A0A024QZV0_HUMAN Loading...

protein disulfide-isomerase

AlphaFold DB , UniProt , Accession A0A024QZV0, Species HUMAN (Homo sapiens, Human), Gene n/a, Length 324 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.1	Low	75.9	Confident	208 Å²	208	140.3 Å²	140.3	100%	1.025	73%	0.728	S	S	*	*				0	36.9	0	-79	-179.7	-172.9	0	0	110.1
2	E	51	Low	77.5	Confident	189 Å²	189	135.9 Å²	135.9	88%	0.883	71%	0.707	S	S	*	*			trans	-101.4	6.3	-162.2	-75.6	177	143.9	0	0	115.2
3	D	55.5	Low	78.8	Confident	158 Å²	158	127.1 Å²	127.1	85%	0.845	66%	0.663	S	S	*	*			trans	-131.6	15.7	-178.7	-71.7	-56.7	0	0	0	114.9	K5	D3-K5 PolarHBondContact O-N 3.43Å
4	A	58.4	Low	79.8	Confident	49 Å²	49	127.1 Å²	127.1	41%	0.405	67%	0.672	S	S	.	*			trans	-80.3	114.7	177.7	0	0	0	0	0	110.9	V6 Y7	A4-V6 PolarHBondContact O-N 3.28Å; A4-Y7 HydrophobicContact CB-CD1 4.49Å; A4-Y7 HydrophobicContact CB-CE1 3.98Å
5	K	72.6	Confident	80.8	Confident	208 Å²	208	123 Å²	123	90%	0.904	66%	0.663	S	S	*	*	S	Bend	trans	-70.5	-18.5	176.7	-66.3	-175.1	178.7	-178	0	113.7	D3	D3-K5 PolarHBondContact O-N 3.43Å
6	V	83	Confident	81.7	Confident	56 Å²	56	121.5 Å²	121.5	34%	0.339	65%	0.65	S	S	.	*			trans	-143.3	139	-179.8	-171.6	0	0	0	0	109.3	A4 M56 L60	A4-V6 PolarHBondContact O-N 3.28Å; V6-M56 HydrophobicContact CB-SD 4.47Å; V6-M56 HydrophobicContact CG1-SD 3.75Å; V6-L60 HydrophobicContact CG2-CD1 3.34Å
7	Y	89.7	Confident	82.2	Confident	159 Å²	159	118.7 Å²	118.7	62%	0.624	64%	0.642	S	S	*	*			trans	-111.1	129.6	173.3	-62.3	-83.9	0	0	0	109.9	A4	A4-Y7 HydrophobicContact CB-CD1 4.49Å; A4-Y7 HydrophobicContact CB-CE1 3.98Å
8	V	90	Very high	82.9	Confident	133 Å²	133	118.1 Å²	118.1	81%	0.806	64%	0.638	S	S	*	*			trans	-95.5	113.1	170	-177.3	0	0	0	0	108	M56	V8-M56 HydrophobicContact CG2-CE 4.4Å
9	A	92.9	Very high	83.5	Confident	93 Å²	93	115.3 Å²	115.3	77%	0.769	63%	0.626	S	S	*	*			trans	-117.2	153.8	-179.1	0	0	0	0	0	111.2
10	K	95.2	Very high	84	Confident	204 Å²	204	109.8 Å²	109.8	89%	0.887	60%	0.596	S	S	*	*			trans	-117.9	142.6	168.9	71.5	178.7	-176.1	175.8	0	109.4
11	V	94.9	Very high	84.4	Confident	86 Å²	86	108.7 Å²	108.7	52%	0.521	60%	0.597	S	S	.	*			trans	-119.1	127.4	172.4	-178.5	0	0	0	0	107.7	C13 H16 V19	V11-C13 PolarHBondContact O-N 3.15Å; V11-H16 HydrophobicContact CG1-CB 4.31Å; V11-V19 HydrophobicContact CG1-CG1 4.24Å
12	D	95.1	Very high	86.3	Confident	88 Å²	88	102.6 Å²	102.6	47%	0.471	58%	0.579	S	S	.	*			trans	-85.2	101.1	172.8	-172.6	-16	0	0	0	109.5	T14 A15 H16	D12-T14 PolarHBondContact O-N 2.89Å; D12-T14 WeakPolarHBondContact OD1-CB 3.5Å; D12-T14 PolarHBondContact OD1-N 2.93Å; D12-T14 PolarHBondContact OD1-OG1 2.82Å; D12-T14 PolarHBondContact OD2-OG1 2.99Å; D12-A15 HydrophobicContact CB-CB 4.33Å; D12-A15 PolarHBondContact O-N 2.73Å; D12-A15 VanDerWaalsContact O-N 3.16Å; D12-H16 PolarHBondContact O-N 3.04Å
13	C	94.1	Very high	88.3	Confident	21 Å²	21	97.4 Å²	97.4	14%	0.142	56%	0.555	C	S	.	*	T	Hydrogen-bonded Turn	trans	-70.3	-10	-179.8	-60.9	0	0	0	0	114	V11 C20 Y28	V11-C13 PolarHBondContact O-N 3.15Å; C13-C20 WeakPolarHBondContact CA-SG 3.47Å; C13-C20 HydrophobicContact CB-CB 3.67Å; C13-C20 WeakPolarHBondContact CB-SG 3.33Å; C13-C20 WeakPolarHBondContact SG-CB 3.19Å; C13-C20 CovalentContact SG-SG 2.02Å; C13-C20 PolarHBondContact SG-SG 3.32Å; C13-Y28 HydrophobicContact CB-CD1 4.3Å; C13-Y28 HydrophobicContact CB-CE1 3.43Å; C13-Y28 VanDerWaalsContact CB-CE1 3.43Å
14	T	92	Very high	90	Very high	128 Å²	128	92.1 Å²	92.1	79%	0.785	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-30.3	172	72.1	0	0	0	0	111.4	D12	D12-T14 PolarHBondContact O-N 2.89Å; D12-T14 WeakPolarHBondContact OD1-CB 3.5Å; D12-T14 PolarHBondContact OD1-N 2.93Å; D12-T14 PolarHBondContact OD1-OG1 2.82Å; D12-T14 PolarHBondContact OD2-OG1 2.99Å
15	A	95.3	Very high	91.7	Very high	65 Å²	65	91 Å²	91	54%	0.537	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-30.5	175.7	0	0	0	0	0	113.2	D12	D12-A15 HydrophobicContact CB-CB 4.33Å; D12-A15 PolarHBondContact O-N 2.73Å; D12-A15 VanDerWaalsContact O-N 3.16Å
16	H	94.8	Very high	92.5	Very high	99 Å²	99	92.7 Å²	92.7	46%	0.458	53%	0.527	S	S	.	.			trans	-127	62.7	-173.6	-58.7	-70	0	0	0	111.3	V11 D12 D18 V19 C20	V11-H16 HydrophobicContact CG1-CB 4.31Å; D12-H16 PolarHBondContact O-N 3.04Å; H16-D18 VanDerWaalsContact C-N 3.31Å; H16-D18 PolarHBondContact O-N 2.85Å; H16-V19 HydrophobicContact CB-CB 4.3Å; H16-V19 HydrophobicContact CB-CG2 4.2Å; H16-V19 PolarHBondContact O-N 3.37Å; H16-C20 PolarHBondContact O-N 3.41Å; H16-C20 PolarHBondContact O-SG 3.24Å
17	S	91.4	Very high	92.5	Very high	74 Å²	74	91.7 Å²	91.7	52%	0.517	53%	0.527	S	S	.	.	H	α-helix	trans	-68.1	-29.1	-174.9	59.9	0	0	0	0	113.3	S21	S17-S21 VanDerWaalsContact O-CB 3.24Å; S17-S21 WeakPolarHBondContact O-CB 3.31Å; S17-S21 PolarHBondContact O-N 2.87Å; S17-S21 PolarHBondContact O-OG 3.27Å
18	D	94.3	Very high	92.6	Very high	107 Å²	107	91.7 Å²	91.7	57%	0.572	53%	0.527	S	S	*	.	H	α-helix	trans	-63.4	-48.1	174.7	61.7	-36.2	0	0	0	111.6	H16 C20 S21 A22	H16-D18 VanDerWaalsContact C-N 3.31Å; H16-D18 PolarHBondContact O-N 2.85Å; D18-C20 VanDerWaalsContact C-N 3.34Å; D18-C20 PolarHBondContact O-N 3.16Å; D18-S21 PolarHBondContact O-N 3.25Å; D18-A22 VanDerWaalsContact O-CB 3.3Å; D18-A22 WeakPolarHBondContact O-CB 3.39Å; D18-A22 PolarHBondContact O-N 2.93Å
19	V	93.8	Very high	92.6	Very high	65 Å²	65	88.9 Å²	88.9	39%	0.394	51%	0.512	S	S	.	.	H	α-helix	trans	-60.5	-46	177	178.4	0	0	0	0	110.3	V11 H16 Q23	V11-V19 HydrophobicContact CG1-CG1 4.24Å; H16-V19 HydrophobicContact CB-CB 4.3Å; H16-V19 HydrophobicContact CB-CG2 4.2Å; H16-V19 PolarHBondContact O-N 3.37Å; V19-Q23 WeakPolarHBondContact O-CG 3.5Å; V19-Q23 PolarHBondContact O-N 3.23Å
20	C	94	Very high	92.6	Very high	6 Å²	6	86.3 Å²	86.3	4%	0.041	49%	0.487	C	S	.	.	H	α-helix	trans	-69.7	-37.8	-178.9	-63.4	0	0	0	0	112.8	C13 H16 D18 Q23 G24 V25	C13-C20 WeakPolarHBondContact CA-SG 3.47Å; C13-C20 HydrophobicContact CB-CB 3.67Å; C13-C20 WeakPolarHBondContact CB-SG 3.33Å; C13-C20 WeakPolarHBondContact SG-CB 3.19Å; C13-C20 CovalentContact SG-SG 2.02Å; C13-C20 PolarHBondContact SG-SG 3.32Å; H16-C20 PolarHBondContact O-N 3.41Å; H16-C20 PolarHBondContact O-SG 3.24Å; D18-C20 VanDerWaalsContact C-N 3.34Å; D18-C20 PolarHBondContact O-N 3.16Å; C20-Q23 CarbonylContact O-C 3.52Å; C20-Q23 PolarHBondContact O-N 2.75Å; C20-G24 PolarHBondContact O-N 3.05Å; C20-V25 HydrophobicContact CB-CB 4.1Å; C20-V25 HydrophobicContact CB-CG2 4.34Å; C20-V25 WeakPolarHBondContact O-CB 3.2Å; C20-V25 WeakPolarHBondContact O-CG2 3.47Å; C20-V25 PolarHBondContact O-N 3.5Å
21	S	92.2	Very high	92.6	Very high	86 Å²	86	79.6 Å²	79.6	60%	0.601	46%	0.46	S	S	*	.	H	α-helix	trans	-67.9	-42.9	176.7	-60	0	0	0	0	111.7	S17 D18 Q23 G24	S17-S21 VanDerWaalsContact O-CB 3.24Å; S17-S21 WeakPolarHBondContact O-CB 3.31Å; S17-S21 PolarHBondContact O-N 2.87Å; S17-S21 PolarHBondContact O-OG 3.27Å; D18-S21 PolarHBondContact O-N 3.25Å; S21-Q23 PolarHBondContact O-N 2.96Å; S21-G24 PolarHBondContact O-N 3.35Å
22	A	92.8	Very high	92.5	Very high	80 Å²	80	78.5 Å²	78.5	66%	0.661	45%	0.448	S	S	*	.	H	α-helix	trans	-59.9	-31.8	175.1	0	0	0	0	0	112.1	D18 G24	D18-A22 VanDerWaalsContact O-CB 3.3Å; D18-A22 WeakPolarHBondContact O-CB 3.39Å; D18-A22 PolarHBondContact O-N 2.93Å; A22-G24 VanDerWaalsContact C-N 3.32Å
23	Q	92.8	Very high	92.3	Very high	80 Å²	80	75 Å²	75	37%	0.374	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	11.1	175.3	-61.2	-54.2	-43	0	0	113.5	V19 C20 S21 V25 K32 F34	V19-Q23 WeakPolarHBondContact O-CG 3.5Å; V19-Q23 PolarHBondContact O-N 3.23Å; C20-Q23 CarbonylContact O-C 3.52Å; C20-Q23 PolarHBondContact O-N 2.75Å; S21-Q23 PolarHBondContact O-N 2.96Å; Q23-V25 VanDerWaalsContact C-N 3.28Å; Q23-V25 HydrophobicContact CB-CG2 4.38Å; Q23-V25 PolarHBondContact O-N 3.25Å; Q23-K32 PolarHBondContact O-NZ 2.79Å; Q23-F34 HydrophobicContact CG-CE1 4.41Å; Q23-F34 HydrophobicContact CG-CZ 4.29Å
24	G	91.6	Very high	92.2	Very high	47 Å²	47	80 Å²	80	49%	0.485	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	28	175.2	0	0	0	0	0	114.4	C20 S21 A22 R26	C20-G24 PolarHBondContact O-N 3.05Å; S21-G24 PolarHBondContact O-N 3.35Å; A22-G24 VanDerWaalsContact C-N 3.32Å; G24-R26 PolarHBondContact O-N 3.41Å
25	V	92.9	Very high	91.9	Very high	25 Å²	25	75.8 Å²	75.8	15%	0.152	42%	0.42	C	S	.	.			trans	-75.2	111.2	177.2	179.5	0	0	0	0	109.3	C20 Q23 Y28 T30	C20-V25 HydrophobicContact CB-CB 4.1Å; C20-V25 HydrophobicContact CB-CG2 4.34Å; C20-V25 WeakPolarHBondContact O-CB 3.2Å; C20-V25 WeakPolarHBondContact O-CG2 3.47Å; C20-V25 PolarHBondContact O-N 3.5Å; Q23-V25 VanDerWaalsContact C-N 3.28Å; Q23-V25 HydrophobicContact CB-CG2 4.38Å; Q23-V25 PolarHBondContact O-N 3.25Å; V25-Y28 HydrophobicContact CG1-CD1 3.93Å; V25-Y28 HydrophobicContact CG1-CE1 3.62Å; V25-T30 HydrophobicContact CG2-CG2 4.28Å
26	R	88.8	Confident	91.4	Very high	245 Å²	245	79.1 Å²	79.1	93%	0.925	44%	0.436	S	S	*	.			trans	-110.4	-0.5	-178.9	-61.9	-176.4	-177.1	174.7	1.1	114.3	G24	G24-R26 PolarHBondContact O-N 3.41Å
27	G	84.5	Confident	90.8	Very high	34 Å²	34	78.8 Å²	78.8	35%	0.351	46%	0.46	S	S	.	.	S	Bend	trans	-164.5	151	-178.9	0	0	0	0	0	111.6	T30	G27-T30 PolarHBondContact O-OG1 3.16Å
28	Y	90.5	Very high	90.5	Very high	159 Å²	159	80.1 Å²	80.1	62%	0.624	46%	0.458	S	S	*	.	S	Bend	trans	-116.9	139.1	-171.8	-49.8	-67	0	0	0	111.6	C13 V25	C13-Y28 HydrophobicContact CB-CD1 4.3Å; C13-Y28 HydrophobicContact CB-CE1 3.43Å; C13-Y28 VanDerWaalsContact CB-CE1 3.43Å; V25-Y28 HydrophobicContact CG1-CD1 3.93Å; V25-Y28 HydrophobicContact CG1-CE1 3.62Å
29	P	91.5	Very high	90.1	Very high	75 Å²	75	83.8 Å²	83.8	49%	0.487	47%	0.471	S	S	.	.	S	Bend	cis	-81.7	140	-7.9	32	-31.8	0	0	0	112	R47	P29-R47 PolarHBondContact O-NH2 2.86Å
30	T	91.9	Very high	89.9	Confident	38 Å²	38	81.9 Å²	81.9	23%	0.233	46%	0.463	C	S	.	.			trans	-107.6	124.5	169.5	-73	0	0	0	0	108.8	V25 G27 K32 K42	V25-T30 HydrophobicContact CG2-CG2 4.28Å; G27-T30 PolarHBondContact O-OG1 3.16Å; T30-K32 HydrophobicContact CG2-CG 4.13Å; T30-K42 HydrophobicContact CG2-CD 4.47Å; T30-K42 HydrophobicContact CG2-CG 4.42Å
31	L	94.6	Very high	89.8	Confident	64 Å²	64	84.4 Å²	84.4	34%	0.335	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133	177.6	-63.8	177.2	0	0	0	109.2	Y43 R47 L52	L31-Y43 HydrophobicContact CB-CD1 4.36Å; L31-Y43 HydrophobicContact CD1-CD1 3.91Å; L31-Y43 HydrophobicContact CD1-CE1 4.49Å; L31-Y43 PolarHBondContact O-N 3.27Å; L31-R47 HydrophobicContact CD1-CG 4.37Å; L31-L52 HydrophobicContact CD1-CD2 3.78Å
32	K	93.3	Very high	89.8	Confident	62 Å²	62	85.5 Å²	85.5	27%	0.27	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	140.9	179.6	-72.6	-172.6	166.6	-157.1	0	110.4	Q23 T30 F34 A40 V41 K42	Q23-K32 PolarHBondContact O-NZ 2.79Å; T30-K32 HydrophobicContact CG2-CG 4.13Å; K32-F34 HydrophobicContact CB-CD2 4.3Å; K32-F34 HydrophobicContact CB-CE2 3.62Å; K32-F34 HydrophobicContact CB-CZ 4.05Å; K32-F34 HydrophobicContact CD-CZ 4.16Å; K32-A40 HydrophobicContact CB-CB 4.36Å; K32-A40 HydrophobicContact CD-CB 4.01Å; K32-V41 CarbonylContact C-O 3.52Å; K32-V41 VanDerWaalsContact CA-O 3.27Å; K32-V41 WeakPolarHBondContact CA-O 3.34Å; K32-K42 HydrophobicContact CG-CB 4.37Å
33	L	91.5	Very high	89.8	Confident	16 Å²	16	82.4 Å²	82.4	8%	0.084	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	127.2	169.7	-173	114.8	0	0	0	108.9	K35 A40 V41 W55 M56 T59 L60	L33-K35 HydrophobicContact CD2-CD 4.28Å; L33-K35 HydrophobicContact CD2-CG 3.87Å; L33-A40 CarbonylContact O-C 3.55Å; L33-A40 WeakPolarHBondContact O-CA 3.45Å; L33-V41 PolarHBondContact N-O 3.49Å; L33-V41 PolarHBondContact O-N 3.45Å; L33-W55 HydrophobicContact CB-CH2 3.54Å; L33-W55 HydrophobicContact CB-CZ3 3.91Å; L33-W55 HydrophobicContact CD1-CZ3 4.39Å; L33-M56 HydrophobicContact CD1-CG 3.77Å; L33-T59 HydrophobicContact CD2-CG2 3.6Å; L33-L60 HydrophobicContact CD2-CD2 4.35Å
34	F	91.1	Very high	89.5	Confident	126 Å²	126	86.5 Å²	86.5	55%	0.553	46%	0.462	S	S	*	.			trans	-107.8	126.6	178.9	-65.6	-97.2	0	0	0	108.9	Q23 K32 A40	Q23-F34 HydrophobicContact CG-CE1 4.41Å; Q23-F34 HydrophobicContact CG-CZ 4.29Å; K32-F34 HydrophobicContact CB-CD2 4.3Å; K32-F34 HydrophobicContact CB-CE2 3.62Å; K32-F34 HydrophobicContact CB-CZ 4.05Å; K32-F34 HydrophobicContact CD-CZ 4.16Å; F34-A40 HydrophobicContact CD1-CB 3.55Å; F34-A40 HydrophobicContact CE1-CB 3.36Å; F34-A40 HydrophobicContact CE2-CB 4.38Å; F34-A40 HydrophobicContact CG-CB 4.15Å; F34-A40 HydrophobicContact CZ-CB 3.81Å
35	K	87.3	Confident	89	Confident	38 Å²	38	85.7 Å²	85.7	17%	0.165	45%	0.453	C	S	.	.			trans	-115.4	146.2	171.5	-69	171.8	177.8	-179.7	0	109.5	L33 G37 Q38 T59	L33-K35 HydrophobicContact CD2-CD 4.28Å; L33-K35 HydrophobicContact CD2-CG 3.87Å; K35-G37 PolarHBondContact O-N 2.92Å; K35-Q38 HydrophobicContact CB-CB 4.16Å; K35-Q38 HydrophobicContact CB-CG 4.41Å; K35-Q38 PolarHBondContact O-N 2.86Å; K35-T59 WeakPolarHBondContact CE-O 3.43Å; K35-T59 PolarHBondContact NZ-O 3.13Å
36	P	83.5	Confident	88.6	Confident	135 Å²	135	88.3 Å²	88.3	88%	0.877	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	125.4	175.7	-24.8	34.5	0	0	0	111.7	Q38	P36-Q38 VanDerWaalsContact C-N 3.27Å; P36-Q38 PolarHBondContact O-N 3.04Å
37	G	82.7	Confident	88.6	Confident	93 Å²	93	84.4 Å²	84.4	96%	0.959	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	7.4	176.4	0	0	0	0	0	116.1	K35	K35-G37 PolarHBondContact O-N 2.92Å
38	Q	84.9	Confident	88.8	Confident	102 Å²	102	86 Å²	86	48%	0.477	46%	0.457	S	S	.	.	S	Bend	trans	-121.1	156.5	177	-58.9	-174.9	-1.3	0	0	111.3	K35 P36	K35-Q38 HydrophobicContact CB-CB 4.16Å; K35-Q38 HydrophobicContact CB-CG 4.41Å; K35-Q38 PolarHBondContact O-N 2.86Å; P36-Q38 VanDerWaalsContact C-N 3.27Å; P36-Q38 PolarHBondContact O-N 3.04Å
39	E	85.9	Confident	88.2	Confident	183 Å²	183	86 Å²	86	86%	0.855	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-66.3	149.9	172.2	-68.6	-162.1	147.4	0	0	111.7	V41	E39-V41 PolarHBondContact O-N 2.73Å
40	A	89.7	Confident	87.4	Confident	26 Å²	26	88.9 Å²	88.9	22%	0.215	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-72.3	120	-177.4	0	0	0	0	0	111.4	K32 L33 F34 K42	K32-A40 HydrophobicContact CB-CB 4.36Å; K32-A40 HydrophobicContact CD-CB 4.01Å; L33-A40 CarbonylContact O-C 3.55Å; L33-A40 WeakPolarHBondContact O-CA 3.45Å; F34-A40 HydrophobicContact CD1-CB 3.55Å; F34-A40 HydrophobicContact CE1-CB 3.36Å; F34-A40 HydrophobicContact CE2-CB 4.38Å; F34-A40 HydrophobicContact CG-CB 4.15Å; F34-A40 HydrophobicContact CZ-CB 3.81Å; A40-K42 PolarHBondContact O-N 3.07Å
41	V	91.8	Very high	86.7	Confident	58 Å²	58	89.5 Å²	89.5	35%	0.352	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	120.7	180	-169.6	0	0	0	0	109.4	K32 L33 E39 W55 T59	K32-V41 CarbonylContact C-O 3.52Å; K32-V41 VanDerWaalsContact CA-O 3.27Å; K32-V41 WeakPolarHBondContact CA-O 3.34Å; L33-V41 PolarHBondContact N-O 3.49Å; L33-V41 PolarHBondContact O-N 3.45Å; E39-V41 PolarHBondContact O-N 2.73Å; V41-W55 HydrophobicContact CB-CZ2 4.28Å; V41-W55 HydrophobicContact CG1-CZ2 3.88Å; V41-T59 HydrophobicContact CB-CG2 4.46Å; V41-T59 HydrophobicContact CG2-CG2 4.21Å
42	K	92	Very high	86.4	Confident	109 Å²	109	88.6 Å²	88.6	47%	0.474	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	126.1	179.4	-176.3	178.7	177.7	-177.9	0	110.8	T30 K32 A40 Q44	T30-K42 HydrophobicContact CG2-CD 4.47Å; T30-K42 HydrophobicContact CG2-CG 4.42Å; K32-K42 HydrophobicContact CG-CB 4.37Å; A40-K42 PolarHBondContact O-N 3.07Å; K42-Q44 HydrophobicContact CG-CG 4.47Å
43	Y	92.3	Very high	85.9	Confident	16 Å²	16	89.8 Å²	89.8	6%	0.063	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	131.8	172.5	-179.1	-109.7	0	0	0	111.3	L31 G45 P46 T51 L52 W55	L31-Y43 HydrophobicContact CB-CD1 4.36Å; L31-Y43 HydrophobicContact CD1-CD1 3.91Å; L31-Y43 HydrophobicContact CD1-CE1 4.49Å; L31-Y43 PolarHBondContact O-N 3.27Å; Y43-G45 VanDerWaalsContact CE1-C 3.4Å; Y43-G45 WeakPolarHBondContact CE1-O 3.37Å; Y43-G45 VanDerWaalsContact CZ-C 3.45Å; Y43-G45 VanDerWaalsContact OH-C 3.28Å; Y43-G45 WeakPolarHBondContact OH-CA 3.4Å; Y43-P46 VanDerWaalsContact CE1-O 3.27Å; Y43-P46 WeakPolarHBondContact CE1-O 3.27Å; Y43-P46 VanDerWaalsContact CZ-O 3.28Å; Y43-P46 PolarHBondContact OH-O 2.88Å; Y43-T51 WeakPolarHBondContact OH-CG2 3.38Å; Y43-L52 HydrophobicContact CD1-CD2 3.55Å; Y43-L52 HydrophobicContact CD2-CD2 4.48Å; Y43-L52 HydrophobicContact CE1-CD2 3.27Å; Y43-L52 HydrophobicContact CE1-CG 4.1Å; Y43-L52 HydrophobicContact CE2-CD2 4.27Å; Y43-L52 HydrophobicContact CG-CD2 4.12Å; Y43-W55 HydrophobicContact CD2-CB 4.17Å; Y43-W55 AromaticContact CD2-CD1 3.89Å; Y43-W55 AromaticContact CD2-CD2 3.32Å; Y43-W55 HydrophobicContact CD2-CD2 3.32Å; Y43-W55 AromaticContact CD2-CE2 3.62Å; Y43-W55 AromaticContact CD2-CE3 3.69Å; Y43-W55 HydrophobicContact CD2-CE3 3.69Å; Y43-W55 AromaticContact CD2-CG 3.51Å; Y43-W55 HydrophobicContact CD2-CG 3.51Å; Y43-W55 HydrophobicContact CD2-CH2 4.48Å; Y43-W55 HydrophobicContact CD2-CZ2 4.2Å; Y43-W55 HydrophobicContact CD2-CZ3 4.26Å; Y43-W55 AromaticContact CD2-NE1 3.95Å; Y43-W55 HydrophobicContact CE2-CB 3.78Å; Y43-W55 AromaticContact CE2-CD2 3.9Å; Y43-W55 HydrophobicContact CE2-CD2 3.9Å; Y43-W55 HydrophobicContact CE2-CE3 4.33Å; Y43-W55 AromaticContact CE2-CG 3.61Å; Y43-W55 HydrophobicContact CE2-CG 3.61Å; Y43-W55 HydrophobicContact CG-CD2 4.21Å; Y43-W55 HydrophobicContact CG-CE3 4.2Å; Y43-W55 HydrophobicContact CG-CZ3 4.39Å
44	Q	86.4	Confident	85.4	Confident	166 Å²	166	92.8 Å²	92.8	78%	0.776	49%	0.489	S	S	*	.			trans	-122.1	1.9	179.8	-60.2	-165.8	8.8	0	0	113.6	K42	K42-Q44 HydrophobicContact CG-CG 4.47Å
45	G	82.9	Confident	85.2	Confident	29 Å²	29	89.3 Å²	89.3	30%	0.299	47%	0.472	S	S	.	.	S	Bend	trans	-82.7	-178.5	-177.6	0	0	0	0	0	115	Y43	Y43-G45 VanDerWaalsContact CE1-C 3.4Å; Y43-G45 WeakPolarHBondContact CE1-O 3.37Å; Y43-G45 VanDerWaalsContact CZ-C 3.45Å; Y43-G45 VanDerWaalsContact OH-C 3.28Å; Y43-G45 WeakPolarHBondContact OH-CA 3.4Å
46	P	83	Confident	85.2	Confident	80 Å²	80	90 Å²	90	52%	0.519	48%	0.476	S	S	.	.			trans	-51.5	140.5	170.4	-29.2	36.6	0	0	0	114	Y43 D48 T51	Y43-P46 VanDerWaalsContact CE1-O 3.27Å; Y43-P46 WeakPolarHBondContact CE1-O 3.27Å; Y43-P46 VanDerWaalsContact CZ-O 3.28Å; Y43-P46 PolarHBondContact OH-O 2.88Å; P46-D48 VanDerWaalsContact C-N 3.28Å; P46-D48 WeakPolarHBondContact CB-OD2 3.38Å; P46-D48 PolarHBondContact O-N 3.36Å; P46-T51 HydrophobicContact CB-CG2 4.47Å; P46-T51 HydrophobicContact CG-CG2 4.49Å
47	R	88.4	Confident	85.2	Confident	164 Å²	164	88.3 Å²	88.3	62%	0.619	46%	0.46	S	S	*	.			trans	-92.1	33.6	-176.3	-59.5	-174.7	-175.5	113.9	-7.6	113.6	P29 L31	P29-R47 PolarHBondContact O-NH2 2.86Å; L31-R47 HydrophobicContact CD1-CG 4.37Å
48	D	89.4	Confident	85.1	Confident	68 Å²	68	90 Å²	90	36%	0.364	44%	0.443	S	S	.	.	S	Bend	trans	-90.1	156.1	171.3	63.5	90.1	0	0	0	111.6	P46 Q50 T51 L52	P46-D48 VanDerWaalsContact C-N 3.28Å; P46-D48 WeakPolarHBondContact CB-OD2 3.38Å; P46-D48 PolarHBondContact O-N 3.36Å; D48-Q50 PolarHBondContact O-N 2.99Å; D48-Q50 PolarHBondContact OD1-N 3.3Å; D48-T51 PolarHBondContact O-N 3.11Å; D48-T51 WeakPolarHBondContact OD1-CB 3Å; D48-T51 PolarHBondContact OD1-N 3.48Å; D48-T51 PolarHBondContact OD1-OG1 2.88Å; D48-T51 PolarHBondContact OD2-OG1 3.33Å; D48-L52 WeakPolarHBondContact O-CB 3.24Å; D48-L52 WeakPolarHBondContact O-CG 3.42Å; D48-L52 PolarHBondContact O-N 3.35Å; D48-L52 VanDerWaalsContact O-N 3.08Å
49	F	77.6	Confident	85.1	Confident	159 Å²	159	86 Å²	86	70%	0.697	43%	0.425	S	S	*	.	H	α-helix	trans	-57.6	-47.9	-173.5	178.2	-95.7	0	0	0	112.6	T51 L52 E53	F49-T51 PolarHBondContact O-N 3.02Å; F49-L52 PolarHBondContact O-N 2.8Å; F49-E53 WeakPolarHBondContact CE1-OE2 3.47Å; F49-E53 VanDerWaalsContact O-CB 3.31Å; F49-E53 WeakPolarHBondContact O-CB 3.31Å; F49-E53 PolarHBondContact O-N 3.23Å
50	Q	74.5	Confident	84.9	Confident	134 Å²	134	80.4 Å²	80.4	63%	0.626	40%	0.401	S	S	*	.	H	α-helix	trans	-66.6	-41.5	-173.8	-169.9	172.6	14.7	0	0	111.7	D48 N54	D48-Q50 PolarHBondContact O-N 2.99Å; D48-Q50 PolarHBondContact OD1-N 3.3Å; Q50-N54 WeakPolarHBondContact O-CB 3.28Å; Q50-N54 PolarHBondContact O-N 3.46Å; Q50-N54 PolarHBondContact O-ND2 3.3Å
51	T	78.8	Confident	84.2	Confident	51 Å²	51	86.3 Å²	86.3	31%	0.313	43%	0.429	S	S	.	.	H	α-helix	trans	-69.3	-40.2	178.1	-49.7	0	0	0	0	111.7	Y43 P46 D48 F49 W55	Y43-T51 WeakPolarHBondContact OH-CG2 3.38Å; P46-T51 HydrophobicContact CB-CG2 4.47Å; P46-T51 HydrophobicContact CG-CG2 4.49Å; D48-T51 PolarHBondContact O-N 3.11Å; D48-T51 WeakPolarHBondContact OD1-CB 3Å; D48-T51 PolarHBondContact OD1-N 3.48Å; D48-T51 PolarHBondContact OD1-OG1 2.88Å; D48-T51 PolarHBondContact OD2-OG1 3.33Å; F49-T51 PolarHBondContact O-N 3.02Å; T51-W55 VanDerWaalsContact O-CB 3.29Å; T51-W55 WeakPolarHBondContact O-CB 2.86Å; T51-W55 PolarHBondContact O-N 3.04Å
52	L	86.4	Confident	82.4	Confident	45 Å²	45	90.5 Å²	90.5	24%	0.236	44%	0.444	C	S	.	.	H	α-helix	trans	-64.6	-42.4	175.8	-76.7	169.3	0	0	0	112.4	L31 Y43 D48 F49 M56	L31-L52 HydrophobicContact CD1-CD2 3.78Å; Y43-L52 HydrophobicContact CD1-CD2 3.55Å; Y43-L52 HydrophobicContact CD2-CD2 4.48Å; Y43-L52 HydrophobicContact CE1-CD2 3.27Å; Y43-L52 HydrophobicContact CE1-CG 4.1Å; Y43-L52 HydrophobicContact CE2-CD2 4.27Å; Y43-L52 HydrophobicContact CG-CD2 4.12Å; D48-L52 WeakPolarHBondContact O-CB 3.24Å; D48-L52 WeakPolarHBondContact O-CG 3.42Å; D48-L52 PolarHBondContact O-N 3.35Å; D48-L52 VanDerWaalsContact O-N 3.08Å; F49-L52 PolarHBondContact O-N 2.8Å; L52-M56 VanDerWaalsContact O-CB 3.22Å; L52-M56 WeakPolarHBondContact O-CB 3.27Å; L52-M56 PolarHBondContact O-N 3.18Å
53	E	83.4	Confident	79.9	Confident	87 Å²	87	93.8 Å²	93.8	41%	0.407	46%	0.461	S	S	.	.	H	α-helix	trans	-63.1	-49.8	177.4	-177.9	172.4	-127.5	0	0	110.9	F49 W55 M56 L57	F49-E53 WeakPolarHBondContact CE1-OE2 3.47Å; F49-E53 VanDerWaalsContact O-CB 3.31Å; F49-E53 WeakPolarHBondContact O-CB 3.31Å; F49-E53 PolarHBondContact O-N 3.23Å; E53-W55 PolarHBondContact O-N 3.28Å; E53-M56 PolarHBondContact O-N 3.25Å; E53-L57 HydrophobicContact CG-CD1 4.01Å; E53-L57 WeakPolarHBondContact O-CB 3.26Å; E53-L57 WeakPolarHBondContact O-CG 3.36Å; E53-L57 PolarHBondContact O-N 2.76Å
54	N	81	Confident	77.4	Confident	79 Å²	79	98.8 Å²	98.8	42%	0.422	50%	0.496	S	S	.	.	H	α-helix	trans	-61.6	-46.2	179.1	-72.6	-19.8	0	0	0	112.2	Q50 M56 L57 Q58	Q50-N54 WeakPolarHBondContact O-CB 3.28Å; Q50-N54 PolarHBondContact O-N 3.46Å; Q50-N54 PolarHBondContact O-ND2 3.3Å; N54-M56 VanDerWaalsContact C-N 3.33Å; N54-M56 PolarHBondContact O-N 2.62Å; N54-L57 PolarHBondContact O-N 3.4Å; N54-Q58 WeakPolarHBondContact O-CB 3.43Å; N54-Q58 VanDerWaalsContact O-CG 3.29Å; N54-Q58 WeakPolarHBondContact O-CG 3.47Å; N54-Q58 PolarHBondContact O-N 3.48Å
55	W	87.3	Confident	74.8	Confident	53 Å²	53	96.6 Å²	96.6	20%	0.201	49%	0.493	C	S	.	.	H	α-helix	trans	-61.4	-42.4	177.4	173.2	78.7	0	0	0	111.9	L33 V41 Y43 T51 E53 T59	L33-W55 HydrophobicContact CB-CH2 3.54Å; L33-W55 HydrophobicContact CB-CZ3 3.91Å; L33-W55 HydrophobicContact CD1-CZ3 4.39Å; V41-W55 HydrophobicContact CB-CZ2 4.28Å; V41-W55 HydrophobicContact CG1-CZ2 3.88Å; Y43-W55 HydrophobicContact CD2-CB 4.17Å; Y43-W55 AromaticContact CD2-CD1 3.89Å; Y43-W55 AromaticContact CD2-CD2 3.32Å; Y43-W55 HydrophobicContact CD2-CD2 3.32Å; Y43-W55 AromaticContact CD2-CE2 3.62Å; Y43-W55 AromaticContact CD2-CE3 3.69Å; Y43-W55 HydrophobicContact CD2-CE3 3.69Å; Y43-W55 AromaticContact CD2-CG 3.51Å; Y43-W55 HydrophobicContact CD2-CG 3.51Å; Y43-W55 HydrophobicContact CD2-CH2 4.48Å; Y43-W55 HydrophobicContact CD2-CZ2 4.2Å; Y43-W55 HydrophobicContact CD2-CZ3 4.26Å; Y43-W55 AromaticContact CD2-NE1 3.95Å; Y43-W55 HydrophobicContact CE2-CB 3.78Å; Y43-W55 AromaticContact CE2-CD2 3.9Å; Y43-W55 HydrophobicContact CE2-CD2 3.9Å; Y43-W55 HydrophobicContact CE2-CE3 4.33Å; Y43-W55 AromaticContact CE2-CG 3.61Å; Y43-W55 HydrophobicContact CE2-CG 3.61Å; Y43-W55 HydrophobicContact CG-CD2 4.21Å; Y43-W55 HydrophobicContact CG-CE3 4.2Å; Y43-W55 HydrophobicContact CG-CZ3 4.39Å; T51-W55 VanDerWaalsContact O-CB 3.29Å; T51-W55 WeakPolarHBondContact O-CB 2.86Å; T51-W55 PolarHBondContact O-N 3.04Å; E53-W55 PolarHBondContact O-N 3.28Å; W55-T59 WeakPolarHBondContact O-CB 3.41Å; W55-T59 PolarHBondContact O-N 3.15Å; W55-T59 PolarHBondContact O-OG1 3.06Å
