A0A061ILP0_CRIGR Loading...

Beta-1,4 N-acetylgalactosaminyltransferase

AlphaFold DB , UniProt , Accession A0A061ILP0, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene n/a, Length 533 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	48.1	Very low	66.4	Low	240 Å²	240	141.4 Å²	141.4	100%	1.182	67%	0.672	S	S	*	*				0	109.6	0	-72.5	159.1	73.5	0	0	108.4	L3	M1-L3 PolarHBondContact O-N 2.9Å
2	R	53.8	Low	67.6	Low	252 Å²	252	136.8 Å²	136.8	95%	0.951	66%	0.66	S	S	*	*			trans	-81.3	108.8	178.9	-74.3	179.2	177.4	177.8	-0.9	108.1	G4	R2-G4 PolarHBondContact O-N 2.83Å; R2-G4 VanDerWaalsContact O-N 3.09Å
3	L	54.4	Low	68.5	Low	130 Å²	130	135.1 Å²	135.1	68%	0.681	66%	0.655	S	S	*	*			trans	-58.1	116.2	167.5	-105.3	86.3	0	0	0	107.7	M1 A7	M1-L3 PolarHBondContact O-N 2.9Å; L3-A7 HydrophobicContact CD2-CB 4.19Å; L3-A7 HydrophobicContact CG-CB 4.49Å
4	G	66.4	Low	69.4	Low	45 Å²	45	134 Å²	134	46%	0.464	65%	0.653	S	S	.	*			trans	-60.5	142.7	-179.9	0	0	0	0	0	110.6	R2 R6 A7 L8	R2-G4 PolarHBondContact O-N 2.83Å; R2-G4 VanDerWaalsContact O-N 3.09Å; G4-R6 PolarHBondContact O-N 2.66Å; G4-A7 WeakPolarHBondContact O-CB 3.5Å; G4-A7 PolarHBondContact O-N 3.13Å; G4-L8 PolarHBondContact O-N 3.47Å
5	R	66.9	Low	70.1	Confident	204 Å²	204	132.3 Å²	132.3	77%	0.77	65%	0.648	S	S	*	*	H	α-helix	trans	-43.9	-34.8	-179.5	-129.2	172.4	174.9	177.2	-2.7	113.4	L8 Y9	R5-L8 WeakPolarHBondContact O-CB 3.15Å; R5-L8 PolarHBondContact O-N 2.86Å; R5-Y9 HydrophobicContact CG-CE2 4.36Å; R5-Y9 WeakPolarHBondContact O-CD2 3.43Å; R5-Y9 PolarHBondContact O-N 3.32Å
6	R	68.1	Low	70.5	Confident	229 Å²	229	126.8 Å²	126.8	86%	0.864	63%	0.629	S	S	*	*	H	α-helix	trans	-65.5	-37.7	176.1	-68.3	-176.1	177.4	179.4	-1	114.3	G4 L8 Y9 A10	G4-R6 PolarHBondContact O-N 2.66Å; R6-L8 VanDerWaalsContact C-N 3.3Å; R6-Y9 PolarHBondContact O-N 3.06Å; R6-A10 PolarHBondContact O-N 2.71Å
7	A	71.9	Confident	70.9	Confident	47 Å²	47	124.1 Å²	124.1	39%	0.388	63%	0.625	S	S	.	*	H	α-helix	trans	-68	-33.9	175.9	0	0	0	0	0	111.4	L3 G4 A10 L11	L3-A7 HydrophobicContact CD2-CB 4.19Å; L3-A7 HydrophobicContact CG-CB 4.49Å; G4-A7 WeakPolarHBondContact O-CB 3.5Å; G4-A7 PolarHBondContact O-N 3.13Å; A7-A10 PolarHBondContact O-N 3.07Å; A7-L11 WeakPolarHBondContact O-CB 3.38Å; A7-L11 PolarHBondContact O-N 3Å
8	L	72.8	Confident	71.3	Confident	103 Å²	103	120.2 Å²	120.2	54%	0.539	62%	0.615	S	S	.	*	H	α-helix	trans	-66.5	-43.7	175	-144.8	94	0	0	0	111.5	G4 R5 R6 L11 V12	G4-L8 PolarHBondContact O-N 3.47Å; R5-L8 WeakPolarHBondContact O-CB 3.15Å; R5-L8 PolarHBondContact O-N 2.86Å; R6-L8 VanDerWaalsContact C-N 3.3Å; L8-L11 PolarHBondContact O-N 3.1Å; L8-V12 VanDerWaalsContact O-CG2 3.31Å; L8-V12 WeakPolarHBondContact O-CG2 3.44Å; L8-V12 PolarHBondContact O-N 2.74Å
9	Y	73.6	Confident	71.5	Confident	152 Å²	152	117.4 Å²	117.4	60%	0.596	61%	0.607	S	S	*	*	H	α-helix	trans	-64	-40.7	175.7	-78.7	-69.9	0	0	0	112.7	R5 R6 L11 V12 L13	R5-Y9 HydrophobicContact CG-CE2 4.36Å; R5-Y9 WeakPolarHBondContact O-CD2 3.43Å; R5-Y9 PolarHBondContact O-N 3.32Å; R6-Y9 PolarHBondContact O-N 3.06Å; Y9-L11 VanDerWaalsContact C-N 3.33Å; Y9-L11 PolarHBondContact O-N 2.94Å; Y9-V12 PolarHBondContact O-N 2.88Å; Y9-L13 WeakPolarHBondContact O-CB 3.48Å; Y9-L13 PolarHBondContact O-N 3.3Å
10	A	75.2	Confident	71.6	Confident	51 Å²	51	117.6 Å²	117.6	42%	0.421	61%	0.608	S	S	.	*	H	α-helix	trans	-62.9	-40.2	175.8	0	0	0	0	0	111.9	R6 A7 L13 L14	R6-A10 PolarHBondContact O-N 2.71Å; A7-A10 PolarHBondContact O-N 3.07Å; A10-L13 PolarHBondContact O-N 3.45Å; A10-L14 WeakPolarHBondContact O-CB 3.38Å; A10-L14 WeakPolarHBondContact O-CG 3.36Å; A10-L14 PolarHBondContact O-N 2.81Å
