicContact CB-CD1 3.77Å; E178-L187 HydrophobicContact CG-CD1 4.32Å
179	V	86.4	Confident	92.7	Very high	108 Å²	108	55.3 Å²	55.3	66%	0.655	27%	0.268	S	S	*	.	S	Bend	trans	-99	-32.1	176.9	-64.5	0	0	0	0	111.7	P181 I197	V179-P181 WeakPolarHBondContact O-CD 3.14Å; V179-I197 HydrophobicContact CG1-CD1 3.85Å; V179-I197 HydrophobicContact CG1-CG1 4.05Å
180	S	82.6	Confident	92.6	Very high	12 Å²	12	55.9 Å²	55.9	8%	0.084	26%	0.259	C	S	.	.			trans	-76.1	120	-175.7	177.9	0	0	0	0	112.5	E178 P182 M183 K184	E178-S180 WeakPolarHBondContact OE1-CB 3.47Å; E178-S180 PolarHBondContact OE1-N 3.48Å; S180-P182 WeakPolarHBondContact OG-CD 3.43Å; S180-M183 PolarHBondContact O-N 2.86Å; S180-M183 VanDerWaalsContact O-N 3.12Å; S180-K184 PolarHBondContact O-N 2.93Å
181	P	86.5	Confident	92.6	Very high	95 Å²	95	64.4 Å²	64.4	62%	0.617	30%	0.296	S	S	*	.	H	α-helix	trans	-58.8	-41.7	-179.8	-22.5	31.8	0	0	0	115.1	V179 M183 K184 W185	V179-P181 WeakPolarHBondContact O-CD 3.14Å; P181-M183 VanDerWaalsContact C-N 3.28Å; P181-M183 PolarHBondContact O-N 2.64Å; P181-K184 PolarHBondContact O-N 2.72Å; P181-W185 PolarHBondContact O-N 3.02Å; P181-W185 VanDerWaalsContact O-N 3.1Å
182	P	84	Confident	92.6	Very high	30 Å²	30	65 Å²	65	20%	0.195	30%	0.298	C	S	.	.	H	α-helix	trans	-59.3	-37.8	173.5	-26.4	35.3	0	0	0	113.4	S180 W185 H186	S180-P182 WeakPolarHBondContact OG-CD 3.43Å; P182-W185 WeakPolarHBondContact O-CB 3.29Å; P182-W185 PolarHBondContact O-N 3.44Å; P182-H186 PolarHBondContact O-CD2 2.68Å; P182-H186 VanDerWaalsContact O-CD2 3.28Å; P182-H186 PolarHBondContact O-N 3.4Å
183	M	86.4	Confident	92.6	Very high	21 Å²	21	62.9 Å²	62.9	10%	0.103	29%	0.29	C	S	.	.	H	α-helix	trans	-71.7	-42.4	180	-65.2	-49.8	-172.1	0	0	111.5	G159 D160 E178 S180 P181 W185 H186 L187	G159-M183 WeakPolarHBondContact O-CB 3.4Å; D160-M183 HydrophobicContact CB-SD 3.92Å; E178-M183 HydrophobicContact CG-CB 3.44Å; E178-M183 VanDerWaalsContact CG-CB 3.44Å; E178-M183 HydrophobicContact CG-CG 4.43Å; S180-M183 PolarHBondContact O-N 2.86Å; S180-M183 VanDerWaalsContact O-N 3.12Å; P181-M183 VanDerWaalsContact C-N 3.28Å; P181-M183 PolarHBondContact O-N 2.64Å; M183-W185 PolarHBondContact O-N 3.29Å; M183-H186 PolarHBondContact O-N 3.3Å; M183-L187 WeakPolarHBondContact O-CG 3.46Å; M183-L187 PolarHBondContact O-N 2.82Å
184	K	90.8	Very high	92.5	Very high	74 Å²	74	62.9 Å²	62.9	32%	0.322	29%	0.291	S	S	.	.	H	α-helix	trans	-51.4	-43.5	168.9	-72.3	-175.4	-179.1	-175.2	0	112.1	E178 S180 P181 H186 L187 Q188 L194	E178-K184 HydrophobicContact CB-CG 4.08Å; E178-K184 HydrophobicContact CG-CG 4.32Å; E178-K184 WeakPolarHBondContact O-CE 3.23Å; E178-K184 PolarHBondContact O-NZ 3.1Å; S180-K184 PolarHBondContact O-N 2.93Å; P181-K184 PolarHBondContact O-N 2.72Å; K184-H186 PolarHBondContact O-N 3.35Å; K184-L187 PolarHBondContact O-N 3.1Å; K184-Q188 WeakPolarHBondContact O-CG 3.29Å; K184-Q188 PolarHBondContact O-N 2.79Å; K184-L194 HydrophobicContact CB-CD1 3.61Å; K184-L194 HydrophobicContact CD-CD1 4.36Å; K184-L194 HydrophobicContact CG-CD1 3.9Å
185	W	90.1	Very high	92.5	Very high	135 Å²	135	63.2 Å²	63.2	51%	0.511	29%	0.292	S	S	.	.	H	α-helix	trans	-62.4	-41.8	177.7	-179.9	84.5	0	0	0	112.7	P181 P182 M183 Q188 R189	P181-W185 PolarHBondContact O-N 3.02Å; P181-W185 VanDerWaalsContact O-N 3.1Å; P182-W185 WeakPolarHBondContact O-CB 3.29Å; P182-W185 PolarHBondContact O-N 3.44Å; M183-W185 PolarHBondContact O-N 3.29Å; W185-Q188 PolarHBondContact O-N 3.43Å; W185-R189 HydrophobicContact CD2-CG 4.44Å; W185-R189 VanDerWaalsContact CZ2-CD 3.49Å; W185-R189 HydrophobicContact CZ2-CG 4.45Å; W185-R189 VanDerWaalsContact CZ3-CD 3.5Å; W185-R189 VanDerWaalsContact CZ3-NH1 3.28Å; W185-R189 WeakPolarHBondContact O-CG 3.43Å; W185-R189 PolarHBondContact O-N 2.61Å; W185-R189 VanDerWaalsContact O-N 3.1Å
186	H	88.5	Confident	92.2	Very high	37 Å²	37	63.8 Å²	63.8	17%	0.171	30%	0.301	C	S	.	.	H	α-helix	trans	-63.2	-44.2	175	-70.6	-53.8	0	0	0	112.4	G123 P182 M183 K184 Q188 R189 K190	G123-H186 PolarHBondContact O-NE2 3.12Å; P182-H186 PolarHBondContact O-CD2 2.68Å; P182-H186 VanDerWaalsContact O-CD2 3.28Å; P182-H186 PolarHBondContact O-N 3.4Å; M183-H186 PolarHBondContact O-N 3.3Å; K184-H186 PolarHBondContact O-N 3.35Å; H186-Q188 VanDerWaalsContact C-N 3.33Å; H186-Q188 PolarHBondContact O-N 3.14Å; H186-R189 WeakPolarHBondContact O-CB 3.44Å; H186-R189 PolarHBondContact O-N 2.91Å; H186-R189 VanDerWaalsContact O-N 3.13Å; H186-K190 PolarHBondContact O-N 3.14Å; H186-K190 VanDerWaalsContact O-N 3.13Å
187	L	94.3	Very high	91.7	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.9	-41.2	177.2	-64.3	168.9	0	0	0	111.7	A158 G161 A176 E178 M183 K184 R189 K190 K191 Y192 L194	A158-L187 HydrophobicContact CB-CD1 3.98Å; A158-L187 HydrophobicContact CB-CD2 3.76Å; G161-L187 VanDerWaalsContact CA-CD2 3.46Å; A176-L187 HydrophobicContact CB-CD1 4.15Å; A176-L187 HydrophobicContact CB-CD2 4.37Å; E178-L187 HydrophobicContact CB-CD1 3.77Å; E178-L187 HydrophobicContact CG-CD1 4.32Å; M183-L187 WeakPolarHBondContact O-CG 3.46Å; M183-L187 PolarHBondContact O-N 2.82Å; K184-L187 PolarHBondContact O-N 3.1Å; L187-R189 VanDerWaalsContact C-N 3.34Å; L187-R189 PolarHBondContact O-N 2.79Å; L187-K190 CarbonylContact O-C 3.6Å; L187-K190 PolarHBondContact O-N 3.24Å; L187-K191 PolarHBondContact O-N 2.5Å; L187-Y192 HydrophobicContact CB-CD2 4.31Å; L187-Y192 HydrophobicContact CD2-CD2 3.73Å; L187-Y192 HydrophobicContact CD2-CE2 4.14Å; L187-Y192 PolarHBondContact O-N 3.41Å; L187-L194 HydrophobicContact CB-CD2 3.74Å; L187-L194 HydrophobicContact CD1-CD2 3.71Å; L187-L194 HydrophobicContact CG-CD2 4.37Å
188	Q	94.1	Very high	91.2	Very high	117 Å²	117	73.7 Å²	73.7	55%	0.547	35%	0.353	S	S	.	.	H	α-helix	trans	-63.3	-37.5	174.6	-74.7	173.6	-31.9	0	0	112.6	K184 W185 H186 K190 K191 L194	K184-Q188 WeakPolarHBondContact O-CG 3.29Å; K184-Q188 PolarHBondContact O-N 2.79Å; W185-Q188 PolarHBondContact O-N 3.43Å; H186-Q188 VanDerWaalsContact C-N 3.33Å; H186-Q188 PolarHBondContact O-N 3.14Å; Q188-K190 VanDerWaalsContact C-N 3.26Å; Q188-K190 PolarHBondContact O-N 3Å; Q188-K191 WeakPolarHBondContact O-CA 3.49Å; Q188-K191 PolarHBondContact O-N 2.57Å; Q188-L194 HydrophobicContact CG-CD1 3.55Å; Q188-L194 HydrophobicContact CG-CG 4.03Å
189	R	93.8	Very high	91.3	Very high	168 Å²	168	78.2 Å²	78.2	63%	0.634	37%	0.374	S	S	*	.	H	α-helix	trans	-65.1	-31	175	-72.2	-178.8	68.4	-168.5	1.2	112.7	W185 H186 L187 K191	W185-R189 HydrophobicContact CD2-CG 4.44Å; W185-R189 VanDerWaalsContact CZ2-CD 3.49Å; W185-R189 HydrophobicContact CZ2-CG 4.45Å; W185-R189 VanDerWaalsContact CZ3-CD 3.5Å; W185-R189 VanDerWaalsContact CZ3-NH1 3.28Å; W185-R189 WeakPolarHBondContact O-CG 3.43Å; W185-R189 PolarHBondContact O-N 2.61Å; W185-R189 VanDerWaalsContact O-N 3.1Å; H186-R189 WeakPolarHBondContact O-CB 3.44Å; H186-R189 PolarHBondContact O-N 2.91Å; H186-R189 VanDerWaalsContact O-N 3.13Å; L187-R189 VanDerWaalsContact C-N 3.34Å; L187-R189 PolarHBondContact O-N 2.79Å; R189-K191 PolarHBondContact O-N 3.44Å
190	K	93.8	Very high	91.7	Very high	73 Å²	73	73.5 Å²	73.5	32%	0.317	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	1.3	170.7	-67.9	177.3	174	-82.6	0	113.1	D160 E165 H186 L187 Q188 Y192	D160-K190 WeakPolarHBondContact O-CE 3.42Å; E165-K190 IonicContact OE1-NZ 3.58Å; E165-K190 IonicContact OE2-NZ 3.29Å; E165-K190 PolarHBondContact OE2-NZ 3.45Å; H186-K190 PolarHBondContact O-N 3.14Å; H186-K190 VanDerWaalsContact O-N 3.13Å; L187-K190 CarbonylContact O-C 3.6Å; L187-K190 PolarHBondContact O-N 3.24Å; Q188-K190 VanDerWaalsContact C-N 3.26Å; Q188-K190 PolarHBondContact O-N 3Å; K190-Y192 HydrophobicContact CB-CD1 4.23Å; K190-Y192 HydrophobicContact CB-CD2 3.92Å; K190-Y192 HydrophobicContact CB-CE1 3.98Å; K190-Y192 HydrophobicContact CB-CE2 3.67Å; K190-Y192 HydrophobicContact CB-CG 4.2Å; K190-Y192 HydrophobicContact CD-CD2 4.45Å; K190-Y192 HydrophobicContact CD-CE2 3.63Å; K190-Y192 HydrophobicContact CG-CE2 4.3Å; K190-Y192 PolarHBondContact O-N 2.91Å
191	K	95.5	Very high	92.3	Very high	189 Å²	189	76.1 Å²	76.1	82%	0.822	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	24.4	-179.7	-53	178.3	-179.8	176	0	114.1	L187 Q188 R189	L187-K191 PolarHBondContact O-N 2.5Å; Q188-K191 WeakPolarHBondContact O-CA 3.49Å; Q188-K191 PolarHBondContact O-N 2.57Å; R189-K191 PolarHBondContact O-N 3.44Å
192	Y	97.1	Very high	92.6	Very high	30 Å²	30	78.9 Å²	78.9	12%	0.118	36%	0.36	C	S	.	.			trans	-74.8	147.8	172	-55	-27.4	0	0	0	110.7	T164 E165 V174 L187 K190 L194	T164-Y192 HydrophobicContact CG2-CD2 4.09Å; T164-Y192 HydrophobicContact CG2-CE2 3.66Å; E165-Y192 VanDerWaalsContact CA-OH 3.31Å; E165-Y192 WeakPolarHBondContact CA-OH 3.31Å; E165-Y192 PolarHBondContact N-OH 2.98Å; V174-Y192 HydrophobicContact CB-CD1 3.8Å; V174-Y192 HydrophobicContact CB-CE1 4.24Å; V174-Y192 HydrophobicContact CB-CG 4.42Å; V174-Y192 HydrophobicContact CG1-CD1 3.63Å; V174-Y192 HydrophobicContact CG1-CD2 4.44Å; V174-Y192 HydrophobicContact CG1-CE1 3.96Å; V174-Y192 HydrophobicContact CG1-CG 3.9Å; L187-Y192 HydrophobicContact CB-CD2 4.31Å; L187-Y192 HydrophobicContact CD2-CD2 3.73Å; L187-Y192 HydrophobicContact CD2-CE2 4.14Å; L187-Y192 PolarHBondContact O-N 3.41Å; K190-Y192 HydrophobicContact CB-CD1 4.23Å; K190-Y192 HydrophobicContact CB-CD2 3.92Å; K190-Y192 HydrophobicContact CB-CE1 3.98Å; K190-Y192 HydrophobicContact CB-CE2 3.67Å; K190-Y192 HydrophobicContact CB-CG 4.2Å; K190-Y192 HydrophobicContact CD-CD2 4.45Å; K190-Y192 HydrophobicContact CD-CE2 3.63Å; K190-Y192 HydrophobicContact CG-CE2 4.3Å; K190-Y192 PolarHBondContact O-N 2.91Å; Y192-L194 PolarHBondContact O-N 3.22Å
193	R	97.6	Very high	93	Very high	131 Å²	131	79.3 Å²	79.3	49%	0.494	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	106.1	177.5	-65.7	-177.2	-176.5	-177.1	10	109.3	E173 V174 Y175 A176	E173-R193 IonicContact OE2-CZ 2.75Å; E173-R193 VanDerWaalsContact OE2-CZ 3.29Å; E173-R193 IonicContact OE2-NH1 2.78Å; E173-R193 PolarHBondContact OE2-NH1 3.03Å; E173-R193 IonicContact OE2-NH2 2.84Å; V174-R193 PolarHBondContact O-N 2.64Å; Y175-R193 VanDerWaalsContact CA-O 3.25Å; Y175-R193 WeakPolarHBondContact CA-O 3.47Å; Y175-R193 HydrophobicContact CD1-CB 3.54Å; Y175-R193 HydrophobicContact CD1-CG 4.47Å; Y175-R193 HydrophobicContact CE1-CB 3.75Å; Y175-R193 VanDerWaalsContact CE1-CD 3.47Å; Y175-R193 HydrophobicContact CE1-CG 4.26Å; Y175-R193 HydrophobicContact CG-CB 4.23Å; Y175-R193 PolarHBondContact OH-NH1 2.82Å; A176-R193 PolarHBondContact N-O 3.3Å
194	L	97.6	Very high	93.4	Very high	46 Å²	46	82.4 Å²	82.4	24%	0.241	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	133	177.4	-71.1	-172.7	0	0	0	111.6	A176 K184 L187 Q188 Y192	A176-L194 HydrophobicContact CB-CD2 4.2Å; A176-L194 WeakPolarHBondContact O-CA 3.43Å; K184-L194 HydrophobicContact CB-CD1 3.61Å; K184-L194 HydrophobicContact CD-CD1 4.36Å; K184-L194 HydrophobicContact CG-CD1 3.9Å; L187-L194 HydrophobicContact CB-CD2 3.74Å; L187-L194 HydrophobicContact CD1-CD2 3.71Å; L187-L194 HydrophobicContact CG-CD2 4.37Å; Q188-L194 HydrophobicContact CG-CD1 3.55Å; Q188-L194 HydrophobicContact CG-CG 4.03Å; Y192-L194 PolarHBondContact O-N 3.22Å
195	L	97	Very high	93.7	Very high	26 Å²	26	81.6 Å²	81.6	14%	0.136	40%	0.395	C	S	.	.			trans	-114.1	148.6	171.9	-60.1	175.6	0	0	0	109.9	L154 Y175 A176 T177 W200 T203 Y207	L154-L195 HydrophobicContact CD1-CD1 4.13Å; Y175-L195 HydrophobicContact CD1-CD1 3.69Å; Y175-L195 HydrophobicContact CD1-CD2 4.06Å; Y175-L195 HydrophobicContact CD1-CG 3.92Å; Y175-L195 HydrophobicContact CG-CD1 4.14Å; A176-L195 PolarHBondContact O-N 3.23Å; T177-L195 HydrophobicContact CG2-CB 4.08Å; L195-W200 HydrophobicContact CB-CB 4.37Å; L195-W200 HydrophobicContact CD1-CB 3.96Å; L195-T203 HydrophobicContact CD1-CG2 3.87Å; L195-T203 HydrophobicContact CD2-CG2 4.24Å; L195-Y207 WeakPolarHBondContact CD1-OH 3.44Å
196	G	92.8	Very high	94	Very high	21 Å²	21	78.9 Å²	78.9	22%	0.216	39%	0.388	C	S	.	.			trans	-64	155.4	166.2	0	0	0	0	0	112	D198 E199 W200	G196-D198 PolarHBondContact O-N 3.22Å; G196-E199 PolarHBondContact N-OE2 3.14Å; G196-E199 PolarHBondContact O-N 3.41Å; G196-W200 PolarHBondContact O-N 3.3Å
197	I	87.9	Confident	94.5	Very high	78 Å²	78	77.1 Å²	77.1	40%	0.4	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-28.1	178.2	-58.3	-63.3	0	0	0	111.7	V179 W200	V179-I197 HydrophobicContact CG1-CD1 3.85Å; V179-I197 HydrophobicContact CG1-CG1 4.05Å; I197-W200 PolarHBondContact O-NE1 3.02Å
198	D	86.8	Confident	94.7	Very high	135 Å²	135	78.9 Å²	78.9	72%	0.722	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-2.2	178.1	-53	-51.5	0	0	0	112.9	G196 H202	G196-D198 PolarHBondContact O-N 3.22Å; D198-H202 PolarHBondContact O-CD2 2.79Å