56	M	87	Confident	73	Confident	52 Å²	52	101.7 Å²	101.7	26%	0.256	52%	0.519	S	S	.	.	H	α-helix	trans	-62.4	-48.1	177.6	-177.3	-171.7	-57.7	0	0	111.2	V6 V8 L33 L52 E53 N54 T59 L60	V6-M56 HydrophobicContact CB-SD 4.47Å; V6-M56 HydrophobicContact CG1-SD 3.75Å; V8-M56 HydrophobicContact CG2-CE 4.4Å; L33-M56 HydrophobicContact CD1-CG 3.77Å; L52-M56 VanDerWaalsContact O-CB 3.22Å; L52-M56 WeakPolarHBondContact O-CB 3.27Å; L52-M56 PolarHBondContact O-N 3.18Å; E53-M56 PolarHBondContact O-N 3.25Å; N54-M56 VanDerWaalsContact C-N 3.33Å; N54-M56 PolarHBondContact O-N 2.62Å; M56-T59 PolarHBondContact O-N 2.92Å; M56-L60 HydrophobicContact CG-CD1 3.95Å; M56-L60 WeakPolarHBondContact O-CD1 3.42Å; M56-L60 VanDerWaalsContact O-CG 3.23Å; M56-L60 WeakPolarHBondContact O-CG 3.35Å; M56-L60 PolarHBondContact O-N 3.13Å
57	L	83.3	Confident	70.7	Confident	101 Å²	101	102.8 Å²	102.8	53%	0.529	53%	0.526	S	S	.	.	H	α-helix	trans	-63.9	-41.5	179.5	-70	174	0	0	0	112.2	E53 N54 L60 N61	E53-L57 HydrophobicContact CG-CD1 4.01Å; E53-L57 WeakPolarHBondContact O-CB 3.26Å; E53-L57 WeakPolarHBondContact O-CG 3.36Å; E53-L57 PolarHBondContact O-N 2.76Å; N54-L57 PolarHBondContact O-N 3.4Å; L57-L60 PolarHBondContact O-N 3.41Å; L57-N61 PolarHBondContact O-N 2.94Å
58	Q	81.9	Confident	68.5	Low	129 Å²	129	103.1 Å²	103.1	60%	0.603	54%	0.535	S	S	*	.	H	α-helix	trans	-62.2	-49.3	174.3	-76	175.1	-22.2	0	0	111.3	N54 L60 N61	N54-Q58 WeakPolarHBondContact O-CB 3.43Å; N54-Q58 VanDerWaalsContact O-CG 3.29Å; N54-Q58 WeakPolarHBondContact O-CG 3.47Å; N54-Q58 PolarHBondContact O-N 3.48Å; Q58-L60 PolarHBondContact O-N 3.48Å; Q58-N61 PolarHBondContact O-N 2.93Å
59	T	83.1	Confident	66	Low	16 Å²	16	105.8 Å²	105.8	10%	0.098	56%	0.556	C	S	.	*	H	α-helix	trans	-61.3	-34.3	-178.6	-51.7	0	0	0	0	110.8	L33 K35 V41 W55 M56 N61	L33-T59 HydrophobicContact CD2-CG2 3.6Å; K35-T59 WeakPolarHBondContact CE-O 3.43Å; K35-T59 PolarHBondContact NZ-O 3.13Å; V41-T59 HydrophobicContact CB-CG2 4.46Å; V41-T59 HydrophobicContact CG2-CG2 4.21Å; W55-T59 WeakPolarHBondContact O-CB 3.41Å; W55-T59 PolarHBondContact O-N 3.15Å; W55-T59 PolarHBondContact O-OG1 3.06Å; M56-T59 PolarHBondContact O-N 2.92Å; T59-N61 VanDerWaalsContact C-N 3.29Å; T59-N61 PolarHBondContact O-N 3.5Å
60	L	83.8	Confident	64.2	Low	66 Å²	66	106.5 Å²	106.5	35%	0.346	56%	0.561	S	S	.	*	H	α-helix	trans	-73.8	-13.9	179.1	-69.8	166	0	0	0	114.7	V6 L33 M56 L57 Q58	V6-L60 HydrophobicContact CG2-CD1 3.34Å; L33-L60 HydrophobicContact CD2-CD2 4.35Å; M56-L60 HydrophobicContact CG-CD1 3.95Å; M56-L60 WeakPolarHBondContact O-CD1 3.42Å; M56-L60 VanDerWaalsContact O-CG 3.23Å; M56-L60 WeakPolarHBondContact O-CG 3.35Å; M56-L60 PolarHBondContact O-N 3.13Å; L57-L60 PolarHBondContact O-N 3.41Å; Q58-L60 PolarHBondContact O-N 3.48Å
61	N	74.6	Confident	62.8	Low	150 Å²	150	106.3 Å²	106.3	80%	0.802	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.4	15.6	-172.1	-103.7	52.4	0	0	0	115.1	L57 Q58 T59	L57-N61 PolarHBondContact O-N 2.94Å; Q58-N61 PolarHBondContact O-N 2.93Å; T59-N61 VanDerWaalsContact C-N 3.29Å; T59-N61 PolarHBondContact O-N 3.5Å
62	E	53.8	Low	61	Low	146 Å²	146	111.1 Å²	111.1	68%	0.682	59%	0.588	S	S	*	*			trans	-103.3	123.4	175.4	-71.8	-178	170.3	0	0	112.9
63	E	38.5	Very low	59.2	Low	178 Å²	178	114 Å²	114	83%	0.832	61%	0.61	S	S	*	*			trans	-76.1	148.1	156.5	-71.2	-162.5	158	0	0	109.7	V65	E63-V65 PolarHBondContact O-N 2.84Å
64	P	40.8	Very low	57.4	Low	121 Å²	121	113.6 Å²	113.6	79%	0.786	61%	0.614	S	S	*	*			trans	-78.7	98.7	-171.9	33	-30.5	0	0	0	109.4
65	V	32.1	Very low	56.1	Low	120 Å²	120	112.8 Å²	112.8	73%	0.727	62%	0.615	S	S	*	*			trans	-97.6	113	154.1	-177.6	0	0	0	0	105.1	E63 P67	E63-V65 PolarHBondContact O-N 2.84Å; V65-P67 WeakPolarHBondContact O-CD 3.37Å
66	T	43.5	Very low	54.7	Low	137 Å²	137	114.3 Å²	114.3	84%	0.84	64%	0.639	S	S	*	*			trans	-71.7	113	152.4	35.9	0	0	0	0	107
67	P	36.1	Very low	53.4	Low	102 Å²	102	113.4 Å²	113.4	66%	0.662	64%	0.637	S	S	*	*			trans	-87.2	128.9	156.2	7	15.5	0	0	0	106.9	V65	V65-P67 WeakPolarHBondContact O-CD 3.37Å
68	E	41.3	Very low	52.3	Low	172 Å²	172	114.6 Å²	114.6	80%	0.804	64%	0.64	S	S	*	*			trans	-44.8	152	148.6	-73	175	143.7	0	0	109.1	E70	E68-E70 VanDerWaalsContact C-N 3.29Å; E68-E70 PolarHBondContact O-N 2.85Å
69	P	37.8	Very low	51.6	Low	124 Å²	124	112.7 Å²	112.7	81%	0.805	63%	0.633	S	S	*	*			trans	-63.5	93.6	-179.4	27.7	-32.7	0	0	0	109.2	V71	P69-V71 PolarHBondContact O-N 2.78Å; P69-V71 VanDerWaalsContact O-N 3.09Å
70	E	38.7	Very low	50.8	Low	173 Å²	173	117 Å²	117	81%	0.808	65%	0.651	S	S	*	*			trans	-67.6	105.5	160.1	-86.6	-171.4	155.8	0	0	105.9	E68 E72	E68-E70 VanDerWaalsContact C-N 3.29Å; E68-E70 PolarHBondContact O-N 2.85Å; E70-E72 VanDerWaalsContact C-N 3.26Å; E70-E72 PolarHBondContact O-N 3.2Å
71	V	45.3	Very low	50	Low	131 Å²	131	120.7 Å²	120.7	79%	0.794	67%	0.666	S	S	*	*			trans	-59.5	97.5	162.8	-179.8	0	0	0	0	105.7	P69	P69-V71 PolarHBondContact O-N 2.78Å; P69-V71 VanDerWaalsContact O-N 3.09Å
72	E	42.4	Very low	50.2	Low	151 Å²	151	113.8 Å²	113.8	71%	0.706	63%	0.63	S	S	*	*			trans	-55.3	130.1	166.7	-71.5	-154.2	163.2	0	0	107.3	E70	E70-E72 VanDerWaalsContact C-N 3.26Å; E70-E72 PolarHBondContact O-N 3.2Å
73	P	48.3	Very low	51.9	Low	107 Å²	107	107.2 Å²	107.2	70%	0.695	60%	0.6	S	S	*	*			trans	-55	141.7	176.8	22.7	-31.1	0	0	0	108.5	S75	P73-S75 PolarHBondContact O-N 3.38Å
74	P	45.8	Very low	54.5	Low	77 Å²	77	101.1 Å²	101.1	50%	0.5	57%	0.57	S	S	.	*			trans	-55.4	110.5	-176	20.3	-31.5	0	0	0	109.9	A76 L93	P74-A76 PolarHBondContact O-N 3.4Å; P74-L93 HydrophobicContact CB-CD1 3.17Å; P74-L93 HydrophobicContact CG-CD1 3.49Å; P74-L93 VanDerWaalsContact CG-CD1 3.49Å
75	S	52.6	Low	56.9	Low	62 Å²	62	98.6 Å²	98.6	43%	0.434	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-71.3	130.5	174.9	51.7	0	0	0	0	108.5	P73 N90	P73-S75 PolarHBondContact O-N 3.38Å; S75-N90 WeakPolarHBondContact O-CB 3.47Å
76	A	57.4	Low	59.8	Low	85 Å²	85	93.2 Å²	93.2	70%	0.702	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-56.7	136	175.7	0	0	0	0	0	109.3	P74 E78	P74-A76 PolarHBondContact O-N 3.4Å; A76-E78 PolarHBondContact O-N 2.85Å
77	P	60.3	Low	61.7	Low	34 Å²	34	87.7 Å²	87.7	22%	0.221	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-62.1	125.2	-178	21.8	-29.2	0	0	0	110.3	L79 Y84 L86 H94	P77-L79 PolarHBondContact O-N 3.19Å; P77-Y84 HydrophobicContact CB-CD1 4.02Å; P77-Y84 HydrophobicContact CG-CD1 4.09Å; P77-L86 HydrophobicContact CB-CD2 3.84Å; P77-H94 HydrophobicContact CG-CB 4.25Å; P77-H94 WeakPolarHBondContact CG-ND1 3.27Å
78	E	60.9	Low	63.7	Low	125 Å²	125	85.9 Å²	85.9	58%	0.584	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-65.1	125.1	178.9	-70.7	-170.9	172.2	0	0	110.1	A76 K80 E85	A76-E78 PolarHBondContact O-N 2.85Å; E78-K80 IonicContact OE2-NZ 3.32Å; E78-K80 PolarHBondContact OE2-NZ 2.88Å; E78-E85 PolarHBondContact O-N 3.39Å
79	L	65.9	Low	65.6	Low	89 Å²	89	80.6 Å²	80.6	47%	0.466	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	118.1	176.5	-176.2	67.5	0	0	0	109.5	P77 Y84	P77-L79 PolarHBondContact O-N 3.19Å; L79-Y84 HydrophobicContact CB-CE1 4.28Å; L79-Y84 HydrophobicContact CD1-CD1 4.04Å; L79-Y84 HydrophobicContact CD1-CD2 4.14Å; L79-Y84 HydrophobicContact CD1-CE1 3.77Å; L79-Y84 HydrophobicContact CD1-CE2 3.85Å; L79-Y84 HydrophobicContact CD1-CG 4.24Å
80	K	67.3	Low	67.9	Low	107 Å²	107	75 Å²	75	47%	0.465	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	106.1	168.8	-68.5	173.4	-171	146.5	0	108.1	E78 G82 L83 E85	E78-K80 IonicContact OE2-NZ 3.32Å; E78-K80 PolarHBondContact OE2-NZ 2.88Å; K80-G82 PolarHBondContact O-N 2.95Å; K80-L83 PolarHBondContact N-O 3.41Å; K80-L83 VanDerWaalsContact N-O 3.1Å; K80-L83 WeakPolarHBondContact O-CB 3.34Å; K80-L83 PolarHBondContact O-N 3.2Å; K80-L83 VanDerWaalsContact O-N 3.11Å; K80-E85 IonicContact NZ-OE2 2.82Å; K80-E85 PolarHBondContact NZ-OE2 3.06Å
81	Q	67.5	Low	70.4	Confident	143 Å²	143	67.2 Å²	67.2	67%	0.668	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	51.6	174.3	-56.5	176.2	-11.8	0	0	113.6	L83 L124 E127	Q81-L83 PolarHBondContact O-N 3.03Å; Q81-L124 HydrophobicContact CB-CD1 4.46Å; Q81-E127 WeakPolarHBondContact CA-OE1 3.36Å
82	G	78.4	Confident	72.6	Confident	5 Å²	5	68.4 Å²	68.4	5%	0.052	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	-4.8	-177.2	0	0	0	0	0	116.1	K80 E127	K80-G82 PolarHBondContact O-N 2.95Å; G82-E127 PolarHBondContact N-OE1 2.7Å; G82-E127 VanDerWaalsContact N-OE1 3.17Å
83	L	89.9	Confident	74.8	Confident	9 Å²	9	66.7 Å²	66.7	5%	0.047	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	121.3	-179.5	-176.9	61.8	0	0	0	111.5	K80 Q81 E120 A123 I134 K136	K80-L83 PolarHBondContact N-O 3.41Å; K80-L83 VanDerWaalsContact N-O 3.1Å; K80-L83 WeakPolarHBondContact O-CB 3.34Å; K80-L83 PolarHBondContact O-N 3.2Å; K80-L83 VanDerWaalsContact O-N 3.11Å; Q81-L83 PolarHBondContact O-N 3.03Å; L83-E120 HydrophobicContact CD2-CG 4.02Å; L83-A123 HydrophobicContact CB-CB 3.76Å; L83-A123 HydrophobicContact CD1-CB 4.15Å; L83-A123 HydrophobicContact CG-CB 4.48Å; L83-I134 HydrophobicContact CD1-CG2 3.99Å; L83-K136 HydrophobicContact CD1-CB 4.47Å; L83-K136 HydrophobicContact CD1-CG 4.32Å; L83-K136 HydrophobicContact CD2-CD 3.9Å; L83-K136 HydrophobicContact CD2-CG 4.35Å; L83-K136 HydrophobicContact CG-CD 4.4Å; L83-K136 HydrophobicContact CG-CG 4.33Å
84	Y	92.7	Very high	76.9	Confident	50 Å²	50	62.3 Å²	62.3	20%	0.196	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128.6	176.9	-66.3	-85.4	0	0	0	111.9	P77 L79 H94 K133 I134 G135 K136	P77-Y84 HydrophobicContact CB-CD1 4.02Å; P77-Y84 HydrophobicContact CG-CD1 4.09Å; L79-Y84 HydrophobicContact CB-CE1 4.28Å; L79-Y84 HydrophobicContact CD1-CD1 4.04Å; L79-Y84 HydrophobicContact CD1-CD2 4.14Å; L79-Y84 HydrophobicContact CD1-CE1 3.77Å; L79-Y84 HydrophobicContact CD1-CE2 3.85Å; L79-Y84 HydrophobicContact CD1-CG 4.24Å; Y84-H94 AromaticContact CD1-CE1 3.41Å; Y84-H94 VanDerWaalsContact CD1-CE1 3.41Å; Y84-H94 WeakPolarHBondContact CD1-CE1 3.24Å; Y84-H94 AromaticContact CD2-CE1 3.47Å; Y84-H94 VanDerWaalsContact CD2-CE1 3.47Å; Y84-H94 WeakPolarHBondContact CD2-CE1 3.38Å; Y84-H94 AromaticContact CD2-NE2 3.76Å; Y84-H94 AromaticContact CE1-CE1 3.74Å; Y84-H94 AromaticContact CE2-CE1 3.82Å; Y84-H94 AromaticContact CG-CE1 3.24Å; Y84-H94 AromaticContact CG-NE2 3.72Å; Y84-H94 AromaticContact CZ-CE1 3.93Å; Y84-K133 HydrophobicContact CD2-CB 4.04Å; Y84-K133 HydrophobicContact CE2-CB 3.73Å; Y84-K133 HydrophobicContact CE2-CD 3.98Å; Y84-K133 HydrophobicContact CE2-CG 3.83Å; Y84-I134 WeakPolarHBondContact CD2-O 3.46Å; Y84-I134 PolarHBondContact N-O 3.47Å; Y84-G135 CarbonylContact O-C 3.59Å; Y84-G135 VanDerWaalsContact O-CA 3.32Å; Y84-G135 WeakPolarHBondContact O-CA 3.31Å; Y84-K136 PolarHBondContact O-N 3.1Å
85	E	91.1	Very high	79.2	Confident	67 Å²	67	58.8 Å²	58.8	31%	0.313	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	113	169.9	-57.3	-161.8	133.1	0	0	109.5	E78 K80 N90 K136	E78-E85 PolarHBondContact O-N 3.39Å; K80-E85 IonicContact NZ-OE2 2.82Å; K80-E85 PolarHBondContact NZ-OE2 3.06Å; E85-N90 PolarHBondContact O-ND2 3.47Å; E85-K136 WeakPolarHBondContact OE1-CE 3.41Å; E85-K136 IonicContact OE1-NZ 2.7Å; E85-K136 PolarHBondContact OE1-NZ 3.09Å
86	L	92.4	Very high	81	Confident	7 Å²	7	58.4 Å²	58.4	4%	0.037	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	136.7	-172.6	-56.4	179.8	0	0	0	111.5	P77 N90 F91 H94 I102 K136 V137	P77-L86 HydrophobicContact CB-CD2 3.84Å; L86-N90 VanDerWaalsContact CA-OD1 3.26Å; L86-N90 WeakPolarHBondContact CA-OD1 3.39Å; L86-F91 HydrophobicContact CB-CD2 4.18Å; L86-F91 HydrophobicContact CD1-CD2 3.97Å; L86-F91 HydrophobicContact CD1-CE2 4.27Å; L86-H94 HydrophobicContact CD2-CB 3.82Å; L86-I102 HydrophobicContact CD1-CD1 3.57Å; L86-I102 HydrophobicContact CD1-CG1 4.02Å; L86-I102 HydrophobicContact CD1-CG2 4.1Å; L86-K136 PolarHBondContact N-O 3.42Å; L86-V137 HydrophobicContact CB-CG2 3.67Å; L86-V137 HydrophobicContact CD1-CG2 4.45Å
87	S	83.8	Confident	82.5	Confident	21 Å²	21	61.8 Å²	61.8	15%	0.147	33%	0.325	C	S	.	.			trans	-126.6	171.5	-179.1	70.6	0	0	0	0	110.4	S89 N90 F91 H142	S87-S89 PolarHBondContact O-N 2.93Å; S87-S89 PolarHBondContact OG-N 3.13Å; S87-S89 PolarHBondContact OG-OG 2.92Å; S87-N90 PolarHBondContact N-OD1 3.25Å; S87-N90 PolarHBondContact O-N 3.23Å; S87-N90 PolarHBondContact O-OD1 3.47Å; S87-N90 PolarHBondContact OG-ND2 2.93Å; S87-F91 WeakPolarHBondContact O-CB 3.46Å; S87-F91 PolarHBondContact O-N 2.78Å; S87-H142 WeakPolarHBondContact CA-NE2 3.48Å; S87-H142 WeakPolarHBondContact CB-NE2 3.45Å
88	A	77.6	Confident	84	Confident	65 Å²	65	61.6 Å²	61.6	54%	0.537	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.9	174.2	0	0	0	0	0	113.5
89	S	81.7	Confident	85.7	Confident	61 Å²	61	56.1 Å²	56.1	43%	0.427	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-23	-177.1	56.2	0	0	0	0	114.3	S87	S87-S89 PolarHBondContact O-N 2.93Å; S87-S89 PolarHBondContact OG-N 3.13Å; S87-S89 PolarHBondContact OG-OG 2.92Å
90	N	86.6	Confident	87.2	Confident	7 Å²	7	51.9 Å²	51.9	4%	0.037	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-13.3	-174.4	73	20.4	0	0	0	114.1	S75 E85 L86 S87 E92 H94	S75-N90 WeakPolarHBondContact O-CB 3.47Å; E85-N90 PolarHBondContact O-ND2 3.47Å; L86-N90 VanDerWaalsContact CA-OD1 3.26Å; L86-N90 WeakPolarHBondContact CA-OD1 3.39Å; S87-N90 PolarHBondContact N-OD1 3.25Å; S87-N90 PolarHBondContact O-N 3.23Å; S87-N90 PolarHBondContact O-OD1 3.47Å; S87-N90 PolarHBondContact OG-ND2 2.93Å; N90-E92 PolarHBondContact O-N 2.7Å; N90-H94 VanDerWaalsContact O-CB 3.28Å; N90-H94 WeakPolarHBondContact O-CB 3.2Å; N90-H94 PolarHBondContact O-N 3.11Å
91	F	91.4	Very high	88.7	Confident	8 Å²	8	46.8 Å²	46.8	4%	0.035	26%	0.26	C	S	.	.	H	α-helix	trans	-59.7	-52.5	-172.4	-177.8	-87.5	0	0	0	112.3	L86 S87 L93 H94 V95 I102 F104 V137 L145 F160	L86-F91 HydrophobicContact CB-CD2 4.18Å; L86-F91 HydrophobicContact CD1-CD2 3.97Å; L86-F91 HydrophobicContact CD1-CE2 4.27Å; S87-F91 WeakPolarHBondContact O-CB 3.46Å; S87-F91 PolarHBondContact O-N 2.78Å; F91-L93 PolarHBondContact O-N 2.99Å; F91-H94 WeakPolarHBondContact O-CB 3.28Å; F91-H94 PolarHBondContact O-N 3.09Å; F91-H94 VanDerWaalsContact O-N 3.15Å; F91-V95 HydrophobicContact CD1-CG1 4.43Å; F91-V95 HydrophobicContact CD1-CG2 4.09Å; F91-V95 HydrophobicContact CE1-CG1 4.06Å; F91-V95 HydrophobicContact CE1-CG2 3.85Å; F91-V95 HydrophobicContact CE2-CG1 4.25Å; F91-V95 HydrophobicContact CZ-CG1 3.96Å; F91-V95 WeakPolarHBondContact O-CG2 2.95Å; F91-V95 PolarHBondContact O-N 2.89Å; F91-I102 HydrophobicContact CD2-CD1 4.35Å; F91-I102 HydrophobicContact CE2-CD1 3.51Å; F91-I102 HydrophobicContact CE2-CG2 4.33Å; F91-I102 HydrophobicContact CZ-CD1 3.92Å; F91-F104 HydrophobicContact CE2-CE1 4.25Å; F91-F104 AromaticContact CE2-CZ 3.66Å; F91-F104 HydrophobicContact CE2-CZ 3.66Å; F91-F104 AromaticContact CZ-CZ 3.9Å; F91-F104 HydrophobicContact CZ-CZ 3.9Å; F91-V137 HydrophobicContact CD2-CG2 3.92Å; F91-V137 HydrophobicContact CE2-CG2 4.05Å; F91-L145 HydrophobicContact CB-CD1 4Å; F91-L145 HydrophobicContact CB-CD2 3.87Å; F91-L145 HydrophobicContact CD1-CD1 3.58Å; F91-L145 HydrophobicContact CD2-CD1 4.06Å; F91-L145 HydrophobicContact CD2-CD2 3.88Å; F91-L145 HydrophobicContact CD2-CG 4.43Å; F91-L145 HydrophobicContact CE1-CD1 4.03Å; F91-L145 HydrophobicContact CE2-CD1 4.44Å; F91-L145 HydrophobicContact CG-CD1 3.61Å; F91-L145 HydrophobicContact CG-CD2 3.93Å; F91-L145 HydrophobicContact CG-CG 4.36Å; F91-L145 HydrophobicContact CZ-CD1 4.44Å; F91-F160 HydrophobicContact CE1-CE1 4.09Å; F91-F160 HydrophobicContact CE1-CZ 4.29Å; F91-F160 HydrophobicContact CZ-CD1 4.37Å; F91-F160 HydrophobicContact CZ-CD2 4.46Å; F91-F160 AromaticContact CZ-CE1 3.8Å; F91-F160 HydrophobicContact CZ-CE1 3.8Å; F91-F160 AromaticContact CZ-CE2 3.89Å; F91-F160 HydrophobicContact CZ-CE2 3.89Å; F91-F160 AromaticContact CZ-CZ 3.57Å; F91-F160 HydrophobicContact CZ-CZ 3.57Å
92	E	90.3	Very high	90.1	Very high	156 Å²	156	40 Å²	40	73%	0.729	23%	0.228	S	C	*	.	H	α-helix	trans	-60.5	-44.8	-174.9	-66.4	-171.7	169.8	0	0	112	N90 V95 A96	N90-E92 PolarHBondContact O-N 2.7Å; E92-V95 PolarHBondContact O-N 2.69Å; E92-A96 WeakPolarHBondContact O-CB 3.26Å; E92-A96 PolarHBondContact O-N 2.83Å
93	L	89.6	Confident	91.1	Very high	115 Å²	115	40 Å²	40	60%	0.602	23%	0.227	S	C	*	.	H	α-helix	trans	-67.3	-38.1	176.8	-71.2	169.2	0	0	0	112.1	P74 F91 A96	P74-L93 HydrophobicContact CB-CD1 3.17Å; P74-L93 HydrophobicContact CG-CD1 3.49Å; P74-L93 VanDerWaalsContact CG-CD1 3.49Å; F91-L93 PolarHBondContact O-N 2.99Å; L93-A96 WeakPolarHBondContact O-CB 3.46Å; L93-A96 PolarHBondContact O-N 2.99Å
94	H	90.8	Very high	91.4	Very high	15 Å²	15	39.6 Å²	39.6	7%	0.069	22%	0.224	C	C	.	.	H	α-helix	trans	-61.7	-49.7	177.2	-173	74.9	0	0	0	110.4	P77 Y84 L86 N90 F91 A96 H100	P77-H94 HydrophobicContact CG-CB 4.25Å; P77-H94 WeakPolarHBondContact CG-ND1 3.27Å; Y84-H94 AromaticContact CD1-CE1 3.41Å; Y84-H94 VanDerWaalsContact CD1-CE1 3.41Å; Y84-H94 WeakPolarHBondContact CD1-CE1 3.24Å; Y84-H94 AromaticContact CD2-CE1 3.47Å; Y84-H94 VanDerWaalsContact CD2-CE1 3.47Å; Y84-H94 WeakPolarHBondContact CD2-CE1 3.38Å; Y84-H94 AromaticContact CD2-NE2 3.76Å; Y84-H94 AromaticContact CE1-CE1 3.74Å; Y84-H94 AromaticContact CE2-CE1 3.82Å; Y84-H94 AromaticContact CG-CE1 3.24Å; Y84-H94 AromaticContact CG-NE2 3.72Å; Y84-H94 AromaticContact CZ-CE1 3.93Å; L86-H94 HydrophobicContact CD2-CB 3.82Å; N90-H94 VanDerWaalsContact O-CB 3.28Å; N90-H94 WeakPolarHBondContact O-CB 3.2Å; N90-H94 PolarHBondContact O-N 3.11Å; F91-H94 WeakPolarHBondContact O-CB 3.28Å; F91-H94 PolarHBondContact O-N 3.09Å; F91-H94 VanDerWaalsContact O-N 3.15Å; H94-A96 VanDerWaalsContact C-N 3.3Å; H94-A96 PolarHBondContact O-N 3.14Å; H94-H100 AromaticContact CD2-CE1 3.94Å; H94-H100 AromaticContact CD2-ND1 3.38Å; H94-H100 PolarHBondContact CD2-ND1 2.02Å; H94-H100 AromaticContact NE2-ND1 3.4Å; H94-H100 PolarHBondContact NE2-ND1 3.19Å; H94-H100 PolarHBondContact O-CE1 3.31Å; H94-H100 PolarHBondContact O-NE2 2.88Å
95	V	94.5	Very high	91.3	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.024	22%	0.222	C	C	.	.	H	α-helix	trans	-79.7	-8.1	-176	-57.7	0	0	0	0	114.5	F91 E92 Q97 H100 I102 F160 G163	F91-V95 HydrophobicContact CD1-CG1 4.43Å; F91-V95 HydrophobicContact CD1-CG2 4.09Å; F91-V95 HydrophobicContact CE1-CG1 4.06Å; F91-V95 HydrophobicContact CE1-CG2 3.85Å; F91-V95 HydrophobicContact CE2-CG1 4.25Å; F91-V95 HydrophobicContact CZ-CG1 3.96Å; F91-V95 WeakPolarHBondContact O-CG2 2.95Å; F91-V95 PolarHBondContact O-N 2.89Å; E92-V95 PolarHBondContact O-N 2.69Å; V95-Q97 PolarHBondContact O-N 3.33Å; V95-Q97 VanDerWaalsContact O-N 3.13Å; V95-H100 HydrophobicContact CG1-CB 4.29Å; V95-I102 HydrophobicContact CG1-CD1 3.45Å; V95-I102 VanDerWaalsContact CG1-CD1 3.45Å; V95-F160 HydrophobicContact CB-CB 4.17Å; V95-F160 HydrophobicContact CB-CG 4.45Å; V95-F160 HydrophobicContact CG1-CB 4.24Å; V95-F160 HydrophobicContact CG1-CG 4.23Å; V95-G163 WeakPolarHBondContact O-CA 3.25Å; V95-G163 PolarHBondContact O-N 3.28Å
96	A	90.4	Very high	90.7	Very high	53 Å²	53	35.6 Å²	35.6	44%	0.438	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-29.8	-170.5	0	0	0	0	0	114.6	E92 L93 H94 D162	E92-A96 WeakPolarHBondContact O-CB 3.26Å; E92-A96 PolarHBondContact O-N 2.83Å; L93-A96 WeakPolarHBondContact O-CB 3.46Å; L93-A96 PolarHBondContact O-N 2.99Å; H94-A96 VanDerWaalsContact C-N 3.3Å; H94-A96 PolarHBondContact O-N 3.14Å; A96-D162 CarbonylContact O-C 3.5Å; A96-D162 VanDerWaalsContact O-CA 3.31Å; A96-D162 WeakPolarHBondContact O-CA 3.05Å
97	Q	89.9	Confident	89.7	Confident	157 Å²	157	38.1 Å²	38.1	73%	0.734	22%	0.224	S	C	*	.	S	Bend	trans	-139.4	138.6	-178.2	-171.4	177.8	33.6	0	0	111.8	V95 H100 D162	V95-Q97 PolarHBondContact O-N 3.33Å; V95-Q97 VanDerWaalsContact O-N 3.13Å; Q97-H100 PolarHBondContact O-NE2 3.24Å; Q97-D162 WeakPolarHBondContact CA-OD1 2.95Å
98	G	91.9	Very high	89	Confident	30 Å²	30	45.5 Å²	45.5	31%	0.309	25%	0.249	S	C	.	.	S	Bend	trans	82	-170.2	177.7	0	0	0	0	0	112.9	H100 R161 D162	G98-H100 PolarHBondContact O-CD2 2.81Å; G98-H100 VanDerWaalsContact O-CD2 3.27Å; G98-R161 WeakPolarHBondContact O-CA 3.42Å; G98-D162 PolarHBondContact N-OD1 3.45Å; G98-D162 PolarHBondContact O-N 3.47Å; G98-D162 VanDerWaalsContact O-N 3.16Å
99	D	96.6	Very high	89	Confident	9 Å²	9	43.1 Å²	43.1	5%	0.048	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	136.2	-178.2	-79.5	-42.9	0	0	0	112	T131 V132 K133 W159 F160 R161 L186 T189	D99-T131 WeakPolarHBondContact CB-O 3.42Å; D99-V132 HydrophobicContact CB-CB 4.44Å; D99-V132 HydrophobicContact CB-CG2 4.47Å; D99-V132 CarbonylContact O-C 3.58Å; D99-V132 VanDerWaalsContact O-CA 3.31Å; D99-V132 WeakPolarHBondContact O-CA 3.29Å; D99-K133 PolarHBondContact O-N 2.9Å; D99-W159 HydrophobicContact CB-CH2 4.36Å; D99-W159 HydrophobicContact CB-CZ2 3.45Å; D99-W159 VanDerWaalsContact CB-CZ2 3.45Å; D99-W159 PolarHBondContact OD1-NE1 3Å; D99-F160 CarbonylContact C-O 3.52Å; D99-F160 WeakPolarHBondContact CA-O 3.39Å; D99-R161 WeakPolarHBondContact OD1-CB 3.29Å; D99-R161 IonicContact OD1-CZ 3.35Å; D99-R161 IonicContact OD1-NE 2.73Å; D99-R161 PolarHBondContact OD1-NE 3.3Å; D99-R161 IonicContact OD1-NH2 3.07Å; D99-R161 PolarHBondContact OD1-NH2 2.88Å; D99-R161 VanDerWaalsContact OD1-NH2 3.07Å; D99-R161 IonicContact OD2-CZ 3.74Å; D99-R161 IonicContact OD2-NE 3.63Å; D99-R161 IonicContact OD2-NH2 3.04Å; D99-R161 PolarHBondContact OD2-NH2 3.37Å; D99-L186 HydrophobicContact CB-CD2 4.35Å; D99-T189 PolarHBondContact OD2-OG1 2.83Å
100	H	97.3	Very high	88.4	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	129.5	-177.8	-54	-99	0	0	0	110.8	H94 V95 Q97 G98 I102 K133 W159 F160	H94-H100 AromaticContact CD2-CE1 3.94Å; H94-H100 AromaticContact CD2-ND1 3.38Å; H94-H100 PolarHBondContact CD2-ND1 2.02Å; H94-H100 AromaticContact NE2-ND1 3.4Å; H94-H100 PolarHBondContact NE2-ND1 3.19Å; H94-H100 PolarHBondContact O-CE1 3.31Å; H94-H100 PolarHBondContact O-NE2 2.88Å; V95-H100 HydrophobicContact CG1-CB 4.29Å; Q97-H100 PolarHBondContact O-NE2 3.24Å; G98-H100 PolarHBondContact O-CD2 2.81Å; G98-H100 VanDerWaalsContact O-CD2 3.27Å; H100-I102 HydrophobicContact CB-CD1 4.14Å; H100-I102 HydrophobicContact CB-CG1 4.17Å; H100-K133 CarbonylContact C-O 3.58Å; H100-K133 WeakPolarHBondContact CA-O 3.48Å; H100-W159 CarbonylContact O-C 3.58Å; H100-W159 WeakPolarHBondContact O-CA 3.27Å; H100-F160 HydrophobicContact CB-CB 4.24Å; H100-F160 PolarHBondContact N-O 2.81Å; H100-F160 PolarHBondContact O-N 2.89Å
101	F	97.8	Very high	87.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	113.2	173.9	-166.9	-156	0	0	0	110.2	W119 L122 K133 I134 G135 L157 L158 W159 Y169 L178 Y181 V182	F101-W119 AromaticContact CD1-CH2 3.49Å; F101-W119 HydrophobicContact CD1-CH2 3.49Å; F101-W119 VanDerWaalsContact CD1-CH2 3.49Å; F101-W119 HydrophobicContact CD1-CZ2 4.38Å; F101-W119 AromaticContact CD1-CZ3 3.98Å; F101-W119 HydrophobicContact CD1-CZ3 3.98Å; F101-W119 AromaticContact CD2-CH2 3.94Å; F101-W119 HydrophobicContact CD2-CH2 3.94Å; F101-W119 AromaticContact CE1-CH2 3.51Å; F101-W119 HydrophobicContact CE1-CH2 3.51Å; F101-W119 AromaticContact CE1-CZ3 3.59Å; F101-W119 HydrophobicContact CE1-CZ3 3.59Å; F101-W119 AromaticContact CE2-CH2 3.95Å; F101-W119 HydrophobicContact CE2-CH2 3.95Å; F101-W119 HydrophobicContact CE2-CZ3 4.47Å; F101-W119 AromaticContact CG-CH2 3.7Å; F101-W119 HydrophobicContact CG-CH2 3.7Å; F101-W119 HydrophobicContact CG-CZ2 4.4Å; F101-W119 AromaticContact CZ-CH2 3.74Å; F101-W119 HydrophobicContact CZ-CH2 3.74Å; F101-W119 AromaticContact CZ-CZ3 3.85Å; F101-W119 HydrophobicContact CZ-CZ3 3.85Å; F101-W119 WeakPolarHBondContact O-CZ2 3.46Å; F101-L122 HydrophobicContact CD1-CD2 4.08Å; F101-L122 HydrophobicContact CE1-CD2 4.16Å; F101-K133 PolarHBondContact N-O 3.24Å; F101-I134 HydrophobicContact CB-CD1 3.77Å; F101-I134 HydrophobicContact CD1-CD1 4.31Å; F101-I134 WeakPolarHBondContact O-CA 3.27Å; F101-G135 PolarHBondContact O-N 3.36Å; F101-L157 HydrophobicContact CE2-CB 3.78Å; F101-L157 HydrophobicContact CZ-CB 4.05Å; F101-L157 HydrophobicContact CZ-CD1 4.33Å; F101-L158 WeakPolarHBondContact CD2-O 3.39Å; F101-W159 HydrophobicContact CB-CE3 3.7Å; F101-W159 HydrophobicContact CB-CZ3 3.8Å; F101-W159 HydrophobicContact CD1-CZ3 4.44Å; F101-W159 AromaticContact CD2-CE3 3.95Å; F101-W159 HydrophobicContact CD2-CE3 3.95Å; F101-W159 AromaticContact CG-CE3 3.83Å; F101-W159 HydrophobicContact CG-CE3 3.83Å; F101-W159 HydrophobicContact CG-CZ3 4.09Å; F101-Y169 HydrophobicContact CZ-CD1 4.44Å; F101-Y169 HydrophobicContact CZ-CG 4.03Å; F101-L178 HydrophobicContact CE1-CD2 3.94Å; F101-L178 HydrophobicContact CZ-CD2 4.06Å; F101-Y181 HydrophobicContact CD2-CE1 4.17Å; F101-Y181 AromaticContact CE1-CD1 3.93Å; F101-Y181 HydrophobicContact CE1-CD1 3.93Å; F101-Y181 HydrophobicContact CE1-CE1 4.24Å; F101-Y181 HydrophobicContact CE2-CD1 4.2Å; F101-Y181 AromaticContact CE2-CE1 3.7Å; F101-Y181 HydrophobicContact CE2-CE1 3.7Å; F101-Y181 AromaticContact CZ-CD1 3.75Å; F101-Y181 HydrophobicContact CZ-CD1 3.75Å; F101-Y181 AromaticContact CZ-CE1 3.74Å; F101-Y181 HydrophobicContact CZ-CE1 3.74Å; F101-V182 HydrophobicContact CD1-CG2 3.93Å; F101-V182 HydrophobicContact CE1-CG2 4.37Å
