A0A087XKH1_POEFO Loading...

Alpha-2-HS-glycoprotein 2

AlphaFold DB , UniProt , Accession A0A087XKH1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 352 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	S	54	Low	56.6	Low	155 Å²	155	122.6 Å²	122.6	100%	1.084	65%	0.652	S	S	*	*				0	-1	0	57	0	0	0	0	114.2	N3	S1-N3 PolarHBondContact O-N 3.15Å
2	L	50.7	Low	56.6	Low	154 Å²	154	121.1 Å²	121.1	81%	0.806	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-3.3	-175.1	-147.8	71.5	0	0	0	115.1	T6	L2-T6 PolarHBondContact O-OG1 2.85Å
3	N	56.5	Low	56.5	Low	129 Å²	129	125.1 Å²	125.1	69%	0.69	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	-24.3	-174.6	-141.7	17.9	0	0	0	113.4	S1 L7	S1-N3 PolarHBondContact O-N 3.15Å; N3-L7 WeakPolarHBondContact O-CD1 3.41Å
4	Q	55.6	Low	56.5	Low	152 Å²	152	123.4 Å²	123.4	71%	0.71	64%	0.636	S	S	*	*	H	α-helix	trans	-85.8	-32.9	-176.4	-159.7	133.9	32.1	0	0	112.7	L8	Q4-L8 WeakPolarHBondContact O-CG 3.31Å; Q4-L8 PolarHBondContact O-N 2.87Å
5	Y	56.8	Low	56.3	Low	180 Å²	180	128.6 Å²	128.6	71%	0.706	65%	0.645	S	S	*	*	H	α-helix	trans	-68.3	-41	175.2	-103.9	-92.2	0	0	0	112.1	L8 V9	Y5-L8 PolarHBondContact O-N 2.71Å; Y5-V9 VanDerWaalsContact O-CG2 3.27Å; Y5-V9 WeakPolarHBondContact O-CG2 3.38Å; Y5-V9 PolarHBondContact O-N 3.02Å
6	T	56.8	Low	56.1	Low	67 Å²	67	126.7 Å²	126.7	41%	0.411	64%	0.638	S	S	.	*	H	α-helix	trans	-66.2	-42.7	-179.8	-42.4	0	0	0	0	111.2	L2 L8 V9 F10	L2-T6 PolarHBondContact O-OG1 2.85Å; T6-L8 PolarHBondContact O-N 2.74Å; T6-V9 PolarHBondContact O-N 2.69Å; T6-F10 HydrophobicContact CG2-CD2 3.98Å; T6-F10 HydrophobicContact CG2-CE2 3.92Å; T6-F10 VanDerWaalsContact O-CD2 3.3Å; T6-F10 WeakPolarHBondContact O-CD2 3.12Å; T6-F10 PolarHBondContact O-N 3.03Å
7	L	57.3	Low	56	Low	121 Å²	121	124.1 Å²	124.1	63%	0.634	63%	0.63	S	S	*	*	H	α-helix	trans	-62.8	-38.2	175	-96	150.2	0	0	0	113.2	N3 S11	N3-L7 WeakPolarHBondContact O-CD1 3.41Å; L7-S11 WeakPolarHBondContact O-CB 3.18Å; L7-S11 PolarHBondContact O-N 2.97Å
8	L	57.9	Low	56	Low	102 Å²	102	121.4 Å²	121.4	53%	0.534	62%	0.62	S	S	.	*	H	α-helix	trans	-68.1	-40.8	175.8	-78.9	164.5	0	0	0	112.2	Q4 Y5 T6 S11 L12	Q4-L8 WeakPolarHBondContact O-CG 3.31Å; Q4-L8 PolarHBondContact O-N 2.87Å; Y5-L8 PolarHBondContact O-N 2.71Å; T6-L8 PolarHBondContact O-N 2.74Å; L8-S11 PolarHBondContact O-N 3.44Å; L8-L12 WeakPolarHBondContact O-CB 3.47Å; L8-L12 WeakPolarHBondContact O-CD1 3.05Å; L8-L12 PolarHBondContact O-N 2.82Å
9	V	59.5	Low	55.8	Low	82 Å²	82	117.4 Å²	117.4	50%	0.497	61%	0.607	S	S	.	*	H	α-helix	trans	-67	-41	178.3	174.2	0	0	0	0	111.4	Y5 T6 L12 Y13	Y5-V9 VanDerWaalsContact O-CG2 3.27Å; Y5-V9 WeakPolarHBondContact O-CG2 3.38Å; Y5-V9 PolarHBondContact O-N 3.02Å; T6-V9 PolarHBondContact O-N 2.69Å; V9-L12 PolarHBondContact O-N 3.44Å; V9-Y13 PolarHBondContact O-N 3.4Å
10	F	57.8	Low	55.6	Low	134 Å²	134	118.1 Å²	118.1	59%	0.588	61%	0.611	S	S	*	*	H	α-helix	trans	-65.9	-39.3	174	-88.7	-80.2	0	0	0	112.3	T6 Y13 I14	T6-F10 HydrophobicContact CG2-CD2 3.98Å; T6-F10 HydrophobicContact CG2-CE2 3.92Å; T6-F10 VanDerWaalsContact O-CD2 3.3Å; T6-F10 WeakPolarHBondContact O-CD2 3.12Å; T6-F10 PolarHBondContact O-N 3.03Å; F10-Y13 PolarHBondContact O-N 3.11Å; F10-I14 VanDerWaalsContact O-CG1 3.27Å; F10-I14 WeakPolarHBondContact O-CG1 3.12Å; F10-I14 PolarHBondContact O-N 3.08Å
11	S	59.2	Low	55.4	Low	73 Å²	73	115.1 Å²	115.1	51%	0.51	61%	0.609	S	S	.	*	H	α-helix	trans	-65.6	-38.9	176.5	-173.6	0	0	0	0	112.6	L7 L8 W15	L7-S11 WeakPolarHBondContact O-CB 3.18Å; L7-S11 PolarHBondContact O-N 2.97Å; L8-S11 PolarHBondContact O-N 3.44Å; S11-W15 WeakPolarHBondContact O-CB 3.26Å; S11-W15 PolarHBondContact O-N 2.9Å
12	L	56.6	Low	55.2	Low	104 Å²	104	114.4 Å²	114.4	55%	0.545	59%	0.593	S	S	.	*	H	α-helix	trans	-68.1	-37.5	175.2	-88.2	149.8	0	0	0	112	L8 V9 N16	L8-L12 WeakPolarHBondContact O-CB 3.47Å; L8-L12 WeakPolarHBondContact O-CD1 3.05Å; L8-L12 PolarHBondContact O-N 2.82Å; V9-L12 PolarHBondContact O-N 3.44Å; L12-N16 WeakPolarHBondContact O-CB 3.23Å; L12-N16 PolarHBondContact O-N 3.4Å; L12-N16 PolarHBondContact O-ND2 3.36Å
13	Y	56.2	Low	55.2	Low	173 Å²	173	113.6 Å²	113.6	68%	0.678	59%	0.589	S	S	*	*	H	α-helix	trans	-67.3	-42.4	176.8	-122.6	-90.7	0	0	0	112.1	V9 F10 N16 T17	V9-Y13 PolarHBondContact O-N 3.4Å; F10-Y13 PolarHBondContact O-N 3.11Å; Y13-N16 PolarHBondContact O-N 3.19Å; Y13-T17 WeakPolarHBondContact O-CG2 3.08Å; Y13-T17 PolarHBondContact O-N 2.7Å; Y13-T17 PolarHBondContact O-OG1 3.03Å
14	I	56.5	Low	54.8	Low	101 Å²	101	110.6 Å²	110.6	52%	0.518	59%	0.589	S	S	.	*	H	α-helix	trans	-67.6	-38.3	177.3	-65	166.8	0	0	0	111	F10 T17 V18	F10-I14 VanDerWaalsContact O-CG1 3.27Å; F10-I14 WeakPolarHBondContact O-CG1 3.12Å; F10-I14 PolarHBondContact O-N 3.08Å; I14-T17 WeakPolarHBondContact CA-OG1 3.24Å; I14-T17 PolarHBondContact O-N 2.85Å; I14-T17 PolarHBondContact O-OG1 3.31Å; I14-T17 VanDerWaalsContact O-OG1 3.08Å; I14-V18 HydrophobicContact CG2-CG2 4.28Å; I14-V18 WeakPolarHBondContact O-CB 3.47Å; I14-V18 WeakPolarHBondContact O-CG2 3.32Å; I14-V18 PolarHBondContact O-N 2.92Å
15	W	53.3	Low	54.3	Low	202 Å²	202	105.8 Å²	105.8	77%	0.765	58%	0.58	S	S	*	*	H	α-helix	trans	-67.9	-36.4	174.6	-113.3	22.2	0	0	0	112.8	S11 A19	S11-W15 WeakPolarHBondContact O-CB 3.26Å; S11-W15 PolarHBondContact O-N 2.9Å; W15-A19 WeakPolarHBondContact O-CB 3.37Å; W15-A19 PolarHBondContact O-N 2.86Å
16	N	53	Low	54	Low	98 Å²	98	104.6 Å²	104.6	52%	0.524	58%	0.584	S	S	.	*	H	α-helix	trans	-70.1	-36.5	175	-82.9	-79.9	0	0	0	112.4	L12 Y13 L20	L12-N16 WeakPolarHBondContact O-CB 3.23Å; L12-N16 PolarHBondContact O-N 3.4Å; L12-N16 PolarHBondContact O-ND2 3.36Å; Y13-N16 PolarHBondContact O-N 3.19Å; N16-L20 WeakPolarHBondContact O-CB 3.13Å; N16-L20 PolarHBondContact O-N 3.32Å
17	T	54.6	Low	53.6	Low	83 Å²	83	112.1 Å²	112.1	51%	0.509	61%	0.605	S	S	.	*	H	α-helix	trans	-74.4	-33.7	176	54.6	0	0	0	0	112.9	Y13 I14 G21	Y13-T17 WeakPolarHBondContact O-CG2 3.08Å; Y13-T17 PolarHBondContact O-N 2.7Å; Y13-T17 PolarHBondContact O-OG1 3.03Å; I14-T17 WeakPolarHBondContact CA-OG1 3.24Å; I14-T17 PolarHBondContact O-N 2.85Å; I14-T17 PolarHBondContact O-OG1 3.31Å; I14-T17 VanDerWaalsContact O-OG1 3.08Å; T17-G21 PolarHBondContact O-N 3.44Å
18	V	54.9	Low	53.4	Low	75 Å²	75	110.7 Å²	110.7	46%	0.455	61%	0.611	S	S	.	*	H	α-helix	trans	-71.4	-38.2	172	173	0	0	0	0	111	I14 G21 L22	I14-V18 HydrophobicContact CG2-CG2 4.28Å; I14-V18 WeakPolarHBondContact O-CB 3.47Å; I14-V18 WeakPolarHBondContact O-CG2 3.32Å; I14-V18 PolarHBondContact O-N 2.92Å; V18-G21 PolarHBondContact O-N 3.01Å; V18-L22 HydrophobicContact CG1-CD1 3.81Å; V18-L22 HydrophobicContact CG1-CG 4.47Å; V18-L22 WeakPolarHBondContact O-CB 3.45Å; V18-L22 WeakPolarHBondContact O-CD1 3.36Å; V18-L22 VanDerWaalsContact O-CG 3.25Å; V18-L22 WeakPolarHBondContact O-CG 3.16Å; V18-L22 PolarHBondContact O-N 2Å
19	A	52.7	Low	53.2	Low	45 Å²	45	113.4 Å²	113.4	37%	0.372	62%	0.62	S	S	.	*	H	α-helix	trans	-69.1	-39.5	174.8	0	0	0	0	0	112.7	W15 L22 L23	W15-A19 WeakPolarHBondContact O-CB 3.37Å; W15-A19 PolarHBondContact O-N 2.86Å; A19-L22 PolarHBondContact O-N 3.42Å; A19-L23 WeakPolarHBondContact O-CD1 3.42Å; A19-L23 WeakPolarHBondContact O-CG 3.46Å; A19-L23 PolarHBondContact O-N 2.82Å; A19-L23 VanDerWaalsContact O-N 3.15Å
20	L	52.8	Low	53.3	Low	131 Å²	131	113.4 Å²	113.4	69%	0.686	62%	0.622	S	S	*	*	H	α-helix	trans	-69	-35.3	171.9	-115.7	68.3	0	0	0	112.2	N16 L23 G24	N16-L20 WeakPolarHBondContact O-CB 3.13Å; N16-L20 PolarHBondContact O-N 3.32Å; L20-L23 PolarHBondContact O-N 3.39Å; L20-G24 PolarHBondContact O-N 3.42Å; L20-G24 VanDerWaalsContact O-N 3.13Å
21	G	50.8	Low	54.4	Low	56 Å²	56	112.2 Å²	112.2	58%	0.577	62%	0.622	S	S	*	*	H	α-helix	trans	-67.2	-34.1	173.8	0	0	0	0	0	113.2	T17 V18 L23	T17-G21 PolarHBondContact O-N 3.44Å; V18-G21 PolarHBondContact O-N 3.01Å; G21-L23 VanDerWaalsContact C-N 3.34Å
22	L	50.7	Low	55.8	Low	141 Å²	141	112.6 Å²	112.6	74%	0.738	62%	0.617	S	S	*	*	H	α-helix	trans	-75.9	-18.6	174.2	-76.6	163.6	0	0	0	113.4	V18 A19	V18-L22 HydrophobicContact CG1-CD1 3.81Å; V18-L22 HydrophobicContact CG1-CG 4.47Å; V18-L22 WeakPolarHBondContact O-CB 3.45Å; V18-L22 WeakPolarHBondContact O-CD1 3.36Å; V18-L22 VanDerWaalsContact O-CG 3.25Å; V18-L22 WeakPolarHBondContact O-CG 3.16Å; V18-L22 PolarHBondContact O-N 2Å; A19-L22 PolarHBondContact O-N 3.42Å
23	L	49.8	Very low	57.4	Low	136 Å²	136	111.8 Å²	111.8	71%	0.712	61%	0.613	S	S	*	*	H	α-helix	trans	-95.7	-11.7	175.9	-76.5	160.5	0	0	0	113.7	A19 L20 G21	A19-L23 WeakPolarHBondContact O-CD1 3.42Å; A19-L23 WeakPolarHBondContact O-CG 3.46Å; A19-L23 PolarHBondContact O-N 2.82Å; A19-L23 VanDerWaalsContact O-N 3.15Å; L20-L23 PolarHBondContact O-N 3.39Å; G21-L23 VanDerWaalsContact C-N 3.34Å
24	G	47.4	Very low	59	Low	67 Å²	67	108.3 Å²	108.3	69%	0.691	61%	0.606	S	S	*	*	S	Bend	trans	-89.2	-0.6	-177.9	0	0	0	0	0	115.7	L20	L20-G24 PolarHBondContact O-N 3.42Å; L20-G24 VanDerWaalsContact O-N 3.13Å
25	G	46.9	Very low	60.6	Low	51 Å²	51	104.2 Å²	104.2	53%	0.526	59%	0.586	S	S	.	*			trans	-104.1	37.5	-175	0	0	0	0	0	114.5	W27	G25-W27 PolarHBondContact O-N 2.93Å
26	I	50	Low	62.6	Low	154 Å²	154	99.2 Å²	99.2	79%	0.79	57%	0.571	S	S	*	*			trans	-75.4	89.1	163.6	-54	176.5	0	0	0	105.8	A28	I26-A28 PolarHBondContact O-N 3.07Å
27	W	47.1	Very low	64.6	Low	226 Å²	226	94.6 Å²	94.6	86%	0.856	55%	0.547	S	S	*	.			trans	-57.7	109.3	162.6	-78.4	57.3	0	0	0	106.1	G25 Q29	G25-W27 PolarHBondContact O-N 2.93Å; W27-Q29 VanDerWaalsContact C-N 3.28Å; W27-Q29 PolarHBondContact O-N 2.88Å
28	A	54.2	Low	66.5	Low	91 Å²	91	94.6 Å²	94.6	75%	0.752	54%	0.543	S	S	*	.			trans	-61.2	97.7	169.9	0	0	0	0	0	106.8	I26	I26-A28 PolarHBondContact O-N 3.07Å
29	Q	52.8	Low	68.4	Low	158 Å²	158	92.4 Å²	92.4	74%	0.738	53%	0.531	S	S	*	.			trans	-60.1	125.3	169.7	-68.9	-96.6	-41.6	0	0	106	W27 N31	W27-Q29 VanDerWaalsContact C-N 3.28Å; W27-Q29 PolarHBondContact O-N 2.88Å; Q29-N31 PolarHBondContact O-N 2.96Å
30	P	62	Low	70.4	Confident	83 Å²	83	97.5 Å²	97.5	54%	0.539	55%	0.552	S	S	.	*			trans	-57.8	128.4	175.5	23.4	-31.1	0	0	0	108	I32	P30-I32 PolarHBondContact O-N 2.74Å
31	N	82.1	Confident	72.4	Confident	108 Å²	108	94.3 Å²	94.3	58%	0.578	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	99.6	175.3	-74.4	-48.2	0	0	0	107.7	Q29 T75	Q29-N31 PolarHBondContact O-N 2.96Å; N31-T75 WeakPolarHBondContact CB-OG1 3.19Å; N31-T75 PolarHBondContact O-N 3.29Å; N31-T75 PolarHBondContact O-OG1 2.86Å
32	I	88.6	Confident	74.6	Confident	81 Å²	81	91.6 Å²	91.6	42%	0.415	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	122.7	176.5	-57.6	175.7	0	0	0	108.3	P30 L34 K72 I73	P30-I32 PolarHBondContact O-N 2.74Å; I32-L34 HydrophobicContact CG2-CD1 3.94Å; I32-K72 HydrophobicContact CG2-CB 4.44Å; I32-I73 CarbonylContact C-O 3.54Å; I32-I73 WeakPolarHBondContact CA-O 3.48Å
33	L	89.3	Confident	76.8	Confident	87 Å²	87	86.5 Å²	86.5	46%	0.455	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	136.2	170.2	175.6	68.8	0	0	0	109	P35 I73	L33-P35 WeakPolarHBondContact O-CD 3.21Å; L33-I73 HydrophobicContact CB-CB 4.2Å; L33-I73 HydrophobicContact CD2-CD1 4.23Å; L33-I73 PolarHBondContact N-O 3.43Å; L33-I73 PolarHBondContact O-N 3.03Å
34	L	90.4	Very high	79	Confident	100 Å²	100	84.4 Å²	84.4	52%	0.524	47%	0.465	S	S	.	.			trans	-115.7	86.5	175.2	-65.9	90.5	0	0	0	107.7	I32	I32-L34 HydrophobicContact CG2-CD1 3.94Å
35	P	90.2	Very high	81.4	Confident	16 Å²	16	81.2 Å²	81.2	10%	0.104	43%	0.432	C	S	.	.			trans	-70.8	165.6	177.8	32.5	-34.7	0	0	0	110.8	L33 I71 I73	L33-P35 WeakPolarHBondContact O-CD 3.21Å; P35-I71 HydrophobicContact CG-CB 4.37Å; P35-I71 HydrophobicContact CG-CD1 3.79Å; P35-I71 HydrophobicContact CG-CG1 3.82Å; P35-I71 HydrophobicContact CG-CG2 3.7Å; P35-I73 HydrophobicContact CG-CD1 3.77Å; P35-I73 HydrophobicContact CG-CG1 4.22Å
36	E	93.8	Very high	83.8	Confident	97 Å²	97	78.8 Å²	78.8	45%	0.453	41%	0.407	S	S	.	.			trans	-66.6	135.1	170	-64.9	178.1	174.1	0	0	110	D38 S39 V344	E36-D38 PolarHBondContact O-N 2.8Å; E36-S39 WeakPolarHBondContact O-CB 3.14Å; E36-S39 PolarHBondContact O-N 2.79Å; E36-S39 PolarHBondContact O-OG 2.72Å; E36-V344 CarbonylContact C-O 3.59Å; E36-V344 WeakPolarHBondContact CA-O 3.19Å
37	C	95.4	Very high	86.1	Confident	1 Å²	1	75 Å²	75	1%	0.007	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-31.3	179.4	-93.3	0	0	0	0	113.1	S39 A42 I68 V344 C345	C37-S39 VanDerWaalsContact C-N 3.31Å; C37-S39 PolarHBondContact O-N 2.04Å; C37-A42 WeakPolarHBondContact O-CB 3.36Å; C37-I68 HydrophobicContact CB-CB 4.16Å; C37-I68 HydrophobicContact CB-CG2 4.16Å; C37-I68 VanDerWaalsContact O-CD1 3.27Å; C37-I68 WeakPolarHBondContact O-CD1 3.01Å; C37-I68 VanDerWaalsContact SG-CG2 3.55Å; C37-I68 PolarHBondContact SG-O 2.76Å; C37-V344 PolarHBondContact N-O 3.36Å; C37-C345 HydrophobicContact CB-CB 4.05Å; C37-C345 WeakPolarHBondContact CB-SG 3.46Å; C37-C345 WeakPolarHBondContact SG-CB 3.48Å; C37-C345 CovalentContact SG-SG 2.03Å; C37-C345 PolarHBondContact SG-SG 3.02Å
38	D	94.5	Very high	88.5	Confident	82 Å²	82	66.5 Å²	66.5	44%	0.439	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	8.8	178.1	-65.8	-27.7	0	0	0	113.4	E36 G347 R348	E36-D38 PolarHBondContact O-N 2.8Å; D38-G347 WeakPolarHBondContact OD1-CA 3Å; D38-R348 PolarHBondContact OD1-N 2.92Å; D38-R348 PolarHBondContact OD2-N 2.98Å
39	S	95.4	Very high	90.6	Very high	30 Å²	30	62.1 Å²	62.1	21%	0.21	32%	0.324	C	S	.	.	S	Bend	trans	-70	150.9	177.7	68.5	0	0	0	0	111.9	E36 C37 E41 A42 E43	E36-S39 WeakPolarHBondContact O-CB 3.14Å; E36-S39 PolarHBondContact O-N 2.79Å; E36-S39 PolarHBondContact O-OG 2.72Å; C37-S39 VanDerWaalsContact C-N 3.31Å; C37-S39 PolarHBondContact O-N 2.04Å; S39-E41 PolarHBondContact O-N 2.95Å; S39-E41 VanDerWaalsContact O-N 3.16Å; S39-A42 PolarHBondContact O-N 3.37Å; S39-A42 VanDerWaalsContact O-N 3.1Å; S39-A42 WeakPolarHBondContact OG-CB 3.47Å; S39-A42 PolarHBondContact OG-N 3.35Å; S39-E43 WeakPolarHBondContact O-CG 3.18Å; S39-E43 PolarHBondContact O-N 3.03Å
40	L	95.1	Very high	92.7	Very high	152 Å²	152	55.3 Å²	55.3	80%	0.796	29%	0.292	S	S	*	.	H	α-helix	trans	-55.9	-35.1	178	-178	65.8	0	0	0	112.7	E44	L40-E44 WeakPolarHBondContact O-CB 3.38Å; L40-E44 PolarHBondContact O-N 2.83Å
41	E	94.4	Very high	94.3	Very high	63 Å²	63	55.5 Å²	55.5	29%	0.294	29%	0.289	S	S	.	.	H	α-helix	trans	-70.3	-41.2	178.3	177.7	168.1	-147.7	0	0	112.3	S39 A45 Y83	S39-E41 PolarHBondContact O-N 2.95Å; S39-E41 VanDerWaalsContact O-N 3.16Å; E41-A45 PolarHBondContact O-N 3Å; E41-Y83 HydrophobicContact CG-CE1 3.92Å; E41-Y83 PolarHBondContact OE1-OH 2.8Å
42	A	96	Very high	94.8	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-65	-43.8	175.1	0	0	0	0	0	111	C37 S39 A45 A46 I68 I71 M85	C37-A42 WeakPolarHBondContact O-CB 3.36Å; S39-A42 PolarHBondContact O-N 3.37Å; S39-A42 VanDerWaalsContact O-N 3.1Å; S39-A42 WeakPolarHBondContact OG-CB 3.47Å; S39-A42 PolarHBondContact OG-N 3.35Å; A42-A45 PolarHBondContact O-N 2.81Å; A42-A46 WeakPolarHBondContact O-CB 3.35Å; A42-A46 PolarHBondContact O-N 3.3Å; A42-I68 HydrophobicContact CB-CD1 4.18Å; A42-I71 HydrophobicContact CB-CD1 3.65Å; A42-I71 HydrophobicContact CB-CG2 4.32Å; A42-M85 WeakPolarHBondContact O-CE 3.33Å
43	E	96.9	Very high	95	Very high	34 Å²	34	49.3 Å²	49.3	16%	0.159	26%	0.255	C	S	.	.	H	α-helix	trans	-62.6	-43.5	178.3	-74.6	-71	-175.8	0	0	113	S39 A45 A46 L47 I68 R350	S39-E43 WeakPolarHBondContact O-CG 3.18Å; S39-E43 PolarHBondContact O-N 3.03Å; E43-A45 VanDerWaalsContact C-N 3.34Å; E43-A45 PolarHBondContact O-N 3.49Å; E43-A46 PolarHBondContact O-N 3.19Å; E43-L47 WeakPolarHBondContact O-CG 3.18Å; E43-L47 PolarHBondContact O-N 3.35Å; E43-I68 HydrophobicContact CG-CD1 4.4Å; E43-R350 IonicContact OE1-CZ 3.78Å; E43-R350 IonicContact OE1-NH2 2.81Å; E43-R350 PolarHBondContact OE1-NH2 3.22Å; E43-R350 IonicContact OE2-CZ 3.61Å; E43-R350 IonicContact OE2-NH2 3.35Å; E43-R350 PolarHBondContact OE2-NH2 3.01Å
44	E	97	Very high	95.2	Very high	92 Å²	92	46.1 Å²	46.1	43%	0.43	24%	0.238	S	C	.	.	H	α-helix	trans	-59	-46.1	174.4	-174.7	-173.7	-176.9	0	0	111.2	L40 L47 V48 K125 L130	L40-E44 WeakPolarHBondContact O-CB 3.38Å; L40-E44 PolarHBondContact O-N 2.83Å; E44-L47 PolarHBondContact O-N 3.16Å; E44-V48 WeakPolarHBondContact O-CG2 3.45Å; E44-V48 PolarHBondContact O-N 2.91Å; E44-V48 VanDerWaalsContact O-N 3.11Å; E44-K125 IonicContact OE2-NZ 3.99Å; E44-L130 HydrophobicContact CG-CD1 4.09Å
45	A	97.5	Very high	95.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66.5	-39.8	179.2	0	0	0	0	0	112.7	E41 A42 E43 V48 A49 Y83 M85 L123 L130	E41-A45 PolarHBondContact O-N 3Å; A42-A45 PolarHBondContact O-N 2.81Å; E43-A45 VanDerWaalsContact C-N 3.34Å; E43-A45 PolarHBondContact O-N 3.49Å; A45-V48 PolarHBondContact O-N 2.92Å; A45-A49 WeakPolarHBondContact O-CB 3.49Å; A45-A49 PolarHBondContact O-N 2.88Å; A45-Y83 HydrophobicContact CB-CD1 4.25Å; A45-M85 HydrophobicContact CB-CE 4.31Å; A45-M85 HydrophobicContact CB-SD 3.47Å; A45-M85 WeakPolarHBondContact CB-SD 3.44Å; A45-L123 WeakPolarHBondContact O-CD2 3.08Å; A45-L130 HydrophobicContact CB-CD1 4.18Å
46	A	98.1	Very high	95	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.1	-39.5	177.3	0	0	0	0	0	112.4	A42 E43 A49 Q50 L65 I68 M85 I87	A42-A46 WeakPolarHBondContact O-CB 3.35Å; A42-A46 PolarHBondContact O-N 3.3Å; E43-A46 PolarHBondContact O-N 3.19Å; A46-A49 WeakPolarHBondContact O-CB 3.5Å; A46-A49 PolarHBondContact O-N 3.44Å; A46-Q50 WeakPolarHBondContact O-CB 3.08Å; A46-Q50 PolarHBondContact O-N 2.76Å; A46-L65 HydrophobicContact CB-CD1 4.11Å; A46-L65 HydrophobicContact CB-CD2 3.6Å; A46-I68 HydrophobicContact CB-CD1 3.62Å; A46-I68 HydrophobicContact CB-CG1 3.82Å; A46-M85 HydrophobicContact CB-CE 3.86Å; A46-I87 HydrophobicContact CB-CG2 4.22Å
47	L	97.8	Very high	94.4	Very high	73 Å²	73	44.2 Å²	44.2	38%	0.382	24%	0.237	S	C	.	.	H	α-helix	trans	-68.2	-40.1	176	-69.2	175.9	0	0	0	112.1	E43 E44 A49 Q50 D51 L65	E43-L47 WeakPolarHBondContact O-CG 3.18Å; E43-L47 PolarHBondContact O-N 3.35Å; E44-L47 PolarHBondContact O-N 3.16Å; L47-A49 VanDerWaalsContact C-N 3.29Å; L47-A49 PolarHBondContact O-N 2.92Å; L47-Q50 PolarHBondContact O-N 3.47Å; L47-D51 WeakPolarHBondContact O-CB 3.33Å; L47-D51 PolarHBondContact O-N 3Å; L47-L65 HydrophobicContact CD2-CD2 4.44Å
48	V	97.9	Very high	93.9	Very high	48 Å²	48	47.6 Å²	47.6	29%	0.291	26%	0.258	S	S	.	.	H	α-helix	trans	-60.7	-41.4	172.5	171.3	0	0	0	0	111	E44 A45 H52 L123 L130	E44-V48 WeakPolarHBondContact O-CG2 3.45Å; E44-V48 PolarHBondContact O-N 2.91Å; E44-V48 VanDerWaalsContact O-N 3.11Å; A45-V48 PolarHBondContact O-N 2.92Å; V48-H52 WeakPolarHBondContact O-CB 3.31Å; V48-H52 PolarHBondContact O-N 3.4Å; V48-L123 HydrophobicContact CB-CD2 4.18Å; V48-L123 HydrophobicContact CG1-CD2 3.9Å; V48-L130 HydrophobicContact CB-CB 4.48Å; V48-L130 HydrophobicContact CG1-CB 4.06Å; V48-L130 HydrophobicContact CG2-CB 4.28Å; V48-L130 HydrophobicContact CG2-CD1 4.29Å
49	A	96.9	Very high	93.6	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62	-51.4	175.2	0	0	0	0	0	111.9	A45 A46 L47 D51 H52 L53 I87 V121 L123	A45-A49 WeakPolarHBondContact O-CB 3.49Å; A45-A49 PolarHBondContact O-N 2.88Å; A46-A49 WeakPolarHBondContact O-CB 3.5Å; A46-A49 PolarHBondContact O-N 3.44Å; L47-A49 VanDerWaalsContact C-N 3.29Å; L47-A49 PolarHBondContact O-N 2.92Å; A49-D51 VanDerWaalsContact C-N 3.34Å; A49-D51 PolarHBondContact O-N 2.96Å; A49-H52 PolarHBondContact O-N 2.95Å; A49-L53 WeakPolarHBondContact O-CB 3.35Å; A49-L53 WeakPolarHBondContact O-CG 3.44Å; A49-L53 PolarHBondContact O-N 3.38Å; A49-I87 HydrophobicContact CB-CD1 3.81Å; A49-V121 HydrophobicContact CB-CB 4.28Å; A49-V121 HydrophobicContact CB-CG1 3.8Å; A49-V121 HydrophobicContact CB-CG2 4.2Å; A49-L123 HydrophobicContact CB-CD2 4.38Å
50	Q	96.9	Very high	93.4	Very high	14 Å²	14	46.5 Å²	46.5	7%	0.065	25%	0.247	C	C	.	.	H	α-helix	trans	-54	-48.8	177.2	179.4	-158.6	-96.5	0	0	111.7	A46 L47 H52 L53 N54 Y63 L89	A46-Q50 WeakPolarHBondContact O-CB 3.08Å; A46-Q50 PolarHBondContact O-N 2.76Å; L47-Q50 PolarHBondContact O-N 3.47Å; Q50-H52 PolarHBondContact O-N 2.98Å; Q50-L53 PolarHBondContact O-N 3.22Å; Q50-N54 WeakPolarHBondContact O-CB 3.37Å; Q50-N54 PolarHBondContact O-N 2.95Å; Q50-N54 PolarHBondContact O-ND2 2.87Å; Q50-N54 VanDerWaalsContact O-ND2 3.14Å; Q50-Y63 WeakPolarHBondContact CG-O 3.32Å; Q50-L89 HydrophobicContact CG-CD2 4.45Å