199	E	94	Very high	94.9	Very high	116 Å²	116	73.5 Å²	73.5	54%	0.542	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-28.5	-171.3	-64.6	178.5	170.2	0	0	113.2	G196 Q201 H202 T203	G196-E199 PolarHBondContact N-OE2 3.14Å; G196-E199 PolarHBondContact O-N 3.41Å; E199-Q201 PolarHBondContact O-N 3.27Å; E199-Q201 VanDerWaalsContact O-N 3.15Å; E199-H202 CarbonylContact O-C 3.6Å; E199-H202 PolarHBondContact O-N 2.87Å; E199-T203 WeakPolarHBondContact O-CG2 3.45Å; E199-T203 PolarHBondContact O-N 3.32Å
200	W	95.6	Very high	95.2	Very high	10 Å²	10	65.5 Å²	65.5	4%	0.038	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-23.6	-171.3	65.3	-91.3	0	0	0	114.1	L154 L156 T177 L195 G196 I197 Y207 L225 I229	L154-W200 HydrophobicContact CD1-CB 4.29Å; L154-W200 HydrophobicContact CD2-CB 3.92Å; L154-W200 HydrophobicContact CD2-CD2 4.16Å; L154-W200 HydrophobicContact CD2-CE3 3.71Å; L154-W200 HydrophobicContact CD2-CG 4.28Å; L156-W200 HydrophobicContact CD2-CD2 3.86Å; L156-W200 HydrophobicContact CD2-CE3 4.33Å; L156-W200 HydrophobicContact CD2-CG 4.05Å; L156-W200 HydrophobicContact CD2-CZ2 4.46Å; T177-W200 HydrophobicContact CG2-CB 4.07Å; T177-W200 HydrophobicContact CG2-CG 4.23Å; L195-W200 HydrophobicContact CB-CB 4.37Å; L195-W200 HydrophobicContact CD1-CB 3.96Å; G196-W200 PolarHBondContact O-N 3.3Å; I197-W200 PolarHBondContact O-NE1 3.02Å; W200-Y207 PolarHBondContact O-OH 3.42Å; W200-L225 HydrophobicContact CH2-CD1 4.08Å; W200-L225 HydrophobicContact CZ2-CD1 3.71Å; W200-I229 HydrophobicContact CH2-CG1 4.06Å; W200-I229 HydrophobicContact CZ3-CG1 4.24Å
201	Q	94.3	Very high	95.4	Very high	66 Å²	66	62 Å²	62	31%	0.308	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-12.6	173.9	-67.3	-178.7	68.8	0	0	113.4	E199	E199-Q201 PolarHBondContact O-N 3.27Å; E199-Q201 VanDerWaalsContact O-N 3.15Å
202	H	93.3	Very high	95.5	Very high	154 Å²	154	53 Å²	53	71%	0.713	28%	0.28	S	S	*	.			trans	-124.8	26.3	-167	-60.5	-45.5	0	0	0	112.9	D198 E199 G204	D198-H202 PolarHBondContact O-CD2 2.79Å; E199-H202 CarbonylContact O-C 3.6Å; E199-H202 PolarHBondContact O-N 2.87Å; H202-G204 VanDerWaalsContact C-N 3.25Å; H202-G204 PolarHBondContact O-N 3.48Å
203	T	92.5	Very high	95.5	Very high	38 Å²	38	52.6 Å²	52.6	23%	0.233	28%	0.28	C	S	.	.	S	Bend	trans	-75.1	-12.9	-179	58.7	0	0	0	0	114	L195 E199 F205 Y207	L195-T203 HydrophobicContact CD1-CG2 3.87Å; L195-T203 HydrophobicContact CD2-CG2 4.24Å; E199-T203 WeakPolarHBondContact O-CG2 3.45Å; E199-T203 PolarHBondContact O-N 3.32Å; T203-F205 VanDerWaalsContact C-N 3.27Å; T203-F205 VanDerWaalsContact CB-CE1 3.5Å; T203-F205 HydrophobicContact CG2-CE1 4.38Å; T203-F205 HydrophobicContact CG2-CE2 4.45Å; T203-F205 HydrophobicContact CG2-CZ 4Å; T203-F205 WeakPolarHBondContact O-CD1 3.44Å; T203-F205 PolarHBondContact OG1-O 3.25Å; T203-Y207 WeakPolarHBondContact CG2-OH 3.21Å
204	G	93.9	Very high	95.3	Very high	86 Å²	86	46.8 Å²	46.8	89%	0.887	26%	0.258	S	S	*	.	S	Bend	trans	79.4	8.2	-176.3	0	0	0	0	0	114	H202	H202-G204 VanDerWaalsContact C-N 3.25Å; H202-G204 PolarHBondContact O-N 3.48Å
205	F	96.4	Very high	95	Very high	58 Å²	58	46.7 Å²	46.7	25%	0.254	26%	0.258	S	S	.	.	S	Bend	trans	-140.5	170.7	172.8	57.4	-102.5	0	0	0	110.6	R152 Y175 T203 Y207	R152-F205 VanDerWaalsContact CD-CD2 3.42Å; Y175-F205 HydrophobicContact CD1-CZ 4.41Å; Y175-F205 HydrophobicContact CE1-CE2 4.4Å; Y175-F205 AromaticContact CE1-CZ 3.66Å; Y175-F205 HydrophobicContact CE1-CZ 3.66Å; Y175-F205 HydrophobicContact CE2-CE2 4.02Å; Y175-F205 AromaticContact CE2-CZ 3.98Å; Y175-F205 HydrophobicContact CE2-CZ 3.98Å; Y175-F205 AromaticContact CZ-CE2 3.95Å; Y175-F205 AromaticContact CZ-CZ 3.41Å; Y175-F205 VanDerWaalsContact CZ-CZ 3.41Å; Y175-F205 WeakPolarHBondContact OH-CZ 3.42Å; T203-F205 VanDerWaalsContact C-N 3.27Å; T203-F205 VanDerWaalsContact CB-CE1 3.5Å; T203-F205 HydrophobicContact CG2-CE1 4.38Å; T203-F205 HydrophobicContact CG2-CE2 4.45Å; T203-F205 HydrophobicContact CG2-CZ 4Å; T203-F205 WeakPolarHBondContact O-CD1 3.44Å; T203-F205 PolarHBondContact OG1-O 3.25Å; F205-Y207 HydrophobicContact CD2-CE1 4.31Å; F205-Y207 HydrophobicContact CE2-CD1 4.28Å; F205-Y207 AromaticContact CE2-CE1 3.55Å; F205-Y207 HydrophobicContact CE2-CE1 3.55Å; F205-Y207 HydrophobicContact CE2-CE2 4.47Å; F205-Y207 AromaticContact CE2-CZ 3.66Å; F205-Y207 HydrophobicContact CZ-CE1 4.49Å
206	Q	97.6	Very high	94.7	Very high	78 Å²	78	45.6 Å²	45.6	36%	0.364	25%	0.252	S	S	.	.			trans	-113.5	163.8	178.7	-69.6	164.6	-1.2	0	0	111.1	R152 S232 L233 V234	R152-Q206 PolarHBondContact NH1-O 3.45Å; Q206-S232 CarbonylContact C-O 3.43Å; Q206-S232 VanDerWaalsContact CA-O 3.23Å; Q206-S232 WeakPolarHBondContact CA-O 3.4Å; Q206-S232 WeakPolarHBondContact CB-O 3.4Å; Q206-L233 PolarHBondContact OE1-O 3.15Å; Q206-V234 HydrophobicContact CB-CG2 3.8Å
207	Y	98.6	Very high	94.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-108.6	138.7	-175.2	-57.9	-82.7	0	0	0	111.7	R152 L154 Y175 L195 W200 T203 F205 I210 S232 L233 V234	R152-Y207 HydrophobicContact CB-CD1 4.01Å; L154-Y207 HydrophobicContact CB-CD1 3.53Å; L154-Y207 HydrophobicContact CB-CD2 4.23Å; L154-Y207 HydrophobicContact CB-CE1 3.59Å; L154-Y207 HydrophobicContact CB-CE2 4.31Å; L154-Y207 HydrophobicContact CB-CG 3.86Å; L154-Y207 HydrophobicContact CD2-CD2 4.05Å; L154-Y207 HydrophobicContact CD2-CE1 4.33Å; L154-Y207 HydrophobicContact CD2-CE2 3.7Å; L154-Y207 HydrophobicContact CG-CE1 4.37Å; Y175-Y207 HydrophobicContact CD2-CD1 4.46Å; Y175-Y207 AromaticContact CD2-CE1 3.81Å; Y175-Y207 HydrophobicContact CD2-CE1 3.81Å; Y175-Y207 HydrophobicContact CE2-CE1 4.44Å; Y175-Y207 HydrophobicContact CG-CE1 4.01Å; L195-Y207 WeakPolarHBondContact CD1-OH 3.44Å; W200-Y207 PolarHBondContact O-OH 3.42Å; T203-Y207 WeakPolarHBondContact CG2-OH 3.21Å; F205-Y207 HydrophobicContact CD2-CE1 4.31Å; F205-Y207 HydrophobicContact CE2-CD1 4.28Å; F205-Y207 AromaticContact CE2-CE1 3.55Å; F205-Y207 HydrophobicContact CE2-CE1 3.55Å; F205-Y207 HydrophobicContact CE2-CE2 4.47Å; F205-Y207 AromaticContact CE2-CZ 3.66Å; F205-Y207 HydrophobicContact CZ-CE1 4.49Å; Y207-I210 HydrophobicContact CD2-CD1 3.88Å; Y207-I210 HydrophobicContact CD2-CG1 4.11Å; Y207-I210 HydrophobicContact CG-CD1 4.32Å; Y207-I210 HydrophobicContact CG-CG1 4.05Å; Y207-S232 WeakPolarHBondContact CD2-O 3.36Å; Y207-S232 PolarHBondContact N-O 3.41Å; Y207-L233 WeakPolarHBondContact O-CA 3.35Å; Y207-V234 PolarHBondContact O-N 3.38Å
208	D	98.4	Very high	94.1	Very high	37 Å²	37	48.3 Å²	48.3	20%	0.198	25%	0.253	C	S	.	.	S	Bend	trans	-74	-35.5	173.6	-61.1	-75.8	0	0	0	110.8	E151 R152 F171 G238 R239	E151-D208 WeakPolarHBondContact CA-OD2 3.34Å; E151-D208 VanDerWaalsContact CB-OD2 3.28Å; E151-D208 WeakPolarHBondContact CB-OD2 3.46Å; E151-D208 PolarHBondContact N-OD2 3.46Å; R152-D208 PolarHBondContact N-OD2 3.1Å; R152-D208 PolarHBondContact O-N 2.83Å; F171-D208 HydrophobicContact CE1-CB 3.95Å; D208-G238 CarbonylContact O-C 3.6Å; D208-G238 WeakPolarHBondContact O-CA 3.48Å; D208-R239 PolarHBondContact O-N 2.89Å
209	L	98.7	Very high	94.1	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	131.1	174.5	-172.6	67.9	0	0	0	109.9	L142 R152 L153 L154 F171 R239 I241	L142-L209 HydrophobicContact CD1-CD2 4.23Å; L142-L209 HydrophobicContact CD2-CD1 4.23Å; R152-L209 PolarHBondContact O-N 3.13Å; L153-L209 WeakPolarHBondContact CA-O 3.36Å; L153-L209 HydrophobicContact CD1-CB 4.11Å; L153-L209 HydrophobicContact CD1-CD2 3.99Å; L153-L209 HydrophobicContact CD1-CG 4.02Å; L154-L209 PolarHBondContact N-O 2.81Å; F171-L209 HydrophobicContact CE1-CB 3.77Å; F171-L209 HydrophobicContact CE2-CB 4.15Å; F171-L209 HydrophobicContact CE2-CD2 3.65Å; F171-L209 HydrophobicContact CZ-CB 3.33Å; F171-L209 HydrophobicContact CZ-CD2 3.57Å; F171-L209 HydrophobicContact CZ-CG 4.08Å; L209-R239 VanDerWaalsContact CA-O 3.32Å; L209-R239 WeakPolarHBondContact CA-O 3.48Å; L209-R239 HydrophobicContact CD1-CB 3.91Å; L209-R239 WeakPolarHBondContact CD1-O 3.5Å; L209-I241 HydrophobicContact CD1-CB 4.24Å; L209-I241 HydrophobicContact CD1-CG2 4.08Å; L209-I241 HydrophobicContact CD2-CG2 4.33Å; L209-I241 HydrophobicContact CG-CG2 4.27Å
210	I	98.8	Very high	93.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	131.1	165.3	-59.4	178	0	0	0	107.7	L154 L156 Y207 I229 L233 R239 L240 I241	L154-I210 HydrophobicContact CB-CG1 4.17Å; L154-I210 HydrophobicContact CB-CG2 4.47Å; L154-I210 HydrophobicContact CD2-CD1 4.31Å; L154-I210 HydrophobicContact CD2-CG1 4.32Å; L154-I210 HydrophobicContact CD2-CG2 4.24Å; L154-I210 HydrophobicContact CG-CG2 4.38Å; L154-I210 CarbonylContact O-C 3.56Å; L154-I210 VanDerWaalsContact O-CA 3.3Å; L154-I210 WeakPolarHBondContact O-CA 3.4Å; L156-I210 HydrophobicContact CD1-CG2 3.56Å; L156-I210 HydrophobicContact CG-CG2 4.09Å; Y207-I210 HydrophobicContact CD2-CD1 3.88Å; Y207-I210 HydrophobicContact CD2-CG1 4.11Å; Y207-I210 HydrophobicContact CG-CD1 4.32Å; Y207-I210 HydrophobicContact CG-CG1 4.05Å; I210-I229 HydrophobicContact CB-CG2 4.04Å; I210-I229 HydrophobicContact CD1-CB 4.44Å; I210-I229 HydrophobicContact CD1-CG2 3.87Å; I210-I229 HydrophobicContact CG1-CG2 4.5Å; I210-I229 HydrophobicContact CG2-CD1 4.47Å; I210-I229 HydrophobicContact CG2-CG1 4.14Å; I210-I229 HydrophobicContact CG2-CG2 4.03Å; I210-L233 HydrophobicContact CB-CD2 4.07Å; I210-L233 HydrophobicContact CD1-CD2 3.77Å; I210-L233 HydrophobicContact CD1-CG 3.95Å; I210-L233 HydrophobicContact CG1-CD2 3.59Å; I210-L233 HydrophobicContact CG1-CG 4.32Å; I210-R239 PolarHBondContact N-O 3.47Å; I210-L240 CarbonylContact O-C 3.53Å; I210-L240 VanDerWaalsContact O-CA 3.3Å; I210-L240 WeakPolarHBondContact O-CA 3.27Å; I210-L240 VanDerWaalsContact O-CD1 3.31Å; I210-L240 WeakPolarHBondContact O-CD1 3.25Å; I210-I241 PolarHBondContact O-N 3.35Å
211	S	98.6	Very high	93.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133.9	171.4	55.1	0	0	0	0	111.3	L154 D155 L156 M167 I241	L154-S211 PolarHBondContact O-N 3.38Å; L154-S211 PolarHBondContact O-OG 3.19Å; D155-S211 WeakPolarHBondContact CA-OG 3.47Å; D155-S211 VanDerWaalsContact CB-OG 3.31Å; D155-S211 WeakPolarHBondContact CB-OG 3.25Å; D155-S211 PolarHBondContact OD1-OG 3.01Å; L156-S211 WeakPolarHBondContact CB-O 3.39Å; L156-S211 PolarHBondContact N-O 2.93Å; M167-S211 VanDerWaalsContact CE-OG 3.25Å; M167-S211 WeakPolarHBondContact CE-OG 3.46Å; M167-S211 VanDerWaalsContact SD-CB 3.58Å; S211-I241 CarbonylContact C-O 3.53Å; S211-I241 WeakPolarHBondContact CA-O 3.25Å
212	C	97.7	Very high	93.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	79.6	175.4	178.6	0	0	0	0	107.7	I229 L240 I241 L242 A243	C212-I229 HydrophobicContact CB-CD1 4.05Å; C212-L240 HydrophobicContact CB-CD1 3.86Å; C212-I241 PolarHBondContact N-O 3.37Å; C212-L242 WeakPolarHBondContact O-CA 3.31Å; C212-A243 PolarHBondContact O-N 3.37Å; C212-A243 VanDerWaalsContact O-N 3.1Å
213	L	96.6	Very high	93.8	Very high	20 Å²	20	32 Å²	32	11%	0.105	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	112.9	-168.4	-52.5	179.7	0	0	0	110.3	F133 V163 M167 L215 I241 A243	F133-L213 HydrophobicContact CE1-CD1 4.21Å; F133-L213 HydrophobicContact CE1-CD2 4.21Å; F133-L213 HydrophobicContact CZ-CD1 4.15Å; V163-L213 HydrophobicContact CB-CD1 4.23Å; V163-L213 HydrophobicContact CG1-CD1 3.47Å; V163-L213 VanDerWaalsContact CG1-CD1 3.47Å; M167-L213 HydrophobicContact CE-CD1 3.9Å; M167-L213 HydrophobicContact SD-CD1 4.39Å; L213-L215 PolarHBondContact O-N 2.67Å; L213-L215 VanDerWaalsContact O-N 3.15Å; L213-I241 HydrophobicContact CD2-CG1 4.31Å; L213-I241 HydrophobicContact CD2-CG2 4.39Å; L213-A243 HydrophobicContact CB-CB 4.17Å; L213-A243 HydrophobicContact CD2-CB 3.84Å
214	N	94	Very high	94	Very high	9 Å²	9	34.2 Å²	34.2	5%	0.048	19%	0.189	C	C	.	.	S	Bend	trans	52.2	39.7	177.2	-63.2	-49.1	0	0	0	113.2	A243 V245 Y299 D314	N214-A243 PolarHBondContact N-O 3.45Å; N214-V245 WeakPolarHBondContact OD1-CG2 3.35Å; N214-V245 PolarHBondContact OD1-N 3.46Å; N214-Y299 HydrophobicContact CB-CD1 4.27Å; N214-Y299 HydrophobicContact CB-CE1 3.73Å; N214-Y299 WeakPolarHBondContact ND2-CD1 3.38Å; N214-Y299 WeakPolarHBondContact ND2-CD2 3.28Å; N214-Y299 VanDerWaalsContact ND2-CG 3.32Å; N214-D314 PolarHBondContact ND2-OD2 3.3Å; N214-D314 PolarHBondContact OD1-OD1 2.87Å; N214-D314 PolarHBondContact OD1-OD2 3.3Å
215	L	91.4	Very high	94	Very high	44 Å²	44	31.2 Å²	31.2	23%	0.23	15%	0.153	C	C	.	.			trans	-110.9	-32.7	-178.8	-179.9	64.1	0	0	0	112.2	L156 L213 D217 R218 C219 L225	L156-L215 HydrophobicContact CB-CD2 3.73Å; L213-L215 PolarHBondContact O-N 2.67Å; L213-L215 VanDerWaalsContact O-N 3.15Å; L215-D217 VanDerWaalsContact C-N 3.26Å; L215-D217 PolarHBondContact O-N 2.96Å; L215-R218 CarbonylContact O-C 3.57Å; L215-R218 WeakPolarHBondContact O-CA 3.37Å; L215-R218 PolarHBondContact O-N 3.45Å; L215-C219 PolarHBondContact O-N 3.26Å; L215-C219 VanDerWaalsContact O-N 3.15Å; L215-L225 HydrophobicContact CD2-CD2 4.06Å; L215-L225 HydrophobicContact CG-CD2 4.39Å