102	I	98.3	Very high	87.3	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	127.7	-165.3	-56.3	176.6	0	0	0	111.1	L86 F91 V95 H100 F104 G135 V137 L157 L158 F160	L86-I102 HydrophobicContact CD1-CD1 3.57Å; L86-I102 HydrophobicContact CD1-CG1 4.02Å; L86-I102 HydrophobicContact CD1-CG2 4.1Å; F91-I102 HydrophobicContact CD2-CD1 4.35Å; F91-I102 HydrophobicContact CE2-CD1 3.51Å; F91-I102 HydrophobicContact CE2-CG2 4.33Å; F91-I102 HydrophobicContact CZ-CD1 3.92Å; V95-I102 HydrophobicContact CG1-CD1 3.45Å; V95-I102 VanDerWaalsContact CG1-CD1 3.45Å; H100-I102 HydrophobicContact CB-CD1 4.14Å; H100-I102 HydrophobicContact CB-CG1 4.17Å; I102-F104 HydrophobicContact CB-CE2 3.91Å; I102-F104 HydrophobicContact CG2-CD2 4.03Å; I102-F104 HydrophobicContact CG2-CE2 3.54Å; I102-F104 HydrophobicContact CG2-CZ 3.97Å; I102-G135 WeakPolarHBondContact CA-O 3.12Å; I102-V137 HydrophobicContact CG2-CG2 3.89Å; I102-L157 WeakPolarHBondContact O-CA 3.14Å; I102-L158 PolarHBondContact N-O 3.25Å; I102-L158 PolarHBondContact O-N 2.97Å; I102-F160 HydrophobicContact CB-CE2 4.36Å; I102-F160 HydrophobicContact CD1-CD2 3.71Å; I102-F160 HydrophobicContact CD1-CE2 3.95Å; I102-F160 HydrophobicContact CD1-CG 4.5Å; I102-F160 HydrophobicContact CG1-CD2 4.23Å; I102-F160 HydrophobicContact CG1-CE2 4.48Å
103	K	97.9	Very high	87.2	Confident	7 Å²	7	46.8 Å²	46.8	3%	0.03	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	113.8	172.4	176.7	-178.6	74	-177.4	0	111.5	F105 L115 W119 G135 K136 V137 P155 L157	K103-F105 HydrophobicContact CG-CB 4.25Å; K103-L115 HydrophobicContact CD-CD2 4.08Å; K103-L115 HydrophobicContact CD-CG 4.41Å; K103-W119 HydrophobicContact CB-CD2 3.87Å; K103-W119 HydrophobicContact CB-CE3 4.45Å; K103-W119 HydrophobicContact CB-CG 4.34Å; K103-W119 HydrophobicContact CB-CH2 4.19Å; K103-W119 HydrophobicContact CB-CZ2 3.57Å; K103-W119 HydrophobicContact CD-CB 4.33Å; K103-W119 HydrophobicContact CD-CD2 4.06Å; K103-W119 HydrophobicContact CD-CG 3.88Å; K103-G135 PolarHBondContact N-O 3.31Å; K103-K136 HydrophobicContact CB-CB 4.41Å; K103-K136 CarbonylContact O-C 3.45Å; K103-K136 WeakPolarHBondContact O-CA 3.25Å; K103-V137 PolarHBondContact O-N 3.15Å; K103-P155 HydrophobicContact CG-CB 4.33Å; K103-L157 HydrophobicContact CB-CD2 3.57Å; K103-L157 HydrophobicContact CD-CD2 4.36Å; K103-L157 HydrophobicContact CG-CD2 3.61Å
104	F	96.7	Very high	86.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.2	169.7	-66.3	-97.1	0	0	0	109.5	F91 I102 V137 C146 N149 V151 P155 T156 L158 F160	F91-F104 HydrophobicContact CE2-CE1 4.25Å; F91-F104 AromaticContact CE2-CZ 3.66Å; F91-F104 HydrophobicContact CE2-CZ 3.66Å; F91-F104 AromaticContact CZ-CZ 3.9Å; F91-F104 HydrophobicContact CZ-CZ 3.9Å; I102-F104 HydrophobicContact CB-CE2 3.91Å; I102-F104 HydrophobicContact CG2-CD2 4.03Å; I102-F104 HydrophobicContact CG2-CE2 3.54Å; I102-F104 HydrophobicContact CG2-CZ 3.97Å; F104-V137 HydrophobicContact CD1-CB 3.71Å; F104-V137 HydrophobicContact CD1-CG1 3.96Å; F104-V137 HydrophobicContact CD1-CG2 4.13Å; F104-V137 HydrophobicContact CE1-CB 3.9Å; F104-V137 HydrophobicContact CE1-CG1 4.09Å; F104-V137 HydrophobicContact CE1-CG2 3.81Å; F104-V137 HydrophobicContact CG-CB 4.4Å; F104-V137 HydrophobicContact CZ-CG2 4.23Å; F104-C146 HydrophobicContact CD1-CB 4.44Å; F104-N149 HydrophobicContact CE1-CB 4.32Å; F104-N149 HydrophobicContact CZ-CB 4.23Å; F104-V151 HydrophobicContact CB-CB 4.47Å; F104-V151 HydrophobicContact CB-CG1 3.95Å; F104-V151 HydrophobicContact CB-CG2 3.71Å; F104-V151 HydrophobicContact CD1-CG2 3.65Å; F104-V151 HydrophobicContact CD2-CG2 4.12Å; F104-V151 HydrophobicContact CE1-CG2 4.27Å; F104-V151 HydrophobicContact CG-CG2 3.54Å; F104-P155 WeakPolarHBondContact O-CA 3.37Å; F104-T156 PolarHBondContact N-O 3.38Å; F104-T156 PolarHBondContact O-N 3.17Å; F104-L158 HydrophobicContact CD2-CB 4.38Å; F104-L158 HydrophobicContact CD2-CD1 3.88Å; F104-L158 HydrophobicContact CD2-CG 4Å; F104-L158 HydrophobicContact CE2-CB 3.99Å; F104-L158 HydrophobicContact CE2-CD1 3.57Å; F104-L158 HydrophobicContact CE2-CG 3.93Å; F104-L158 HydrophobicContact CZ-CD1 4.17Å; F104-F160 AromaticContact CE2-CE2 3.99Å; F104-F160 HydrophobicContact CE2-CE2 3.99Å; F104-F160 HydrophobicContact CE2-CZ 4.32Å; F104-F160 HydrophobicContact CZ-CE2 4.21Å; F104-F160 HydrophobicContact CZ-CZ 4.19Å
105	F	91.4	Very high	87	Confident	32 Å²	32	44.3 Å²	44.3	14%	0.14	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	172.1	-170	78.3	-78.4	0	0	0	113.2	K103 C112 K136 V137 D138 C139	K103-F105 HydrophobicContact CG-CB 4.25Å; F105-C112 HydrophobicContact CB-CB 3.98Å; F105-K136 HydrophobicContact CD1-CB 4.15Å; F105-K136 HydrophobicContact CE1-CB 3.93Å; F105-K136 HydrophobicContact CE1-CD 3.89Å; F105-K136 HydrophobicContact CE1-CG 4.11Å; F105-K136 HydrophobicContact CZ-CD 4.29Å; F105-V137 WeakPolarHBondContact CD1-O 3.49Å; F105-V137 WeakPolarHBondContact CE1-O 3.48Å; F105-V137 PolarHBondContact N-O 2.99Å; F105-D138 HydrophobicContact CE1-CB 4.02Å; F105-D138 HydrophobicContact CE2-CB 4.43Å; F105-D138 HydrophobicContact CZ-CB 3.82Å; F105-C139 WeakPolarHBondContact O-CB 3.26Å; F105-C139 PolarHBondContact O-N 3.11Å
106	A	77.1	Confident	86.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.256	C	S	.	.			trans	-130	137.5	165.2	0	0	0	0	0	109.1	W108 C109 T140 Y154	A106-W108 HydrophobicContact CB-CD2 4.13Å; A106-W108 HydrophobicContact CB-CH2 4.36Å; A106-W108 HydrophobicContact CB-CZ2 3.77Å; A106-W108 PolarHBondContact O-N 2.85Å; A106-C109 HydrophobicContact CB-CB 4.3Å; A106-C109 WeakPolarHBondContact O-CB 3.18Å; A106-C109 PolarHBondContact O-N 2.92Å; A106-T140 HydrophobicContact CB-CG2 3.67Å; A106-Y154 HydrophobicContact CB-CD2 3.6Å; A106-Y154 HydrophobicContact CB-CE2 3.82Å; A106-Y154 HydrophobicContact CB-CG 4.1Å
107	P	73.1	Confident	86.9	Confident	61 Å²	61	45.7 Å²	45.7	40%	0.396	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-25.9	-171.9	23.8	-34.1	0	0	0	113	K113 D138 T140	P107-K113 WeakPolarHBondContact O-CE 3.24Å; P107-D138 WeakPolarHBondContact CD-OD1 3.44Å; P107-D138 WeakPolarHBondContact CD-OD2 3.49Å; P107-T140 HydrophobicContact CG-CG2 4.47Å
108	W	67.6	Low	87.1	Confident	175 Å²	175	39.6 Å²	39.6	66%	0.663	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-11.1	176.6	49.7	-101.7	0	0	0	113.7	A106 G110 Y154	A106-W108 HydrophobicContact CB-CD2 4.13Å; A106-W108 HydrophobicContact CB-CH2 4.36Å; A106-W108 HydrophobicContact CB-CZ2 3.77Å; A106-W108 PolarHBondContact O-N 2.85Å; W108-G110 PolarHBondContact O-N 3.35Å; W108-Y154 HydrophobicContact CH2-CD2 4.14Å; W108-Y154 HydrophobicContact CH2-CE2 4.24Å; W108-Y154 HydrophobicContact CZ2-CD2 4.39Å; W108-Y154 HydrophobicContact CZ2-CE2 4.18Å
109	C	79.1	Confident	87.3	Confident	15 Å²	15	38.2 Å²	38.2	10%	0.101	21%	0.214	C	C	.	.			trans	-77.5	119.3	-175.2	176.5	0	0	0	0	111.8	A106 H111 C112 K113	A106-C109 HydrophobicContact CB-CB 4.3Å; A106-C109 WeakPolarHBondContact O-CB 3.18Å; A106-C109 PolarHBondContact O-N 2.92Å; C109-H111 VanDerWaalsContact C-N 3.35Å; C109-H111 PolarHBondContact O-N 3.12Å; C109-C112 HydrophobicContact CB-CB 3.86Å; C109-C112 WeakPolarHBondContact CB-SG 3.25Å; C109-C112 WeakPolarHBondContact O-CB 3.22Å; C109-C112 PolarHBondContact O-N 2.86Å; C109-C112 PolarHBondContact SG-SG 2.84Å; C109-K113 PolarHBondContact O-N 3Å
110	G	67.9	Low	87.1	Confident	51 Å²	51	42 Å²	42	53%	0.526	23%	0.231	S	C	.	.	H	α-helix	trans	-57.3	-41.7	179.6	0	0	0	0	0	114	W108 C112 K113 A114	W108-G110 PolarHBondContact O-N 3.35Å; G110-C112 VanDerWaalsContact C-N 3.28Å; G110-C112 PolarHBondContact O-N 3.21Å; G110-K113 PolarHBondContact O-N 3.19Å; G110-A114 PolarHBondContact O-N 2.88Å
111	H	72.6	Confident	86.8	Confident	125 Å²	125	46.9 Å²	46.9	58%	0.579	25%	0.254	S	S	*	.	H	α-helix	trans	-66.6	-28.6	175.9	-63	165.2	0	0	0	113.1	C109 L115	C109-H111 VanDerWaalsContact C-N 3.35Å; C109-H111 PolarHBondContact O-N 3.12Å; H111-L115 WeakPolarHBondContact O-CB 3.26Å; H111-L115 PolarHBondContact O-N 3.37Å
112	C	82.7	Confident	86.6	Confident	4 Å²	4	46.9 Å²	46.9	3%	0.027	25%	0.254	C	S	.	.	H	α-helix	trans	-72.9	-42.8	174.7	-64.4	0	0	0	0	111.1	F105 C109 G110 A114 L115 A116 Y154 P155	F105-C112 HydrophobicContact CB-CB 3.98Å; C109-C112 HydrophobicContact CB-CB 3.86Å; C109-C112 WeakPolarHBondContact CB-SG 3.25Å; C109-C112 WeakPolarHBondContact O-CB 3.22Å; C109-C112 PolarHBondContact O-N 2.86Å; C109-C112 PolarHBondContact SG-SG 2.84Å; G110-C112 VanDerWaalsContact C-N 3.28Å; G110-C112 PolarHBondContact O-N 3.21Å; C112-A114 VanDerWaalsContact C-N 3.32Å; C112-A114 PolarHBondContact O-N 2.95Å; C112-L115 PolarHBondContact O-N 3.36Å; C112-A116 PolarHBondContact O-N 2.94Å; C112-Y154 VanDerWaalsContact SG-CB 3.55Å; C112-P155 VanDerWaalsContact SG-CD 3.57Å; C112-P155 VanDerWaalsContact SG-N 3.41Å
113	K	87.6	Confident	86.4	Confident	130 Å²	130	46.9 Å²	46.9	57%	0.565	25%	0.254	S	S	*	.	H	α-helix	trans	-60.5	-42.9	174.9	-65.7	179.7	-176.7	-175.3	0	111.3	P107 C109 G110 L115 A116 P117	P107-K113 WeakPolarHBondContact O-CE 3.24Å; C109-K113 PolarHBondContact O-N 3Å; G110-K113 PolarHBondContact O-N 3.19Å; K113-L115 VanDerWaalsContact C-N 3.33Å; K113-L115 PolarHBondContact O-N 3Å; K113-A116 WeakPolarHBondContact O-CB 3.08Å; K113-A116 PolarHBondContact O-N 3.3Å; K113-P117 WeakPolarHBondContact O-CD 3.26Å
114	A	83.7	Confident	86	Confident	73 Å²	73	51 Å²	51	60%	0.603	28%	0.276	S	S	*	.	H	α-helix	trans	-63	-37.3	177.3	0	0	0	0	0	113	G110 C112	G110-A114 PolarHBondContact O-N 2.88Å; C112-A114 VanDerWaalsContact C-N 3.32Å; C112-A114 PolarHBondContact O-N 2.95Å
115	L	92.8	Very high	85.7	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-80.2	-22.6	178.2	176.7	57.2	0	0	0	113.4	K103 H111 C112 K113 T118 W119 P155 L157 R173 L178	K103-L115 HydrophobicContact CD-CD2 4.08Å; K103-L115 HydrophobicContact CD-CG 4.41Å; H111-L115 WeakPolarHBondContact O-CB 3.26Å; H111-L115 PolarHBondContact O-N 3.37Å; C112-L115 PolarHBondContact O-N 3.36Å; K113-L115 VanDerWaalsContact C-N 3.33Å; K113-L115 PolarHBondContact O-N 3Å; L115-T118 PolarHBondContact O-N 3.3Å; L115-W119 HydrophobicContact CG-CB 4.46Å; L115-W119 WeakPolarHBondContact O-CB 3.13Å; L115-W119 PolarHBondContact O-N 3.24Å; L115-P155 HydrophobicContact CD2-CB 4.11Å; L115-P155 HydrophobicContact CD2-CG 3.79Å; L115-L157 HydrophobicContact CD2-CD1 4.03Å; L115-L157 HydrophobicContact CD2-CD2 3.99Å; L115-L157 HydrophobicContact CD2-CG 4.44Å; L115-R173 HydrophobicContact CD1-CB 3.91Å; L115-R173 HydrophobicContact CD1-CG 4.46Å; L115-L178 HydrophobicContact CD1-CD1 4.2Å
116	A	91.4	Very high	85.6	Confident	24 Å²	24	54 Å²	54	20%	0.198	31%	0.305	C	S	.	.	H	α-helix	trans	-48.8	-52.8	-175.8	0	0	0	0	0	114.5	C112 K113 T118 W119 E120	C112-A116 PolarHBondContact O-N 2.94Å; K113-A116 WeakPolarHBondContact O-CB 3.08Å; K113-A116 PolarHBondContact O-N 3.3Å; A116-T118 VanDerWaalsContact C-N 3.34Å; A116-T118 PolarHBondContact O-N 2.84Å; A116-W119 WeakPolarHBondContact O-CB 3.25Å; A116-W119 PolarHBondContact O-N 2.67Å; A116-E120 WeakPolarHBondContact O-CG 3.46Å; A116-E120 PolarHBondContact O-N 2.88Å
117	P	91.3	Very high	86.1	Confident	63 Å²	63	57.8 Å²	57.8	41%	0.409	32%	0.323	S	S	.	.	H	α-helix	trans	-64.1	-38.2	-178.4	24.8	-35	0	0	0	112.7	K113 E120 Q121	K113-P117 WeakPolarHBondContact O-CD 3.26Å; P117-E120 PolarHBondContact O-N 2.96Å; P117-Q121 VanDerWaalsContact O-CG 3.32Å; P117-Q121 WeakPolarHBondContact O-CG 3.46Å; P117-Q121 PolarHBondContact O-N 3.09Å
118	T	93.6	Very high	86.4	Confident	29 Å²	29	63 Å²	63	18%	0.178	34%	0.342	C	S	.	.	H	α-helix	trans	-67.5	-38	177.3	-52.5	0	0	0	0	111.7	L115 A116 Q121 L122 L175 L178	L115-T118 PolarHBondContact O-N 3.3Å; A116-T118 VanDerWaalsContact C-N 3.34Å; A116-T118 PolarHBondContact O-N 2.84Å; T118-Q121 PolarHBondContact O-N 3.49Å; T118-L122 PolarHBondContact O-N 3.28Å; T118-L175 HydrophobicContact CG2-CB 3.9Å; T118-L175 HydrophobicContact CG2-CD1 4.39Å; T118-L178 HydrophobicContact CG2-CD1 4.01Å
119	W	96.8	Very high	87.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-66.1	-40.3	177.1	-163.9	-99.3	0	0	0	112.2	F101 K103 L115 A116 L122 A123 I134 G135 L157 L178	F101-W119 AromaticContact CD1-CH2 3.49Å; F101-W119 HydrophobicContact CD1-CH2 3.49Å; F101-W119 VanDerWaalsContact CD1-CH2 3.49Å; F101-W119 HydrophobicContact CD1-CZ2 4.38Å; F101-W119 AromaticContact CD1-CZ3 3.98Å; F101-W119 HydrophobicContact CD1-CZ3 3.98Å; F101-W119 AromaticContact CD2-CH2 3.94Å; F101-W119 HydrophobicContact CD2-CH2 3.94Å; F101-W119 AromaticContact CE1-CH2 3.51Å; F101-W119 HydrophobicContact CE1-CH2 3.51Å; F101-W119 AromaticContact CE1-CZ3 3.59Å; F101-W119 HydrophobicContact CE1-CZ3 3.59Å; F101-W119 AromaticContact CE2-CH2 3.95Å; F101-W119 HydrophobicContact CE2-CH2 3.95Å; F101-W119 HydrophobicContact CE2-CZ3 4.47Å; F101-W119 AromaticContact CG-CH2 3.7Å; F101-W119 HydrophobicContact CG-CH2 3.7Å; F101-W119 HydrophobicContact CG-CZ2 4.4Å; F101-W119 AromaticContact CZ-CH2 3.74Å; F101-W119 HydrophobicContact CZ-CH2 3.74Å; F101-W119 AromaticContact CZ-CZ3 3.85Å; F101-W119 HydrophobicContact CZ-CZ3 3.85Å; F101-W119 WeakPolarHBondContact O-CZ2 3.46Å; K103-W119 HydrophobicContact CB-CD2 3.87Å; K103-W119 HydrophobicContact CB-CE3 4.45Å; K103-W119 HydrophobicContact CB-CG 4.34Å; K103-W119 HydrophobicContact CB-CH2 4.19Å; K103-W119 HydrophobicContact CB-CZ2 3.57Å; K103-W119 HydrophobicContact CD-CB 4.33Å; K103-W119 HydrophobicContact CD-CD2 4.06Å; K103-W119 HydrophobicContact CD-CG 3.88Å; L115-W119 HydrophobicContact CG-CB 4.46Å; L115-W119 WeakPolarHBondContact O-CB 3.13Å; L115-W119 PolarHBondContact O-N 3.24Å; A116-W119 WeakPolarHBondContact O-CB 3.25Å; A116-W119 PolarHBondContact O-N 2.67Å; W119-L122 HydrophobicContact CE3-CD2 4.33Å; W119-L122 HydrophobicContact CZ3-CD2 4.2Å; W119-L122 PolarHBondContact O-N 2.97Å; W119-A123 WeakPolarHBondContact O-CB 3.48Å; W119-A123 PolarHBondContact O-N 3.42Å; W119-I134 HydrophobicContact CD2-CG2 4.5Å; W119-I134 HydrophobicContact CZ2-CG2 3.8Å; W119-G135 PolarHBondContact NE1-O 2.88Å; W119-G135 VanDerWaalsContact NE1-O 3.09Å; W119-L157 HydrophobicContact CE3-CD1 4.48Å; W119-L157 HydrophobicContact CE3-CD2 4.17Å; W119-L157 HydrophobicContact CH2-CD2 3.88Å; W119-L157 HydrophobicContact CZ3-CD1 3.84Å; W119-L157 HydrophobicContact CZ3-CD2 3.7Å; W119-L157 HydrophobicContact CZ3-CG 4.28Å; W119-L178 HydrophobicContact CE3-CD1 4.28Å; W119-L178 HydrophobicContact CZ3-CD1 4.49Å; W119-L178 HydrophobicContact CZ3-CD2 4.28Å
120	E	91.7	Very high	87.4	Confident	89 Å²	89	65 Å²	65	42%	0.416	36%	0.361	S	S	.	.	H	α-helix	trans	-65.9	-41	175.2	-72.4	161.9	-169.3	0	0	111.4	L83 A116 P117 L122 A123 L124	L83-E120 HydrophobicContact CD2-CG 4.02Å; A116-E120 WeakPolarHBondContact O-CG 3.46Å; A116-E120 PolarHBondContact O-N 2.88Å; P117-E120 PolarHBondContact O-N 2.96Å; E120-L122 VanDerWaalsContact C-N 3.33Å; E120-L122 PolarHBondContact O-N 3.35Å; E120-A123 PolarHBondContact O-N 3.37Å; E120-L124 WeakPolarHBondContact O-CB 2.98Å; E120-L124 PolarHBondContact O-N 3.02Å
121	Q	90.9	Very high	88.2	Confident	103 Å²	103	66.4 Å²	66.4	48%	0.481	36%	0.36	S	S	.	.	H	α-helix	trans	-63.9	-37	174.1	-73.4	175.6	28.4	0	0	113	P117 T118 G125 L175	P117-Q121 VanDerWaalsContact O-CG 3.32Å; P117-Q121 WeakPolarHBondContact O-CG 3.46Å; P117-Q121 PolarHBondContact O-N 3.09Å; T118-Q121 PolarHBondContact O-N 3.49Å; Q121-G125 PolarHBondContact O-N 2.94Å; Q121-L175 HydrophobicContact CB-CD1 4.17Å; Q121-L175 HydrophobicContact CB-CD2 4.21Å
122	L	94.5	Very high	89.2	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-63.8	-47.4	173.9	-179.1	69.1	0	0	0	110.8	F101 T118 W119 E120 G125 L126 I134 L175 L178 R179	F101-L122 HydrophobicContact CD1-CD2 4.08Å; F101-L122 HydrophobicContact CE1-CD2 4.16Å; T118-L122 PolarHBondContact O-N 3.28Å; W119-L122 HydrophobicContact CE3-CD2 4.33Å; W119-L122 HydrophobicContact CZ3-CD2 4.2Å; W119-L122 PolarHBondContact O-N 2.97Å; E120-L122 VanDerWaalsContact C-N 3.33Å; E120-L122 PolarHBondContact O-N 3.35Å; L122-G125 PolarHBondContact O-N 3.14Å; L122-L126 HydrophobicContact CD1-CD1 3.96Å; L122-L126 HydrophobicContact CG-CD1 4.14Å; L122-L126 PolarHBondContact O-N 3Å; L122-I134 HydrophobicContact CD2-CD1 4.38Å; L122-L175 HydrophobicContact CB-CD1 3.92Å; L122-L175 HydrophobicContact CD1-CD1 4.31Å; L122-L178 HydrophobicContact CD1-CB 4.33Å; L122-L178 HydrophobicContact CD2-CB 3.96Å; L122-L178 HydrophobicContact CD2-CD1 4.35Å; L122-R179 HydrophobicContact CD1-CG 3.7Å
123	A	93.9	Very high	89.8	Confident	0 Å²	0	64 Å²	64	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-60.3	-46.1	178.7	0	0	0	0	0	112	L83 W119 E120 G125 L126 E127 I134	L83-A123 HydrophobicContact CB-CB 3.76Å; L83-A123 HydrophobicContact CD1-CB 4.15Å; L83-A123 HydrophobicContact CG-CB 4.48Å; W119-A123 WeakPolarHBondContact O-CB 3.48Å; W119-A123 PolarHBondContact O-N 3.42Å; E120-A123 PolarHBondContact O-N 3.37Å; A123-G125 VanDerWaalsContact C-N 3.33Å; A123-G125 PolarHBondContact O-N 3.44Å; A123-L126 CarbonylContact O-C 3.59Å; A123-L126 PolarHBondContact O-N 2.92Å; A123-L126 VanDerWaalsContact O-N 3.1Å; A123-E127 PolarHBondContact O-N 3.23Å; A123-I134 HydrophobicContact CB-CB 3.88Å; A123-I134 HydrophobicContact CB-CG1 4.42Å; A123-I134 HydrophobicContact CB-CG2 3.82Å
124	L	90.1	Very high	90.3	Very high	93 Å²	93	57.9 Å²	57.9	49%	0.487	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-41.5	176.6	-176.7	66	0	0	0	112.1	Q81 E120 L126 E127	Q81-L124 HydrophobicContact CB-CD1 4.46Å; E120-L124 WeakPolarHBondContact O-CB 2.98Å; E120-L124 PolarHBondContact O-N 3.02Å; L124-L126 PolarHBondContact O-N 3.18Å; L124-E127 WeakPolarHBondContact O-CB 3.46Å; L124-E127 PolarHBondContact O-N 3.44Å
125	G	89.7	Confident	90.9	Very high	53 Å²	53	54.4 Å²	54.4	55%	0.546	29%	0.292	S	S	.	.	H	α-helix	trans	-66.1	-19.2	177.5	0	0	0	0	0	114.2	Q121 L122 A123	Q121-G125 PolarHBondContact O-N 2.94Å; L122-G125 PolarHBondContact O-N 3.14Å; A123-G125 VanDerWaalsContact C-N 3.33Å; A123-G125 PolarHBondContact O-N 3.44Å
126	L	89.8	Confident	91.1	Very high	41 Å²	41	56.1 Å²	56.1	22%	0.215	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	10.4	-178.8	-64.8	171.1	0	0	0	112.5	L122 A123 L124 H128 S129 V132 I134 V182	L122-L126 HydrophobicContact CD1-CD1 3.96Å; L122-L126 HydrophobicContact CG-CD1 4.14Å; L122-L126 PolarHBondContact O-N 3Å; A123-L126 CarbonylContact O-C 3.59Å; A123-L126 PolarHBondContact O-N 2.92Å; A123-L126 VanDerWaalsContact O-N 3.1Å; L124-L126 PolarHBondContact O-N 3.18Å; L126-H128 PolarHBondContact O-N 3.11Å; L126-H128 VanDerWaalsContact O-N 3.13Å; L126-S129 WeakPolarHBondContact O-CB 3.5Å; L126-S129 PolarHBondContact O-N 3.05Å; L126-V132 HydrophobicContact CD1-CG1 4.14Å; L126-V132 HydrophobicContact CD2-CG1 4.27Å; L126-I134 HydrophobicContact CB-CG1 4.31Å; L126-I134 HydrophobicContact CD1-CD1 3.76Å; L126-I134 HydrophobicContact CD1-CG1 3.92Å; L126-V182 HydrophobicContact CD1-CG1 4.02Å; L126-V182 HydrophobicContact CD1-CG2 4.27Å
127	E	86.4	Confident	91.3	Very high	80 Å²	80	55 Å²	55	37%	0.374	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-31.7	-175.4	179.2	171.1	-136	0	0	113.1	Q81 G82 A123 L124	Q81-E127 WeakPolarHBondContact CA-OE1 3.36Å; G82-E127 PolarHBondContact N-OE1 2.7Å; G82-E127 VanDerWaalsContact N-OE1 3.17Å; A123-E127 PolarHBondContact O-N 3.23Å; L124-E127 WeakPolarHBondContact O-CB 3.46Å; L124-E127 PolarHBondContact O-N 3.44Å
128	H	80.4	Confident	91.1	Very high	172 Å²	172	53 Å²	53	80%	0.796	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	9.6	179.6	-58.8	86.2	0	0	0	113	L126 E130	L126-H128 PolarHBondContact O-N 3.11Å; L126-H128 VanDerWaalsContact O-N 3.13Å; H128-E130 PolarHBondContact O-N 3.35Å
129	S	83.6	Confident	90.4	Very high	34 Å²	34	51.7 Å²	51.7	24%	0.238	27%	0.268	C	S	.	.			trans	-76.1	123.5	177.1	-173.6	0	0	0	0	110.3	L126 T131 V132	L126-S129 WeakPolarHBondContact O-CB 3.5Å; L126-S129 PolarHBondContact O-N 3.05Å; S129-T131 VanDerWaalsContact C-N 3.28Å; S129-T131 PolarHBondContact OG-N 2.89Å; S129-T131 PolarHBondContact OG-OG1 3.44Å; S129-V132 PolarHBondContact OG-N 2.92Å
130	E	83.1	Confident	88.9	Confident	196 Å²	196	55 Å²	55	92%	0.916	29%	0.288	S	S	*	.	S	Bend	trans	-81.4	-12.8	170.5	-62.4	-170.7	166.5	0	0	112.3	H128	H128-E130 PolarHBondContact O-N 3.35Å
131	T	85.4	Confident	87.8	Confident	82 Å²	82	57.5 Å²	57.5	50%	0.503	30%	0.3	S	S	.	.	S	Bend	trans	-97.2	-30.1	-171.2	58.7	0	0	0	0	113.5	D99 S129	D99-T131 WeakPolarHBondContact CB-O 3.42Å; S129-T131 VanDerWaalsContact C-N 3.28Å; S129-T131 PolarHBondContact OG-N 2.89Å; S129-T131 PolarHBondContact OG-OG1 3.44Å
132	V	94.4	Very high	87.1	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.006	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	138.3	-178.7	60.2	0	0	0	0	112.2	D99 L126 S129 I134 W159 V182 L186	D99-V132 HydrophobicContact CB-CB 4.44Å; D99-V132 HydrophobicContact CB-CG2 4.47Å; D99-V132 CarbonylContact O-C 3.58Å; D99-V132 VanDerWaalsContact O-CA 3.31Å; D99-V132 WeakPolarHBondContact O-CA 3.29Å; L126-V132 HydrophobicContact CD1-CG1 4.14Å; L126-V132 HydrophobicContact CD2-CG1 4.27Å; S129-V132 PolarHBondContact OG-N 2.92Å; V132-I134 HydrophobicContact CG2-CD1 4.18Å; V132-W159 HydrophobicContact CB-CH2 4.39Å; V132-W159 HydrophobicContact CG2-CH2 3.67Å; V132-W159 HydrophobicContact CG2-CZ2 4.32Å; V132-W159 HydrophobicContact CG2-CZ3 4.1Å; V132-V182 HydrophobicContact CG1-CG1 3.83Å; V132-V182 HydrophobicContact CG2-CG1 4.4Å; V132-L186 HydrophobicContact CB-CD2 4.34Å; V132-L186 HydrophobicContact CG1-CD1 4.17Å
133	K	95.3	Very high	85.8	Confident	76 Å²	76	62.4 Å²	62.4	33%	0.33	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	140	174.5	-63.8	176.4	-167.8	160.2	0	111.1	Y84 D99 H100 F101	Y84-K133 HydrophobicContact CD2-CB 4.04Å; Y84-K133 HydrophobicContact CE2-CB 3.73Å; Y84-K133 HydrophobicContact CE2-CD 3.98Å; Y84-K133 HydrophobicContact CE2-CG 3.83Å; D99-K133 PolarHBondContact O-N 2.9Å; H100-K133 CarbonylContact C-O 3.58Å; H100-K133 WeakPolarHBondContact CA-O 3.48Å; F101-K133 PolarHBondContact N-O 3.24Å
134	I	96.9	Very high	84.5	Confident	2 Å²	2	70.5 Å²	70.5	1%	0.01	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.4	-179.6	-52.5	-56.6	0	0	0	109.9	L83 Y84 F101 W119 L122 A123 L126 V132	L83-I134 HydrophobicContact CD1-CG2 3.99Å; Y84-I134 WeakPolarHBondContact CD2-O 3.46Å; Y84-I134 PolarHBondContact N-O 3.47Å; F101-I134 HydrophobicContact CB-CD1 3.77Å; F101-I134 HydrophobicContact CD1-CD1 4.31Å; F101-I134 WeakPolarHBondContact O-CA 3.27Å; W119-I134 HydrophobicContact CD2-CG2 4.5Å; W119-I134 HydrophobicContact CZ2-CG2 3.8Å; L122-I134 HydrophobicContact CD2-CD1 4.38Å; A123-I134 HydrophobicContact CB-CB 3.88Å; A123-I134 HydrophobicContact CB-CG1 4.42Å; A123-I134 HydrophobicContact CB-CG2 3.82Å; L126-I134 HydrophobicContact CB-CG1 4.31Å; L126-I134 HydrophobicContact CD1-CD1 3.76Å; L126-I134 HydrophobicContact CD1-CG1 3.92Å; V132-I134 HydrophobicContact CG2-CD1 4.18Å
135	G	96.8	Very high	83.9	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	166.4	-175.6	0	0	0	0	0	114.2	Y84 F101 I102 K103 W119	Y84-G135 CarbonylContact O-C 3.59Å; Y84-G135 VanDerWaalsContact O-CA 3.32Å; Y84-G135 WeakPolarHBondContact O-CA 3.31Å; F101-G135 PolarHBondContact O-N 3.36Å; I102-G135 WeakPolarHBondContact CA-O 3.12Å; K103-G135 PolarHBondContact N-O 3.31Å; W119-G135 PolarHBondContact NE1-O 2.88Å; W119-G135 VanDerWaalsContact NE1-O 3.09Å
136	K	97.2	Very high	83.1	Confident	40 Å²	40	64.9 Å²	64.9	17%	0.174	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	146.9	167.4	63.1	173.2	176.8	-179.9	0	111.7	L83 Y84 E85 L86 K103 F105	L83-K136 HydrophobicContact CD1-CB 4.47Å; L83-K136 HydrophobicContact CD1-CG 4.32Å; L83-K136 HydrophobicContact CD2-CD 3.9Å; L83-K136 HydrophobicContact CD2-CG 4.35Å; L83-K136 HydrophobicContact CG-CD 4.4Å; L83-K136 HydrophobicContact CG-CG 4.33Å; Y84-K136 PolarHBondContact O-N 3.1Å; E85-K136 WeakPolarHBondContact OE1-CE 3.41Å; E85-K136 IonicContact OE1-NZ 2.7Å; E85-K136 PolarHBondContact OE1-NZ 3.09Å; L86-K136 PolarHBondContact N-O 3.42Å; K103-K136 HydrophobicContact CB-CB 4.41Å; K103-K136 CarbonylContact O-C 3.45Å; K103-K136 WeakPolarHBondContact O-CA 3.25Å; F105-K136 HydrophobicContact CD1-CB 4.15Å; F105-K136 HydrophobicContact CE1-CB 3.93Å; F105-K136 HydrophobicContact CE1-CD 3.89Å; F105-K136 HydrophobicContact CE1-CG 4.11Å; F105-K136 HydrophobicContact CZ-CD 4.29Å