51	D	95.6	Very high	93.4	Very high	87 Å²	87	39.3 Å²	39.3	47%	0.465	21%	0.209	S	C	.	.	H	α-helix	trans	-67.1	-39	-177.3	-71.8	-7.2	0	0	0	111.5	L47 A49 A55	L47-D51 WeakPolarHBondContact O-CB 3.33Å; L47-D51 PolarHBondContact O-N 3Å; A49-D51 VanDerWaalsContact C-N 3.34Å; A49-D51 PolarHBondContact O-N 2.96Å; D51-A55 WeakPolarHBondContact O-CB 3.19Å; D51-A55 PolarHBondContact O-N 2.79Å
52	H	94.1	Very high	93.5	Very high	54 Å²	54	37.7 Å²	37.7	25%	0.25	20%	0.201	C	C	.	.	H	α-helix	trans	-63.3	-47.4	174.3	-176.2	88.5	0	0	0	112	V48 A49 Q50 N54 A55 Q56 V132 F135	V48-H52 WeakPolarHBondContact O-CB 3.31Å; V48-H52 PolarHBondContact O-N 3.4Å; A49-H52 PolarHBondContact O-N 2.95Å; Q50-H52 PolarHBondContact O-N 2.98Å; H52-N54 VanDerWaalsContact C-N 3.35Å; H52-N54 PolarHBondContact O-N 3.29Å; H52-A55 PolarHBondContact O-N 3.43Å; H52-A55 VanDerWaalsContact O-N 3.13Å; H52-Q56 WeakPolarHBondContact O-CG 3.24Å; H52-Q56 PolarHBondContact O-N 2.81Å; H52-Q56 VanDerWaalsContact O-N 3.1Å; H52-V132 HydrophobicContact CB-CB 4.22Å; H52-V132 HydrophobicContact CB-CG2 3.59Å; H52-F135 AromaticContact CD2-CE1 3.87Å; H52-F135 AromaticContact NE2-CE1 3.8Å
53	L	92.3	Very high	93.5	Very high	5 Å²	5	37.8 Å²	37.8	3%	0.026	20%	0.202	C	C	.	.	H	α-helix	trans	-58.8	-47	179	-71.7	169.1	0	0	0	111.1	A49 Q50 A55 Q56 H57 I87 L89 C119 V121 F135	A49-L53 WeakPolarHBondContact O-CB 3.35Å; A49-L53 WeakPolarHBondContact O-CG 3.44Å; A49-L53 PolarHBondContact O-N 3.38Å; Q50-L53 PolarHBondContact O-N 3.22Å; L53-A55 VanDerWaalsContact C-N 3.3Å; L53-A55 PolarHBondContact O-N 3.04Å; L53-Q56 PolarHBondContact O-N 2.92Å; L53-H57 PolarHBondContact O-N 3.19Å; L53-I87 HydrophobicContact CD1-CD1 4.16Å; L53-L89 HydrophobicContact CD1-CD1 3.68Å; L53-C119 HydrophobicContact CD1-CB 4.38Å; L53-V121 HydrophobicContact CD1-CG2 4.19Å; L53-F135 HydrophobicContact CD2-CB 3.92Å; L53-F135 HydrophobicContact CD2-CD1 3.92Å; L53-F135 HydrophobicContact CD2-CD2 3.07Å; L53-F135 HydrophobicContact CD2-CE1 4.15Å; L53-F135 HydrophobicContact CD2-CE2 3.31Å; L53-F135 HydrophobicContact CD2-CG 3.38Å; L53-F135 HydrophobicContact CD2-CZ 3.88Å
54	N	93.4	Very high	93.5	Very high	20 Å²	20	36.6 Å²	36.6	11%	0.107	20%	0.198	C	C	.	.	H	α-helix	trans	-62	-36.4	175.6	-78.1	-42.5	0	0	0	112.8	Q50 H52 Q56 H57 K62 Y63	Q50-N54 WeakPolarHBondContact O-CB 3.37Å; Q50-N54 PolarHBondContact O-N 2.95Å; Q50-N54 PolarHBondContact O-ND2 2.87Å; Q50-N54 VanDerWaalsContact O-ND2 3.14Å; H52-N54 VanDerWaalsContact C-N 3.35Å; H52-N54 PolarHBondContact O-N 3.29Å; N54-Q56 VanDerWaalsContact C-N 3.3Å; N54-Q56 PolarHBondContact O-N 2.92Å; N54-H57 PolarHBondContact O-N 3.38Å; N54-K62 WeakPolarHBondContact OD1-CA 3.43Å; N54-Y63 PolarHBondContact ND2-O 3.2Å; N54-Y63 PolarHBondContact OD1-N 3.39Å
55	A	90.5	Very high	93.6	Very high	71 Å²	71	32.3 Å²	32.3	59%	0.587	18%	0.178	S	C	*	.	H	α-helix	trans	-70.8	-23.3	178	0	0	0	0	0	113.5	D51 H52 L53	D51-A55 WeakPolarHBondContact O-CB 3.19Å; D51-A55 PolarHBondContact O-N 2.79Å; H52-A55 PolarHBondContact O-N 3.43Å; H52-A55 VanDerWaalsContact O-N 3.13Å; L53-A55 VanDerWaalsContact C-N 3.3Å; L53-A55 PolarHBondContact O-N 3.04Å
56	Q	85.2	Confident	93.6	Very high	89 Å²	89	32.3 Å²	32.3	42%	0.416	18%	0.178	S	C	.	.	H	α-helix	trans	-84.9	-14.4	174.7	-63.9	-53.1	-60.3	0	0	113.1	H52 L53 N54 F135	H52-Q56 WeakPolarHBondContact O-CG 3.24Å; H52-Q56 PolarHBondContact O-N 2.81Å; H52-Q56 VanDerWaalsContact O-N 3.1Å; L53-Q56 PolarHBondContact O-N 2.92Å; N54-Q56 VanDerWaalsContact C-N 3.3Å; N54-Q56 PolarHBondContact O-N 2.92Å; Q56-F135 HydrophobicContact CB-CZ 4.22Å; Q56-F135 HydrophobicContact CG-CE1 4.23Å; Q56-F135 HydrophobicContact CG-CZ 4.15Å
57	H	81.9	Confident	93.6	Very high	13 Å²	13	35 Å²	35	6%	0.06	19%	0.188	C	C	.	.			trans	-83.9	120.7	-174.5	-158	-151.2	0	0	0	111.1	L53 N54 H59 Y61 V96 K282	L53-H57 PolarHBondContact O-N 3.19Å; N54-H57 PolarHBondContact O-N 3.38Å; H57-H59 PolarHBondContact CE1-O 3.49Å; H57-H59 PolarHBondContact ND1-O 2.74Å; H57-H59 VanDerWaalsContact ND1-O 3.08Å; H57-H59 PolarHBondContact NE2-O 2.8Å; H57-Y61 PolarHBondContact ND1-O 3.2Å; H57-Y61 VanDerWaalsContact ND1-O 3.08Å; H57-V96 HydrophobicContact CB-CG1 3.87Å; H57-V96 WeakPolarHBondContact ND1-CG1 3.3Å; H57-K282 PolarHBondContact NE2-O 2.97Å
58	T	83.8	Confident	93.6	Very high	73 Å²	73	31.6 Å²	31.6	45%	0.448	17%	0.17	S	C	.	.			trans	-103.7	-7.5	-175.5	61.8	0	0	0	0	114.7
59	H	88.1	Confident	93.5	Very high	89 Å²	89	31.7 Å²	31.7	41%	0.412	17%	0.167	S	C	.	.	S	Bend	trans	-136.6	165.6	-177.8	-63.3	-64.7	0	0	0	109.8	H57 V96 E185	H57-H59 PolarHBondContact CE1-O 3.49Å; H57-H59 PolarHBondContact ND1-O 2.74Å; H57-H59 VanDerWaalsContact ND1-O 3.08Å; H57-H59 PolarHBondContact NE2-O 2.8Å; H59-V96 WeakPolarHBondContact O-CG1 3.49Å; H59-E185 WeakPolarHBondContact CB-OE1 3.34Å; H59-E185 IonicContact CE1-OE2 3.81Å; H59-E185 IonicContact CG-OE2 3.51Å; H59-E185 IonicContact ND1-OE2 2.72Å; H59-E185 PolarHBondContact ND1-OE2 2.03Å
60	G	92.1	Very high	93.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	63.2	-142.6	176.7	0	0	0	0	0	114.4	H95 V96 E185	G60-H95 WeakPolarHBondContact O-CA 3.44Å; G60-H95 PolarHBondContact O-CD2 2.96Å; G60-H95 VanDerWaalsContact O-CG 3.3Å; G60-H95 PolarHBondContact O-NE2 3.21Å; G60-V96 PolarHBondContact O-N 2.97Å; G60-E185 PolarHBondContact N-OE1 2.9Å
61	Y	94.9	Very high	93.4	Very high	1 Å²	1	34.4 Å²	34.4	0%	0.004	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	161.5	-166.5	-59.8	-92.7	0	0	0	112.9	H57 Y63 E91 T92 C94 R188 E203 I228	H57-Y61 PolarHBondContact ND1-O 3.2Å; H57-Y61 VanDerWaalsContact ND1-O 3.08Å; Y61-Y63 WeakPolarHBondContact O-CD2 3.5Å; Y61-Y63 WeakPolarHBondContact O-CE2 3.36Å; Y61-E91 HydrophobicContact CD2-CG 4.26Å; Y61-E91 WeakPolarHBondContact CD2-OE2 3.5Å; Y61-E91 HydrophobicContact CG-CG 4.16Å; Y61-T92 VanDerWaalsContact CB-O 3.27Å; Y61-T92 WeakPolarHBondContact CB-O 3.32Å; Y61-T92 WeakPolarHBondContact CD1-O 3.38Å; Y61-C94 CarbonylContact C-O 3.52Å; Y61-C94 VanDerWaalsContact CA-O 3.29Å; Y61-C94 WeakPolarHBondContact CA-O 3.49Å; Y61-C94 WeakPolarHBondContact CB-O 3.12Å; Y61-R188 HydrophobicContact CE2-CB 4.15Å; Y61-R188 WeakPolarHBondContact OH-CB 3.45Å; Y61-E203 VanDerWaalsContact CE1-OE2 3.25Å; Y61-E203 WeakPolarHBondContact CE1-OE2 3.39Å; Y61-E203 VanDerWaalsContact CZ-OE2 3.24Å; Y61-E203 WeakPolarHBondContact OH-CB 3.41Å; Y61-E203 PolarHBondContact OH-OE2 2.86Å; Y61-I228 HydrophobicContact CE1-CD1 4.12Å
62	K	95.8	Very high	93.3	Very high	29 Å²	29	33.3 Å²	33.3	13%	0.126	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	152.5	170.5	-64.5	178.2	177.8	177.8	0	110.1	N54 T92 C94 D98 T100 V102	N54-K62 WeakPolarHBondContact OD1-CA 3.43Å; K62-T92 WeakPolarHBondContact O-CB 3.27Å; K62-T92 WeakPolarHBondContact O-CG2 3.25Å; K62-T92 PolarHBondContact O-N 2.81Å; K62-T92 PolarHBondContact O-OG1 2.7Å; K62-C94 HydrophobicContact CB-CB 4.42Å; K62-C94 HydrophobicContact CD-CB 4.01Å; K62-C94 HydrophobicContact CG-CB 4.4Å; K62-C94 PolarHBondContact N-O 3.06Å; K62-D98 WeakPolarHBondContact CE-O 3.32Å; K62-D98 PolarHBondContact NZ-O 2.95Å; K62-T100 PolarHBondContact NZ-O 3.14Å; K62-V102 HydrophobicContact CB-CG2 4.41Å
63	Y	96.8	Very high	93.3	Very high	1 Å²	1	30.8 Å²	30.8	0%	0.004	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	136.5	-179.5	-78.7	-99.8	0	0	0	110.9	Q50 N54 Y61 L89 L90 E91 V102 I115 L283	Q50-Y63 WeakPolarHBondContact CG-O 3.32Å; N54-Y63 PolarHBondContact ND2-O 3.2Å; N54-Y63 PolarHBondContact OD1-N 3.39Å; Y61-Y63 WeakPolarHBondContact O-CD2 3.5Å; Y61-Y63 WeakPolarHBondContact O-CE2 3.36Å; Y63-L89 HydrophobicContact CD1-CB 3.96Å; Y63-L89 HydrophobicContact CG-CB 4.42Å; Y63-L90 CarbonylContact C-O 3.46Å; Y63-L90 VanDerWaalsContact CA-O 3.28Å; Y63-L90 WeakPolarHBondContact CA-O 3.45Å; Y63-E91 HydrophobicContact CD1-CB 4.4Å; Y63-E91 HydrophobicContact CE1-CB 3.97Å; Y63-V102 VanDerWaalsContact O-CG2 3.31Å; Y63-V102 WeakPolarHBondContact O-CG2 2.95Å; Y63-I115 HydrophobicContact CE1-CG2 4.39Å; Y63-L283 HydrophobicContact CD1-CD1 4.08Å; Y63-L283 HydrophobicContact CD2-CD1 4.3Å; Y63-L283 HydrophobicContact CD2-CD2 3.52Å; Y63-L283 HydrophobicContact CD2-CG 4.01Å; Y63-L283 HydrophobicContact CE1-CD1 4.05Å; Y63-L283 HydrophobicContact CE1-CG 4.29Å; Y63-L283 HydrophobicContact CE2-CD1 4.29Å; Y63-L283 HydrophobicContact CE2-CD2 3.62Å; Y63-L283 HydrophobicContact CE2-CG 3.73Å; Y63-L283 HydrophobicContact CG-CD1 4.2Å; Y63-L283 HydrophobicContact CG-CD2 4.12Å; Y63-L283 HydrophobicContact CG-CG 4.41Å
64	A	97.9	Very high	93.2	Very high	9 Å²	9	32.3 Å²	32.3	7%	0.074	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	143.1	176	0	0	0	0	0	110.7	N66 L89 L90 T92 V102 V107 F351	A64-N66 PolarHBondContact O-N 3.38Å; A64-L89 CarbonylContact O-C 3.57Å; A64-L89 WeakPolarHBondContact O-CA 3.34Å; A64-L90 PolarHBondContact N-O 2.6Å; A64-L90 PolarHBondContact O-N 3.16Å; A64-T92 HydrophobicContact CB-CG2 3.76Å; A64-V102 HydrophobicContact CB-CG2 4.23Å; A64-V107 HydrophobicContact CB-CG2 3.76Å; A64-F351 HydrophobicContact CB-CE2 4.43Å
65	L	98.3	Very high	93	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.016	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	121.1	176.7	-178.8	69.1	0	0	0	110.4	A46 L47 I68 I87 L89 R350 F351	A46-L65 HydrophobicContact CB-CD1 4.11Å; A46-L65 HydrophobicContact CB-CD2 3.6Å; L47-L65 HydrophobicContact CD2-CD2 4.44Å; L65-I68 HydrophobicContact CD1-CG1 4.35Å; L65-I68 HydrophobicContact CD2-CG1 4.42Å; L65-I87 HydrophobicContact CD1-CB 3.88Å; L65-I87 HydrophobicContact CD1-CG2 4.17Å; L65-L89 HydrophobicContact CB-CD2 4.26Å; L65-L89 HydrophobicContact CD1-CD2 4.09Å; L65-R350 WeakPolarHBondContact O-CD 3.27Å; L65-F351 WeakPolarHBondContact O-CE2 3.43Å
66	N	97.7	Very high	92.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-45.8	171.2	-169.6	29	0	0	0	111.3	A64 E88 L90 R350 F351 F352	A64-N66 PolarHBondContact O-N 3.38Å; N66-E88 HydrophobicContact CB-CB 4.41Å; N66-E88 HydrophobicContact CB-CG 4.44Å; N66-E88 PolarHBondContact N-O 3.15Å; N66-E88 VanDerWaalsContact ND2-CD 3.31Å; N66-E88 PolarHBondContact ND2-OE1 2.88Å; N66-E88 PolarHBondContact ND2-OE2 3.1Å; N66-L90 HydrophobicContact CB-CD1 3.68Å; N66-L90 HydrophobicContact CB-CG 3.78Å; N66-L90 VanDerWaalsContact CG-CD1 3.48Å; N66-R350 WeakPolarHBondContact O-CB 3.48Å; N66-R350 WeakPolarHBondContact O-CD 3.27Å; N66-R350 VanDerWaalsContact O-CG 3.25Å; N66-R350 WeakPolarHBondContact O-CG 3.39Å; N66-R350 PolarHBondContact O-N 3.46Å; N66-R350 PolarHBondContact OD1-N 3.34Å; N66-F351 HydrophobicContact CB-CD2 4.34Å; N66-F351 PolarHBondContact OD1-N 2.92Å; N66-F352 PolarHBondContact ND2-O 3.27Å
67	R	97.1	Very high	91.9	Very high	55 Å²	55	35.2 Å²	35.2	21%	0.208	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	151.3	-170.9	-166.3	154.9	-178.3	-135	20	112.1	E69 I87 E88 G347	R67-E69 WeakPolarHBondContact CD-OE1 3.38Å; R67-E69 VanDerWaalsContact CG-OE1 3.25Å; R67-E69 WeakPolarHBondContact CG-OE1 3.43Å; R67-E69 IonicContact CZ-OE1 2.75Å; R67-E69 IonicContact CZ-OE2 3.93Å; R67-E69 IonicContact NE-OE1 3.64Å; R67-E69 PolarHBondContact NE-OE1 3.35Å; R67-E69 IonicContact NH1-OE1 3.28Å; R67-E69 PolarHBondContact NH1-OE1 2.99Å; R67-E69 IonicContact NH1-OE2 3.93Å; R67-E69 PolarHBondContact NH1-OE2 2.88Å; R67-I87 WeakPolarHBondContact O-CA 3.12Å; R67-E88 HydrophobicContact CB-CB 3.98Å; R67-E88 PolarHBondContact N-O 2.57Å; R67-E88 PolarHBondContact O-N 2.7Å; R67-G347 PolarHBondContact NE-O 3.03Å
68	I	98.1	Very high	91.6	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.015	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	114.3	166.6	-56.3	167.8	0	0	0	105.4	C37 A42 E43 A46 L65 M85 I87 G347	C37-I68 HydrophobicContact CB-CB 4.16Å; C37-I68 HydrophobicContact CB-CG2 4.16Å; C37-I68 VanDerWaalsContact O-CD1 3.27Å; C37-I68 WeakPolarHBondContact O-CD1 3.01Å; C37-I68 VanDerWaalsContact SG-CG2 3.55Å; C37-I68 PolarHBondContact SG-O 2.76Å; A42-I68 HydrophobicContact CB-CD1 4.18Å; E43-I68 HydrophobicContact CG-CD1 4.4Å; A46-I68 HydrophobicContact CB-CD1 3.62Å; A46-I68 HydrophobicContact CB-CG1 3.82Å; L65-I68 HydrophobicContact CD1-CG1 4.35Å; L65-I68 HydrophobicContact CD2-CG1 4.42Å; I68-M85 HydrophobicContact CD1-CE 4.4Å; I68-M85 HydrophobicContact CG2-CE 3.82Å; I68-I87 HydrophobicContact CG1-CG2 4.36Å; I68-I87 HydrophobicContact CG2-CG2 4.49Å; I68-G347 PolarHBondContact O-N 3.33Å
69	E	96.4	Very high	91.1	Very high	49 Å²	49	38.6 Å²	38.6	23%	0.229	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-36.6	-177	-69.8	-61	143.2	0	0	111.3	R67 E86 C345 P346	R67-E69 WeakPolarHBondContact CD-OE1 3.38Å; R67-E69 VanDerWaalsContact CG-OE1 3.25Å; R67-E69 WeakPolarHBondContact CG-OE1 3.43Å; R67-E69 IonicContact CZ-OE1 2.75Å; R67-E69 IonicContact CZ-OE2 3.93Å; R67-E69 IonicContact NE-OE1 3.64Å; R67-E69 PolarHBondContact NE-OE1 3.35Å; R67-E69 IonicContact NH1-OE1 3.28Å; R67-E69 PolarHBondContact NH1-OE1 2.99Å; R67-E69 IonicContact NH1-OE2 3.93Å; R67-E69 PolarHBondContact NH1-OE2 2.88Å; E69-E86 HydrophobicContact CB-CB 4.08Å; E69-E86 HydrophobicContact CB-CG 3.95Å; E69-E86 PolarHBondContact N-O 3.31Å; E69-C345 VanDerWaalsContact O-CB 3.28Å; E69-C345 WeakPolarHBondContact O-CB 3.33Å; E69-P346 WeakPolarHBondContact OE2-CB 3.43Å
70	E	95.8	Very high	91	Very high	68 Å²	68	36.1 Å²	36.1	32%	0.318	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	149.3	177.8	-165.6	176	-143	0	0	111.6	K72 M85 E86	E70-K72 VanDerWaalsContact CD-CE 3.48Å; E70-K72 WeakPolarHBondContact OE1-CE 3.19Å; E70-K72 IonicContact OE1-NZ 2.67Å; E70-K72 PolarHBondContact OE1-NZ 2.83Å; E70-K72 IonicContact OE2-NZ 2.68Å; E70-K72 PolarHBondContact OE2-NZ 2.86Å; E70-M85 VanDerWaalsContact O-CA 3.26Å; E70-M85 WeakPolarHBondContact O-CA 3.45Å; E70-E86 HydrophobicContact CB-CB 3.99Å; E70-E86 PolarHBondContact N-O 2.84Å; E70-E86 PolarHBondContact O-N 3.33Å
71	I	95.3	Very high	91	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.015	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	130	167.4	177.6	166.8	0	0	0	111.2	P35 A42 I73 Y83 V84 M85	P35-I71 HydrophobicContact CG-CB 4.37Å; P35-I71 HydrophobicContact CG-CD1 3.79Å; P35-I71 HydrophobicContact CG-CG1 3.82Å; P35-I71 HydrophobicContact CG-CG2 3.7Å; A42-I71 HydrophobicContact CB-CD1 3.65Å; A42-I71 HydrophobicContact CB-CG2 4.32Å; I71-I73 HydrophobicContact CD1-CD1 4.49Å; I71-I73 HydrophobicContact CD1-CG1 4.44Å; I71-I73 HydrophobicContact CG1-CG1 4.29Å; I71-Y83 HydrophobicContact CD1-CD1 4.18Å; I71-V84 CarbonylContact C-O 3.54Å; I71-V84 WeakPolarHBondContact CA-O 3.33Å; I71-M85 HydrophobicContact CB-CE 4.46Å; I71-M85 HydrophobicContact CB-CG 4.1Å; I71-M85 HydrophobicContact CD1-CE 4.03Å; I71-M85 HydrophobicContact CD1-CG 4.11Å; I71-M85 HydrophobicContact CD1-SD 3.95Å; I71-M85 HydrophobicContact CG1-CG 3.86Å; I71-M85 HydrophobicContact CG1-SD 4.38Å
72	K	94.4	Very high	90.9	Very high	65 Å²	65	38.9 Å²	38.9	28%	0.283	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	130.5	173.4	-67.2	167.6	179.5	137.5	0	109.5	I32 E70 Y83 V84	I32-K72 HydrophobicContact CG2-CB 4.44Å; E70-K72 VanDerWaalsContact CD-CE 3.48Å; E70-K72 WeakPolarHBondContact OE1-CE 3.19Å; E70-K72 IonicContact OE1-NZ 2.67Å; E70-K72 PolarHBondContact OE1-NZ 2.83Å; E70-K72 IonicContact OE2-NZ 2.68Å; E70-K72 PolarHBondContact OE2-NZ 2.86Å; K72-Y83 CarbonylContact O-C 3.53Å; K72-Y83 WeakPolarHBondContact O-CA 3.35Å; K72-V84 HydrophobicContact CB-CB 4.38Å; K72-V84 PolarHBondContact N-O 3Å; K72-V84 PolarHBondContact O-N 2.02Å
73	I	93.4	Very high	90.9	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	111.1	177.8	-53.5	175.7	0	0	0	109.1	I32 L33 P35 I71 T75 N81 T82 Y83	I32-I73 CarbonylContact C-O 3.54Å; I32-I73 WeakPolarHBondContact CA-O 3.48Å; L33-I73 HydrophobicContact CB-CB 4.2Å; L33-I73 HydrophobicContact CD2-CD1 4.23Å; L33-I73 PolarHBondContact N-O 3.43Å; L33-I73 PolarHBondContact O-N 3.03Å; P35-I73 HydrophobicContact CG-CD1 3.77Å; P35-I73 HydrophobicContact CG-CG1 4.22Å; I71-I73 HydrophobicContact CD1-CD1 4.49Å; I71-I73 HydrophobicContact CD1-CG1 4.44Å; I71-I73 HydrophobicContact CG1-CG1 4.29Å; I73-T75 HydrophobicContact CG2-CG2 3.98Å; I73-T75 PolarHBondContact O-N 2.78Å; I73-N81 HydrophobicContact CG2-CB 3.87Å; I73-T82 CarbonylContact C-O 3.53Å; I73-T82 WeakPolarHBondContact CA-O 3.42Å; I73-Y83 HydrophobicContact CD1-CD1 3.79Å; I73-Y83 HydrophobicContact CD1-CE1 3.34Å; I73-Y83 HydrophobicContact CG1-CD1 3.62Å; I73-Y83 HydrophobicContact CG1-CE1 3.69Å; I73-Y83 HydrophobicContact CG1-CG 4.27Å; I73-Y83 HydrophobicContact CG2-CE1 4.34Å; I73-Y83 HydrophobicContact CG2-CE2 4.35Å
74	H	91.2	Very high	90.9	Very high	36 Å²	36	38.3 Å²	38.3	17%	0.167	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	108.5	168.8	-60.4	-89.9	0	0	0	109	N81 T82 Y294	H74-N81 WeakPolarHBondContact O-CA 2.91Å; H74-T82 PolarHBondContact N-O 2.85Å; H74-T82 PolarHBondContact O-N 2.59Å; H74-Y294 AromaticContact NE2-CE1 3.91Å
75	T	88.1	Confident	90.8	Very high	43 Å²	43	38 Å²	38	26%	0.264	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	133.4	179	61.7	0	0	0	0	110.7	N31 I73 N81	N31-T75 WeakPolarHBondContact CB-OG1 3.19Å; N31-T75 PolarHBondContact O-N 3.29Å; N31-T75 PolarHBondContact O-OG1 2.86Å; I73-T75 HydrophobicContact CG2-CG2 3.98Å; I73-T75 PolarHBondContact O-N 2.78Å; T75-N81 WeakPolarHBondContact CA-OD1 2.96Å; T75-N81 WeakPolarHBondContact CG2-OD1 3.39Å
76	V	80.9	Confident	90.7	Very high	69 Å²	69	40.6 Å²	40.6	42%	0.418	23%	0.228	S	C	.	.			trans	-107.3	142.7	174	-173.8	0	0	0	0	108.4	D78 G79 N80	V76-D78 WeakPolarHBondContact CB-OD1 3.47Å; V76-D78 WeakPolarHBondContact CG1-OD1 3.19Å; V76-D78 PolarHBondContact O-N 2.9Å; V76-G79 PolarHBondContact O-N 3.03Å; V76-N80 VanDerWaalsContact CB-O 3.28Å; V76-N80 WeakPolarHBondContact CB-O 3.31Å; V76-N80 PolarHBondContact N-O 2.81Å
77	P	73.1	Confident	90.7	Very high	130 Å²	130	40.6 Å²	40.6	84%	0.844	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-15.6	-176.5	-27.1	35.4	0	0	0	115.9	G79	P77-G79 PolarHBondContact O-N 2.85Å
78	D	74.9	Confident	90.7	Very high	103 Å²	103	39.3 Å²	39.3	55%	0.551	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-1.5	175.3	65.6	-6.6	0	0	0	113.2	V76 N80	V76-D78 WeakPolarHBondContact CB-OD1 3.47Å; V76-D78 WeakPolarHBondContact CG1-OD1 3.19Å; V76-D78 PolarHBondContact O-N 2.9Å; D78-N80 VanDerWaalsContact C-N 3.33Å; D78-N80 VanDerWaalsContact OD1-CB 3.31Å; D78-N80 WeakPolarHBondContact OD1-CB 3.48Å; D78-N80 PolarHBondContact OD1-N 2.69Å; D78-N80 PolarHBondContact OD2-ND2 2.81Å
79	G	72.4	Confident	90.6	Very high	54 Å²	54	39.2 Å²	39.2	56%	0.557	22%	0.224	S	C	*	.	S	Bend	trans	85.4	2.3	-178.1	0	0	0	0	0	114.1	V76 P77	V76-G79 PolarHBondContact O-N 3.03Å; P77-G79 PolarHBondContact O-N 2.85Å
80	N	86.5	Confident	90.7	Very high	37 Å²	37	37 Å²	37	20%	0.198	21%	0.214	C	C	.	.			trans	-82	129.5	171.5	-65.6	-37.3	0	0	0	109.7	V76 D78	V76-N80 VanDerWaalsContact CB-O 3.28Å; V76-N80 WeakPolarHBondContact CB-O 3.31Å; V76-N80 PolarHBondContact N-O 2.81Å; D78-N80 VanDerWaalsContact C-N 3.33Å; D78-N80 VanDerWaalsContact OD1-CB 3.31Å; D78-N80 WeakPolarHBondContact OD1-CB 3.48Å; D78-N80 PolarHBondContact OD1-N 2.69Å; D78-N80 PolarHBondContact OD2-ND2 2.81Å
81	N	91.6	Very high	90.7	Very high	33 Å²	33	34 Å²	34	18%	0.176	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	139.3	-178.8	-66.2	-18.9	0	0	0	110.2	I73 H74 T75 Y83 K124 K125	I73-N81 HydrophobicContact CG2-CB 3.87Å; H74-N81 WeakPolarHBondContact O-CA 2.91Å; T75-N81 WeakPolarHBondContact CA-OD1 2.96Å; T75-N81 WeakPolarHBondContact CG2-OD1 3.39Å; N81-Y83 HydrophobicContact CB-CD2 4.41Å; N81-Y83 HydrophobicContact CB-CE2 3.63Å; N81-K124 CarbonylContact O-C 3.58Å; N81-K124 WeakPolarHBondContact O-CA 3.39Å; N81-K125 HydrophobicContact CB-CB 4.43Å; N81-K125 PolarHBondContact N-O 2.75Å; N81-K125 PolarHBondContact O-N 2.99Å
82	T	93.6	Very high	90.8	Very high	26 Å²	26	33.9 Å²	33.9	16%	0.16	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	124.3	171.3	-58.1	0	0	0	0	108.9	I73 H74 V122 L123	I73-T82 CarbonylContact C-O 3.53Å; I73-T82 WeakPolarHBondContact CA-O 3.42Å; H74-T82 PolarHBondContact N-O 2.85Å; H74-T82 PolarHBondContact O-N 2.59Å; T82-V122 HydrophobicContact CG2-CG1 3.77Å; T82-L123 CarbonylContact C-O 3.57Å; T82-L123 WeakPolarHBondContact CA-O 3.29Å