11	L	78.9	Confident	71.6	Confident	102 Å²	102	113.9 Å²	113.9	53%	0.534	60%	0.599	S	S	.	*	H	α-helix	trans	-65.9	-41.9	176.8	-161.9	84.4	0	0	0	112	A7 L8 Y9 L14 L15	A7-L11 WeakPolarHBondContact O-CB 3.38Å; A7-L11 PolarHBondContact O-N 3Å; L8-L11 PolarHBondContact O-N 3.1Å; Y9-L11 VanDerWaalsContact C-N 3.33Å; Y9-L11 PolarHBondContact O-N 2.94Å; L11-L14 PolarHBondContact O-N 3.23Å; L11-L15 HydrophobicContact CD2-CD1 4.44Å; L11-L15 HydrophobicContact CG-CD1 4.29Å; L11-L15 WeakPolarHBondContact O-CB 3.46Å; L11-L15 WeakPolarHBondContact O-CG 3.18Å; L11-L15 PolarHBondContact O-N 3.04Å
12	V	80.8	Confident	72.6	Confident	87 Å²	87	108.4 Å²	108.4	53%	0.527	57%	0.574	S	S	.	*	H	α-helix	trans	-65.3	-40.9	177.1	172.2	0	0	0	0	111.2	L8 Y9 L15 A16	L8-V12 VanDerWaalsContact O-CG2 3.31Å; L8-V12 WeakPolarHBondContact O-CG2 3.44Å; L8-V12 PolarHBondContact O-N 2.74Å; Y9-V12 PolarHBondContact O-N 2.88Å; V12-L15 PolarHBondContact O-N 2.87Å; V12-A16 WeakPolarHBondContact O-CB 3.47Å; V12-A16 PolarHBondContact O-N 2.86Å
13	L	79.1	Confident	73.2	Confident	114 Å²	114	102 Å²	102	60%	0.597	56%	0.558	S	S	*	*	H	α-helix	trans	-63.8	-43.2	174.3	-96.7	148.8	0	0	0	112	Y9 A10 L15 A16 C17	Y9-L13 WeakPolarHBondContact O-CB 3.48Å; Y9-L13 PolarHBondContact O-N 3.3Å; A10-L13 PolarHBondContact O-N 3.45Å; L13-L15 PolarHBondContact O-N 3.07Å; L13-A16 PolarHBondContact O-N 2.99Å; L13-C17 WeakPolarHBondContact O-CB 3.35Å; L13-C17 PolarHBondContact O-N 3.11Å; L13-C17 PolarHBondContact O-SG 2.86Å
14	L	81	Confident	73.9	Confident	120 Å²	120	103.1 Å²	103.1	63%	0.628	55%	0.554	S	S	*	*	H	α-helix	trans	-62.9	-41.9	176.1	-81.3	162.4	0	0	0	112	A10 L11 C17 A18	A10-L14 WeakPolarHBondContact O-CB 3.38Å; A10-L14 WeakPolarHBondContact O-CG 3.36Å; A10-L14 PolarHBondContact O-N 2.81Å; L11-L14 PolarHBondContact O-N 3.23Å; L14-C17 PolarHBondContact O-N 2.9Å; L14-A18 VanDerWaalsContact O-CB 3.29Å; L14-A18 WeakPolarHBondContact O-CB 3.48Å; L14-A18 PolarHBondContact O-N 2.84Å
15	L	80.1	Confident	73.7	Confident	109 Å²	109	103.2 Å²	103.2	57%	0.571	55%	0.551	S	S	*	*	H	α-helix	trans	-66.5	-38.1	176	-76.6	164.7	0	0	0	112.1	L11 V12 L13 A18 S19	L11-L15 HydrophobicContact CD2-CD1 4.44Å; L11-L15 HydrophobicContact CG-CD1 4.29Å; L11-L15 WeakPolarHBondContact O-CB 3.46Å; L11-L15 WeakPolarHBondContact O-CG 3.18Å; L11-L15 PolarHBondContact O-N 3.04Å; V12-L15 PolarHBondContact O-N 2.87Å; L13-L15 PolarHBondContact O-N 3.07Å; L15-A18 PolarHBondContact O-N 3.11Å; L15-S19 WeakPolarHBondContact O-CB 3.37Å; L15-S19 PolarHBondContact O-N 3.09Å; L15-S19 PolarHBondContact O-OG 2.94Å
16	A	77.8	Confident	73.3	Confident	43 Å²	43	97.2 Å²	97.2	36%	0.355	54%	0.54	S	S	.	.	H	α-helix	trans	-67	-40.6	174.6	0	0	0	0	0	112.1	V12 L13 S19 L20	V12-A16 WeakPolarHBondContact O-CB 3.47Å; V12-A16 PolarHBondContact O-N 2.86Å; L13-A16 PolarHBondContact O-N 2.99Å; A16-S19 WeakPolarHBondContact CA-OG 3.41Å; A16-S19 PolarHBondContact O-OG 3.45Å; A16-L20 WeakPolarHBondContact O-CB 3.46Å; A16-L20 WeakPolarHBondContact O-CD1 3.39Å; A16-L20 PolarHBondContact O-N 3.33Å
17	C	76.1	Confident	72.6	Confident	82 Å²	82	90.9 Å²	90.9	55%	0.554	53%	0.527	S	S	*	.	H	α-helix	trans	-67.5	-38.6	174.6	-70.6	0	0	0	0	111.9	L13 L14 G21	L13-C17 WeakPolarHBondContact O-CB 3.35Å; L13-C17 PolarHBondContact O-N 3.11Å; L13-C17 PolarHBondContact O-SG 2.86Å; L14-C17 PolarHBondContact O-N 2.9Å; C17-G21 PolarHBondContact O-N 3.49Å
18	A	78.3	Confident	71.6	Confident	53 Å²	53	97.3 Å²	97.3	44%	0.438	54%	0.541	S	S	.	.	H	α-helix	trans	-67.3	-40.3	176.5	0	0	0	0	0	112	L14 L15 G21 L22	L14-A18 VanDerWaalsContact O-CB 3.29Å; L14-A18 WeakPolarHBondContact O-CB 3.48Å; L14-A18 PolarHBondContact O-N 2.84Å; L15-A18 PolarHBondContact O-N 3.11Å; A18-G21 PolarHBondContact O-N 3.26Å; A18-L22 WeakPolarHBondContact O-CB 3.47Å; A18-L22 WeakPolarHBondContact O-CG 3.47Å; A18-L22 PolarHBondContact O-N 2.91Å