137	V	94.8	Very high	82.1	Confident	0 Å²	0	66 Å²	66	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125.5	175.8	176.9	0	0	0	0	108.8	L86 F91 I102 K103 F104 F105 C139 H142 L145	L86-V137 HydrophobicContact CB-CG2 3.67Å; L86-V137 HydrophobicContact CD1-CG2 4.45Å; F91-V137 HydrophobicContact CD2-CG2 3.92Å; F91-V137 HydrophobicContact CE2-CG2 4.05Å; I102-V137 HydrophobicContact CG2-CG2 3.89Å; K103-V137 PolarHBondContact O-N 3.15Å; F104-V137 HydrophobicContact CD1-CB 3.71Å; F104-V137 HydrophobicContact CD1-CG1 3.96Å; F104-V137 HydrophobicContact CD1-CG2 4.13Å; F104-V137 HydrophobicContact CE1-CB 3.9Å; F104-V137 HydrophobicContact CE1-CG1 4.09Å; F104-V137 HydrophobicContact CE1-CG2 3.81Å; F104-V137 HydrophobicContact CG-CB 4.4Å; F104-V137 HydrophobicContact CZ-CG2 4.23Å; F105-V137 WeakPolarHBondContact CD1-O 3.49Å; F105-V137 WeakPolarHBondContact CE1-O 3.48Å; F105-V137 PolarHBondContact N-O 2.99Å; V137-C139 PolarHBondContact O-N 3.49Å; V137-H142 HydrophobicContact CG1-CB 4.22Å; V137-L145 HydrophobicContact CG1-CD2 3.75Å; V137-L145 HydrophobicContact CG1-CG 4.44Å; V137-L145 HydrophobicContact CG2-CD2 4.17Å
138	D	88.1	Confident	81.4	Confident	21 Å²	21	65.2 Å²	65.2	11%	0.112	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	107.2	170.4	-170.3	-22.4	0	0	0	110.3	F105 P107 T140 Q141 H142	F105-D138 HydrophobicContact CE1-CB 4.02Å; F105-D138 HydrophobicContact CE2-CB 4.43Å; F105-D138 HydrophobicContact CZ-CB 3.82Å; P107-D138 WeakPolarHBondContact CD-OD1 3.44Å; P107-D138 WeakPolarHBondContact CD-OD2 3.49Å; D138-T140 VanDerWaalsContact CG-OG1 3.29Å; D138-T140 PolarHBondContact O-N 3.17Å; D138-T140 WeakPolarHBondContact OD1-CA 3.45Å; D138-T140 WeakPolarHBondContact OD1-CB 3.42Å; D138-T140 PolarHBondContact OD1-N 3.38Å; D138-T140 PolarHBondContact OD1-OG1 3.2Å; D138-T140 PolarHBondContact OD2-OG1 2.98Å; D138-Q141 HydrophobicContact CB-CG 4.47Å; D138-Q141 PolarHBondContact O-N 3.08Å; D138-H142 PolarHBondContact O-N 3.04Å
139	C	77.9	Confident	81.2	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.014	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-6.6	-179	-64.8	0	0	0	0	114.5	F105 V137 C146 Y154	F105-C139 WeakPolarHBondContact O-CB 3.26Å; F105-C139 PolarHBondContact O-N 3.11Å; V137-C139 PolarHBondContact O-N 3.49Å; C139-C146 WeakPolarHBondContact CA-SG 3.41Å; C139-C146 HydrophobicContact CB-CB 3.68Å; C139-C146 WeakPolarHBondContact CB-SG 3.26Å; C139-C146 WeakPolarHBondContact SG-CB 3.46Å; C139-C146 CovalentContact SG-SG 2.03Å; C139-C146 PolarHBondContact SG-SG 3.35Å; C139-Y154 HydrophobicContact CB-CD1 4.38Å; C139-Y154 HydrophobicContact CB-CE1 3.39Å; C139-Y154 VanDerWaalsContact CB-OH 3.31Å; C139-Y154 WeakPolarHBondContact CB-OH 3.34Å
140	T	66.7	Low	81.1	Confident	71 Å²	71	62.3 Å²	62.3	44%	0.436	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-23.1	170	68	0	0	0	0	112.3	A106 P107 D138	A106-T140 HydrophobicContact CB-CG2 3.67Å; P107-T140 HydrophobicContact CG-CG2 4.47Å; D138-T140 VanDerWaalsContact CG-OG1 3.29Å; D138-T140 PolarHBondContact O-N 3.17Å; D138-T140 WeakPolarHBondContact OD1-CA 3.45Å; D138-T140 WeakPolarHBondContact OD1-CB 3.42Å; D138-T140 PolarHBondContact OD1-N 3.38Å; D138-T140 PolarHBondContact OD1-OG1 3.2Å; D138-T140 PolarHBondContact OD2-OG1 2.98Å
141	Q	68.3	Low	80.5	Confident	141 Å²	141	53.7 Å²	53.7	66%	0.659	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-33.1	175.5	-61.3	-175.6	-6	0	0	111.7	D138	D138-Q141 HydrophobicContact CB-CG 4.47Å; D138-Q141 PolarHBondContact O-N 3.08Å
142	H	76.7	Confident	80	Confident	43 Å²	43	59.6 Å²	59.6	20%	0.199	30%	0.295	C	S	.	.			trans	-120.6	62	-174.9	-55	-58.9	0	0	0	112.2	S87 V137 D138 E144 L145 C146	S87-H142 WeakPolarHBondContact CA-NE2 3.48Å; S87-H142 WeakPolarHBondContact CB-NE2 3.45Å; V137-H142 HydrophobicContact CG1-CB 4.22Å; D138-H142 PolarHBondContact O-N 3.04Å; H142-E144 PolarHBondContact O-N 3.21Å; H142-L145 HydrophobicContact CB-CB 4.11Å; H142-L145 HydrophobicContact CB-CD2 4.25Å; H142-L145 PolarHBondContact O-N 3.25Å; H142-C146 PolarHBondContact O-N 3.07Å; H142-C146 VanDerWaalsContact O-N 3.15Å; H142-C146 PolarHBondContact O-SG 3.17Å
143	Y	66.6	Low	78.6	Confident	163 Å²	163	61.1 Å²	61.1	64%	0.639	31%	0.311	S	S	*	.	H	α-helix	trans	-59.3	-46.5	-175.1	177.8	-99.6	0	0	0	113.5	C146 S147	Y143-C146 PolarHBondContact O-N 3.34Å; Y143-S147 WeakPolarHBondContact O-CB 3.43Å; Y143-S147 PolarHBondContact O-N 3.12Å
144	E	66.4	Low	77.7	Confident	169 Å²	169	60.4 Å²	60.4	79%	0.79	31%	0.307	S	S	*	.	H	α-helix	trans	-65	-43.3	-177.3	-65.9	-174.1	168.1	0	0	111.9	H142 C146 S147 G148	H142-E144 PolarHBondContact O-N 3.21Å; E144-C146 VanDerWaalsContact C-N 3.29Å; E144-C146 PolarHBondContact O-N 3.45Å; E144-S147 PolarHBondContact O-N 3.43Å; E144-G148 PolarHBondContact O-N 3.47Å
145	L	76.7	Confident	77.4	Confident	27 Å²	27	60.6 Å²	60.6	14%	0.141	31%	0.308	C	S	.	.	H	α-helix	trans	-56.6	-44.6	173.8	174.7	61.9	0	0	0	111.3	F91 V137 H142 N149	F91-L145 HydrophobicContact CB-CD1 4Å; F91-L145 HydrophobicContact CB-CD2 3.87Å; F91-L145 HydrophobicContact CD1-CD1 3.58Å; F91-L145 HydrophobicContact CD2-CD1 4.06Å; F91-L145 HydrophobicContact CD2-CD2 3.88Å; F91-L145 HydrophobicContact CD2-CG 4.43Å; F91-L145 HydrophobicContact CE1-CD1 4.03Å; F91-L145 HydrophobicContact CE2-CD1 4.44Å; F91-L145 HydrophobicContact CG-CD1 3.61Å; F91-L145 HydrophobicContact CG-CD2 3.93Å; F91-L145 HydrophobicContact CG-CG 4.36Å; F91-L145 HydrophobicContact CZ-CD1 4.44Å; V137-L145 HydrophobicContact CG1-CD2 3.75Å; V137-L145 HydrophobicContact CG1-CG 4.44Å; V137-L145 HydrophobicContact CG2-CD2 4.17Å; H142-L145 HydrophobicContact CB-CB 4.11Å; H142-L145 HydrophobicContact CB-CD2 4.25Å; H142-L145 PolarHBondContact O-N 3.25Å; L145-N149 WeakPolarHBondContact CD1-ND2 3.43Å; L145-N149 WeakPolarHBondContact O-CB 3.4Å; L145-N149 PolarHBondContact O-N 3.11Å; L145-N149 VanDerWaalsContact O-N 3.15Å; L145-N149 PolarHBondContact O-ND2 3.28Å
146	C	74.3	Confident	77.3	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.014	31%	0.312	C	S	.	.	H	α-helix	trans	-69.5	-43.6	178.9	-66.3	0	0	0	0	112.7	F104 C139 H142 Y143 E144 N149 Q150 V151	F104-C146 HydrophobicContact CD1-CB 4.44Å; C139-C146 WeakPolarHBondContact CA-SG 3.41Å; C139-C146 HydrophobicContact CB-CB 3.68Å; C139-C146 WeakPolarHBondContact CB-SG 3.26Å; C139-C146 WeakPolarHBondContact SG-CB 3.46Å; C139-C146 CovalentContact SG-SG 2.03Å; C139-C146 PolarHBondContact SG-SG 3.35Å; H142-C146 PolarHBondContact O-N 3.07Å; H142-C146 VanDerWaalsContact O-N 3.15Å; H142-C146 PolarHBondContact O-SG 3.17Å; Y143-C146 PolarHBondContact O-N 3.34Å; E144-C146 VanDerWaalsContact C-N 3.29Å; E144-C146 PolarHBondContact O-N 3.45Å; C146-N149 CarbonylContact O-C 3.6Å; C146-N149 PolarHBondContact O-N 3.4Å; C146-Q150 PolarHBondContact O-N 3.22Å; C146-V151 HydrophobicContact CB-CB 4.05Å; C146-V151 HydrophobicContact CB-CG2 4.3Å; C146-V151 VanDerWaalsContact O-CB 3.27Å; C146-V151 WeakPolarHBondContact O-CB 3.48Å; C146-V151 WeakPolarHBondContact O-CG2 3.34Å; C146-V151 PolarHBondContact O-N 3.01Å
147	S	67.8	Low	77.3	Confident	64 Å²	64	59.5 Å²	59.5	45%	0.448	31%	0.305	S	S	.	.	H	α-helix	trans	-63.3	-44.6	177.8	-174.3	0	0	0	0	111.6	Y143 E144 N149 Q150	Y143-S147 WeakPolarHBondContact O-CB 3.43Å; Y143-S147 PolarHBondContact O-N 3.12Å; E144-S147 PolarHBondContact O-N 3.43Å; S147-N149 VanDerWaalsContact C-N 3.27Å; S147-N149 PolarHBondContact O-N 2.82Å; S147-Q150 WeakPolarHBondContact O-CA 3.33Å; S147-Q150 PolarHBondContact O-N 3.25Å
148	G	71.4	Confident	77.4	Confident	64 Å²	64	59.6 Å²	59.6	66%	0.66	31%	0.305	S	S	*	.	H	α-helix	trans	-60.9	-35.5	175.9	0	0	0	0	0	112.7	E144 Q150	E144-G148 PolarHBondContact O-N 3.47Å; G148-Q150 PolarHBondContact O-N 2.85Å
149	N	76.6	Confident	77.9	Confident	23 Å²	23	58.6 Å²	58.6	12%	0.123	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	4.6	172.7	-77.2	-72.6	0	0	0	114.2	F104 L145 C146 S147 V151 L158 F160 K165	F104-N149 HydrophobicContact CE1-CB 4.32Å; F104-N149 HydrophobicContact CZ-CB 4.23Å; L145-N149 WeakPolarHBondContact CD1-ND2 3.43Å; L145-N149 WeakPolarHBondContact O-CB 3.4Å; L145-N149 PolarHBondContact O-N 3.11Å; L145-N149 VanDerWaalsContact O-N 3.15Å; L145-N149 PolarHBondContact O-ND2 3.28Å; C146-N149 CarbonylContact O-C 3.6Å; C146-N149 PolarHBondContact O-N 3.4Å; S147-N149 VanDerWaalsContact C-N 3.27Å; S147-N149 PolarHBondContact O-N 2.82Å; N149-V151 VanDerWaalsContact C-N 3.34Å; N149-V151 HydrophobicContact CB-CG2 4.38Å; N149-L158 HydrophobicContact CB-CD1 4.08Å; N149-F160 VanDerWaalsContact OD1-CE1 3.26Å; N149-F160 WeakPolarHBondContact OD1-CE1 3.49Å; N149-F160 VanDerWaalsContact OD1-CZ 3.24Å; N149-F160 WeakPolarHBondContact OD1-CZ 3.45Å; N149-K165 PolarHBondContact O-NZ 2.85Å
150	Q	81	Confident	78.8	Confident	122 Å²	122	58.7 Å²	58.7	57%	0.57	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	32.6	179.5	-53.1	169.5	-31.6	0	0	113.6	C146 S147 G148 R152	C146-Q150 PolarHBondContact O-N 3.22Å; S147-Q150 WeakPolarHBondContact O-CA 3.33Å; S147-Q150 PolarHBondContact O-N 3.25Å; G148-Q150 PolarHBondContact O-N 2.85Å; Q150-R152 PolarHBondContact O-N 3.47Å
151	V	72.2	Confident	80.1	Confident	14 Å²	14	58 Å²	58	9%	0.085	29%	0.289	C	S	.	.			trans	-75	110	174	179.5	0	0	0	0	109.1	F104 C146 N149 Y154 T156 L158	F104-V151 HydrophobicContact CB-CB 4.47Å; F104-V151 HydrophobicContact CB-CG1 3.95Å; F104-V151 HydrophobicContact CB-CG2 3.71Å; F104-V151 HydrophobicContact CD1-CG2 3.65Å; F104-V151 HydrophobicContact CD2-CG2 4.12Å; F104-V151 HydrophobicContact CE1-CG2 4.27Å; F104-V151 HydrophobicContact CG-CG2 3.54Å; C146-V151 HydrophobicContact CB-CB 4.05Å; C146-V151 HydrophobicContact CB-CG2 4.3Å; C146-V151 VanDerWaalsContact O-CB 3.27Å; C146-V151 WeakPolarHBondContact O-CB 3.48Å; C146-V151 WeakPolarHBondContact O-CG2 3.34Å; C146-V151 PolarHBondContact O-N 3.01Å; N149-V151 VanDerWaalsContact C-N 3.34Å; N149-V151 HydrophobicContact CB-CG2 4.38Å; V151-Y154 HydrophobicContact CG1-CD1 3.91Å; V151-Y154 HydrophobicContact CG1-CE1 3.61Å; V151-T156 HydrophobicContact CG2-CG2 4.34Å; V151-L158 HydrophobicContact CG2-CD1 4.29Å
152	R	74.8	Confident	81.3	Confident	206 Å²	206	55.7 Å²	55.7	78%	0.777	28%	0.282	S	S	*	.			trans	-109.4	-2.8	-177	-64.1	178.4	-179.3	177.6	-0.4	114	Q150	Q150-R152 PolarHBondContact O-N 3.47Å
153	G	63.6	Low	81.9	Confident	34 Å²	34	55.5 Å²	55.5	35%	0.351	29%	0.291	S	S	.	.	S	Bend	trans	-169	162.3	-178.8	0	0	0	0	0	111.2	T156	G153-T156 PolarHBondContact O-OG1 3.31Å
154	Y	77.7	Confident	83	Confident	61 Å²	61	55 Å²	55	24%	0.239	29%	0.293	C	S	.	.	S	Bend	trans	-121.6	145.2	-172	-48.1	-58.7	0	0	0	112.6	A106 W108 C112 C139 V151	A106-Y154 HydrophobicContact CB-CD2 3.6Å; A106-Y154 HydrophobicContact CB-CE2 3.82Å; A106-Y154 HydrophobicContact CB-CG 4.1Å; W108-Y154 HydrophobicContact CH2-CD2 4.14Å; W108-Y154 HydrophobicContact CH2-CE2 4.24Å; W108-Y154 HydrophobicContact CZ2-CD2 4.39Å; W108-Y154 HydrophobicContact CZ2-CE2 4.18Å; C112-Y154 VanDerWaalsContact SG-CB 3.55Å; C139-Y154 HydrophobicContact CB-CD1 4.38Å; C139-Y154 HydrophobicContact CB-CE1 3.39Å; C139-Y154 VanDerWaalsContact CB-OH 3.31Å; C139-Y154 WeakPolarHBondContact CB-OH 3.34Å; V151-Y154 HydrophobicContact CG1-CD1 3.91Å; V151-Y154 HydrophobicContact CG1-CE1 3.61Å
155	P	90.4	Very high	84.3	Confident	6 Å²	6	50.6 Å²	50.6	4%	0.039	27%	0.27	C	S	.	.	S	Bend	cis	-73.6	145.6	-14.6	29.5	-31.6	0	0	0	111.1	K103 F104 C112 L115 R173	K103-P155 HydrophobicContact CG-CB 4.33Å; F104-P155 WeakPolarHBondContact O-CA 3.37Å; C112-P155 VanDerWaalsContact SG-CD 3.57Å; C112-P155 VanDerWaalsContact SG-N 3.41Å; L115-P155 HydrophobicContact CD2-CB 4.11Å; L115-P155 HydrophobicContact CD2-CG 3.79Å; P155-R173 PolarHBondContact O-NH2 3.38Å
156	T	93.6	Very high	85.1	Confident	14 Å²	14	52.9 Å²	52.9	9%	0.086	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	131.5	167.8	-71.3	0	0	0	0	108.6	F104 V151 G153 L158	F104-T156 PolarHBondContact N-O 3.38Å; F104-T156 PolarHBondContact O-N 3.17Å; V151-T156 HydrophobicContact CG2-CG2 4.34Å; G153-T156 PolarHBondContact O-OG1 3.31Å; T156-L158 HydrophobicContact CG2-CD1 4.39Å; T156-L158 HydrophobicContact CG2-CD2 3.61Å; T156-L158 HydrophobicContact CG2-CG 3.85Å
157	L	98	Very high	85.9	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.016	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	115.2	-174.7	-57.3	-175.9	0	0	0	108.7	F101 I102 K103 L115 W119 Q168 Y169 L178	F101-L157 HydrophobicContact CE2-CB 3.78Å; F101-L157 HydrophobicContact CZ-CB 4.05Å; F101-L157 HydrophobicContact CZ-CD1 4.33Å; I102-L157 WeakPolarHBondContact O-CA 3.14Å; K103-L157 HydrophobicContact CB-CD2 3.57Å; K103-L157 HydrophobicContact CD-CD2 4.36Å; K103-L157 HydrophobicContact CG-CD2 3.61Å; L115-L157 HydrophobicContact CD2-CD1 4.03Å; L115-L157 HydrophobicContact CD2-CD2 3.99Å; L115-L157 HydrophobicContact CD2-CG 4.44Å; W119-L157 HydrophobicContact CE3-CD1 4.48Å; W119-L157 HydrophobicContact CE3-CD2 4.17Å; W119-L157 HydrophobicContact CH2-CD2 3.88Å; W119-L157 HydrophobicContact CZ3-CD1 3.84Å; W119-L157 HydrophobicContact CZ3-CD2 3.7Å; W119-L157 HydrophobicContact CZ3-CG 4.28Å; L157-Q168 WeakPolarHBondContact O-CA 3.4Å; L157-Y169 HydrophobicContact CD1-CD1 3.76Å; L157-Y169 HydrophobicContact CD1-CE1 4.46Å; L157-Y169 PolarHBondContact O-N 3.47Å; L157-L178 HydrophobicContact CD1-CD2 4.07Å
158	L	96.7	Very high	87.1	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	141.5	-172.5	-59	-176.9	0	0	0	110.7	F101 I102 F104 N149 V151 T156 F160 K165 Q168	F101-L158 WeakPolarHBondContact CD2-O 3.39Å; I102-L158 PolarHBondContact N-O 3.25Å; I102-L158 PolarHBondContact O-N 2.97Å; F104-L158 HydrophobicContact CD2-CB 4.38Å; F104-L158 HydrophobicContact CD2-CD1 3.88Å; F104-L158 HydrophobicContact CD2-CG 4Å; F104-L158 HydrophobicContact CE2-CB 3.99Å; F104-L158 HydrophobicContact CE2-CD1 3.57Å; F104-L158 HydrophobicContact CE2-CG 3.93Å; F104-L158 HydrophobicContact CZ-CD1 4.17Å; N149-L158 HydrophobicContact CB-CD1 4.08Å; V151-L158 HydrophobicContact CG2-CD1 4.29Å; T156-L158 HydrophobicContact CG2-CD1 4.39Å; T156-L158 HydrophobicContact CG2-CD2 3.61Å; T156-L158 HydrophobicContact CG2-CG 3.85Å; L158-F160 HydrophobicContact CB-CD2 4.3Å; L158-F160 HydrophobicContact CB-CE2 3.53Å; L158-F160 HydrophobicContact CB-CZ 4.13Å; L158-F160 HydrophobicContact CD1-CE2 4.27Å; L158-F160 HydrophobicContact CD1-CZ 4.08Å; L158-K165 HydrophobicContact CD1-CD 3.81Å; L158-K165 HydrophobicContact CD2-CD 4.15Å; L158-K165 HydrophobicContact CG-CD 4.43Å; L158-Q168 HydrophobicContact CD2-CB 3.67Å; L158-Q168 HydrophobicContact CD2-CG 3.69Å
159	W	97.9	Very high	88	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	130.4	172.4	-167.4	-77.9	0	0	0	110.3	D99 H100 F101 V132 V166 D167 Y181 V182 Q185 L186	D99-W159 HydrophobicContact CB-CH2 4.36Å; D99-W159 HydrophobicContact CB-CZ2 3.45Å; D99-W159 VanDerWaalsContact CB-CZ2 3.45Å; D99-W159 PolarHBondContact OD1-NE1 3Å; H100-W159 CarbonylContact O-C 3.58Å; H100-W159 WeakPolarHBondContact O-CA 3.27Å; F101-W159 HydrophobicContact CB-CE3 3.7Å; F101-W159 HydrophobicContact CB-CZ3 3.8Å; F101-W159 HydrophobicContact CD1-CZ3 4.44Å; F101-W159 AromaticContact CD2-CE3 3.95Å; F101-W159 HydrophobicContact CD2-CE3 3.95Å; F101-W159 AromaticContact CG-CE3 3.83Å; F101-W159 HydrophobicContact CG-CE3 3.83Å; F101-W159 HydrophobicContact CG-CZ3 4.09Å; V132-W159 HydrophobicContact CB-CH2 4.39Å; V132-W159 HydrophobicContact CG2-CH2 3.67Å; V132-W159 HydrophobicContact CG2-CZ2 4.32Å; V132-W159 HydrophobicContact CG2-CZ3 4.1Å; W159-V166 HydrophobicContact CB-CG2 4.42Å; W159-V166 HydrophobicContact CG-CG2 4.23Å; W159-V166 PolarHBondContact O-N 3.26Å; W159-D167 HydrophobicContact CB-CB 4.08Å; W159-D167 PolarHBondContact N-O 3.13Å; W159-D167 PolarHBondContact O-N 2.03Å; W159-Y181 HydrophobicContact CE3-CD1 4.44Å; W159-Y181 AromaticContact CE3-CE1 3.76Å; W159-Y181 HydrophobicContact CE3-CE1 3.76Å; W159-Y181 HydrophobicContact CZ3-CE1 4.33Å; W159-V182 HydrophobicContact CH2-CB 4.48Å; W159-V182 HydrophobicContact CH2-CG1 4.17Å; W159-V182 HydrophobicContact CZ3-CB 4.33Å; W159-V182 HydrophobicContact CZ3-CG1 4.4Å; W159-V182 HydrophobicContact CZ3-CG2 4.03Å; W159-Q185 HydrophobicContact CD2-CB 3.94Å; W159-Q185 HydrophobicContact CD2-CG 3.84Å; W159-Q185 HydrophobicContact CE3-CB 4.16Å; W159-Q185 HydrophobicContact CE3-CG 3.94Å; W159-Q185 HydrophobicContact CG-CG 4.38Å; W159-Q185 HydrophobicContact CH2-CB 3.56Å; W159-Q185 HydrophobicContact CH2-CG 4.22Å; W159-Q185 HydrophobicContact CZ2-CB 3.31Å; W159-Q185 HydrophobicContact CZ2-CG 4.14Å; W159-Q185 HydrophobicContact CZ3-CB 4Å; W159-Q185 HydrophobicContact CZ3-CG 4.13Å; W159-L186 HydrophobicContact CZ2-CD2 4.45Å
160	F	96.6	Very high	88.4	Confident	4 Å²	4	60.2 Å²	60.2	2%	0.018	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	142.2	174.5	-62.8	-102.5	0	0	0	110.3	F91 V95 D99 H100 I102 F104 N149 L158 K164 K165	F91-F160 HydrophobicContact CE1-CE1 4.09Å; F91-F160 HydrophobicContact CE1-CZ 4.29Å; F91-F160 HydrophobicContact CZ-CD1 4.37Å; F91-F160 HydrophobicContact CZ-CD2 4.46Å; F91-F160 AromaticContact CZ-CE1 3.8Å; F91-F160 HydrophobicContact CZ-CE1 3.8Å; F91-F160 AromaticContact CZ-CE2 3.89Å; F91-F160 HydrophobicContact CZ-CE2 3.89Å; F91-F160 AromaticContact CZ-CZ 3.57Å; F91-F160 HydrophobicContact CZ-CZ 3.57Å; V95-F160 HydrophobicContact CB-CB 4.17Å; V95-F160 HydrophobicContact CB-CG 4.45Å; V95-F160 HydrophobicContact CG1-CB 4.24Å; V95-F160 HydrophobicContact CG1-CG 4.23Å; D99-F160 CarbonylContact C-O 3.52Å; D99-F160 WeakPolarHBondContact CA-O 3.39Å; H100-F160 HydrophobicContact CB-CB 4.24Å; H100-F160 PolarHBondContact N-O 2.81Å; H100-F160 PolarHBondContact O-N 2.89Å; I102-F160 HydrophobicContact CB-CE2 4.36Å; I102-F160 HydrophobicContact CD1-CD2 3.71Å; I102-F160 HydrophobicContact CD1-CE2 3.95Å; I102-F160 HydrophobicContact CD1-CG 4.5Å; I102-F160 HydrophobicContact CG1-CD2 4.23Å; I102-F160 HydrophobicContact CG1-CE2 4.48Å; F104-F160 AromaticContact CE2-CE2 3.99Å; F104-F160 HydrophobicContact CE2-CE2 3.99Å; F104-F160 HydrophobicContact CE2-CZ 4.32Å; F104-F160 HydrophobicContact CZ-CE2 4.21Å; F104-F160 HydrophobicContact CZ-CZ 4.19Å; N149-F160 VanDerWaalsContact OD1-CE1 3.26Å; N149-F160 WeakPolarHBondContact OD1-CE1 3.49Å; N149-F160 VanDerWaalsContact OD1-CZ 3.24Å; N149-F160 WeakPolarHBondContact OD1-CZ 3.45Å; L158-F160 HydrophobicContact CB-CD2 4.3Å; L158-F160 HydrophobicContact CB-CE2 3.53Å; L158-F160 HydrophobicContact CB-CZ 4.13Å; L158-F160 HydrophobicContact CD1-CE2 4.27Å; L158-F160 HydrophobicContact CD1-CZ 4.08Å; F160-K164 CarbonylContact C-O 3.35Å; F160-K164 WeakPolarHBondContact CA-O 3.02Å; F160-K165 HydrophobicContact CD1-CB 3.97Å; F160-K165 HydrophobicContact CE1-CB 3.63Å; F160-K165 HydrophobicContact CE1-CG 4.29Å; F160-K165 HydrophobicContact CZ-CB 4.14Å; F160-K165 HydrophobicContact CZ-CG 4.31Å
161	R	94.9	Very high	88.6	Confident	55 Å²	55	56.3 Å²	56.3	21%	0.208	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	121.9	173.5	-179.7	169.3	-65.1	167.1	0.7	108.6	G98 D99 G163 K164 V166 Q185 T189	G98-R161 WeakPolarHBondContact O-CA 3.42Å; D99-R161 WeakPolarHBondContact OD1-CB 3.29Å; D99-R161 IonicContact OD1-CZ 3.35Å; D99-R161 IonicContact OD1-NE 2.73Å; D99-R161 PolarHBondContact OD1-NE 3.3Å; D99-R161 IonicContact OD1-NH2 3.07Å; D99-R161 PolarHBondContact OD1-NH2 2.88Å; D99-R161 VanDerWaalsContact OD1-NH2 3.07Å; D99-R161 IonicContact OD2-CZ 3.74Å; D99-R161 IonicContact OD2-NE 3.63Å; D99-R161 IonicContact OD2-NH2 3.04Å; D99-R161 PolarHBondContact OD2-NH2 3.37Å; R161-G163 VanDerWaalsContact C-N 3.29Å; R161-G163 PolarHBondContact O-N 2.96Å; R161-K164 PolarHBondContact N-O 2.86Å; R161-K164 PolarHBondContact O-N 2.94Å; R161-V166 HydrophobicContact CB-CG1 4.04Å; R161-V166 HydrophobicContact CB-CG2 4.01Å; R161-Q185 PolarHBondContact NH2-O 3.24Å; R161-T189 PolarHBondContact NH1-OG1 2.84Å; R161-T189 PolarHBondContact NH2-OG1 3.15Å
162	D	92.6	Very high	89.3	Confident	94 Å²	94	62.9 Å²	62.9	50%	0.503	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.6	52.2	176.9	-55.5	-47	0	0	0	112.9	A96 Q97 G98 K164	A96-D162 CarbonylContact O-C 3.5Å; A96-D162 VanDerWaalsContact O-CA 3.31Å; A96-D162 WeakPolarHBondContact O-CA 3.05Å; Q97-D162 WeakPolarHBondContact CA-OD1 2.95Å; G98-D162 PolarHBondContact N-OD1 3.45Å; G98-D162 PolarHBondContact O-N 3.47Å; G98-D162 VanDerWaalsContact O-N 3.16Å; D162-K164 VanDerWaalsContact C-N 3.26Å; D162-K164 PolarHBondContact O-N 2.9Å
163	G	89.2	Confident	90.1	Very high	39 Å²	39	58 Å²	58	40%	0.402	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	-8.3	178.7	0	0	0	0	0	115.4	V95 R161	V95-G163 WeakPolarHBondContact O-CA 3.25Å; V95-G163 PolarHBondContact O-N 3.28Å; R161-G163 VanDerWaalsContact C-N 3.29Å; R161-G163 PolarHBondContact O-N 2.96Å
164	K	91.1	Very high	91.4	Very high	153 Å²	153	59.2 Å²	59.2	67%	0.665	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	133.7	-176	-65.1	177.7	-175.9	173.7	0	111.6	F160 R161 D162 V166	F160-K164 CarbonylContact C-O 3.35Å; F160-K164 WeakPolarHBondContact CA-O 3.02Å; R161-K164 PolarHBondContact N-O 2.86Å; R161-K164 PolarHBondContact O-N 2.94Å; D162-K164 VanDerWaalsContact C-N 3.26Å; D162-K164 PolarHBondContact O-N 2.9Å; K164-V166 HydrophobicContact CB-CG1 4.36Å; K164-V166 PolarHBondContact O-N 3.06Å
165	K	92.9	Very high	92	Very high	75 Å²	75	57.8 Å²	57.8	33%	0.326	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	114.2	165.7	-176.3	-179.1	68.4	172.9	0	109.1	N149 L158 F160	N149-K165 PolarHBondContact O-NZ 2.85Å; L158-K165 HydrophobicContact CD1-CD 3.81Å; L158-K165 HydrophobicContact CD2-CD 4.15Å; L158-K165 HydrophobicContact CG-CD 4.43Å; F160-K165 HydrophobicContact CD1-CB 3.97Å; F160-K165 HydrophobicContact CE1-CB 3.63Å; F160-K165 HydrophobicContact CE1-CG 4.29Å; F160-K165 HydrophobicContact CZ-CB 4.14Å; F160-K165 HydrophobicContact CZ-CG 4.31Å
166	V	92.8	Very high	91.9	Very high	75 Å²	75	63.9 Å²	63.9	46%	0.455	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	-22.9	-176.9	-64.7	0	0	0	0	113.5	W159 R161 K164	W159-V166 HydrophobicContact CB-CG2 4.42Å; W159-V166 HydrophobicContact CG-CG2 4.23Å; W159-V166 PolarHBondContact O-N 3.26Å; R161-V166 HydrophobicContact CB-CG1 4.04Å; R161-V166 HydrophobicContact CB-CG2 4.01Å; K164-V166 HydrophobicContact CB-CG1 4.36Å; K164-V166 PolarHBondContact O-N 3.06Å
167	D	91.6	Very high	91.7	Very high	57 Å²	57	64.3 Å²	64.3	31%	0.305	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	162.7	178.7	-157.7	2.8	0	0	0	112.9	W159 Y181 Q185	W159-D167 HydrophobicContact CB-CB 4.08Å; W159-D167 PolarHBondContact N-O 3.13Å; W159-D167 PolarHBondContact O-N 2.03Å; D167-Y181 WeakPolarHBondContact CB-OH 3.46Å; D167-Y181 PolarHBondContact OD2-OH 3.14Å; D167-Q185 PolarHBondContact OD2-NE2 3.45Å
168	Q	92.4	Very high	91.6	Very high	79 Å²	79	64.1 Å²	64.1	37%	0.369	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	119.1	172.4	173.8	179	5.9	0	0	109.7	L157 L158 K170	L157-Q168 WeakPolarHBondContact O-CA 3.4Å; L158-Q168 HydrophobicContact CD2-CB 3.67Å; L158-Q168 HydrophobicContact CD2-CG 3.69Å; Q168-K170 HydrophobicContact CG-CG 4.28Å; Q168-K170 PolarHBondContact O-N 2.84Å
169	Y	91	Very high	91.4	Very high	25 Å²	25	69 Å²	69	10%	0.098	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	128.4	177.2	-176.1	-99.2	0	0	0	111.8	F101 L157 G171 K172 S177 L178 Y181	F101-Y169 HydrophobicContact CZ-CD1 4.44Å; F101-Y169 HydrophobicContact CZ-CG 4.03Å; L157-Y169 HydrophobicContact CD1-CD1 3.76Å; L157-Y169 HydrophobicContact CD1-CE1 4.46Å; L157-Y169 PolarHBondContact O-N 3.47Å; Y169-G171 VanDerWaalsContact CZ-CA 3.46Å; Y169-K172 VanDerWaalsContact CE1-O 3.26Å; Y169-K172 WeakPolarHBondContact CE1-O 3.48Å; Y169-K172 PolarHBondContact OH-N 3.35Å; Y169-K172 PolarHBondContact OH-O 2.06Å; Y169-S177 VanDerWaalsContact OH-CB 3.26Å; Y169-S177 WeakPolarHBondContact OH-CB 3.37Å; Y169-S177 PolarHBondContact OH-O 3.05Å; Y169-L178 HydrophobicContact CD1-CD2 3.86Å; Y169-L178 HydrophobicContact CE1-CD2 3.46Å; Y169-L178 VanDerWaalsContact CE1-CD2 3.46Å; Y169-L178 HydrophobicContact CE1-CG 4.49Å; Y169-Y181 AromaticContact CD2-CD1 3.6Å; Y169-Y181 HydrophobicContact CD2-CD1 3.6Å; Y169-Y181 AromaticContact CD2-CD2 3.44Å; Y169-Y181 HydrophobicContact CD2-CD2 3.44Å; Y169-Y181 VanDerWaalsContact CD2-CD2 3.44Å; Y169-Y181 AromaticContact CD2-CE1 3.96Å; Y169-Y181 HydrophobicContact CD2-CE1 3.96Å; Y169-Y181 AromaticContact CD2-CE2 3.78Å; Y169-Y181 HydrophobicContact CD2-CE2 3.78Å; Y169-Y181 AromaticContact CD2-CG 3.3Å; Y169-Y181 HydrophobicContact CD2-CG 3.3Å; Y169-Y181 HydrophobicContact CE2-CD1 4.2Å; Y169-Y181 AromaticContact CE2-CD2 3.88Å; Y169-Y181 HydrophobicContact CE2-CD2 3.88Å; Y169-Y181 AromaticContact CE2-CG 3.6Å; Y169-Y181 HydrophobicContact CE2-CG 3.6Å; Y169-Y181 HydrophobicContact CG-CD1 4.24Å; Y169-Y181 HydrophobicContact CG-CE1 4.35Å; Y169-Y181 HydrophobicContact CG-CG 4.35Å