83	Y	95.6	Very high	90.8	Very high	1 Å²	1	34 Å²	34	0%	0.004	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	129.2	179.4	-61	-113.9	0	0	0	107.3	E41 A45 I71 K72 I73 N81 V122 L123 K125 L130	E41-Y83 HydrophobicContact CG-CE1 3.92Å; E41-Y83 PolarHBondContact OE1-OH 2.8Å; A45-Y83 HydrophobicContact CB-CD1 4.25Å; I71-Y83 HydrophobicContact CD1-CD1 4.18Å; K72-Y83 CarbonylContact O-C 3.53Å; K72-Y83 WeakPolarHBondContact O-CA 3.35Å; I73-Y83 HydrophobicContact CD1-CD1 3.79Å; I73-Y83 HydrophobicContact CD1-CE1 3.34Å; I73-Y83 HydrophobicContact CG1-CD1 3.62Å; I73-Y83 HydrophobicContact CG1-CE1 3.69Å; I73-Y83 HydrophobicContact CG1-CG 4.27Å; I73-Y83 HydrophobicContact CG2-CE1 4.34Å; I73-Y83 HydrophobicContact CG2-CE2 4.35Å; N81-Y83 HydrophobicContact CB-CD2 4.41Å; N81-Y83 HydrophobicContact CB-CE2 3.63Å; Y83-V122 CarbonylContact O-C 3.54Å; Y83-V122 VanDerWaalsContact O-CA 3.28Å; Y83-V122 WeakPolarHBondContact O-CA 3.4Å; Y83-L123 PolarHBondContact N-O 2.93Å; Y83-L123 PolarHBondContact O-N 3.01Å; Y83-K125 HydrophobicContact CD2-CB 4.38Å; Y83-K125 HydrophobicContact CE2-CB 3.56Å; Y83-K125 HydrophobicContact CE2-CD 4.12Å; Y83-K125 VanDerWaalsContact OH-CD 3.3Å; Y83-K125 WeakPolarHBondContact OH-CD 3.42Å; Y83-L130 HydrophobicContact CD2-CD2 3.95Å; Y83-L130 HydrophobicContact CE2-CD2 3.92Å; Y83-L130 HydrophobicContact CG-CD2 4.47Å
84	V	95.7	Very high	91	Very high	17 Å²	17	34.2 Å²	34.2	10%	0.103	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	116.3	171.9	-177.7	0	0	0	0	105.5	I71 K72 Y294	I71-V84 CarbonylContact C-O 3.54Å; I71-V84 WeakPolarHBondContact CA-O 3.33Å; K72-V84 HydrophobicContact CB-CB 4.38Å; K72-V84 PolarHBondContact N-O 3Å; K72-V84 PolarHBondContact O-N 2.02Å; V84-Y294 HydrophobicContact CG2-CD1 3.77Å; V84-Y294 HydrophobicContact CG2-CE1 4.48Å; V84-Y294 HydrophobicContact CG2-CG 4.28Å
85	M	95.9	Very high	91.1	Very high	3 Å²	3	32.5 Å²	32.5	2%	0.015	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	144.5	-172.1	-62.4	-178.1	66	0	0	110.7	A42 A45 A46 I68 E70 I71 I87 D120 V121 L123	A42-M85 WeakPolarHBondContact O-CE 3.33Å; A45-M85 HydrophobicContact CB-CE 4.31Å; A45-M85 HydrophobicContact CB-SD 3.47Å; A45-M85 WeakPolarHBondContact CB-SD 3.44Å; A46-M85 HydrophobicContact CB-CE 3.86Å; I68-M85 HydrophobicContact CD1-CE 4.4Å; I68-M85 HydrophobicContact CG2-CE 3.82Å; E70-M85 VanDerWaalsContact O-CA 3.26Å; E70-M85 WeakPolarHBondContact O-CA 3.45Å; I71-M85 HydrophobicContact CB-CE 4.46Å; I71-M85 HydrophobicContact CB-CG 4.1Å; I71-M85 HydrophobicContact CD1-CE 4.03Å; I71-M85 HydrophobicContact CD1-CG 4.11Å; I71-M85 HydrophobicContact CD1-SD 3.95Å; I71-M85 HydrophobicContact CG1-CG 3.86Å; I71-M85 HydrophobicContact CG1-SD 4.38Å; M85-I87 HydrophobicContact CB-CG2 4.36Å; M85-I87 HydrophobicContact CE-CG2 4.16Å; M85-D120 CarbonylContact O-C 3.51Å; M85-D120 WeakPolarHBondContact O-CA 3.25Å; M85-V121 PolarHBondContact N-O 2.9Å; M85-V121 PolarHBondContact O-N 2.96Å; M85-L123 HydrophobicContact CG-CD1 4.4Å; M85-L123 HydrophobicContact SD-CD1 3.95Å
86	E	97	Very high	91.4	Very high	56 Å²	56	31.5 Å²	31.5	26%	0.262	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	120.3	166.2	-170.6	177.9	172.8	0	0	106.7	E69 E70 C119	E69-E86 HydrophobicContact CB-CB 4.08Å; E69-E86 HydrophobicContact CB-CG 3.95Å; E69-E86 PolarHBondContact N-O 3.31Å; E70-E86 HydrophobicContact CB-CB 3.99Å; E70-E86 PolarHBondContact N-O 2.84Å; E70-E86 PolarHBondContact O-N 3.33Å; E86-C119 WeakPolarHBondContact CA-O 3.46Å
87	I	97.4	Very high	91.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138	-179	64.8	178.9	0	0	0	110.2	A46 A49 L53 L65 R67 I68 M85 L89 C119 V121	A46-I87 HydrophobicContact CB-CG2 4.22Å; A49-I87 HydrophobicContact CB-CD1 3.81Å; L53-I87 HydrophobicContact CD1-CD1 4.16Å; L65-I87 HydrophobicContact CD1-CB 3.88Å; L65-I87 HydrophobicContact CD1-CG2 4.17Å; R67-I87 WeakPolarHBondContact O-CA 3.12Å; I68-I87 HydrophobicContact CG1-CG2 4.36Å; I68-I87 HydrophobicContact CG2-CG2 4.49Å; M85-I87 HydrophobicContact CB-CG2 4.36Å; M85-I87 HydrophobicContact CE-CG2 4.16Å; I87-L89 HydrophobicContact CD1-CD1 4.49Å; I87-L89 HydrophobicContact CD1-CD2 3.94Å; I87-L89 HydrophobicContact CD1-CG 4.33Å; I87-L89 HydrophobicContact CG1-CD2 4.24Å; I87-L89 HydrophobicContact CG1-CG 4.31Å; I87-C119 HydrophobicContact CG1-CB 3.89Å; I87-C119 PolarHBondContact N-O 3.03Å; I87-C119 PolarHBondContact O-N 3.02Å; I87-V121 HydrophobicContact CD1-CG2 4.02Å; I87-V121 HydrophobicContact CG1-CG2 4.2Å
88	E	97.5	Very high	92.8	Very high	29 Å²	29	25 Å²	25	14%	0.136	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	128.2	171.8	-162.6	-159.3	144.9	0	0	109	N66 R67 G117	N66-E88 HydrophobicContact CB-CB 4.41Å; N66-E88 HydrophobicContact CB-CG 4.44Å; N66-E88 PolarHBondContact N-O 3.15Å; N66-E88 VanDerWaalsContact ND2-CD 3.31Å; N66-E88 PolarHBondContact ND2-OE1 2.88Å; N66-E88 PolarHBondContact ND2-OE2 3.1Å; R67-E88 HydrophobicContact CB-CB 3.98Å; R67-E88 PolarHBondContact N-O 2.57Å; R67-E88 PolarHBondContact O-N 2.7Å; E88-G117 CarbonylContact C-O 3.47Å; E88-G117 WeakPolarHBondContact CA-O 3.42Å
89	L	96.9	Very high	93.6	Very high	1 Å²	1	24 Å²	24	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	149.8	-179.3	-59.7	-176.1	0	0	0	110.8	Q50 L53 Y63 A64 L65 I87 E116 G117 L283	Q50-L89 HydrophobicContact CG-CD2 4.45Å; L53-L89 HydrophobicContact CD1-CD1 3.68Å; Y63-L89 HydrophobicContact CD1-CB 3.96Å; Y63-L89 HydrophobicContact CG-CB 4.42Å; A64-L89 CarbonylContact O-C 3.57Å; A64-L89 WeakPolarHBondContact O-CA 3.34Å; L65-L89 HydrophobicContact CB-CD2 4.26Å; L65-L89 HydrophobicContact CD1-CD2 4.09Å; I87-L89 HydrophobicContact CD1-CD1 4.49Å; I87-L89 HydrophobicContact CD1-CD2 3.94Å; I87-L89 HydrophobicContact CD1-CG 4.33Å; I87-L89 HydrophobicContact CG1-CD2 4.24Å; I87-L89 HydrophobicContact CG1-CG 4.31Å; L89-E116 CarbonylContact O-C 3.55Å; L89-E116 WeakPolarHBondContact O-CA 3.19Å; L89-G117 PolarHBondContact N-O 3.23Å; L89-G117 PolarHBondContact O-N 2.9Å; L89-L283 HydrophobicContact CD1-CD1 4.25Å
90	L	97	Very high	94.5	Very high	1 Å²	1	23 Å²	23	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	135.2	176.3	-66.3	172.3	0	0	0	111.6	Y63 A64 N66 V107 E116 F351 F352	Y63-L90 CarbonylContact C-O 3.46Å; Y63-L90 VanDerWaalsContact CA-O 3.28Å; Y63-L90 WeakPolarHBondContact CA-O 3.45Å; A64-L90 PolarHBondContact N-O 2.6Å; A64-L90 PolarHBondContact O-N 3.16Å; N66-L90 HydrophobicContact CB-CD1 3.68Å; N66-L90 HydrophobicContact CB-CG 3.78Å; N66-L90 VanDerWaalsContact CG-CD1 3.48Å; L90-V107 HydrophobicContact CB-CG1 3.65Å; L90-V107 HydrophobicContact CB-CG2 4.27Å; L90-V107 HydrophobicContact CD1-CG1 3.69Å; L90-V107 HydrophobicContact CG-CG1 4.29Å; L90-E116 HydrophobicContact CD2-CB 4.03Å; L90-E116 HydrophobicContact CD2-CG 3.51Å; L90-F351 HydrophobicContact CD1-CB 3.58Å; L90-F351 HydrophobicContact CD1-CD2 3.81Å; L90-F351 HydrophobicContact CD1-CG 3.93Å; L90-F352 HydrophobicContact CD1-CD2 4.37Å; L90-F352 HydrophobicContact CD1-CE1 4.03Å; L90-F352 HydrophobicContact CD1-CE2 3.86Å; L90-F352 HydrophobicContact CD1-CZ 3.67Å; L90-F352 HydrophobicContact CD2-CE2 3.66Å; L90-F352 HydrophobicContact CD2-CZ 3.79Å; L90-F352 HydrophobicContact CG-CE2 4.44Å; L90-F352 HydrophobicContact CG-CZ 4.33Å
91	E	95.9	Very high	94.9	Very high	7 Å²	7	25.1 Å²	25.1	3%	0.033	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	134.2	174.7	-172	-167.3	78	0	0	111.5	Y61 Y63 R108 I115 R188	Y61-E91 HydrophobicContact CD2-CG 4.26Å; Y61-E91 WeakPolarHBondContact CD2-OE2 3.5Å; Y61-E91 HydrophobicContact CG-CG 4.16Å; Y63-E91 HydrophobicContact CD1-CB 4.4Å; Y63-E91 HydrophobicContact CE1-CB 3.97Å; E91-R108 PolarHBondContact O-N 2.67Å; E91-R108 WeakPolarHBondContact OE1-CD 3.27Å; E91-R108 IonicContact OE1-CZ 3.16Å; E91-R108 IonicContact OE1-NE 3.25Å; E91-R108 IonicContact OE1-NH1 3.9Å; E91-R108 PolarHBondContact OE1-NH1 2.87Å; E91-I115 HydrophobicContact CB-CB 3.76Å; E91-I115 HydrophobicContact CB-CG1 4.38Å; E91-I115 HydrophobicContact CG-CB 4.46Å; E91-I115 PolarHBondContact N-O 2.68Å; E91-R188 IonicContact OE1-CZ 2.86Å; E91-R188 IonicContact OE1-NH1 2.86Å; E91-R188 PolarHBondContact OE1-NH1 2.82Å
92	T	97.1	Very high	95.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	166.9	178.1	71.4	0	0	0	0	112.3	Y61 K62 A64 C94 C105 T106 V107 R108	Y61-T92 VanDerWaalsContact CB-O 3.27Å; Y61-T92 WeakPolarHBondContact CB-O 3.32Å; Y61-T92 WeakPolarHBondContact CD1-O 3.38Å; K62-T92 WeakPolarHBondContact O-CB 3.27Å; K62-T92 WeakPolarHBondContact O-CG2 3.25Å; K62-T92 PolarHBondContact O-N 2.81Å; K62-T92 PolarHBondContact O-OG1 2.7Å; A64-T92 HydrophobicContact CB-CG2 3.76Å; T92-C94 PolarHBondContact O-N 3.43Å; T92-C94 PolarHBondContact OG1-N 3.2Å; T92-C105 HydrophobicContact CG2-CB 4.02Å; T92-T106 CarbonylContact C-O 3.57Å; T92-T106 WeakPolarHBondContact CA-O 3.23Å; T92-T106 WeakPolarHBondContact CB-O 3.37Å; T92-V107 HydrophobicContact CG2-CG2 4.14Å; T92-R108 PolarHBondContact O-NH1 3.03Å
93	D	95.7	Very high	95.2	Very high	67 Å²	67	27.6 Å²	27.6	36%	0.358	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	-8.7	174.8	64.3	0.2	0	0	0	115.2	T106	D93-T106 PolarHBondContact N-O 2.7Å; D93-T106 PolarHBondContact OD1-N 3.39Å; D93-T106 WeakPolarHBondContact OD2-CB 3.25Å; D93-T106 PolarHBondContact OD2-OG1 3.15Å
94	C	96.1	Very high	95.2	Very high	5 Å²	5	33.2 Å²	33.2	3%	0.034	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	119.4	177.9	-71.3	0	0	0	0	112	Y61 K62 T92 D98 C105	Y61-C94 CarbonylContact C-O 3.52Å; Y61-C94 VanDerWaalsContact CA-O 3.29Å; Y61-C94 WeakPolarHBondContact CA-O 3.49Å; Y61-C94 WeakPolarHBondContact CB-O 3.12Å; K62-C94 HydrophobicContact CB-CB 4.42Å; K62-C94 HydrophobicContact CD-CB 4.01Å; K62-C94 HydrophobicContact CG-CB 4.4Å; K62-C94 PolarHBondContact N-O 3.06Å; T92-C94 PolarHBondContact O-N 3.43Å; T92-C94 PolarHBondContact OG1-N 3.2Å; C94-D98 HydrophobicContact CB-CB 4.39Å; C94-C105 HydrophobicContact CB-CB 3.69Å; C94-C105 WeakPolarHBondContact CB-SG 3.44Å; C94-C105 WeakPolarHBondContact SG-CB 3.35Å; C94-C105 CovalentContact SG-SG 2.02Å; C94-C105 PolarHBondContact SG-SG 3.13Å
95	H	95.2	Very high	95.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	152.1	166.6	-170.7	-93.7	0	0	0	110.6	G60 L97 D98 E185 V205 I228 F244	G60-H95 WeakPolarHBondContact O-CA 3.44Å; G60-H95 PolarHBondContact O-CD2 2.96Å; G60-H95 VanDerWaalsContact O-CG 3.3Å; G60-H95 PolarHBondContact O-NE2 3.21Å; H95-L97 WeakPolarHBondContact ND1-CB 3.37Å; H95-L97 PolarHBondContact ND1-N 2.95Å; H95-L97 VanDerWaalsContact ND1-N 3.15Å; H95-L97 PolarHBondContact O-N 3.36Å; H95-L97 VanDerWaalsContact O-N 3.1Å; H95-D98 VanDerWaalsContact O-CB 3.22Å; H95-D98 WeakPolarHBondContact O-CB 3.49Å; H95-D98 PolarHBondContact O-N 3.12Å; H95-E185 IonicContact NE2-OE1 3.96Å; H95-E185 IonicContact NE2-OE2 3.83Å; H95-V205 VanDerWaalsContact CD2-CG2 3.49Å; H95-V205 WeakPolarHBondContact CD2-CG2 3.5Å; H95-V205 WeakPolarHBondContact NE2-CG2 3.45Å; H95-I228 HydrophobicContact CB-CD1 4.11Å; H95-F244 HydrophobicContact CB-CZ 4.45Å
96	V	92.7	Very high	95.4	Very high	23 Å²	23	37.2 Å²	37.2	14%	0.139	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-27.3	179.9	-65.6	0	0	0	0	113.6	H57 H59 G60	H57-V96 HydrophobicContact CB-CG1 3.87Å; H57-V96 WeakPolarHBondContact ND1-CG1 3.3Å; H59-V96 WeakPolarHBondContact O-CG1 3.49Å; G60-V96 PolarHBondContact O-N 2.97Å
97	L	90.9	Very high	95.4	Very high	54 Å²	54	35.2 Å²	35.2	28%	0.283	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-10.9	175.3	-60.7	176.6	0	0	0	114.1	H95 L184 V205 F244	H95-L97 WeakPolarHBondContact ND1-CB 3.37Å; H95-L97 PolarHBondContact ND1-N 2.95Å; H95-L97 VanDerWaalsContact ND1-N 3.15Å; H95-L97 PolarHBondContact O-N 3.36Å; H95-L97 VanDerWaalsContact O-N 3.1Å; L97-L184 HydrophobicContact CD1-CD2 3.87Å; L97-V205 HydrophobicContact CD1-CG1 4.14Å; L97-F244 HydrophobicContact CB-CD2 4Å; L97-F244 HydrophobicContact CB-CE2 3.56Å; L97-F244 HydrophobicContact CB-CZ 4.3Å
98	D	92.7	Very high	95.3	Very high	7 Å²	7	35.8 Å²	35.8	4%	0.037	22%	0.219	C	C	.	.			trans	-71.3	125	175.4	-168.3	-41.4	0	0	0	109.1	K62 C94 H95 T100 K242 F244	K62-D98 WeakPolarHBondContact CE-O 3.32Å; K62-D98 PolarHBondContact NZ-O 2.95Å; C94-D98 HydrophobicContact CB-CB 4.39Å; H95-D98 VanDerWaalsContact O-CB 3.22Å; H95-D98 WeakPolarHBondContact O-CB 3.49Å; H95-D98 PolarHBondContact O-N 3.12Å; D98-T100 PolarHBondContact O-N 2.67Å; D98-T100 VanDerWaalsContact O-N 3.15Å; D98-T100 WeakPolarHBondContact OD1-CB 3.42Å; D98-T100 PolarHBondContact OD1-N 3.19Å; D98-T100 PolarHBondContact OD1-OG1 3.4Å; D98-K242 IonicContact OD1-NZ 3.19Å; D98-K242 PolarHBondContact OD1-NZ 2.8Å; D98-K242 WeakPolarHBondContact OD2-CE 3.39Å; D98-K242 IonicContact OD2-NZ 3.94Å; D98-K242 PolarHBondContact OD2-NZ 2.81Å; D98-F244 HydrophobicContact CB-CD1 4.24Å; D98-F244 HydrophobicContact CB-CE1 3.62Å; D98-F244 HydrophobicContact CB-CZ 4.13Å
99	P	91.3	Very high	95	Very high	82 Å²	82	36.5 Å²	36.5	53%	0.532	23%	0.225	S	C	.	.			trans	-69.3	-9.6	-179.1	29.1	-36.6	0	0	0	113.9	P101	P99-P101 WeakPolarHBondContact O-CD 3.46Å
100	T	92.9	Very high	94.8	Very high	33 Å²	33	39.1 Å²	39.1	20%	0.202	24%	0.237	C	C	.	.	S	Bend	trans	-56.6	124	179.5	-54.2	0	0	0	0	110.4	K62 D98 N104 K242	K62-T100 PolarHBondContact NZ-O 3.14Å; D98-T100 PolarHBondContact O-N 2.67Å; D98-T100 VanDerWaalsContact O-N 3.15Å; D98-T100 WeakPolarHBondContact OD1-CB 3.42Å; D98-T100 PolarHBondContact OD1-N 3.19Å; D98-T100 PolarHBondContact OD1-OG1 3.4Å; T100-N104 HydrophobicContact CG2-CB 3.8Å; T100-K242 PolarHBondContact OG1-NZ 2.83Å
101	P	94.6	Very high	94.3	Very high	82 Å²	82	42.9 Å²	42.9	53%	0.532	25%	0.254	S	S	.	.			trans	-58	143.3	175.2	-24.8	34.4	0	0	0	111.2	P99 A103 N104 C105	P99-P101 WeakPolarHBondContact O-CD 3.46Å; P101-A103 PolarHBondContact O-N 3.37Å; P101-A103 VanDerWaalsContact O-N 3.13Å; P101-N104 PolarHBondContact O-N 3.09Å; P101-C105 PolarHBondContact O-SG 3.21Å; P101-C105 VanDerWaalsContact O-SG 3.39Å
102	V	96.2	Very high	94	Very high	19 Å²	19	46.2 Å²	46.2	12%	0.115	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-55.7	-34	-176	63.8	0	0	0	0	113.4	K62 Y63 A64 N104 C105	K62-V102 HydrophobicContact CB-CG2 4.41Å; Y63-V102 VanDerWaalsContact O-CG2 3.31Å; Y63-V102 WeakPolarHBondContact O-CG2 2.95Å; A64-V102 HydrophobicContact CB-CG2 4.23Å; V102-N104 PolarHBondContact O-N 3.34Å; V102-N104 VanDerWaalsContact O-N 3.1Å; V102-C105 WeakPolarHBondContact O-CB 3.45Å; V102-C105 PolarHBondContact O-N 3.28Å
103	A	94.7	Very high	93.7	Very high	92 Å²	92	46.5 Å²	46.5	76%	0.76	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-61.2	-19.2	176	0	0	0	0	0	114.1	P101	P101-A103 PolarHBondContact O-N 3.37Å; P101-A103 VanDerWaalsContact O-N 3.13Å
104	N	96.6	Very high	93.5	Very high	120 Å²	120	43.4 Å²	43.4	64%	0.642	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-106	6	178	-64.9	-17.9	0	0	0	112.7	T100 P101 V102	T100-N104 HydrophobicContact CG2-CB 3.8Å; P101-N104 PolarHBondContact O-N 3.09Å; V102-N104 PolarHBondContact O-N 3.34Å; V102-N104 VanDerWaalsContact O-N 3.1Å
105	C	97.2	Very high	93.4	Very high	14 Å²	14	43.4 Å²	43.4	10%	0.095	26%	0.257	C	S	.	.	S	Bend	trans	-92.6	139.3	176.7	-60.9	0	0	0	0	109.7	T92 C94 P101 V102	T92-C105 HydrophobicContact CG2-CB 4.02Å; C94-C105 HydrophobicContact CB-CB 3.69Å; C94-C105 WeakPolarHBondContact CB-SG 3.44Å; C94-C105 WeakPolarHBondContact SG-CB 3.35Å; C94-C105 CovalentContact SG-SG 2.02Å; C94-C105 PolarHBondContact SG-SG 3.13Å; P101-C105 PolarHBondContact O-SG 3.21Å; P101-C105 VanDerWaalsContact O-SG 3.39Å; V102-C105 WeakPolarHBondContact O-CB 3.45Å; V102-C105 PolarHBondContact O-N 3.28Å
106	T	97.6	Very high	93.3	Very high	90 Å²	90	45.6 Å²	45.6	55%	0.552	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-83.4	127.7	-178	-41.7	0	0	0	0	109.1	T92 D93	T92-T106 CarbonylContact C-O 3.57Å; T92-T106 WeakPolarHBondContact CA-O 3.23Å; T92-T106 WeakPolarHBondContact CB-O 3.37Å; D93-T106 PolarHBondContact N-O 2.7Å; D93-T106 PolarHBondContact OD1-N 3.39Å; D93-T106 WeakPolarHBondContact OD2-CB 3.25Å; D93-T106 PolarHBondContact OD2-OG1 3.15Å
107	V	97.7	Very high	93.3	Very high	13 Å²	13	44.5 Å²	44.5	8%	0.079	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-66.5	134.2	170.1	167.2	0	0	0	0	110	A64 L90 T92 F351 F352	A64-V107 HydrophobicContact CB-CG2 3.76Å; L90-V107 HydrophobicContact CB-CG1 3.65Å; L90-V107 HydrophobicContact CB-CG2 4.27Å; L90-V107 HydrophobicContact CD1-CG1 3.69Å; L90-V107 HydrophobicContact CG-CG1 4.29Å; T92-V107 HydrophobicContact CG2-CG2 4.14Å; V107-F351 HydrophobicContact CB-CD1 3.71Å; V107-F351 HydrophobicContact CB-CE1 3.69Å; V107-F351 HydrophobicContact CB-CG 4.17Å; V107-F351 HydrophobicContact CB-CZ 4.15Å; V107-F351 HydrophobicContact CG1-CB 4.36Å; V107-F351 HydrophobicContact CG1-CD1 4Å; V107-F351 HydrophobicContact CG1-CD2 4.47Å; V107-F351 HydrophobicContact CG1-CE1 4.44Å; V107-F351 HydrophobicContact CG1-CG 4.02Å; V107-F351 HydrophobicContact CG2-CD1 3.84Å; V107-F351 HydrophobicContact CG2-CD2 4.04Å; V107-F351 HydrophobicContact CG2-CE1 3.45Å; V107-F351 VanDerWaalsContact CG2-CE1 3.45Å; V107-F351 HydrophobicContact CG2-CE2 3.67Å; V107-F351 HydrophobicContact CG2-CG 4.12Å; V107-F351 HydrophobicContact CG2-CZ 3.36Å; V107-F352 HydrophobicContact CG1-CE1 4.09Å; V107-F352 HydrophobicContact CG1-CZ 4.42Å
108	R	94.8	Very high	93.4	Very high	13 Å²	13	45.1 Å²	45.1	5%	0.049	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-71.6	129.4	177.9	-73.6	-166	173.3	82.5	11.2	110.6	E91 T92 E203 F352	E91-R108 PolarHBondContact O-N 2.67Å; E91-R108 WeakPolarHBondContact OE1-CD 3.27Å; E91-R108 IonicContact OE1-CZ 3.16Å; E91-R108 IonicContact OE1-NE 3.25Å; E91-R108 IonicContact OE1-NH1 3.9Å; E91-R108 PolarHBondContact OE1-NH1 2.87Å; T92-R108 PolarHBondContact O-NH1 3.03Å; R108-E203 IonicContact CZ-OE1 2.61Å; R108-E203 IonicContact CZ-OE2 3.79Å; R108-E203 IonicContact NE-OE1 3.76Å; R108-E203 IonicContact NH2-OE1 2.68Å; R108-E203 PolarHBondContact NH2-OE1 3.11Å; R108-E203 IonicContact NH2-OE2 3.5Å; R108-E203 PolarHBondContact NH2-OE2 2.93Å; R108-F352 WeakPolarHBondContact O-CE1 3.3Å
109	P	92.3	Very high	93.5	Very high	43 Å²	43	44.8 Å²	44.8	28%	0.279	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-76.4	156.2	179	32.4	-36.6	0	0	0	112.3	H111 L112	P109-H111 VanDerWaalsContact C-N 3.3Å; P109-H111 VanDerWaalsContact CB-CE1 3.46Å; P109-H111 WeakPolarHBondContact CB-CE1 3.46Å; P109-H111 WeakPolarHBondContact CG-CE1 3.42Å; P109-H111 PolarHBondContact O-N 2.84Å; P109-L112 HydrophobicContact CG-CB 4.38Å; P109-L112 HydrophobicContact CG-CD1 4.05Å; P109-L112 HydrophobicContact CG-CG 4.05Å; P109-L112 PolarHBondContact O-N 2.83Å
110	K	90.9	Very high	93.7	Very high	56 Å²	56	41.9 Å²	41.9	24%	0.243	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-54.4	-36.2	-179.9	-74.1	174.8	159.5	156.9	0	114	L112 T113 A114 S142 E144 F352	K110-L112 PolarHBondContact O-N 2.97Å; K110-T113 WeakPolarHBondContact O-CA 3.42Å; K110-T113 PolarHBondContact O-N 2.8Å; K110-A114 HydrophobicContact CG-CB 4.31Å; K110-S142 WeakPolarHBondContact CE-OG 3.44Å; K110-E144 HydrophobicContact CB-CG 3.58Å; K110-F352 HydrophobicContact CD-CB 4.39Å; K110-F352 HydrophobicContact CD-CD2 3.61Å; K110-F352 HydrophobicContact CD-CE2 3.98Å; K110-F352 HydrophobicContact CD-CG 3.99Å; K110-F352 HydrophobicContact CG-CD1 4.46Å; K110-F352 HydrophobicContact CG-CD2 3.75Å; K110-F352 HydrophobicContact CG-CE1 4.37Å; K110-F352 HydrophobicContact CG-CE2 3.61Å; K110-F352 HydrophobicContact CG-CG 4.15Å; K110-F352 HydrophobicContact CG-CZ 3.94Å; K110-F352 PolarHBondContact NZ-OXT 3.48Å
111	H	87.5	Confident	93.8	Very high	81 Å²	81	40.3 Å²	40.3	38%	0.375	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-64.7	-17.7	176.3	63.8	-93.2	0	0	0	114.4	P109 E144 C150	P109-H111 VanDerWaalsContact C-N 3.3Å; P109-H111 VanDerWaalsContact CB-CE1 3.46Å; P109-H111 WeakPolarHBondContact CB-CE1 3.46Å; P109-H111 WeakPolarHBondContact CG-CE1 3.42Å; P109-H111 PolarHBondContact O-N 2.84Å; H111-E144 HydrophobicContact CB-CG 4.33Å; H111-E144 WeakPolarHBondContact CB-OE1 3.35Å; H111-E144 IonicContact CG-OE1 2.7Å; H111-E144 PolarHBondContact N-OE1 2.86Å; H111-E144 IonicContact ND1-OE1 2.71Å; H111-C150 WeakPolarHBondContact O-CB 3.09Å; H111-C150 PolarHBondContact O-SG 2.82Å
112	L	89	Confident	93.8	Very high	77 Å²	77	36.4 Å²	36.4	40%	0.403	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-97.6	12.5	172.4	-62.8	-176	0	0	0	112.5	P109 K110 R188	P109-L112 HydrophobicContact CG-CB 4.38Å; P109-L112 HydrophobicContact CG-CD1 4.05Å; P109-L112 HydrophobicContact CG-CG 4.05Å; P109-L112 PolarHBondContact O-N 2.83Å; K110-L112 PolarHBondContact O-N 2.97Å; L112-R188 PolarHBondContact O-NH2 3.49Å