19	S	74.4	Confident	70.2	Confident	67 Å²	67	99.3 Å²	99.3	47%	0.469	55%	0.552	S	S	.	*	H	α-helix	trans	-69.5	-38.1	176.5	59.1	0	0	0	0	112.4	L15 A16 L22 L23	L15-S19 WeakPolarHBondContact O-CB 3.37Å; L15-S19 PolarHBondContact O-N 3.09Å; L15-S19 PolarHBondContact O-OG 2.94Å; A16-S19 WeakPolarHBondContact CA-OG 3.41Å; A16-S19 PolarHBondContact O-OG 3.45Å; S19-L22 PolarHBondContact O-N 3.2Å; S19-L23 WeakPolarHBondContact O-CB 3.37Å; S19-L23 PolarHBondContact O-N 3.38Å
20	L	73.6	Confident	68.4	Low	122 Å²	122	95 Å²	95	64%	0.639	55%	0.548	S	S	*	.	H	α-helix	trans	-62.8	-40.2	169.5	-90.2	151.3	0	0	0	112.3	A16 L23 Y24	A16-L20 WeakPolarHBondContact O-CB 3.46Å; A16-L20 WeakPolarHBondContact O-CD1 3.39Å; A16-L20 PolarHBondContact O-N 3.33Å; L20-L23 PolarHBondContact O-N 3.4Å; L20-Y24 WeakPolarHBondContact O-CB 3.36Å; L20-Y24 PolarHBondContact O-N 3.29Å
21	G	71.6	Confident	66.5	Low	40 Å²	40	99 Å²	99	41%	0.412	57%	0.569	S	S	.	*	H	α-helix	trans	-64.2	-40.4	175.1	0	0	0	0	0	112.9	C17 A18 Y24 A25	C17-G21 PolarHBondContact O-N 3.49Å; A18-G21 PolarHBondContact O-N 3.26Å; G21-Y24 PolarHBondContact O-N 2.84Å; G21-A25 WeakPolarHBondContact O-CB 3.16Å; G21-A25 PolarHBondContact O-N 3.29Å
22	L	70.1	Confident	64.5	Low	124 Å²	124	98.8 Å²	98.8	65%	0.649	58%	0.576	S	S	*	*	H	α-helix	trans	-69.3	-37	175.1	-77.8	162.8	0	0	0	112.4	A18 S19 A25 S26	A18-L22 WeakPolarHBondContact O-CB 3.47Å; A18-L22 WeakPolarHBondContact O-CG 3.47Å; A18-L22 PolarHBondContact O-N 2.91Å; S19-L22 PolarHBondContact O-N 3.2Å; L22-A25 PolarHBondContact O-N 2.94Å; L22-S26 WeakPolarHBondContact O-CB 3.05Å; L22-S26 PolarHBondContact O-N 3.47Å
23	L	67.2	Low	62.5	Low	119 Å²	119	102.1 Å²	102.1	62%	0.623	59%	0.59	S	S	*	*	H	α-helix	trans	-68.5	-36.7	175	-146.3	107.3	0	0	0	111.8	S19 L20 S26 T27	S19-L23 WeakPolarHBondContact O-CB 3.37Å; S19-L23 PolarHBondContact O-N 3.38Å; L20-L23 PolarHBondContact O-N 3.4Å; L23-S26 PolarHBondContact O-OG 2.98Å; L23-T27 WeakPolarHBondContact O-CG2 3.44Å; L23-T27 PolarHBondContact O-N 3.13Å; L23-T27 VanDerWaalsContact O-N 3.16Å; L23-T27 PolarHBondContact O-OG1 3.49Å
24	Y	68.1	Low	60.5	Low	153 Å²	153	102.3 Å²	102.3	60%	0.6	60%	0.599	S	S	*	*	H	α-helix	trans	-67.7	-36.2	172.6	-176.5	-98.2	0	0	0	112	L20 G21 T27	L20-Y24 WeakPolarHBondContact O-CB 3.36Å; L20-Y24 PolarHBondContact O-N 3.29Å; G21-Y24 PolarHBondContact O-N 2.84Å; Y24-T27 PolarHBondContact O-OG1 3.37Å
25	A	61.3	Low	58.3	Low	47 Å²	47	102.6 Å²	102.6	39%	0.388	60%	0.601	S	S	.	*	H	α-helix	trans	-71.5	-42.6	175.1	0	0	0	0	0	112.1	G21 L22 T27 R28	G21-A25 WeakPolarHBondContact O-CB 3.16Å; G21-A25 PolarHBondContact O-N 3.29Å; L22-A25 PolarHBondContact O-N 2.94Å; A25-T27 VanDerWaalsContact C-N 3.34Å; A25-T27 PolarHBondContact O-N 3.39Å; A25-R28 WeakPolarHBondContact O-CB 2.87Å; A25-R28 PolarHBondContact O-N 2.98Å
26	S	58.7	Low	56.3	Low	78 Å²	78	102.2 Å²	102.2	55%	0.545	61%	0.605	S	S	.	*	H	α-helix	trans	-70.8	-27.2	-178.3	79.3	0	0	0	0	113.7	L22 L23 R28	L22-S26 WeakPolarHBondContact O-CB 3.05Å; L22-S26 PolarHBondContact O-N 3.47Å; L23-S26 PolarHBondContact O-OG 2.98Å; S26-R28 PolarHBondContact O-N 3.37Å
27	T	54.6	Low	54.3	Low	95 Å²	95	107.4 Å²	107.4	58%	0.583	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-10.9	171.6	49.6	0	0	0	0	113.1	L23 Y24 A25	L23-T27 WeakPolarHBondContact O-CG2 3.44Å; L23-T27 PolarHBondContact O-N 3.13Å; L23-T27 VanDerWaalsContact O-N 3.16Å; L23-T27 PolarHBondContact O-OG1 3.49Å; Y24-T27 PolarHBondContact O-OG1 3.37Å; A25-T27 VanDerWaalsContact C-N 3.34Å; A25-T27 PolarHBondContact O-N 3.39Å