170	K	85.9	Confident	91.2	Very high	146 Å²	146	74.5 Å²	74.5	64%	0.635	36%	0.364	S	S	*	.			trans	-128.2	8.6	-179.5	-63.1	176.6	-174.1	171	0	113.1	Q168	Q168-K170 HydrophobicContact CG-CG 4.28Å; Q168-K170 PolarHBondContact O-N 2.84Å
171	G	85.3	Confident	91.1	Very high	40 Å²	40	75.4 Å²	75.4	41%	0.412	37%	0.367	S	S	.	.	S	Bend	trans	-76.7	-170.8	179.7	0	0	0	0	0	113.4	Y169	Y169-G171 VanDerWaalsContact CZ-CA 3.46Å
172	K	85.8	Confident	91.1	Very high	153 Å²	153	73 Å²	73	67%	0.665	36%	0.358	S	S	*	.			trans	-66.6	151.6	176.8	-60.6	178.3	-178.6	171.2	0	110.5	Y169 D174	Y169-K172 VanDerWaalsContact CE1-O 3.26Å; Y169-K172 WeakPolarHBondContact CE1-O 3.48Å; Y169-K172 PolarHBondContact OH-N 3.35Å; Y169-K172 PolarHBondContact OH-O 2.06Å; K172-D174 VanDerWaalsContact C-N 3.35Å; K172-D174 WeakPolarHBondContact CB-OD2 3.48Å
173	R	91.3	Very high	91.1	Very high	104 Å²	104	73.6 Å²	73.6	39%	0.392	36%	0.359	S	S	.	.			trans	-99.3	21.2	-172.5	-67.1	176.1	-179.8	167.4	-1.1	113.2	L115 P155	L115-R173 HydrophobicContact CD1-CB 3.91Å; L115-R173 HydrophobicContact CD1-CG 4.46Å; P155-R173 PolarHBondContact O-NH2 3.38Å
174	D	92	Very high	91.3	Very high	58 Å²	58	74 Å²	74	31%	0.31	36%	0.355	S	S	.	.	S	Bend	trans	-83.2	160.8	170.6	56.8	79.6	0	0	0	111.4	K172 E176 S177 L178	K172-D174 VanDerWaalsContact C-N 3.35Å; K172-D174 WeakPolarHBondContact CB-OD2 3.48Å; D174-E176 VanDerWaalsContact C-N 3.34Å; D174-E176 PolarHBondContact O-N 3.18Å; D174-S177 VanDerWaalsContact CG-OG 3.26Å; D174-S177 VanDerWaalsContact OD1-CB 3.26Å; D174-S177 WeakPolarHBondContact OD1-CB 3.32Å; D174-S177 PolarHBondContact OD1-N 2.82Å; D174-S177 PolarHBondContact OD1-OG 2.86Å; D174-S177 PolarHBondContact OD2-OG 2.89Å; D174-L178 WeakPolarHBondContact O-CG 3.39Å; D174-L178 PolarHBondContact O-N 2.88Å
175	L	89.4	Confident	91.4	Very high	31 Å²	31	67.1 Å²	67.1	16%	0.162	33%	0.326	C	S	.	.	H	α-helix	trans	-64.7	-37.8	-171.8	-174.8	58.8	0	0	0	112.8	T118 Q121 L122 L178 R179	T118-L175 HydrophobicContact CG2-CB 3.9Å; T118-L175 HydrophobicContact CG2-CD1 4.39Å; Q121-L175 HydrophobicContact CB-CD1 4.17Å; Q121-L175 HydrophobicContact CB-CD2 4.21Å; L122-L175 HydrophobicContact CB-CD1 3.92Å; L122-L175 HydrophobicContact CD1-CD1 4.31Å; L175-L178 PolarHBondContact O-N 3.27Å; L175-R179 VanDerWaalsContact CD2-NH1 3.32Å; L175-R179 WeakPolarHBondContact O-CG 3.48Å; L175-R179 PolarHBondContact O-N 3.48Å
176	E	88.5	Confident	91.2	Very high	135 Å²	135	65.3 Å²	65.3	63%	0.631	32%	0.319	S	S	*	.	H	α-helix	trans	-63.6	-53.3	179.8	-176.1	172.9	-154.7	0	0	110.2	D174 L178 R179 E180	D174-E176 VanDerWaalsContact C-N 3.34Å; D174-E176 PolarHBondContact O-N 3.18Å; E176-L178 PolarHBondContact O-N 2.64Å; E176-R179 PolarHBondContact O-N 2.91Å; E176-R179 VanDerWaalsContact O-N 3.08Å; E176-E180 WeakPolarHBondContact O-CG 3.21Å; E176-E180 PolarHBondContact O-N 2.97Å
177	S	89.7	Confident	90.9	Very high	22 Å²	22	67.4 Å²	67.4	15%	0.154	32%	0.324	C	S	.	.	H	α-helix	trans	-61.7	-28.4	179.6	-55.4	0	0	0	0	113.5	Y169 D174 Y181	Y169-S177 VanDerWaalsContact OH-CB 3.26Å; Y169-S177 WeakPolarHBondContact OH-CB 3.37Å; Y169-S177 PolarHBondContact OH-O 3.05Å; D174-S177 VanDerWaalsContact CG-OG 3.26Å; D174-S177 VanDerWaalsContact OD1-CB 3.26Å; D174-S177 WeakPolarHBondContact OD1-CB 3.32Å; D174-S177 PolarHBondContact OD1-N 2.82Å; D174-S177 PolarHBondContact OD1-OG 2.86Å; D174-S177 PolarHBondContact OD2-OG 2.89Å; S177-Y181 WeakPolarHBondContact O-CB 3.4Å; S177-Y181 PolarHBondContact O-N 3.26Å
178	L	94.9	Very high	90.2	Very high	0 Å²	0	72 Å²	72	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-78.1	-37.2	175.9	-69.7	171.7	0	0	0	112.3	F101 L115 T118 W119 L122 L157 Y169 D174 L175 E176 Y181 V182	F101-L178 HydrophobicContact CE1-CD2 3.94Å; F101-L178 HydrophobicContact CZ-CD2 4.06Å; L115-L178 HydrophobicContact CD1-CD1 4.2Å; T118-L178 HydrophobicContact CG2-CD1 4.01Å; W119-L178 HydrophobicContact CE3-CD1 4.28Å; W119-L178 HydrophobicContact CZ3-CD1 4.49Å; W119-L178 HydrophobicContact CZ3-CD2 4.28Å; L122-L178 HydrophobicContact CD1-CB 4.33Å; L122-L178 HydrophobicContact CD2-CB 3.96Å; L122-L178 HydrophobicContact CD2-CD1 4.35Å; L157-L178 HydrophobicContact CD1-CD2 4.07Å; Y169-L178 HydrophobicContact CD1-CD2 3.86Å; Y169-L178 HydrophobicContact CE1-CD2 3.46Å; Y169-L178 VanDerWaalsContact CE1-CD2 3.46Å; Y169-L178 HydrophobicContact CE1-CG 4.49Å; D174-L178 WeakPolarHBondContact O-CG 3.39Å; D174-L178 PolarHBondContact O-N 2.88Å; L175-L178 PolarHBondContact O-N 3.27Å; E176-L178 PolarHBondContact O-N 2.64Å; L178-Y181 PolarHBondContact O-N 3.32Å; L178-V182 VanDerWaalsContact O-CG2 3.26Å; L178-V182 WeakPolarHBondContact O-CG2 3.46Å; L178-V182 PolarHBondContact O-N 3.21Å; L178-V182 VanDerWaalsContact O-N 3.09Å
179	R	94.6	Very high	88.9	Confident	105 Å²	105	71.5 Å²	71.5	40%	0.396	34%	0.34	S	S	.	.	H	α-helix	trans	-66.5	-47.8	175.3	-78.4	-179.2	177.5	139.4	0.1	111.6	L122 L175 E176 Y181 V182 E183	L122-R179 HydrophobicContact CD1-CG 3.7Å; L175-R179 VanDerWaalsContact CD2-NH1 3.32Å; L175-R179 WeakPolarHBondContact O-CG 3.48Å; L175-R179 PolarHBondContact O-N 3.48Å; E176-R179 PolarHBondContact O-N 2.91Å; E176-R179 VanDerWaalsContact O-N 3.08Å; R179-Y181 PolarHBondContact O-N 3.43Å; R179-V182 WeakPolarHBondContact O-CB 3.45Å; R179-V182 PolarHBondContact O-N 3.16Å; R179-E183 WeakPolarHBondContact O-CG 3.5Å; R179-E183 PolarHBondContact O-N 2.93Å
180	E	91.9	Very high	87.4	Confident	114 Å²	114	78.5 Å²	78.5	53%	0.533	37%	0.373	S	S	.	.	H	α-helix	trans	-55.6	-40.6	175.8	-71.1	179.5	166.1	0	0	111.4	E176 E183 S184	E176-E180 WeakPolarHBondContact O-CG 3.21Å; E176-E180 PolarHBondContact O-N 2.97Å; E180-E183 PolarHBondContact O-N 3.1Å; E180-S184 WeakPolarHBondContact O-CB 3.26Å; E180-S184 PolarHBondContact O-N 2.74Å
181	Y	95	Very high	85.7	Confident	23 Å²	23	76.6 Å²	76.6	9%	0.09	37%	0.374	C	S	.	.	H	α-helix	trans	-64	-46.2	176	176.2	-105.3	0	0	0	112.5	F101 W159 D167 Y169 S177 L178 R179 E183 S184 Q185	F101-Y181 HydrophobicContact CD2-CE1 4.17Å; F101-Y181 AromaticContact CE1-CD1 3.93Å; F101-Y181 HydrophobicContact CE1-CD1 3.93Å; F101-Y181 HydrophobicContact CE1-CE1 4.24Å; F101-Y181 HydrophobicContact CE2-CD1 4.2Å; F101-Y181 AromaticContact CE2-CE1 3.7Å; F101-Y181 HydrophobicContact CE2-CE1 3.7Å; F101-Y181 AromaticContact CZ-CD1 3.75Å; F101-Y181 HydrophobicContact CZ-CD1 3.75Å; F101-Y181 AromaticContact CZ-CE1 3.74Å; F101-Y181 HydrophobicContact CZ-CE1 3.74Å; W159-Y181 HydrophobicContact CE3-CD1 4.44Å; W159-Y181 AromaticContact CE3-CE1 3.76Å; W159-Y181 HydrophobicContact CE3-CE1 3.76Å; W159-Y181 HydrophobicContact CZ3-CE1 4.33Å; D167-Y181 WeakPolarHBondContact CB-OH 3.46Å; D167-Y181 PolarHBondContact OD2-OH 3.14Å; Y169-Y181 AromaticContact CD2-CD1 3.6Å; Y169-Y181 HydrophobicContact CD2-CD1 3.6Å; Y169-Y181 AromaticContact CD2-CD2 3.44Å; Y169-Y181 HydrophobicContact CD2-CD2 3.44Å; Y169-Y181 VanDerWaalsContact CD2-CD2 3.44Å; Y169-Y181 AromaticContact CD2-CE1 3.96Å; Y169-Y181 HydrophobicContact CD2-CE1 3.96Å; Y169-Y181 AromaticContact CD2-CE2 3.78Å; Y169-Y181 HydrophobicContact CD2-CE2 3.78Å; Y169-Y181 AromaticContact CD2-CG 3.3Å; Y169-Y181 HydrophobicContact CD2-CG 3.3Å; Y169-Y181 HydrophobicContact CE2-CD1 4.2Å; Y169-Y181 AromaticContact CE2-CD2 3.88Å; Y169-Y181 HydrophobicContact CE2-CD2 3.88Å; Y169-Y181 AromaticContact CE2-CG 3.6Å; Y169-Y181 HydrophobicContact CE2-CG 3.6Å; Y169-Y181 HydrophobicContact CG-CD1 4.24Å; Y169-Y181 HydrophobicContact CG-CE1 4.35Å; Y169-Y181 HydrophobicContact CG-CG 4.35Å; S177-Y181 WeakPolarHBondContact O-CB 3.4Å; S177-Y181 PolarHBondContact O-N 3.26Å; L178-Y181 PolarHBondContact O-N 3.32Å; R179-Y181 PolarHBondContact O-N 3.43Å; Y181-E183 VanDerWaalsContact C-N 3.34Å; Y181-E183 PolarHBondContact O-N 3.32Å; Y181-S184 PolarHBondContact O-N 2.93Å; Y181-S184 PolarHBondContact O-OG 3.02Å; Y181-Q185 HydrophobicContact CD1-CG 4.45Å; Y181-Q185 HydrophobicContact CD2-CG 4.36Å; Y181-Q185 HydrophobicContact CE1-CG 4.02Å; Y181-Q185 HydrophobicContact CE2-CG 3.96Å; Y181-Q185 WeakPolarHBondContact O-CG 3.26Å; Y181-Q185 PolarHBondContact O-N 3.29Å
182	V	95.3	Very high	83.9	Confident	4 Å²	4	77.6 Å²	77.6	2%	0.024	39%	0.385	C	S	.	.	H	α-helix	trans	-57.5	-48.8	176.4	171	0	0	0	0	110.5	F101 L126 V132 W159 L178 R179 S184 Q185 L186	F101-V182 HydrophobicContact CD1-CG2 3.93Å; F101-V182 HydrophobicContact CE1-CG2 4.37Å; L126-V182 HydrophobicContact CD1-CG1 4.02Å; L126-V182 HydrophobicContact CD1-CG2 4.27Å; V132-V182 HydrophobicContact CG1-CG1 3.83Å; V132-V182 HydrophobicContact CG2-CG1 4.4Å; W159-V182 HydrophobicContact CH2-CB 4.48Å; W159-V182 HydrophobicContact CH2-CG1 4.17Å; W159-V182 HydrophobicContact CZ3-CB 4.33Å; W159-V182 HydrophobicContact CZ3-CG1 4.4Å; W159-V182 HydrophobicContact CZ3-CG2 4.03Å; L178-V182 VanDerWaalsContact O-CG2 3.26Å; L178-V182 WeakPolarHBondContact O-CG2 3.46Å; L178-V182 PolarHBondContact O-N 3.21Å; L178-V182 VanDerWaalsContact O-N 3.09Å; R179-V182 WeakPolarHBondContact O-CB 3.45Å; R179-V182 PolarHBondContact O-N 3.16Å; V182-S184 VanDerWaalsContact C-N 3.32Å; V182-S184 PolarHBondContact O-N 3.09Å; V182-Q185 PolarHBondContact O-N 3.01Å; V182-L186 HydrophobicContact CG1-CD1 4.02Å; V182-L186 WeakPolarHBondContact O-CG 3.32Å; V182-L186 PolarHBondContact O-N 3Å; V182-L186 VanDerWaalsContact O-N 3.11Å
183	E	93.1	Very high	81.7	Confident	108 Å²	108	74.1 Å²	74.1	51%	0.505	38%	0.384	S	S	.	.	H	α-helix	trans	-58.5	-43.5	177.5	-69.7	172.2	-169.7	0	0	111.7	R179 E180 Y181 Q185 L186 Q187	R179-E183 WeakPolarHBondContact O-CG 3.5Å; R179-E183 PolarHBondContact O-N 2.93Å; E180-E183 PolarHBondContact O-N 3.1Å; Y181-E183 VanDerWaalsContact C-N 3.34Å; Y181-E183 PolarHBondContact O-N 3.32Å; E183-Q185 VanDerWaalsContact C-N 3.34Å; E183-Q185 PolarHBondContact O-N 2.9Å; E183-L186 PolarHBondContact O-N 3.46Å; E183-Q187 WeakPolarHBondContact O-CG 3.46Å; E183-Q187 PolarHBondContact O-N 3.16Å
184	S	92.4	Very high	79.2	Confident	48 Å²	48	75 Å²	75	34%	0.336	40%	0.401	S	S	.	.	H	α-helix	trans	-62.6	-37.6	177.9	79.2	0	0	0	0	113.2	E180 Y181 V182 R188	E180-S184 WeakPolarHBondContact O-CB 3.26Å; E180-S184 PolarHBondContact O-N 2.74Å; Y181-S184 PolarHBondContact O-N 2.93Å; Y181-S184 PolarHBondContact O-OG 3.02Å; V182-S184 VanDerWaalsContact C-N 3.32Å; V182-S184 PolarHBondContact O-N 3.09Å; S184-R188 WeakPolarHBondContact O-CG 3.49Å; S184-R188 PolarHBondContact O-N 3.48Å
185	Q	92.8	Very high	76.8	Confident	8 Å²	8	80.9 Å²	80.9	4%	0.037	43%	0.427	C	S	.	.	H	α-helix	trans	-72.2	-33.8	179	-66.4	-64.9	-32.4	0	0	111.9	W159 R161 D167 Y181 V182 E183 T189	W159-Q185 HydrophobicContact CD2-CB 3.94Å; W159-Q185 HydrophobicContact CD2-CG 3.84Å; W159-Q185 HydrophobicContact CE3-CB 4.16Å; W159-Q185 HydrophobicContact CE3-CG 3.94Å; W159-Q185 HydrophobicContact CG-CG 4.38Å; W159-Q185 HydrophobicContact CH2-CB 3.56Å; W159-Q185 HydrophobicContact CH2-CG 4.22Å; W159-Q185 HydrophobicContact CZ2-CB 3.31Å; W159-Q185 HydrophobicContact CZ2-CG 4.14Å; W159-Q185 HydrophobicContact CZ3-CB 4Å; W159-Q185 HydrophobicContact CZ3-CG 4.13Å; R161-Q185 PolarHBondContact NH2-O 3.24Å; D167-Q185 PolarHBondContact OD2-NE2 3.45Å; Y181-Q185 HydrophobicContact CD1-CG 4.45Å; Y181-Q185 HydrophobicContact CD2-CG 4.36Å; Y181-Q185 HydrophobicContact CE1-CG 4.02Å; Y181-Q185 HydrophobicContact CE2-CG 3.96Å; Y181-Q185 WeakPolarHBondContact O-CG 3.26Å; Y181-Q185 PolarHBondContact O-N 3.29Å; V182-Q185 PolarHBondContact O-N 3.01Å; E183-Q185 VanDerWaalsContact C-N 3.34Å; E183-Q185 PolarHBondContact O-N 2.9Å; Q185-T189 PolarHBondContact O-OG1 3.22Å
186	L	90	Very high	74	Confident	36 Å²	36	84.1 Å²	84.1	19%	0.188	45%	0.448	C	S	.	.	H	α-helix	trans	-71.8	-38.7	176.5	-67.4	174.9	0	0	0	112.1	D99 V132 W159 V182 E183 R188 T189 E190	D99-L186 HydrophobicContact CB-CD2 4.35Å; V132-L186 HydrophobicContact CB-CD2 4.34Å; V132-L186 HydrophobicContact CG1-CD1 4.17Å; W159-L186 HydrophobicContact CZ2-CD2 4.45Å; V182-L186 HydrophobicContact CG1-CD1 4.02Å; V182-L186 WeakPolarHBondContact O-CG 3.32Å; V182-L186 PolarHBondContact O-N 3Å; V182-L186 VanDerWaalsContact O-N 3.11Å; E183-L186 PolarHBondContact O-N 3.46Å; L186-R188 VanDerWaalsContact C-N 3.28Å; L186-R188 PolarHBondContact O-N 3.38Å; L186-T189 WeakPolarHBondContact O-CA 3.5Å; L186-T189 WeakPolarHBondContact O-CB 3.43Å; L186-T189 PolarHBondContact O-N 2.7Å; L186-T189 PolarHBondContact O-OG1 2.92Å; L186-E190 PolarHBondContact O-N 3.43Å
187	Q	85.1	Confident	71.9	Confident	119 Å²	119	84.3 Å²	84.3	56%	0.556	46%	0.458	S	S	*	.	H	α-helix	trans	-64.5	-31.7	176.1	-73.7	174.6	21	0	0	113	E183 T189 E190 T191	E183-Q187 WeakPolarHBondContact O-CG 3.46Å; E183-Q187 PolarHBondContact O-N 3.16Å; Q187-T189 PolarHBondContact O-N 3.46Å; Q187-E190 PolarHBondContact O-N 2.99Å; Q187-T191 PolarHBondContact O-N 3.41Å; Q187-T191 VanDerWaalsContact O-N 3.16Å; Q187-T191 PolarHBondContact O-OG1 3.02Å
188	R	78.2	Confident	68.9	Low	153 Å²	153	89 Å²	89	58%	0.577	49%	0.486	S	S	*	.	H	α-helix	trans	-65.6	-15.6	172.2	-68.4	174.1	83.4	-176.2	5.8	112.9	S184 L186	S184-R188 WeakPolarHBondContact O-CG 3.49Å; S184-R188 PolarHBondContact O-N 3.48Å; L186-R188 VanDerWaalsContact C-N 3.28Å; L186-R188 PolarHBondContact O-N 3.38Å
189	T	65.6	Low	66.2	Low	70 Å²	70	94.2 Å²	94.2	43%	0.429	52%	0.52	S	S	.	.	H	α-helix	trans	-86.4	-37.7	174.8	-46.5	0	0	0	0	111.4	D99 R161 Q185 L186 Q187	D99-T189 PolarHBondContact OD2-OG1 2.83Å; R161-T189 PolarHBondContact NH1-OG1 2.84Å; R161-T189 PolarHBondContact NH2-OG1 3.15Å; Q185-T189 PolarHBondContact O-OG1 3.22Å; L186-T189 WeakPolarHBondContact O-CA 3.5Å; L186-T189 WeakPolarHBondContact O-CB 3.43Å; L186-T189 PolarHBondContact O-N 2.7Å; L186-T189 PolarHBondContact O-OG1 2.92Å; Q187-T189 PolarHBondContact O-N 3.46Å
190	E	59.3	Low	64.2	Low	171 Å²	171	94.9 Å²	94.9	80%	0.799	54%	0.541	S	S	*	.	H	α-helix	trans	-75.3	-36	-178.5	-64.1	-171.6	155	0	0	113.3	L186 Q187 G192	L186-E190 PolarHBondContact O-N 3.43Å; Q187-E190 PolarHBondContact O-N 2.99Å; E190-G192 VanDerWaalsContact C-N 3.26Å; E190-G192 PolarHBondContact O-N 3.39Å
191	T	49.7	Very low	61.2	Low	106 Å²	106	98.6 Å²	98.6	65%	0.65	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	77.7	168.9	36.6	0	0	0	0	108.7	Q187 A193	Q187-T191 PolarHBondContact O-N 3.41Å; Q187-T191 VanDerWaalsContact O-N 3.16Å; Q187-T191 PolarHBondContact O-OG1 3.02Å; T191-A193 PolarHBondContact O-N 2.79Å
192	G	46.8	Very low	58.7	Low	62 Å²	62	101.3 Å²	101.3	64%	0.639	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-41.9	94.2	-177.3	0	0	0	0	0	113.5	E190 T194	E190-G192 VanDerWaalsContact C-N 3.26Å; E190-G192 PolarHBondContact O-N 3.39Å; G192-T194 VanDerWaalsContact C-N 3.31Å; G192-T194 PolarHBondContact O-N 3.1Å
193	A	40.2	Very low	55.7	Low	80 Å²	80	107.3 Å²	107.3	66%	0.661	62%	0.624	S	S	*	*			trans	-76.4	93.3	171.1	0	0	0	0	0	106.8	T191 E195	T191-A193 PolarHBondContact O-N 2.79Å; A193-E195 PolarHBondContact O-N 3.3Å
194	T	37.8	Very low	53.3	Low	122 Å²	122	108.5 Å²	108.5	75%	0.748	64%	0.639	S	S	*	*			trans	-63.8	74.8	162.9	-35.9	0	0	0	0	107.8	G192 T196	G192-T194 VanDerWaalsContact C-N 3.31Å; G192-T194 PolarHBondContact O-N 3.1Å; T194-T196 HydrophobicContact CG2-CG2 4.19Å; T194-T196 PolarHBondContact O-N 3.24Å
195	E	43.3	Very low	50.3	Low	181 Å²	181	114.4 Å²	114.4	85%	0.846	67%	0.666	S	S	*	*			trans	-75.4	79	160.8	-77.2	-167.5	171.3	0	0	107.2	A193 V197	A193-E195 PolarHBondContact O-N 3.3Å; E195-V197 PolarHBondContact O-N 3.48Å; E195-V197 VanDerWaalsContact O-N 3.15Å
196	T	29.3	Very low	47.6	Very low	99 Å²	99	118.7 Å²	118.7	61%	0.607	70%	0.702	S	S	*	*			trans	-56.4	115.9	154.6	36.5	0	0	0	0	107	T194 T198	T194-T196 HydrophobicContact CG2-CG2 4.19Å; T194-T196 PolarHBondContact O-N 3.24Å; T196-T198 VanDerWaalsContact C-N 3.31Å; T196-T198 PolarHBondContact O-N 3.19Å
197	V	44.4	Very low	44.7	Very low	140 Å²	140	121.8 Å²	121.8	85%	0.848	73%	0.733	S	S	*	*			trans	-50.1	102.8	156.2	177.8	0	0	0	0	106.6	E195	E195-V197 PolarHBondContact O-N 3.48Å; E195-V197 VanDerWaalsContact O-N 3.15Å
198	T	26.6	Very low	42.5	Very low	119 Å²	119	124.8 Å²	124.8	73%	0.73	75%	0.747	S	S	*	*			trans	-101.5	119	163	30.1	0	0	0	0	106.9	T196	T196-T198 VanDerWaalsContact C-N 3.31Å; T196-T198 PolarHBondContact O-N 3.19Å
199	P	38.1	Very low	41.5	Very low	111 Å²	111	122.8 Å²	122.8	72%	0.721	75%	0.754	S	S	*	*			trans	-63.7	137.8	176.1	-17	29.6	0	0	0	110.7	E201	P199-E201 PolarHBondContact O-N 2.9Å
200	S	53.2	Low	39.8	Very low	119 Å²	119	128.1 Å²	128.1	83%	0.832	77%	0.774	S	S	*	*			trans	6.3	102.9	140.2	173.5	0	0	0	0	115.4
201	E	29.1	Very low	38.9	Very low	192 Å²	192	124.7 Å²	124.7	90%	0.897	78%	0.775	S	S	*	*			trans	-131.6	120.5	145.9	-115.7	178.3	153.2	0	0	108.8	P199	P199-E201 PolarHBondContact O-N 2.9Å
202	A	42.9	Very low	38.1	Very low	80 Å²	80	126.2 Å²	126.2	66%	0.661	78%	0.779	S	S	*	*			trans	-67.8	154.9	-179	0	0	0	0	0	111.6
203	P	32	Very low	37.8	Very low	130 Å²	130	133.3 Å²	133.3	84%	0.844	79%	0.792	S	S	*	*			trans	-103.7	103.7	136.9	11.6	7.3	0	0	0	107.6	L205	P203-L205 PolarHBondContact O-N 2.78Å
204	V	42.3	Very low	38.1	Very low	132 Å²	132	130.5 Å²	130.5	80%	0.8	77%	0.771	S	S	*	*			trans	-63.2	121.8	153.9	-123.4	0	0	0	0	106.8
205	L	29.2	Very low	39.3	Very low	173 Å²	173	130.4 Å²	130.4	91%	0.906	77%	0.77	S	S	*	*			trans	-151.7	101.3	145.6	-96.2	170.1	0	0	0	107.2	P203	P203-L205 PolarHBondContact O-N 2.78Å
206	A	37.6	Very low	41.2	Very low	98 Å²	98	122.7 Å²	122.7	81%	0.81	74%	0.736	S	S	*	*			trans	-76.5	140.8	166.5	0	0	0	0	0	109.7
207	A	28.9	Very low	44.2	Very low	100 Å²	100	121.3 Å²	121.3	83%	0.826	72%	0.724	S	S	*	*			trans	-175.2	119.3	134.4	0	0	0	0	0	109.6
208	E	37.5	Very low	46.5	Very low	183 Å²	183	117.5 Å²	117.5	86%	0.855	71%	0.707	S	S	*	*			trans	-74.8	178.1	154.7	-53.8	-172.9	160.9	0	0	109.6
209	P	57.3	Low	49.7	Very low	110 Å²	110	112.1 Å²	112.1	71%	0.714	67%	0.674	S	S	*	*			cis	-118.5	172.3	-25.6	28.6	-9.6	0	0	0	110.1
210	E	29.9	Very low	52.2	Low	182 Å²	182	109 Å²	109	85%	0.85	65%	0.653	S	S	*	*			trans	-172.9	134.6	144.2	-95.5	-49.9	135.5	0	0	108.1	D212	E210-D212 PolarHBondContact O-N 2.82Å
211	A	41.9	Very low	53.7	Low	99 Å²	99	107.9 Å²	107.9	82%	0.818	64%	0.635	S	S	*	*			trans	-74.4	119.6	176.4	0	0	0	0	0	109.6
212	D	32	Very low	56.5	Low	139 Å²	139	105.8 Å²	105.8	74%	0.743	63%	0.63	S	S	*	*			trans	-128.2	134.1	162.1	-165.1	20.3	0	0	0	111	E210 G214	E210-D212 PolarHBondContact O-N 2.82Å; D212-G214 PolarHBondContact O-N 3.3Å
213	K	39.5	Very low	58.8	Low	211 Å²	211	104.4 Å²	104.4	92%	0.917	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	99.5	-170.9	-71.9	176.6	176.6	178.7	0	109.5
214	G	47	Very low	61.7	Low	21 Å²	21	98.4 Å²	98.4	22%	0.216	57%	0.572	C	S	.	*	T	Hydrogen-bonded Turn	trans	142.3	8.7	160.7	0	0	0	0	0	116.6	D212 K257	D212-G214 PolarHBondContact O-N 3.3Å; G214-K257 VanDerWaalsContact O-CE 3.25Å; G214-K257 WeakPolarHBondContact O-CE 3.26Å
215	T	63.3	Low	64.1	Low	119 Å²	119	96.1 Å²	96.1	73%	0.73	56%	0.555	S	S	*	*			trans	-97.3	133.7	171.2	49	0	0	0	0	110	L217	T215-L217 PolarHBondContact O-N 3.16Å
216	V	84.1	Confident	67.2	Low	20 Å²	20	94.1 Å²	94.1	12%	0.121	55%	0.545	C	S	.	.			trans	-58.4	131.3	174.5	177.8	0	0	0	0	108	A218 E253 E270	V216-A218 PolarHBondContact O-N 3.17Å; V216-E253 HydrophobicContact CG2-CB 4.38Å; V216-E253 HydrophobicContact CG2-CG 3.89Å; V216-E270 HydrophobicContact CG1-CB 3.93Å; V216-E270 HydrophobicContact CG1-CG 3.7Å
217	L	90.8	Very high	69.8	Low	70 Å²	70	90.3 Å²	90.3	37%	0.366	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	114.2	-178	-179	64.7	0	0	0	110.3	T215 L219 T227 I268 A269 E270	T215-L217 PolarHBondContact O-N 3.16Å; L217-L219 HydrophobicContact CD2-CD2 3.78Å; L217-L219 HydrophobicContact CG-CD2 3.78Å; L217-T227 HydrophobicContact CD2-CG2 3.54Å; L217-I268 PolarHBondContact N-O 2.95Å; L217-I268 VanDerWaalsContact N-O 3.12Å; L217-A269 HydrophobicContact CB-CB 4.04Å; L217-A269 CarbonylContact O-C 3.6Å; L217-A269 WeakPolarHBondContact O-CA 3.06Å; L217-A269 VanDerWaalsContact O-CB 3.27Å; L217-A269 WeakPolarHBondContact O-CB 3.19Å; L217-E270 PolarHBondContact O-N 3.22Å
218	A	93.4	Very high	72.9	Confident	60 Å²	60	85.6 Å²	85.6	50%	0.496	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	123.1	174.4	0	0	0	0	0	110.4	V216 N223	V216-A218 PolarHBondContact O-N 3.17Å; A218-N223 PolarHBondContact O-ND2 2.82Å
219	L	93.3	Very high	75.5	Confident	5 Å²	5	79.2 Å²	79.2	3%	0.026	45%	0.452	C	S	.	.			trans	-104.4	138	-179.3	-56.5	178.4	0	0	0	111.5	L217 N223 F224 T227 I235 A269 E270 V271	L217-L219 HydrophobicContact CD2-CD2 3.78Å; L217-L219 HydrophobicContact CG-CD2 3.78Å; L219-N223 VanDerWaalsContact CA-OD1 3.27Å; L219-N223 WeakPolarHBondContact CA-OD1 3.37Å; L219-F224 HydrophobicContact CB-CD2 3.92Å; L219-F224 HydrophobicContact CD1-CD2 3.83Å; L219-F224 HydrophobicContact CD1-CE2 4.09Å; L219-T227 HydrophobicContact CD1-CG2 4.47Å; L219-T227 HydrophobicContact CD2-CG2 3.78Å; L219-I235 HydrophobicContact CD1-CD1 3.7Å; L219-I235 HydrophobicContact CD1-CG1 4.17Å; L219-I235 HydrophobicContact CD1-CG2 4.42Å; L219-A269 HydrophobicContact CD1-CB 3.67Å; L219-A269 HydrophobicContact CD2-CB 4.5Å; L219-A269 HydrophobicContact CG-CB 3.92Å; L219-E270 PolarHBondContact N-O 2.85Å; L219-V271 HydrophobicContact CB-CG2 3.77Å; L219-V271 HydrophobicContact CD1-CG2 4.42Å
220	T	91.4	Very high	76.9	Confident	47 Å²	47	81.3 Å²	81.3	29%	0.288	45%	0.452	S	S	.	.			trans	-128.1	169.9	178.5	64.1	0	0	0	0	109.2	N222 N223 F224	T220-N222 PolarHBondContact O-N 2.85Å; T220-N223 PolarHBondContact N-OD1 3.28Å; T220-N223 PolarHBondContact O-N 2.99Å; T220-N223 VanDerWaalsContact O-N 3.14Å; T220-N223 PolarHBondContact O-OD1 2.85Å; T220-N223 VanDerWaalsContact O-OD1 3.11Å; T220-F224 VanDerWaalsContact O-CB 3.28Å; T220-F224 WeakPolarHBondContact O-CB 3.3Å; T220-F224 PolarHBondContact O-N 3.45Å
221	E	83.6	Confident	79.6	Confident	94 Å²	94	74 Å²	74	44%	0.439	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-28.9	177.5	-78.7	176	-167.3	0	0	113.2	E276 N278 I279	E221-E276 WeakPolarHBondContact CG-OE2 3.39Å; E221-E276 PolarHBondContact N-OE2 3.36Å; E221-N278 VanDerWaalsContact OE1-CB 3.27Å; E221-N278 WeakPolarHBondContact OE1-CB 3.31Å; E221-N278 PolarHBondContact OE1-ND2 3.07Å; E221-I279 HydrophobicContact CG-CD1 3.99Å; E221-I279 HydrophobicContact CG-CG1 3.77Å
222	N	88.4	Confident	82	Confident	149 Å²	149	69.4 Å²	69.4	80%	0.797	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-24.2	-176.9	-63	-34.2	0	0	0	114.4	T220	T220-N222 PolarHBondContact O-N 2.85Å
223	N	91.3	Very high	85.1	Confident	51 Å²	51	62.8 Å²	62.8	27%	0.273	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.7	-6.1	-173.3	71.4	7.8	0	0	0	113.7	A218 L219 T220 T227	A218-N223 PolarHBondContact O-ND2 2.82Å; L219-N223 VanDerWaalsContact CA-OD1 3.27Å; L219-N223 WeakPolarHBondContact CA-OD1 3.37Å; T220-N223 PolarHBondContact N-OD1 3.28Å; T220-N223 PolarHBondContact O-N 2.99Å; T220-N223 VanDerWaalsContact O-N 3.14Å; T220-N223 PolarHBondContact O-OD1 2.85Å; T220-N223 VanDerWaalsContact O-OD1 3.11Å; N223-T227 VanDerWaalsContact O-CB 3.24Å; N223-T227 WeakPolarHBondContact O-CB 3.37Å; N223-T227 PolarHBondContact O-N 2.94Å; N223-T227 PolarHBondContact O-OG1 2.97Å