216	L	90.2	Very high	94.1	Very high	3 Å²	3	28.4 Å²	28.4	2%	0.016	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-58.7	-37.7	-176.3	-76.1	-166.3	0	0	0	112.9	R218 C219 P222 L225 L226 L242 F248 I265	L216-R218 PolarHBondContact O-N 2.89Å; L216-C219 PolarHBondContact O-N 3.38Å; L216-P222 HydrophobicContact CD2-CB 4.04Å; L216-L225 HydrophobicContact CD2-CD2 4.11Å; L216-L226 HydrophobicContact CD1-CD1 4.35Å; L216-L226 HydrophobicContact CD2-CD1 4.45Å; L216-L226 HydrophobicContact CD2-CD2 4.19Å; L216-L226 HydrophobicContact CD2-CG 4.14Å; L216-L242 HydrophobicContact CD1-CD1 3.73Å; L216-L242 HydrophobicContact CD1-CD2 4.22Å; L216-L242 HydrophobicContact CD1-CG 4.39Å; L216-L242 HydrophobicContact CG-CD1 4.16Å; L216-F248 HydrophobicContact CB-CE2 4.2Å; L216-F248 HydrophobicContact CB-CZ 4.23Å; L216-I265 HydrophobicContact CD1-CD1 4.24Å
217	D	83.4	Confident	94	Very high	21 Å²	21	28.9 Å²	28.9	11%	0.112	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-72.1	-7.7	178.2	64.5	-46.7	0	0	0	113	L215 F248 P250 W251	L215-D217 VanDerWaalsContact C-N 3.26Å; L215-D217 PolarHBondContact O-N 2.96Å; D217-F248 HydrophobicContact CB-CE2 3.92Å; D217-F248 HydrophobicContact CB-CZ 4.26Å; D217-P250 HydrophobicContact CB-CB 4.48Å; D217-P250 CarbonylContact O-C 3.32Å; D217-P250 VanDerWaalsContact O-CA 3.25Å; D217-P250 WeakPolarHBondContact O-CA 3.18Å; D217-W251 CarbonylContact O-C 3.44Å; D217-W251 PolarHBondContact O-N 3.21Å; D217-W251 VanDerWaalsContact O-O 3.12Å
218	R	85.2	Confident	93.9	Very high	136 Å²	136	28.9 Å²	28.9	51%	0.513	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-120.6	10.8	179	-57.5	-173.7	179.1	-78.4	-5	113	L215 L216	L215-R218 CarbonylContact O-C 3.57Å; L215-R218 WeakPolarHBondContact O-CA 3.37Å; L215-R218 PolarHBondContact O-N 3.45Å; L216-R218 PolarHBondContact O-N 2.89Å
219	C	86.9	Confident	93.9	Very high	26 Å²	26	27.1 Å²	27.1	18%	0.176	13%	0.13	C	C	.	.			trans	-100.1	138.3	178.8	-170.6	0	0	0	0	110.7	L215 L216 P222 L225 V252 P261	L215-C219 PolarHBondContact O-N 3.26Å; L215-C219 VanDerWaalsContact O-N 3.15Å; L216-C219 PolarHBondContact O-N 3.38Å; C219-P222 HydrophobicContact CB-CB 4.16Å; C219-L225 HydrophobicContact CB-CD2 4.38Å; C219-V252 WeakPolarHBondContact O-CG1 3.34Å; C219-P261 WeakPolarHBondContact O-CB 3.19Å
220	D	89.3	Confident	93.8	Very high	40 Å²	40	29 Å²	29	21%	0.214	14%	0.138	C	C	.	.	S	Bend	trans	-77	-32.8	179.4	-157.4	29.5	0	0	0	112.3	P222 P261 R262 E263	D220-P222 VanDerWaalsContact C-CD 3.5Å; D220-P261 WeakPolarHBondContact OD1-CA 3.43Å; D220-R262 PolarHBondContact O-N 2.88Å; D220-R262 WeakPolarHBondContact OD1-CG 3.31Å; D220-R262 PolarHBondContact OD1-N 3.27Å; D220-R262 WeakPolarHBondContact OD2-CD 3.49Å; D220-R262 WeakPolarHBondContact OD2-CG 3.43Å; D220-E263 PolarHBondContact O-N 2.98Å
221	D	92.9	Very high	93.7	Very high	55 Å²	55	37.1 Å²	37.1	29%	0.294	17%	0.169	S	C	.	.	S	Bend	trans	-127.2	65.7	-179.4	-55.7	-69.5	0	0	0	111	L223 D224 L225 E263	D221-L223 PolarHBondContact O-N 2.82Å; D221-D224 HydrophobicContact CB-CB 4.17Å; D221-D224 PolarHBondContact O-N 3.36Å; D221-L225 PolarHBondContact O-N 3.13Å; D221-E263 VanDerWaalsContact C-OE2 3.25Å
222	P	93.9	Very high	93.7	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.019	17%	0.171	C	C	.	.	H	α-helix	trans	-68.7	-29.3	-169.3	27.2	-38.3	0	0	0	115.9	L216 C219 D220 L225 L226 I265	L216-P222 HydrophobicContact CD2-CB 4.04Å; C219-P222 HydrophobicContact CB-CB 4.16Å; D220-P222 VanDerWaalsContact C-CD 3.5Å; P222-L225 WeakPolarHBondContact O-CB 3.47Å; P222-L226 WeakPolarHBondContact O-CG 3.42Å; P222-L226 PolarHBondContact O-N 3.48Å; P222-L226 VanDerWaalsContact O-N 3.12Å; P222-I265 HydrophobicContact CB-CD1 3.78Å; P222-I265 HydrophobicContact CB-CG1 4.35Å; P222-I265 HydrophobicContact CG-CD1 3.91Å; P222-I265 HydrophobicContact CG-CG1 3.92Å
223	L	95.5	Very high	93.7	Very high	14 Å²	14	37.7 Å²	37.7	7%	0.073	17%	0.173	C	C	.	.	H	α-helix	trans	-74.9	-36.4	175	-53.7	176.3	0	0	0	110.6	D221 L225 L226 R227 E263 I265 V283 V287	D221-L223 PolarHBondContact O-N 2.82Å; L223-L225 VanDerWaalsContact C-N 3.31Å; L223-L226 HydrophobicContact CD2-CD1 4.4Å; L223-L226 PolarHBondContact O-N 2.99Å; L223-R227 WeakPolarHBondContact O-CG 3.03Å; L223-R227 PolarHBondContact O-N 2.82Å; L223-E263 WeakPolarHBondContact CA-OE2 3.4Å; L223-E263 VanDerWaalsContact CB-CD 3.46Å; L223-E263 WeakPolarHBondContact CB-OE1 3.31Å; L223-E263 VanDerWaalsContact CB-OE2 3.23Å; L223-E263 WeakPolarHBondContact CB-OE2 3.36Å; L223-E263 HydrophobicContact CD1-CG 4.14Å; L223-E263 WeakPolarHBondContact CD1-OE1 3.49Å; L223-E263 HydrophobicContact CG-CG 4.16Å; L223-E263 PolarHBondContact N-OE2 2.94Å; L223-I265 HydrophobicContact CD2-CD1 4.13Å; L223-I265 HydrophobicContact CD2-CG1 3.87Å; L223-I265 HydrophobicContact CG-CG1 4.37Å; L223-V283 HydrophobicContact CD2-CG1 4.14Å; L223-V287 HydrophobicContact CB-CG1 4.04Å; L223-V287 HydrophobicContact CD2-CG1 3.95Å
224	D	94.9	Very high	93.7	Very high	84 Å²	84	38.3 Å²	38.3	45%	0.449	18%	0.177	S	C	.	.	H	α-helix	trans	-63.5	-38.7	172.6	-79.4	-16.2	0	0	0	111.8	D221 R227 G228 E263	D221-D224 HydrophobicContact CB-CB 4.17Å; D221-D224 PolarHBondContact O-N 3.36Å; D224-R227 PolarHBondContact O-N 2.67Å; D224-R227 IonicContact OD1-CZ 2.95Å; D224-R227 IonicContact OD1-NH1 2.73Å; D224-R227 PolarHBondContact OD1-NH1 3.22Å; D224-G228 PolarHBondContact O-N 2.91Å; D224-E263 PolarHBondContact N-OE2 3.39Å
225	L	95.7	Very high	93.7	Very high	23 Å²	23	41.7 Å²	41.7	12%	0.12	20%	0.199	C	C	.	.	H	α-helix	trans	-56.7	-49.7	169.5	177.4	62.2	0	0	0	111.2	L156 W200 L215 L216 C219 D221 P222 L223 R227 G228 I229	L156-L225 HydrophobicContact CD1-CD1 4.18Å; W200-L225 HydrophobicContact CH2-CD1 4.08Å; W200-L225 HydrophobicContact CZ2-CD1 3.71Å; L215-L225 HydrophobicContact CD2-CD2 4.06Å; L215-L225 HydrophobicContact CG-CD2 4.39Å; L216-L225 HydrophobicContact CD2-CD2 4.11Å; C219-L225 HydrophobicContact CB-CD2 4.38Å; D221-L225 PolarHBondContact O-N 3.13Å; P222-L225 WeakPolarHBondContact O-CB 3.47Å; L223-L225 VanDerWaalsContact C-N 3.31Å; L225-R227 PolarHBondContact O-N 3.2Å; L225-G228 PolarHBondContact O-N 3.36Å; L225-G228 VanDerWaalsContact O-N 3.16Å; L225-I229 HydrophobicContact CD1-CD1 4.35Å; L225-I229 HydrophobicContact CD1-CG1 4.48Å; L225-I229 HydrophobicContact CG-CD1 4.12Å; L225-I229 WeakPolarHBondContact O-CG1 3.33Å; L225-I229 PolarHBondContact O-N 2.99Å
226	L	97.4	Very high	93.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.8	-43.1	179	-68.3	170	0	0	0	112.4	L216 P222 L223 G228 I229 H230 L240 L242 V287 F289	L216-L226 HydrophobicContact CD1-CD1 4.35Å; L216-L226 HydrophobicContact CD2-CD1 4.45Å; L216-L226 HydrophobicContact CD2-CD2 4.19Å; L216-L226 HydrophobicContact CD2-CG 4.14Å; P222-L226 WeakPolarHBondContact O-CG 3.42Å; P222-L226 PolarHBondContact O-N 3.48Å; P222-L226 VanDerWaalsContact O-N 3.12Å; L223-L226 HydrophobicContact CD2-CD1 4.4Å; L223-L226 PolarHBondContact O-N 2.99Å; L226-G228 VanDerWaalsContact C-N 3.29Å; L226-G228 PolarHBondContact O-N 3Å; L226-I229 HydrophobicContact CD2-CD1 4.42Å; L226-I229 WeakPolarHBondContact O-CB 3.04Å; L226-I229 PolarHBondContact O-N 3.47Å; L226-H230 PolarHBondContact O-N 2.88Å; L226-L240 HydrophobicContact CD2-CD2 3.95Å; L226-L242 HydrophobicContact CD2-CD1 3.68Å; L226-V287 HydrophobicContact CB-CB 4.17Å; L226-V287 HydrophobicContact CB-CG1 4.33Å; L226-V287 HydrophobicContact CB-CG2 3.88Å; L226-V287 HydrophobicContact CD1-CG2 3.93Å; L226-V287 HydrophobicContact CG-CG2 4.49Å; L226-F289 WeakPolarHBondContact O-CE2 3.42Å
227	R	96.4	Very high	93.9	Very high	87 Å²	87	46.7 Å²	46.7	33%	0.328	24%	0.235	S	C	.	.	H	α-helix	trans	-62.4	-37.2	174.3	-67.9	173.6	-167.5	116.5	6.8	111.8	L223 D224 L225 H230 R231 E263 V287	L223-R227 WeakPolarHBondContact O-CG 3.03Å; L223-R227 PolarHBondContact O-N 2.82Å; D224-R227 PolarHBondContact O-N 2.67Å; D224-R227 IonicContact OD1-CZ 2.95Å; D224-R227 IonicContact OD1-NH1 2.73Å; D224-R227 PolarHBondContact OD1-NH1 3.22Å; L225-R227 PolarHBondContact O-N 3.2Å; R227-H230 PolarHBondContact O-N 3.38Å; R227-R231 WeakPolarHBondContact O-CG 3.3Å; R227-R231 PolarHBondContact O-N 3.12Å; R227-R231 PolarHBondContact O-NE 3.4Å; R227-E263 IonicContact NH1-OE1 3.73Å; R227-V287 HydrophobicContact CG-CB 4.36Å; R227-V287 HydrophobicContact CG-CG1 4.19Å
228	G	96.3	Very high	94.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.7	-45	173.2	0	0	0	0	0	112.3	D224 L225 L226 R231 S232	D224-G228 PolarHBondContact O-N 2.91Å; L225-G228 PolarHBondContact O-N 3.36Å; L225-G228 VanDerWaalsContact O-N 3.16Å; L226-G228 VanDerWaalsContact C-N 3.29Å; L226-G228 PolarHBondContact O-N 3Å; G228-R231 PolarHBondContact O-N 2.83Å; G228-S232 WeakPolarHBondContact O-CB 3.37Å; G228-S232 PolarHBondContact O-N 3.29Å; G228-S232 PolarHBondContact O-OG 3.11Å
229	I	97.9	Very high	95.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.9	-50.3	174.9	-66.3	167.3	0	0	0	109.7	L156 W200 I210 C212 L225 L226 R231 S232 L233 L240 F289	L156-I229 HydrophobicContact CD1-CD1 3.65Å; L156-I229 HydrophobicContact CD1-CG1 3.69Å; W200-I229 HydrophobicContact CH2-CG1 4.06Å; W200-I229 HydrophobicContact CZ3-CG1 4.24Å; I210-I229 HydrophobicContact CB-CG2 4.04Å; I210-I229 HydrophobicContact CD1-CB 4.44Å; I210-I229 HydrophobicContact CD1-CG2 3.87Å; I210-I229 HydrophobicContact CG1-CG2 4.5Å; I210-I229 HydrophobicContact CG2-CD1 4.47Å; I210-I229 HydrophobicContact CG2-CG1 4.14Å; I210-I229 HydrophobicContact CG2-CG2 4.03Å; C212-I229 HydrophobicContact CB-CD1 4.05Å; L225-I229 HydrophobicContact CD1-CD1 4.35Å; L225-I229 HydrophobicContact CD1-CG1 4.48Å; L225-I229 HydrophobicContact CG-CD1 4.12Å; L225-I229 WeakPolarHBondContact O-CG1 3.33Å; L225-I229 PolarHBondContact O-N 2.99Å; L226-I229 HydrophobicContact CD2-CD1 4.42Å; L226-I229 WeakPolarHBondContact O-CB 3.04Å; L226-I229 PolarHBondContact O-N 3.47Å; I229-R231 VanDerWaalsContact C-N 3.29Å; I229-R231 PolarHBondContact O-N 3.1Å; I229-S232 PolarHBondContact O-N 3.26Å; I229-L233 HydrophobicContact CG2-CD1 4.14Å; I229-L233 HydrophobicContact CG2-CG 4.34Å; I229-L233 WeakPolarHBondContact O-CG 3.41Å; I229-L233 PolarHBondContact O-N 3.46Å; I229-L233 VanDerWaalsContact O-N 3.13Å; I229-L240 HydrophobicContact CD1-CD1 4.18Å; I229-L240 HydrophobicContact CD1-CD2 4.34Å; I229-L240 HydrophobicContact CG2-CB 4.05Å; I229-L240 HydrophobicContact CG2-CD1 4Å; I229-L240 HydrophobicContact CG2-CD2 3.87Å; I229-L240 HydrophobicContact CG2-CG 4.19Å; I229-F289 HydrophobicContact CG2-CZ 3.98Å
230	H	97.3	Very high	95.8	Very high	45 Å²	45	40.5 Å²	40.5	21%	0.208	21%	0.206	C	C	.	.	H	α-helix	trans	-50.4	-49	179.5	-176.6	-81.5	0	0	0	112.2	L226 R227 S232 L233 G288 F289 P321	L226-H230 PolarHBondContact O-N 2.88Å; R227-H230 PolarHBondContact O-N 3.38Å; H230-S232 VanDerWaalsContact C-N 3.26Å; H230-S232 PolarHBondContact O-N 3.13Å; H230-L233 PolarHBondContact O-N 3.01Å; H230-G288 PolarHBondContact CD2-O 3.12Å; H230-G288 PolarHBondContact NE2-O 2.75Å; H230-F289 HydrophobicContact CB-CE2 3.75Å; H230-F289 HydrophobicContact CB-CZ 3.7Å; H230-P321 VanDerWaalsContact CD2-CB 3.5Å; H230-P321 WeakPolarHBondContact CD2-CB 3.47Å; H230-P321 VanDerWaalsContact NE2-CB 3.29Å; H230-P321 WeakPolarHBondContact NE2-CB 3.37Å
231	R	96.1	Very high	96.2	Very high	169 Å²	169	38.6 Å²	38.6	64%	0.638	20%	0.196	S	C	*	.	H	α-helix	trans	-70	-20.1	179.9	-66.9	-179.5	-63.1	-178.3	4.8	114.3	R227 G228 I229	R227-R231 WeakPolarHBondContact O-CG 3.3Å; R227-R231 PolarHBondContact O-N 3.12Å; R227-R231 PolarHBondContact O-NE 3.4Å; G228-R231 PolarHBondContact O-N 2.83Å; I229-R231 VanDerWaalsContact C-N 3.29Å; I229-R231 PolarHBondContact O-N 3.1Å
232	S	97.6	Very high	96.5	Very high	8 Å²	8	36 Å²	36	6%	0.056	18%	0.182	C	C	.	.	H	α-helix	trans	-95.9	-10.1	-176.2	-54.4	0	0	0	0	112.8	Q206 Y207 G228 I229 H230	Q206-S232 CarbonylContact C-O 3.43Å; Q206-S232 VanDerWaalsContact CA-O 3.23Å; Q206-S232 WeakPolarHBondContact CA-O 3.4Å; Q206-S232 WeakPolarHBondContact CB-O 3.4Å; Y207-S232 WeakPolarHBondContact CD2-O 3.36Å; Y207-S232 PolarHBondContact N-O 3.41Å; G228-S232 WeakPolarHBondContact O-CB 3.37Å; G228-S232 PolarHBondContact O-N 3.29Å; G228-S232 PolarHBondContact O-OG 3.11Å; I229-S232 PolarHBondContact O-N 3.26Å; H230-S232 VanDerWaalsContact C-N 3.26Å; H230-S232 PolarHBondContact O-N 3.13Å