28	R	51.5	Low	52.5	Low	182 Å²	182	106.6 Å²	106.6	69%	0.687	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-25.4	178.1	-140.8	179.6	-175.1	166.1	1.8	113.3	A25 S26	A25-R28 WeakPolarHBondContact O-CB 2.87Å; A25-R28 PolarHBondContact O-N 2.98Å; S26-R28 PolarHBondContact O-N 3.37Å
29	D	42.4	Very low	50.4	Low	146 Å²	146	112.4 Å²	112.4	78%	0.781	65%	0.648	S	S	*	*			trans	-94.8	15.2	-179.1	-71.9	-28.9	0	0	0	113.7
30	A	36.5	Very low	48.9	Very low	60 Å²	60	115 Å²	115	50%	0.496	65%	0.647	S	S	.	*	S	Bend	trans	-57.8	137.8	162.1	0	0	0	0	0	108.4	S32	A30-S32 PolarHBondContact O-N 3.23Å
31	P	35.3	Very low	47	Very low	135 Å²	135	113.6 Å²	113.6	88%	0.877	65%	0.648	S	S	*	*			trans	-55.7	103.4	-175.6	21.5	-31.1	0	0	0	108.8	L33	P31-L33 PolarHBondContact O-N 3.33Å
32	S	37	Very low	45.2	Very low	98 Å²	98	114.3 Å²	114.3	69%	0.685	65%	0.645	S	S	*	*			trans	-72.5	127.7	178.7	31.4	0	0	0	0	106.6	A30	A30-S32 PolarHBondContact O-N 3.23Å
33	L	37.4	Very low	43.6	Very low	157 Å²	157	114 Å²	114	82%	0.822	65%	0.65	S	S	*	*			trans	-41.8	139.2	157	-82.3	142.1	0	0	0	108.3	P31 N35	P31-L33 PolarHBondContact O-N 3.33Å; L33-N35 PolarHBondContact O-N 3.03Å
34	P	37.3	Very low	42	Very low	119 Å²	119	119.7 Å²	119.7	77%	0.773	66%	0.664	S	S	*	*			trans	-47	121.9	-177.4	-18.1	22.1	0	0	0	109.7	P36	P34-P36 VanDerWaalsContact O-CD 3.31Å; P34-P36 WeakPolarHBondContact O-CD 3.31Å
35	N	34.4	Very low	40.4	Very low	126 Å²	126	114.8 Å²	114.8	67%	0.674	66%	0.66	S	S	*	*			trans	-42.5	115.5	177.8	-104.9	-26.6	0	0	0	109.9	L33 L37	L33-N35 PolarHBondContact O-N 3.03Å; N35-L37 HydrophobicContact CB-CG 4.46Å; N35-L37 PolarHBondContact O-N 2.7Å
36	P	39.5	Very low	38.7	Very low	101 Å²	101	117.7 Å²	117.7	66%	0.656	68%	0.675	S	S	*	*			trans	-81.6	50.5	172.2	35	-32.5	0	0	0	108.7	P34 A38	P34-P36 VanDerWaalsContact O-CD 3.31Å; P34-P36 WeakPolarHBondContact O-CD 3.31Å; P36-A38 PolarHBondContact O-N 3.21Å
37	L	35.6	Very low	37.4	Very low	152 Å²	152	120.1 Å²	120.1	80%	0.796	69%	0.689	S	S	*	*			trans	-89.9	53.3	169	-68.8	175.9	0	0	0	109.2	N35	N35-L37 HydrophobicContact CB-CG 4.46Å; N35-L37 PolarHBondContact O-N 2.7Å
38	A	37.4	Very low	36.3	Very low	64 Å²	64	124.3 Å²	124.3	53%	0.529	69%	0.694	S	S	.	*			trans	-109.5	105	160.5	0	0	0	0	0	106.7	P36 W40 K104	P36-A38 PolarHBondContact O-N 3.21Å; A38-W40 PolarHBondContact O-N 3.41Å; A38-K104 PolarHBondContact O-NZ 3.29Å
39	L	34.9	Very low	35.6	Very low	175 Å²	175	120.3 Å²	120.3	92%	0.916	69%	0.686	S	S	*	*			trans	-47.9	115.5	163.7	-119	90.3	0	0	0	106.9
40	W	41.9	Very low	35.3	Very low	121 Å²	121	118.9 Å²	118.9	46%	0.458	68%	0.678	S	S	.	*			trans	-62.7	139.6	174.4	174.8	80.6	0	0	0	109.4	A38 P42 E83	A38-W40 PolarHBondContact O-N 3.41Å; W40-P42 HydrophobicContact CE3-CB 4.26Å; W40-P42 VanDerWaalsContact CE3-CD 3.46Å; W40-P42 HydrophobicContact CE3-CG 3.84Å; W40-P42 VanDerWaalsContact CH2-CA 3.46Å; W40-P42 HydrophobicContact CH2-CB 3.23Å; W40-P42 HydrophobicContact CH2-CG 3.54Å; W40-P42 HydrophobicContact CZ2-CB 3.62Å; W40-P42 HydrophobicContact CZ2-CG 4.26Å; W40-P42 HydrophobicContact CZ3-CB 3.58Å; W40-P42 VanDerWaalsContact CZ3-CD 3.49Å; W40-P42 HydrophobicContact CZ3-CG 3.28Å; W40-E83 HydrophobicContact CZ3-CG 4.28Å
41	S	33.8	Very low	35.9	Very low	94 Å²	94	118.1 Å²	118.1	66%	0.657	67%	0.665	S	S	*	*			trans	-107.7	122.8	159.8	-66.4	0	0	0	0	106.8
42	P	34.9	Very low	36.3	Very low	55 Å²	55	115.9 Å²	115.9	36%	0.357	65%	0.651	S	S	.	*			trans	-54.3	155.6	171.1	-4	5.1	0	0	0	111.4	W40 R44	W40-P42 HydrophobicContact CE3-CB 4.26Å; W40-P42 VanDerWaalsContact CE3-CD 3.46Å; W40-P42 HydrophobicContact CE3-CG 3.84Å; W40-P42 VanDerWaalsContact CH2-CA 3.46Å; W40-P42 HydrophobicContact CH2-CB 3.23Å; W40-P42 HydrophobicContact CH2-CG 3.54Å; W40-P42 HydrophobicContact CZ2-CB 3.62Å; W40-P42 HydrophobicContact CZ2-CG 4.26Å; W40-P42 HydrophobicContact CZ3-CB 3.58Å; W40-P42 VanDerWaalsContact CZ3-CD 3.49Å; W40-P42 HydrophobicContact CZ3-CG 3.28Å; P42-R44 PolarHBondContact O-N 2.95Å