224	F	93.9	Very high	87.8	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.018	31%	0.309	C	S	.	.	H	α-helix	trans	-62.7	-55.9	-173.3	-174.4	-83.1	0	0	0	111.9	L219 T220 D226 T227 I228 I235 F237 V271 I279 Y283 F294	L219-F224 HydrophobicContact CB-CD2 3.92Å; L219-F224 HydrophobicContact CD1-CD2 3.83Å; L219-F224 HydrophobicContact CD1-CE2 4.09Å; T220-F224 VanDerWaalsContact O-CB 3.28Å; T220-F224 WeakPolarHBondContact O-CB 3.3Å; T220-F224 PolarHBondContact O-N 3.45Å; F224-D226 PolarHBondContact O-N 3.05Å; F224-T227 PolarHBondContact O-N 2.93Å; F224-I228 HydrophobicContact CD1-CD1 4.13Å; F224-I228 HydrophobicContact CD1-CG1 4.41Å; F224-I228 HydrophobicContact CE1-CD1 3.64Å; F224-I228 HydrophobicContact CE1-CG1 4.28Å; F224-I228 HydrophobicContact CE1-CG2 4.19Å; F224-I228 HydrophobicContact CZ-CG2 4.31Å; F224-I228 WeakPolarHBondContact O-CG1 3.47Å; F224-I228 PolarHBondContact O-N 2.82Å; F224-I228 VanDerWaalsContact O-N 3.11Å; F224-I235 HydrophobicContact CD2-CD1 4.47Å; F224-I235 HydrophobicContact CE2-CD1 3.52Å; F224-I235 HydrophobicContact CZ-CD1 3.69Å; F224-F237 HydrophobicContact CE2-CE1 4.3Å; F224-F237 AromaticContact CE2-CZ 3.95Å; F224-F237 HydrophobicContact CE2-CZ 3.95Å; F224-F237 HydrophobicContact CZ-CZ 4.07Å; F224-V271 HydrophobicContact CD2-CG2 3.92Å; F224-V271 HydrophobicContact CE2-CG2 3.8Å; F224-I279 HydrophobicContact CB-CD1 3.97Å; F224-I279 HydrophobicContact CD1-CG2 4.22Å; F224-I279 HydrophobicContact CD2-CD1 3.94Å; F224-I279 HydrophobicContact CD2-CG2 3.58Å; F224-I279 HydrophobicContact CE1-CG2 4.14Å; F224-I279 HydrophobicContact CE2-CG2 3.48Å; F224-I279 VanDerWaalsContact CE2-CG2 3.48Å; F224-I279 HydrophobicContact CG-CD1 4.08Å; F224-I279 HydrophobicContact CG-CG2 3.98Å; F224-I279 HydrophobicContact CZ-CG2 3.78Å; F224-Y283 HydrophobicContact CD1-CE2 4.32Å; F224-Y283 HydrophobicContact CE1-CD2 4.31Å; F224-Y283 AromaticContact CE1-CE2 3.34Å; F224-Y283 HydrophobicContact CE1-CE2 3.34Å; F224-Y283 AromaticContact CE1-CZ 3.76Å; F224-Y283 HydrophobicContact CZ-CD2 4.09Å; F224-Y283 AromaticContact CZ-CE2 3.54Å; F224-Y283 HydrophobicContact CZ-CE2 3.54Å; F224-F294 HydrophobicContact CE1-CE1 4.49Å; F224-F294 HydrophobicContact CZ-CE1 4.29Å; F224-F294 HydrophobicContact CZ-CE2 4.3Å; F224-F294 AromaticContact CZ-CZ 3.95Å; F224-F294 HydrophobicContact CZ-CZ 3.95Å
225	D	92.9	Very high	90.2	Very high	84 Å²	84	51.8 Å²	51.8	45%	0.449	30%	0.298	S	S	.	.	H	α-helix	trans	-64.5	-40.7	-173.5	-73.3	-35.7	0	0	0	111.4	I228 A229 K282	D225-I228 WeakPolarHBondContact O-CG1 3.44Å; D225-I228 PolarHBondContact O-N 2.7Å; D225-A229 WeakPolarHBondContact O-CB 3.43Å; D225-A229 PolarHBondContact O-N 3.19Å; D225-A229 VanDerWaalsContact O-N 3.12Å; D225-K282 IonicContact OD1-NZ 3.64Å; D225-K282 PolarHBondContact OD1-NZ 2.6Å; D225-K282 IonicContact OD2-NZ 2.67Å
226	D	93.4	Very high	91.8	Very high	130 Å²	130	46.5 Å²	46.5	70%	0.695	27%	0.265	S	S	*	.	H	α-helix	trans	-65.9	-40	175.4	-68.7	-20.4	0	0	0	112.1	F224 I228 A229	F224-D226 PolarHBondContact O-N 3.05Å; D226-I228 VanDerWaalsContact C-N 3.33Å; D226-I228 PolarHBondContact O-N 2.91Å; D226-A229 WeakPolarHBondContact O-CB 3.31Å; D226-A229 PolarHBondContact O-N 3.38Å
227	T	91.9	Very high	92.3	Very high	18 Å²	18	45.5 Å²	45.5	11%	0.11	26%	0.259	C	S	.	.	H	α-helix	trans	-63.4	-42.1	179.7	-62.8	0	0	0	0	111.4	L217 L219 N223 F224 T233 K267	L217-T227 HydrophobicContact CD2-CG2 3.54Å; L219-T227 HydrophobicContact CD1-CG2 4.47Å; L219-T227 HydrophobicContact CD2-CG2 3.78Å; N223-T227 VanDerWaalsContact O-CB 3.24Å; N223-T227 WeakPolarHBondContact O-CB 3.37Å; N223-T227 PolarHBondContact O-N 2.94Å; N223-T227 PolarHBondContact O-OG1 2.97Å; F224-T227 PolarHBondContact O-N 2.93Å; T227-T233 HydrophobicContact CG2-CG2 4.22Å; T227-T233 PolarHBondContact O-OG1 2.98Å; T227-K267 HydrophobicContact CG2-CD 3.77Å; T227-K267 PolarHBondContact O-NZ 3.19Å
228	I	94.3	Very high	92.3	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-82.8	-11.3	-177.3	66.9	161.1	0	0	0	113.6	F224 D225 D226 E230 T233 I235 F294 G297	F224-I228 HydrophobicContact CD1-CD1 4.13Å; F224-I228 HydrophobicContact CD1-CG1 4.41Å; F224-I228 HydrophobicContact CE1-CD1 3.64Å; F224-I228 HydrophobicContact CE1-CG1 4.28Å; F224-I228 HydrophobicContact CE1-CG2 4.19Å; F224-I228 HydrophobicContact CZ-CG2 4.31Å; F224-I228 WeakPolarHBondContact O-CG1 3.47Å; F224-I228 PolarHBondContact O-N 2.82Å; F224-I228 VanDerWaalsContact O-N 3.11Å; D225-I228 WeakPolarHBondContact O-CG1 3.44Å; D225-I228 PolarHBondContact O-N 2.7Å; D226-I228 VanDerWaalsContact C-N 3.33Å; D226-I228 PolarHBondContact O-N 2.91Å; I228-E230 VanDerWaalsContact C-N 3.3Å; I228-E230 PolarHBondContact O-N 3.32Å; I228-T233 HydrophobicContact CG2-CG2 4.23Å; I228-I235 HydrophobicContact CG2-CD1 3.81Å; I228-F294 HydrophobicContact CB-CB 4.02Å; I228-F294 HydrophobicContact CB-CD1 4.46Å; I228-F294 HydrophobicContact CB-CG 4.36Å; I228-F294 HydrophobicContact CD1-CD1 3.7Å; I228-F294 HydrophobicContact CD1-CE1 4.14Å; I228-F294 HydrophobicContact CD1-CG 4.41Å; I228-F294 HydrophobicContact CG2-CB 4.02Å; I228-F294 HydrophobicContact CG2-CD1 4.39Å; I228-F294 HydrophobicContact CG2-CD2 4.48Å; I228-F294 HydrophobicContact CG2-CG 4.06Å; I228-G297 WeakPolarHBondContact O-CA 3.38Å; I228-G297 PolarHBondContact O-N 3.19Å
229	A	91.1	Very high	91.6	Very high	50 Å²	50	41.5 Å²	41.5	41%	0.413	23%	0.227	S	C	.	.	H	α-helix	trans	-62.3	-35.7	-175.6	0	0	0	0	0	113	D225 D226 G296	D225-A229 WeakPolarHBondContact O-CB 3.43Å; D225-A229 PolarHBondContact O-N 3.19Å; D225-A229 VanDerWaalsContact O-N 3.12Å; D226-A229 WeakPolarHBondContact O-CB 3.31Å; D226-A229 PolarHBondContact O-N 3.38Å; A229-G296 VanDerWaalsContact O-CA 3.31Å; A229-G296 WeakPolarHBondContact O-CA 3.48Å
230	E	86.8	Confident	90.6	Very high	153 Å²	153	44.1 Å²	44.1	72%	0.715	24%	0.244	S	C	*	.	S	Bend	trans	-125.3	145	-177.8	-64.6	-174.2	177.6	0	0	112.5	I228	I228-E230 VanDerWaalsContact C-N 3.3Å; I228-E230 PolarHBondContact O-N 3.32Å
231	G	88.1	Confident	89.6	Confident	30 Å²	30	49.2 Å²	49.2	31%	0.309	26%	0.258	S	S	.	.	S	Bend	trans	72.1	-152.8	179.3	0	0	0	0	0	113.2	R295	G231-R295 WeakPolarHBondContact O-CA 3.06Å
232	I	92.8	Very high	89.2	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	127.2	178.3	-67.2	173.2	0	0	0	108.2	L263 G265 V266 K267 L293 F294 R295 Q319	I232-L263 HydrophobicContact CD1-CB 4.39Å; I232-L263 HydrophobicContact CD1-CD1 4.05Å; I232-L263 HydrophobicContact CD1-CD2 3.53Å; I232-L263 HydrophobicContact CD1-CG 4.2Å; I232-G265 PolarHBondContact N-O 3.02Å; I232-V266 HydrophobicContact CB-CG2 4.31Å; I232-V266 CarbonylContact O-C 3.41Å; I232-V266 VanDerWaalsContact O-CA 3.3Å; I232-V266 WeakPolarHBondContact O-CA 3.33Å; I232-K267 PolarHBondContact O-N 2.99Å; I232-L293 HydrophobicContact CG2-CD1 4.01Å; I232-L293 HydrophobicContact CG2-CD2 3.87Å; I232-L293 HydrophobicContact CG2-CG 3.96Å; I232-F294 WeakPolarHBondContact CA-O 3.36Å; I232-R295 HydrophobicContact CG1-CG 4.47Å; I232-Q319 HydrophobicContact CD1-CB 4.36Å
233	T	95.8	Very high	88.2	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120	174.2	-53.9	0	0	0	0	109.5	T227 I228 I235 K267 A269 F294	T227-T233 HydrophobicContact CG2-CG2 4.22Å; T227-T233 PolarHBondContact O-OG1 2.98Å; I228-T233 HydrophobicContact CG2-CG2 4.23Å; T233-I235 HydrophobicContact CG2-CD1 3.95Å; T233-I235 HydrophobicContact CG2-CG1 3.6Å; T233-K267 CarbonylContact C-O 3.49Å; T233-K267 WeakPolarHBondContact CA-O 3.49Å; T233-K267 HydrophobicContact CG2-CB 4.12Å; T233-A269 HydrophobicContact CG2-CB 3.96Å; T233-F294 PolarHBondContact N-O 3.32Å; T233-F294 PolarHBondContact O-N 3.03Å
234	F	96.6	Very high	87.4	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	117.4	174.3	-170.4	-149.1	0	0	0	109.5	W252 L255 K267 I268 A269 L291 L292 L293 H303 L312 F315 V316	F234-W252 AromaticContact CD1-CH2 3.42Å; F234-W252 HydrophobicContact CD1-CH2 3.42Å; F234-W252 VanDerWaalsContact CD1-CH2 3.42Å; F234-W252 HydrophobicContact CD1-CZ2 4.16Å; F234-W252 HydrophobicContact CD1-CZ3 4.01Å; F234-W252 HydrophobicContact CD2-CH2 4.11Å; F234-W252 AromaticContact CE1-CH2 3.37Å; F234-W252 HydrophobicContact CE1-CH2 3.37Å; F234-W252 HydrophobicContact CE1-CZ2 4.49Å; F234-W252 AromaticContact CE1-CZ3 3.57Å; F234-W252 HydrophobicContact CE1-CZ3 3.57Å; F234-W252 HydrophobicContact CE2-CH2 4.06Å; F234-W252 AromaticContact CG-CH2 3.8Å; F234-W252 HydrophobicContact CG-CH2 3.8Å; F234-W252 HydrophobicContact CG-CZ2 4.33Å; F234-W252 AromaticContact CZ-CH2 3.71Å; F234-W252 HydrophobicContact CZ-CH2 3.71Å; F234-W252 AromaticContact CZ-CZ3 3.98Å; F234-W252 HydrophobicContact CZ-CZ3 3.98Å; F234-W252 WeakPolarHBondContact O-CZ2 3.35Å; F234-L255 HydrophobicContact CD1-CD2 3.94Å; F234-L255 HydrophobicContact CE1-CD2 4.03Å; F234-K267 PolarHBondContact N-O 3.5Å; F234-I268 HydrophobicContact CB-CD1 3.87Å; F234-I268 HydrophobicContact CD1-CD1 4.22Å; F234-A269 PolarHBondContact O-N 2.95Å; F234-L291 HydrophobicContact CE2-CB 3.83Å; F234-L291 HydrophobicContact CZ-CB 3.93Å; F234-L291 HydrophobicContact CZ-CD1 4.42Å; F234-L292 WeakPolarHBondContact CD2-O 3.19Å; F234-L293 HydrophobicContact CB-CD1 4.35Å; F234-L293 HydrophobicContact CD2-CB 4.02Å; F234-L293 HydrophobicContact CD2-CD1 4.23Å; F234-L293 HydrophobicContact CD2-CG 4.46Å; F234-L293 HydrophobicContact CG-CD1 4.37Å; F234-H303 HydrophobicContact CE2-CB 4.15Å; F234-H303 HydrophobicContact CZ-CB 3.93Å; F234-L312 HydrophobicContact CE1-CD2 4.05Å; F234-L312 HydrophobicContact CZ-CD2 4.19Å; F234-F315 HydrophobicContact CD2-CE1 4.18Å; F234-F315 HydrophobicContact CE1-CD1 4.12Å; F234-F315 HydrophobicContact CE1-CE1 4.46Å; F234-F315 HydrophobicContact CE2-CD1 4.1Å; F234-F315 AromaticContact CE2-CE1 3.64Å; F234-F315 HydrophobicContact CE2-CE1 3.64Å; F234-F315 AromaticContact CZ-CD1 3.76Å; F234-F315 HydrophobicContact CZ-CD1 3.76Å; F234-F315 AromaticContact CZ-CE1 3.8Å; F234-F315 HydrophobicContact CZ-CE1 3.8Å; F234-V316 HydrophobicContact CB-CG2 4.39Å; F234-V316 HydrophobicContact CD1-CG2 3.58Å; F234-V316 HydrophobicContact CE1-CG2 4.07Å; F234-V316 HydrophobicContact CG-CG2 4.17Å
235	I	97.8	Very high	87	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127.8	-166	-50.1	-179.4	0	0	0	110.6	L219 F224 I228 T233 F237 A269 V271 L291 L292 F294	L219-I235 HydrophobicContact CD1-CD1 3.7Å; L219-I235 HydrophobicContact CD1-CG1 4.17Å; L219-I235 HydrophobicContact CD1-CG2 4.42Å; F224-I235 HydrophobicContact CD2-CD1 4.47Å; F224-I235 HydrophobicContact CE2-CD1 3.52Å; F224-I235 HydrophobicContact CZ-CD1 3.69Å; I228-I235 HydrophobicContact CG2-CD1 3.81Å; T233-I235 HydrophobicContact CG2-CD1 3.95Å; T233-I235 HydrophobicContact CG2-CG1 3.6Å; I235-F237 HydrophobicContact CB-CD2 4.34Å; I235-F237 HydrophobicContact CB-CE2 3.79Å; I235-F237 HydrophobicContact CB-CZ 4.41Å; I235-F237 HydrophobicContact CG2-CD2 3.96Å; I235-F237 HydrophobicContact CG2-CE1 4.5Å; I235-F237 HydrophobicContact CG2-CE2 3.57Å; I235-F237 HydrophobicContact CG2-CZ 3.89Å; I235-A269 WeakPolarHBondContact CA-O 3.33Å; I235-A269 HydrophobicContact CG1-CB 4.28Å; I235-V271 HydrophobicContact CG2-CB 4.42Å; I235-V271 HydrophobicContact CG2-CG2 3.74Å; I235-L291 WeakPolarHBondContact O-CA 3.35Å; I235-L292 PolarHBondContact N-O 2.95Å; I235-L292 PolarHBondContact O-N 2.65Å; I235-F294 HydrophobicContact CB-CE2 4.38Å; I235-F294 HydrophobicContact CD1-CD2 3.44Å; I235-F294 VanDerWaalsContact CD1-CD2 3.44Å; I235-F294 HydrophobicContact CD1-CE2 3.49Å; I235-F294 VanDerWaalsContact CD1-CE2 3.49Å; I235-F294 HydrophobicContact CD1-CG 4.3Å; I235-F294 HydrophobicContact CD1-CZ 4.39Å; I235-F294 HydrophobicContact CG1-CD2 3.9Å; I235-F294 HydrophobicContact CG1-CE2 4.09Å
236	K	97	Very high	86.7	Confident	8 Å²	8	46.6 Å²	46.6	4%	0.035	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	108.8	167.6	175.8	-168.4	70.5	-177	0	109.8	L248 W252 A269 E270 V271 P289 L291	K236-L248 HydrophobicContact CD-CD2 4.23Å; K236-L248 HydrophobicContact CG-CD2 4.47Å; K236-W252 HydrophobicContact CB-CD2 3.83Å; K236-W252 HydrophobicContact CB-CE3 4.33Å; K236-W252 HydrophobicContact CB-CG 4.35Å; K236-W252 HydrophobicContact CB-CH2 4.03Å; K236-W252 HydrophobicContact CB-CZ2 3.5Å; K236-W252 VanDerWaalsContact CB-CZ2 3.5Å; K236-W252 HydrophobicContact CB-CZ3 4.42Å; K236-W252 HydrophobicContact CD-CB 4.41Å; K236-W252 HydrophobicContact CD-CD2 4.12Å; K236-W252 HydrophobicContact CD-CG 3.97Å; K236-W252 HydrophobicContact CG-CD2 4.46Å; K236-W252 VanDerWaalsContact N-CZ2 3.31Å; K236-A269 PolarHBondContact N-O 3.4Å; K236-E270 HydrophobicContact CB-CB 4.35Å; K236-E270 WeakPolarHBondContact CE-OE2 3.42Å; K236-E270 IonicContact NZ-OE2 3.01Å; K236-E270 PolarHBondContact NZ-OE2 3.32Å; K236-E270 CarbonylContact O-C 3.58Å; K236-E270 VanDerWaalsContact O-CA 3.25Å; K236-E270 WeakPolarHBondContact O-CA 3.25Å; K236-V271 PolarHBondContact O-N 3.29Å; K236-P289 HydrophobicContact CG-CB 4.16Å; K236-L291 HydrophobicContact CB-CD2 3.79Å; K236-L291 HydrophobicContact CG-CD2 3.83Å
237	F	94.7	Very high	86.3	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	119.7	169.4	-67.6	-92.8	0	0	0	109.3	F224 I235 V271 I279 Y283 V285 P289 T290 L292 F294	F224-F237 HydrophobicContact CE2-CE1 4.3Å; F224-F237 AromaticContact CE2-CZ 3.95Å; F224-F237 HydrophobicContact CE2-CZ 3.95Å; F224-F237 HydrophobicContact CZ-CZ 4.07Å; I235-F237 HydrophobicContact CB-CD2 4.34Å; I235-F237 HydrophobicContact CB-CE2 3.79Å; I235-F237 HydrophobicContact CB-CZ 4.41Å; I235-F237 HydrophobicContact CG2-CD2 3.96Å; I235-F237 HydrophobicContact CG2-CE1 4.5Å; I235-F237 HydrophobicContact CG2-CE2 3.57Å; I235-F237 HydrophobicContact CG2-CZ 3.89Å; F237-V271 HydrophobicContact CD1-CB 3.7Å; F237-V271 HydrophobicContact CD1-CG1 3.92Å; F237-V271 HydrophobicContact CD1-CG2 4.19Å; F237-V271 HydrophobicContact CE1-CB 3.86Å; F237-V271 HydrophobicContact CE1-CG1 4.03Å; F237-V271 HydrophobicContact CE1-CG2 3.85Å; F237-V271 HydrophobicContact CG-CB 4.45Å; F237-V271 HydrophobicContact CZ-CG2 4.34Å; F237-I279 HydrophobicContact CE1-CG2 3.94Å; F237-Y283 HydrophobicContact CZ-CD2 4.35Å; F237-V285 HydrophobicContact CB-CG1 3.96Å; F237-V285 HydrophobicContact CB-CG2 3.96Å; F237-V285 HydrophobicContact CD1-CG2 3.79Å; F237-V285 HydrophobicContact CD2-CG2 4.2Å; F237-V285 HydrophobicContact CE1-CG2 4.32Å; F237-V285 HydrophobicContact CG-CG2 3.7Å; F237-P289 VanDerWaalsContact O-CA 3.29Å; F237-P289 WeakPolarHBondContact O-CA 3.42Å; F237-T290 PolarHBondContact N-O 3.31Å; F237-T290 PolarHBondContact O-N 3.42Å; F237-L292 HydrophobicContact CD2-CB 4.39Å; F237-L292 HydrophobicContact CD2-CD1 4.05Å; F237-L292 HydrophobicContact CD2-CG 4.01Å; F237-L292 HydrophobicContact CE2-CB 3.94Å; F237-L292 HydrophobicContact CE2-CD1 3.65Å; F237-L292 HydrophobicContact CE2-CG 3.87Å; F237-L292 HydrophobicContact CZ-CD1 4.3Å; F237-F294 HydrophobicContact CE2-CE2 4.14Å; F237-F294 HydrophobicContact CZ-CE2 4.33Å; F237-F294 HydrophobicContact CZ-CZ 4.39Å
238	Y	91.3	Very high	86.3	Confident	45 Å²	45	45 Å²	45	18%	0.176	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	177.1	-171.5	78.9	-75.2	0	0	0	113.2	P240 E270 V271 D272 C273	Y238-P240 HydrophobicContact CE2-CG 4.21Å; Y238-E270 HydrophobicContact CD1-CB 4.13Å; Y238-E270 HydrophobicContact CE1-CB 3.91Å; Y238-E270 HydrophobicContact CE1-CG 3.92Å; Y238-V271 WeakPolarHBondContact CD1-O 3.22Å; Y238-V271 PolarHBondContact N-O 2.65Å; Y238-D272 HydrophobicContact CE1-CB 4.06Å; Y238-C273 WeakPolarHBondContact O-CB 3.44Å; Y238-C273 PolarHBondContact O-N 2.62Å
239	A	78.3	Confident	86.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.253	C	S	.	.			trans	-130.6	140.7	164.8	0	0	0	0	0	108.8	W241 C242 T274 Y288	A239-W241 HydrophobicContact CB-CD2 3.98Å; A239-W241 HydrophobicContact CB-CE3 4.48Å; A239-W241 HydrophobicContact CB-CG 4.46Å; A239-W241 HydrophobicContact CB-CH2 4.2Å; A239-W241 HydrophobicContact CB-CZ2 3.67Å; A239-W241 PolarHBondContact O-N 2.95Å; A239-W241 VanDerWaalsContact O-N 3.13Å; A239-C242 HydrophobicContact CB-CB 4.19Å; A239-C242 VanDerWaalsContact O-CB 3.25Å; A239-C242 WeakPolarHBondContact O-CB 3.42Å; A239-C242 PolarHBondContact O-N 2.93Å; A239-T274 HydrophobicContact CB-CG2 3.6Å; A239-Y288 HydrophobicContact CB-CD2 3.77Å; A239-Y288 HydrophobicContact CB-CE2 3.88Å; A239-Y288 HydrophobicContact CB-CG 4.39Å
240	P	71.4	Confident	86.3	Confident	60 Å²	60	47 Å²	47	39%	0.39	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.5	-175.5	-27.6	34.3	0	0	0	113.8	Y238 K246 D272	Y238-P240 HydrophobicContact CE2-CG 4.21Å; P240-K246 WeakPolarHBondContact O-CE 3.45Å; P240-D272 VanDerWaalsContact CD-OD1 3.24Å; P240-D272 WeakPolarHBondContact CD-OD1 3.21Å; P240-D272 VanDerWaalsContact CD-OD2 3.31Å; P240-D272 WeakPolarHBondContact CD-OD2 3.35Å; P240-D272 WeakPolarHBondContact CG-OD2 3.5Å
241	W	70.1	Confident	86.7	Confident	154 Å²	154	41.2 Å²	41.2	58%	0.583	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-7.4	178.6	49.7	-102.7	0	0	0	113.9	A239 G243 Y288	A239-W241 HydrophobicContact CB-CD2 3.98Å; A239-W241 HydrophobicContact CB-CE3 4.48Å; A239-W241 HydrophobicContact CB-CG 4.46Å; A239-W241 HydrophobicContact CB-CH2 4.2Å; A239-W241 HydrophobicContact CB-CZ2 3.67Å; A239-W241 PolarHBondContact O-N 2.95Å; A239-W241 VanDerWaalsContact O-N 3.13Å; W241-G243 PolarHBondContact O-N 3.12Å; W241-Y288 HydrophobicContact CH2-CD2 4.17Å; W241-Y288 HydrophobicContact CH2-CE2 4.16Å; W241-Y288 HydrophobicContact CZ2-CE2 4.26Å
242	C	76.7	Confident	87.1	Confident	11 Å²	11	39.8 Å²	39.8	7%	0.074	21%	0.214	C	C	.	.			trans	-76.1	115.2	-176.1	157.1	0	0	0	0	111.8	A239 H244 C245 K246	A239-C242 HydrophobicContact CB-CB 4.19Å; A239-C242 VanDerWaalsContact O-CB 3.25Å; A239-C242 WeakPolarHBondContact O-CB 3.42Å; A239-C242 PolarHBondContact O-N 2.93Å; C242-H244 PolarHBondContact O-N 2.89Å; C242-C245 HydrophobicContact CB-CB 3.66Å; C242-C245 WeakPolarHBondContact CB-SG 3.34Å; C242-C245 WeakPolarHBondContact O-CA 3.07Å; C242-C245 VanDerWaalsContact O-CB 3.26Å; C242-C245 WeakPolarHBondContact O-CB 3.47Å; C242-C245 PolarHBondContact O-N 3.45Å; C242-C245 WeakPolarHBondContact SG-CB 2.99Å; C242-C245 PolarHBondContact SG-N 3.21Å; C242-C245 CovalentContact SG-SG 2.06Å; C242-C245 PolarHBondContact SG-SG 2.99Å; C242-K246 PolarHBondContact O-N 3.46Å
243	G	66.8	Low	87.1	Confident	45 Å²	45	44.4 Å²	44.4	46%	0.464	24%	0.236	S	C	.	.	H	α-helix	trans	-57.2	-47.8	179.7	0	0	0	0	0	114.1	W241 C245 K246 T247	W241-G243 PolarHBondContact O-N 3.12Å; G243-C245 PolarHBondContact O-N 3.31Å; G243-K246 WeakPolarHBondContact O-CB 3.42Å; G243-K246 PolarHBondContact O-N 3.3Å; G243-K246 VanDerWaalsContact O-N 3.14Å; G243-T247 PolarHBondContact O-N 3.24Å; G243-T247 PolarHBondContact O-OG1 3.49Å; G243-T247 VanDerWaalsContact O-OG1 3.11Å
244	H	74.6	Confident	87	Confident	134 Å²	134	49.3 Å²	49.3	62%	0.62	26%	0.258	S	S	*	.	H	α-helix	trans	-60.9	-27.6	176	-61.8	158.7	0	0	0	113.2	C242 L248	C242-H244 PolarHBondContact O-N 2.89Å; H244-L248 WeakPolarHBondContact O-CB 3.32Å; H244-L248 PolarHBondContact O-N 2.99Å; H244-L248 VanDerWaalsContact O-N 3.16Å
245	C	84.4	Confident	86.9	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.02	26%	0.258	C	S	.	.	H	α-helix	trans	-76.6	-41.3	178	-51.7	0	0	0	0	110.7	C242 G243 T247 L248 A249 Y288 P289	C242-C245 HydrophobicContact CB-CB 3.66Å; C242-C245 WeakPolarHBondContact CB-SG 3.34Å; C242-C245 WeakPolarHBondContact O-CA 3.07Å; C242-C245 VanDerWaalsContact O-CB 3.26Å; C242-C245 WeakPolarHBondContact O-CB 3.47Å; C242-C245 PolarHBondContact O-N 3.45Å; C242-C245 WeakPolarHBondContact SG-CB 2.99Å; C242-C245 PolarHBondContact SG-N 3.21Å; C242-C245 CovalentContact SG-SG 2.06Å; C242-C245 PolarHBondContact SG-SG 2.99Å; G243-C245 PolarHBondContact O-N 3.31Å; C245-T247 VanDerWaalsContact C-N 3.34Å; C245-L248 PolarHBondContact O-N 3.38Å; C245-A249 PolarHBondContact O-N 2.79Å; C245-Y288 WeakPolarHBondContact SG-CB 3.39Å; C245-P289 VanDerWaalsContact SG-CD 3.58Å; C245-P289 VanDerWaalsContact SG-N 3.45Å
246	K	86.1	Confident	86.7	Confident	134 Å²	134	50.7 Å²	50.7	58%	0.583	27%	0.268	S	S	*	.	H	α-helix	trans	-61.3	-41.9	172	-65.4	179.5	-177.3	-174.8	0	111.6	P240 C242 G243 L248 A249 P250	P240-K246 WeakPolarHBondContact O-CE 3.45Å; C242-K246 PolarHBondContact O-N 3.46Å; G243-K246 WeakPolarHBondContact O-CB 3.42Å; G243-K246 PolarHBondContact O-N 3.3Å; G243-K246 VanDerWaalsContact O-N 3.14Å; K246-L248 VanDerWaalsContact C-N 3.31Å; K246-L248 PolarHBondContact O-N 3.06Å; K246-A249 WeakPolarHBondContact O-CB 3.48Å; K246-A249 PolarHBondContact O-N 3.43Å; K246-P250 WeakPolarHBondContact O-CD 3.4Å
247	T	85.8	Confident	86.5	Confident	109 Å²	109	56.6 Å²	56.6	67%	0.669	29%	0.294	S	S	*	.	H	α-helix	trans	-63.9	-35.7	175.4	-52.9	0	0	0	0	112.4	G243 C245 P250	G243-T247 PolarHBondContact O-N 3.24Å; G243-T247 PolarHBondContact O-OG1 3.49Å; G243-T247 VanDerWaalsContact O-OG1 3.11Å; C245-T247 VanDerWaalsContact C-N 3.34Å; T247-P250 WeakPolarHBondContact O-CD 3.21Å
248	L	91.4	Very high	86.4	Confident	7 Å²	7	60.4 Å²	60.4	4%	0.037	31%	0.31	C	S	.	.	H	α-helix	trans	-79.5	-25.2	179.1	-177.4	59	0	0	0	113.4	K236 H244 C245 K246 T251 W252 P289 L291 R307 L312	K236-L248 HydrophobicContact CD-CD2 4.23Å; K236-L248 HydrophobicContact CG-CD2 4.47Å; H244-L248 WeakPolarHBondContact O-CB 3.32Å; H244-L248 PolarHBondContact O-N 2.99Å; H244-L248 VanDerWaalsContact O-N 3.16Å; C245-L248 PolarHBondContact O-N 3.38Å; K246-L248 VanDerWaalsContact C-N 3.31Å; K246-L248 PolarHBondContact O-N 3.06Å; L248-T251 PolarHBondContact O-N 3.22Å; L248-W252 HydrophobicContact CD2-CE3 4.39Å; L248-W252 HydrophobicContact CG-CE3 4.48Å; L248-W252 WeakPolarHBondContact O-CB 3.25Å; L248-W252 PolarHBondContact O-N 2.98Å; L248-P289 HydrophobicContact CD2-CB 4.05Å; L248-P289 HydrophobicContact CD2-CG 3.69Å; L248-L291 HydrophobicContact CD2-CD1 4.13Å; L248-L291 HydrophobicContact CD2-CD2 3.87Å; L248-R307 HydrophobicContact CD1-CB 4.05Å; L248-L312 HydrophobicContact CD1-CD1 4.15Å
249	A	91.3	Very high	86.3	Confident	25 Å²	25	66.1 Å²	66.1	21%	0.207	34%	0.339	C	S	.	.	H	α-helix	trans	-48.9	-51.6	-176.2	0	0	0	0	0	114.5	C245 K246 T251 W252 E253	C245-A249 PolarHBondContact O-N 2.79Å; K246-A249 WeakPolarHBondContact O-CB 3.48Å; K246-A249 PolarHBondContact O-N 3.43Å; A249-T251 PolarHBondContact O-N 2.8Å; A249-W252 WeakPolarHBondContact O-CB 3.36Å; A249-W252 PolarHBondContact O-N 3.46Å; A249-W252 VanDerWaalsContact O-N 3.09Å; A249-E253 PolarHBondContact O-N 3.04Å
250	P	94.2	Very high	86.9	Confident	68 Å²	68	67.2 Å²	67.2	44%	0.442	34%	0.344	S	S	.	.	H	α-helix	trans	-62	-43.8	-179.6	23.4	-34.1	0	0	0	112.4	K246 T247 W252 E253 E254	K246-P250 WeakPolarHBondContact O-CD 3.4Å; T247-P250 WeakPolarHBondContact O-CD 3.21Å; P250-W252 PolarHBondContact O-N 2.88Å; P250-E253 PolarHBondContact O-N 3.05Å; P250-E254 WeakPolarHBondContact O-CG 3.22Å; P250-E254 PolarHBondContact O-N 3.09Å
251	T	95.1	Very high	87.6	Confident	30 Å²	30	68.9 Å²	68.9	18%	0.184	36%	0.355	C	S	.	.	H	α-helix	trans	-62.3	-34.4	176.1	-47.8	0	0	0	0	112	L248 A249 E254 L255 L309 L312	L248-T251 PolarHBondContact O-N 3.22Å; A249-T251 PolarHBondContact O-N 2.8Å; T251-E254 PolarHBondContact O-N 3.01Å; T251-L255 WeakPolarHBondContact O-CB 3.32Å; T251-L255 PolarHBondContact O-N 2.7Å; T251-L309 HydrophobicContact CG2-CB 3.91Å; T251-L309 HydrophobicContact CG2-CD1 4.44Å; T251-L312 HydrophobicContact CG2-CD1 4.06Å
252	W	96.3	Very high	88.2	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-69.1	-39.7	178.5	-158.5	-103.7	0	0	0	112.1	F234 K236 L248 A249 P250 L255 S256 I268 A269 L291 L312	F234-W252 AromaticContact CD1-CH2 3.42Å; F234-W252 HydrophobicContact CD1-CH2 3.42Å; F234-W252 VanDerWaalsContact CD1-CH2 3.42Å; F234-W252 HydrophobicContact CD1-CZ2 4.16Å; F234-W252 HydrophobicContact CD1-CZ3 4.01Å; F234-W252 HydrophobicContact CD2-CH2 4.11Å; F234-W252 AromaticContact CE1-CH2 3.37Å; F234-W252 HydrophobicContact CE1-CH2 3.37Å; F234-W252 HydrophobicContact CE1-CZ2 4.49Å; F234-W252 AromaticContact CE1-CZ3 3.57Å; F234-W252 HydrophobicContact CE1-CZ3 3.57Å; F234-W252 HydrophobicContact CE2-CH2 4.06Å; F234-W252 AromaticContact CG-CH2 3.8Å; F234-W252 HydrophobicContact CG-CH2 3.8Å; F234-W252 HydrophobicContact CG-CZ2 4.33Å; F234-W252 AromaticContact CZ-CH2 3.71Å; F234-W252 HydrophobicContact CZ-CH2 3.71Å; F234-W252 AromaticContact CZ-CZ3 3.98Å; F234-W252 HydrophobicContact CZ-CZ3 3.98Å; F234-W252 WeakPolarHBondContact O-CZ2 3.35Å; K236-W252 HydrophobicContact CB-CD2 3.83Å; K236-W252 HydrophobicContact CB-CE3 4.33Å; K236-W252 HydrophobicContact CB-CG 4.35Å; K236-W252 HydrophobicContact CB-CH2 4.03Å; K236-W252 HydrophobicContact CB-CZ2 3.5Å; K236-W252 VanDerWaalsContact CB-CZ2 3.5Å; K236-W252 HydrophobicContact CB-CZ3 4.42Å; K236-W252 HydrophobicContact CD-CB 4.41Å; K236-W252 HydrophobicContact CD-CD2 4.12Å; K236-W252 HydrophobicContact CD-CG 3.97Å; K236-W252 HydrophobicContact CG-CD2 4.46Å; K236-W252 VanDerWaalsContact N-CZ2 3.31Å; L248-W252 HydrophobicContact CD2-CE3 4.39Å; L248-W252 HydrophobicContact CG-CE3 4.48Å; L248-W252 WeakPolarHBondContact O-CB 3.25Å; L248-W252 PolarHBondContact O-N 2.98Å; A249-W252 WeakPolarHBondContact O-CB 3.36Å; A249-W252 PolarHBondContact O-N 3.46Å; A249-W252 VanDerWaalsContact O-N 3.09Å; P250-W252 PolarHBondContact O-N 2.88Å; W252-L255 HydrophobicContact CE3-CD2 4.22Å; W252-L255 HydrophobicContact CZ3-CD2 4.15Å; W252-L255 PolarHBondContact O-N 3.4Å; W252-S256 PolarHBondContact O-N 2.88Å; W252-I268 HydrophobicContact CD2-CG2 4.26Å; W252-I268 HydrophobicContact CG-CG2 4.45Å; W252-I268 HydrophobicContact CZ2-CG2 4Å; W252-A269 PolarHBondContact NE1-O 3.44Å; W252-L291 HydrophobicContact CE3-CD2 4.36Å; W252-L291 HydrophobicContact CH2-CD2 3.87Å; W252-L291 HydrophobicContact CZ3-CD1 4.06Å; W252-L291 HydrophobicContact CZ3-CD2 3.71Å; W252-L291 HydrophobicContact CZ3-CG 4.38Å; W252-L312 HydrophobicContact CE3-CD1 4.2Å; W252-L312 HydrophobicContact CZ3-CD1 4.31Å; W252-L312 HydrophobicContact CZ3-CD2 4.35Å