233	L	98.2	Very high	96.7	Very high	5 Å²	5	35.8 Å²	35.8	3%	0.026	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-77.9	148.8	175.1	-73	171.6	0	0	0	111.5	Q206 Y207 I210 I229 H230 R239 L240 F289	Q206-L233 PolarHBondContact OE1-O 3.15Å; Y207-L233 WeakPolarHBondContact O-CA 3.35Å; I210-L233 HydrophobicContact CB-CD2 4.07Å; I210-L233 HydrophobicContact CD1-CD2 3.77Å; I210-L233 HydrophobicContact CD1-CG 3.95Å; I210-L233 HydrophobicContact CG1-CD2 3.59Å; I210-L233 HydrophobicContact CG1-CG 4.32Å; I229-L233 HydrophobicContact CG2-CD1 4.14Å; I229-L233 HydrophobicContact CG2-CG 4.34Å; I229-L233 WeakPolarHBondContact O-CG 3.41Å; I229-L233 PolarHBondContact O-N 3.46Å; I229-L233 VanDerWaalsContact O-N 3.13Å; H230-L233 PolarHBondContact O-N 3.01Å; L233-R239 WeakPolarHBondContact CD2-O 3.24Å; L233-L240 HydrophobicContact CD1-CB 4.17Å; L233-F289 HydrophobicContact CD1-CE1 3.7Å; L233-F289 HydrophobicContact CD1-CZ 3.99Å
234	V	97.2	Very high	96.7	Very high	32 Å²	32	35.2 Å²	35.2	19%	0.194	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-60.6	134.1	168.4	177.7	0	0	0	0	108.4	Q206 Y207 T237 G238	Q206-V234 HydrophobicContact CB-CG2 3.8Å; Y207-V234 PolarHBondContact O-N 3.38Å; V234-T237 WeakPolarHBondContact CG1-OG1 3.41Å; V234-G238 VanDerWaalsContact O-CA 3.25Å; V234-G238 WeakPolarHBondContact O-CA 3.14Å; V234-G238 PolarHBondContact O-N 2.71Å
235	P	93.3	Very high	96.7	Very high	80 Å²	80	32.3 Å²	32.3	52%	0.519	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	145.9	-175.3	-12.6	32.9	0	0	0	108.7	T237	P235-T237 PolarHBondContact O-N 3.43Å
236	S	90.9	Very high	96.6	Very high	65 Å²	65	31.4 Å²	31.4	46%	0.455	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	-42.4	-178.5	-37	0	0	0	0	115.6	R239 E323	S236-R239 PolarHBondContact O-NH1 3.47Å; S236-E323 VanDerWaalsContact CB-OE1 3.22Å; S236-E323 WeakPolarHBondContact CB-OE1 3.42Å; S236-E323 PolarHBondContact OG-OE1 3.43Å
237	T	95.3	Very high	96.4	Very high	87 Å²	87	34.9 Å²	34.9	53%	0.534	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-24.4	-172.5	62.7	0	0	0	0	114.1	V234 P235 R239	V234-T237 WeakPolarHBondContact CG1-OG1 3.41Å; P235-T237 PolarHBondContact O-N 3.43Å; T237-R239 PolarHBondContact O-NH1 3.48Å; T237-R239 VanDerWaalsContact O-NH1 3.12Å
238	G	97.7	Very high	96.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.17	C	C	.	.			trans	-64.5	143.5	179.9	0	0	0	0	0	111.8	D208 V234 P321	D208-G238 CarbonylContact O-C 3.6Å; D208-G238 WeakPolarHBondContact O-CA 3.48Å; V234-G238 VanDerWaalsContact O-CA 3.25Å; V234-G238 WeakPolarHBondContact O-CA 3.14Å; V234-G238 PolarHBondContact O-N 2.71Å; G238-P321 VanDerWaalsContact O-CD 3.22Å; G238-P321 WeakPolarHBondContact O-CD 3.35Å
239	R	98.5	Very high	95.8	Very high	53 Å²	53	37.7 Å²	37.7	20%	0.2	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	147.8	177.5	-62.2	-61.5	179	-96.8	9.4	111.7	D208 L209 I210 L233 S236 T237 E292 V318 L319	D208-R239 PolarHBondContact O-N 2.89Å; L209-R239 VanDerWaalsContact CA-O 3.32Å; L209-R239 WeakPolarHBondContact CA-O 3.48Å; L209-R239 HydrophobicContact CD1-CB 3.91Å; L209-R239 WeakPolarHBondContact CD1-O 3.5Å; I210-R239 PolarHBondContact N-O 3.47Å; L233-R239 WeakPolarHBondContact CD2-O 3.24Å; S236-R239 PolarHBondContact O-NH1 3.47Å; T237-R239 PolarHBondContact O-NH1 3.48Å; T237-R239 VanDerWaalsContact O-NH1 3.12Å; R239-E292 WeakPolarHBondContact CD-OE2 3.2Å; R239-E292 IonicContact CZ-OE1 3.74Å; R239-E292 IonicContact CZ-OE2 3.73Å; R239-E292 IonicContact NE-OE1 3.59Å; R239-E292 PolarHBondContact NE-OE1 3.43Å; R239-E292 IonicContact NE-OE2 2.69Å; R239-E292 PolarHBondContact NE-OE2 3.38Å; R239-E292 IonicContact NH2-OE1 3.37Å; R239-E292 PolarHBondContact NH2-OE1 2.9Å; R239-E292 IonicContact NH2-OE2 3.72Å; R239-V318 HydrophobicContact CB-CG1 4.3Å; R239-V318 HydrophobicContact CG-CG1 4.34Å; R239-L319 WeakPolarHBondContact CA-O 3.43Å
240	L	98.8	Very high	95.3	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	123.1	166.3	161.1	62	0	0	0	108.3	I210 C212 L226 I229 L233 L242 F289 V318 L319	I210-L240 CarbonylContact O-C 3.53Å; I210-L240 VanDerWaalsContact O-CA 3.3Å; I210-L240 WeakPolarHBondContact O-CA 3.27Å; I210-L240 VanDerWaalsContact O-CD1 3.31Å; I210-L240 WeakPolarHBondContact O-CD1 3.25Å; C212-L240 HydrophobicContact CB-CD1 3.86Å; L226-L240 HydrophobicContact CD2-CD2 3.95Å; I229-L240 HydrophobicContact CD1-CD1 4.18Å; I229-L240 HydrophobicContact CD1-CD2 4.34Å; I229-L240 HydrophobicContact CG2-CB 4.05Å; I229-L240 HydrophobicContact CG2-CD1 4Å; I229-L240 HydrophobicContact CG2-CD2 3.87Å; I229-L240 HydrophobicContact CG2-CG 4.19Å; L233-L240 HydrophobicContact CD1-CB 4.17Å; L240-L242 HydrophobicContact CD1-CB 4.23Å; L240-L242 HydrophobicContact CD2-CB 4.4Å; L240-L242 HydrophobicContact CD2-CD1 4.02Å; L240-L242 HydrophobicContact CG-CB 4.1Å; L240-F289 HydrophobicContact CB-CE1 4.11Å; L240-F289 HydrophobicContact CB-CZ 4.36Å; L240-F289 HydrophobicContact CD2-CE1 4.28Å; L240-F289 HydrophobicContact CD2-CE2 4.1Å; L240-F289 HydrophobicContact CD2-CZ 3.94Å; L240-V318 WeakPolarHBondContact O-CA 3.49Å; L240-L319 HydrophobicContact CB-CB 4.14Å; L240-L319 HydrophobicContact CD2-CB 4.44Å; L240-L319 HydrophobicContact CD2-CD1 3.74Å; L240-L319 HydrophobicContact CG-CB 4.37Å; L240-L319 HydrophobicContact CG-CD1 4.23Å; L240-L319 PolarHBondContact N-O 3.15Å; L240-L319 PolarHBondContact O-N 3.37Å
241	I	98.6	Very high	94.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	118.2	163.8	-171.7	167.8	0	0	0	109.2	F133 L138 L141 M167 L209 I210 S211 C212 L213 V316 F317	F133-I241 HydrophobicContact CD1-CD1 4.3Å; F133-I241 HydrophobicContact CE1-CD1 3.51Å; F133-I241 HydrophobicContact CE1-CG1 4.35Å; F133-I241 HydrophobicContact CZ-CD1 3.73Å; L138-I241 HydrophobicContact CD1-CD1 3.41Å; L138-I241 VanDerWaalsContact CD1-CD1 3.41Å; L141-I241 HydrophobicContact CD2-CD1 4.33Å; M167-I241 HydrophobicContact SD-CG2 3.9Å; L209-I241 HydrophobicContact CD1-CB 4.24Å; L209-I241 HydrophobicContact CD1-CG2 4.08Å; L209-I241 HydrophobicContact CD2-CG2 4.33Å; L209-I241 HydrophobicContact CG-CG2 4.27Å; I210-I241 PolarHBondContact O-N 3.35Å; S211-I241 CarbonylContact C-O 3.53Å; S211-I241 WeakPolarHBondContact CA-O 3.25Å; C212-I241 PolarHBondContact N-O 3.37Å; L213-I241 HydrophobicContact CD2-CG1 4.31Å; L213-I241 HydrophobicContact CD2-CG2 4.39Å; I241-V316 HydrophobicContact CD1-CG1 4.14Å; I241-V316 HydrophobicContact CG1-CG1 3.91Å; I241-F317 WeakPolarHBondContact CA-O 2.98Å
242	L	98.7	Very high	93.7	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129.2	-172.8	-175.4	144.4	0	0	0	110.1	C212 L216 L226 L240 A244 F284 V316 F317 L319	C212-L242 WeakPolarHBondContact O-CA 3.31Å; L216-L242 HydrophobicContact CD1-CD1 3.73Å; L216-L242 HydrophobicContact CD1-CD2 4.22Å; L216-L242 HydrophobicContact CD1-CG 4.39Å; L216-L242 HydrophobicContact CG-CD1 4.16Å; L226-L242 HydrophobicContact CD2-CD1 3.68Å; L240-L242 HydrophobicContact CD1-CB 4.23Å; L240-L242 HydrophobicContact CD2-CB 4.4Å; L240-L242 HydrophobicContact CD2-CD1 4.02Å; L240-L242 HydrophobicContact CG-CB 4.1Å; L242-A244 HydrophobicContact CD2-CB 4.11Å; L242-F284 HydrophobicContact CD1-CE1 4.28Å; L242-F284 HydrophobicContact CD2-CE1 4.28Å; L242-F284 HydrophobicContact CD2-CZ 3.85Å; L242-V316 CarbonylContact O-C 3.57Å; L242-V316 WeakPolarHBondContact O-CA 3.3Å; L242-F317 HydrophobicContact CD2-CD2 3.96Å; L242-F317 PolarHBondContact N-O 2.83Å; L242-F317 PolarHBondContact O-N 3.37Å; L242-L319 HydrophobicContact CB-CD1 4.34Å; L242-L319 HydrophobicContact CD1-CD1 4.35Å
243	A	98.1	Very high	92.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	138.2	172.1	0	0	0	0	0	110	V132 C212 L213 N214 D314 A315 V316	V132-A243 HydrophobicContact CG1-CB 4.17Å; C212-A243 PolarHBondContact O-N 3.37Å; C212-A243 VanDerWaalsContact O-N 3.1Å; L213-A243 HydrophobicContact CB-CB 4.17Å; L213-A243 HydrophobicContact CD2-CB 3.84Å; N214-A243 PolarHBondContact N-O 3.45Å; A243-D314 WeakPolarHBondContact CB-OD2 3.31Å; A243-A315 WeakPolarHBondContact CA-O 3.1Å; A243-V316 HydrophobicContact CB-CG2 3.99Å
244	A	95.8	Very high	91.5	Very high	2 Å²	2	40.8 Å²	40.8	2%	0.017	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	118.2	179.7	0	0	0	0	0	110.7	L242 L246 F248 D314 A315	L242-A244 HydrophobicContact CD2-CB 4.11Å; A244-L246 PolarHBondContact O-N 3.23Å; A244-F248 HydrophobicContact CB-CD2 4.43Å; A244-D314 WeakPolarHBondContact CA-OD1 3.47Å; A244-D314 PolarHBondContact N-OD1 2.89Å; A244-A315 PolarHBondContact N-O 3.45Å; A244-A315 PolarHBondContact O-N 3.02Å; A244-A315 VanDerWaalsContact O-N 3.12Å
245	V	94.4	Very high	90.3	Very high	22 Å²	22	43.2 Å²	43.2	13%	0.133	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	129.3	172.1	176.3	0	0	0	0	110.9	N214 F248 Y299 L312 D313 D314	N214-V245 WeakPolarHBondContact OD1-CG2 3.35Å; N214-V245 PolarHBondContact OD1-N 3.46Å; V245-F248 WeakPolarHBondContact O-CA 3.23Å; V245-Y299 HydrophobicContact CG2-CD1 3.71Å; V245-Y299 HydrophobicContact CG2-CE1 4.37Å; V245-L312 HydrophobicContact CG1-CB 3.92Å; V245-L312 HydrophobicContact CG1-CD1 4.23Å; V245-L312 HydrophobicContact CG1-CG 4.46Å; V245-L312 HydrophobicContact CG2-CB 3.96Å; V245-L312 HydrophobicContact CG2-CD1 3.93Å; V245-D313 WeakPolarHBondContact CA-O 3.33Å; V245-D314 PolarHBondContact N-OD1 2.82Å
246	L	93.3	Very high	89.2	Confident	5 Å²	5	42.1 Å²	42.1	3%	0.026	25%	0.252	C	S	.	.	S	Bend	trans	-114.3	141.9	175.2	-57.6	-176	0	0	0	111	A244 F248 W272 Q275 V276 L279 D313 A315	A244-L246 PolarHBondContact O-N 3.23Å; L246-F248 HydrophobicContact CD2-CB 3.99Å; L246-W272 HydrophobicContact CD1-CD2 4.46Å; L246-W272 HydrophobicContact CD1-CG 4.11Å; L246-Q275 HydrophobicContact CD1-CB 4.02Å; L246-Q275 HydrophobicContact CD2-CB 4.19Å; L246-V276 HydrophobicContact CD1-CG2 3.5Å; L246-L279 HydrophobicContact CD2-CD1 3.9Å; L246-D313 PolarHBondContact N-O 3.39Å; L246-A315 HydrophobicContact CD1-CB 3.74Å; L246-A315 HydrophobicContact CG-CB 4.22Å
247	P	94.4	Very high	88.4	Confident	73 Å²	73	46 Å²	46	47%	0.474	26%	0.26	S	S	.	.	S	Bend	cis	-67.1	138.6	-1.4	29.1	-35.6	0	0	0	112.6	Q249 Q275	P247-Q249 PolarHBondContact O-N 3.4Å; P247-Q275 VanDerWaalsContact CA-OE1 3.3Å
248	F	92.3	Very high	87.5	Confident	20 Å²	20	48.3 Å²	48.3	9%	0.088	26%	0.259	C	S	.	.			trans	-67.9	116.1	-172.1	-169.6	-104.3	0	0	0	111.7	L216 D217 A244 V245 L246 P250 I265 V267	L216-F248 HydrophobicContact CB-CE2 4.2Å; L216-F248 HydrophobicContact CB-CZ 4.23Å; D217-F248 HydrophobicContact CB-CE2 3.92Å; D217-F248 HydrophobicContact CB-CZ 4.26Å; A244-F248 HydrophobicContact CB-CD2 4.43Å; V245-F248 WeakPolarHBondContact O-CA 3.23Å; L246-F248 HydrophobicContact CD2-CB 3.99Å; F248-P250 HydrophobicContact CD1-CG 4.32Å; F248-P250 HydrophobicContact CE1-CB 4.03Å; F248-P250 HydrophobicContact CE1-CG 3.82Å; F248-P250 HydrophobicContact CZ-CB 4.26Å; F248-I265 HydrophobicContact CE1-CB 3.89Å; F248-I265 HydrophobicContact CE1-CG2 4.24Å; F248-I265 HydrophobicContact CZ-CD1 4.48Å; F248-V267 HydrophobicContact CB-CB 4.11Å; F248-V267 HydrophobicContact CB-CG2 3.7Å; F248-V267 HydrophobicContact CD1-CG2 3.63Å; F248-V267 HydrophobicContact CG-CG2 3.83Å
249	Q	87.4	Confident	87	Confident	125 Å²	125	52.4 Å²	52.4	58%	0.584	28%	0.279	S	S	*	.			trans	-135.7	84.8	-175.8	-69.4	-174.8	-0.3	0	0	111	P247	P247-Q249 PolarHBondContact O-N 3.4Å
250	P	86.6	Confident	86.5	Confident	10 Å²	10	56 Å²	56	7%	0.065	29%	0.292	C	S	.	.			trans	-74.5	134.7	-174	30.4	-35.9	0	0	0	112.3	D217 F248 R260 P261	D217-P250 HydrophobicContact CB-CB 4.48Å; D217-P250 CarbonylContact O-C 3.32Å; D217-P250 VanDerWaalsContact O-CA 3.25Å; D217-P250 WeakPolarHBondContact O-CA 3.18Å; F248-P250 HydrophobicContact CD1-CG 4.32Å; F248-P250 HydrophobicContact CE1-CB 4.03Å; F248-P250 HydrophobicContact CE1-CG 3.82Å; F248-P250 HydrophobicContact CZ-CB 4.26Å; P250-R260 PolarHBondContact O-NH1 3.48Å; P250-P261 HydrophobicContact CB-CG 3.97Å; P250-P261 HydrophobicContact CG-CG 4.12Å
251	W	81.4	Confident	86	Confident	103 Å²	103	56.2 Å²	56.2	39%	0.39	29%	0.293	S	S	.	.			trans	-146.7	127.1	176.2	-72.6	97.4	0	0	0	111.1	D217 W258 R260	D217-W251 CarbonylContact O-C 3.44Å; D217-W251 PolarHBondContact O-N 3.21Å; D217-W251 VanDerWaalsContact O-O 3.12Å; W251-W258 HydrophobicContact CB-CE3 4.03Å; W251-W258 HydrophobicContact CB-CZ3 4.5Å; W251-W258 HydrophobicContact CE3-CB 4.31Å; W251-R260 HydrophobicContact CZ3-CG 4.47Å
252	V	79.8	Confident	85.5	Confident	5 Å²	5	65 Å²	65	3%	0.03	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	142	-179	-60.5	0	0	0	0	110.9	C219 I254 W258 Q259 P261	C219-V252 WeakPolarHBondContact O-CG1 3.34Å; V252-I254 HydrophobicContact CB-CG1 4.49Å; V252-I254 HydrophobicContact CG2-CD1 3.76Å; V252-I254 HydrophobicContact CG2-CG1 4.01Å; V252-W258 CarbonylContact O-C 3.57Å; V252-W258 WeakPolarHBondContact O-CA 3.47Å; V252-Q259 HydrophobicContact CG2-CB 4.35Å; V252-Q259 WeakPolarHBondContact CG2-O 3.33Å; V252-Q259 PolarHBondContact N-O 3.38Å; V252-Q259 PolarHBondContact O-N 3.06Å; V252-P261 HydrophobicContact CG1-CB 4.03Å