43	P	35.9	Very low	37.1	Very low	116 Å²	116	116.9 Å²	116.9	75%	0.753	65%	0.649	S	S	*	*			trans	-51.6	110.3	149.2	-3.6	15	0	0	0	106.5	G45	P43-G45 VanDerWaalsContact C-N 3.25Å; P43-G45 PolarHBondContact O-N 2.8Å
44	R	33.4	Very low	38.1	Very low	239 Å²	239	110.3 Å²	110.3	90%	0.902	61%	0.614	S	S	*	*			trans	-69	87	177.7	-73.3	-175.8	-179.4	-178.4	0.6	108.4	P42	P42-R44 PolarHBondContact O-N 2.95Å
45	G	33.8	Very low	39.3	Very low	51 Å²	51	107.9 Å²	107.9	53%	0.526	60%	0.604	S	S	.	*			trans	-101.1	150	147.1	0	0	0	0	0	108.1	P43	P43-G45 VanDerWaalsContact C-N 3.25Å; P43-G45 PolarHBondContact O-N 2.8Å
46	P	26.9	Very low	41.2	Very low	107 Å²	107	104 Å²	104	70%	0.695	59%	0.585	S	S	*	*			trans	-51.4	145.8	162.5	25.7	-32.2	0	0	0	107.8	R48	P46-R48 PolarHBondContact O-N 3.16Å
47	P	30.6	Very low	43.2	Very low	129 Å²	129	103 Å²	103	84%	0.838	57%	0.572	S	S	*	*			trans	-59.9	91.8	167.1	25.8	-30.9	0	0	0	106.4	L49	P47-L49 PolarHBondContact O-N 3.14Å; P47-L49 VanDerWaalsContact O-N 3.13Å
48	R	31.7	Very low	45.5	Very low	184 Å²	184	101.7 Å²	101.7	69%	0.694	57%	0.572	S	S	*	*			trans	-69.7	110.8	158.2	-88.1	-172.5	173.7	175.5	-2.3	103.4	P46 D50	P46-R48 PolarHBondContact O-N 3.16Å; R48-D50 HydrophobicContact CB-CB 4.33Å; R48-D50 PolarHBondContact O-N 3.34Å
49	L	36.1	Very low	47.8	Very low	98 Å²	98	104.9 Å²	104.9	51%	0.513	57%	0.571	S	S	.	*			trans	-53.8	63.6	143.1	-85.5	143	0	0	0	107.8	P47 L51 V72	P47-L49 PolarHBondContact O-N 3.14Å; P47-L49 VanDerWaalsContact O-N 3.13Å; L49-L51 HydrophobicContact CB-CD1 4.08Å; L49-L51 HydrophobicContact CD2-CD1 3.37Å; L49-L51 HydrophobicContact CD2-CG 3.99Å; L49-L51 HydrophobicContact CG-CD1 4.34Å; L49-L51 PolarHBondContact O-N 3.49Å; L49-V72 HydrophobicContact CD2-CG1 4.1Å
50	D	35.8	Very low	50.2	Low	116 Å²	116	96.7 Å²	96.7	62%	0.62	53%	0.528	S	S	*	.			trans	-74.3	85.1	160.4	-76.8	-24.2	0	0	0	102.7	R48 P52	R48-D50 HydrophobicContact CB-CB 4.33Å; R48-D50 PolarHBondContact O-N 3.34Å; D50-P52 WeakPolarHBondContact O-CD 3.21Å
51	L	49.4	Very low	52.2	Low	43 Å²	43	93.6 Å²	93.6	23%	0.225	53%	0.528	C	S	.	.			trans	-91.1	85.7	167.1	-74.1	148.3	0	0	0	105	L49 D53 L54 V72	L49-L51 HydrophobicContact CB-CD1 4.08Å; L49-L51 HydrophobicContact CD2-CD1 3.37Å; L49-L51 HydrophobicContact CD2-CG 3.99Å; L49-L51 HydrophobicContact CG-CD1 4.34Å; L49-L51 PolarHBondContact O-N 3.49Å; L51-D53 PolarHBondContact O-N 3.44Å; L51-D53 VanDerWaalsContact O-N 3.13Å; L51-L54 HydrophobicContact CB-CB 3.79Å; L51-L54 HydrophobicContact CB-CD1 4.01Å; L51-L54 HydrophobicContact CB-CG 4.04Å; L51-L54 HydrophobicContact CD1-CD1 3.4Å; L51-L54 HydrophobicContact CD1-CG 4.34Å; L51-L54 HydrophobicContact CD2-CD1 3.98Å; L51-L54 HydrophobicContact CD2-CG 4.47Å; L51-L54 HydrophobicContact CG-CD1 3.98Å; L51-L54 PolarHBondContact O-N 3.4Å; L51-V72 HydrophobicContact CD1-CG1 4.03Å; L51-V72 HydrophobicContact CD2-CG1 4.27Å
52	P	45.3	Very low	54.8	Low	89 Å²	89	95.5 Å²	95.5	58%	0.578	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-60.4	-28.8	-177	-13.9	32	0	0	0	110	D50 L54 A55	D50-P52 WeakPolarHBondContact O-CD 3.21Å; P52-L54 VanDerWaalsContact C-N 3.33Å; P52-L54 PolarHBondContact O-N 3.17Å; P52-A55 WeakPolarHBondContact O-CB 3.44Å; P52-A55 PolarHBondContact O-N 3.27Å
53	D	52.4	Low	57.5	Low	119 Å²	119	93.6 Å²	93.6	64%	0.636	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-77.8	-9.2	178.6	-61.4	-24.3	0	0	0	114.4	L51 L161	L51-D53 PolarHBondContact O-N 3.44Å; L51-D53 VanDerWaalsContact O-N 3.13Å; D53-L161 HydrophobicContact CB-CD1 3.81Å