113	T	90.3	Very high	93.8	Very high	5 Å²	5	35.5 Å²	35.5	3%	0.031	20%	0.202	C	C	.	.			trans	61.3	90.7	-168	-50.9	0	0	0	0	111	K110 E141 S142 R143 L153 R188	K110-T113 WeakPolarHBondContact O-CA 3.42Å; K110-T113 PolarHBondContact O-N 2.8Å; T113-E141 HydrophobicContact CG2-CB 4.12Å; T113-E141 HydrophobicContact CG2-CG 4.22Å; T113-S142 CarbonylContact C-O 3.52Å; T113-R143 HydrophobicContact CG2-CG 3.73Å; T113-L153 HydrophobicContact CG2-CB 3.84Å; T113-L153 HydrophobicContact CG2-CD2 3.72Å; T113-L153 HydrophobicContact CG2-CG 4.43Å; T113-R188 PolarHBondContact O-NH2 2.61Å
114	A	92.6	Very high	93.7	Very high	2 Å²	2	34.8 Å²	34.8	2%	0.017	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	150.9	173.2	0	0	0	0	0	110.4	K110 S142 F352	K110-A114 HydrophobicContact CG-CB 4.31Å; A114-S142 PolarHBondContact N-O 2.86Å; A114-S142 PolarHBondContact O-N 3.25Å; A114-F352 HydrophobicContact CB-CE2 4Å; A114-F352 HydrophobicContact CB-CZ 3.52Å
115	I	93.2	Very high	93.6	Very high	5 Å²	5	31 Å²	31	3%	0.026	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	120.1	168.4	-52.5	-60.9	0	0	0	106.8	Y63 E91 E140 E141 L153	Y63-I115 HydrophobicContact CE1-CG2 4.39Å; E91-I115 HydrophobicContact CB-CB 3.76Å; E91-I115 HydrophobicContact CB-CG1 4.38Å; E91-I115 HydrophobicContact CG-CB 4.46Å; E91-I115 PolarHBondContact N-O 2.68Å; I115-E140 WeakPolarHBondContact CA-O 3.38Å; I115-E141 HydrophobicContact CD1-CB 4.39Å; I115-E141 HydrophobicContact CD1-CG 3.64Å; I115-L153 HydrophobicContact CD1-CD2 3.87Å
116	E	93.5	Very high	93.3	Very high	46 Å²	46	33.5 Å²	33.5	22%	0.215	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	135.4	-179.8	-46.5	-171.6	167.5	0	0	108.3	L89 L90 T139 E140 S142 F352	L89-E116 CarbonylContact O-C 3.55Å; L89-E116 WeakPolarHBondContact O-CA 3.19Å; L90-E116 HydrophobicContact CD2-CB 4.03Å; L90-E116 HydrophobicContact CD2-CG 3.51Å; E116-T139 CarbonylContact O-C 3.57Å; E116-T139 VanDerWaalsContact O-CA 3.25Å; E116-T139 WeakPolarHBondContact O-CA 3.22Å; E116-E140 PolarHBondContact N-O 2.82Å; E116-E140 PolarHBondContact O-N 3.1Å; E116-S142 VanDerWaalsContact CG-CB 3.46Å; E116-S142 WeakPolarHBondContact OE1-CB 3.32Å; E116-S142 PolarHBondContact OE1-OG 3.15Å; E116-F352 WeakPolarHBondContact OE1-CE2 3.46Å
117	G	93	Very high	92.9	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	111.3	178.9	0	0	0	0	0	109.8	E88 L89 K138	E88-G117 CarbonylContact C-O 3.47Å; E88-G117 WeakPolarHBondContact CA-O 3.42Å; L89-G117 PolarHBondContact N-O 3.23Å; L89-G117 PolarHBondContact O-N 2.9Å; G117-K138 CarbonylContact C-O 3.58Å; G117-K138 WeakPolarHBondContact CA-O 3.47Å
118	D	93.8	Very high	92.4	Very high	68 Å²	68	35.8 Å²	35.8	36%	0.364	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	114.9	172.5	175.9	11.5	0	0	0	108.7	C137 K138	D118-C137 CarbonylContact O-C 3.54Å; D118-C137 VanDerWaalsContact O-CA 3.25Å; D118-C137 WeakPolarHBondContact O-CA 3.39Å; D118-K138 PolarHBondContact N-O 2.75Å; D118-K138 PolarHBondContact O-N 2.97Å
119	C	94.4	Very high	92.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	120.3	-169.1	-68.3	0	0	0	0	113.1	L53 E86 I87 V121 K136 C137	L53-C119 HydrophobicContact CD1-CB 4.38Å; E86-C119 WeakPolarHBondContact CA-O 3.46Å; I87-C119 HydrophobicContact CG1-CB 3.89Å; I87-C119 PolarHBondContact N-O 3.03Å; I87-C119 PolarHBondContact O-N 3.02Å; C119-V121 HydrophobicContact CB-CG2 4.2Å; C119-K136 CarbonylContact C-O 3.52Å; C119-K136 VanDerWaalsContact CA-O 3.3Å; C119-K136 WeakPolarHBondContact CA-O 3.34Å; C119-C137 HydrophobicContact CB-CB 4.16Å; C119-C137 WeakPolarHBondContact CB-SG 3.42Å; C119-C137 WeakPolarHBondContact SG-CB 3.2Å; C119-C137 CovalentContact SG-SG 2.05Å; C119-C137 PolarHBondContact SG-SG 3.01Å
120	D	94.4	Very high	92.5	Very high	20 Å²	20	38.5 Å²	38.5	11%	0.107	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	126.7	161.1	-65.4	-49.3	0	0	0	109.4	M85 F135 K136 L295 S296	M85-D120 CarbonylContact O-C 3.51Å; M85-D120 WeakPolarHBondContact O-CA 3.25Å; D120-F135 CarbonylContact O-C 3.57Å; D120-F135 WeakPolarHBondContact O-CA 3.32Å; D120-F135 WeakPolarHBondContact O-CB 3.31Å; D120-K136 HydrophobicContact CB-CB 4.49Å; D120-K136 PolarHBondContact N-O 3.4Å; D120-K136 PolarHBondContact O-N 2.84Å; D120-L295 HydrophobicContact CB-CD2 3.68Å; D120-S296 PolarHBondContact OD1-OG 3.25Å; D120-S296 WeakPolarHBondContact OD2-CB 3.46Å; D120-S296 PolarHBondContact OD2-N 2.98Å; D120-S296 PolarHBondContact OD2-OG 2.84Å
121	V	95	Very high	92.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	132.5	-180	-169.5	0	0	0	0	110.9	A49 L53 M85 I87 C119 L123 V132 F135	A49-V121 HydrophobicContact CB-CB 4.28Å; A49-V121 HydrophobicContact CB-CG1 3.8Å; A49-V121 HydrophobicContact CB-CG2 4.2Å; L53-V121 HydrophobicContact CD1-CG2 4.19Å; M85-V121 PolarHBondContact N-O 2.9Å; M85-V121 PolarHBondContact O-N 2.96Å; I87-V121 HydrophobicContact CD1-CG2 4.02Å; I87-V121 HydrophobicContact CG1-CG2 4.2Å; C119-V121 HydrophobicContact CB-CG2 4.2Å; V121-L123 HydrophobicContact CB-CD1 4.33Å; V121-L123 HydrophobicContact CG1-CD1 3.79Å; V121-L123 HydrophobicContact CG1-CG 4.13Å; V121-V132 HydrophobicContact CG1-CG1 3.92Å; V121-V132 HydrophobicContact CG1-CG2 4.32Å; V121-F135 HydrophobicContact CG1-CB 4.31Å; V121-F135 HydrophobicContact CG2-CB 4.17Å
122	V	95.3	Very high	93	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	118.4	173.6	-175.7	0	0	0	0	109.2	T82 Y83 L133 A134 L295	T82-V122 HydrophobicContact CG2-CG1 3.77Å; Y83-V122 CarbonylContact O-C 3.54Å; Y83-V122 VanDerWaalsContact O-CA 3.28Å; Y83-V122 WeakPolarHBondContact O-CA 3.4Å; V122-L133 HydrophobicContact CG1-CB 4.44Å; V122-L133 PolarHBondContact O-N 3.33Å; V122-A134 HydrophobicContact CB-CB 4.4Å; V122-A134 PolarHBondContact N-O 2.86Å; V122-A134 PolarHBondContact O-N 2.04Å; V122-L295 HydrophobicContact CG2-CD2 4.05Å
123	L	95.3	Very high	93.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	153.1	174.9	-50.5	91.9	0	0	0	110.9	A45 V48 A49 T82 Y83 M85 V121 L130 T131 V132	A45-L123 WeakPolarHBondContact O-CD2 3.08Å; V48-L123 HydrophobicContact CB-CD2 4.18Å; V48-L123 HydrophobicContact CG1-CD2 3.9Å; A49-L123 HydrophobicContact CB-CD2 4.38Å; T82-L123 CarbonylContact C-O 3.57Å; T82-L123 WeakPolarHBondContact CA-O 3.29Å; Y83-L123 PolarHBondContact N-O 2.93Å; Y83-L123 PolarHBondContact O-N 3.01Å; M85-L123 HydrophobicContact CG-CD1 4.4Å; M85-L123 HydrophobicContact SD-CD1 3.95Å; V121-L123 HydrophobicContact CB-CD1 4.33Å; V121-L123 HydrophobicContact CG1-CD1 3.79Å; V121-L123 HydrophobicContact CG1-CG 4.13Å; L123-L130 HydrophobicContact CB-CD2 4.25Å; L123-T131 CarbonylContact C-O 3.54Å; L123-T131 WeakPolarHBondContact CA-O 3.39Å; L123-V132 HydrophobicContact CD2-CG2 3.92Å; L123-V132 HydrophobicContact CG-CG2 4.12Å
124	K	94.4	Very high	93.1	Very high	77 Å²	77	35.6 Å²	35.6	34%	0.335	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	131.5	170.4	-168.6	-179.8	-178.2	176	0	110	N81 V126 L130 T131 L133	N81-K124 CarbonylContact O-C 3.58Å; N81-K124 WeakPolarHBondContact O-CA 3.39Å; K124-V126 HydrophobicContact CD-CG2 3.89Å; K124-V126 HydrophobicContact CG-CG2 3.9Å; K124-L130 WeakPolarHBondContact O-CA 3.45Å; K124-T131 PolarHBondContact N-O 2.79Å; K124-T131 PolarHBondContact O-N 3.31Å; K124-L133 HydrophobicContact CB-CD1 3.72Å; K124-L133 HydrophobicContact CB-CD2 4.22Å; K124-L133 HydrophobicContact CB-CG 3.93Å; K124-L133 HydrophobicContact CD-CD1 4.27Å
125	K	94.2	Very high	93	Very high	41 Å²	41	35.8 Å²	35.8	18%	0.178	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	116.9	172.3	-163.4	168.6	-171.8	163.3	0	109.6	E44 N81 Y83 V129 L130	E44-K125 IonicContact OE2-NZ 3.99Å; N81-K125 HydrophobicContact CB-CB 4.43Å; N81-K125 PolarHBondContact N-O 2.75Å; N81-K125 PolarHBondContact O-N 2.99Å; Y83-K125 HydrophobicContact CD2-CB 4.38Å; Y83-K125 HydrophobicContact CE2-CB 3.56Å; Y83-K125 HydrophobicContact CE2-CD 4.12Å; Y83-K125 VanDerWaalsContact OH-CD 3.3Å; Y83-K125 WeakPolarHBondContact OH-CD 3.42Å; K125-V129 VanDerWaalsContact CA-O 3.28Å; K125-V129 WeakPolarHBondContact CA-O 3.49Å; K125-L130 HydrophobicContact CB-CD2 3.81Å; K125-L130 HydrophobicContact CB-CG 4.4Å; K125-L130 HydrophobicContact CD-CD2 4.2Å; K125-L130 HydrophobicContact CD-CG 4.3Å; K125-L130 HydrophobicContact CG-CD2 4.16Å; K125-L130 HydrophobicContact CG-CG 4.25Å
126	V	91.1	Very high	92.8	Very high	66 Å²	66	37.7 Å²	37.7	40%	0.4	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	125	176.7	-178.8	0	0	0	0	108.2	K124 G128 V129	K124-V126 HydrophobicContact CD-CG2 3.89Å; K124-V126 HydrophobicContact CG-CG2 3.9Å; V126-G128 PolarHBondContact O-N 3.4Å; V126-G128 VanDerWaalsContact O-N 3.13Å; V126-V129 PolarHBondContact N-O 2.79Å; V126-V129 PolarHBondContact O-N 3.29Å
127	A	88.9	Confident	92.6	Very high	102 Å²	102	36.4 Å²	36.4	84%	0.843	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.6	36.6	-177.6	0	0	0	0	0	113.6	V129	A127-V129 VanDerWaalsContact C-N 3.32Å; A127-V129 PolarHBondContact O-N 3.03Å
128	G	86.9	Confident	92.3	Very high	49 Å²	49	41.4 Å²	41.4	51%	0.505	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	-7.2	-179.8	0	0	0	0	0	115.6	V126	V126-G128 PolarHBondContact O-N 3.4Å; V126-G128 VanDerWaalsContact O-N 3.13Å
129	V	92.9	Very high	92	Very high	93 Å²	93	39.5 Å²	39.5	56%	0.564	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	127.1	-179.8	-177.8	0	0	0	0	110.4	K125 V126 A127	K125-V129 VanDerWaalsContact CA-O 3.28Å; K125-V129 WeakPolarHBondContact CA-O 3.49Å; V126-V129 PolarHBondContact N-O 2.79Å; V126-V129 PolarHBondContact O-N 3.29Å; A127-V129 VanDerWaalsContact C-N 3.32Å; A127-V129 PolarHBondContact O-N 3.03Å
130	L	95.8	Very high	91.8	Very high	21 Å²	21	44.5 Å²	44.5	11%	0.11	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	130.3	174.2	-75.5	160.5	0	0	0	110.8	E44 A45 V48 Y83 L123 K124 K125	E44-L130 HydrophobicContact CG-CD1 4.09Å; A45-L130 HydrophobicContact CB-CD1 4.18Å; V48-L130 HydrophobicContact CB-CB 4.48Å; V48-L130 HydrophobicContact CG1-CB 4.06Å; V48-L130 HydrophobicContact CG2-CB 4.28Å; V48-L130 HydrophobicContact CG2-CD1 4.29Å; Y83-L130 HydrophobicContact CD2-CD2 3.95Å; Y83-L130 HydrophobicContact CE2-CD2 3.92Å; Y83-L130 HydrophobicContact CG-CD2 4.47Å; L123-L130 HydrophobicContact CB-CD2 4.25Å; K124-L130 WeakPolarHBondContact O-CA 3.45Å; K125-L130 HydrophobicContact CB-CD2 3.81Å; K125-L130 HydrophobicContact CB-CG 4.4Å; K125-L130 HydrophobicContact CD-CD2 4.2Å; K125-L130 HydrophobicContact CD-CG 4.3Å; K125-L130 HydrophobicContact CG-CD2 4.16Å; K125-L130 HydrophobicContact CG-CG 4.25Å
131	T	94.4	Very high	91.6	Very high	79 Å²	79	47.5 Å²	47.5	49%	0.485	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	129.4	176.1	-56.3	0	0	0	0	109.8	L123 K124 L133	L123-T131 CarbonylContact C-O 3.54Å; L123-T131 WeakPolarHBondContact CA-O 3.39Å; K124-T131 PolarHBondContact N-O 2.79Å; K124-T131 PolarHBondContact O-N 3.31Å; T131-L133 PolarHBondContact O-N 2.8Å
132	V	93.9	Very high	91.2	Very high	15 Å²	15	48.3 Å²	48.3	9%	0.091	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	127.9	173.1	-179.3	0	0	0	0	109.7	H52 V121 L123 F135	H52-V132 HydrophobicContact CB-CB 4.22Å; H52-V132 HydrophobicContact CB-CG2 3.59Å; V121-V132 HydrophobicContact CG1-CG1 3.92Å; V121-V132 HydrophobicContact CG1-CG2 4.32Å; L123-V132 HydrophobicContact CD2-CG2 3.92Å; L123-V132 HydrophobicContact CG-CG2 4.12Å; V132-F135 HydrophobicContact CG1-CD1 4.02Å
133	L	92	Very high	90.7	Very high	64 Å²	64	53.8 Å²	53.8	34%	0.335	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-35.1	179.8	-64.1	-171.7	0	0	0	113	V122 K124 T131 M291	V122-L133 HydrophobicContact CG1-CB 4.44Å; V122-L133 PolarHBondContact O-N 3.33Å; K124-L133 HydrophobicContact CB-CD1 3.72Å; K124-L133 HydrophobicContact CB-CD2 4.22Å; K124-L133 HydrophobicContact CB-CG 3.93Å; K124-L133 HydrophobicContact CD-CD1 4.27Å; T131-L133 PolarHBondContact O-N 2.8Å; L133-M291 HydrophobicContact CD1-SD 4.41Å
134	A	90.9	Very high	90.1	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	153.2	-178.8	0	0	0	0	0	109.2	V122 N288 M291 L295	V122-A134 HydrophobicContact CB-CB 4.4Å; V122-A134 PolarHBondContact N-O 2.86Å; V122-A134 PolarHBondContact O-N 2.04Å; A134-N288 HydrophobicContact CB-CB 4.08Å; A134-M291 HydrophobicContact CB-CB 3.71Å; A134-M291 HydrophobicContact CB-CG 4.07Å; A134-L295 HydrophobicContact CB-CD1 4.27Å
135	F	90.4	Very high	89.1	Confident	6 Å²	6	62.2 Å²	62.2	3%	0.026	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	157	171.4	62.1	-91.7	0	0	0	110.6	H52 L53 Q56 D120 V121 V132 T284 L286	H52-F135 AromaticContact CD2-CE1 3.87Å; H52-F135 AromaticContact NE2-CE1 3.8Å; L53-F135 HydrophobicContact CD2-CB 3.92Å; L53-F135 HydrophobicContact CD2-CD1 3.92Å; L53-F135 HydrophobicContact CD2-CD2 3.07Å; L53-F135 HydrophobicContact CD2-CE1 4.15Å; L53-F135 HydrophobicContact CD2-CE2 3.31Å; L53-F135 HydrophobicContact CD2-CG 3.38Å; L53-F135 HydrophobicContact CD2-CZ 3.88Å; Q56-F135 HydrophobicContact CB-CZ 4.22Å; Q56-F135 HydrophobicContact CG-CE1 4.23Å; Q56-F135 HydrophobicContact CG-CZ 4.15Å; D120-F135 CarbonylContact O-C 3.57Å; D120-F135 WeakPolarHBondContact O-CA 3.32Å; D120-F135 WeakPolarHBondContact O-CB 3.31Å; V121-F135 HydrophobicContact CG1-CB 4.31Å; V121-F135 HydrophobicContact CG2-CB 4.17Å; V132-F135 HydrophobicContact CG1-CD1 4.02Å; F135-T284 WeakPolarHBondContact CE2-O 3.36Å; F135-L286 HydrophobicContact CD1-CB 4.18Å; F135-L286 HydrophobicContact CE1-CB 3.54Å; F135-L286 HydrophobicContact CE1-CD2 4.03Å; F135-L286 HydrophobicContact CE1-CG 4.43Å; F135-L286 HydrophobicContact CE2-CB 4.22Å; F135-L286 HydrophobicContact CZ-CB 3.57Å; F135-L286 VanDerWaalsContact O-O 3.1Å
136	K	87.9	Confident	88.3	Confident	44 Å²	44	68.1 Å²	68.1	19%	0.191	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	129.6	174.3	-176.2	-171.1	-177.5	-163.3	0	107.8	C119 D120 L295 S296 S298	C119-K136 CarbonylContact C-O 3.52Å; C119-K136 VanDerWaalsContact CA-O 3.3Å; C119-K136 WeakPolarHBondContact CA-O 3.34Å; D120-K136 HydrophobicContact CB-CB 4.49Å; D120-K136 PolarHBondContact N-O 3.4Å; D120-K136 PolarHBondContact O-N 2.84Å; K136-L295 HydrophobicContact CB-CD1 4.28Å; K136-L295 HydrophobicContact CB-CD2 4.37Å; K136-S296 PolarHBondContact NZ-O 3.15Å; K136-S298 VanDerWaalsContact NZ-CB 3.29Å; K136-S298 PolarHBondContact NZ-O 3.13Å; K136-S298 PolarHBondContact NZ-OG 2.89Å
137	C	88.8	Confident	87.8	Confident	19 Å²	19	67.5 Å²	67.5	13%	0.128	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	145.1	-179.9	-63.6	0	0	0	0	111	D118 C119 L283	D118-C137 CarbonylContact O-C 3.54Å; D118-C137 VanDerWaalsContact O-CA 3.25Å; D118-C137 WeakPolarHBondContact O-CA 3.39Å; C119-C137 HydrophobicContact CB-CB 4.16Å; C119-C137 WeakPolarHBondContact CB-SG 3.42Å; C119-C137 WeakPolarHBondContact SG-CB 3.2Å; C119-C137 CovalentContact SG-SG 2.05Å; C119-C137 PolarHBondContact SG-SG 3.01Å; C137-L283 HydrophobicContact CB-CB 3.69Å; C137-L283 HydrophobicContact CB-CD1 3.89Å; C137-L283 HydrophobicContact CB-CG 4.45Å
138	K	87.6	Confident	87.3	Confident	105 Å²	105	69 Å²	69	46%	0.457	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	129.5	168.9	-171.9	-167.7	-171.2	-161.4	0	108	G117 D118 E140	G117-K138 CarbonylContact C-O 3.58Å; G117-K138 WeakPolarHBondContact CA-O 3.47Å; D118-K138 PolarHBondContact N-O 2.75Å; D118-K138 PolarHBondContact O-N 2.97Å; K138-E140 WeakPolarHBondContact CE-OE1 3.04Å; K138-E140 IonicContact NZ-OE1 2.59Å; K138-E140 PolarHBondContact NZ-OE1 2.8Å
139	T	88.4	Confident	87.1	Confident	29 Å²	29	69 Å²	69	18%	0.178	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	133.6	179.2	55.5	0	0	0	0	111	E116 K282 L283	E116-T139 CarbonylContact O-C 3.57Å; E116-T139 VanDerWaalsContact O-CA 3.25Å; E116-T139 WeakPolarHBondContact O-CA 3.22Å; T139-K282 HydrophobicContact CG2-CB 4.42Å; T139-K282 WeakPolarHBondContact OG1-CG 3.42Å; T139-L283 HydrophobicContact CG2-CB 4.07Å; T139-L283 HydrophobicContact CG2-CD1 4.23Å; T139-L283 HydrophobicContact CG2-CG 4.12Å
140	E	88.9	Confident	86.8	Confident	104 Å²	104	66 Å²	66	49%	0.486	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	152.7	177.8	-60.5	-165.7	167.8	0	0	111.7	I115 E116 K138	I115-E140 WeakPolarHBondContact CA-O 3.38Å; E116-E140 PolarHBondContact N-O 2.82Å; E116-E140 PolarHBondContact O-N 3.1Å; K138-E140 WeakPolarHBondContact CE-OE1 3.04Å; K138-E140 IonicContact NZ-OE1 2.59Å; K138-E140 PolarHBondContact NZ-OE1 2.8Å
141	E	90.3	Very high	86.5	Confident	83 Å²	83	65.9 Å²	65.9	39%	0.388	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	129.2	171.8	-69.1	-179.2	-141.8	0	0	109.9	T113 I115 R143 L153 H280	T113-E141 HydrophobicContact CG2-CB 4.12Å; T113-E141 HydrophobicContact CG2-CG 4.22Å; I115-E141 HydrophobicContact CD1-CB 4.39Å; I115-E141 HydrophobicContact CD1-CG 3.64Å; E141-R143 IonicContact OE2-CZ 3.71Å; E141-R143 VanDerWaalsContact OE2-CZ 3.25Å; E141-R143 IonicContact OE2-NE 3.96Å; E141-R143 PolarHBondContact OE2-NE 3.5Å; E141-R143 VanDerWaalsContact OE2-NE 3.16Å; E141-R143 IonicContact OE2-NH2 3.45Å; E141-R143 PolarHBondContact OE2-NH2 3.08Å; E141-L153 HydrophobicContact CG-CD2 4.31Å; E141-H280 IonicContact OE1-CD2 3.02Å; E141-H280 PolarHBondContact OE1-CD2 2.97Å; E141-H280 VanDerWaalsContact OE1-CD2 3.28Å; E141-H280 IonicContact OE1-NE2 2.7Å; E141-H280 PolarHBondContact OE1-NE2 3.29Å
142	S	87.4	Confident	86.2	Confident	18 Å²	18	65.3 Å²	65.3	13%	0.126	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	121.4	175.2	179.1	0	0	0	0	109.7	K110 T113 A114 E116	K110-S142 WeakPolarHBondContact CE-OG 3.44Å; T113-S142 CarbonylContact C-O 3.52Å; A114-S142 PolarHBondContact N-O 2.86Å; A114-S142 PolarHBondContact O-N 3.25Å; E116-S142 VanDerWaalsContact CG-CB 3.46Å; E116-S142 WeakPolarHBondContact OE1-CB 3.32Å; E116-S142 PolarHBondContact OE1-OG 3.15Å
143	R	84.5	Confident	86.1	Confident	114 Å²	114	64.9 Å²	64.9	43%	0.43	36%	0.356	S	S	.	.			trans	-122.5	151.7	-173.3	-64.1	178.3	177.8	-167.7	-4.2	108.9	T113 E141 D145	T113-R143 HydrophobicContact CG2-CG 3.73Å; E141-R143 IonicContact OE2-CZ 3.71Å; E141-R143 VanDerWaalsContact OE2-CZ 3.25Å; E141-R143 IonicContact OE2-NE 3.96Å; E141-R143 PolarHBondContact OE2-NE 3.5Å; E141-R143 VanDerWaalsContact OE2-NE 3.16Å; E141-R143 IonicContact OE2-NH2 3.45Å; E141-R143 PolarHBondContact OE2-NH2 3.08Å; R143-D145 PolarHBondContact O-N 2.86Å
144	E	82.4	Confident	86.2	Confident	89 Å²	89	62.6 Å²	62.6	42%	0.416	34%	0.344	S	S	.	.			trans	-65.5	129.4	167.5	-73.9	-177.1	-171	0	0	109.9	K110 H111 L146 C147	K110-E144 HydrophobicContact CB-CG 3.58Å; H111-E144 HydrophobicContact CB-CG 4.33Å; H111-E144 WeakPolarHBondContact CB-OE1 3.35Å; H111-E144 IonicContact CG-OE1 2.7Å; H111-E144 PolarHBondContact N-OE1 2.86Å; H111-E144 IonicContact ND1-OE1 2.71Å; E144-L146 PolarHBondContact O-N 3.45Å; E144-L146 VanDerWaalsContact O-N 3.07Å; E144-C147 HydrophobicContact CB-CB 4.39Å
145	D	74.3	Confident	86.2	Confident	166 Å²	166	65.1 Å²	65.1	89%	0.888	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-29.1	-176.5	-68	-38.6	0	0	0	113.1	R143	R143-D145 PolarHBondContact O-N 2.86Å
146	L	77.2	Confident	86.3	Confident	165 Å²	165	65.2 Å²	65.2	86%	0.864	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.3	77.3	-175.1	-66.4	174	0	0	0	111.5	E144	E144-L146 PolarHBondContact O-N 3.45Å; E144-L146 VanDerWaalsContact O-N 3.07Å
147	C	79.4	Confident	86.4	Confident	52 Å²	52	66.9 Å²	66.9	35%	0.351	37%	0.373	S	S	.	.			trans	-124	88.8	165.8	-170.6	0	0	0	0	113	E144 G149 C150	E144-C147 HydrophobicContact CB-CB 4.39Å; C147-G149 PolarHBondContact O-N 2.83Å; C147-G149 VanDerWaalsContact O-N 3.11Å; C147-C150 HydrophobicContact CB-CB 3.64Å; C147-C150 WeakPolarHBondContact CB-SG 3.22Å; C147-C150 PolarHBondContact O-N 2.99Å; C147-C150 WeakPolarHBondContact SG-CB 3.41Å; C147-C150 PolarHBondContact SG-N 2.92Å; C147-C150 VanDerWaalsContact SG-N 3.44Å; C147-C150 CovalentContact SG-SG 2Å; C147-C150 PolarHBondContact SG-SG 2.82Å
148	S	79.3	Confident	86.6	Confident	134 Å²	134	68.6 Å²	68.6	94%	0.937	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	107.6	170.2	-68.9	0	0	0	0	109.8