253	E	74.2	Confident	85	Confident	97 Å²	97	67 Å²	67	45%	0.453	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	106.8	173.4	-171.4	-178.6	176.6	0	0	109.5	K257 W258	E253-K257 WeakPolarHBondContact CA-O 3.3Å; E253-W258 HydrophobicContact CB-CD2 4.46Å; E253-W258 HydrophobicContact CB-CE3 4.16Å; E253-W258 HydrophobicContact CB-CH2 4.02Å; E253-W258 HydrophobicContact CB-CZ2 4.34Å; E253-W258 HydrophobicContact CB-CZ3 3.95Å
254	I	74.1	Confident	84.6	Confident	77 Å²	77	71.7 Å²	71.7	40%	0.395	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	116.2	178.1	-59.4	172.1	0	0	0	108.3	V252 G256 K257 Q259	V252-I254 HydrophobicContact CB-CG1 4.49Å; V252-I254 HydrophobicContact CG2-CD1 3.76Å; V252-I254 HydrophobicContact CG2-CG1 4.01Å; I254-G256 VanDerWaalsContact C-N 3.28Å; I254-G256 PolarHBondContact O-N 2.94Å; I254-K257 PolarHBondContact N-O 3.01Å; I254-K257 PolarHBondContact O-N 2.94Å; I254-Q259 PolarHBondContact O-NE2 2.52Å
255	G	71.9	Confident	84.4	Confident	83 Å²	83	72.3 Å²	72.3	86%	0.856	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	35	179.8	0	0	0	0	0	113.6	K257	G255-K257 VanDerWaalsContact C-N 3.29Å; G255-K257 PolarHBondContact O-N 3.49Å
256	G	71	Confident	84.3	Confident	57 Å²	57	79.4 Å²	79.4	59%	0.588	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	10.6	-178.6	0	0	0	0	0	114.9	I254	I254-G256 VanDerWaalsContact C-N 3.28Å; I254-G256 PolarHBondContact O-N 2.94Å
257	K	74.1	Confident	84.3	Confident	146 Å²	146	80.6 Å²	80.6	64%	0.635	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	137	175.7	-66.6	-179.2	-178.1	176.8	0	110.6	E253 I254 G255 Q259	E253-K257 WeakPolarHBondContact CA-O 3.3Å; I254-K257 PolarHBondContact N-O 3.01Å; I254-K257 PolarHBondContact O-N 2.94Å; G255-K257 VanDerWaalsContact C-N 3.29Å; G255-K257 PolarHBondContact O-N 3.49Å; K257-Q259 HydrophobicContact CB-CG 4.35Å
258	W	76.4	Confident	84.3	Confident	136 Å²	136	82.9 Å²	82.9	52%	0.515	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	124.2	171.8	-66.2	100.6	0	0	0	110.3	W251 V252 E253	W251-W258 HydrophobicContact CB-CE3 4.03Å; W251-W258 HydrophobicContact CB-CZ3 4.5Å; W251-W258 HydrophobicContact CE3-CB 4.31Å; V252-W258 CarbonylContact O-C 3.57Å; V252-W258 WeakPolarHBondContact O-CA 3.47Å; E253-W258 HydrophobicContact CB-CD2 4.46Å; E253-W258 HydrophobicContact CB-CE3 4.16Å; E253-W258 HydrophobicContact CB-CH2 4.02Å; E253-W258 HydrophobicContact CB-CZ2 4.34Å; E253-W258 HydrophobicContact CB-CZ3 3.95Å
259	Q	87.5	Confident	84.4	Confident	87 Å²	87	83.5 Å²	83.5	41%	0.407	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	163.3	-177.1	-49.4	-170.9	53.9	0	0	109.7	V252 I254 K257	V252-Q259 HydrophobicContact CG2-CB 4.35Å; V252-Q259 WeakPolarHBondContact CG2-O 3.33Å; V252-Q259 PolarHBondContact N-O 3.38Å; V252-Q259 PolarHBondContact O-N 3.06Å; I254-Q259 PolarHBondContact O-NE2 2.52Å; K257-Q259 HydrophobicContact CB-CG 4.35Å
260	R	87.6	Confident	84.7	Confident	129 Å²	129	86.9 Å²	86.9	49%	0.487	42%	0.424	S	S	.	.			trans	-73.7	145.3	169.2	-72.1	-66.8	-168.6	164.3	5.7	109.3	P250 W251	P250-R260 PolarHBondContact O-NH1 3.48Å; W251-R260 HydrophobicContact CZ3-CG 4.47Å
261	P	88	Confident	85.1	Confident	3 Å²	3	91.5 Å²	91.5	2%	0.019	44%	0.444	C	S	.	.			trans	-62.4	157.7	175.8	31.5	-38.9	0	0	0	110.6	C219 D220 P250 V252 E263 H264	C219-P261 WeakPolarHBondContact O-CB 3.19Å; D220-P261 WeakPolarHBondContact OD1-CA 3.43Å; P250-P261 HydrophobicContact CB-CG 3.97Å; P250-P261 HydrophobicContact CG-CG 4.12Å; V252-P261 HydrophobicContact CG1-CB 4.03Å; P261-E263 WeakPolarHBondContact CB-O 3.42Å; P261-E263 WeakPolarHBondContact CG-O 3.35Å; P261-H264 PolarHBondContact O-CE1 3.15Å; P261-H264 PolarHBondContact O-ND1 3.46Å; P261-H264 PolarHBondContact O-NE2 3.18Å
262	R	88	Confident	85.8	Confident	186 Å²	186	87.2 Å²	87.2	70%	0.702	43%	0.427	S	S	*	.	S	Bend	trans	-66.6	-50.7	174.3	-71.9	171.7	68.3	-155.6	-6.9	111	D220 H264	D220-R262 PolarHBondContact O-N 2.88Å; D220-R262 WeakPolarHBondContact OD1-CG 3.31Å; D220-R262 PolarHBondContact OD1-N 3.27Å; D220-R262 WeakPolarHBondContact OD2-CD 3.49Å; D220-R262 WeakPolarHBondContact OD2-CG 3.43Å; R262-H264 PolarHBondContact O-ND1 3.14Å; R262-H264 VanDerWaalsContact O-ND1 3.11Å
263	E	89.5	Confident	86.7	Confident	40 Å²	40	87.4 Å²	87.4	19%	0.187	43%	0.428	C	S	.	.	S	Bend	trans	-93.7	133.1	175.1	180	-178.9	-123.7	0	0	110.6	D220 D221 L223 D224 R227 P261	D220-E263 PolarHBondContact O-N 2.98Å; D221-E263 VanDerWaalsContact C-OE2 3.25Å; L223-E263 WeakPolarHBondContact CA-OE2 3.4Å; L223-E263 VanDerWaalsContact CB-CD 3.46Å; L223-E263 WeakPolarHBondContact CB-OE1 3.31Å; L223-E263 VanDerWaalsContact CB-OE2 3.23Å; L223-E263 WeakPolarHBondContact CB-OE2 3.36Å; L223-E263 HydrophobicContact CD1-CG 4.14Å; L223-E263 WeakPolarHBondContact CD1-OE1 3.49Å; L223-E263 HydrophobicContact CG-CG 4.16Å; L223-E263 PolarHBondContact N-OE2 2.94Å; D224-E263 PolarHBondContact N-OE2 3.39Å; R227-E263 IonicContact NH1-OE1 3.73Å; P261-E263 WeakPolarHBondContact CB-O 3.42Å; P261-E263 WeakPolarHBondContact CG-O 3.35Å
264	H	88.9	Confident	87.8	Confident	100 Å²	100	86.3 Å²	86.3	46%	0.463	42%	0.423	S	S	.	.			trans	-115.4	116.7	-169.1	-70.8	73.1	0	0	0	111.4	P261 R262 K266	P261-H264 PolarHBondContact O-CE1 3.15Å; P261-H264 PolarHBondContact O-ND1 3.46Å; P261-H264 PolarHBondContact O-NE2 3.18Å; R262-H264 PolarHBondContact O-ND1 3.14Å; R262-H264 VanDerWaalsContact O-ND1 3.11Å; H264-K266 PolarHBondContact O-N 3.31Å
265	I	92.5	Very high	89	Confident	14 Å²	14	83.2 Å²	83.2	7%	0.072	41%	0.407	C	S	.	.			trans	-79.3	116.7	164.9	-61.5	177.4	0	0	0	108.7	L216 P222 L223 F248 V267 L279 V283	L216-I265 HydrophobicContact CD1-CD1 4.24Å; P222-I265 HydrophobicContact CB-CD1 3.78Å; P222-I265 HydrophobicContact CB-CG1 4.35Å; P222-I265 HydrophobicContact CG-CD1 3.91Å; P222-I265 HydrophobicContact CG-CG1 3.92Å; L223-I265 HydrophobicContact CD2-CD1 4.13Å; L223-I265 HydrophobicContact CD2-CG1 3.87Å; L223-I265 HydrophobicContact CG-CG1 4.37Å; F248-I265 HydrophobicContact CE1-CB 3.89Å; F248-I265 HydrophobicContact CE1-CG2 4.24Å; F248-I265 HydrophobicContact CZ-CD1 4.48Å; I265-V267 HydrophobicContact CG2-CG2 3.82Å; I265-V267 PolarHBondContact O-N 3.35Å; I265-L279 HydrophobicContact CG2-CD2 4.33Å; I265-V283 HydrophobicContact CD1-CG1 4.19Å; I265-V283 HydrophobicContact CG1-CG1 4.38Å; I265-V283 HydrophobicContact CG2-CB 4.33Å; I265-V283 HydrophobicContact CG2-CG1 3.71Å; I265-V283 HydrophobicContact CG2-CG2 3.66Å
266	K	90.3	Very high	90.2	Very high	171 Å²	171	79.3 Å²	79.3	74%	0.743	37%	0.366	S	S	*	.			trans	-94	96.7	177.9	-66.8	-178.8	-175.3	172.3	0	110.1	H264 N278	H264-K266 PolarHBondContact O-N 3.31Å; K266-N278 PolarHBondContact O-OD1 3.46Å
267	V	94.4	Very high	91.5	Very high	30 Å²	30	77.6 Å²	77.6	18%	0.182	34%	0.344	C	S	.	.			trans	-87.1	121.7	176	-171	0	0	0	0	110.5	F248 I265 Q275 N278 L279	F248-V267 HydrophobicContact CB-CB 4.11Å; F248-V267 HydrophobicContact CB-CG2 3.7Å; F248-V267 HydrophobicContact CD1-CG2 3.63Å; F248-V267 HydrophobicContact CG-CG2 3.83Å; I265-V267 HydrophobicContact CG2-CG2 3.82Å; I265-V267 PolarHBondContact O-N 3.35Å; V267-Q275 HydrophobicContact CG1-CB 3.6Å; V267-Q275 HydrophobicContact CG1-CG 3.68Å; V267-N278 VanDerWaalsContact CA-OD1 3.31Å; V267-N278 WeakPolarHBondContact CA-OD1 3.31Å; V267-L279 HydrophobicContact CG1-CG 4.12Å; V267-L279 HydrophobicContact CG2-CD2 3.65Å; V267-L279 HydrophobicContact CG2-CG 4.1Å
268	K	95.2	Very high	92.6	Very high	121 Å²	121	71.1 Å²	71.1	53%	0.526	32%	0.317	S	S	.	.			trans	-89.5	152.7	174.8	-58	174.2	-170.2	149.5	0	110.5	Q275 N278 E282	K268-Q275 WeakPolarHBondContact O-CA 3.49Å; K268-N278 HydrophobicContact CB-CB 4.29Å; K268-N278 PolarHBondContact N-OD1 3.49Å; K268-N278 WeakPolarHBondContact O-CB 3.39Å; K268-E282 WeakPolarHBondContact CE-OE2 3.14Å; K268-E282 IonicContact NZ-OE1 3.97Å; K268-E282 PolarHBondContact NZ-OE1 3.26Å; K268-E282 IonicContact NZ-OE2 2.65Å; K268-E282 PolarHBondContact NZ-OE2 3.49Å
269	G	94	Very high	93.7	Very high	34 Å²	34	64.8 Å²	64.8	35%	0.351	29%	0.293	S	S	.	.			trans	106.4	152.6	179.8	0	0	0	0	0	112.9	E274 Q275	G269-E274 WeakPolarHBondContact CA-OE2 3.31Å; G269-Q275 PolarHBondContact O-NE2 3.46Å
270	K	92.8	Very high	94.1	Very high	195 Å²	195	60.8 Å²	60.8	85%	0.848	28%	0.275	S	S	*	.	S	Bend	trans	-103.2	-32.3	178.6	-65.8	-177.9	-179.9	178.7	0	111.9	E274	K270-E274 PolarHBondContact N-OE2 2.89Å
271	K	95.6	Very high	94.5	Very high	108 Å²	108	56.9 Å²	56.9	47%	0.47	26%	0.263	S	S	.	.	S	Bend	trans	-94.2	159.3	179.8	-63.7	-177.8	175.1	-174.4	0	111.2	L67 E273 E274 Q275	L67-K271 HydrophobicContact CD1-CD 3.58Å; K271-E273 VanDerWaalsContact C-N 3.29Å; K271-E273 PolarHBondContact O-N 3Å; K271-E274 HydrophobicContact CB-CG 4.21Å; K271-E274 PolarHBondContact N-OE2 3.06Å; K271-E274 PolarHBondContact O-N 3.35Å; K271-Q275 PolarHBondContact O-N 2.83Å; K271-Q275 VanDerWaalsContact O-N 3.1Å
272	W	96.8	Very high	94.9	Very high	13 Å²	13	60.8 Å²	60.8	5%	0.049	28%	0.281	C	S	.	.	H	α-helix	trans	-52.9	-48.5	177.4	-176.5	98.4	0	0	0	110.9	C63 L68 F76 L246 E274 Q275 V276 V294 R296 D314 A315	C63-W272 HydrophobicContact CB-CZ3 4.45Å; L68-W272 HydrophobicContact CD2-CZ3 4.22Å; F76-W272 HydrophobicContact CD2-CH2 4.15Å; F76-W272 HydrophobicContact CD2-CZ3 4.4Å; F76-W272 AromaticContact CE2-CH2 3.81Å; F76-W272 HydrophobicContact CE2-CH2 3.81Å; F76-W272 HydrophobicContact CE2-CZ3 4.14Å; L246-W272 HydrophobicContact CD1-CD2 4.46Å; L246-W272 HydrophobicContact CD1-CG 4.11Å; W272-E274 VanDerWaalsContact C-N 3.35Å; W272-E274 PolarHBondContact O-N 2.98Å; W272-Q275 PolarHBondContact O-N 3.46Å; W272-V276 HydrophobicContact CD2-CG2 3.73Å; W272-V276 HydrophobicContact CE3-CB 4.47Å; W272-V276 HydrophobicContact CE3-CG2 3.81Å; W272-V276 HydrophobicContact CH2-CB 4.47Å; W272-V276 HydrophobicContact CH2-CG1 4.39Å; W272-V276 HydrophobicContact CH2-CG2 3.64Å; W272-V276 HydrophobicContact CZ2-CG2 3.56Å; W272-V276 HydrophobicContact CZ3-CB 4.32Å; W272-V276 HydrophobicContact CZ3-CG1 4.43Å; W272-V276 HydrophobicContact CZ3-CG2 3.77Å; W272-V276 WeakPolarHBondContact O-CB 3.4Å; W272-V276 WeakPolarHBondContact O-CG2 3.34Å; W272-V276 PolarHBondContact O-N 2.86Å; W272-V294 HydrophobicContact CH2-CG2 4.39Å; W272-R296 HydrophobicContact CD2-CG 4.19Å; W272-R296 HydrophobicContact CH2-CB 3.73Å; W272-R296 HydrophobicContact CH2-CG 4.34Å; W272-R296 HydrophobicContact CZ2-CB 3.42Å; W272-R296 VanDerWaalsContact CZ2-CB 3.42Å; W272-R296 HydrophobicContact CZ2-CG 3.69Å; W272-R296 HydrophobicContact CZ3-CB 4.4Å; W272-D314 PolarHBondContact NE1-O 3.34Å; W272-A315 HydrophobicContact CZ2-CB 3.64Å
273	E	98.1	Very high	95.2	Very high	9 Å²	9	52.3 Å²	52.3	4%	0.042	25%	0.25	C	S	.	.	H	α-helix	trans	-63.4	-38.7	-177.1	-61.9	85.1	169.7	0	0	113	S64 L67 L68 K271 T277	S64-E273 VanDerWaalsContact CB-OE1 3.29Å; S64-E273 WeakPolarHBondContact CB-OE1 3.39Å; S64-E273 PolarHBondContact N-OE1 2.89Å; S64-E273 PolarHBondContact OG-OE1 3.47Å; L67-E273 HydrophobicContact CB-CB 3.69Å; L67-E273 HydrophobicContact CB-CG 4Å; L68-E273 HydrophobicContact CD2-CB 3.77Å; L68-E273 HydrophobicContact CD2-CG 4.08Å; L68-E273 HydrophobicContact CG-CB 4.06Å; L68-E273 HydrophobicContact CG-CG 4.05Å; K271-E273 VanDerWaalsContact C-N 3.29Å; K271-E273 PolarHBondContact O-N 3Å; E273-T277 WeakPolarHBondContact O-CB 3.35Å; E273-T277 PolarHBondContact O-N 3.08Å; E273-T277 PolarHBondContact O-OG1 2.95Å
274	E	97.6	Very high	95.6	Very high	73 Å²	73	50.4 Å²	50.4	34%	0.341	24%	0.241	S	C	.	.	H	α-helix	trans	-67.8	-41.6	178.7	-63	170.4	167.8	0	0	110.6	G269 K270 K271 W272 T277 N278	G269-E274 WeakPolarHBondContact CA-OE2 3.31Å; K270-E274 PolarHBondContact N-OE2 2.89Å; K271-E274 HydrophobicContact CB-CG 4.21Å; K271-E274 PolarHBondContact N-OE2 3.06Å; K271-E274 PolarHBondContact O-N 3.35Å; W272-E274 VanDerWaalsContact C-N 3.35Å; W272-E274 PolarHBondContact O-N 2.98Å; E274-T277 PolarHBondContact O-N 3.5Å; E274-N278 WeakPolarHBondContact O-CB 3.47Å; E274-N278 PolarHBondContact O-N 3.35Å
275	Q	97.9	Very high	95.9	Very high	13 Å²	13	51.5 Å²	51.5	6%	0.061	24%	0.241	C	C	.	.	H	α-helix	trans	-70.8	-40.9	178.2	-69.5	-156.9	14.6	0	0	112.3	L246 P247 V267 K268 G269 K271 W272 T277 N278 L279	L246-Q275 HydrophobicContact CD1-CB 4.02Å; L246-Q275 HydrophobicContact CD2-CB 4.19Å; P247-Q275 VanDerWaalsContact CA-OE1 3.3Å; V267-Q275 HydrophobicContact CG1-CB 3.6Å; V267-Q275 HydrophobicContact CG1-CG 3.68Å; K268-Q275 WeakPolarHBondContact O-CA 3.49Å; G269-Q275 PolarHBondContact O-NE2 3.46Å; K271-Q275 PolarHBondContact O-N 2.83Å; K271-Q275 VanDerWaalsContact O-N 3.1Å; W272-Q275 PolarHBondContact O-N 3.46Å; Q275-T277 VanDerWaalsContact C-N 3.29Å; Q275-T277 PolarHBondContact O-N 3.26Å; Q275-N278 PolarHBondContact O-N 3.4Å; Q275-L279 WeakPolarHBondContact O-CB 3.5Å; Q275-L279 WeakPolarHBondContact O-CG 3.28Å; Q275-L279 PolarHBondContact O-N 2.98Å