253	E	93.6	Very high	88.4	Confident	99 Å²	99	65 Å²	65	46%	0.463	36%	0.359	S	S	.	.	H	α-helix	trans	-67.7	-34.5	172.4	-69.1	174.1	-164.4	0	0	112.7	V216 A249 P250 S256 K257	V216-E253 HydrophobicContact CG2-CB 4.38Å; V216-E253 HydrophobicContact CG2-CG 3.89Å; A249-E253 PolarHBondContact O-N 3.04Å; P250-E253 PolarHBondContact O-N 3.05Å; E253-S256 PolarHBondContact O-OG 3.3Å; E253-K257 WeakPolarHBondContact O-CG 3.48Å
254	E	93.1	Very high	89	Confident	103 Å²	103	66.5 Å²	66.5	48%	0.481	37%	0.368	S	S	.	.	H	α-helix	trans	-68.9	-39.2	172.5	-73.4	-179.2	-175.1	0	0	111.4	P250 T251 S256 K257 K258 L309	P250-E254 WeakPolarHBondContact O-CG 3.22Å; P250-E254 PolarHBondContact O-N 3.09Å; T251-E254 PolarHBondContact O-N 3.01Å; E254-S256 VanDerWaalsContact C-N 3.33Å; E254-S256 PolarHBondContact O-N 3.07Å; E254-K257 PolarHBondContact O-N 3.38Å; E254-K257 VanDerWaalsContact O-N 3.14Å; E254-K258 PolarHBondContact O-N 3.23Å; E254-L309 HydrophobicContact CB-CD1 3.95Å; E254-L309 HydrophobicContact CB-CD2 4.15Å; E254-L309 WeakPolarHBondContact OE2-CD2 3.48Å
255	L	94.5	Very high	89.4	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-63	-38.6	176.3	-176.5	68.4	0	0	0	111.7	F234 T251 W252 K257 K258 F260 I268 L309 L312 H313	F234-L255 HydrophobicContact CD1-CD2 3.94Å; F234-L255 HydrophobicContact CE1-CD2 4.03Å; T251-L255 WeakPolarHBondContact O-CB 3.32Å; T251-L255 PolarHBondContact O-N 2.7Å; W252-L255 HydrophobicContact CE3-CD2 4.22Å; W252-L255 HydrophobicContact CZ3-CD2 4.15Å; W252-L255 PolarHBondContact O-N 3.4Å; L255-K257 PolarHBondContact O-N 3.01Å; L255-K257 VanDerWaalsContact O-N 3.13Å; L255-K258 WeakPolarHBondContact O-CB 3.35Å; L255-K258 PolarHBondContact O-N 3.24Å; L255-F260 HydrophobicContact CD1-CE1 4.21Å; L255-F260 HydrophobicContact CD1-CZ 3.92Å; L255-F260 HydrophobicContact CG-CZ 4.28Å; L255-I268 HydrophobicContact CD2-CD1 4.1Å; L255-I268 HydrophobicContact CD2-CG2 4.42Å; L255-I268 HydrophobicContact CG-CD1 4.15Å; L255-I268 HydrophobicContact CG-CG1 4.27Å; L255-L309 HydrophobicContact CB-CD1 3.92Å; L255-L309 HydrophobicContact CD1-CD1 4.25Å; L255-L312 HydrophobicContact CD1-CB 4.09Å; L255-L312 HydrophobicContact CD2-CB 3.79Å; L255-L312 HydrophobicContact CD2-CD1 4.26Å; L255-H313 HydrophobicContact CD1-CB 4.05Å
256	S	93.5	Very high	89.7	Confident	30 Å²	30	63.8 Å²	63.8	21%	0.21	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-14.3	176.8	67.1	0	0	0	0	113.8	W252 E253 E254	W252-S256 PolarHBondContact O-N 2.88Å; E253-S256 PolarHBondContact O-OG 3.3Å; E254-S256 VanDerWaalsContact C-N 3.33Å; E254-S256 PolarHBondContact O-N 3.07Å
257	K	93.5	Very high	90.1	Very high	131 Å²	131	60.6 Å²	60.6	57%	0.57	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-3.3	176.8	-62.5	167.3	-172.4	168.5	0	112.9	G214 E253 E254 L255	G214-K257 VanDerWaalsContact O-CE 3.25Å; G214-K257 WeakPolarHBondContact O-CE 3.26Å; E253-K257 WeakPolarHBondContact O-CG 3.48Å; E254-K257 PolarHBondContact O-N 3.38Å; E254-K257 VanDerWaalsContact O-N 3.14Å; L255-K257 PolarHBondContact O-N 3.01Å; L255-K257 VanDerWaalsContact O-N 3.13Å
258	K	92	Very high	90.6	Very high	80 Å²	80	56 Å²	56	35%	0.348	33%	0.327	S	S	.	.	S	Bend	trans	-78.3	149.4	179.3	-71.7	-74.4	-178.7	171.7	0	111.5	E254 L255 F260 L309	E254-K258 PolarHBondContact O-N 3.23Å; L255-K258 WeakPolarHBondContact O-CB 3.35Å; L255-K258 PolarHBondContact O-N 3.24Å; K258-F260 HydrophobicContact CB-CE2 4.28Å; K258-F260 HydrophobicContact CB-CZ 4.08Å; K258-F260 WeakPolarHBondContact O-CD2 3.47Å; K258-F260 WeakPolarHBondContact O-CE2 3.46Å; K258-L309 HydrophobicContact CG-CD1 4.21Å
259	E	90.1	Very high	90.9	Very high	165 Å²	165	55.7 Å²	55.7	77%	0.771	33%	0.325	S	S	*	.			trans	-85.3	142.6	169.7	-63.2	-172.5	158.4	0	0	110.7	P261 H313	E259-P261 VanDerWaalsContact C-CD 3.5Å; E259-P261 WeakPolarHBondContact O-CD 3.37Å; E259-H313 PolarHBondContact O-NE2 3.34Å
260	F	90.7	Very high	91.1	Very high	23 Å²	23	56.3 Å²	56.3	10%	0.101	32%	0.324	C	S	.	.			trans	-121.1	73.7	179.5	-58.8	-84.2	0	0	0	110	L255 K258 G262 L263 V266 I268 H313 V316 L317	L255-F260 HydrophobicContact CD1-CE1 4.21Å; L255-F260 HydrophobicContact CD1-CZ 3.92Å; L255-F260 HydrophobicContact CG-CZ 4.28Å; K258-F260 HydrophobicContact CB-CE2 4.28Å; K258-F260 HydrophobicContact CB-CZ 4.08Å; K258-F260 WeakPolarHBondContact O-CD2 3.47Å; K258-F260 WeakPolarHBondContact O-CE2 3.46Å; F260-G262 PolarHBondContact O-N 2.95Å; F260-L263 HydrophobicContact CB-CB 4.36Å; F260-L263 HydrophobicContact CB-CD1 4.46Å; F260-L263 PolarHBondContact O-N 3.29Å; F260-V266 HydrophobicContact CB-CB 4.21Å; F260-V266 HydrophobicContact CB-CG2 3.75Å; F260-V266 HydrophobicContact CD1-CG1 4.38Å; F260-V266 HydrophobicContact CD2-CB 3.77Å; F260-V266 HydrophobicContact CD2-CG1 3.55Å; F260-V266 HydrophobicContact CD2-CG2 4.24Å; F260-V266 HydrophobicContact CE2-CB 4.39Å; F260-V266 HydrophobicContact CE2-CG1 3.73Å; F260-V266 HydrophobicContact CG-CB 4.08Å; F260-V266 HydrophobicContact CG-CG1 3.9Å; F260-V266 HydrophobicContact CG-CG2 4.04Å; F260-V266 HydrophobicContact CZ-CG1 4.22Å; F260-I268 HydrophobicContact CE2-CD1 4.35Å; F260-I268 HydrophobicContact CE2-CG1 4.32Å; F260-I268 HydrophobicContact CZ-CD1 4.03Å; F260-I268 HydrophobicContact CZ-CG1 4.31Å; F260-H313 AromaticContact CD1-CD2 3.76Å; F260-H313 AromaticContact CE1-CD2 3.42Å; F260-H313 VanDerWaalsContact CE1-CD2 3.42Å; F260-H313 WeakPolarHBondContact CE1-CD2 3.39Å; F260-V316 HydrophobicContact CD1-CB 3.84Å; F260-V316 HydrophobicContact CD1-CG1 3.47Å; F260-V316 VanDerWaalsContact CD1-CG1 3.47Å; F260-V316 HydrophobicContact CE1-CB 3.58Å; F260-V316 HydrophobicContact CE1-CG1 3.55Å; F260-V316 HydrophobicContact CE1-CG2 4.05Å; F260-V316 HydrophobicContact CG-CG1 4.21Å; F260-V316 HydrophobicContact CZ-CG1 4.36Å; F260-L317 HydrophobicContact CB-CD2 4.29Å; F260-L317 HydrophobicContact CD1-CD2 4.4Å; F260-L317 HydrophobicContact CD1-CG 4.47Å
261	P	86.5	Confident	91.1	Very high	96 Å²	96	53.1 Å²	53.1	62%	0.623	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	137.3	-178.7	24.4	-35.3	0	0	0	111.4	E259 L263 L317	E259-P261 VanDerWaalsContact C-CD 3.5Å; E259-P261 WeakPolarHBondContact O-CD 3.37Å; P261-L263 VanDerWaalsContact C-N 3.32Å; P261-L317 HydrophobicContact CG-CD2 4.36Å
262	G	81.4	Confident	90.8	Very high	64 Å²	64	53.2 Å²	53.2	66%	0.66	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	4.5	-178.6	0	0	0	0	0	114.9	F260	F260-G262 PolarHBondContact O-N 2.95Å
263	L	81.6	Confident	90	Very high	18 Å²	18	53.5 Å²	53.5	9%	0.094	31%	0.305	C	S	.	.			trans	-123.1	126.3	172.9	-68.7	175.1	0	0	0	110.3	I232 F260 P261 V266 V316 A320	I232-L263 HydrophobicContact CD1-CB 4.39Å; I232-L263 HydrophobicContact CD1-CD1 4.05Å; I232-L263 HydrophobicContact CD1-CD2 3.53Å; I232-L263 HydrophobicContact CD1-CG 4.2Å; F260-L263 HydrophobicContact CB-CB 4.36Å; F260-L263 HydrophobicContact CB-CD1 4.46Å; F260-L263 PolarHBondContact O-N 3.29Å; P261-L263 VanDerWaalsContact C-N 3.32Å; L263-V266 HydrophobicContact CB-CG2 3.5Å; L263-V266 HydrophobicContact CD1-CG2 4.07Å; L263-V266 HydrophobicContact CG-CG2 4.42Å; L263-V316 HydrophobicContact CD1-CG1 4.08Å; L263-V316 WeakPolarHBondContact CD1-O 3.49Å; L263-A320 HydrophobicContact CD1-CB 4.38Å; L263-A320 VanDerWaalsContact CD2-CA 3.42Å; L263-A320 HydrophobicContact CD2-CB 3.52Å; L263-A320 HydrophobicContact CG-CB 3.81Å
264	A	78.8	Confident	89	Confident	78 Å²	78	51.1 Å²	51.1	65%	0.645	30%	0.297	S	S	*	.	S	Bend	trans	-85.3	133.3	175.3	0	0	0	0	0	111.1
265	G	82.8	Confident	88.2	Confident	47 Å²	47	49.2 Å²	49.2	49%	0.485	30%	0.299	S	S	.	.	S	Bend	trans	65.1	42.5	168.4	0	0	0	0	0	115	I232 K267	I232-G265 PolarHBondContact N-O 3.02Å; G265-K267 PolarHBondContact O-N 3.28Å
266	V	91.8	Very high	87.6	Confident	33 Å²	33	51 Å²	51	20%	0.2	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	123.5	173.6	-178.5	0	0	0	0	110.4	I232 F260 L263 I268 V316	I232-V266 HydrophobicContact CB-CG2 4.31Å; I232-V266 CarbonylContact O-C 3.41Å; I232-V266 VanDerWaalsContact O-CA 3.3Å; I232-V266 WeakPolarHBondContact O-CA 3.33Å; F260-V266 HydrophobicContact CB-CB 4.21Å; F260-V266 HydrophobicContact CB-CG2 3.75Å; F260-V266 HydrophobicContact CD1-CG1 4.38Å; F260-V266 HydrophobicContact CD2-CB 3.77Å; F260-V266 HydrophobicContact CD2-CG1 3.55Å; F260-V266 HydrophobicContact CD2-CG2 4.24Å; F260-V266 HydrophobicContact CE2-CB 4.39Å; F260-V266 HydrophobicContact CE2-CG1 3.73Å; F260-V266 HydrophobicContact CG-CB 4.08Å; F260-V266 HydrophobicContact CG-CG1 3.9Å; F260-V266 HydrophobicContact CG-CG2 4.04Å; F260-V266 HydrophobicContact CZ-CG1 4.22Å; L263-V266 HydrophobicContact CB-CG2 3.5Å; L263-V266 HydrophobicContact CD1-CG2 4.07Å; L263-V266 HydrophobicContact CG-CG2 4.42Å; V266-I268 HydrophobicContact CG1-CD1 4.18Å; V266-V316 HydrophobicContact CG1-CG1 3.83Å; V266-V316 HydrophobicContact CG2-CG1 4.42Å
267	K	94.5	Very high	86.6	Confident	67 Å²	67	57.7 Å²	57.7	29%	0.291	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	130.2	176.3	-57.9	173	-163.2	166.8	0	109.2	T227 I232 T233 F234 G265	T227-K267 HydrophobicContact CG2-CD 3.77Å; T227-K267 PolarHBondContact O-NZ 3.19Å; I232-K267 PolarHBondContact O-N 2.99Å; T233-K267 CarbonylContact C-O 3.49Å; T233-K267 WeakPolarHBondContact CA-O 3.49Å; T233-K267 HydrophobicContact CG2-CB 4.12Å; F234-K267 PolarHBondContact N-O 3.5Å; G265-K267 PolarHBondContact O-N 3.28Å
268	I	96.3	Very high	85.9	Confident	12 Å²	12	56.6 Å²	56.6	6%	0.062	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	120.4	171.8	-55.2	-55.4	0	0	0	107.8	L217 F234 W252 L255 F260 V266	L217-I268 PolarHBondContact N-O 2.95Å; L217-I268 VanDerWaalsContact N-O 3.12Å; F234-I268 HydrophobicContact CB-CD1 3.87Å; F234-I268 HydrophobicContact CD1-CD1 4.22Å; W252-I268 HydrophobicContact CD2-CG2 4.26Å; W252-I268 HydrophobicContact CG-CG2 4.45Å; W252-I268 HydrophobicContact CZ2-CG2 4Å; L255-I268 HydrophobicContact CD2-CD1 4.1Å; L255-I268 HydrophobicContact CD2-CG2 4.42Å; L255-I268 HydrophobicContact CG-CD1 4.15Å; L255-I268 HydrophobicContact CG-CG1 4.27Å; F260-I268 HydrophobicContact CE2-CD1 4.35Å; F260-I268 HydrophobicContact CE2-CG1 4.32Å; F260-I268 HydrophobicContact CZ-CD1 4.03Å; F260-I268 HydrophobicContact CZ-CG1 4.31Å; V266-I268 HydrophobicContact CG1-CD1 4.18Å
269	A	96.7	Very high	85.6	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	169.4	-167.5	0	0	0	0	0	112.4	L217 L219 T233 F234 I235 K236 W252	L217-A269 HydrophobicContact CB-CB 4.04Å; L217-A269 CarbonylContact O-C 3.6Å; L217-A269 WeakPolarHBondContact O-CA 3.06Å; L217-A269 VanDerWaalsContact O-CB 3.27Å; L217-A269 WeakPolarHBondContact O-CB 3.19Å; L219-A269 HydrophobicContact CD1-CB 3.67Å; L219-A269 HydrophobicContact CD2-CB 4.5Å; L219-A269 HydrophobicContact CG-CB 3.92Å; T233-A269 HydrophobicContact CG2-CB 3.96Å; F234-A269 PolarHBondContact O-N 2.95Å; I235-A269 WeakPolarHBondContact CA-O 3.33Å; I235-A269 HydrophobicContact CG1-CB 4.28Å; K236-A269 PolarHBondContact N-O 3.4Å; W252-A269 PolarHBondContact NE1-O 3.44Å
270	E	96.8	Very high	85.1	Confident	39 Å²	39	45.6 Å²	45.6	18%	0.182	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	153.6	176.8	66.1	-175.5	-164.1	0	0	112.6	V216 L217 L219 K236 Y238	V216-E270 HydrophobicContact CG1-CB 3.93Å; V216-E270 HydrophobicContact CG1-CG 3.7Å; L217-E270 PolarHBondContact O-N 3.22Å; L219-E270 PolarHBondContact N-O 2.85Å; K236-E270 HydrophobicContact CB-CB 4.35Å; K236-E270 WeakPolarHBondContact CE-OE2 3.42Å; K236-E270 IonicContact NZ-OE2 3.01Å; K236-E270 PolarHBondContact NZ-OE2 3.32Å; K236-E270 CarbonylContact O-C 3.58Å; K236-E270 VanDerWaalsContact O-CA 3.25Å; K236-E270 WeakPolarHBondContact O-CA 3.25Å; Y238-E270 HydrophobicContact CD1-CB 4.13Å; Y238-E270 HydrophobicContact CE1-CB 3.91Å; Y238-E270 HydrophobicContact CE1-CG 3.92Å
271	V	93.3	Very high	84.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	123.1	176.3	174.6	0	0	0	0	108.4	L219 F224 I235 K236 F237 Y238 C273 E276 I279	L219-V271 HydrophobicContact CB-CG2 3.77Å; L219-V271 HydrophobicContact CD1-CG2 4.42Å; F224-V271 HydrophobicContact CD2-CG2 3.92Å; F224-V271 HydrophobicContact CE2-CG2 3.8Å; I235-V271 HydrophobicContact CG2-CB 4.42Å; I235-V271 HydrophobicContact CG2-CG2 3.74Å; K236-V271 PolarHBondContact O-N 3.29Å; F237-V271 HydrophobicContact CD1-CB 3.7Å; F237-V271 HydrophobicContact CD1-CG1 3.92Å; F237-V271 HydrophobicContact CD1-CG2 4.19Å; F237-V271 HydrophobicContact CE1-CB 3.86Å; F237-V271 HydrophobicContact CE1-CG1 4.03Å; F237-V271 HydrophobicContact CE1-CG2 3.85Å; F237-V271 HydrophobicContact CG-CB 4.45Å; F237-V271 HydrophobicContact CZ-CG2 4.34Å; Y238-V271 WeakPolarHBondContact CD1-O 3.22Å; Y238-V271 PolarHBondContact N-O 2.65Å; V271-C273 PolarHBondContact O-N 2.95Å; V271-E276 HydrophobicContact CG1-CB 3.84Å; V271-E276 HydrophobicContact CG1-CG 4.37Å; V271-I279 HydrophobicContact CG1-CB 4.47Å; V271-I279 HydrophobicContact CG1-CD1 4.46Å; V271-I279 HydrophobicContact CG1-CG2 4.49Å
272	D	89.9	Confident	84.3	Confident	33 Å²	33	49.7 Å²	49.7	18%	0.176	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	104.6	169.7	-176.5	-14	0	0	0	109.8	Y238 P240 T274 A275 E276	Y238-D272 HydrophobicContact CE1-CB 4.06Å; P240-D272 VanDerWaalsContact CD-OD1 3.24Å; P240-D272 WeakPolarHBondContact CD-OD1 3.21Å; P240-D272 VanDerWaalsContact CD-OD2 3.31Å; P240-D272 WeakPolarHBondContact CD-OD2 3.35Å; P240-D272 WeakPolarHBondContact CG-OD2 3.5Å; D272-T274 VanDerWaalsContact CG-OG1 3.28Å; D272-T274 PolarHBondContact O-N 3.32Å; D272-T274 WeakPolarHBondContact OD1-CA 3.29Å; D272-T274 VanDerWaalsContact OD1-CB 3.27Å; D272-T274 WeakPolarHBondContact OD1-CB 3.3Å; D272-T274 PolarHBondContact OD1-N 3.47Å; D272-T274 PolarHBondContact OD1-OG1 2.69Å; D272-T274 PolarHBondContact OD2-OG1 3.41Å; D272-A275 HydrophobicContact CB-CB 4.45Å; D272-A275 PolarHBondContact O-N 3.22Å; D272-E276 WeakPolarHBondContact O-CB 3.29Å; D272-E276 PolarHBondContact O-N 3.46Å
273	C	79	Confident	84.3	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.034	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-7.1	179.9	-66.4	0	0	0	0	114.7	Y238 V271 R277 C280 Y288	Y238-C273 WeakPolarHBondContact O-CB 3.44Å; Y238-C273 PolarHBondContact O-N 2.62Å; V271-C273 PolarHBondContact O-N 2.95Å; C273-R277 WeakPolarHBondContact O-CG 3.44Å; C273-C280 WeakPolarHBondContact CA-SG 3.3Å; C273-C280 HydrophobicContact CB-CB 3.7Å; C273-C280 WeakPolarHBondContact CB-SG 3.48Å; C273-C280 WeakPolarHBondContact SG-CB 3.33Å; C273-C280 CovalentContact SG-SG 2.02Å; C273-C280 PolarHBondContact SG-SG 2.72Å; C273-Y288 HydrophobicContact CB-CE1 3.49Å; C273-Y288 VanDerWaalsContact CB-CE1 3.49Å; C273-Y288 VanDerWaalsContact CB-OH 3.29Å; C273-Y288 WeakPolarHBondContact CB-OH 3.41Å; C273-Y288 VanDerWaalsContact SG-CE1 3.56Å
274	T	71.4	Confident	84.4	Confident	49 Å²	49	51.1 Å²	51.1	30%	0.301	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-32.5	172.9	72.1	0	0	0	0	111.8	A239 D272 R277	A239-T274 HydrophobicContact CB-CG2 3.6Å; D272-T274 VanDerWaalsContact CG-OG1 3.28Å; D272-T274 PolarHBondContact O-N 3.32Å; D272-T274 WeakPolarHBondContact OD1-CA 3.29Å; D272-T274 VanDerWaalsContact OD1-CB 3.27Å; D272-T274 WeakPolarHBondContact OD1-CB 3.3Å; D272-T274 PolarHBondContact OD1-N 3.47Å; D272-T274 PolarHBondContact OD1-OG1 2.69Å; D272-T274 PolarHBondContact OD2-OG1 3.41Å; T274-R277 PolarHBondContact O-NE 3.43Å
275	A	76.3	Confident	84.2	Confident	64 Å²	64	48.3 Å²	48.3	53%	0.529	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-53.2	173.4	0	0	0	0	0	111.4	D272 R277	D272-A275 HydrophobicContact CB-CB 4.45Å; D272-A275 PolarHBondContact O-N 3.22Å; A275-R277 PolarHBondContact O-N 3.05Å
276	E	83.4	Confident	83.6	Confident	36 Å²	36	56.2 Å²	56.2	17%	0.168	28%	0.284	C	S	.	.			trans	-96.2	56	-170.7	-52.9	-58.9	138.3	0	0	112.3	E221 V271 D272 N278 I279 C280	E221-E276 WeakPolarHBondContact CG-OE2 3.39Å; E221-E276 PolarHBondContact N-OE2 3.36Å; V271-E276 HydrophobicContact CG1-CB 3.84Å; V271-E276 HydrophobicContact CG1-CG 4.37Å; D272-E276 WeakPolarHBondContact O-CB 3.29Å; D272-E276 PolarHBondContact O-N 3.46Å; E276-N278 VanDerWaalsContact C-N 3.28Å; E276-N278 PolarHBondContact O-N 3.46Å; E276-I279 HydrophobicContact CB-CD1 3.87Å; E276-I279 HydrophobicContact CB-CG1 4.2Å; E276-I279 HydrophobicContact CG-CD1 4.37Å; E276-I279 PolarHBondContact O-N 3.17Å; E276-C280 PolarHBondContact O-N 2.91Å
277	R	72.1	Confident	82.2	Confident	171 Å²	171	56.2 Å²	56.2	65%	0.645	29%	0.29	S	S	*	.	H	α-helix	trans	-61	-32.8	-170.6	-65.6	-179.2	-175.1	-174.6	2	113.8	C273 T274 A275 S281	C273-R277 WeakPolarHBondContact O-CG 3.44Å; T274-R277 PolarHBondContact O-NE 3.43Å; A275-R277 PolarHBondContact O-N 3.05Å; R277-S281 WeakPolarHBondContact O-CB 3.09Å; R277-S281 PolarHBondContact O-N 2.9Å; R277-S281 PolarHBondContact O-OG 2.77Å
278	N	78.5	Confident	81.5	Confident	109 Å²	109	56.5 Å²	56.5	58%	0.583	29%	0.29	S	S	*	.	H	α-helix	trans	-70.1	-41.7	-177.4	-61	-45	0	0	0	111.2	E221 E276 C280 S281 K282	E221-N278 VanDerWaalsContact OE1-CB 3.27Å; E221-N278 WeakPolarHBondContact OE1-CB 3.31Å; E221-N278 PolarHBondContact OE1-ND2 3.07Å; E276-N278 VanDerWaalsContact C-N 3.28Å; E276-N278 PolarHBondContact O-N 3.46Å; N278-C280 PolarHBondContact O-N 3.39Å; N278-S281 PolarHBondContact O-N 3.27Å; N278-K282 WeakPolarHBondContact O-CB 2.82Å; N278-K282 PolarHBondContact O-N 3.26Å
279	I	86.1	Confident	81.2	Confident	9 Å²	9	56 Å²	56	5%	0.046	29%	0.288	C	S	.	.	H	α-helix	trans	-59.3	-49.4	176.3	-50.1	-177.9	0	0	0	109.8	E221 F224 F237 V271 E276 S281 K282 Y283	E221-I279 HydrophobicContact CG-CD1 3.99Å; E221-I279 HydrophobicContact CG-CG1 3.77Å; F224-I279 HydrophobicContact CB-CD1 3.97Å; F224-I279 HydrophobicContact CD1-CG2 4.22Å; F224-I279 HydrophobicContact CD2-CD1 3.94Å; F224-I279 HydrophobicContact CD2-CG2 3.58Å; F224-I279 HydrophobicContact CE1-CG2 4.14Å; F224-I279 HydrophobicContact CE2-CG2 3.48Å; F224-I279 VanDerWaalsContact CE2-CG2 3.48Å; F224-I279 HydrophobicContact CG-CD1 4.08Å; F224-I279 HydrophobicContact CG-CG2 3.98Å; F224-I279 HydrophobicContact CZ-CG2 3.78Å; F237-I279 HydrophobicContact CE1-CG2 3.94Å; V271-I279 HydrophobicContact CG1-CB 4.47Å; V271-I279 HydrophobicContact CG1-CD1 4.46Å; V271-I279 HydrophobicContact CG1-CG2 4.49Å; E276-I279 HydrophobicContact CB-CD1 3.87Å; E276-I279 HydrophobicContact CB-CG1 4.2Å; E276-I279 HydrophobicContact CG-CD1 4.37Å; E276-I279 PolarHBondContact O-N 3.17Å; I279-S281 VanDerWaalsContact C-N 3.31Å; I279-S281 PolarHBondContact O-N 3.22Å; I279-K282 WeakPolarHBondContact O-CB 3.24Å; I279-K282 PolarHBondContact O-N 3.18Å; I279-Y283 HydrophobicContact CG2-CD2 4.07Å; I279-Y283 HydrophobicContact CG2-CE2 4.11Å; I279-Y283 VanDerWaalsContact O-CD2 3.26Å; I279-Y283 WeakPolarHBondContact O-CD2 3.3Å; I279-Y283 PolarHBondContact O-N 2.81Å
280	C	79.1	Confident	80.8	Confident	5 Å²	5	57 Å²	57	3%	0.034	29%	0.294	C	S	.	.	H	α-helix	trans	-64.9	-35.8	-178.7	-59.3	0	0	0	0	112.7	C273 E276 N278 S284 V285	C273-C280 WeakPolarHBondContact CA-SG 3.3Å; C273-C280 HydrophobicContact CB-CB 3.7Å; C273-C280 WeakPolarHBondContact CB-SG 3.48Å; C273-C280 WeakPolarHBondContact SG-CB 3.33Å; C273-C280 CovalentContact SG-SG 2.02Å; C273-C280 PolarHBondContact SG-SG 2.72Å; E276-C280 PolarHBondContact O-N 2.91Å; N278-C280 PolarHBondContact O-N 3.39Å; C280-S284 PolarHBondContact O-N 3.23Å; C280-V285 HydrophobicContact CB-CB 4.11Å; C280-V285 HydrophobicContact CB-CG2 4.34Å; C280-V285 WeakPolarHBondContact O-CB 3.34Å; C280-V285 PolarHBondContact O-N 3.4Å
281	S	74.6	Confident	80.8	Confident	85 Å²	85	55.1 Å²	55.1	59%	0.594	29%	0.285	S	S	*	.	H	α-helix	trans	-68.7	-44.1	174.2	-58	0	0	0	0	111.9	R277 N278 I279 Y283 S284	R277-S281 WeakPolarHBondContact O-CB 3.09Å; R277-S281 PolarHBondContact O-N 2.9Å; R277-S281 PolarHBondContact O-OG 2.77Å; N278-S281 PolarHBondContact O-N 3.27Å; I279-S281 VanDerWaalsContact C-N 3.31Å; I279-S281 PolarHBondContact O-N 3.22Å; S281-Y283 PolarHBondContact O-N 2.89Å; S281-S284 PolarHBondContact O-N 2.93Å
282	K	86.1	Confident	80.8	Confident	120 Å²	120	55.2 Å²	55.2	52%	0.522	29%	0.285	S	S	.	.	H	α-helix	trans	-52.9	-42	176.9	179.4	-177.7	178.2	-173.8	0	111.4	D225 N278 I279	D225-K282 IonicContact OD1-NZ 3.64Å; D225-K282 PolarHBondContact OD1-NZ 2.6Å; D225-K282 IonicContact OD2-NZ 2.67Å; N278-K282 WeakPolarHBondContact O-CB 2.82Å; N278-K282 PolarHBondContact O-N 3.26Å; I279-K282 WeakPolarHBondContact O-CB 3.24Å; I279-K282 PolarHBondContact O-N 3.18Å
283	Y	82.1	Confident	81.1	Confident	36 Å²	36	53.6 Å²	53.6	14%	0.141	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	13.2	179.6	-62.6	-69.4	0	0	0	114.6	F224 F237 I279 S281 V285 F294	F224-Y283 HydrophobicContact CD1-CE2 4.32Å; F224-Y283 HydrophobicContact CE1-CD2 4.31Å; F224-Y283 AromaticContact CE1-CE2 3.34Å; F224-Y283 HydrophobicContact CE1-CE2 3.34Å; F224-Y283 AromaticContact CE1-CZ 3.76Å; F224-Y283 HydrophobicContact CZ-CD2 4.09Å; F224-Y283 AromaticContact CZ-CE2 3.54Å; F224-Y283 HydrophobicContact CZ-CE2 3.54Å; F237-Y283 HydrophobicContact CZ-CD2 4.35Å; I279-Y283 HydrophobicContact CG2-CD2 4.07Å; I279-Y283 HydrophobicContact CG2-CE2 4.11Å; I279-Y283 VanDerWaalsContact O-CD2 3.26Å; I279-Y283 WeakPolarHBondContact O-CD2 3.3Å; I279-Y283 PolarHBondContact O-N 2.81Å; S281-Y283 PolarHBondContact O-N 2.89Å; Y283-V285 VanDerWaalsContact C-N 3.28Å; Y283-V285 PolarHBondContact O-N 3.33Å; Y283-F294 AromaticContact CD1-CE1 3.9Å; Y283-F294 HydrophobicContact CD1-CE1 3.9Å; Y283-F294 AromaticContact CD1-CZ 3.93Å; Y283-F294 HydrophobicContact CD1-CZ 3.93Å; Y283-F294 HydrophobicContact CD2-CZ 4.22Å; Y283-F294 AromaticContact CE1-CE1 3.47Å; Y283-F294 HydrophobicContact CE1-CE1 3.47Å; Y283-F294 VanDerWaalsContact CE1-CE1 3.47Å; Y283-F294 AromaticContact CE1-CZ 3.94Å; Y283-F294 HydrophobicContact CE1-CZ 3.94Å; Y283-F294 HydrophobicContact CE2-CE1 4.24Å; Y283-F294 HydrophobicContact CE2-CZ 4.24Å; Y283-F294 HydrophobicContact CG-CE1 4.45Å; Y283-F294 HydrophobicContact CG-CZ 4.08Å; Y283-F294 AromaticContact CZ-CE1 3.66Å
284	S	82.5	Confident	81.8	Confident	76 Å²	76	53.4 Å²	53.4	53%	0.531	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	40.8	176.7	-66	0	0	0	0	113.5	C280 S281 R286	C280-S284 PolarHBondContact O-N 3.23Å; S281-S284 PolarHBondContact O-N 2.93Å; S284-R286 WeakPolarHBondContact O-CG 3.35Å; S284-R286 PolarHBondContact O-N 2.94Å; S284-R286 VanDerWaalsContact O-N 3.16Å
285	V	74.2	Confident	82.7	Confident	19 Å²	19	53.9 Å²	53.9	12%	0.115	27%	0.272	C	S	.	.			trans	-69.7	109.5	174.2	178.7	0	0	0	0	108.9	F237 C280 Y283 G287 Y288 T290	F237-V285 HydrophobicContact CB-CG1 3.96Å; F237-V285 HydrophobicContact CB-CG2 3.96Å; F237-V285 HydrophobicContact CD1-CG2 3.79Å; F237-V285 HydrophobicContact CD2-CG2 4.2Å; F237-V285 HydrophobicContact CE1-CG2 4.32Å; F237-V285 HydrophobicContact CG-CG2 3.7Å; C280-V285 HydrophobicContact CB-CB 4.11Å; C280-V285 HydrophobicContact CB-CG2 4.34Å; C280-V285 WeakPolarHBondContact O-CB 3.34Å; C280-V285 PolarHBondContact O-N 3.4Å; Y283-V285 VanDerWaalsContact C-N 3.28Å; Y283-V285 PolarHBondContact O-N 3.33Å; V285-G287 WeakPolarHBondContact CG1-O 3.47Å; V285-Y288 HydrophobicContact CG1-CD1 3.89Å; V285-Y288 HydrophobicContact CG1-CE1 3.61Å; V285-T290 HydrophobicContact CG2-CG2 4.39Å
286	R	71	Confident	83.2	Confident	212 Å²	212	53.1 Å²	53.1	80%	0.8	27%	0.271	S	S	*	.			trans	-104.5	-9.2	-174.2	-69	174	-172	-161.7	1.6	114	S284	S284-R286 WeakPolarHBondContact O-CG 3.35Å; S284-R286 PolarHBondContact O-N 2.94Å; S284-R286 VanDerWaalsContact O-N 3.16Å
287	G	62.5	Low	83.3	Confident	33 Å²	33	53 Å²	53	34%	0.34	28%	0.279	S	S	.	.	S	Bend	trans	-159.3	169.2	-179.1	0	0	0	0	0	111	V285 T290	V285-G287 WeakPolarHBondContact CG1-O 3.47Å; G287-T290 PolarHBondContact O-OG1 3.28Å