149	G	81.7	Confident	86.9	Confident	49 Å²	49	68.2 Å²	68.2	51%	0.505	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.8	4.1	178.1	0	0	0	0	0	115.1	C147 Q192	C147-G149 PolarHBondContact O-N 2.83Å; C147-G149 VanDerWaalsContact O-N 3.11Å; G149-Q192 VanDerWaalsContact O-CG 3.31Å; G149-Q192 WeakPolarHBondContact O-CG 3.44Å; G149-Q192 PolarHBondContact O-NE2 2.91Å
150	C	87.3	Confident	87.2	Confident	30 Å²	30	72.3 Å²	72.3	20%	0.203	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-64.2	157.7	167.6	-83.1	0	0	0	0	111.8	H111 C147 T152	H111-C150 WeakPolarHBondContact O-CB 3.09Å; H111-C150 PolarHBondContact O-SG 2.82Å; C147-C150 HydrophobicContact CB-CB 3.64Å; C147-C150 WeakPolarHBondContact CB-SG 3.22Å; C147-C150 PolarHBondContact O-N 2.99Å; C147-C150 WeakPolarHBondContact SG-CB 3.41Å; C147-C150 PolarHBondContact SG-N 2.92Å; C147-C150 VanDerWaalsContact SG-N 3.44Å; C147-C150 CovalentContact SG-SG 2Å; C147-C150 PolarHBondContact SG-SG 2.82Å; C150-T152 PolarHBondContact O-N 2.94Å
151	S	88.7	Confident	87.5	Confident	19 Å²	19	67.4 Å²	67.4	13%	0.133	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-64.5	132.6	171.7	-165.4	0	0	0	0	109.9	S190 S191	S151-S190 WeakPolarHBondContact OG-CB 3.02Å; S151-S190 PolarHBondContact OG-OG 2.84Å; S151-S191 WeakPolarHBondContact CA-O 3.39Å; S151-S191 PolarHBondContact OG-N 3.24Å; S151-S191 PolarHBondContact OG-O 2.76Å
152	T	89.4	Confident	87.7	Confident	66 Å²	66	67.5 Å²	67.5	41%	0.405	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	127.2	175.5	-60.7	0	0	0	0	109.1	C150 L154 S190 S191	C150-T152 PolarHBondContact O-N 2.94Å; T152-L154 PolarHBondContact O-N 2.89Å; T152-S190 CarbonylContact O-C 3.59Å; T152-S190 WeakPolarHBondContact O-CA 3.33Å; T152-S190 WeakPolarHBondContact O-CB 3.4Å; T152-S191 PolarHBondContact N-O 2.74Å; T152-S191 PolarHBondContact O-N 3.27Å
153	L	92.1	Very high	88.1	Confident	7 Å²	7	71.1 Å²	71.1	4%	0.037	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	130.9	173.2	-174	61.2	0	0	0	110.1	T113 I115 E141 R188 M189 H280	T113-L153 HydrophobicContact CG2-CB 3.84Å; T113-L153 HydrophobicContact CG2-CD2 3.72Å; T113-L153 HydrophobicContact CG2-CG 4.43Å; I115-L153 HydrophobicContact CD1-CD2 3.87Å; E141-L153 HydrophobicContact CG-CD2 4.31Å; L153-R188 HydrophobicContact CD1-CG 3.55Å; L153-M189 WeakPolarHBondContact CD1-O 3.32Å; L153-H280 VanDerWaalsContact CD2-CE1 3.44Å; L153-H280 WeakPolarHBondContact CD2-CE1 3.43Å; L153-H280 VanDerWaalsContact CD2-NE2 3.35Å; L153-H280 WeakPolarHBondContact CD2-NE2 3.32Å; L153-H280 WeakPolarHBondContact CG-CE1 3.22Å; L153-H280 WeakPolarHBondContact CG-NE2 3.25Å
154	L	92.7	Very high	88.7	Confident	16 Å²	16	66.2 Å²	66.2	8%	0.084	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	141.3	-178.6	-66.2	-180	0	0	0	110.6	T152 H158 M189 Y200 H280	T152-L154 PolarHBondContact O-N 2.89Å; L154-H158 HydrophobicContact CB-CB 4.22Å; L154-M189 HydrophobicContact CB-CB 4.13Å; L154-M189 PolarHBondContact N-O 3.2Å; L154-Y200 HydrophobicContact CD1-CD1 3.92Å; L154-Y200 HydrophobicContact CD1-CE1 3.87Å; L154-H280 PolarHBondContact O-CE1 3.06Å
155	P	92.3	Very high	89.5	Confident	53 Å²	53	62 Å²	62	34%	0.344	36%	0.36	S	S	.	.			trans	-61.2	149.9	175.1	28.4	-34.9	0	0	0	110.7	N157 H158 M189 T278	P155-N157 WeakPolarHBondContact CB-OD1 3.28Å; P155-N157 PolarHBondContact O-N 3.33Å; P155-H158 HydrophobicContact CG-CB 4.24Å; P155-H158 VanDerWaalsContact O-CB 3.23Å; P155-H158 WeakPolarHBondContact O-CB 3.35Å; P155-H158 PolarHBondContact O-N 2.94Å; P155-M189 WeakPolarHBondContact O-CE 3.47Å; P155-T278 WeakPolarHBondContact CB-O 3.33Å
156	L	91.1	Very high	90.5	Very high	8 Å²	8	58.7 Å²	58.7	4%	0.042	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-16.2	-173.7	-63.8	-178.7	0	0	0	113.4	Q162 I186 M189	L156-Q162 PolarHBondContact O-NE2 2.95Å; L156-I186 HydrophobicContact CD2-CB 4.4Å; L156-I186 HydrophobicContact CD2-CG2 3.94Å; L156-M189 VanDerWaalsContact O-CE 3.27Å; L156-M189 WeakPolarHBondContact O-CE 3.27Å
157	N	90.3	Very high	91.5	Very high	79 Å²	79	53.7 Å²	53.7	42%	0.422	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	7.4	175.2	72.3	-8.4	0	0	0	114.3	P155 T159 T278	P155-N157 WeakPolarHBondContact CB-OD1 3.28Å; P155-N157 PolarHBondContact O-N 3.33Å; N157-T159 PolarHBondContact O-N 3.42Å; N157-T159 VanDerWaalsContact O-N 3.14Å; N157-T278 VanDerWaalsContact ND2-CG2 3.26Å; N157-T278 WeakPolarHBondContact ND2-CG2 3.46Å
158	H	93.1	Very high	92.3	Very high	54 Å²	54	51.2 Å²	51.2	25%	0.25	30%	0.299	C	S	.	.			trans	-65.4	112.5	179.8	-173.3	-86.8	0	0	0	111	L154 P155 Q160 G161 Q162 M189	L154-H158 HydrophobicContact CB-CB 4.22Å; P155-H158 HydrophobicContact CG-CB 4.24Å; P155-H158 VanDerWaalsContact O-CB 3.23Å; P155-H158 WeakPolarHBondContact O-CB 3.35Å; P155-H158 PolarHBondContact O-N 2.94Å; H158-Q160 PolarHBondContact O-N 2.73Å; H158-G161 PolarHBondContact ND1-N 2.9Å; H158-G161 WeakPolarHBondContact O-CA 3.49Å; H158-G161 PolarHBondContact O-N 2.86Å; H158-Q162 PolarHBondContact O-N 3.28Å; H158-M189 HydrophobicContact CB-CE 4.41Å
159	T	94.3	Very high	93.2	Very high	98 Å²	98	45.4 Å²	45.4	60%	0.601	26%	0.258	S	S	*	.	H	α-helix	trans	-53.1	-55.1	-169.9	-50.2	0	0	0	0	113.4	N157 G161 Q162 D163	N157-T159 PolarHBondContact O-N 3.42Å; N157-T159 VanDerWaalsContact O-N 3.14Å; T159-G161 PolarHBondContact O-N 3.28Å; T159-Q162 PolarHBondContact O-N 3.05Å; T159-Q162 VanDerWaalsContact O-N 3.12Å; T159-D163 PolarHBondContact O-N 3.49Å
160	Q	94.6	Very high	93.8	Very high	114 Å²	114	47 Å²	47	53%	0.533	25%	0.254	S	S	.	.	H	α-helix	trans	-65	-26.4	-179.6	-65.1	171.5	-21.8	0	0	112.6	H158 F164 Y200	H158-Q160 PolarHBondContact O-N 2.73Å; Q160-F164 WeakPolarHBondContact O-CB 3.25Å; Q160-F164 PolarHBondContact O-N 3.11Å; Q160-Y200 HydrophobicContact CB-CE1 4.4Å; Q160-Y200 WeakPolarHBondContact CB-OH 3.03Å; Q160-Y200 PolarHBondContact OE1-OH 3.19Å
161	G	94.4	Very high	94.2	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-71.9	-42.5	175.8	0	0	0	0	0	110.9	H158 T159 F164 V165 M189	H158-G161 PolarHBondContact ND1-N 2.9Å; H158-G161 WeakPolarHBondContact O-CA 3.49Å; H158-G161 PolarHBondContact O-N 2.86Å; T159-G161 PolarHBondContact O-N 3.28Å; G161-F164 WeakPolarHBondContact O-CB 3.43Å; G161-F164 PolarHBondContact O-N 2.79Å; G161-V165 WeakPolarHBondContact O-CG2 3.01Å; G161-V165 PolarHBondContact O-N 2.95Å; G161-M189 VanDerWaalsContact CA-SD 3.58Å; G161-M189 VanDerWaalsContact O-SD 3.39Å
162	Q	95.6	Very high	94.6	Very high	85 Å²	85	47.8 Å²	47.8	40%	0.397	25%	0.252	S	S	.	.	H	α-helix	trans	-64.8	-41.5	174.9	-67.1	-171.7	-15.3	0	0	111.9	L156 H158 T159 F164 V165 Q166 I186 M189	L156-Q162 PolarHBondContact O-NE2 2.95Å; H158-Q162 PolarHBondContact O-N 3.28Å; T159-Q162 PolarHBondContact O-N 3.05Å; T159-Q162 VanDerWaalsContact O-N 3.12Å; Q162-F164 VanDerWaalsContact C-N 3.29Å; Q162-F164 PolarHBondContact O-N 3.21Å; Q162-V165 PolarHBondContact O-N 3.37Å; Q162-Q166 PolarHBondContact O-N 2.91Å; Q162-I186 HydrophobicContact CG-CD1 4.08Å; Q162-M189 HydrophobicContact CG-CE 4.18Å
163	D	96.1	Very high	94.8	Very high	95 Å²	95	46.3 Å²	46.3	51%	0.508	24%	0.242	S	C	.	.	H	α-helix	trans	-61.5	-39.4	174.7	-67.4	-25.1	0	0	0	111.5	T159 Q166 T167	T159-D163 PolarHBondContact O-N 3.49Å; D163-Q166 PolarHBondContact O-N 3.01Å; D163-T167 WeakPolarHBondContact O-CB 3.25Å; D163-T167 PolarHBondContact O-N 3.3Å; D163-T167 PolarHBondContact O-OG1 2.96Å
164	F	97.3	Very high	94.9	Very high	10 Å²	10	52.3 Å²	52.3	4%	0.044	27%	0.274	C	S	.	.	H	α-helix	trans	-63.4	-43.2	173.3	178.2	-98.4	0	0	0	112.5	Q160 G161 Q162 T167 S168 Y200 A202 S231 T234 P237	Q160-F164 WeakPolarHBondContact O-CB 3.25Å; Q160-F164 PolarHBondContact O-N 3.11Å; G161-F164 WeakPolarHBondContact O-CB 3.43Å; G161-F164 PolarHBondContact O-N 2.79Å; Q162-F164 VanDerWaalsContact C-N 3.29Å; Q162-F164 PolarHBondContact O-N 3.21Å; F164-T167 PolarHBondContact O-N 3.29Å; F164-S168 WeakPolarHBondContact O-CB 3.42Å; F164-S168 PolarHBondContact O-N 2.87Å; F164-S168 PolarHBondContact O-OG 3.01Å; F164-Y200 HydrophobicContact CB-CD2 4.46Å; F164-Y200 HydrophobicContact CB-CG 4.37Å; F164-Y200 HydrophobicContact CD1-CG 4.47Å; F164-Y200 HydrophobicContact CD2-CD2 4.22Å; F164-Y200 HydrophobicContact CD2-CG 4.4Å; F164-Y200 HydrophobicContact CG-CD2 4.34Å; F164-Y200 HydrophobicContact CG-CG 4.17Å; F164-A202 HydrophobicContact CD1-CB 4.07Å; F164-A202 HydrophobicContact CE1-CB 4.12Å; F164-S231 WeakPolarHBondContact CE1-OG 3.45Å; F164-T234 WeakPolarHBondContact CD2-O 3.42Å; F164-T234 WeakPolarHBondContact CE2-O 3.19Å; F164-P237 HydrophobicContact CE2-CB 3.65Å; F164-P237 HydrophobicContact CE2-CG 4.44Å; F164-P237 HydrophobicContact CZ-CB 3.7Å
165	V	97.5	Very high	95	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-61.8	-44.3	174	171.1	0	0	0	0	110.9	G161 Q162 T167 S168 L169 L183 I186 M189 A202 F204	G161-V165 WeakPolarHBondContact O-CG2 3.01Å; G161-V165 PolarHBondContact O-N 2.95Å; Q162-V165 PolarHBondContact O-N 3.37Å; V165-T167 VanDerWaalsContact C-N 3.33Å; V165-T167 PolarHBondContact O-N 2.88Å; V165-S168 WeakPolarHBondContact O-CB 3.26Å; V165-S168 PolarHBondContact O-N 2.96Å; V165-S168 VanDerWaalsContact O-N 3.16Å; V165-L169 PolarHBondContact O-N 3.47Å; V165-L183 HydrophobicContact CG1-CD1 4.04Å; V165-L183 HydrophobicContact CG1-CD2 4.17Å; V165-I186 HydrophobicContact CB-CD1 4.3Å; V165-I186 HydrophobicContact CG1-CD1 4.19Å; V165-I186 HydrophobicContact CG1-CG1 4.18Å; V165-I186 HydrophobicContact CG2-CD1 4.21Å; V165-I186 HydrophobicContact CG2-CG2 4.37Å; V165-M189 HydrophobicContact CG2-CG 4.36Å; V165-M189 HydrophobicContact CG2-SD 3.97Å; V165-A202 HydrophobicContact CG2-CB 3.51Å; V165-F204 HydrophobicContact CG1-CB 4.17Å; V165-F204 HydrophobicContact CG1-CD1 4.19Å; V165-F204 HydrophobicContact CG1-CD2 4.4Å; V165-F204 HydrophobicContact CG1-CG 4.01Å
166	Q	96.4	Very high	94.9	Very high	96 Å²	96	56.8 Å²	56.8	45%	0.449	29%	0.292	S	S	.	.	H	α-helix	trans	-62.8	-41.9	178.8	-176.3	62.3	16.2	0	0	111.5	Q162 D163 S168 L169 I170	Q162-Q166 PolarHBondContact O-N 2.91Å; D163-Q166 PolarHBondContact O-N 3.01Å; Q166-S168 VanDerWaalsContact C-N 3.31Å; Q166-S168 PolarHBondContact O-N 3.1Å; Q166-L169 PolarHBondContact O-N 3Å; Q166-I170 HydrophobicContact CG-CD1 4.21Å; Q166-I170 VanDerWaalsContact O-CG1 3.3Å; Q166-I170 WeakPolarHBondContact O-CG1 3.45Å; Q166-I170 PolarHBondContact O-N 3.38Å
167	T	97.2	Very high	94.8	Very high	61 Å²	61	64.1 Å²	64.1	37%	0.374	33%	0.326	S	S	.	.	H	α-helix	trans	-62.6	-40.6	175	-56.7	0	0	0	0	111	D163 F164 V165 I170 K171 P237	D163-T167 WeakPolarHBondContact O-CB 3.25Å; D163-T167 PolarHBondContact O-N 3.3Å; D163-T167 PolarHBondContact O-OG1 2.96Å; F164-T167 PolarHBondContact O-N 3.29Å; V165-T167 VanDerWaalsContact C-N 3.33Å; V165-T167 PolarHBondContact O-N 2.88Å; T167-I170 PolarHBondContact O-N 3.42Å; T167-K171 PolarHBondContact O-N 3.33Å; T167-P237 HydrophobicContact CG2-CG 4.15Å
168	S	97.8	Very high	94.6	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-63	-43	175.7	-56.3	0	0	0	0	111.8	F164 V165 Q166 K171 L172 S231 P237	F164-S168 WeakPolarHBondContact O-CB 3.42Å; F164-S168 PolarHBondContact O-N 2.87Å; F164-S168 PolarHBondContact O-OG 3.01Å; V165-S168 WeakPolarHBondContact O-CB 3.26Å; V165-S168 PolarHBondContact O-N 2.96Å; V165-S168 VanDerWaalsContact O-N 3.16Å; Q166-S168 VanDerWaalsContact C-N 3.31Å; Q166-S168 PolarHBondContact O-N 3.1Å; S168-K171 PolarHBondContact O-N 3.16Å; S168-L172 PolarHBondContact O-N 3.14Å; S168-S231 VanDerWaalsContact OG-CB 3.24Å; S168-S231 WeakPolarHBondContact OG-CB 2.97Å; S168-S231 PolarHBondContact OG-OG 3.25Å; S168-P237 WeakPolarHBondContact OG-CB 3.13Å
169	L	96.4	Very high	94.4	Very high	12 Å²	12	68.6 Å²	68.6	6%	0.063	35%	0.352	C	S	.	.	H	α-helix	trans	-64.8	-42	176.9	179.6	65.1	0	0	0	112.2	V165 Q166 K171 L172 N173 L183 V206	V165-L169 PolarHBondContact O-N 3.47Å; Q166-L169 PolarHBondContact O-N 3Å; L169-K171 VanDerWaalsContact C-N 3.32Å; L169-K171 PolarHBondContact O-N 3.46Å; L169-L172 HydrophobicContact CD1-CD2 4.42Å; L169-L172 PolarHBondContact O-N 2.83Å; L169-N173 PolarHBondContact O-N 3.5Å; L169-L183 HydrophobicContact CD2-CB 4.05Å; L169-V206 HydrophobicContact CD1-CG1 4.06Å
170	I	95.2	Very high	94.4	Very high	83 Å²	83	66.4 Å²	66.4	43%	0.426	34%	0.339	S	S	.	.	H	α-helix	trans	-60.5	-45.3	175.7	-69.5	164.2	0	0	0	110.1	Q166 T167 N173 N174	Q166-I170 HydrophobicContact CG-CD1 4.21Å; Q166-I170 VanDerWaalsContact O-CG1 3.3Å; Q166-I170 WeakPolarHBondContact O-CG1 3.45Å; Q166-I170 PolarHBondContact O-N 3.38Å; T167-I170 PolarHBondContact O-N 3.42Å; I170-N173 PolarHBondContact O-N 3.38Å; I170-N174 VanDerWaalsContact O-CG 3.27Å; I170-N174 PolarHBondContact O-N 2.99Å; I170-N174 PolarHBondContact O-ND2 3.46Å
171	K	96.3	Very high	94.4	Very high	45 Å²	45	62 Å²	62	20%	0.196	32%	0.317	C	S	.	.	H	α-helix	trans	-60.8	-47.8	177.3	-174.1	172	-177.5	167.2	0	111.9	T167 S168 L169 N173 N174 E175 D236 P237 V239	T167-K171 PolarHBondContact O-N 3.33Å; S168-K171 PolarHBondContact O-N 3.16Å; L169-K171 VanDerWaalsContact C-N 3.32Å; L169-K171 PolarHBondContact O-N 3.46Å; K171-N173 VanDerWaalsContact C-N 3.32Å; K171-N173 PolarHBondContact O-N 3.44Å; K171-N174 PolarHBondContact O-N 3.36Å; K171-E175 WeakPolarHBondContact CE-OE1 3.45Å; K171-E175 WeakPolarHBondContact CG-OE1 3.29Å; K171-E175 WeakPolarHBondContact O-CG 3.47Å; K171-E175 PolarHBondContact O-N 3.32Å; K171-E175 VanDerWaalsContact O-N 3.08Å; K171-D236 IonicContact NZ-OD1 2.67Å; K171-D236 PolarHBondContact NZ-OD1 2.86Å; K171-D236 IonicContact NZ-OD2 3.43Å; K171-P237 HydrophobicContact CD-CG 4.4Å; K171-P237 WeakPolarHBondContact CD-O 3.15Å; K171-P237 WeakPolarHBondContact CE-O 3.13Å; K171-P237 PolarHBondContact NZ-O 2.95Å; K171-V239 HydrophobicContact CD-CG2 4.43Å
172	L	95.9	Very high	94.4	Very high	19 Å²	19	62.4 Å²	62.4	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-53.5	-48.7	175.9	174.5	64.3	0	0	0	111.9	S168 L169 E175 T176 Y181 V206 V239	S168-L172 PolarHBondContact O-N 3.14Å; L169-L172 HydrophobicContact CD1-CD2 4.42Å; L169-L172 PolarHBondContact O-N 2.83Å; L172-E175 PolarHBondContact O-N 2.98Å; L172-T176 WeakPolarHBondContact O-CB 3.41Å; L172-T176 PolarHBondContact O-N 3.38Å; L172-T176 PolarHBondContact O-OG1 3.5Å; L172-Y181 HydrophobicContact CD2-CD2 3.93Å; L172-Y181 HydrophobicContact CD2-CG 4.4Å; L172-Y181 HydrophobicContact CG-CD2 4.16Å; L172-V206 HydrophobicContact CD2-CG1 4.11Å; L172-V239 HydrophobicContact CB-CG1 4.35Å
173	N	94.9	Very high	94.4	Very high	36 Å²	36	61 Å²	61	19%	0.193	32%	0.315	C	S	.	.	H	α-helix	trans	-69.4	-31.9	-178.4	-77.4	-28.1	0	0	0	113	L169 I170 K171 E175 Y181	L169-N173 PolarHBondContact O-N 3.5Å; I170-N173 PolarHBondContact O-N 3.38Å; K171-N173 VanDerWaalsContact C-N 3.32Å; K171-N173 PolarHBondContact O-N 3.44Å; N173-E175 VanDerWaalsContact C-N 3.32Å; N173-Y181 PolarHBondContact ND2-O 2.87Å; N173-Y181 PolarHBondContact OD1-N 3.22Å
174	N	94.3	Very high	94.2	Very high	132 Å²	132	59.7 Å²	59.7	71%	0.706	31%	0.307	S	S	*	.	H	α-helix	trans	-69.8	-30.7	175	-73.2	-19.9	0	0	0	112.6	I170 K171	I170-N174 VanDerWaalsContact O-CG 3.27Å; I170-N174 PolarHBondContact O-N 2.99Å; I170-N174 PolarHBondContact O-ND2 3.46Å; K171-N174 PolarHBondContact O-N 3.36Å
175	E	93.4	Very high	93.9	Very high	126 Å²	126	59.4 Å²	59.4	59%	0.589	31%	0.306	S	S	*	.	H	α-helix	trans	-89.1	-20.3	179.7	-67.6	175.7	-176.9	0	0	112.6	K171 L172 N173	K171-E175 WeakPolarHBondContact CE-OE1 3.45Å; K171-E175 WeakPolarHBondContact CG-OE1 3.29Å; K171-E175 WeakPolarHBondContact O-CG 3.47Å; K171-E175 PolarHBondContact O-N 3.32Å; K171-E175 VanDerWaalsContact O-N 3.08Å; L172-E175 PolarHBondContact O-N 2.98Å; N173-E175 VanDerWaalsContact C-N 3.32Å
176	T	91.4	Very high	93.9	Very high	38 Å²	38	60.2 Å²	60.2	23%	0.233	31%	0.31	C	S	.	.			trans	-83.8	132.3	177.1	-57.4	0	0	0	0	110.9	L172 L179 Y181	L172-T176 WeakPolarHBondContact O-CB 3.41Å; L172-T176 PolarHBondContact O-N 3.38Å; L172-T176 PolarHBondContact O-OG1 3.5Å; T176-L179 HydrophobicContact CG2-CB 4.01Å; T176-L179 WeakPolarHBondContact CG2-O 3.34Å; T176-Y181 HydrophobicContact CG2-CE2 3.86Å
177	Q	88.4	Confident	93.7	Very high	161 Å²	161	55.8 Å²	55.8	75%	0.752	29%	0.291	S	S	*	.	S	Bend	trans	-99.2	141.7	174.2	-62.3	-176.5	0.9	0	0	110.8	L179	Q177-L179 PolarHBondContact O-N 2.72Å
178	N	85.8	Confident	93.6	Very high	164 Å²	164	53.5 Å²	53.5	88%	0.877	28%	0.275	S	S	*	.	S	Bend	trans	66.3	-5.2	172.1	-49	-52.6	0	0	0	117.3
179	L	89.8	Confident	93.5	Very high	63 Å²	63	53.6 Å²	53.6	33%	0.33	28%	0.276	S	S	.	.			trans	-129.6	144.8	175.5	-65.3	174.7	0	0	0	109.1	T176 Q177 E208	T176-L179 HydrophobicContact CG2-CB 4.01Å; T176-L179 WeakPolarHBondContact CG2-O 3.34Å; Q177-L179 PolarHBondContact O-N 2.72Å; L179-E208 HydrophobicContact CD2-CG 4.26Å; L179-E208 WeakPolarHBondContact CD2-OE1 3.44Å
180	T	93.4	Very high	93.4	Very high	53 Å²	53	53.7 Å²	53.7	33%	0.325	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	137.3	170	-49.5	0	0	0	0	108.8	A209 C211	T180-A209 PolarHBondContact O-N 2.95Å; T180-C211 WeakPolarHBondContact CG2-SG 3.46Å
181	Y	94.8	Very high	93.4	Very high	20 Å²	20	50.3 Å²	50.3	8%	0.078	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	146	177.3	-64.4	-68.1	0	0	0	111.2	L172 N173 T176 V206 V207 A225 M243	L172-Y181 HydrophobicContact CD2-CD2 3.93Å; L172-Y181 HydrophobicContact CD2-CG 4.4Å; L172-Y181 HydrophobicContact CG-CD2 4.16Å; N173-Y181 PolarHBondContact ND2-O 2.87Å; N173-Y181 PolarHBondContact OD1-N 3.22Å; T176-Y181 HydrophobicContact CG2-CE2 3.86Å; Y181-V206 HydrophobicContact CD1-CB 4.32Å; Y181-V206 HydrophobicContact CD1-CG2 4.18Å; Y181-V206 HydrophobicContact CG-CB 4.31Å; Y181-V206 HydrophobicContact CG-CG2 4.33Å; Y181-V207 WeakPolarHBondContact CA-O 3.42Å; Y181-A225 HydrophobicContact CE1-CB 4.36Å; Y181-M243 HydrophobicContact CD1-CE 4.46Å; Y181-M243 HydrophobicContact CE1-CE 3.55Å
182	S	94.9	Very high	93.2	Very high	10 Å²	10	51.7 Å²	51.7	7%	0.07	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	151.2	166.6	61	0	0	0	0	109.8	L184 V206 V207 P218	S182-L184 PolarHBondContact O-N 3.08Å; S182-V206 WeakPolarHBondContact O-CA 3.47Å; S182-V207 PolarHBondContact N-O 3.5Å; S182-V207 PolarHBondContact O-N 2.79Å; S182-V207 WeakPolarHBondContact OG-CG1 3.36Å; S182-V207 PolarHBondContact OG-O 3.32Å; S182-P218 WeakPolarHBondContact OG-CG 3.45Å
183	L	95.1	Very high	93	Very high	57 Å²	57	54.9 Å²	54.9	30%	0.298	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	120	171.7	-177.3	65.2	0	0	0	109.1	V165 L169 E185 I186 F204	V165-L183 HydrophobicContact CG1-CD1 4.04Å; V165-L183 HydrophobicContact CG1-CD2 4.17Å; L169-L183 HydrophobicContact CD2-CB 4.05Å; L183-E185 WeakPolarHBondContact CD1-O 3.15Å; L183-I186 HydrophobicContact CD1-CG1 4.27Å; L183-I186 HydrophobicContact CD2-CD1 4.31Å; L183-I186 HydrophobicContact CD2-CG1 3.92Å; L183-F204 HydrophobicContact CD1-CB 3.74Å; L183-F204 HydrophobicContact CD1-CD2 3.86Å; L183-F204 HydrophobicContact CD1-CG 4.18Å
184	L	92.1	Very high	92.8	Very high	66 Å²	66	56.2 Å²	56.2	35%	0.346	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-46.5	170.4	-176.2	63.2	0	0	0	110.3	L97 S182 V205 V207	L97-L184 HydrophobicContact CD1-CD2 3.87Å; S182-L184 PolarHBondContact O-N 3.08Å; L184-V205 HydrophobicContact CB-CB 4.27Å; L184-V205 HydrophobicContact CB-CG1 4.11Å; L184-V205 WeakPolarHBondContact CB-O 3.41Å; L184-V205 HydrophobicContact CD2-CG1 3.8Å; L184-V205 HydrophobicContact CG-CG1 4.48Å; L184-V205 PolarHBondContact N-O 2.94Å; L184-V207 HydrophobicContact CB-CG1 4.06Å; L184-V207 HydrophobicContact CD1-CG1 4.27Å
185	E	91.9	Very high	92.5	Very high	5 Å²	5	55.4 Å²	55.4	2%	0.023	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	145.1	-172.7	-177.8	178.2	148.3	0	0	111	H59 G60 H95 L183 F204 V205 H281	H59-E185 WeakPolarHBondContact CB-OE1 3.34Å; H59-E185 IonicContact CE1-OE2 3.81Å; H59-E185 IonicContact CG-OE2 3.51Å; H59-E185 IonicContact ND1-OE2 2.72Å; H59-E185 PolarHBondContact ND1-OE2 2.03Å; G60-E185 PolarHBondContact N-OE1 2.9Å; H95-E185 IonicContact NE2-OE1 3.96Å; H95-E185 IonicContact NE2-OE2 3.83Å; L183-E185 WeakPolarHBondContact CD1-O 3.15Å; E185-F204 CarbonylContact O-C 3.52Å; E185-F204 WeakPolarHBondContact O-CA 2.95Å; E185-F204 WeakPolarHBondContact O-CB 3.48Å; E185-V205 HydrophobicContact CB-CB 4.43Å; E185-V205 PolarHBondContact N-O 2.72Å; E185-V205 PolarHBondContact O-N 3.22Å; E185-H281 IonicContact OE1-CD2 2.73Å; E185-H281 PolarHBondContact OE1-CD2 3.22Å; E185-H281 IonicContact OE1-CE1 3.42Å; E185-H281 PolarHBondContact OE1-CE1 2.91Å; E185-H281 IonicContact OE1-CG 3.28Å; E185-H281 IonicContact OE1-ND1 3.98Å; E185-H281 PolarHBondContact OE1-ND1 2.72Å; E185-H281 IonicContact OE1-NE2 3.41Å; E185-H281 PolarHBondContact OE1-NE2 2.96Å