54	L	58.2	Low	60.1	Low	19 Å²	19	92.6 Å²	92.6	10%	0.099	51%	0.506	C	S	.	.	G	3₁₀ helix	trans	-103.9	1.7	172.4	-71.9	179.5	0	0	0	113.1	L51 P52 P56 V72 L161 A190 L222	L51-L54 HydrophobicContact CB-CB 3.79Å; L51-L54 HydrophobicContact CB-CD1 4.01Å; L51-L54 HydrophobicContact CB-CG 4.04Å; L51-L54 HydrophobicContact CD1-CD1 3.4Å; L51-L54 HydrophobicContact CD1-CG 4.34Å; L51-L54 HydrophobicContact CD2-CD1 3.98Å; L51-L54 HydrophobicContact CD2-CG 4.47Å; L51-L54 HydrophobicContact CG-CD1 3.98Å; L51-L54 PolarHBondContact O-N 3.4Å; P52-L54 VanDerWaalsContact C-N 3.33Å; P52-L54 PolarHBondContact O-N 3.17Å; L54-P56 WeakPolarHBondContact O-CD 3.46Å; L54-V72 HydrophobicContact CD1-CG2 4.22Å; L54-L161 HydrophobicContact CD2-CD1 3.42Å; L54-L161 VanDerWaalsContact CD2-CD1 3.42Å; L54-L161 HydrophobicContact CD2-CD2 3.65Å; L54-L161 HydrophobicContact CD2-CG 4.18Å; L54-L161 HydrophobicContact CG-CD1 3.64Å; L54-A190 HydrophobicContact CD1-CB 4.34Å; L54-A190 HydrophobicContact CD2-CB 3.95Å; L54-L222 HydrophobicContact CD2-CD2 3.64Å
55	A	64.2	Low	62.8	Low	67 Å²	67	83 Å²	83	55%	0.554	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-60.1	122.5	174.4	0	0	0	0	0	109.3	P52 E57	P52-A55 WeakPolarHBondContact O-CB 3.44Å; P52-A55 PolarHBondContact O-N 3.27Å; A55-E57 PolarHBondContact O-N 2.62Å
56	P	74.4	Confident	65.7	Low	44 Å²	44	87.7 Å²	87.7	29%	0.286	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-58.1	141.9	175.1	14.9	-22.9	0	0	0	110.7	L54 A61 R218	L54-P56 WeakPolarHBondContact O-CD 3.46Å; P56-A61 HydrophobicContact CB-CB 3.88Å; P56-A61 HydrophobicContact CG-CB 3.69Å; P56-R218 VanDerWaalsContact CA-NH1 3.28Å; P56-R218 VanDerWaalsContact CB-CZ 3.48Å; P56-R218 VanDerWaalsContact CB-NH1 3.32Å
57	E	80.4	Confident	68.8	Low	82 Å²	82	86.1 Å²	86.1	38%	0.383	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-52.2	136.1	155.6	-77.8	166.1	-134	0	0	108.6	A55 R59 Y60 A61 Q221	A55-E57 PolarHBondContact O-N 2.62Å; E57-R59 PolarHBondContact O-N 3.39Å; E57-Y60 HydrophobicContact CB-CD2 4.08Å; E57-Y60 HydrophobicContact CB-CE2 4.46Å; E57-Y60 PolarHBondContact O-N 3.01Å; E57-A61 PolarHBondContact O-N 2.93Å; E57-Q221 PolarHBondContact OE1-NE2 3.03Å
58	P	84.1	Confident	71.8	Confident	123 Å²	123	81.2 Å²	81.2	80%	0.799	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-50.5	-33.4	-174.8	-30.2	34.9	0	0	0	113.7	Y60 A61	P58-Y60 VanDerWaalsContact C-N 3.29Å; P58-Y60 PolarHBondContact O-N 2.95Å; P58-A61 PolarHBondContact O-N 3.22Å
59	R	84.8	Confident	74.5	Confident	132 Å²	132	78.2 Å²	78.2	50%	0.498	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-57.3	-37.6	176.6	-175.7	176.8	168.5	179.6	-8.2	113.2	E57 H62 D214	E57-R59 PolarHBondContact O-N 3.39Å; R59-H62 PolarHBondContact O-CE1 3.22Å; R59-H62 PolarHBondContact O-ND1 3.18Å; R59-H62 VanDerWaalsContact O-ND1 3.09Å; R59-D214 IonicContact CZ-OD1 3.72Å; R59-D214 IonicContact NE-OD1 3.68Å; R59-D214 IonicContact NH2-OD1 2.99Å; R59-D214 PolarHBondContact NH2-OD1 3.48Å
60	Y	87.1	Confident	77	Confident	2 Å²	2	80.8 Å²	80.8	1%	0.008	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-107.3	3.5	-174.4	-46.6	-58	0	0	0	113.7	E57 P58 H62 I63 D214 N217	E57-Y60 HydrophobicContact CB-CD2 4.08Å; E57-Y60 HydrophobicContact CB-CE2 4.46Å; E57-Y60 PolarHBondContact O-N 3.01Å; P58-Y60 VanDerWaalsContact C-N 3.29Å; P58-Y60 PolarHBondContact O-N 2.95Å; Y60-H62 PolarHBondContact O-N 3.11Å; Y60-H62 VanDerWaalsContact O-N 3.1Å; Y60-I63 WeakPolarHBondContact O-CB 3.41Å; Y60-I63 PolarHBondContact O-N 3.25Å; Y60-D214 HydrophobicContact CD1-CB 4.02Å; Y60-D214 HydrophobicContact CE1-CB 4.05Å; Y60-N217 HydrophobicContact CE1-CB 4.05Å; Y60-N217 HydrophobicContact CE2-CB 3.92Å; Y60-N217 PolarHBondContact OH-ND2 3.18Å