276	V	98.3	Very high	96	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-57	-45.5	171.1	164	0	0	0	0	110.9	L68 V72 L246 W272 N278 S280 V294 A315 F317	L68-V276 HydrophobicContact CD2-CB 4.3Å; L68-V276 HydrophobicContact CD2-CG1 3.91Å; V72-V276 HydrophobicContact CG1-CG1 3.9Å; L246-V276 HydrophobicContact CD1-CG2 3.5Å; W272-V276 HydrophobicContact CD2-CG2 3.73Å; W272-V276 HydrophobicContact CE3-CB 4.47Å; W272-V276 HydrophobicContact CE3-CG2 3.81Å; W272-V276 HydrophobicContact CH2-CB 4.47Å; W272-V276 HydrophobicContact CH2-CG1 4.39Å; W272-V276 HydrophobicContact CH2-CG2 3.64Å; W272-V276 HydrophobicContact CZ2-CG2 3.56Å; W272-V276 HydrophobicContact CZ3-CB 4.32Å; W272-V276 HydrophobicContact CZ3-CG1 4.43Å; W272-V276 HydrophobicContact CZ3-CG2 3.77Å; W272-V276 WeakPolarHBondContact O-CB 3.4Å; W272-V276 WeakPolarHBondContact O-CG2 3.34Å; W272-V276 PolarHBondContact O-N 2.86Å; V276-N278 PolarHBondContact O-N 3.37Å; V276-S280 WeakPolarHBondContact O-CB 3.33Å; V276-S280 PolarHBondContact O-N 3.09Å; V276-S280 PolarHBondContact O-OG 3.45Å; V276-V294 HydrophobicContact CG1-CG1 4.35Å; V276-V294 HydrophobicContact CG1-CG2 4.01Å; V276-A315 HydrophobicContact CG2-CB 3.75Å; V276-F317 HydrophobicContact CB-CZ 4.37Å; V276-F317 HydrophobicContact CG1-CE1 3.93Å; V276-F317 HydrophobicContact CG1-CZ 4.14Å; V276-F317 HydrophobicContact CG2-CZ 4.06Å
277	T	98.1	Very high	96.3	Very high	21 Å²	21	49.2 Å²	49.2	13%	0.129	23%	0.234	C	C	.	.	H	α-helix	trans	-62.8	-43	177.7	-60.4	0	0	0	0	111.5	G69 E273 E274 Q275 S280 N281	G69-T277 PolarHBondContact N-OG1 2.84Å; E273-T277 WeakPolarHBondContact O-CB 3.35Å; E273-T277 PolarHBondContact O-N 3.08Å; E273-T277 PolarHBondContact O-OG1 2.95Å; E274-T277 PolarHBondContact O-N 3.5Å; Q275-T277 VanDerWaalsContact C-N 3.29Å; Q275-T277 PolarHBondContact O-N 3.26Å; T277-S280 PolarHBondContact O-N 2.94Å; T277-N281 WeakPolarHBondContact CG2-ND2 3.31Å; T277-N281 WeakPolarHBondContact O-CB 3.35Å; T277-N281 PolarHBondContact O-N 3.43Å; T277-N281 PolarHBondContact O-ND2 2.89Å
278	N	98.1	Very high	96.4	Very high	11 Å²	11	48.9 Å²	48.9	6%	0.059	24%	0.236	C	C	.	.	H	α-helix	trans	-68.4	-44.2	179.5	179.8	-108.7	0	0	0	112.8	K266 V267 K268 E274 Q275 V276 S280 N281 E282	K266-N278 PolarHBondContact O-OD1 3.46Å; V267-N278 VanDerWaalsContact CA-OD1 3.31Å; V267-N278 WeakPolarHBondContact CA-OD1 3.31Å; K268-N278 HydrophobicContact CB-CB 4.29Å; K268-N278 PolarHBondContact N-OD1 3.49Å; K268-N278 WeakPolarHBondContact O-CB 3.39Å; E274-N278 WeakPolarHBondContact O-CB 3.47Å; E274-N278 PolarHBondContact O-N 3.35Å; Q275-N278 PolarHBondContact O-N 3.4Å; V276-N278 PolarHBondContact O-N 3.37Å; N278-S280 VanDerWaalsContact C-N 3.29Å; N278-S280 PolarHBondContact O-N 3.45Å; N278-N281 PolarHBondContact O-N 3.03Å; N278-E282 PolarHBondContact ND2-OE1 3.38Å; N278-E282 VanDerWaalsContact ND2-OE1 3.17Å; N278-E282 PolarHBondContact ND2-OE2 2.9Å; N278-E282 WeakPolarHBondContact O-CB 3.45Å; N278-E282 PolarHBondContact O-N 2.86Å
279	L	97.9	Very high	96.5	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	21%	0.211	C	C	.	.	I	π-helix	trans	-56.1	-46.4	173.5	-77.7	169.5	0	0	0	111.1	L246 I265 V267 Q275 V283 F284 F317	L246-L279 HydrophobicContact CD2-CD1 3.9Å; I265-L279 HydrophobicContact CG2-CD2 4.33Å; V267-L279 HydrophobicContact CG1-CG 4.12Å; V267-L279 HydrophobicContact CG2-CD2 3.65Å; V267-L279 HydrophobicContact CG2-CG 4.1Å; Q275-L279 WeakPolarHBondContact O-CB 3.5Å; Q275-L279 WeakPolarHBondContact O-CG 3.28Å; Q275-L279 PolarHBondContact O-N 2.98Å; L279-V283 HydrophobicContact CD2-CB 4.18Å; L279-V283 HydrophobicContact CD2-CG1 4.38Å; L279-V283 HydrophobicContact CD2-CG2 4.07Å; L279-V283 PolarHBondContact O-N 2.89Å; L279-F284 HydrophobicContact CB-CE2 3.95Å; L279-F284 HydrophobicContact CB-CZ 4Å; L279-F284 HydrophobicContact CD2-CE1 4.46Å; L279-F284 HydrophobicContact CD2-CZ 4.36Å; L279-F284 WeakPolarHBondContact O-CD2 3.35Å; L279-F284 WeakPolarHBondContact O-CG 3.15Å; L279-F284 PolarHBondContact O-N 2.89Å; L279-F317 HydrophobicContact CB-CZ 4.41Å; L279-F317 HydrophobicContact CD1-CE2 4.34Å; L279-F317 HydrophobicContact CD1-CZ 4.19Å
280	S	97.4	Very high	96.6	Very high	4 Å²	4	45 Å²	45	3%	0.028	21%	0.211	C	C	.	.	I	π-helix	trans	-65.2	-45.8	-178.5	-54.9	0	0	0	0	113.2	V72 V276 T277 N278	V72-S280 VanDerWaalsContact CG2-CB 3.44Å; V276-S280 WeakPolarHBondContact O-CB 3.33Å; V276-S280 PolarHBondContact O-N 3.09Å; V276-S280 PolarHBondContact O-OG 3.45Å; T277-S280 PolarHBondContact O-N 2.94Å; N278-S280 VanDerWaalsContact C-N 3.29Å; N278-S280 PolarHBondContact O-N 3.45Å
281	N	95.6	Very high	96.9	Very high	47 Å²	47	36.6 Å²	36.6	25%	0.251	18%	0.176	S	C	.	.	I	π-helix	trans	-91.2	-24.7	-169.9	-70.9	-23.8	0	0	0	114.2	T277 N278 R285	T277-N281 WeakPolarHBondContact CG2-ND2 3.31Å; T277-N281 WeakPolarHBondContact O-CB 3.35Å; T277-N281 PolarHBondContact O-N 3.43Å; T277-N281 PolarHBondContact O-ND2 2.89Å; N278-N281 PolarHBondContact O-N 3.03Å; N281-R285 WeakPolarHBondContact O-CD 3.42Å
282	E	95.2	Very high	97	Very high	84 Å²	84	34.2 Å²	34.2	39%	0.393	17%	0.166	S	C	.	.	I	π-helix	trans	-110	-65.1	-178.5	-60.7	-174.1	-166.9	0	0	110	K268 N278 E286	K268-E282 WeakPolarHBondContact CE-OE2 3.14Å; K268-E282 IonicContact NZ-OE1 3.97Å; K268-E282 PolarHBondContact NZ-OE1 3.26Å; K268-E282 IonicContact NZ-OE2 2.65Å; K268-E282 PolarHBondContact NZ-OE2 3.49Å; N278-E282 PolarHBondContact ND2-OE1 3.38Å; N278-E282 VanDerWaalsContact ND2-OE1 3.17Å; N278-E282 PolarHBondContact ND2-OE2 2.9Å; N278-E282 WeakPolarHBondContact O-CB 3.45Å; N278-E282 PolarHBondContact O-N 2.86Å; E282-E286 WeakPolarHBondContact O-CB 3.18Å; E282-E286 PolarHBondContact O-N 3.45Å
283	V	96	Very high	97.1	Very high	8 Å²	8	33.7 Å²	33.7	5%	0.048	17%	0.165	C	C	.	.	I	π-helix	trans	-65.8	-53.5	-168.6	-178	0	0	0	0	112.3	L223 I265 L279 E286 V287	L223-V283 HydrophobicContact CD2-CG1 4.14Å; I265-V283 HydrophobicContact CD1-CG1 4.19Å; I265-V283 HydrophobicContact CG1-CG1 4.38Å; I265-V283 HydrophobicContact CG2-CB 4.33Å; I265-V283 HydrophobicContact CG2-CG1 3.71Å; I265-V283 HydrophobicContact CG2-CG2 3.66Å; L279-V283 HydrophobicContact CD2-CB 4.18Å; L279-V283 HydrophobicContact CD2-CG1 4.38Å; L279-V283 HydrophobicContact CD2-CG2 4.07Å; L279-V283 PolarHBondContact O-N 2.89Å; V283-E286 WeakPolarHBondContact O-CB 3.49Å; V283-E286 PolarHBondContact O-N 3.3Å; V283-V287 WeakPolarHBondContact O-CG2 3.21Å
284	F	97.5	Very high	97.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-69.1	-37.2	-176.5	-60.1	-28.3	0	0	0	112.2	L242 L279 E286 V287 G288 F289 V291 F317 L319	L242-F284 HydrophobicContact CD1-CE1 4.28Å; L242-F284 HydrophobicContact CD2-CE1 4.28Å; L242-F284 HydrophobicContact CD2-CZ 3.85Å; L279-F284 HydrophobicContact CB-CE2 3.95Å; L279-F284 HydrophobicContact CB-CZ 4Å; L279-F284 HydrophobicContact CD2-CE1 4.46Å; L279-F284 HydrophobicContact CD2-CZ 4.36Å; L279-F284 WeakPolarHBondContact O-CD2 3.35Å; L279-F284 WeakPolarHBondContact O-CG 3.15Å; L279-F284 PolarHBondContact O-N 2.89Å; F284-E286 VanDerWaalsContact C-N 3.32Å; F284-E286 PolarHBondContact O-N 2.84Å; F284-V287 CarbonylContact O-C 3.51Å; F284-V287 VanDerWaalsContact O-CG2 3.26Å; F284-V287 WeakPolarHBondContact O-CG2 3.5Å; F284-V287 PolarHBondContact O-N 3.34Å; F284-G288 PolarHBondContact O-N 2.9Å; F284-F289 CarbonylContact C-O 3.53Å; F284-F289 VanDerWaalsContact C-O 3.32Å; F284-F289 HydrophobicContact CB-CB 4.06Å; F284-F289 WeakPolarHBondContact O-CA 3.42Å; F284-F289 PolarHBondContact O-N 3.28Å; F284-V291 HydrophobicContact CD2-CG2 3.99Å; F284-F317 HydrophobicContact CE2-CB 4.5Å; F284-F317 AromaticContact CE2-CD1 3.77Å; F284-F317 HydrophobicContact CE2-CD1 3.77Å; F284-F317 HydrophobicContact CE2-CD2 4.05Å; F284-F317 AromaticContact CE2-CE1 3.86Å; F284-F317 HydrophobicContact CE2-CE1 3.86Å; F284-F317 HydrophobicContact CE2-CE2 4.16Å; F284-F317 AromaticContact CE2-CG 3.86Å; F284-F317 HydrophobicContact CE2-CG 3.86Å; F284-F317 HydrophobicContact CE2-CZ 4.06Å; F284-F317 HydrophobicContact CZ-CD2 4.18Å; F284-F317 HydrophobicContact CZ-CE2 4.24Å; F284-F317 HydrophobicContact CZ-CG 4.4Å; F284-F317 HydrophobicContact CZ-CZ 4.5Å; F284-L319 HydrophobicContact CD1-CD1 4.02Å; F284-L319 HydrophobicContact CD2-CD1 3.97Å; F284-L319 HydrophobicContact CD2-CD2 3.67Å; F284-L319 HydrophobicContact CE1-CD1 4.21Å; F284-L319 HydrophobicContact CE2-CD1 4.16Å; F284-L319 HydrophobicContact CE2-CD2 4.05Å; F284-L319 HydrophobicContact CG-CD1 3.91Å; F284-L319 HydrophobicContact CG-CD2 4.26Å; F284-L319 HydrophobicContact CZ-CD1 4.29Å
285	R	95.4	Very high	97.2	Very high	124 Å²	124	29.9 Å²	29.9	47%	0.468	15%	0.147	S	C	.	.	H	α-helix	trans	-63.9	-37.3	175	-73.7	-170.1	-179.2	166.3	-5.5	112.7	N281 V287 G288 F289	N281-R285 WeakPolarHBondContact O-CD 3.42Å; R285-V287 PolarHBondContact O-N 2.87Å; R285-G288 PolarHBondContact O-N 2.89Å; R285-G288 VanDerWaalsContact O-N 3.15Å; R285-F289 WeakPolarHBondContact CA-O 3.42Å; R285-F289 PolarHBondContact N-O 3.37Å
286	E	94.8	Very high	97.2	Very high	128 Å²	128	31.2 Å²	31.2	60%	0.598	15%	0.151	S	C	*	.	H	α-helix	trans	-60.1	-31.3	177.6	-173.9	-177.8	160.7	0	0	112.5	E282 V283 F284	E282-E286 WeakPolarHBondContact O-CB 3.18Å; E282-E286 PolarHBondContact O-N 3.45Å; V283-E286 WeakPolarHBondContact O-CB 3.49Å; V283-E286 PolarHBondContact O-N 3.3Å; F284-E286 VanDerWaalsContact C-N 3.32Å; F284-E286 PolarHBondContact O-N 2.84Å
287	V	95.6	Very high	97.1	Very high	9 Å²	9	31.2 Å²	31.2	6%	0.055	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	17.8	179.3	-64.6	0	0	0	0	113.5	L223 L226 R227 V283 F284 R285 F289	L223-V287 HydrophobicContact CB-CG1 4.04Å; L223-V287 HydrophobicContact CD2-CG1 3.95Å; L226-V287 HydrophobicContact CB-CB 4.17Å; L226-V287 HydrophobicContact CB-CG1 4.33Å; L226-V287 HydrophobicContact CB-CG2 3.88Å; L226-V287 HydrophobicContact CD1-CG2 3.93Å; L226-V287 HydrophobicContact CG-CG2 4.49Å; R227-V287 HydrophobicContact CG-CB 4.36Å; R227-V287 HydrophobicContact CG-CG1 4.19Å; V283-V287 WeakPolarHBondContact O-CG2 3.21Å; F284-V287 CarbonylContact O-C 3.51Å; F284-V287 VanDerWaalsContact O-CG2 3.26Å; F284-V287 WeakPolarHBondContact O-CG2 3.5Å; F284-V287 PolarHBondContact O-N 3.34Å; R285-V287 PolarHBondContact O-N 2.87Å; V287-F289 HydrophobicContact CG2-CD2 3.95Å
288	G	96.4	Very high	97	Very high	23 Å²	23	30.3 Å²	30.3	24%	0.237	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.5	24.3	173.2	0	0	0	0	0	114.8	H230 F284 R285 V322	H230-G288 PolarHBondContact CD2-O 3.12Å; H230-G288 PolarHBondContact NE2-O 2.75Å; F284-G288 PolarHBondContact O-N 2.9Å; R285-G288 PolarHBondContact O-N 2.89Å; R285-G288 VanDerWaalsContact O-N 3.15Å; G288-V322 PolarHBondContact O-N 2.94Å
289	F	97.8	Very high	96.7	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	144.3	175.6	-77.1	-73.6	0	0	0	112.6	L226 I229 H230 L233 L240 F284 R285 V287 L319 K320 P321	L226-F289 WeakPolarHBondContact O-CE2 3.42Å; I229-F289 HydrophobicContact CG2-CZ 3.98Å; H230-F289 HydrophobicContact CB-CE2 3.75Å; H230-F289 HydrophobicContact CB-CZ 3.7Å; L233-F289 HydrophobicContact CD1-CE1 3.7Å; L233-F289 HydrophobicContact CD1-CZ 3.99Å; L240-F289 HydrophobicContact CB-CE1 4.11Å; L240-F289 HydrophobicContact CB-CZ 4.36Å; L240-F289 HydrophobicContact CD2-CE1 4.28Å; L240-F289 HydrophobicContact CD2-CE2 4.1Å; L240-F289 HydrophobicContact CD2-CZ 3.94Å; F284-F289 CarbonylContact C-O 3.53Å; F284-F289 VanDerWaalsContact C-O 3.32Å; F284-F289 HydrophobicContact CB-CB 4.06Å; F284-F289 WeakPolarHBondContact O-CA 3.42Å; F284-F289 PolarHBondContact O-N 3.28Å; R285-F289 WeakPolarHBondContact CA-O 3.42Å; R285-F289 PolarHBondContact N-O 3.37Å; V287-F289 HydrophobicContact CG2-CD2 3.95Å; F289-L319 HydrophobicContact CB-CB 4.19Å; F289-L319 HydrophobicContact CB-CD1 4.29Å; F289-L319 HydrophobicContact CD1-CB 3.71Å; F289-L319 HydrophobicContact CE1-CB 4.4Å; F289-L319 HydrophobicContact CG-CB 4.14Å; F289-L319 HydrophobicContact CG-CD1 4.34Å; F289-K320 WeakPolarHBondContact CA-O 3.37Å; F289-K320 WeakPolarHBondContact CD1-O 3.45Å; F289-P321 HydrophobicContact CE1-CB 4.39Å
290	E	97.1	Very high	96.3	Very high	74 Å²	74	31.4 Å²	31.4	35%	0.346	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	142.4	165.5	-84.6	178.2	-176.9	0	0	110.3	L319 K320 V322	E290-L319 CarbonylContact O-C 3.6Å; E290-L319 VanDerWaalsContact O-CA 3.31Å; E290-L319 WeakPolarHBondContact O-CA 3.35Å; E290-K320 HydrophobicContact CB-CD 4.48Å; E290-K320 VanDerWaalsContact CB-CE 3.49Å; E290-K320 HydrophobicContact CB-CG 4Å; E290-K320 PolarHBondContact N-O 3.06Å; E290-K320 PolarHBondContact O-N 3.47Å; E290-K320 WeakPolarHBondContact OE2-CE 3.45Å; E290-K320 IonicContact OE2-NZ 3.89Å; E290-K320 PolarHBondContact OE2-NZ 2.92Å; E290-V322 HydrophobicContact CB-CG2 4.12Å; E290-V322 HydrophobicContact CG-CG2 3.57Å