186	I	95.8	Very high	92.3	Very high	17 Å²	17	52.9 Å²	52.9	9%	0.087	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	113.5	163.4	-54.4	-178.8	0	0	0	106.9	L156 Q162 V165 L183 M189 H281	L156-I186 HydrophobicContact CD2-CB 4.4Å; L156-I186 HydrophobicContact CD2-CG2 3.94Å; Q162-I186 HydrophobicContact CG-CD1 4.08Å; V165-I186 HydrophobicContact CB-CD1 4.3Å; V165-I186 HydrophobicContact CG1-CD1 4.19Å; V165-I186 HydrophobicContact CG1-CG1 4.18Å; V165-I186 HydrophobicContact CG2-CD1 4.21Å; V165-I186 HydrophobicContact CG2-CG2 4.37Å; L183-I186 HydrophobicContact CD1-CG1 4.27Å; L183-I186 HydrophobicContact CD2-CD1 4.31Å; L183-I186 HydrophobicContact CD2-CG1 3.92Å; I186-M189 HydrophobicContact CD1-SD 4.43Å; I186-M189 HydrophobicContact CG2-CE 4.27Å; I186-M189 HydrophobicContact CG2-CG 3.59Å; I186-M189 HydrophobicContact CG2-SD 4Å; I186-H281 PolarHBondContact O-NE2 2.98Å
187	G	93.5	Very high	92.3	Very high	4 Å²	4	55.6 Å²	55.6	4%	0.041	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-51.1	179.1	0	0	0	0	0	111	E203 H281	G187-E203 WeakPolarHBondContact CA-O 3.41Å; G187-E203 PolarHBondContact N-O 3.32Å; G187-H281 PolarHBondContact O-CD2 3.24Å
188	R	94.8	Very high	92.4	Very high	12 Å²	12	51.4 Å²	51.4	5%	0.045	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	142.7	-173.8	-150.9	174.7	160.3	86.8	10	111.1	Y61 E91 L112 T113 L153 A202 E203	Y61-R188 HydrophobicContact CE2-CB 4.15Å; Y61-R188 WeakPolarHBondContact OH-CB 3.45Å; E91-R188 IonicContact OE1-CZ 2.86Å; E91-R188 IonicContact OE1-NH1 2.86Å; E91-R188 PolarHBondContact OE1-NH1 2.82Å; L112-R188 PolarHBondContact O-NH2 3.49Å; T113-R188 PolarHBondContact O-NH2 2.61Å; L153-R188 HydrophobicContact CD1-CG 3.55Å; R188-A202 CarbonylContact O-C 3.56Å; R188-A202 WeakPolarHBondContact O-CA 3.25Å; R188-E203 HydrophobicContact CB-CB 4.1Å; R188-E203 HydrophobicContact CB-CG 4.4Å; R188-E203 PolarHBondContact N-O 2.95Å; R188-E203 PolarHBondContact O-N 2.6Å
189	M	95.4	Very high	92.9	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	138.5	170.3	-68.1	-169.7	-68.1	0	0	109.2	L153 L154 P155 L156 H158 G161 Q162 V165 I186 K201 A202	L153-M189 WeakPolarHBondContact CD1-O 3.32Å; L154-M189 HydrophobicContact CB-CB 4.13Å; L154-M189 PolarHBondContact N-O 3.2Å; P155-M189 WeakPolarHBondContact O-CE 3.47Å; L156-M189 VanDerWaalsContact O-CE 3.27Å; L156-M189 WeakPolarHBondContact O-CE 3.27Å; H158-M189 HydrophobicContact CB-CE 4.41Å; G161-M189 VanDerWaalsContact CA-SD 3.58Å; G161-M189 VanDerWaalsContact O-SD 3.39Å; Q162-M189 HydrophobicContact CG-CE 4.18Å; V165-M189 HydrophobicContact CG2-CG 4.36Å; V165-M189 HydrophobicContact CG2-SD 3.97Å; I186-M189 HydrophobicContact CD1-SD 4.43Å; I186-M189 HydrophobicContact CG2-CE 4.27Å; I186-M189 HydrophobicContact CG2-CG 3.59Å; I186-M189 HydrophobicContact CG2-SD 4Å; M189-K201 CarbonylContact C-O 3.57Å; M189-K201 WeakPolarHBondContact CA-O 3.28Å; M189-A202 HydrophobicContact CG-CB 4.15Å
190	S	94.8	Very high	93.2	Very high	14 Å²	14	47 Å²	47	10%	0.098	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	162.2	176.5	68.6	0	0	0	0	110	S151 T152 Y200 K201	S151-S190 WeakPolarHBondContact OG-CB 3.02Å; S151-S190 PolarHBondContact OG-OG 2.84Å; T152-S190 CarbonylContact O-C 3.59Å; T152-S190 WeakPolarHBondContact O-CA 3.33Å; T152-S190 WeakPolarHBondContact O-CB 3.4Å; S190-Y200 WeakPolarHBondContact O-CA 3.48Å; S190-K201 PolarHBondContact N-O 2.59Å; S190-K201 PolarHBondContact O-N 3.29Å
191	S	94.5	Very high	93.4	Very high	13 Å²	13	48 Å²	48	9%	0.091	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	151	177.7	71.5	0	0	0	0	113.2	S151 T152 Q198 R199	S151-S191 WeakPolarHBondContact CA-O 3.39Å; S151-S191 PolarHBondContact OG-N 3.24Å; S151-S191 PolarHBondContact OG-O 2.76Å; T152-S191 PolarHBondContact N-O 2.74Å; T152-S191 PolarHBondContact O-N 3.27Å; S191-Q198 PolarHBondContact OG-NE2 3.15Å; S191-R199 CarbonylContact C-O 3.56Å; S191-R199 WeakPolarHBondContact CA-O 3.06Å; S191-R199 WeakPolarHBondContact CB-O 3.47Å
192	Q	93.3	Very high	93.5	Very high	73 Å²	73	47 Å²	47	34%	0.341	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	139.3	-174.6	-168.2	-176.3	30.3	0	0	109.1	G149 V194 R199	G149-Q192 VanDerWaalsContact O-CG 3.31Å; G149-Q192 WeakPolarHBondContact O-CG 3.44Å; G149-Q192 PolarHBondContact O-NE2 2.91Å; Q192-V194 HydrophobicContact CG-CG2 4.04Å; Q192-R199 PolarHBondContact N-O 2.82Å; Q192-R199 PolarHBondContact O-N 2.83Å
193	V	91.5	Very high	93.6	Very high	87 Å²	87	47.6 Å²	47.6	53%	0.527	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	118	170.7	179	0	0	0	0	108.6	E197	V193-E197 WeakPolarHBondContact CA-O 3.48Å
194	V	89.6	Confident	93.7	Very high	64 Å²	64	44.9 Å²	44.9	39%	0.388	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	123.4	176.3	-178.9	0	0	0	0	108.2	Q192 G196 E197	Q192-V194 HydrophobicContact CG-CG2 4.04Å; V194-G196 PolarHBondContact O-N 2.9Å; V194-G196 VanDerWaalsContact O-N 3.15Å; V194-E197 PolarHBondContact N-O 3.23Å; V194-E197 PolarHBondContact O-N 2.05Å
195	A	89.3	Confident	93.9	Very high	114 Å²	114	41.8 Å²	41.8	94%	0.942	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	32.3	-176.7	0	0	0	0	0	114.2	E197	A195-E197 VanDerWaalsContact C-N 3.32Å
196	G	88.4	Confident	94.1	Very high	73 Å²	73	41.5 Å²	41.5	75%	0.753	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.6	-0.3	-179.9	0	0	0	0	0	115.1	V194	V194-G196 PolarHBondContact O-N 2.9Å; V194-G196 VanDerWaalsContact O-N 3.15Å
197	E	90.8	Very high	94	Very high	96 Å²	96	40.8 Å²	40.8	45%	0.449	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	134.8	176.3	-163.6	-176.7	175.9	0	0	110.9	V193 V194 A195 R199 T234	V193-E197 WeakPolarHBondContact CA-O 3.48Å; V194-E197 PolarHBondContact N-O 3.23Å; V194-E197 PolarHBondContact O-N 2.05Å; A195-E197 VanDerWaalsContact C-N 3.32Å; E197-R199 PolarHBondContact O-N 3.19Å; E197-T234 HydrophobicContact CG-CG2 3.97Å; E197-T234 WeakPolarHBondContact OE1-CB 3.46Å; E197-T234 WeakPolarHBondContact OE1-CG2 3.17Å; E197-T234 PolarHBondContact OE1-OG1 2.91Å
198	Q	91.9	Very high	94.1	Very high	73 Å²	73	42.9 Å²	42.9	34%	0.341	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	119.5	175.1	-174	71.5	12.5	0	0	109.8	S191 Y200 T234	S191-Q198 PolarHBondContact OG-NE2 3.15Å; Q198-Y200 HydrophobicContact CG-CE2 3.96Å; Q198-T234 WeakPolarHBondContact O-CG2 3.48Å
199	R	94.9	Very high	94	Very high	105 Å²	105	42.8 Å²	42.8	40%	0.396	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	142	175.9	-55.5	-175.1	71.2	102.4	-1.8	110.3	S191 Q192 E197 G233 T234	S191-R199 CarbonylContact C-O 3.56Å; S191-R199 WeakPolarHBondContact CA-O 3.06Å; S191-R199 WeakPolarHBondContact CB-O 3.47Å; Q192-R199 PolarHBondContact N-O 2.82Å; Q192-R199 PolarHBondContact O-N 2.83Å; E197-R199 PolarHBondContact O-N 3.19Å; R199-G233 WeakPolarHBondContact CA-O 3.4Å; R199-T234 HydrophobicContact CB-CG2 4.44Å; R199-T234 HydrophobicContact CG-CG2 3.9Å
200	Y	96.4	Very high	93.8	Very high	28 Å²	28	47 Å²	47	11%	0.11	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	146.1	173.9	-62.4	-83.5	0	0	0	110.2	L154 Q160 F164 S190 Q198 E232 G233	L154-Y200 HydrophobicContact CD1-CD1 3.92Å; L154-Y200 HydrophobicContact CD1-CE1 3.87Å; Q160-Y200 HydrophobicContact CB-CE1 4.4Å; Q160-Y200 WeakPolarHBondContact CB-OH 3.03Å; Q160-Y200 PolarHBondContact OE1-OH 3.19Å; F164-Y200 HydrophobicContact CB-CD2 4.46Å; F164-Y200 HydrophobicContact CB-CG 4.37Å; F164-Y200 HydrophobicContact CD1-CG 4.47Å; F164-Y200 HydrophobicContact CD2-CD2 4.22Å; F164-Y200 HydrophobicContact CD2-CG 4.4Å; F164-Y200 HydrophobicContact CG-CD2 4.34Å; F164-Y200 HydrophobicContact CG-CG 4.17Å; S190-Y200 WeakPolarHBondContact O-CA 3.48Å; Q198-Y200 HydrophobicContact CG-CE2 3.96Å; Y200-E232 WeakPolarHBondContact O-CA 3.38Å; Y200-G233 PolarHBondContact N-O 2.55Å; Y200-G233 PolarHBondContact O-N 2.77Å
201	K	97.1	Very high	93.5	Very high	74 Å²	74	48.4 Å²	48.4	32%	0.322	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	126.2	164.2	172.3	170.7	-175	153.3	0	108.2	M189 S190 S231 E232	M189-K201 CarbonylContact C-O 3.57Å; M189-K201 WeakPolarHBondContact CA-O 3.28Å; S190-K201 PolarHBondContact N-O 2.59Å; S190-K201 PolarHBondContact O-N 3.29Å; K201-S231 CarbonylContact C-O 3.51Å; K201-S231 VanDerWaalsContact CA-O 3.23Å; K201-S231 WeakPolarHBondContact CA-O 3.3Å; K201-E232 HydrophobicContact CB-CG 4.03Å; K201-E232 HydrophobicContact CD-CG 4Å; K201-E232 VanDerWaalsContact CD-OE1 3.26Å; K201-E232 WeakPolarHBondContact CD-OE1 3.28Å; K201-E232 WeakPolarHBondContact CE-OE1 3.36Å; K201-E232 HydrophobicContact CG-CG 3.79Å; K201-E232 IonicContact NZ-OE1 3.83Å; K201-E232 PolarHBondContact NZ-OE1 3.01Å
202	A	97.3	Very high	93.2	Very high	1 Å²	1	53 Å²	53	1%	0.008	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	144.4	178.1	0	0	0	0	0	111.1	F164 V165 R188 M189 F204 I230 S231	F164-A202 HydrophobicContact CD1-CB 4.07Å; F164-A202 HydrophobicContact CE1-CB 4.12Å; V165-A202 HydrophobicContact CG2-CB 3.51Å; R188-A202 CarbonylContact O-C 3.56Å; R188-A202 WeakPolarHBondContact O-CA 3.25Å; M189-A202 HydrophobicContact CG-CB 4.15Å; A202-F204 HydrophobicContact CB-CD1 4.49Å; A202-I230 CarbonylContact O-C 3.58Å; A202-I230 WeakPolarHBondContact O-CA 3.14Å; A202-S231 PolarHBondContact N-O 2.86Å; A202-S231 PolarHBondContact O-N 3.14Å
203	E	97.8	Very high	92.6	Very high	21 Å²	21	56.5 Å²	56.5	10%	0.098	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	120.6	172	-60	-177.4	-148.3	0	0	107.2	Y61 R108 G187 R188 C229 I230	Y61-E203 VanDerWaalsContact CE1-OE2 3.25Å; Y61-E203 WeakPolarHBondContact CE1-OE2 3.39Å; Y61-E203 VanDerWaalsContact CZ-OE2 3.24Å; Y61-E203 WeakPolarHBondContact OH-CB 3.41Å; Y61-E203 PolarHBondContact OH-OE2 2.86Å; R108-E203 IonicContact CZ-OE1 2.61Å; R108-E203 IonicContact CZ-OE2 3.79Å; R108-E203 IonicContact NE-OE1 3.76Å; R108-E203 IonicContact NH2-OE1 2.68Å; R108-E203 PolarHBondContact NH2-OE1 3.11Å; R108-E203 IonicContact NH2-OE2 3.5Å; R108-E203 PolarHBondContact NH2-OE2 2.93Å; G187-E203 WeakPolarHBondContact CA-O 3.41Å; G187-E203 PolarHBondContact N-O 3.32Å; R188-E203 HydrophobicContact CB-CB 4.1Å; R188-E203 HydrophobicContact CB-CG 4.4Å; R188-E203 PolarHBondContact N-O 2.95Å; R188-E203 PolarHBondContact O-N 2.6Å; E203-C229 CarbonylContact C-O 3.53Å; E203-C229 VanDerWaalsContact CA-O 3.32Å; E203-C229 WeakPolarHBondContact CA-O 3.3Å; E203-I230 HydrophobicContact CG-CG1 4.28Å
204	F	97.3	Very high	92	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	146.9	-174.4	61.3	-84.8	0	0	0	111.1	V165 L183 E185 A202 V206 C229 V239	V165-F204 HydrophobicContact CG1-CB 4.17Å; V165-F204 HydrophobicContact CG1-CD1 4.19Å; V165-F204 HydrophobicContact CG1-CD2 4.4Å; V165-F204 HydrophobicContact CG1-CG 4.01Å; L183-F204 HydrophobicContact CD1-CB 3.74Å; L183-F204 HydrophobicContact CD1-CD2 3.86Å; L183-F204 HydrophobicContact CD1-CG 4.18Å; E185-F204 CarbonylContact O-C 3.52Å; E185-F204 WeakPolarHBondContact O-CA 2.95Å; E185-F204 WeakPolarHBondContact O-CB 3.48Å; A202-F204 HydrophobicContact CB-CD1 4.49Å; F204-V206 HydrophobicContact CD2-CG1 3.72Å; F204-V206 HydrophobicContact CE2-CG1 3.61Å; F204-C229 HydrophobicContact CD1-CB 4.24Å; F204-C229 HydrophobicContact CD2-CB 4.03Å; F204-C229 HydrophobicContact CE1-CB 3.8Å; F204-C229 HydrophobicContact CE2-CB 3.57Å; F204-C229 HydrophobicContact CG-CB 4.35Å; F204-C229 HydrophobicContact CZ-CB 3.44Å; F204-C229 VanDerWaalsContact CZ-CB 3.44Å; F204-C229 PolarHBondContact N-O 3.31Å; F204-C229 PolarHBondContact O-N 2.86Å; F204-V239 HydrophobicContact CZ-CG1 4.19Å
205	V	96.3	Very high	91.8	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.006	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	133	-179.7	-176.5	0	0	0	0	109.3	H95 L97 L184 E185 G227	H95-V205 VanDerWaalsContact CD2-CG2 3.49Å; H95-V205 WeakPolarHBondContact CD2-CG2 3.5Å; H95-V205 WeakPolarHBondContact NE2-CG2 3.45Å; L97-V205 HydrophobicContact CD1-CG1 4.14Å; L184-V205 HydrophobicContact CB-CB 4.27Å; L184-V205 HydrophobicContact CB-CG1 4.11Å; L184-V205 WeakPolarHBondContact CB-O 3.41Å; L184-V205 HydrophobicContact CD2-CG1 3.8Å; L184-V205 HydrophobicContact CG-CG1 4.48Å; L184-V205 PolarHBondContact N-O 2.94Å; E185-V205 HydrophobicContact CB-CB 4.43Å; E185-V205 PolarHBondContact N-O 2.72Å; E185-V205 PolarHBondContact O-N 3.22Å; V205-G227 WeakPolarHBondContact CA-O 3.26Å; V205-G227 WeakPolarHBondContact CG1-O 3.09Å
206	V	95.7	Very high	91.7	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	150.3	176.4	-64.6	0	0	0	0	110.8	L169 L172 Y181 S182 F204 R226 G227 M243	L169-V206 HydrophobicContact CD1-CG1 4.06Å; L172-V206 HydrophobicContact CD2-CG1 4.11Å; Y181-V206 HydrophobicContact CD1-CB 4.32Å; Y181-V206 HydrophobicContact CD1-CG2 4.18Å; Y181-V206 HydrophobicContact CG-CB 4.31Å; Y181-V206 HydrophobicContact CG-CG2 4.33Å; S182-V206 WeakPolarHBondContact O-CA 3.47Å; F204-V206 HydrophobicContact CD2-CG1 3.72Å; F204-V206 HydrophobicContact CE2-CG1 3.61Å; V206-R226 VanDerWaalsContact O-CA 3.32Å; V206-R226 WeakPolarHBondContact O-CA 3.46Å; V206-G227 PolarHBondContact N-O 2.82Å; V206-G227 PolarHBondContact O-N 3.36Å; V206-M243 HydrophobicContact CG2-SD 4.4Å
207	V	94.4	Very high	91.8	Very high	2 Å²	2	59.1 Å²	59.1	1%	0.012	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	141	171.9	60.6	0	0	0	0	109.2	Y181 S182 L184 A209 P218 A224 A225 R226	Y181-V207 WeakPolarHBondContact CA-O 3.42Å; S182-V207 PolarHBondContact N-O 3.5Å; S182-V207 PolarHBondContact O-N 2.79Å; S182-V207 WeakPolarHBondContact OG-CG1 3.36Å; S182-V207 PolarHBondContact OG-O 3.32Å; L184-V207 HydrophobicContact CB-CG1 4.06Å; L184-V207 HydrophobicContact CD1-CG1 4.27Å; V207-A209 PolarHBondContact O-N 3.39Å; V207-P218 HydrophobicContact CG1-CB 3.7Å; V207-P218 HydrophobicContact CG1-CG 4.38Å; V207-A224 HydrophobicContact CG2-CB 4.18Å; V207-A225 CarbonylContact C-O 3.52Å; V207-A225 WeakPolarHBondContact CA-O 3.41Å; V207-R226 HydrophobicContact CB-CG 4.06Å; V207-R226 HydrophobicContact CG2-CG 3.74Å
208	E	94.3	Very high	91.8	Very high	48 Å²	48	57.6 Å²	57.6	22%	0.224	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.4	138.9	172.8	-170.2	-177.2	170.8	0	0	110.4	L179 L219 A224 A225	L179-E208 HydrophobicContact CD2-CG 4.26Å; L179-E208 WeakPolarHBondContact CD2-OE1 3.44Å; E208-L219 HydrophobicContact CB-CD1 4.09Å; E208-L219 HydrophobicContact CG-CD1 3.65Å; E208-L219 HydrophobicContact CG-CG 4.46Å; E208-L219 WeakPolarHBondContact O-CB 3.35Å; E208-L219 WeakPolarHBondContact O-CG 3.35Å; E208-L219 PolarHBondContact O-N 3.2Å; E208-A224 HydrophobicContact CB-CB 4.38Å; E208-A225 HydrophobicContact CB-CB 4.27Å; E208-A225 PolarHBondContact N-O 2.67Å; E208-A225 PolarHBondContact OE2-N 2.93Å; E208-A225 VanDerWaalsContact OE2-N 3.09Å
209	A	93.6	Very high	91.7	Very high	10 Å²	10	56.9 Å²	56.9	8%	0.083	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	149.1	-172.2	0	0	0	0	0	111.4	T180 V207 C216 T217	T180-A209 PolarHBondContact O-N 2.95Å; V207-A209 PolarHBondContact O-N 3.39Å; A209-C216 HydrophobicContact CB-CB 4.2Å; A209-T217 CarbonylContact C-O 3.55Å; A209-T217 WeakPolarHBondContact CA-O 3.46Å; A209-T217 WeakPolarHBondContact CB-O 3.4Å
210	N	91.4	Very high	91.1	Very high	89 Å²	89	57.5 Å²	57.5	48%	0.476	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	126.7	167.1	-173.5	18.3	0	0	0	109.2	C216 T217 L219	N210-C216 WeakPolarHBondContact O-CA 3.48Å; N210-T217 PolarHBondContact N-O 3.27Å; N210-T217 PolarHBondContact O-N 3.11Å; N210-T217 PolarHBondContact O-OG1 3.33Å; N210-L219 HydrophobicContact CB-CD2 4.14Å
211	C	88.1	Confident	90.3	Very high	45 Å²	45	60 Å²	60	30%	0.304	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	124.6	-177	-54.1	0	0	0	0	111.1	T180 T215 C216	T180-C211 WeakPolarHBondContact CG2-SG 3.46Å; C211-T215 WeakPolarHBondContact CA-O 3.21Å; C211-C216 HydrophobicContact CB-CB 4.13Å; C211-C216 WeakPolarHBondContact CB-SG 3.41Å; C211-C216 WeakPolarHBondContact SG-CB 3.49Å; C211-C216 CovalentContact SG-SG 2.04Å; C211-C216 PolarHBondContact SG-SG 3.19Å
212	I	87	Confident	89.4	Confident	109 Å²	109	61.4 Å²	61.4	56%	0.559	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.8	120.5	175.3	-57.3	174.8	0	0	0	107.5	D214 T215	I212-D214 PolarHBondContact O-N 3.03Å; I212-T215 PolarHBondContact N-O 3.1Å; I212-T215 WeakPolarHBondContact O-CB 3.45Å; I212-T215 PolarHBondContact O-N 3.25Å
213	N	82.4	Confident	88.6	Confident	147 Å²	147	65.3 Å²	65.3	79%	0.786	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	56.9	179.7	-59.4	-23.4	0	0	0	112.5	T215	N213-T215 PolarHBondContact O-N 3Å
214	D	78.2	Confident	88.2	Confident	167 Å²	167	64.4 Å²	64.4	89%	0.893	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	2.7	-179.1	-51.3	-39.8	0	0	0	116	I212	I212-D214 PolarHBondContact O-N 3.03Å
215	T	85	Confident	87.9	Confident	95 Å²	95	65.5 Å²	65.5	58%	0.583	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	109.8	172.6	-54.7	0	0	0	0	109.4	C211 I212 N213	C211-T215 WeakPolarHBondContact CA-O 3.21Å; I212-T215 PolarHBondContact N-O 3.1Å; I212-T215 WeakPolarHBondContact O-CB 3.45Å; I212-T215 PolarHBondContact O-N 3.25Å; N213-T215 PolarHBondContact O-N 3Å
216	C	87.8	Confident	87.7	Confident	52 Å²	52	67.7 Å²	67.7	35%	0.351	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	128	177.9	-64.4	0	0	0	0	111.3	A209 N210 C211	A209-C216 HydrophobicContact CB-CB 4.2Å; N210-C216 WeakPolarHBondContact O-CA 3.48Å; C211-C216 HydrophobicContact CB-CB 4.13Å; C211-C216 WeakPolarHBondContact CB-SG 3.41Å; C211-C216 WeakPolarHBondContact SG-CB 3.49Å; C211-C216 CovalentContact SG-SG 2.04Å; C211-C216 PolarHBondContact SG-SG 3.19Å
217	T	90.1	Very high	87.6	Confident	79 Å²	79	67.7 Å²	67.7	49%	0.485	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	127.5	174.3	54.2	0	0	0	0	110.5	A209 N210 L219	A209-T217 CarbonylContact C-O 3.55Å; A209-T217 WeakPolarHBondContact CA-O 3.46Å; A209-T217 WeakPolarHBondContact CB-O 3.4Å; N210-T217 PolarHBondContact N-O 3.27Å; N210-T217 PolarHBondContact O-N 3.11Å; N210-T217 PolarHBondContact O-OG1 3.33Å; T217-L219 PolarHBondContact O-N 3.13Å
218	P	90.9	Very high	87.7	Confident	63 Å²	63	68.2 Å²	68.2	41%	0.409	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.9	133.6	174	-25.7	32	0	0	0	112	S182 V207 N220	S182-P218 WeakPolarHBondContact OG-CG 3.45Å; V207-P218 HydrophobicContact CG1-CB 3.7Å; V207-P218 HydrophobicContact CG1-CG 4.38Å; P218-N220 PolarHBondContact O-N 3.39Å
219	L	90.3	Very high	87.9	Confident	59 Å²	59	66 Å²	66	31%	0.309	38%	0.376	S	S	.	.			trans	-72.1	129.2	169.8	-64.9	-175.4	0	0	0	109.7	E208 N210 T217 D221 A224	E208-L219 HydrophobicContact CB-CD1 4.09Å; E208-L219 HydrophobicContact CG-CD1 3.65Å; E208-L219 HydrophobicContact CG-CG 4.46Å; E208-L219 WeakPolarHBondContact O-CB 3.35Å; E208-L219 WeakPolarHBondContact O-CG 3.35Å; E208-L219 PolarHBondContact O-N 3.2Å; N210-L219 HydrophobicContact CB-CD2 4.14Å; T217-L219 PolarHBondContact O-N 3.13Å; L219-D221 VanDerWaalsContact C-N 3.33Å; L219-A224 HydrophobicContact CB-CB 3.64Å; L219-A224 HydrophobicContact CD1-CB 4.45Å
220	N	82.1	Confident	88.1	Confident	117 Å²	117	68.7 Å²	68.7	63%	0.626	39%	0.389	S	S	*	.			trans	-94.3	13.2	178.9	-162.9	25.2	0	0	0	113	P218	P218-N220 PolarHBondContact O-N 3.39Å
221	D	80.3	Confident	88.4	Confident	82 Å²	82	64.5 Å²	64.5	44%	0.439	37%	0.366	S	S	.	.			trans	-76.6	145.9	176.9	-159.1	-35.2	0	0	0	110.5	L219 T223 A224 R226	L219-D221 VanDerWaalsContact C-N 3.33Å; D221-T223 PolarHBondContact O-N 2.9Å; D221-T223 PolarHBondContact OD1-N 3.32Å; D221-T223 PolarHBondContact OD1-OG1 2.67Å; D221-T223 PolarHBondContact OD2-OG1 2.97Å; D221-A224 HydrophobicContact CB-CB 4.41Å; D221-A224 VanDerWaalsContact O-CB 3.29Å; D221-A224 WeakPolarHBondContact O-CB 3.46Å; D221-A224 PolarHBondContact O-N 2.78Å; D221-R226 PolarHBondContact O-NH1 3.46Å; D221-R226 PolarHBondContact O-NH2 2.87Å
222	T	76.4	Confident	88.9	Confident	103 Å²	103	66.2 Å²	66.2	63%	0.632	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-27.8	164.1	56.2	0	0	0	0	112.8