61	A	83.3	Confident	79.6	Confident	56 Å²	56	75.4 Å²	75.4	46%	0.463	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-24.1	-176.5	0	0	0	0	0	114.1	P56 E57 P58 I63	P56-A61 HydrophobicContact CB-CB 3.88Å; P56-A61 HydrophobicContact CG-CB 3.69Å; E57-A61 PolarHBondContact O-N 2.93Å; P58-A61 PolarHBondContact O-N 3.22Å; A61-I63 VanDerWaalsContact C-N 3.27Å; A61-I63 PolarHBondContact O-N 3.03Å
62	H	87.8	Confident	81.5	Confident	135 Å²	135	73.5 Å²	73.5	63%	0.625	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-11.1	177.6	67.8	-83.3	0	0	0	113.7	R59 Y60	R59-H62 PolarHBondContact O-CE1 3.22Å; R59-H62 PolarHBondContact O-ND1 3.18Å; R59-H62 VanDerWaalsContact O-ND1 3.09Å; Y60-H62 PolarHBondContact O-N 3.11Å; Y60-H62 VanDerWaalsContact O-N 3.1Å
63	I	91.4	Very high	83.4	Confident	15 Å²	15	71.2 Å²	71.2	8%	0.077	39%	0.388	C	S	.	.	S	Bend	trans	-90.2	117.4	-178.1	-58.6	176.9	0	0	0	109.3	Y60 A61 V193 D214 R215 R218	Y60-I63 WeakPolarHBondContact O-CB 3.41Å; Y60-I63 PolarHBondContact O-N 3.25Å; A61-I63 VanDerWaalsContact C-N 3.27Å; A61-I63 PolarHBondContact O-N 3.03Å; I63-V193 HydrophobicContact CG2-CG1 3.58Å; I63-D214 HydrophobicContact CD1-CB 3.89Å; I63-D214 WeakPolarHBondContact CD1-O 3.3Å; I63-R215 HydrophobicContact CD1-CG 4.27Å; I63-R215 HydrophobicContact CG2-CG 4.42Å; I63-R218 HydrophobicContact CB-CB 4.34Å; I63-R218 HydrophobicContact CB-CG 3.97Å; I63-R218 HydrophobicContact CD1-CB 4.11Å; I63-R218 HydrophobicContact CG2-CB 4.19Å; I63-R218 HydrophobicContact CG2-CG 3.9Å
64	P	90.2	Very high	85.1	Confident	95 Å²	95	70 Å²	70	62%	0.617	38%	0.381	S	S	*	.			trans	-70.1	147.3	-176.6	29.4	-34.8	0	0	0	111.7
65	V	91.3	Very high	86.5	Confident	37 Å²	37	69.7 Å²	69.7	22%	0.224	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	133.2	-179.9	-179	0	0	0	0	109	I67 E192 V193 R218 L222	V65-I67 HydrophobicContact CG1-CD1 3.91Å; V65-E192 WeakPolarHBondContact CA-O 3.37Å; V65-V193 HydrophobicContact CG2-CG2 4.16Å; V65-R218 HydrophobicContact CG2-CG 4.24Å; V65-L222 HydrophobicContact CB-CD1 4.27Å; V65-L222 HydrophobicContact CG1-CD1 3.36Å; V65-L222 HydrophobicContact CG2-CD1 3.86Å
66	K	93.6	Very high	87	Confident	150 Å²	150	70.7 Å²	70.7	65%	0.652	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	106.5	168.3	-175.8	-174.9	175.7	-168.4	0	109.2	G191 E192	K66-G191 CarbonylContact O-C 3.46Å; K66-G191 WeakPolarHBondContact O-CA 3.47Å; K66-E192 PolarHBondContact N-O 2.91Å; K66-E192 PolarHBondContact O-N 2.86Å
67	I	92.4	Very high	86.7	Confident	73 Å²	73	72 Å²	72	37%	0.374	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	138.1	-176.4	-59.7	-61.4	0	0	0	111.6	V65 V72	V65-I67 HydrophobicContact CG1-CD1 3.91Å; I67-V72 HydrophobicContact CG2-CG2 3.69Å
68	K	93.4	Very high	86.1	Confident	27 Å²	27	75 Å²	75	12%	0.117	40%	0.4	C	S	.	.			trans	-97.1	88.7	171.6	-77.5	-180	164.9	159.7	0	109.3	Q70 V71 V72 V189 A190 E192 E201	K68-Q70 PolarHBondContact O-N 3.39Å; K68-Q70 VanDerWaalsContact O-N 3.11Å; K68-V71 HydrophobicContact CB-CB 4.18Å; K68-V71 HydrophobicContact CB-CG2 3.97Å; K68-V71 HydrophobicContact CD-CG2 4.31Å; K68-V71 PolarHBondContact O-N 2.58Å; K68-V72 PolarHBondContact O-N 3.2Å; K68-V189 HydrophobicContact CD-CG2 4.07Å; K68-V189 WeakPolarHBondContact CD-O 3.38Å; K68-A190 PolarHBondContact N-O 3.27Å; K68-E192 HydrophobicContact CD-CG 4.3Å; K68-E192 VanDerWaalsContact CE-CD 3.49Å; K68-E192 WeakPolarHBondContact CE-OE1 3.29Å; K68-E192 IonicContact NZ-OE1 2.78Å; K68-E192 PolarHBondContact NZ-OE1 3.09Å; K68-E201 IonicContact NZ-OE1 2.58Å; K68-E201 PolarHBondContact NZ-OE1 2.78Å; K68-E201 IonicContact NZ-OE2 3.09Å; K68-E201 PolarHBondContact NZ-OE2 3.46Å; K68-E201 VanDerWaalsContact NZ-OE2 3.09Å