291	V	98.2	Very high	95.6	Very high	18 Å²	18	32.9 Å²	32.9	11%	0.109	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	131	173.3	-176.6	0	0	0	0	109.4	L75 F284 A293 V294 F317 L319	L75-V291 HydrophobicContact CD1-CB 4.03Å; L75-V291 HydrophobicContact CD1-CG1 4.04Å; L75-V291 VanDerWaalsContact CD1-O 3.29Å; L75-V291 WeakPolarHBondContact CD1-O 3.32Å; F284-V291 HydrophobicContact CD2-CG2 3.99Å; V291-A293 WeakPolarHBondContact CG1-O 3.21Å; V291-V294 HydrophobicContact CG1-CB 4.37Å; V291-F317 HydrophobicContact CG1-CD1 4.23Å; V291-F317 HydrophobicContact CG2-CD1 4.21Å; V291-L319 HydrophobicContact CB-CD2 4.17Å; V291-L319 HydrophobicContact CG2-CD2 3.58Å
292	E	97.9	Very high	94.9	Very high	58 Å²	58	31.3 Å²	31.3	27%	0.271	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-34.3	169.4	-71.9	-166.3	145.9	0	0	112.6	R239 V318 K320	R239-E292 WeakPolarHBondContact CD-OE2 3.2Å; R239-E292 IonicContact CZ-OE1 3.74Å; R239-E292 IonicContact CZ-OE2 3.73Å; R239-E292 IonicContact NE-OE1 3.59Å; R239-E292 PolarHBondContact NE-OE1 3.43Å; R239-E292 IonicContact NE-OE2 2.69Å; R239-E292 PolarHBondContact NE-OE2 3.38Å; R239-E292 IonicContact NH2-OE1 3.37Å; R239-E292 PolarHBondContact NH2-OE1 2.9Å; R239-E292 IonicContact NH2-OE2 3.72Å; E292-V318 HydrophobicContact CB-CG1 4.37Å; E292-V318 PolarHBondContact N-O 3.33Å; E292-K320 HydrophobicContact CG-CB 3.97Å; E292-K320 HydrophobicContact CG-CD 3.72Å; E292-K320 HydrophobicContact CG-CG 3.8Å; E292-K320 WeakPolarHBondContact OE1-CD 3.3Å
293	A	98.5	Very high	93.7	Very high	2 Å²	2	28 Å²	28	2%	0.017	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	150.8	176.7	0	0	0	0	0	110.5	L75 V77 L141 V291 F317 V318	L75-A293 WeakPolarHBondContact O-CA 3.3Å; V77-A293 HydrophobicContact CG2-CB 4.15Å; L141-A293 HydrophobicContact CD1-CB 3.75Å; L141-A293 HydrophobicContact CG-CB 4.47Å; V291-A293 WeakPolarHBondContact CG1-O 3.21Å; A293-F317 WeakPolarHBondContact O-CA 3.36Å; A293-V318 HydrophobicContact CB-CB 4.31Å; A293-V318 PolarHBondContact N-O 2.6Å; A293-V318 PolarHBondContact O-N 3.16Å
294	V	98.6	Very high	92.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	142.8	171.6	59.2	0	0	0	0	110.1	V72 L75 F76 V77 W272 V276 V291 V316 F317	V72-V294 HydrophobicContact CG1-CG1 3.68Å; L75-V294 PolarHBondContact O-N 3.26Å; F76-V294 CarbonylContact C-O 3.57Å; F76-V294 VanDerWaalsContact CA-O 3.32Å; F76-V294 WeakPolarHBondContact CA-O 3.15Å; F76-V294 HydrophobicContact CB-CG1 4.4Å; F76-V294 HydrophobicContact CD2-CG1 4.35Å; V77-V294 PolarHBondContact N-O 2.91Å; W272-V294 HydrophobicContact CH2-CG2 4.39Å; V276-V294 HydrophobicContact CG1-CG1 4.35Å; V276-V294 HydrophobicContact CG1-CG2 4.01Å; V291-V294 HydrophobicContact CG1-CB 4.37Å; V294-V316 CarbonylContact C-O 3.59Å; V294-V316 VanDerWaalsContact CA-O 3.3Å; V294-V316 WeakPolarHBondContact CA-O 3.25Å; V294-F317 HydrophobicContact CB-CD1 3.79Å; V294-F317 HydrophobicContact CB-CE1 4.08Å; V294-F317 HydrophobicContact CG2-CD1 3.54Å; V294-F317 HydrophobicContact CG2-CE1 3.49Å; V294-F317 VanDerWaalsContact CG2-CE1 3.49Å; V294-F317 HydrophobicContact CG2-CG 4.13Å; V294-F317 HydrophobicContact CG2-CZ 4.02Å
295	T	98.4	Very high	90.5	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	155.4	174.4	-168.6	0	0	0	0	110.8	V77 S79 L141 L297 V316	V77-T295 VanDerWaalsContact O-CB 3.23Å; V77-T295 WeakPolarHBondContact O-CB 3.41Å; V77-T295 PolarHBondContact O-OG1 3.4Å; S79-T295 WeakPolarHBondContact CB-OG1 3.24Å; S79-T295 PolarHBondContact OG-OG1 3.15Å; L141-T295 HydrophobicContact CD1-CG2 3.76Å; L141-T295 HydrophobicContact CD2-CG2 3.96Å; L141-T295 HydrophobicContact CG-CG2 4.4Å; T295-L297 HydrophobicContact CG2-CD1 3.72Å; T295-L297 HydrophobicContact CG2-CD2 4.4Å; T295-L297 HydrophobicContact CG2-CG 3.77Å; T295-V316 HydrophobicContact CG2-CB 4.04Å; T295-V316 PolarHBondContact N-O 3.16Å; T295-V316 PolarHBondContact O-N 2.93Å
296	R	98.2	Very high	88.8	Confident	41 Å²	41	37.9 Å²	37.9	16%	0.155	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	121.4	174.1	-170.1	175.4	-178.1	178.8	-2.6	108.5	W60 K62 F76 W272 D313	W60-R296 WeakPolarHBondContact O-CG 3.42Å; K62-R296 VanDerWaalsContact O-CD 3.25Å; K62-R296 WeakPolarHBondContact O-CD 3.37Å; K62-R296 PolarHBondContact O-NH1 3.47Å; F76-R296 HydrophobicContact CE2-CB 4.22Å; W272-R296 HydrophobicContact CD2-CG 4.19Å; W272-R296 HydrophobicContact CH2-CB 3.73Å; W272-R296 HydrophobicContact CH2-CG 4.34Å; W272-R296 HydrophobicContact CZ2-CB 3.42Å; W272-R296 VanDerWaalsContact CZ2-CB 3.42Å; W272-R296 HydrophobicContact CZ2-CG 3.69Å; W272-R296 HydrophobicContact CZ3-CB 4.4Å; R296-D313 IonicContact CZ-OD1 3.02Å; R296-D313 VanDerWaalsContact CZ-OD1 3.26Å; R296-D313 IonicContact CZ-OD2 2.64Å; R296-D313 IonicContact NE-OD1 2.87Å; R296-D313 PolarHBondContact NE-OD1 2.88Å; R296-D313 IonicContact NE-OD2 3.26Å; R296-D313 IonicContact NH2-OD1 2.79Å; R296-D313 PolarHBondContact NH2-OD1 3.22Å; R296-D313 IonicContact NH2-OD2 2.72Å; R296-D313 PolarHBondContact NH2-OD2 2.76Å
297	L	97	Very high	87.4	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	153.4	-177.8	-65.7	176.8	0	0	0	110.4	Y61 S79 V132 F133 T295 D314 V316	Y61-L297 HydrophobicContact CD1-CD2 3.91Å; Y61-L297 HydrophobicContact CE1-CD2 3.59Å; S79-L297 VanDerWaalsContact CB-CD2 3.5Å; V132-L297 WeakPolarHBondContact O-CD1 3.41Å; F133-L297 HydrophobicContact CB-CD1 3.75Å; F133-L297 HydrophobicContact CD1-CD1 4.48Å; T295-L297 HydrophobicContact CG2-CD1 3.72Å; T295-L297 HydrophobicContact CG2-CD2 4.4Å; T295-L297 HydrophobicContact CG2-CG 3.77Å; L297-D314 PolarHBondContact N-O 2.91Å; L297-D314 WeakPolarHBondContact O-CA 3.29Å; L297-D314 WeakPolarHBondContact O-CB 3.21Å; L297-D314 PolarHBondContact O-N 3.34Å; L297-V316 HydrophobicContact CB-CG2 4.29Å; L297-V316 HydrophobicContact CD1-CB 4.27Å; L297-V316 HydrophobicContact CD1-CG2 3.83Å; L297-V316 HydrophobicContact CG-CG2 4.38Å
298	P	95.1	Very high	86.6	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.013	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	122.3	169	32	-33.9	0	0	0	109.8	W60 Y61 L300 V311	W60-P298 HydrophobicContact CB-CB 4.18Å; W60-P298 HydrophobicContact CB-CG 4.47Å; W60-P298 HydrophobicContact CD2-CB 4.04Å; W60-P298 HydrophobicContact CE3-CB 3.71Å; W60-P298 HydrophobicContact CE3-CG 3.79Å; W60-P298 HydrophobicContact CG-CB 4.28Å; W60-P298 HydrophobicContact CZ3-CB 4.37Å; W60-P298 HydrophobicContact CZ3-CG 4.44Å; Y61-P298 HydrophobicContact CE1-CG 4.35Å; Y61-P298 HydrophobicContact CE2-CG 4.48Å; P298-L300 HydrophobicContact CB-CD2 4.12Å; P298-L300 HydrophobicContact CB-CG 4.01Å; P298-L300 HydrophobicContact CG-CD1 4.27Å; P298-L300 HydrophobicContact CG-CG 4.27Å; P298-L300 PolarHBondContact O-N 2.89Å; P298-V311 HydrophobicContact CB-CG2 3.64Å
299	Y	92.3	Very high	85.8	Confident	35 Å²	35	41.4 Å²	41.4	14%	0.137	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	104	164.8	177	-148.6	0	0	0	109.2	M130 V132 N214 V245 V311 L312	M130-Y299 HydrophobicContact CB-CE2 4Å; M130-Y299 HydrophobicContact CG-CE2 4.28Å; M130-Y299 HydrophobicContact SD-CE2 4.29Å; M130-Y299 PolarHBondContact SD-OH 3.44Å; V132-Y299 HydrophobicContact CG2-CD2 3.86Å; V132-Y299 HydrophobicContact CG2-CE2 4.09Å; N214-Y299 HydrophobicContact CB-CD1 4.27Å; N214-Y299 HydrophobicContact CB-CE1 3.73Å; N214-Y299 WeakPolarHBondContact ND2-CD1 3.38Å; N214-Y299 WeakPolarHBondContact ND2-CD2 3.28Å; N214-Y299 VanDerWaalsContact ND2-CG 3.32Å; V245-Y299 HydrophobicContact CG2-CD1 3.71Å; V245-Y299 HydrophobicContact CG2-CE1 4.37Å; Y299-V311 WeakPolarHBondContact O-CA 3.24Å; Y299-L312 HydrophobicContact CD1-CB 4.23Å; Y299-L312 HydrophobicContact CD1-CD1 3.99Å; Y299-L312 HydrophobicContact CE1-CD1 4.42Å; Y299-L312 PolarHBondContact N-O 2.98Å; Y299-L312 PolarHBondContact O-N 3.16Å
300	L	89.7	Confident	85	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	138.7	-174.7	-63.9	171.2	0	0	0	110.8	W60 T85 F88 L89 M130 F131 P298 Y309 Y310 V311	W60-L300 HydrophobicContact CH2-CD2 4.31Å; W60-L300 HydrophobicContact CZ3-CD2 4.22Å; T85-L300 HydrophobicContact CG2-CD1 3.75Å; F88-L300 HydrophobicContact CD1-CB 3.97Å; F88-L300 HydrophobicContact CD1-CD1 4.09Å; F88-L300 HydrophobicContact CE1-CB 3.62Å; F88-L300 HydrophobicContact CZ-CB 4.45Å; L89-L300 HydrophobicContact CD2-CD1 3.88Å; L89-L300 HydrophobicContact CD2-CD2 4.09Å; L89-L300 HydrophobicContact CG-CD1 4.35Å; M130-L300 CarbonylContact C-O 3.56Å; M130-L300 WeakPolarHBondContact CA-O 3.48Å; F131-L300 HydrophobicContact CB-CB 4.18Å; F131-L300 HydrophobicContact CD1-CD1 4.04Å; F131-L300 PolarHBondContact N-O 2.88Å; F131-L300 PolarHBondContact O-N 2.99Å; P298-L300 HydrophobicContact CB-CD2 4.12Å; P298-L300 HydrophobicContact CB-CG 4.01Å; P298-L300 HydrophobicContact CG-CD1 4.27Å; P298-L300 HydrophobicContact CG-CG 4.27Å; P298-L300 PolarHBondContact O-N 2.89Å; L300-Y309 HydrophobicContact CD2-CD2 4.09Å; L300-Y309 HydrophobicContact CD2-CE2 4.46Å; L300-Y310 WeakPolarHBondContact CA-O 3.47Å; L300-V311 HydrophobicContact CD2-CB 3.76Å; L300-V311 HydrophobicContact CD2-CG2 3.77Å
301	C	81.7	Confident	84.5	Confident	35 Å²	35	44.9 Å²	44.9	24%	0.236	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	140.8	172.5	-177.6	0	0	0	0	109.6	G303 Y309 Y310	C301-G303 PolarHBondContact O-N 2.9Å; C301-Y309 CarbonylContact O-C 3.58Å; C301-Y309 VanDerWaalsContact O-CA 3.3Å; C301-Y309 WeakPolarHBondContact O-CA 3.33Å; C301-Y309 WeakPolarHBondContact O-CB 3.32Å; C301-Y310 PolarHBondContact N-O 3.26Å; C301-Y310 PolarHBondContact O-N 3.43Å
302	E	81.1	Confident	84.1	Confident	14 Å²	14	48.2 Å²	48.2	7%	0.065	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54	136.3	172.1	-71.7	-175	162.4	0	0	110.8	F88 K95 G128 S129	F88-E302 HydrophobicContact CE2-CG 4.32Å; F88-E302 HydrophobicContact CZ-CG 3.94Å; K95-E302 VanDerWaalsContact CD-OE1 3.23Å; K95-E302 WeakPolarHBondContact CD-OE1 3.32Å; K95-E302 WeakPolarHBondContact CE-OE1 3.44Å; K95-E302 IonicContact NZ-OE1 2.67Å; K95-E302 PolarHBondContact NZ-OE1 2.9Å; K95-E302 IonicContact NZ-OE2 3.3Å; K95-E302 PolarHBondContact NZ-OE2 3.13Å; G128-E302 PolarHBondContact N-OE2 3.18Å; S129-E302 PolarHBondContact N-OE2 2.99Å; S129-E302 PolarHBondContact O-N 3.03Å
303	G	71.1	Confident	83.8	Confident	15 Å²	15	47.6 Å²	47.6	16%	0.155	23%	0.226	C	C	.	.			trans	-80.4	-170.3	-175.5	0	0	0	0	0	114.3	C301 K307 D308	C301-G303 PolarHBondContact O-N 2.9Å; G303-K307 CarbonylContact C-O 3.58Å; G303-K307 WeakPolarHBondContact CA-O 3.34Å; G303-D308 VanDerWaalsContact CA-O 3.31Å; G303-D308 WeakPolarHBondContact CA-O 3.48Å; G303-D308 PolarHBondContact N-O 3.3Å
304	D	66.9	Low	83.7	Confident	57 Å²	57	47.5 Å²	47.5	31%	0.305	23%	0.225	S	C	.	.			trans	-122.2	-152.2	-179.4	68.4	9.3	0	0	0	111.2	Y306 K307 Y310	D304-Y306 PolarHBondContact O-N 3.5Å; D304-Y306 WeakPolarHBondContact OD1-CA 3.31Å; D304-Y306 WeakPolarHBondContact OD1-CB 3.36Å; D304-Y306 PolarHBondContact OD1-N 3.37Å; D304-Y306 WeakPolarHBondContact OD2-CD2 3.34Å; D304-K307 PolarHBondContact N-O 3.39Å; D304-K307 VanDerWaalsContact O-O 3.13Å; D304-K307 PolarHBondContact OD1-N 3.23Å; D304-K307 VanDerWaalsContact OD1-N 3.12Å; D304-Y310 PolarHBondContact OD1-OH 3.47Å; D304-Y310 PolarHBondContact OD2-OH 3.06Å
305	M	58.8	Low	83.7	Confident	102 Å²	102	47.5 Å²	47.5	50%	0.502	23%	0.225	S	C	.	.	S	Bend	trans	-73.5	-13.6	176	54.5	176.8	42.4	0	0	114.5	Q102	Q102-M305 VanDerWaalsContact OE1-CE 3.31Å
306	Y	60.3	Low	83.7	Confident	181 Å²	181	47.5 Å²	47.5	71%	0.71	23%	0.225	S	C	*	.	S	Bend	trans	-105.3	-34.2	-173.5	-54.6	-70.8	0	0	0	112.3	D304	D304-Y306 PolarHBondContact O-N 3.5Å; D304-Y306 WeakPolarHBondContact OD1-CA 3.31Å; D304-Y306 WeakPolarHBondContact OD1-CB 3.36Å; D304-Y306 PolarHBondContact OD1-N 3.37Å; D304-Y306 WeakPolarHBondContact OD2-CD2 3.34Å
307	K	65.9	Low	83.7	Confident	120 Å²	120	45.5 Å²	45.5	52%	0.522	22%	0.217	S	C	.	.			trans	-130.5	145.3	176	-67.6	-167.4	179.2	-175.2	0	110.7	G303 D304 Y310	G303-K307 CarbonylContact C-O 3.58Å; G303-K307 WeakPolarHBondContact CA-O 3.34Å; D304-K307 PolarHBondContact N-O 3.39Å; D304-K307 VanDerWaalsContact O-O 3.13Å; D304-K307 PolarHBondContact OD1-N 3.23Å; D304-K307 VanDerWaalsContact OD1-N 3.12Å; K307-Y310 HydrophobicContact CB-CE1 4.4Å; K307-Y310 HydrophobicContact CB-CE2 4.38Å; K307-Y310 HydrophobicContact CD-CD1 4.08Å; K307-Y310 HydrophobicContact CD-CE1 3.72Å; K307-Y310 HydrophobicContact CG-CE1 4.39Å