223	T	81.9	Confident	89.2	Confident	82 Å²	82	61.2 Å²	61.2	50%	0.503	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-8.1	177.2	67.1	0	0	0	0	113.9	D221 A225	D221-T223 PolarHBondContact O-N 2.9Å; D221-T223 PolarHBondContact OD1-N 3.32Å; D221-T223 PolarHBondContact OD1-OG1 2.67Å; D221-T223 PolarHBondContact OD2-OG1 2.97Å; T223-A225 PolarHBondContact O-N 2.68Å
224	A	87.9	Confident	89.6	Confident	2 Å²	2	55.7 Å²	55.7	2%	0.017	32%	0.317	C	S	.	.	S	Bend	trans	-61.6	130.1	178.7	0	0	0	0	0	110.1	V207 E208 L219 D221 R226	V207-A224 HydrophobicContact CG2-CB 4.18Å; E208-A224 HydrophobicContact CB-CB 4.38Å; L219-A224 HydrophobicContact CB-CB 3.64Å; L219-A224 HydrophobicContact CD1-CB 4.45Å; D221-A224 HydrophobicContact CB-CB 4.41Å; D221-A224 VanDerWaalsContact O-CB 3.29Å; D221-A224 WeakPolarHBondContact O-CB 3.46Å; D221-A224 PolarHBondContact O-N 2.78Å; A224-R226 PolarHBondContact O-N 2.73Å; A224-R226 PolarHBondContact O-NH1 3.48Å
225	A	91.3	Very high	89.9	Confident	24 Å²	24	54.9 Å²	54.9	20%	0.198	31%	0.312	C	S	.	.			trans	-62.8	127	178.4	0	0	0	0	0	110	Y181 V207 E208 T223 M243	Y181-A225 HydrophobicContact CE1-CB 4.36Å; V207-A225 CarbonylContact C-O 3.52Å; V207-A225 WeakPolarHBondContact CA-O 3.41Å; E208-A225 HydrophobicContact CB-CB 4.27Å; E208-A225 PolarHBondContact N-O 2.67Å; E208-A225 PolarHBondContact OE2-N 2.93Å; E208-A225 VanDerWaalsContact OE2-N 3.09Å; T223-A225 PolarHBondContact O-N 2.68Å; A225-M243 HydrophobicContact CB-CE 3.92Å
226	R	92.4	Very high	90.2	Very high	46 Å²	46	56 Å²	56	17%	0.174	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	149.8	176.2	-68.5	176.2	-177.6	86.9	1	109.1	V206 V207 D221 A224 M243 F244	V206-R226 VanDerWaalsContact O-CA 3.32Å; V206-R226 WeakPolarHBondContact O-CA 3.46Å; V207-R226 HydrophobicContact CB-CG 4.06Å; V207-R226 HydrophobicContact CG2-CG 3.74Å; D221-R226 PolarHBondContact O-NH1 3.46Å; D221-R226 PolarHBondContact O-NH2 2.87Å; A224-R226 PolarHBondContact O-N 2.73Å; A224-R226 PolarHBondContact O-NH1 3.48Å; R226-M243 WeakPolarHBondContact O-CE 3.36Å; R226-F244 HydrophobicContact CB-CD2 3.92Å; R226-F244 PolarHBondContact O-N 2.88Å
227	G	94.5	Very high	90.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	164	177.2	0	0	0	0	0	112.3	V205 V206 K242	V205-G227 WeakPolarHBondContact CA-O 3.26Å; V205-G227 WeakPolarHBondContact CG1-O 3.09Å; V206-G227 PolarHBondContact N-O 2.82Å; V206-G227 PolarHBondContact O-N 3.36Å; G227-K242 CarbonylContact C-O 3.57Å; G227-K242 WeakPolarHBondContact CA-O 3.37Å
228	I	96.8	Very high	90.9	Very high	14 Å²	14	53.2 Å²	53.2	7%	0.072	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	131.4	169.2	-171.8	178	0	0	0	109.1	Y61 H95 C241 K242 F244	Y61-I228 HydrophobicContact CE1-CD1 4.12Å; H95-I228 HydrophobicContact CB-CD1 4.11Å; I228-C241 CarbonylContact O-C 3.47Å; I228-C241 WeakPolarHBondContact O-CA 3.33Å; I228-K242 HydrophobicContact CG2-CB 4.11Å; I228-K242 PolarHBondContact N-O 2.82Å; I228-K242 PolarHBondContact O-N 3.47Å; I228-F244 HydrophobicContact CB-CE1 4.35Å; I228-F244 HydrophobicContact CB-CZ 3.91Å; I228-F244 HydrophobicContact CG2-CE1 3.91Å; I228-F244 HydrophobicContact CG2-CZ 3.99Å
229	C	98	Very high	91.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	137.8	175.7	-61.2	0	0	0	0	110	E203 F204 V239 N240 C241	E203-C229 CarbonylContact C-O 3.53Å; E203-C229 VanDerWaalsContact CA-O 3.32Å; E203-C229 WeakPolarHBondContact CA-O 3.3Å; F204-C229 HydrophobicContact CD1-CB 4.24Å; F204-C229 HydrophobicContact CD2-CB 4.03Å; F204-C229 HydrophobicContact CE1-CB 3.8Å; F204-C229 HydrophobicContact CE2-CB 3.57Å; F204-C229 HydrophobicContact CG-CB 4.35Å; F204-C229 HydrophobicContact CZ-CB 3.44Å; F204-C229 VanDerWaalsContact CZ-CB 3.44Å; F204-C229 PolarHBondContact N-O 3.31Å; F204-C229 PolarHBondContact O-N 2.86Å; C229-V239 HydrophobicContact CB-CG1 4.38Å; C229-N240 CarbonylContact C-O 3.55Å; C229-N240 VanDerWaalsContact CA-O 3.31Å; C229-N240 WeakPolarHBondContact CA-O 3.42Å; C229-C241 HydrophobicContact CB-CB 4.11Å; C229-C241 WeakPolarHBondContact CB-SG 3.45Å; C229-C241 WeakPolarHBondContact SG-CB 3.1Å; C229-C241 CovalentContact SG-SG 2.04Å; C229-C241 PolarHBondContact SG-SG 2.8Å
230	I	98.1	Very high	91.5	Very high	68 Å²	68	54.7 Å²	54.7	35%	0.349	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124.9	171.3	-53.6	179.9	0	0	0	106.7	A202 E203 E232 N240	A202-I230 CarbonylContact O-C 3.58Å; A202-I230 WeakPolarHBondContact O-CA 3.14Å; E203-I230 HydrophobicContact CG-CG1 4.28Å; I230-E232 HydrophobicContact CG2-CG 4.44Å; I230-N240 PolarHBondContact N-O 2.84Å; I230-N240 PolarHBondContact O-N 3.01Å
231	S	97.8	Very high	92.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	142.1	172.6	65.7	0	0	0	0	112.3	F164 S168 K201 A202 S238	F164-S231 WeakPolarHBondContact CE1-OG 3.45Å; S168-S231 VanDerWaalsContact OG-CB 3.24Å; S168-S231 WeakPolarHBondContact OG-CB 2.97Å; S168-S231 PolarHBondContact OG-OG 3.25Å; K201-S231 CarbonylContact C-O 3.51Å; K201-S231 VanDerWaalsContact CA-O 3.23Å; K201-S231 WeakPolarHBondContact CA-O 3.3Å; A202-S231 PolarHBondContact N-O 2.86Å; A202-S231 PolarHBondContact O-N 3.14Å; S231-S238 CarbonylContact C-O 3.55Å; S231-S238 WeakPolarHBondContact CA-O 3.49Å; S231-S238 VanDerWaalsContact CB-O 3.24Å; S231-S238 WeakPolarHBondContact CB-O 3.45Å
232	E	97	Very high	93	Very high	81 Å²	81	51.6 Å²	51.6	38%	0.379	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	135.6	-177.7	-64.4	-176.5	-178	0	0	110.2	Y200 K201 I230 S238	Y200-E232 WeakPolarHBondContact O-CA 3.38Å; K201-E232 HydrophobicContact CB-CG 4.03Å; K201-E232 HydrophobicContact CD-CG 4Å; K201-E232 VanDerWaalsContact CD-OE1 3.26Å; K201-E232 WeakPolarHBondContact CD-OE1 3.28Å; K201-E232 WeakPolarHBondContact CE-OE1 3.36Å; K201-E232 HydrophobicContact CG-CG 3.79Å; K201-E232 IonicContact NZ-OE1 3.83Å; K201-E232 PolarHBondContact NZ-OE1 3.01Å; I230-E232 HydrophobicContact CG2-CG 4.44Å; E232-S238 PolarHBondContact N-O 2.88Å; E232-S238 PolarHBondContact O-N 2.92Å; E232-S238 PolarHBondContact O-OG 2.74Å
233	G	95	Very high	93.8	Very high	4 Å²	4	50 Å²	50	4%	0.041	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.8	-155.3	177.4	0	0	0	0	0	113.8	R199 Y200	R199-G233 WeakPolarHBondContact CA-O 3.4Å; Y200-G233 PolarHBondContact N-O 2.55Å; Y200-G233 PolarHBondContact O-N 2.77Å
234	T	90.3	Very high	94.2	Very high	31 Å²	31	47 Å²	47	19%	0.19	25%	0.252	C	S	.	.	S	Bend	trans	-118.1	-106.3	174.8	64.5	0	0	0	0	109.4	F164 E197 Q198 R199	F164-T234 WeakPolarHBondContact CD2-O 3.42Å; F164-T234 WeakPolarHBondContact CE2-O 3.19Å; E197-T234 HydrophobicContact CG-CG2 3.97Å; E197-T234 WeakPolarHBondContact OE1-CB 3.46Å; E197-T234 WeakPolarHBondContact OE1-CG2 3.17Å; E197-T234 PolarHBondContact OE1-OG1 2.91Å; Q198-T234 WeakPolarHBondContact O-CG2 3.48Å; R199-T234 HydrophobicContact CB-CG2 4.44Å; R199-T234 HydrophobicContact CG-CG2 3.9Å
235	N	84.3	Confident	93.7	Very high	150 Å²	150	51.6 Å²	51.6	80%	0.802	28%	0.284	S	S	*	.	S	Bend	trans	-83.5	-25.7	179.7	-63	-36.5	0	0	0	113.3	P237	N235-P237 WeakPolarHBondContact O-CD 3.28Å
236	D	90.3	Very high	92.5	Very high	120 Å²	120	53.5 Å²	53.5	64%	0.642	29%	0.293	S	S	*	.	S	Bend	trans	-112.1	89.8	173.9	-177.2	23.1	0	0	0	109.2	K171	K171-D236 IonicContact NZ-OD1 2.67Å; K171-D236 PolarHBondContact NZ-OD1 2.86Å; K171-D236 IonicContact NZ-OD2 3.43Å
237	P	95.3	Very high	90.5	Very high	1 Å²	1	58 Å²	58	1%	0.006	32%	0.32	C	S	.	.			trans	-69.7	141.3	-176	25.8	-32.4	0	0	0	111.4	F164 T167 S168 K171 N235 V239	F164-P237 HydrophobicContact CE2-CB 3.65Å; F164-P237 HydrophobicContact CE2-CG 4.44Å; F164-P237 HydrophobicContact CZ-CB 3.7Å; T167-P237 HydrophobicContact CG2-CG 4.15Å; S168-P237 WeakPolarHBondContact OG-CB 3.13Å; K171-P237 HydrophobicContact CD-CG 4.4Å; K171-P237 WeakPolarHBondContact CD-O 3.15Å; K171-P237 WeakPolarHBondContact CE-O 3.13Å; K171-P237 PolarHBondContact NZ-O 2.95Å; N235-P237 WeakPolarHBondContact O-CD 3.28Å; P237-V239 HydrophobicContact CB-CG2 4.29Å; P237-V239 HydrophobicContact CG-CG2 4.41Å
238	S	97.3	Very high	88	Confident	71 Å²	71	64.3 Å²	64.3	50%	0.497	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	141.7	154.6	63.5	0	0	0	0	108.6	S231 E232	S231-S238 CarbonylContact C-O 3.55Å; S231-S238 WeakPolarHBondContact CA-O 3.49Å; S231-S238 VanDerWaalsContact CB-O 3.24Å; S231-S238 WeakPolarHBondContact CB-O 3.45Å; E232-S238 PolarHBondContact N-O 2.88Å; E232-S238 PolarHBondContact O-N 2.92Å; E232-S238 PolarHBondContact O-OG 2.74Å
239	V	97.8	Very high	85.1	Confident	31 Å²	31	68.6 Å²	68.6	19%	0.188	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	127.5	-179.5	-171.8	0	0	0	0	109	K171 L172 F204 C229 P237	K171-V239 HydrophobicContact CD-CG2 4.43Å; L172-V239 HydrophobicContact CB-CG1 4.35Å; F204-V239 HydrophobicContact CZ-CG1 4.19Å; C229-V239 HydrophobicContact CB-CG1 4.38Å; P237-V239 HydrophobicContact CB-CG2 4.29Å; P237-V239 HydrophobicContact CG-CG2 4.41Å
240	N	97.5	Very high	82.2	Confident	122 Å²	122	75.2 Å²	75.2	65%	0.652	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.7	126.6	176.1	-176.1	-7.9	0	0	0	109.5	C229 I230	C229-N240 CarbonylContact C-O 3.55Å; C229-N240 VanDerWaalsContact CA-O 3.31Å; C229-N240 WeakPolarHBondContact CA-O 3.42Å; I230-N240 PolarHBondContact N-O 2.84Å; I230-N240 PolarHBondContact O-N 3.01Å
241	C	96.6	Very high	79.4	Confident	32 Å²	32	78.5 Å²	78.5	22%	0.216	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	129.1	-176.6	-57.3	0	0	0	0	112	I228 C229 M243	I228-C241 CarbonylContact O-C 3.47Å; I228-C241 WeakPolarHBondContact O-CA 3.33Å; C229-C241 HydrophobicContact CB-CB 4.11Å; C229-C241 WeakPolarHBondContact CB-SG 3.45Å; C229-C241 WeakPolarHBondContact SG-CB 3.1Å; C229-C241 CovalentContact SG-SG 2.04Å; C229-C241 PolarHBondContact SG-SG 2.8Å; C241-M243 HydrophobicContact CB-SD 4.33Å
242	K	95.6	Very high	76.3	Confident	102 Å²	102	84.4 Å²	84.4	44%	0.443	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	104	166	-178.9	-172.8	177.6	-169.5	0	108.1	D98 T100 G227 I228	D98-K242 IonicContact OD1-NZ 3.19Å; D98-K242 PolarHBondContact OD1-NZ 2.8Å; D98-K242 WeakPolarHBondContact OD2-CE 3.39Å; D98-K242 IonicContact OD2-NZ 3.94Å; D98-K242 PolarHBondContact OD2-NZ 2.81Å; T100-K242 PolarHBondContact OG1-NZ 2.83Å; G227-K242 CarbonylContact C-O 3.57Å; G227-K242 WeakPolarHBondContact CA-O 3.37Å; I228-K242 HydrophobicContact CG2-CB 4.11Å; I228-K242 PolarHBondContact N-O 2.82Å; I228-K242 PolarHBondContact O-N 3.47Å
243	M	93.4	Very high	73.5	Confident	68 Å²	68	85.3 Å²	85.3	34%	0.335	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	133.9	174.2	-57.4	-52	-68.5	0	0	110.3	Y181 V206 A225 R226 C241	Y181-M243 HydrophobicContact CD1-CE 4.46Å; Y181-M243 HydrophobicContact CE1-CE 3.55Å; V206-M243 HydrophobicContact CG2-SD 4.4Å; A225-M243 HydrophobicContact CB-CE 3.92Å; R226-M243 WeakPolarHBondContact O-CE 3.36Å; C241-M243 HydrophobicContact CB-SD 4.33Å
244	F	90.6	Very high	70.9	Confident	21 Å²	21	92.1 Å²	92.1	9%	0.092	53%	0.527	C	S	.	.	P	Polyproline II helix	trans	-76	135.9	175.3	-52	-40.9	0	0	0	109.5	H95 L97 D98 R226 I228 T246	H95-F244 HydrophobicContact CB-CZ 4.45Å; L97-F244 HydrophobicContact CB-CD2 4Å; L97-F244 HydrophobicContact CB-CE2 3.56Å; L97-F244 HydrophobicContact CB-CZ 4.3Å; D98-F244 HydrophobicContact CB-CD1 4.24Å; D98-F244 HydrophobicContact CB-CE1 3.62Å; D98-F244 HydrophobicContact CB-CZ 4.13Å; R226-F244 HydrophobicContact CB-CD2 3.92Å; R226-F244 PolarHBondContact O-N 2.88Å; I228-F244 HydrophobicContact CB-CE1 4.35Å; I228-F244 HydrophobicContact CB-CZ 3.91Å; I228-F244 HydrophobicContact CG2-CE1 3.91Å; I228-F244 HydrophobicContact CG2-CZ 3.99Å; F244-T246 PolarHBondContact O-N 2.87Å
245	S	78.6	Confident	68.6	Low	97 Å²	97	98.6 Å²	98.6	68%	0.678	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-64.9	121	175.5	-52.9	0	0	0	0	109.4	L247	S245-L247 PolarHBondContact O-N 3.3Å; S245-L247 VanDerWaalsContact O-N 3.11Å
246	T	64.7	Low	66.1	Low	64 Å²	64	97.2 Å²	97.2	39%	0.393	56%	0.562	S	S	.	*			trans	-69.8	106.3	167.8	45	0	0	0	0	107	F244 I248	F244-T246 PolarHBondContact O-N 2.87Å; T246-I248 PolarHBondContact O-N 2.85Å
247	L	50.3	Low	63.9	Low	141 Å²	141	99.8 Å²	99.8	74%	0.738	57%	0.574	S	S	*	*			trans	-67.1	92.1	169.4	-68.6	173.7	0	0	0	107	S245 P249	S245-L247 PolarHBondContact O-N 3.3Å; S245-L247 VanDerWaalsContact O-N 3.11Å; L247-P249 WeakPolarHBondContact O-CD 3.28Å
248	I	41.8	Very low	61.1	Low	133 Å²	133	103.3 Å²	103.3	68%	0.682	61%	0.611	S	S	*	*			trans	-58	125.7	164.1	-59.6	169.8	0	0	0	105.6	T246 L250	T246-I248 PolarHBondContact O-N 2.85Å; I248-L250 PolarHBondContact O-N 2.87Å
249	P	37.3	Very low	57.9	Low	104 Å²	104	105.1 Å²	105.1	68%	0.675	62%	0.623	S	S	*	*			trans	-61.3	111	167.8	-14.1	27.2	0	0	0	106.7	L247 V251	L247-P249 WeakPolarHBondContact O-CD 3.28Å; P249-V251 VanDerWaalsContact C-N 3.34Å; P249-V251 PolarHBondContact O-N 3.22Å
250	L	36.3	Very low	54.9	Low	138 Å²	138	109.3 Å²	109.3	72%	0.723	65%	0.651	S	S	*	*			trans	-60.7	106.2	163.2	-121.2	122.1	0	0	0	105.4	I248 D252	I248-L250 PolarHBondContact O-N 2.87Å; L250-D252 WeakPolarHBondContact CD2-OD1 3.31Å; L250-D252 PolarHBondContact O-N 3.24Å
251	V	39	Very low	51.6	Low	137 Å²	137	109.9 Å²	109.9	83%	0.83	65%	0.653	S	S	*	*			trans	-70.9	80.3	164.6	-180	0	0	0	0	105.5	P249 A253	P249-V251 VanDerWaalsContact C-N 3.34Å; P249-V251 PolarHBondContact O-N 3.22Å; V251-A253 PolarHBondContact O-N 3.34Å; V251-A253 VanDerWaalsContact O-N 3.11Å
252	D	32.7	Very low	48.5	Very low	124 Å²	124	112.4 Å²	112.4	66%	0.663	67%	0.669	S	S	*	*			trans	-72	104.1	169.7	-86.2	-36	0	0	0	107.8	L250 N254	L250-D252 WeakPolarHBondContact CD2-OD1 3.31Å; L250-D252 PolarHBondContact O-N 3.24Å; D252-N254 PolarHBondContact O-N 2.75Å
253	A	39.6	Very low	45.4	Very low	100 Å²	100	112.7 Å²	112.7	83%	0.826	68%	0.682	S	S	*	*			trans	-70.2	61.9	165.6	0	0	0	0	0	110.1	V251	V251-A253 PolarHBondContact O-N 3.34Å; V251-A253 VanDerWaalsContact O-N 3.11Å
254	N	40	Very low	42.4	Very low	148 Å²	148	115.8 Å²	115.8	79%	0.791	70%	0.695	S	S	*	*	S	Bend	trans	-164	129.9	156	-137.6	-1.6	0	0	0	112.5	D252 S256	D252-N254 PolarHBondContact O-N 2.75Å; N254-S256 PolarHBondContact O-N 3.45Å
255	N	42.3	Very low	39.6	Very low	167 Å²	167	119 Å²	119	89%	0.893	72%	0.716	S	S	*	*			trans	-60.6	116.5	176.9	-75.6	-28.6	0	0	0	112.1
256	S	31.9	Very low	37.3	Very low	120 Å²	120	120.6 Å²	120.6	84%	0.839	71%	0.713	S	S	*	*			trans	-167.1	138.3	143.3	-179.2	0	0	0	0	110.6	N254	N254-S256 PolarHBondContact O-N 3.45Å
257	I	42.5	Very low	35.7	Very low	175 Å²	175	121.8 Å²	121.8	90%	0.897	72%	0.716	S	S	*	*			trans	-63.6	142.1	-171.9	-69.1	161.7	0	0	0	112.8
258	G	37.1	Very low	34.7	Very low	75 Å²	75	122.9 Å²	122.9	77%	0.773	72%	0.717	S	S	*	*			trans	115.9	64.4	155.4	0	0	0	0	0	115.6
259	S	30.3	Very low	34.2	Very low	108 Å²	108	121 Å²	121	76%	0.755	72%	0.721	S	S	*	*			trans	-113.6	135.6	162.1	-146.1	0	0	0	0	108.4	L261	S259-L261 PolarHBondContact O-N 3.13Å
260	P	34.9	Very low	33.7	Very low	120 Å²	120	118.5 Å²	118.5	78%	0.779	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-61.7	124.9	177.7	27.6	-32.5	0	0	0	107.6
261	L	27	Very low	33.2	Very low	133 Å²	133	122.7 Å²	122.7	70%	0.696	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-52.3	134.2	173.6	-90.3	111.7	0	0	0	108.4	S259	S259-L261 PolarHBondContact O-N 3.13Å
262	P	31.5	Very low	33.1	Very low	85 Å²	85	120.9 Å²	120.9	55%	0.552	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-54.2	148.9	168.4	25.3	-32.3	0	0	0	108.1	Q264	P262-Q264 PolarHBondContact O-N 2.99Å
263	P	31.8	Very low	33.1	Very low	108 Å²	108	118.4 Å²	118.4	70%	0.701	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-49.3	120.4	173.2	20.5	-30.2	0	0	0	107	V265	P263-V265 HydrophobicContact CB-CG2 4.49Å; P263-V265 PolarHBondContact O-N 2.98Å
264	Q	30.4	Very low	32.9	Very low	133 Å²	133	121.8 Å²	121.8	62%	0.621	70%	0.701	S	S	*	*			trans	-68.8	81.7	172.5	-68	-141.4	-8.8	0	0	106.3	P262 H266	P262-Q264 PolarHBondContact O-N 2.99Å; Q264-H266 PolarHBondContact O-N 2.83Å
265	V	32.3	Very low	32.6	Very low	88 Å²	88	123.1 Å²	123.1	53%	0.533	70%	0.699	S	S	.	*			trans	-67	95.5	162.3	-176.6	0	0	0	0	103.6	P263 I267	P263-V265 HydrophobicContact CB-CG2 4.49Å; P263-V265 PolarHBondContact O-N 2.98Å; V265-I267 HydrophobicContact CG1-CG1 4.14Å; V265-I267 PolarHBondContact O-N 3.24Å
266	H	30.1	Very low	32.6	Very low	132 Å²	132	119.4 Å²	119.4	61%	0.611	68%	0.676	S	S	*	*			trans	-61.2	92.3	164.1	-73.9	-59.2	0	0	0	106.3	Q264 H268	Q264-H266 PolarHBondContact O-N 2.83Å; H266-H268 PolarHBondContact O-N 2.84Å
267	I	30	Very low	33.1	Very low	89 Å²	89	115.9 Å²	115.9	46%	0.456	66%	0.659	S	S	.	*			trans	-66.1	94.8	167.3	-58.3	177.2	0	0	0	104.7	V265 A269	V265-I267 HydrophobicContact CG1-CG1 4.14Å; V265-I267 PolarHBondContact O-N 3.24Å; I267-A269 PolarHBondContact O-N 3.49Å
268	H	30.5	Very low	33.5	Very low	164 Å²	164	110.3 Å²	110.3	76%	0.759	63%	0.634	S	S	*	*			trans	-62.6	100.1	160.1	-81.6	-42.9	0	0	0	106.4	H266 G270	H266-H268 PolarHBondContact O-N 2.84Å; H268-G270 PolarHBondContact O-N 2.88Å
269	A	30.5	Very low	34.6	Very low	92 Å²	92	107.7 Å²	107.7	76%	0.76	61%	0.606	S	S	*	*			trans	-63.4	70.8	157.5	0	0	0	0	0	107.8	I267	I267-A269 PolarHBondContact O-N 3.49Å
270	G	27	Very low	36.6	Very low	53 Å²	53	104 Å²	104	55%	0.546	58%	0.577	S	S	.	*			trans	-143	83.4	-173.7	0	0	0	0	0	106.6	H268	H268-G270 PolarHBondContact O-N 2.88Å
271	R	26.1	Very low	38.5	Very low	225 Å²	225	99.2 Å²	99.2	85%	0.849	54%	0.544	S	S	*	.			trans	48.5	104.1	156.7	-166.7	-180	-164.2	-142.1	4.1	113.4	S273	R271-S273 VanDerWaalsContact C-N 3.27Å; R271-S273 WeakPolarHBondContact O-CA 3.22Å; R271-S273 PolarHBondContact O-N 3.44Å
272	V	35.7	Very low	40.6	Very low	99 Å²	99	97.4 Å²	97.4	60%	0.6	53%	0.53	S	S	*	.			trans	-36.4	99.6	157.4	178.1	0	0	0	0	107.5	H274	V272-H274 PolarHBondContact O-CD2 2.9Å; V272-H274 PolarHBondContact O-N 2.76Å
273	S	32.5	Very low	42.3	Very low	72 Å²	72	93.8 Å²	93.8	50%	0.503	51%	0.507	S	S	.	.			trans	-79.1	94.4	-178.4	-174.7	0	0	0	0	102.7	R271 K275	R271-S273 VanDerWaalsContact C-N 3.27Å; R271-S273 WeakPolarHBondContact O-CA 3.22Å; R271-S273 PolarHBondContact O-N 3.44Å; S273-K275 PolarHBondContact O-N 2.92Å
274	H	35.8	Very low	43.6	Very low	172 Å²	172	92.4 Å²	92.4	80%	0.796	50%	0.496	S	S	*	.	S	Bend	trans	-60.9	25.1	164.1	-63.4	-74	0	0	0	112.3	V272	V272-H274 PolarHBondContact O-CD2 2.9Å; V272-H274 PolarHBondContact O-N 2.76Å
275	K	34.1	Very low	45	Very low	175 Å²	175	88.8 Å²	88.8	76%	0.761	49%	0.489	S	S	*	.			trans	-123	62.3	173	-57.1	-165.1	174	-162	0	107.2	S273 G277	S273-K275 PolarHBondContact O-N 2.92Å; K275-G277 PolarHBondContact O-N 2.78Å
276	H	43.3	Very low	46.2	Very low	89 Å²	89	88.8 Å²	88.8	41%	0.412	49%	0.486	S	S	.	.			trans	-57.2	125	148.9	-61.3	-67.3	0	0	0	105.1	H281	H276-H281 AromaticContact ND1-CE1 4Å
277	G	42.1	Very low	47.5	Very low	46 Å²	46	87.9 Å²	87.9	47%	0.474	48%	0.481	S	S	.	.			trans	-53.4	162.6	170.2	0	0	0	0	0	109.6	K275 G279	K275-G277 PolarHBondContact O-N 2.78Å; G277-G279 PolarHBondContact O-N 2.84Å
278	T	49.7	Very low	48.9	Very low	59 Å²	59	86.3 Å²	86.3	36%	0.362	47%	0.474	S	S	.	.	S	Bend	trans	-67.6	-16.8	179.3	45.6	0	0	0	0	112.4	P155 N157 E303	P155-T278 WeakPolarHBondContact CB-O 3.33Å; N157-T278 VanDerWaalsContact ND2-CG2 3.26Å; N157-T278 WeakPolarHBondContact ND2-CG2 3.46Å; T278-E303 WeakPolarHBondContact CB-OE1 3.43Å; T278-E303 PolarHBondContact OG1-OE1 2.8Å; T278-E303 PolarHBondContact OG1-OE2 2.93Å
279	G	60.2	Low	50.1	Low	19 Å²	19	82.6 Å²	82.6	20%	0.196	47%	0.465	C	S	.	.	S	Bend	trans	-92.5	-178.8	175.8	0	0	0	0	0	116	G277 E303	G277-G279 PolarHBondContact O-N 2.84Å; G279-E303 PolarHBondContact N-OE1 3Å
280	H	72.6	Confident	51.5	Low	30 Å²	30	85.5 Å²	85.5	14%	0.139	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-68.2	162.5	177.7	-61.2	-64.4	0	0	0	112.7	E141 L153 L154 K282	E141-H280 IonicContact OE1-CD2 3.02Å; E141-H280 PolarHBondContact OE1-CD2 2.97Å; E141-H280 VanDerWaalsContact OE1-CD2 3.28Å; E141-H280 IonicContact OE1-NE2 2.7Å; E141-H280 PolarHBondContact OE1-NE2 3.29Å; L153-H280 VanDerWaalsContact CD2-CE1 3.44Å; L153-H280 WeakPolarHBondContact CD2-CE1 3.43Å; L153-H280 VanDerWaalsContact CD2-NE2 3.35Å; L153-H280 WeakPolarHBondContact CD2-NE2 3.32Å; L153-H280 WeakPolarHBondContact CG-CE1 3.22Å; L153-H280 WeakPolarHBondContact CG-NE2 3.25Å; L154-H280 PolarHBondContact O-CE1 3.06Å; H280-K282 WeakPolarHBondContact O-CG 3.41Å; H280-K282 PolarHBondContact O-N 3.12Å; H280-K282 VanDerWaalsContact O-N 3.15Å