288	Y	80.3	Confident	84.1	Confident	73 Å²	73	52.1 Å²	52.1	29%	0.286	28%	0.28	S	S	.	.	S	Bend	trans	-131	146.8	-176.2	-47.8	-57.9	0	0	0	112	A239 W241 C245 C273 V285	A239-Y288 HydrophobicContact CB-CD2 3.77Å; A239-Y288 HydrophobicContact CB-CE2 3.88Å; A239-Y288 HydrophobicContact CB-CG 4.39Å; W241-Y288 HydrophobicContact CH2-CD2 4.17Å; W241-Y288 HydrophobicContact CH2-CE2 4.16Å; W241-Y288 HydrophobicContact CZ2-CE2 4.26Å; C245-Y288 WeakPolarHBondContact SG-CB 3.39Å; C273-Y288 HydrophobicContact CB-CE1 3.49Å; C273-Y288 VanDerWaalsContact CB-CE1 3.49Å; C273-Y288 VanDerWaalsContact CB-OH 3.29Å; C273-Y288 WeakPolarHBondContact CB-OH 3.41Å; C273-Y288 VanDerWaalsContact SG-CE1 3.56Å; V285-Y288 HydrophobicContact CG1-CD1 3.89Å; V285-Y288 HydrophobicContact CG1-CE1 3.61Å
289	P	88.9	Confident	84.7	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.019	27%	0.27	C	S	.	.	S	Bend	cis	-72.8	142.8	-14.4	30.4	-32.8	0	0	0	110.6	K236 F237 C245 L248 L291 R307	K236-P289 HydrophobicContact CG-CB 4.16Å; F237-P289 VanDerWaalsContact O-CA 3.29Å; F237-P289 WeakPolarHBondContact O-CA 3.42Å; C245-P289 VanDerWaalsContact SG-CD 3.58Å; C245-P289 VanDerWaalsContact SG-N 3.45Å; L248-P289 HydrophobicContact CD2-CB 4.05Å; L248-P289 HydrophobicContact CD2-CG 3.69Å; P289-L291 HydrophobicContact CB-CD2 4.31Å; P289-R307 VanDerWaalsContact CG-NH1 3.29Å; P289-R307 PolarHBondContact O-NH2 3.3Å
290	T	89	Confident	84.9	Confident	19 Å²	19	54.1 Å²	54.1	12%	0.117	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	132.3	167.6	-75.2	0	0	0	0	108.2	F237 V285 G287 L292	F237-T290 PolarHBondContact N-O 3.31Å; F237-T290 PolarHBondContact O-N 3.42Å; V285-T290 HydrophobicContact CG2-CG2 4.39Å; G287-T290 PolarHBondContact O-OG1 3.28Å; T290-L292 HydrophobicContact CG2-CD1 4.38Å; T290-L292 HydrophobicContact CG2-CD2 3.63Å; T290-L292 HydrophobicContact CG2-CG 3.84Å
291	L	96.4	Very high	85.2	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	108	-171.1	-54	-178.5	0	0	0	109.2	F234 I235 K236 L248 W252 P289 H303 R307 L312	F234-L291 HydrophobicContact CE2-CB 3.83Å; F234-L291 HydrophobicContact CZ-CB 3.93Å; F234-L291 HydrophobicContact CZ-CD1 4.42Å; I235-L291 WeakPolarHBondContact O-CA 3.35Å; K236-L291 HydrophobicContact CB-CD2 3.79Å; K236-L291 HydrophobicContact CG-CD2 3.83Å; L248-L291 HydrophobicContact CD2-CD1 4.13Å; L248-L291 HydrophobicContact CD2-CD2 3.87Å; W252-L291 HydrophobicContact CE3-CD2 4.36Å; W252-L291 HydrophobicContact CH2-CD2 3.87Å; W252-L291 HydrophobicContact CZ3-CD1 4.06Å; W252-L291 HydrophobicContact CZ3-CD2 3.71Å; W252-L291 HydrophobicContact CZ3-CG 4.38Å; P289-L291 HydrophobicContact CB-CD2 4.31Å; L291-H303 HydrophobicContact CB-CB 4.09Å; L291-H303 PolarHBondContact O-N 3.24Å; L291-R307 HydrophobicContact CD1-CG 4.5Å; L291-L312 HydrophobicContact CD1-CD2 3.96Å
292	L	94.1	Very high	85.9	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	139.1	-174.9	-54.6	-174.9	0	0	0	110.4	F234 I235 F237 T290 F294 K299 E302	F234-L292 WeakPolarHBondContact CD2-O 3.19Å; I235-L292 PolarHBondContact N-O 2.95Å; I235-L292 PolarHBondContact O-N 2.65Å; F237-L292 HydrophobicContact CD2-CB 4.39Å; F237-L292 HydrophobicContact CD2-CD1 4.05Å; F237-L292 HydrophobicContact CD2-CG 4.01Å; F237-L292 HydrophobicContact CE2-CB 3.94Å; F237-L292 HydrophobicContact CE2-CD1 3.65Å; F237-L292 HydrophobicContact CE2-CG 3.87Å; F237-L292 HydrophobicContact CZ-CD1 4.3Å; T290-L292 HydrophobicContact CG2-CD1 4.38Å; T290-L292 HydrophobicContact CG2-CD2 3.63Å; T290-L292 HydrophobicContact CG2-CG 3.84Å; L292-F294 HydrophobicContact CB-CD2 4.4Å; L292-F294 HydrophobicContact CB-CE2 3.63Å; L292-F294 HydrophobicContact CB-CZ 4.25Å; L292-F294 HydrophobicContact CD1-CE2 4.46Å; L292-F294 HydrophobicContact CD1-CZ 4.34Å; L292-K299 HydrophobicContact CD1-CD 4.24Å; L292-K299 HydrophobicContact CD2-CD 4.43Å; L292-E302 HydrophobicContact CD2-CB 3.72Å; L292-E302 HydrophobicContact CD2-CG 3.62Å
293	L	94.7	Very high	86	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	132.8	176.5	-165.5	141.5	0	0	0	110.4	I232 F234 V300 S301 F315 Q319	I232-L293 HydrophobicContact CG2-CD1 4.01Å; I232-L293 HydrophobicContact CG2-CD2 3.87Å; I232-L293 HydrophobicContact CG2-CG 3.96Å; F234-L293 HydrophobicContact CB-CD1 4.35Å; F234-L293 HydrophobicContact CD2-CB 4.02Å; F234-L293 HydrophobicContact CD2-CD1 4.23Å; F234-L293 HydrophobicContact CD2-CG 4.46Å; F234-L293 HydrophobicContact CG-CD1 4.37Å; L293-V300 HydrophobicContact CB-CG2 4.48Å; L293-V300 HydrophobicContact CD2-CG2 3.3Å; L293-V300 HydrophobicContact CG-CG2 4.47Å; L293-V300 WeakPolarHBondContact O-CG2 3.23Å; L293-V300 PolarHBondContact O-N 2.89Å; L293-S301 PolarHBondContact N-O 2.93Å; L293-S301 PolarHBondContact O-N 2.93Å; L293-F315 HydrophobicContact CB-CE1 4.16Å; L293-F315 HydrophobicContact CB-CZ 4.38Å; L293-F315 HydrophobicContact CD1-CD1 4.39Å; L293-F315 HydrophobicContact CD1-CE1 3.69Å; L293-F315 HydrophobicContact CD1-CZ 4.37Å; L293-Q319 HydrophobicContact CD1-CG 3.73Å; L293-Q319 HydrophobicContact CD2-CG 4.08Å
294	F	94.3	Very high	85.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	143	-178.7	-66.4	-98.9	0	0	0	110.7	F224 I228 I232 T233 I235 F237 Y283 L292 K298 K299	F224-F294 HydrophobicContact CE1-CE1 4.49Å; F224-F294 HydrophobicContact CZ-CE1 4.29Å; F224-F294 HydrophobicContact CZ-CE2 4.3Å; F224-F294 AromaticContact CZ-CZ 3.95Å; F224-F294 HydrophobicContact CZ-CZ 3.95Å; I228-F294 HydrophobicContact CB-CB 4.02Å; I228-F294 HydrophobicContact CB-CD1 4.46Å; I228-F294 HydrophobicContact CB-CG 4.36Å; I228-F294 HydrophobicContact CD1-CD1 3.7Å; I228-F294 HydrophobicContact CD1-CE1 4.14Å; I228-F294 HydrophobicContact CD1-CG 4.41Å; I228-F294 HydrophobicContact CG2-CB 4.02Å; I228-F294 HydrophobicContact CG2-CD1 4.39Å; I228-F294 HydrophobicContact CG2-CD2 4.48Å; I228-F294 HydrophobicContact CG2-CG 4.06Å; I232-F294 WeakPolarHBondContact CA-O 3.36Å; T233-F294 PolarHBondContact N-O 3.32Å; T233-F294 PolarHBondContact O-N 3.03Å; I235-F294 HydrophobicContact CB-CE2 4.38Å; I235-F294 HydrophobicContact CD1-CD2 3.44Å; I235-F294 VanDerWaalsContact CD1-CD2 3.44Å; I235-F294 HydrophobicContact CD1-CE2 3.49Å; I235-F294 VanDerWaalsContact CD1-CE2 3.49Å; I235-F294 HydrophobicContact CD1-CG 4.3Å; I235-F294 HydrophobicContact CD1-CZ 4.39Å; I235-F294 HydrophobicContact CG1-CD2 3.9Å; I235-F294 HydrophobicContact CG1-CE2 4.09Å; F237-F294 HydrophobicContact CE2-CE2 4.14Å; F237-F294 HydrophobicContact CZ-CE2 4.33Å; F237-F294 HydrophobicContact CZ-CZ 4.39Å; Y283-F294 AromaticContact CD1-CE1 3.9Å; Y283-F294 HydrophobicContact CD1-CE1 3.9Å; Y283-F294 AromaticContact CD1-CZ 3.93Å; Y283-F294 HydrophobicContact CD1-CZ 3.93Å; Y283-F294 HydrophobicContact CD2-CZ 4.22Å; Y283-F294 AromaticContact CE1-CE1 3.47Å; Y283-F294 HydrophobicContact CE1-CE1 3.47Å; Y283-F294 VanDerWaalsContact CE1-CE1 3.47Å; Y283-F294 AromaticContact CE1-CZ 3.94Å; Y283-F294 HydrophobicContact CE1-CZ 3.94Å; Y283-F294 HydrophobicContact CE2-CE1 4.24Å; Y283-F294 HydrophobicContact CE2-CZ 4.24Å; Y283-F294 HydrophobicContact CG-CE1 4.45Å; Y283-F294 HydrophobicContact CG-CZ 4.08Å; Y283-F294 AromaticContact CZ-CE1 3.66Å; L292-F294 HydrophobicContact CB-CD2 4.4Å; L292-F294 HydrophobicContact CB-CE2 3.63Å; L292-F294 HydrophobicContact CB-CZ 4.25Å; L292-F294 HydrophobicContact CD1-CE2 4.46Å; L292-F294 HydrophobicContact CD1-CZ 4.34Å; F294-K298 CarbonylContact C-O 3.56Å; F294-K298 WeakPolarHBondContact CA-O 3.27Å; F294-K299 HydrophobicContact CD1-CB 4.23Å; F294-K299 HydrophobicContact CE1-CB 3.86Å; F294-K299 HydrophobicContact CZ-CB 4.31Å
295	R	90.2	Very high	85.8	Confident	59 Å²	59	53.5 Å²	53.5	22%	0.223	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	129.4	173.3	-178.5	-176.2	-75.4	162.3	-9.8	108.8	G231 I232 G297 K298 V300 Q319	G231-R295 WeakPolarHBondContact O-CA 3.06Å; I232-R295 HydrophobicContact CG1-CG 4.47Å; R295-G297 VanDerWaalsContact C-N 3.29Å; R295-G297 PolarHBondContact O-N 2.91Å; R295-K298 PolarHBondContact N-O 2.92Å; R295-K298 PolarHBondContact O-N 2.98Å; R295-K298 VanDerWaalsContact O-N 3.1Å; R295-V300 HydrophobicContact CB-CG1 4Å; R295-V300 HydrophobicContact CB-CG2 4.18Å; R295-Q319 PolarHBondContact NH2-O 3.24Å
296	G	86.6	Confident	86.3	Confident	49 Å²	49	54.3 Å²	54.3	51%	0.505	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	39.2	176.7	0	0	0	0	0	113.7	A229 K298	A229-G296 VanDerWaalsContact O-CA 3.31Å; A229-G296 WeakPolarHBondContact O-CA 3.48Å; G296-K298 VanDerWaalsContact C-N 3.28Å; G296-K298 PolarHBondContact O-N 3.42Å
297	G	86.3	Confident	87.3	Confident	33 Å²	33	49.1 Å²	49.1	34%	0.34	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	1.6	-178.4	0	0	0	0	0	115.8	I228 R295	I228-G297 WeakPolarHBondContact O-CA 3.38Å; I228-G297 PolarHBondContact O-N 3.19Å; R295-G297 VanDerWaalsContact C-N 3.29Å; R295-G297 PolarHBondContact O-N 2.91Å
298	K	88.3	Confident	88.7	Confident	153 Å²	153	51.1 Å²	51.1	67%	0.665	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.9	141.6	-176.4	-64.8	-179.4	-177.9	175.8	0	112	F294 R295 G296 V300	F294-K298 CarbonylContact C-O 3.56Å; F294-K298 WeakPolarHBondContact CA-O 3.27Å; R295-K298 PolarHBondContact N-O 2.92Å; R295-K298 PolarHBondContact O-N 2.98Å; R295-K298 VanDerWaalsContact O-N 3.1Å; G296-K298 VanDerWaalsContact C-N 3.28Å; G296-K298 PolarHBondContact O-N 3.42Å; K298-V300 PolarHBondContact O-N 3.36Å
299	K	90.8	Very high	89.3	Confident	88 Å²	88	49.1 Å²	49.1	38%	0.383	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	118.8	165.3	174.7	-175.6	172.5	167.6	0	107.9	L292 F294 E302	L292-K299 HydrophobicContact CD1-CD 4.24Å; L292-K299 HydrophobicContact CD2-CD 4.43Å; F294-K299 HydrophobicContact CD1-CB 4.23Å; F294-K299 HydrophobicContact CE1-CB 3.86Å; F294-K299 HydrophobicContact CZ-CB 4.31Å; K299-E302 IonicContact NZ-OE2 2.89Å; K299-E302 PolarHBondContact NZ-OE2 3.27Å
300	V	90.1	Very high	89.4	Confident	72 Å²	72	53.5 Å²	53.5	44%	0.436	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	-28.1	179.5	-65.8	0	0	0	0	112.8	L293 R295 K298	L293-V300 HydrophobicContact CB-CG2 4.48Å; L293-V300 HydrophobicContact CD2-CG2 3.3Å; L293-V300 HydrophobicContact CG-CG2 4.47Å; L293-V300 WeakPolarHBondContact O-CG2 3.23Å; L293-V300 PolarHBondContact O-N 2.89Å; R295-V300 HydrophobicContact CB-CG1 4Å; R295-V300 HydrophobicContact CB-CG2 4.18Å; K298-V300 PolarHBondContact O-N 3.36Å
301	S	87.1	Confident	89.5	Confident	35 Å²	35	53.7 Å²	53.7	25%	0.245	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	161.5	-178.8	-167.6	0	0	0	0	112.8	L293	L293-S301 PolarHBondContact N-O 2.93Å; L293-S301 PolarHBondContact O-N 2.93Å
302	E	89.4	Confident	89.4	Confident	98 Å²	98	53.6 Å²	53.6	46%	0.458	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	126.6	172.5	175.5	164.7	167.2	0	0	109	L292 K299 S304	L292-E302 HydrophobicContact CD2-CB 3.72Å; L292-E302 HydrophobicContact CD2-CG 3.62Å; K299-E302 IonicContact NZ-OE2 2.89Å; K299-E302 PolarHBondContact NZ-OE2 3.27Å; E302-S304 PolarHBondContact O-N 3.45Å
303	H	87.1	Confident	89.5	Confident	18 Å²	18	55.3 Å²	55.3	8%	0.083	32%	0.32	C	S	.	.			trans	-86.6	115.2	-178.7	-177	61.9	0	0	0	111.1	F234 L291 G306 L312 F315	F234-H303 HydrophobicContact CE2-CB 4.15Å; F234-H303 HydrophobicContact CZ-CB 3.93Å; L291-H303 HydrophobicContact CB-CB 4.09Å; L291-H303 PolarHBondContact O-N 3.24Å; H303-G306 PolarHBondContact NE2-O 3.47Å; H303-L312 VanDerWaalsContact CD2-CD2 3.45Å; H303-L312 WeakPolarHBondContact CD2-CD2 3.36Å; H303-F315 HydrophobicContact CB-CD1 4.06Å; H303-F315 HydrophobicContact CB-CD2 4.31Å; H303-F315 HydrophobicContact CB-CE1 3.83Å; H303-F315 HydrophobicContact CB-CE2 4.09Å; H303-F315 HydrophobicContact CB-CG 4.3Å; H303-F315 HydrophobicContact CB-CZ 3.84Å; H303-F315 AromaticContact ND1-CD2 3.37Å; H303-F315 WeakPolarHBondContact ND1-CD2 3.29Å; H303-F315 AromaticContact ND1-CE2 3.91Å; H303-F315 AromaticContact ND1-CG 3.46Å; H303-F315 WeakPolarHBondContact ND1-CG 2.99Å
304	S	80.1	Confident	89.3	Confident	118 Å²	118	62.5 Å²	62.5	83%	0.825	35%	0.347	S	S	*	.			trans	-110.9	0.5	176.9	58.8	0	0	0	0	113.7	E302	E302-S304 PolarHBondContact O-N 3.45Å
305	G	81.4	Confident	89.2	Confident	39 Å²	39	63.8 Å²	63.8	40%	0.402	35%	0.353	S	S	.	.	S	Bend	trans	-83.3	-163.2	-177.5	0	0	0	0	0	114.6
306	G	83.9	Confident	89.3	Confident	36 Å²	36	61 Å²	61	37%	0.371	34%	0.342	S	S	.	.			trans	-54.4	141.4	177.1	0	0	0	0	0	112.6	H303 S311	H303-G306 PolarHBondContact NE2-O 3.47Å; G306-S311 WeakPolarHBondContact O-CB 3.49Å
307	R	91.1	Very high	89.5	Confident	104 Å²	104	60.9 Å²	60.9	39%	0.392	33%	0.33	S	S	.	.			trans	-106	10.6	-176	-65.6	-178.9	177.2	-176.1	-8.8	113.2	L248 P289 L291	L248-R307 HydrophobicContact CD1-CB 4.05Å; P289-R307 VanDerWaalsContact CG-NH1 3.29Å; P289-R307 PolarHBondContact O-NH2 3.3Å; L291-R307 HydrophobicContact CD1-CG 4.5Å
308	D	92.9	Very high	89.6	Confident	75 Å²	75	61.8 Å²	61.8	40%	0.401	33%	0.331	S	S	.	.	S	Bend	trans	-71.8	158.7	166.7	61.5	93.9	0	0	0	111	D310 S311 L312	D308-D310 VanDerWaalsContact C-N 3.3Å; D308-D310 PolarHBondContact O-N 3.43Å; D308-D310 PolarHBondContact OD1-N 2.52Å; D308-S311 PolarHBondContact O-N 3.36Å; D308-S311 WeakPolarHBondContact OD1-CB 3.27Å; D308-S311 PolarHBondContact OD1-N 3.08Å; D308-S311 PolarHBondContact OD1-OG 2.97Å; D308-S311 VanDerWaalsContact OD2-CB 3.22Å; D308-S311 WeakPolarHBondContact OD2-CB 3.15Å; D308-S311 PolarHBondContact OD2-OG 3Å; D308-L312 WeakPolarHBondContact O-CG 3.36Å; D308-L312 PolarHBondContact O-N 3Å
309	L	93.3	Very high	89.4	Confident	30 Å²	30	55.2 Å²	55.2	16%	0.157	30%	0.303	C	S	.	.	H	α-helix	trans	-55.5	-44.3	-174.4	-176.9	60.2	0	0	0	112.5	T251 E254 L255 K258 L312 H313	T251-L309 HydrophobicContact CG2-CB 3.91Å; T251-L309 HydrophobicContact CG2-CD1 4.44Å; E254-L309 HydrophobicContact CB-CD1 3.95Å; E254-L309 HydrophobicContact CB-CD2 4.15Å; E254-L309 WeakPolarHBondContact OE2-CD2 3.48Å; L255-L309 HydrophobicContact CB-CD1 3.92Å; L255-L309 HydrophobicContact CD1-CD1 4.25Å; K258-L309 HydrophobicContact CG-CD1 4.21Å; L309-L312 PolarHBondContact O-N 2.74Å; L309-H313 VanDerWaalsContact O-CB 3.25Å; L309-H313 WeakPolarHBondContact O-CB 3.38Å; L309-H313 PolarHBondContact O-N 2.94Å
310	D	90.8	Very high	88.5	Confident	96 Å²	96	52.1 Å²	52.1	51%	0.513	29%	0.294	S	S	.	.	H	α-helix	trans	-69.1	-39	-176.7	-69.6	-22.6	0	0	0	111.7	D308 R314	D308-D310 VanDerWaalsContact C-N 3.3Å; D308-D310 PolarHBondContact O-N 3.43Å; D308-D310 PolarHBondContact OD1-N 2.52Å; D310-R314 VanDerWaalsContact O-CB 3.3Å; D310-R314 WeakPolarHBondContact O-CB 3.22Å; D310-R314 VanDerWaalsContact O-CG 3.29Å; D310-R314 WeakPolarHBondContact O-CG 3.32Å; D310-R314 PolarHBondContact O-N 3.44Å; D310-R314 PolarHBondContact O-NE 3.26Å
311	S	91.1	Very high	87.1	Confident	22 Å²	22	56.9 Å²	56.9	15%	0.154	31%	0.308	C	S	.	.	H	α-helix	trans	-64.8	-42.8	175.3	-67.2	0	0	0	0	112	G306 D308 R314 F315	G306-S311 WeakPolarHBondContact O-CB 3.49Å; D308-S311 PolarHBondContact O-N 3.36Å; D308-S311 WeakPolarHBondContact OD1-CB 3.27Å; D308-S311 PolarHBondContact OD1-N 3.08Å; D308-S311 PolarHBondContact OD1-OG 2.97Å; D308-S311 VanDerWaalsContact OD2-CB 3.22Å; D308-S311 WeakPolarHBondContact OD2-CB 3.15Å; D308-S311 PolarHBondContact OD2-OG 3Å; S311-R314 PolarHBondContact OG-NH2 3.3Å; S311-R314 VanDerWaalsContact OG-NH2 3.09Å; S311-F315 WeakPolarHBondContact O-CB 3.14Å; S311-F315 PolarHBondContact O-N 2.9Å
312	L	95	Very high	85.6	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-68	-43.1	177.5	-64.6	171.9	0	0	0	111.8	F234 L248 T251 W252 L255 L291 H303 D308 L309 F315 V316	F234-L312 HydrophobicContact CE1-CD2 4.05Å; F234-L312 HydrophobicContact CZ-CD2 4.19Å; L248-L312 HydrophobicContact CD1-CD1 4.15Å; T251-L312 HydrophobicContact CG2-CD1 4.06Å; W252-L312 HydrophobicContact CE3-CD1 4.2Å; W252-L312 HydrophobicContact CZ3-CD1 4.31Å; W252-L312 HydrophobicContact CZ3-CD2 4.35Å; L255-L312 HydrophobicContact CD1-CB 4.09Å; L255-L312 HydrophobicContact CD2-CB 3.79Å; L255-L312 HydrophobicContact CD2-CD1 4.26Å; L291-L312 HydrophobicContact CD1-CD2 3.96Å; H303-L312 VanDerWaalsContact CD2-CD2 3.45Å; H303-L312 WeakPolarHBondContact CD2-CD2 3.36Å; D308-L312 WeakPolarHBondContact O-CG 3.36Å; D308-L312 PolarHBondContact O-N 3Å; L309-L312 PolarHBondContact O-N 2.74Å; L312-F315 WeakPolarHBondContact O-CB 3.35Å; L312-F315 PolarHBondContact O-N 3.43Å; L312-V316 WeakPolarHBondContact O-CG2 3.43Å; L312-V316 PolarHBondContact O-N 3.45Å
313	H	94.3	Very high	83.7	Confident	37 Å²	37	61.3 Å²	61.3	17%	0.171	33%	0.329	C	S	.	.	H	α-helix	trans	-61.9	-46.2	177.4	-175.9	-121.7	0	0	0	111.7	L255 E259 F260 L309 F315 V316 L317	L255-H313 HydrophobicContact CD1-CB 4.05Å; E259-H313 PolarHBondContact O-NE2 3.34Å; F260-H313 AromaticContact CD1-CD2 3.76Å; F260-H313 AromaticContact CE1-CD2 3.42Å; F260-H313 VanDerWaalsContact CE1-CD2 3.42Å; F260-H313 WeakPolarHBondContact CE1-CD2 3.39Å; L309-H313 VanDerWaalsContact O-CB 3.25Å; L309-H313 WeakPolarHBondContact O-CB 3.38Å; L309-H313 PolarHBondContact O-N 2.94Å; H313-F315 VanDerWaalsContact C-N 3.32Å; H313-F315 PolarHBondContact O-N 3.46Å; H313-V316 PolarHBondContact O-N 3.37Å; H313-L317 WeakPolarHBondContact O-CG 3.31Å; H313-L317 PolarHBondContact O-N 3.3Å
314	R	91.5	Very high	81.5	Confident	150 Å²	150	71 Å²	71	57%	0.566	38%	0.38	S	S	*	.	H	α-helix	trans	-62.5	-36.8	174.3	-77.4	-179.9	-74.1	127.2	-2.2	112.9	D310 S311 L317 S318	D310-R314 VanDerWaalsContact O-CB 3.3Å; D310-R314 WeakPolarHBondContact O-CB 3.22Å; D310-R314 VanDerWaalsContact O-CG 3.29Å; D310-R314 WeakPolarHBondContact O-CG 3.32Å; D310-R314 PolarHBondContact O-N 3.44Å; D310-R314 PolarHBondContact O-NE 3.26Å; S311-R314 PolarHBondContact OG-NH2 3.3Å; S311-R314 VanDerWaalsContact OG-NH2 3.09Å; R314-L317 PolarHBondContact O-N 2.88Å; R314-S318 WeakPolarHBondContact O-CB 3.44Å; R314-S318 PolarHBondContact O-N 3.48Å
315	F	92.6	Very high	81.6	Confident	28 Å²	28	68.7 Å²	68.7	12%	0.123	36%	0.358	C	S	.	.	H	α-helix	trans	-62.8	-45	176.1	170.6	-99.2	0	0	0	111.6	F234 L293 H303 S311 L312 H313 S318	F234-F315 HydrophobicContact CD2-CE1 4.18Å; F234-F315 HydrophobicContact CE1-CD1 4.12Å; F234-F315 HydrophobicContact CE1-CE1 4.46Å; F234-F315 HydrophobicContact CE2-CD1 4.1Å; F234-F315 AromaticContact CE2-CE1 3.64Å; F234-F315 HydrophobicContact CE2-CE1 3.64Å; F234-F315 AromaticContact CZ-CD1 3.76Å; F234-F315 HydrophobicContact CZ-CD1 3.76Å; F234-F315 AromaticContact CZ-CE1 3.8Å; F234-F315 HydrophobicContact CZ-CE1 3.8Å; L293-F315 HydrophobicContact CB-CE1 4.16Å; L293-F315 HydrophobicContact CB-CZ 4.38Å; L293-F315 HydrophobicContact CD1-CD1 4.39Å; L293-F315 HydrophobicContact CD1-CE1 3.69Å; L293-F315 HydrophobicContact CD1-CZ 4.37Å; H303-F315 HydrophobicContact CB-CD1 4.06Å; H303-F315 HydrophobicContact CB-CD2 4.31Å; H303-F315 HydrophobicContact CB-CE1 3.83Å; H303-F315 HydrophobicContact CB-CE2 4.09Å; H303-F315 HydrophobicContact CB-CG 4.3Å; H303-F315 HydrophobicContact CB-CZ 3.84Å; H303-F315 AromaticContact ND1-CD2 3.37Å; H303-F315 WeakPolarHBondContact ND1-CD2 3.29Å; H303-F315 AromaticContact ND1-CE2 3.91Å; H303-F315 AromaticContact ND1-CG 3.46Å; H303-F315 WeakPolarHBondContact ND1-CG 2.99Å; S311-F315 WeakPolarHBondContact O-CB 3.14Å; S311-F315 PolarHBondContact O-N 2.9Å; L312-F315 WeakPolarHBondContact O-CB 3.35Å; L312-F315 PolarHBondContact O-N 3.43Å; H313-F315 VanDerWaalsContact C-N 3.32Å; H313-F315 PolarHBondContact O-N 3.46Å; F315-S318 PolarHBondContact O-N 3.42Å; F315-S318 PolarHBondContact O-OG 3.16Å
316	V	91.7	Very high	81.6	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-65.7	-44.9	176.8	180	0	0	0	0	110.5	F234 F260 L263 V266 L312 H313 S318 Q319	F234-V316 HydrophobicContact CB-CG2 4.39Å; F234-V316 HydrophobicContact CD1-CG2 3.58Å; F234-V316 HydrophobicContact CE1-CG2 4.07Å; F234-V316 HydrophobicContact CG-CG2 4.17Å; F260-V316 HydrophobicContact CD1-CB 3.84Å; F260-V316 HydrophobicContact CD1-CG1 3.47Å; F260-V316 VanDerWaalsContact CD1-CG1 3.47Å; F260-V316 HydrophobicContact CE1-CB 3.58Å; F260-V316 HydrophobicContact CE1-CG1 3.55Å; F260-V316 HydrophobicContact CE1-CG2 4.05Å; F260-V316 HydrophobicContact CG-CG1 4.21Å; F260-V316 HydrophobicContact CZ-CG1 4.36Å; L263-V316 HydrophobicContact CD1-CG1 4.08Å; L263-V316 WeakPolarHBondContact CD1-O 3.49Å; V266-V316 HydrophobicContact CG1-CG1 3.83Å; V266-V316 HydrophobicContact CG2-CG1 4.42Å; L312-V316 WeakPolarHBondContact O-CG2 3.43Å; L312-V316 PolarHBondContact O-N 3.45Å; H313-V316 PolarHBondContact O-N 3.37Å; V316-S318 VanDerWaalsContact C-N 3.28Å; V316-S318 PolarHBondContact O-N 3.48Å; V316-Q319 VanDerWaalsContact O-CB 3.25Å; V316-Q319 WeakPolarHBondContact O-CB 3.04Å; V316-Q319 WeakPolarHBondContact O-CG 3.46Å; V316-Q319 PolarHBondContact O-N 2.02Å; V316-Q319 VanDerWaalsContact O-N 3.12Å
317	L	90.8	Very high	81.4	Confident	47 Å²	47	72.1 Å²	72.1	25%	0.246	36%	0.355	C	S	.	.	H	α-helix	trans	-62.9	-30.1	177.8	-74.5	177.7	0	0	0	113.8	F260 P261 H313 R314 Q319 A320	F260-L317 HydrophobicContact CB-CD2 4.29Å; F260-L317 HydrophobicContact CD1-CD2 4.4Å; F260-L317 HydrophobicContact CD1-CG 4.47Å; P261-L317 HydrophobicContact CG-CD2 4.36Å; H313-L317 WeakPolarHBondContact O-CG 3.31Å; H313-L317 PolarHBondContact O-N 3.3Å; R314-L317 PolarHBondContact O-N 2.88Å; L317-Q319 PolarHBondContact O-N 2.87Å; L317-A320 VanDerWaalsContact O-CB 3.3Å; L317-A320 WeakPolarHBondContact O-CB 3.35Å; L317-A320 PolarHBondContact O-N 2.62Å; L317-A320 VanDerWaalsContact O-N 3.07Å
318	S	87.9	Confident	80.9	Confident	51 Å²	51	70.2 Å²	70.2	36%	0.357	35%	0.353	S	S	.	.	H	α-helix	trans	-62.7	-23.5	177.6	77.6	0	0	0	0	112.2	R314 F315 V316 A320 K321	R314-S318 WeakPolarHBondContact O-CB 3.44Å; R314-S318 PolarHBondContact O-N 3.48Å; F315-S318 PolarHBondContact O-N 3.42Å; F315-S318 PolarHBondContact O-OG 3.16Å; V316-S318 VanDerWaalsContact C-N 3.28Å; V316-S318 PolarHBondContact O-N 3.48Å; S318-A320 PolarHBondContact O-N 2.88Å; S318-K321 PolarHBondContact O-N 3.48Å
319	Q	83.9	Confident	80.1	Confident	15 Å²	15	69.9 Å²	69.9	7%	0.07	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-68.6	-16.8	177.4	-51.6	-55.9	-76.9	0	0	112.8	I232 L293 R295 V316 L317 K321 D322	I232-Q319 HydrophobicContact CD1-CB 4.36Å; L293-Q319 HydrophobicContact CD1-CG 3.73Å; L293-Q319 HydrophobicContact CD2-CG 4.08Å; R295-Q319 PolarHBondContact NH2-O 3.24Å; V316-Q319 VanDerWaalsContact O-CB 3.25Å; V316-Q319 WeakPolarHBondContact O-CB 3.04Å; V316-Q319 WeakPolarHBondContact O-CG 3.46Å; V316-Q319 PolarHBondContact O-N 2.02Å; V316-Q319 VanDerWaalsContact O-N 3.12Å; L317-Q319 PolarHBondContact O-N 2.87Å; Q319-K321 VanDerWaalsContact C-N 3.26Å; Q319-K321 PolarHBondContact O-N 3.39Å; Q319-D322 PolarHBondContact O-N 3.44Å
320	A	71.9	Confident	79.2	Confident	24 Å²	24	72.6 Å²	72.6	20%	0.198	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-69.6	-24.6	175.1	0	0	0	0	0	112.7	L263 L317 S318 D322 E323	L263-A320 HydrophobicContact CD1-CB 4.38Å; L263-A320 VanDerWaalsContact CD2-CA 3.42Å; L263-A320 HydrophobicContact CD2-CB 3.52Å; L263-A320 HydrophobicContact CG-CB 3.81Å; L317-A320 VanDerWaalsContact O-CB 3.3Å; L317-A320 WeakPolarHBondContact O-CB 3.35Å; L317-A320 PolarHBondContact O-N 2.62Å; L317-A320 VanDerWaalsContact O-N 3.07Å; S318-A320 PolarHBondContact O-N 2.88Å; A320-D322 PolarHBondContact O-N 3.39Å; A320-E323 PolarHBondContact O-N 3.37Å
321	K	61	Low	78.4	Confident	171 Å²	171	70.9 Å²	70.9	74%	0.743	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-74.6	-17.3	179.3	-65.1	-176.1	178.5	-178.2	0	113.1	S318 Q319 E323	S318-K321 PolarHBondContact O-N 3.48Å; Q319-K321 VanDerWaalsContact C-N 3.26Å; Q319-K321 PolarHBondContact O-N 3.39Å; K321-E323 VanDerWaalsContact C-N 3.28Å
322	D	56.6	Low	77.4	Confident	114 Å²	114	74.7 Å²	74.7	61%	0.61	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-85.4	1.5	174.8	-65.6	-21.7	0	0	0	112.5	Q319 A320	Q319-D322 PolarHBondContact O-N 3.44Å; A320-D322 PolarHBondContact O-N 3.39Å
323	E	48.9	Very low	76	Confident	112 Å²	112	80.9 Å²	80.9	52%	0.523	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-93.2	-5.4	173.8	-68	-171	171.9	0	0	113.6	A320 K321	A320-E323 PolarHBondContact O-N 3.37Å; K321-E323 VanDerWaalsContact C-N 3.28Å
324	L	40.7	Very low	74.3	Confident	222 Å²	222	84.9 Å²	84.9	100%	1.162	42%	0.418	S	S	*	.			trans	-105.2	0	179.3	-82.7	161.3	0	0	0	112.4

Retrieved 324 of 324 residues in 1659.5 ms (Link to these results)

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