308	D	77.5	Confident	83.8	Confident	48 Å²	48	45.6 Å²	45.6	26%	0.257	22%	0.218	S	C	.	.	S	Bend	trans	-70.4	-34.7	178	-67	-28.7	0	0	0	112	R40 S92 I93 S96 G303	R40-D308 IonicContact NH2-OD1 3.14Å; R40-D308 PolarHBondContact NH2-OD1 2.96Å; R40-D308 VanDerWaalsContact NH2-OD1 3.14Å; S92-D308 WeakPolarHBondContact CB-O 3.43Å; I93-D308 HydrophobicContact CB-CB 4.48Å; I93-D308 HydrophobicContact CG1-CB 3.77Å; S96-D308 WeakPolarHBondContact CB-OD1 3.31Å; S96-D308 PolarHBondContact OG-OD1 3.31Å; G303-D308 VanDerWaalsContact CA-O 3.31Å; G303-D308 WeakPolarHBondContact CA-O 3.48Å; G303-D308 PolarHBondContact N-O 3.3Å
309	Y	80.7	Confident	83.9	Confident	65 Å²	65	45.5 Å²	45.5	26%	0.255	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	162.3	173.7	56.1	-89.5	0	0	0	110.2	W60 L89 I93 L300 C301	W60-Y309 AromaticContact CH2-CE2 3.87Å; W60-Y309 HydrophobicContact CH2-CE2 3.87Å; W60-Y309 HydrophobicContact CZ2-CE2 4.25Å; L89-Y309 HydrophobicContact CD2-CD1 3.89Å; L89-Y309 HydrophobicContact CD2-CD2 3.84Å; L89-Y309 HydrophobicContact CD2-CE1 3.83Å; L89-Y309 HydrophobicContact CD2-CE2 3.77Å; L89-Y309 HydrophobicContact CD2-CG 3.9Å; I93-Y309 HydrophobicContact CG1-CD1 4.48Å; L300-Y309 HydrophobicContact CD2-CD2 4.09Å; L300-Y309 HydrophobicContact CD2-CE2 4.46Å; C301-Y309 CarbonylContact O-C 3.58Å; C301-Y309 VanDerWaalsContact O-CA 3.3Å; C301-Y309 WeakPolarHBondContact O-CA 3.33Å; C301-Y309 WeakPolarHBondContact O-CB 3.32Å
310	Y	80.2	Confident	84.2	Confident	91 Å²	91	46.8 Å²	46.8	36%	0.357	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	145.1	169.1	-64.1	-91.3	0	0	0	109.1	L300 C301 D304 K307	L300-Y310 WeakPolarHBondContact CA-O 3.47Å; C301-Y310 PolarHBondContact N-O 3.26Å; C301-Y310 PolarHBondContact O-N 3.43Å; D304-Y310 PolarHBondContact OD1-OH 3.47Å; D304-Y310 PolarHBondContact OD2-OH 3.06Å; K307-Y310 HydrophobicContact CB-CE1 4.4Å; K307-Y310 HydrophobicContact CB-CE2 4.38Å; K307-Y310 HydrophobicContact CD-CD1 4.08Å; K307-Y310 HydrophobicContact CD-CE1 3.72Å; K307-Y310 HydrophobicContact CG-CE1 4.39Å
311	V	87.3	Confident	84.5	Confident	57 Å²	57	47.7 Å²	47.7	35%	0.345	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	133.5	175.6	62	0	0	0	0	108.9	W60 P298 Y299 L300	W60-V311 HydrophobicContact CD2-CG2 4.25Å; W60-V311 HydrophobicContact CZ2-CB 4.45Å; W60-V311 HydrophobicContact CZ2-CG1 4.24Å; W60-V311 HydrophobicContact CZ2-CG2 4.3Å; P298-V311 HydrophobicContact CB-CG2 3.64Å; Y299-V311 WeakPolarHBondContact O-CA 3.24Å; L300-V311 HydrophobicContact CD2-CB 3.76Å; L300-V311 HydrophobicContact CD2-CG2 3.77Å
312	L	88.1	Confident	85	Confident	87 Å²	87	48.6 Å²	48.6	46%	0.455	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	150.1	169	-64.8	173.8	0	0	0	108.8	V245 Y299 D314	V245-L312 HydrophobicContact CG1-CB 3.92Å; V245-L312 HydrophobicContact CG1-CD1 4.23Å; V245-L312 HydrophobicContact CG1-CG 4.46Å; V245-L312 HydrophobicContact CG2-CB 3.96Å; V245-L312 HydrophobicContact CG2-CD1 3.93Å; Y299-L312 HydrophobicContact CD1-CB 4.23Å; Y299-L312 HydrophobicContact CD1-CD1 3.99Å; Y299-L312 HydrophobicContact CE1-CD1 4.42Å; Y299-L312 PolarHBondContact N-O 2.98Å; Y299-L312 PolarHBondContact O-N 3.16Å; L312-D314 PolarHBondContact O-N 3.44Å
313	D	92.5	Very high	84.9	Confident	46 Å²	46	54.4 Å²	54.4	25%	0.246	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	112.9	179.2	-173.7	24.1	0	0	0	109.2	V245 L246 R296	V245-D313 WeakPolarHBondContact CA-O 3.33Å; L246-D313 PolarHBondContact N-O 3.39Å; R296-D313 IonicContact CZ-OD1 3.02Å; R296-D313 VanDerWaalsContact CZ-OD1 3.26Å; R296-D313 IonicContact CZ-OD2 2.64Å; R296-D313 IonicContact NE-OD1 2.87Å; R296-D313 PolarHBondContact NE-OD1 2.88Å; R296-D313 IonicContact NE-OD2 3.26Å; R296-D313 IonicContact NH2-OD1 2.79Å; R296-D313 PolarHBondContact NH2-OD1 3.22Å; R296-D313 IonicContact NH2-OD2 2.72Å; R296-D313 PolarHBondContact NH2-OD2 2.76Å
314	D	95.8	Very high	84.4	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	150.1	-170.2	-154.9	-7.7	0	0	0	111.4	N214 A243 A244 V245 W272 L297 L312	N214-D314 PolarHBondContact ND2-OD2 3.3Å; N214-D314 PolarHBondContact OD1-OD1 2.87Å; N214-D314 PolarHBondContact OD1-OD2 3.3Å; A243-D314 WeakPolarHBondContact CB-OD2 3.31Å; A244-D314 WeakPolarHBondContact CA-OD1 3.47Å; A244-D314 PolarHBondContact N-OD1 2.89Å; V245-D314 PolarHBondContact N-OD1 2.82Å; W272-D314 PolarHBondContact NE1-O 3.34Å; L297-D314 PolarHBondContact N-O 2.91Å; L297-D314 WeakPolarHBondContact O-CA 3.29Å; L297-D314 WeakPolarHBondContact O-CB 3.21Å; L297-D314 PolarHBondContact O-N 3.34Å; L312-D314 PolarHBondContact O-N 3.44Å
315	A	98.3	Very high	85.2	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	118.3	168.5	0	0	0	0	0	108.8	A243 A244 L246 W272 V276 F317	A243-A315 WeakPolarHBondContact CA-O 3.1Å; A244-A315 PolarHBondContact N-O 3.45Å; A244-A315 PolarHBondContact O-N 3.02Å; A244-A315 VanDerWaalsContact O-N 3.12Å; L246-A315 HydrophobicContact CD1-CB 3.74Å; L246-A315 HydrophobicContact CG-CB 4.22Å; W272-A315 HydrophobicContact CZ2-CB 3.64Å; V276-A315 HydrophobicContact CG2-CB 3.75Å; A315-F317 HydrophobicContact CB-CD2 4.37Å; A315-F317 HydrophobicContact CB-CE2 3.49Å; A315-F317 VanDerWaalsContact CB-CE2 3.49Å; A315-F317 HydrophobicContact CB-CZ 3.82Å; A315-F317 WeakPolarHBondContact O-CD2 3.29Å; A315-F317 WeakPolarHBondContact O-CE2 3.32Å
316	V	98.7	Very high	86.6	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	119.4	179.7	-171.2	0	0	0	0	109.5	V132 F133 L141 I241 L242 A243 V294 T295 L297	V132-V316 HydrophobicContact CG1-CG2 3.74Å; F133-V316 HydrophobicContact CD1-CG1 4.27Å; F133-V316 HydrophobicContact CE1-CG1 4.36Å; L141-V316 HydrophobicContact CD2-CB 4.28Å; L141-V316 HydrophobicContact CD2-CG1 3.69Å; I241-V316 HydrophobicContact CD1-CG1 4.14Å; I241-V316 HydrophobicContact CG1-CG1 3.91Å; L242-V316 CarbonylContact O-C 3.57Å; L242-V316 WeakPolarHBondContact O-CA 3.3Å; A243-V316 HydrophobicContact CB-CG2 3.99Å; V294-V316 CarbonylContact C-O 3.59Å; V294-V316 VanDerWaalsContact CA-O 3.3Å; V294-V316 WeakPolarHBondContact CA-O 3.25Å; T295-V316 HydrophobicContact CG2-CB 4.04Å; T295-V316 PolarHBondContact N-O 3.16Å; T295-V316 PolarHBondContact O-N 2.93Å; L297-V316 HydrophobicContact CB-CG2 4.29Å; L297-V316 HydrophobicContact CD1-CB 4.27Å; L297-V316 HydrophobicContact CD1-CG2 3.83Å; L297-V316 HydrophobicContact CG-CG2 4.38Å
317	F	98.8	Very high	88.1	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	144.8	-176.4	-57.8	-96	0	0	0	110.6	I241 L242 V276 L279 F284 V291 A293 V294 A315 L319	I241-F317 WeakPolarHBondContact CA-O 2.98Å; L242-F317 HydrophobicContact CD2-CD2 3.96Å; L242-F317 PolarHBondContact N-O 2.83Å; L242-F317 PolarHBondContact O-N 3.37Å; V276-F317 HydrophobicContact CB-CZ 4.37Å; V276-F317 HydrophobicContact CG1-CE1 3.93Å; V276-F317 HydrophobicContact CG1-CZ 4.14Å; V276-F317 HydrophobicContact CG2-CZ 4.06Å; L279-F317 HydrophobicContact CB-CZ 4.41Å; L279-F317 HydrophobicContact CD1-CE2 4.34Å; L279-F317 HydrophobicContact CD1-CZ 4.19Å; F284-F317 HydrophobicContact CE2-CB 4.5Å; F284-F317 AromaticContact CE2-CD1 3.77Å; F284-F317 HydrophobicContact CE2-CD1 3.77Å; F284-F317 HydrophobicContact CE2-CD2 4.05Å; F284-F317 AromaticContact CE2-CE1 3.86Å; F284-F317 HydrophobicContact CE2-CE1 3.86Å; F284-F317 HydrophobicContact CE2-CE2 4.16Å; F284-F317 AromaticContact CE2-CG 3.86Å; F284-F317 HydrophobicContact CE2-CG 3.86Å; F284-F317 HydrophobicContact CE2-CZ 4.06Å; F284-F317 HydrophobicContact CZ-CD2 4.18Å; F284-F317 HydrophobicContact CZ-CE2 4.24Å; F284-F317 HydrophobicContact CZ-CG 4.4Å; F284-F317 HydrophobicContact CZ-CZ 4.5Å; V291-F317 HydrophobicContact CG1-CD1 4.23Å; V291-F317 HydrophobicContact CG2-CD1 4.21Å; A293-F317 WeakPolarHBondContact O-CA 3.36Å; V294-F317 HydrophobicContact CB-CD1 3.79Å; V294-F317 HydrophobicContact CB-CE1 4.08Å; V294-F317 HydrophobicContact CG2-CD1 3.54Å; V294-F317 HydrophobicContact CG2-CE1 3.49Å; V294-F317 VanDerWaalsContact CG2-CE1 3.49Å; V294-F317 HydrophobicContact CG2-CG 4.13Å; V294-F317 HydrophobicContact CG2-CZ 4.02Å; A315-F317 HydrophobicContact CB-CD2 4.37Å; A315-F317 HydrophobicContact CB-CE2 3.49Å; A315-F317 VanDerWaalsContact CB-CE2 3.49Å; A315-F317 HydrophobicContact CB-CZ 3.82Å; A315-F317 WeakPolarHBondContact O-CD2 3.29Å; A315-F317 WeakPolarHBondContact O-CE2 3.32Å; F317-L319 HydrophobicContact CB-CD2 3.82Å; F317-L319 HydrophobicContact CB-CG 4.1Å
318	V	98.8	Very high	89.4	Confident	2 Å²	2	55 Å²	55	1%	0.012	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	118.7	159.3	176.9	0	0	0	0	107.2	L141 L142 R239 L240 E292 A293	L141-V318 HydrophobicContact CD1-CG2 4.45Å; L141-V318 HydrophobicContact CD2-CG2 3.87Å; L141-V318 HydrophobicContact CG-CG2 3.62Å; L142-V318 HydrophobicContact CD2-CG1 4.08Å; L142-V318 HydrophobicContact CD2-CG2 3.73Å; R239-V318 HydrophobicContact CB-CG1 4.3Å; R239-V318 HydrophobicContact CG-CG1 4.34Å; L240-V318 WeakPolarHBondContact O-CA 3.49Å; E292-V318 HydrophobicContact CB-CG1 4.37Å; E292-V318 PolarHBondContact N-O 3.33Å; A293-V318 HydrophobicContact CB-CB 4.31Å; A293-V318 PolarHBondContact N-O 2.6Å; A293-V318 PolarHBondContact O-N 3.16Å
319	L	98.6	Very high	90.1	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.1	-177.3	-53	-178.2	0	0	0	109.7	R239 L240 L242 F284 F289 E290 V291 F317	R239-L319 WeakPolarHBondContact CA-O 3.43Å; L240-L319 HydrophobicContact CB-CB 4.14Å; L240-L319 HydrophobicContact CD2-CB 4.44Å; L240-L319 HydrophobicContact CD2-CD1 3.74Å; L240-L319 HydrophobicContact CG-CB 4.37Å; L240-L319 HydrophobicContact CG-CD1 4.23Å; L240-L319 PolarHBondContact N-O 3.15Å; L240-L319 PolarHBondContact O-N 3.37Å; L242-L319 HydrophobicContact CB-CD1 4.34Å; L242-L319 HydrophobicContact CD1-CD1 4.35Å; F284-L319 HydrophobicContact CD1-CD1 4.02Å; F284-L319 HydrophobicContact CD2-CD1 3.97Å; F284-L319 HydrophobicContact CD2-CD2 3.67Å; F284-L319 HydrophobicContact CE1-CD1 4.21Å; F284-L319 HydrophobicContact CE2-CD1 4.16Å; F284-L319 HydrophobicContact CE2-CD2 4.05Å; F284-L319 HydrophobicContact CG-CD1 3.91Å; F284-L319 HydrophobicContact CG-CD2 4.26Å; F284-L319 HydrophobicContact CZ-CD1 4.29Å; F289-L319 HydrophobicContact CB-CB 4.19Å; F289-L319 HydrophobicContact CB-CD1 4.29Å; F289-L319 HydrophobicContact CD1-CB 3.71Å; F289-L319 HydrophobicContact CE1-CB 4.4Å; F289-L319 HydrophobicContact CG-CB 4.14Å; F289-L319 HydrophobicContact CG-CD1 4.34Å; E290-L319 CarbonylContact O-C 3.6Å; E290-L319 VanDerWaalsContact O-CA 3.31Å; E290-L319 WeakPolarHBondContact O-CA 3.35Å; V291-L319 HydrophobicContact CB-CD2 4.17Å; V291-L319 HydrophobicContact CG2-CD2 3.58Å; F317-L319 HydrophobicContact CB-CD2 3.82Å; F317-L319 HydrophobicContact CB-CG 4.1Å
320	K	97	Very high	90.8	Very high	63 Å²	63	54.8 Å²	54.8	27%	0.274	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	141.6	169.9	68.5	174.9	-178.5	171.5	0	109.8	F289 E290 E292	F289-K320 WeakPolarHBondContact CA-O 3.37Å; F289-K320 WeakPolarHBondContact CD1-O 3.45Å; E290-K320 HydrophobicContact CB-CD 4.48Å; E290-K320 VanDerWaalsContact CB-CE 3.49Å; E290-K320 HydrophobicContact CB-CG 4Å; E290-K320 PolarHBondContact N-O 3.06Å; E290-K320 PolarHBondContact O-N 3.47Å; E290-K320 WeakPolarHBondContact OE2-CE 3.45Å; E290-K320 IonicContact OE2-NZ 3.89Å; E290-K320 PolarHBondContact OE2-NZ 2.92Å; E292-K320 HydrophobicContact CG-CB 3.97Å; E292-K320 HydrophobicContact CG-CD 3.72Å; E292-K320 HydrophobicContact CG-CG 3.8Å; E292-K320 WeakPolarHBondContact OE1-CD 3.3Å
321	P	96.3	Very high	91.5	Very high	18 Å²	18	52.2 Å²	52.2	12%	0.117	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	141.4	171.1	28.2	-32.5	0	0	0	110	H230 G238 F289	H230-P321 VanDerWaalsContact CD2-CB 3.5Å; H230-P321 WeakPolarHBondContact CD2-CB 3.47Å; H230-P321 VanDerWaalsContact NE2-CB 3.29Å; H230-P321 WeakPolarHBondContact NE2-CB 3.37Å; G238-P321 VanDerWaalsContact O-CD 3.22Å; G238-P321 WeakPolarHBondContact O-CD 3.35Å; F289-P321 HydrophobicContact CE1-CB 4.39Å
322	V	92.6	Very high	91.9	Very high	54 Å²	54	51.8 Å²	51.8	33%	0.327	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-86.2	126.9	171.8	-178	0	0	0	0	107.5	G288 E290	G288-V322 PolarHBondContact O-N 2.94Å; E290-V322 HydrophobicContact CB-CG2 4.12Å; E290-V322 HydrophobicContact CG-CG2 3.57Å
323	E	79.5	Confident	92.2	Very high	136 Å²	136	48.9 Å²	48.9	64%	0.636	24%	0.239	S	C	*	.	P	Polyproline II helix	trans	-69.6	131.9	174.3	-66.5	176.4	-172.4	0	0	109.4	S236	S236-E323 VanDerWaalsContact CB-OE1 3.22Å; S236-E323 WeakPolarHBondContact CB-OE1 3.42Å; S236-E323 PolarHBondContact OG-OE1 3.43Å
324	E	59.3	Low	92.1	Very high	268 Å²	268	49.2 Å²	49.2	100%	1.252	24%	0.238	S	C	*	.			trans	-67.5	0	173.5	-75.9	-174.5	167.9	0	0	112.8

Retrieved 324 of 324 residues in 1261.5 ms (Link to these results)

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