281	H	75	Confident	53.3	Low	20 Å²	20	85 Å²	85	9%	0.093	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-60.4	117.5	174.8	-61.6	-61.8	0	0	0	109.8	E185 I186 G187 H276	E185-H281 IonicContact OE1-CD2 2.73Å; E185-H281 PolarHBondContact OE1-CD2 3.22Å; E185-H281 IonicContact OE1-CE1 3.42Å; E185-H281 PolarHBondContact OE1-CE1 2.91Å; E185-H281 IonicContact OE1-CG 3.28Å; E185-H281 IonicContact OE1-ND1 3.98Å; E185-H281 PolarHBondContact OE1-ND1 2.72Å; E185-H281 IonicContact OE1-NE2 3.41Å; E185-H281 PolarHBondContact OE1-NE2 2.96Å; I186-H281 PolarHBondContact O-NE2 2.98Å; G187-H281 PolarHBondContact O-CD2 3.24Å; H276-H281 AromaticContact ND1-CE1 4Å
282	K	70.4	Confident	55	Low	95 Å²	95	77.1 Å²	77.1	41%	0.413	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-100.3	147.4	-180	-55.4	-170.3	-178.7	177.8	0	109.9	H57 T139 H280 T284	H57-K282 PolarHBondContact NE2-O 2.97Å; T139-K282 HydrophobicContact CG2-CB 4.42Å; T139-K282 WeakPolarHBondContact OG1-CG 3.42Å; H280-K282 WeakPolarHBondContact O-CG 3.41Å; H280-K282 PolarHBondContact O-N 3.12Å; H280-K282 VanDerWaalsContact O-N 3.15Å; K282-T284 PolarHBondContact O-N 3.45Å
283	L	67.9	Low	56.4	Low	10 Å²	10	77.1 Å²	77.1	5%	0.052	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-54	124.3	166.7	-74	169.5	0	0	0	109.1	Y63 L89 C137 T139	Y63-L283 HydrophobicContact CD1-CD1 4.08Å; Y63-L283 HydrophobicContact CD2-CD1 4.3Å; Y63-L283 HydrophobicContact CD2-CD2 3.52Å; Y63-L283 HydrophobicContact CD2-CG 4.01Å; Y63-L283 HydrophobicContact CE1-CD1 4.05Å; Y63-L283 HydrophobicContact CE1-CG 4.29Å; Y63-L283 HydrophobicContact CE2-CD1 4.29Å; Y63-L283 HydrophobicContact CE2-CD2 3.62Å; Y63-L283 HydrophobicContact CE2-CG 3.73Å; Y63-L283 HydrophobicContact CG-CD1 4.2Å; Y63-L283 HydrophobicContact CG-CD2 4.12Å; Y63-L283 HydrophobicContact CG-CG 4.41Å; L89-L283 HydrophobicContact CD1-CD1 4.25Å; C137-L283 HydrophobicContact CB-CB 3.69Å; C137-L283 HydrophobicContact CB-CD1 3.89Å; C137-L283 HydrophobicContact CB-CG 4.45Å; T139-L283 HydrophobicContact CG2-CB 4.07Å; T139-L283 HydrophobicContact CG2-CD1 4.23Å; T139-L283 HydrophobicContact CG2-CG 4.12Å
284	T	59.9	Low	57.9	Low	78 Å²	78	77.8 Å²	77.8	48%	0.479	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-67.8	137.5	-176.7	-58.2	0	0	0	0	109.8	F135 K282	F135-T284 WeakPolarHBondContact CE2-O 3.36Å; K282-T284 PolarHBondContact O-N 3.45Å
285	A	59.6	Low	59.6	Low	58 Å²	58	70.4 Å²	70.4	48%	0.479	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-86	120.8	175.4	0	0	0	0	0	111.2
286	L	57.5	Low	60.9	Low	87 Å²	87	65 Å²	65	46%	0.455	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-99.7	89.6	164.1	-173.6	70.3	0	0	0	109.7	F135 N288	F135-L286 HydrophobicContact CD1-CB 4.18Å; F135-L286 HydrophobicContact CE1-CB 3.54Å; F135-L286 HydrophobicContact CE1-CD2 4.03Å; F135-L286 HydrophobicContact CE1-CG 4.43Å; F135-L286 HydrophobicContact CE2-CB 4.22Å; F135-L286 HydrophobicContact CZ-CB 3.57Å; F135-L286 VanDerWaalsContact O-O 3.1Å; L286-N288 PolarHBondContact O-N 3Å
287	H	56.8	Low	61.3	Low	113 Å²	113	70.3 Å²	70.3	52%	0.523	40%	0.398	S	S	.	.			trans	-82.7	104.2	178.8	-171.9	-77.7	0	0	0	111.2	P289	H287-P289 WeakPolarHBondContact O-CD 3.12Å
288	N	59.7	Low	61.6	Low	56 Å²	56	71 Å²	71	30%	0.299	40%	0.395	S	S	.	.			trans	-82.3	111.2	164.5	-176.6	-15.3	0	0	0	109.3	A134 L286 H290 M291	A134-N288 HydrophobicContact CB-CB 4.08Å; L286-N288 PolarHBondContact O-N 3Å; N288-H290 PolarHBondContact O-N 2.79Å; N288-H290 PolarHBondContact OD1-N 2.96Å; N288-M291 HydrophobicContact CB-CB 4.33Å; N288-M291 HydrophobicContact CB-CG 4.24Å; N288-M291 PolarHBondContact O-N 3.03Å
289	P	55.1	Low	60.9	Low	87 Å²	87	72.4 Å²	72.4	57%	0.565	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-18.3	-175.2	27.3	-35.3	0	0	0	114	H287 S292	H287-P289 WeakPolarHBondContact O-CD 3.12Å; P289-S292 PolarHBondContact O-OG 3.21Å; P289-S292 VanDerWaalsContact O-OG 3.14Å
290	H	60.8	Low	59.9	Low	153 Å²	153	79.6 Å²	79.6	71%	0.708	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-16	176	-67.2	-71.4	0	0	0	113.6	N288	N288-H290 PolarHBondContact O-N 2.79Å; N288-H290 PolarHBondContact OD1-N 2.96Å
291	M	64.1	Low	58	Low	42 Å²	42	83.2 Å²	83.2	21%	0.207	47%	0.47	C	S	.	.	S	Bend	trans	-107.4	6.3	-178.5	-59.4	-71.5	88.4	0	0	112.7	L133 A134 N288 S293 Y294	L133-M291 HydrophobicContact CD1-SD 4.41Å; A134-M291 HydrophobicContact CB-CB 3.71Å; A134-M291 HydrophobicContact CB-CG 4.07Å; N288-M291 HydrophobicContact CB-CB 4.33Å; N288-M291 HydrophobicContact CB-CG 4.24Å; N288-M291 PolarHBondContact O-N 3.03Å; M291-S293 PolarHBondContact O-N 3.07Å; M291-S293 VanDerWaalsContact O-N 3.12Å; M291-Y294 HydrophobicContact CE-CE2 4.4Å; M291-Y294 PolarHBondContact O-N 3.14Å; M291-Y294 HydrophobicContact SD-CD2 4.37Å
292	S	61.3	Low	56	Low	59 Å²	59	86.3 Å²	86.3	41%	0.413	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-57.1	-27	-179	53.7	0	0	0	0	113.8	P289 Y294 L295	P289-S292 PolarHBondContact O-OG 3.21Å; P289-S292 VanDerWaalsContact O-OG 3.14Å; S292-Y294 PolarHBondContact O-N 2.83Å; S292-L295 PolarHBondContact O-N 2.99Å
293	S	66.5	Low	54.2	Low	99 Å²	99	87 Å²	87	69%	0.692	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-66.2	-17.4	175.9	62.5	0	0	0	0	114.3	M291	M291-S293 PolarHBondContact O-N 3.07Å; M291-S293 VanDerWaalsContact O-N 3.12Å
294	Y	63	Low	52.4	Low	87 Å²	87	92.7 Å²	92.7	34%	0.341	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-104.7	-1.9	-179.6	-61.7	-73.3	0	0	0	112.9	H74 V84 M291 S292	H74-Y294 AromaticContact NE2-CE1 3.91Å; V84-Y294 HydrophobicContact CG2-CD1 3.77Å; V84-Y294 HydrophobicContact CG2-CE1 4.48Å; V84-Y294 HydrophobicContact CG2-CG 4.28Å; M291-Y294 HydrophobicContact CE-CE2 4.4Å; M291-Y294 PolarHBondContact O-N 3.14Å; M291-Y294 HydrophobicContact SD-CD2 4.37Å; S292-Y294 PolarHBondContact O-N 2.83Å
295	L	71.6	Confident	50.9	Low	17 Å²	17	94.3 Å²	94.3	9%	0.089	55%	0.548	C	S	.	.	S	Bend	trans	-110.7	143.2	179.7	-59	175	0	0	0	108.7	D120 V122 A134 K136 S292	D120-L295 HydrophobicContact CB-CD2 3.68Å; V122-L295 HydrophobicContact CG2-CD2 4.05Å; A134-L295 HydrophobicContact CB-CD1 4.27Å; K136-L295 HydrophobicContact CB-CD1 4.28Å; K136-L295 HydrophobicContact CB-CD2 4.37Å; S292-L295 PolarHBondContact O-N 2.99Å
296	S	62	Low	49.5	Very low	62 Å²	62	97.4 Å²	97.4	43%	0.434	56%	0.563	S	S	.	*			trans	-68.1	140.1	-178.9	-60.6	0	0	0	0	111.2	D120 K136 S298	D120-S296 PolarHBondContact OD1-OG 3.25Å; D120-S296 WeakPolarHBondContact OD2-CB 3.46Å; D120-S296 PolarHBondContact OD2-N 2.98Å; D120-S296 PolarHBondContact OD2-OG 2.84Å; K136-S296 PolarHBondContact NZ-O 3.15Å; S296-S298 PolarHBondContact O-N 3.32Å
297	E	52	Low	48.2	Very low	200 Å²	200	99.6 Å²	99.6	94%	0.935	58%	0.58	S	S	*	*			trans	-71.4	118.7	168.3	-75.3	-168.5	169.8	0	0	108.6
298	S	47	Very low	47	Very low	59 Å²	59	98.2 Å²	98.2	41%	0.413	59%	0.588	S	S	.	*			trans	-143.5	121.7	176.3	-15.8	0	0	0	0	106.2	K136 S296 E300	K136-S298 VanDerWaalsContact NZ-CB 3.29Å; K136-S298 PolarHBondContact NZ-O 3.13Å; K136-S298 PolarHBondContact NZ-OG 2.89Å; S296-S298 PolarHBondContact O-N 3.32Å; S298-E300 PolarHBondContact O-N 3.44Å
299	A	36.9	Very low	45.7	Very low	90 Å²	90	101.5 Å²	101.5	74%	0.744	61%	0.613	S	S	*	*			trans	-69.5	115.2	171.7	0	0	0	0	0	108.1	S301	A299-S301 PolarHBondContact O-N 2.84Å
300	E	37.8	Very low	44.5	Very low	169 Å²	169	101.6 Å²	101.6	79%	0.79	62%	0.62	S	S	*	*			trans	-57.6	110.9	158.1	-95.2	-173.1	103.3	0	0	106.9	S298 A302	S298-E300 PolarHBondContact O-N 3.44Å; E300-A302 PolarHBondContact O-N 2.87Å; E300-A302 VanDerWaalsContact O-N 3.14Å
301	S	33.9	Very low	42.8	Very low	107 Å²	107	102.6 Å²	102.6	75%	0.748	63%	0.63	S	S	*	*			trans	-64.4	116.9	173	-69.4	0	0	0	0	107.6	A299 E303	A299-S301 PolarHBondContact O-N 2.84Å; S301-E303 PolarHBondContact O-N 2.88Å
302	A	31.7	Very low	41.2	Very low	84 Å²	84	108 Å²	108	69%	0.694	66%	0.658	S	S	*	*			trans	-54	129.4	169.3	0	0	0	0	0	108.8	E300 V304	E300-A302 PolarHBondContact O-N 2.87Å; E300-A302 VanDerWaalsContact O-N 3.14Å; A302-V304 PolarHBondContact O-N 3.41Å
303	E	32.3	Very low	39.7	Very low	109 Å²	109	111.2 Å²	111.2	51%	0.509	68%	0.675	S	S	.	*			trans	-55.9	107.1	174.3	-86.4	-179.5	115.8	0	0	109.5	T278 G279 S301	T278-E303 WeakPolarHBondContact CB-OE1 3.43Å; T278-E303 PolarHBondContact OG1-OE1 2.8Å; T278-E303 PolarHBondContact OG1-OE2 2.93Å; G279-E303 PolarHBondContact N-OE1 3Å; S301-E303 PolarHBondContact O-N 2.88Å
304	V	30.9	Very low	38.1	Very low	130 Å²	130	112.2 Å²	112.2	79%	0.788	68%	0.679	S	S	*	*			trans	-87.6	116.1	167	-178.5	0	0	0	0	107	A302 P306	A302-V304 PolarHBondContact O-N 3.41Å; V304-P306 WeakPolarHBondContact O-CD 3.47Å
305	V	28.6	Very low	36.5	Very low	112 Å²	112	112.9 Å²	112.9	68%	0.679	70%	0.703	S	S	*	*			trans	-55.6	121.3	171.4	178.6	0	0	0	0	108.4	V307	V305-V307 PolarHBondContact O-N 2.97Å
306	P	30.5	Very low	34.5	Very low	123 Å²	123	116.5 Å²	116.5	80%	0.799	74%	0.735	S	S	*	*			trans	-67.8	111.4	175.6	-7.6	20.7	0	0	0	108.5	V304 A308	V304-P306 WeakPolarHBondContact O-CD 3.47Å; P306-A308 PolarHBondContact O-N 3.46Å
307	V	30.6	Very low	33	Very low	133 Å²	133	122 Å²	122	81%	0.806	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-77.3	118.8	161.9	175.8	0	0	0	0	106.5	V305	V305-V307 PolarHBondContact O-N 2.97Å
308	A	29.7	Very low	32.4	Very low	84 Å²	84	117.6 Å²	117.6	69%	0.694	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-54.6	128.2	177.4	0	0	0	0	0	110.8	P306 A310	P306-A308 PolarHBondContact O-N 3.46Å; A308-A310 PolarHBondContact O-N 3.36Å
309	P	33.9	Very low	31.6	Very low	126 Å²	126	118.9 Å²	118.9	82%	0.818	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-69.5	128.2	171.3	22.7	-25.5	0	0	0	109.8	L311	P309-L311 PolarHBondContact O-N 3Å
310	A	28.6	Very low	31.3	Very low	88 Å²	88	120.2 Å²	120.2	73%	0.727	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-60.1	128.6	169.5	0	0	0	0	0	109.7	A308 I312	A308-A310 PolarHBondContact O-N 3.36Å; A310-I312 PolarHBondContact O-N 3.05Å; A310-I312 VanDerWaalsContact O-N 3.15Å
311	L	26.6	Very low	31.5	Very low	174 Å²	174	118.2 Å²	118.2	91%	0.911	76%	0.762	S	S	*	*			trans	-55.2	112.9	173.9	-75.8	154.2	0	0	0	110.4	P309	P309-L311 PolarHBondContact O-N 3Å
312	I	30.8	Very low	31.6	Very low	156 Å²	156	118.4 Å²	118.4	80%	0.8	76%	0.763	S	S	*	*			trans	-110	113.2	162	-58.2	176.3	0	0	0	106.8	A310 P314	A310-I312 PolarHBondContact O-N 3.05Å; A310-I312 VanDerWaalsContact O-N 3.15Å; I312-P314 WeakPolarHBondContact O-CD 3.48Å
313	V	28.2	Very low	32.1	Very low	127 Å²	127	119.9 Å²	119.9	77%	0.77	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-73.9	127.1	176.4	-177.9	0	0	0	0	109.1
314	P	34.2	Very low	32.1	Very low	119 Å²	119	121 Å²	121	77%	0.773	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-93.7	133.7	163.2	7.4	12	0	0	0	110.5	I312	I312-P314 WeakPolarHBondContact O-CD 3.48Å
315	A	28.6	Very low	32.2	Very low	101 Å²	101	119.5 Å²	119.5	84%	0.835	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-79.1	144.2	169.2	0	0	0	0	0	111.2
316	A	29.5	Very low	32.3	Very low	93 Å²	93	121.3 Å²	121.3	77%	0.769	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-66.4	158.7	170.2	0	0	0	0	0	111
317	E	31.5	Very low	32.2	Very low	179 Å²	179	123 Å²	123	84%	0.836	79%	0.79	S	S	*	*			cis	176.3	-170.4	46.1	-126.7	-170	157	0	0	106.1
318	P	39.3	Very low	32.4	Very low	106 Å²	106	120.9 Å²	120.9	69%	0.688	78%	0.78	S	S	*	*			cis	-132.8	165.5	-43.4	31.6	-11.1	0	0	0	116.3
319	A	29	Very low	32.6	Very low	86 Å²	86	122.1 Å²	122.1	71%	0.711	78%	0.784	S	S	*	*			trans	64	115.2	139.5	0	0	0	0	0	126.3
320	S	31.5	Very low	32.6	Very low	118 Å²	118	121.8 Å²	121.8	83%	0.825	79%	0.785	S	S	*	*				69.2	161.6	125.5	-53.5	0	0	0	0	122.6
321	P	42	Very low	33	Very low	127 Å²	127	125.2 Å²	125.2	83%	0.825	79%	0.791	S	S	*	*			cis	-131.1	177.4	-13.7	33.9	-12.7	0	0	0	116.3
322	S	34.8	Very low	33.3	Very low	111 Å²	111	121.4 Å²	121.4	78%	0.776	79%	0.785	S	S	*	*			trans	-61.5	172.5	174.7	-47.2	0	0	0	0	116
323	P	43.3	Very low	33.7	Very low	116 Å²	116	119.7 Å²	119.7	75%	0.753	79%	0.787	S	S	*	*				-148.4	145.3	86.7	33.7	-12.3	0	0	0	116.4
324	V	31.4	Very low	34.1	Very low	132 Å²	132	118.8 Å²	118.8	80%	0.8	79%	0.785	S	S	*	*				68.6	120.4	106.8	-171.5	0	0	0	0	117.5
325	A	33.9	Very low	34.7	Very low	98 Å²	98	118.3 Å²	118.3	81%	0.81	79%	0.792	S	S	*	*				-171.7	127.3	127.9	0	0	0	0	0	111.9
326	D	30	Very low	35.2	Very low	150 Å²	150	118.7 Å²	118.7	80%	0.802	79%	0.788	S	S	*	*			trans	-66.6	158.2	168.4	-60.5	-59.8	0	0	0	112.4
327	D	29.7	Very low	35.7	Very low	159 Å²	159	120.5 Å²	120.5	85%	0.85	79%	0.789	S	S	*	*				-166.6	168.9	110.8	-140.2	-12.7	0	0	0	113.8
328	S	32.9	Very low	36.2	Very low	88 Å²	88	120.9 Å²	120.9	62%	0.615	79%	0.791	S	S	*	*			trans	-98.5	158.7	-146.9	-53.5	0	0	0	0	116.2
329	S	34.6	Very low	36.2	Very low	110 Å²	110	121.1 Å²	121.1	77%	0.769	79%	0.79	S	S	*	*			trans	63.9	130.3	135.6	70.6	0	0	0	0	121.7
330	S	34.1	Very low	37	Very low	119 Å²	119	122.5 Å²	122.5	83%	0.832	79%	0.792	S	S	*	*				178.4	133.2	98.2	40.2	0	0	0	0	112.5
331	D	36.3	Very low	37.7	Very low	161 Å²	161	123.7 Å²	123.7	86%	0.861	79%	0.788	S	S	*	*			trans	-64.5	145.4	168.2	-80.1	-52.8	0	0	0	112.2
332	A	33	Very low	38.4	Very low	94 Å²	94	122.2 Å²	122.2	78%	0.777	78%	0.777	S	S	*	*			trans	-155.5	100.2	146.7	0	0	0	0	0	110.1
333	S	40.6	Very low	39.5	Very low	120 Å²	120	122 Å²	122	84%	0.839	77%	0.766	S	S	*	*			trans	-59.1	135.2	165.9	-47.2	0	0	0	0	110.5
334	S	37	Very low	41.3	Very low	107 Å²	107	119.7 Å²	119.7	75%	0.748	75%	0.75	S	S	*	*			trans	-137.4	111.3	161.5	-69.3	0	0	0	0	107.3	S336	S334-S336 PolarHBondContact O-N 3.08Å
335	A	45	Very low	44.1	Very low	110 Å²	110	115.2 Å²	115.2	91%	0.909	72%	0.724	S	S	*	*			trans	-66	110.2	173.9	0	0	0	0	0	108.8
336	S	40.2	Very low	46.9	Very low	108 Å²	108	112.7 Å²	112.7	76%	0.755	70%	0.699	S	S	*	*			trans	-90.5	125.3	169.4	-64.7	0	0	0	0	108.5	S334 E338	S334-S336 PolarHBondContact O-N 3.08Å; S336-E338 PolarHBondContact O-N 3.17Å
337	V	40	Very low	49.9	Very low	131 Å²	131	105.8 Å²	105.8	79%	0.794	66%	0.664	S	S	*	*			trans	-54.8	117.8	167.1	173.3	0	0	0	0	108.1	V339	V337-V339 PolarHBondContact O-N 3.45Å
338	E	41.3	Very low	53	Low	188 Å²	188	106.8 Å²	106.8	88%	0.879	66%	0.656	S	S	*	*			trans	-66.1	96.3	171.8	-81.6	178.6	153.7	0	0	109.1	S336	S336-E338 PolarHBondContact O-N 3.17Å
339	V	40.5	Very low	56	Low	110 Å²	110	106.2 Å²	106.2	67%	0.667	65%	0.645	S	S	*	*			trans	-71.3	133.3	155	-180	0	0	0	0	106	V337 I341	V337-V339 PolarHBondContact O-N 3.45Å; V339-I341 PolarHBondContact O-N 3.02Å
340	P	45.4	Very low	59	Low	115 Å²	115	106 Å²	106	75%	0.747	63%	0.627	S	S	*	*			trans	-61.3	113	175.9	-11.2	24.7	0	0	0	107.4	T342	P340-T342 PolarHBondContact O-N 2.97Å
341	I	44.6	Very low	61.9	Low	144 Å²	144	105.2 Å²	105.2	74%	0.738	61%	0.609	S	S	*	*			trans	-65.9	104.2	173.7	-58.7	170.1	0	0	0	105	V339 L343	V339-I341 PolarHBondContact O-N 3.02Å; I341-L343 VanDerWaalsContact C-N 3.3Å; I341-L343 HydrophobicContact CG2-CD1 4.26Å; I341-L343 PolarHBondContact O-N 3.36Å
342	T	57	Low	64.5	Low	96 Å²	96	101 Å²	101	59%	0.589	58%	0.583	S	S	*	*			trans	-60	101.2	163.2	43.2	0	0	0	0	105.8	P340 V344	P340-T342 PolarHBondContact O-N 2.97Å; T342-V344 PolarHBondContact O-N 3.02Å
343	L	57.9	Low	66.1	Low	106 Å²	106	101.3 Å²	101.3	56%	0.555	57%	0.573	S	S	*	*			trans	-68.7	99.8	178.5	-134.8	91.4	0	0	0	106.3	I341 P346	I341-L343 VanDerWaalsContact C-N 3.3Å; I341-L343 HydrophobicContact CG2-CD1 4.26Å; I341-L343 PolarHBondContact O-N 3.36Å; L343-P346 WeakPolarHBondContact CD2-O 3.21Å
344	V	82.6	Confident	67.4	Low	68 Å²	68	100.3 Å²	100.3	41%	0.412	56%	0.559	S	S	.	*			trans	-68	-51.2	-176	179.7	0	0	0	0	108.8	E36 C37 T342	E36-V344 CarbonylContact C-O 3.59Å; E36-V344 WeakPolarHBondContact CA-O 3.19Å; C37-V344 PolarHBondContact N-O 3.36Å; T342-V344 PolarHBondContact O-N 3.02Å
345	C	89.3	Confident	69.1	Low	38 Å²	38	99.9 Å²	99.9	26%	0.257	55%	0.549	S	S	.	.	S	Bend	trans	-167.4	164.7	171.7	-76.4	0	0	0	0	106.3	C37 E69	C37-C345 HydrophobicContact CB-CB 4.05Å; C37-C345 WeakPolarHBondContact CB-SG 3.46Å; C37-C345 WeakPolarHBondContact SG-CB 3.48Å; C37-C345 CovalentContact SG-SG 2.03Å; C37-C345 PolarHBondContact SG-SG 3.02Å; E69-C345 VanDerWaalsContact O-CB 3.28Å; E69-C345 WeakPolarHBondContact O-CB 3.33Å
346	P	92.9	Very high	70.5	Confident	44 Å²	44	99.4 Å²	99.4	29%	0.286	53%	0.528	S	S	.	.	S	Bend	cis	-72.5	157.1	-5.8	32.9	-41.1	0	0	0	112.9	E69 L343	E69-P346 WeakPolarHBondContact OE2-CB 3.43Å; L343-P346 WeakPolarHBondContact CD2-O 3.21Å
347	G	93.4	Very high	72.4	Confident	6 Å²	6	98.8 Å²	98.8	6%	0.062	51%	0.513	C	S	.	.			trans	-72.7	-172.3	179.9	0	0	0	0	0	113.8	D38 R67 I68	D38-G347 WeakPolarHBondContact OD1-CA 3Å; R67-G347 PolarHBondContact NE-O 3.03Å; I68-G347 PolarHBondContact O-N 3.33Å
348	R	95.3	Very high	74.6	Confident	179 Å²	179	96.7 Å²	96.7	68%	0.675	50%	0.495	S	S	*	.			trans	-65.8	136.3	176	169.2	176.8	172.1	-168.1	-2.1	111.6	D38	D38-R348 PolarHBondContact OD1-N 2.92Å; D38-R348 PolarHBondContact OD2-N 2.98Å
349	I	95.9	Very high	76.9	Confident	77 Å²	77	90.1 Å²	90.1	40%	0.395	47%	0.467	S	S	.	.			trans	-72.8	131	165.9	-62.1	164.7	0	0	0	109.8	F352	I349-F352 WeakPolarHBondContact CG2-O 3.49Å
350	R	95.6	Very high	79.7	Confident	105 Å²	105	88.6 Å²	88.6	40%	0.396	45%	0.452	S	S	.	.	S	Bend	trans	-91.1	-34.9	179.2	-68.7	165.1	175.9	-109.5	-8.5	112.8	E43 L65 N66	E43-R350 IonicContact OE1-CZ 3.78Å; E43-R350 IonicContact OE1-NH2 2.81Å; E43-R350 PolarHBondContact OE1-NH2 3.22Å; E43-R350 IonicContact OE2-CZ 3.61Å; E43-R350 IonicContact OE2-NH2 3.35Å; E43-R350 PolarHBondContact OE2-NH2 3.01Å; L65-R350 WeakPolarHBondContact O-CD 3.27Å; N66-R350 WeakPolarHBondContact O-CB 3.48Å; N66-R350 WeakPolarHBondContact O-CD 3.27Å; N66-R350 VanDerWaalsContact O-CG 3.25Å; N66-R350 WeakPolarHBondContact O-CG 3.39Å; N66-R350 PolarHBondContact O-N 3.46Å; N66-R350 PolarHBondContact OD1-N 3.34Å
351	F	95.2	Very high	82.6	Confident	102 Å²	102	86.4 Å²	86.4	45%	0.447	43%	0.427	S	S	.	.			trans	-119.4	-67.1	-174.6	-59.3	-84.4	0	0	0	113	A64 L65 N66 L90 V107	A64-F351 HydrophobicContact CB-CE2 4.43Å; L65-F351 WeakPolarHBondContact O-CE2 3.43Å; N66-F351 HydrophobicContact CB-CD2 4.34Å; N66-F351 PolarHBondContact OD1-N 2.92Å; L90-F351 HydrophobicContact CD1-CB 3.58Å; L90-F351 HydrophobicContact CD1-CD2 3.81Å; L90-F351 HydrophobicContact CD1-CG 3.93Å; V107-F351 HydrophobicContact CB-CD1 3.71Å; V107-F351 HydrophobicContact CB-CE1 3.69Å; V107-F351 HydrophobicContact CB-CG 4.17Å; V107-F351 HydrophobicContact CB-CZ 4.15Å; V107-F351 HydrophobicContact CG1-CB 4.36Å; V107-F351 HydrophobicContact CG1-CD1 4Å; V107-F351 HydrophobicContact CG1-CD2 4.47Å; V107-F351 HydrophobicContact CG1-CE1 4.44Å; V107-F351 HydrophobicContact CG1-CG 4.02Å; V107-F351 HydrophobicContact CG2-CD1 3.84Å; V107-F351 HydrophobicContact CG2-CD2 4.04Å; V107-F351 HydrophobicContact CG2-CE1 3.45Å; V107-F351 VanDerWaalsContact CG2-CE1 3.45Å; V107-F351 HydrophobicContact CG2-CE2 3.67Å; V107-F351 HydrophobicContact CG2-CG 4.12Å; V107-F351 HydrophobicContact CG2-CZ 3.36Å
352	F	91.4	Very high	86.1	Confident	72 Å²	72	81.2 Å²	81.2	32%	0.316	40%	0.399	S	S	.	.			trans	-165.6	0	-175.9	51.6	-111.5	0	0	0	113.7	N66 L90 V107 R108 K110 A114 E116 I349	N66-F352 PolarHBondContact ND2-O 3.27Å; L90-F352 HydrophobicContact CD1-CD2 4.37Å; L90-F352 HydrophobicContact CD1-CE1 4.03Å; L90-F352 HydrophobicContact CD1-CE2 3.86Å; L90-F352 HydrophobicContact CD1-CZ 3.67Å; L90-F352 HydrophobicContact CD2-CE2 3.66Å; L90-F352 HydrophobicContact CD2-CZ 3.79Å; L90-F352 HydrophobicContact CG-CE2 4.44Å; L90-F352 HydrophobicContact CG-CZ 4.33Å; V107-F352 HydrophobicContact CG1-CE1 4.09Å; V107-F352 HydrophobicContact CG1-CZ 4.42Å; R108-F352 WeakPolarHBondContact O-CE1 3.3Å; K110-F352 HydrophobicContact CD-CB 4.39Å; K110-F352 HydrophobicContact CD-CD2 3.61Å; K110-F352 HydrophobicContact CD-CE2 3.98Å; K110-F352 HydrophobicContact CD-CG 3.99Å; K110-F352 HydrophobicContact CG-CD1 4.46Å; K110-F352 HydrophobicContact CG-CD2 3.75Å; K110-F352 HydrophobicContact CG-CE1 4.37Å; K110-F352 HydrophobicContact CG-CE2 3.61Å; K110-F352 HydrophobicContact CG-CG 4.15Å; K110-F352 HydrophobicContact CG-CZ 3.94Å; K110-F352 PolarHBondContact NZ-OXT 3.48Å; A114-F352 HydrophobicContact CB-CE2 4Å; A114-F352 HydrophobicContact CB-CZ 3.52Å; E116-F352 WeakPolarHBondContact OE1-CE2 3.46Å; I349-F352 WeakPolarHBondContact CG2-O 3.49Å

Retrieved 352 of 352 residues in 609.4 ms (Link to these results)

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