69	E	89.3	Confident	85.3	Confident	120 Å²	120	73.7 Å²	73.7	56%	0.561	39%	0.386	S	S	*	.	H	α-helix	trans	-52.5	-37.2	-177	-66.2	-60.7	158.9	0	0	113.5	V71 V72 G73	E69-V71 VanDerWaalsContact C-N 3.31Å; E69-V71 PolarHBondContact O-N 2.75Å; E69-V72 PolarHBondContact O-N 3.34Å; E69-G73 PolarHBondContact O-N 3.43Å
70	Q	89.2	Confident	84.6	Confident	153 Å²	153	73.4 Å²	73.4	72%	0.715	40%	0.403	S	S	*	.	H	α-helix	trans	-62.5	-35.2	177.7	67.7	-163.7	4	0	0	113.4	K68	K68-Q70 PolarHBondContact O-N 3.39Å; K68-Q70 VanDerWaalsContact O-N 3.11Å
71	V	89.6	Confident	83.7	Confident	3 Å²	3	76.3 Å²	76.3	2%	0.018	42%	0.423	C	S	.	.	H	α-helix	trans	-82.4	-43.6	179.2	-177.5	0	0	0	0	109.9	K68 E69 G73 L74 D188 T224	K68-V71 HydrophobicContact CB-CB 4.18Å; K68-V71 HydrophobicContact CB-CG2 3.97Å; K68-V71 HydrophobicContact CD-CG2 4.31Å; K68-V71 PolarHBondContact O-N 2.58Å; E69-V71 VanDerWaalsContact C-N 3.31Å; E69-V71 PolarHBondContact O-N 2.75Å; V71-G73 PolarHBondContact O-N 2.86Å; V71-L74 WeakPolarHBondContact O-CB 3.43Å; V71-L74 PolarHBondContact O-N 3.42Å; V71-D188 HydrophobicContact CG1-CB 4.15Å; V71-D188 WeakPolarHBondContact CG2-OD2 3.37Å; V71-T224 HydrophobicContact CG1-CG2 3.97Å
72	V	88.6	Confident	82.9	Confident	2 Å²	2	77.6 Å²	77.6	1%	0.012	43%	0.428	C	S	.	.	H	α-helix	trans	-58.3	-35.6	174.5	173.7	0	0	0	0	111.5	L49 L51 L54 I67 K68 E69 L74 L75 A190	L49-V72 HydrophobicContact CD2-CG1 4.1Å; L51-V72 HydrophobicContact CD1-CG1 4.03Å; L51-V72 HydrophobicContact CD2-CG1 4.27Å; L54-V72 HydrophobicContact CD1-CG2 4.22Å; I67-V72 HydrophobicContact CG2-CG2 3.69Å; K68-V72 PolarHBondContact O-N 3.2Å; E69-V72 PolarHBondContact O-N 3.34Å; V72-L74 PolarHBondContact O-N 3.44Å; V72-L75 WeakPolarHBondContact O-CB 3.45Å; V72-L75 PolarHBondContact O-N 3.04Å; V72-A190 HydrophobicContact CG2-CB 3.97Å
73	G	85.6	Confident	81.7	Confident	42 Å²	42	76.3 Å²	76.3	43%	0.433	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-17	174.8	0	0	0	0	0	115.1	E69 V71	E69-G73 PolarHBondContact O-N 3.43Å; V71-G73 PolarHBondContact O-N 2.86Å
74	L	88.1	Confident	80.1	Confident	93 Å²	93	79 Å²	79	49%	0.487	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-23.7	175.6	-58.2	174.4	0	0	0	112.8	V71 V72	V71-L74 WeakPolarHBondContact O-CB 3.43Å; V71-L74 PolarHBondContact O-N 3.42Å; V72-L74 PolarHBondContact O-N 3.44Å
75	L	87.3	Confident	78.1	Confident	12 Å²	12	84.8 Å²	84.8	6%	0.063	45%	0.452	C	S	.	.	B	Isolated β-bridge	trans	-67.5	149.2	-179.6	-62.3	177.6	0	0	0	111.1	V72 Q77 I160 L161 A190 T224	V72-L75 WeakPolarHBondContact O-CB 3.45Å; V72-L75 PolarHBondContact O-N 3.04Å; L75-Q77 PolarHBondContact O-N 3.33Å; L75-Q77 VanDerWaalsContact O-N 3.16Å; L75-I160 VanDerWaalsContact CD2-C 3.49Å; L75-L161 HydrophobicContact CD1-CD1 3.77Å; L75-L161 HydrophobicContact CD1-CD2 4.27Å; L75-L161 HydrophobicContact CD1-CG 3.74Å; L75-L161 HydrophobicContact CD2-CG 4.22Å; L75-A190 HydrophobicContact CD1-CB 4.46Å; L75-T224 HydrophobicContact CD1-CG2 4.31Å; L75-T224 HydrophobicContact CD2-CG2 3.84Å; L75-T224 HydrophobicContact CG-CG2 4.45Å
76	T	74.4	Confident	76.1	Confident	89 Å²	89	85.6 Å²	85.6	55%	0.546	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-64.4	116.6	175.9	-34.4	0	0	0	0	109.4
77	Q	69.4	Low	73.8	Confident	71 Å²	71	82 Å²	82	33%	0.332	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-94.6	126	178.4	-55.3	-179.7	-17.2	0	0	109.2	L75 N79	L75-Q77 PolarHBondContact O-N 3.33Å; L75-Q77 VanDerWaalsContact O-N 3.16Å; Q77-N79 WeakPolarHBondContact CB-OD1 3.45Å; Q77-N79 PolarHBondContact O-N 2.94Å; Q77-N79 PolarHBondContact OE1-OD1 3.14Å
78	N	67.9	Low	71.4	Confident	146 Å²	146	84 Å²	84	78%	0.781	49%	0.494	S	S	*	.	S	Bend	trans	-76.1	26.5	178.4	-68.9	-21.6	0	0	0	113.1
79	N	66.9	Low	69.2	Low	95 Å²	95	90.6 Å²	90.6	51%	0.508	52%	0.523	S	S	.	.			trans	-131.1	31.3	-172.6	68.4	0.9	0	0	0	111.9	Q77 S81	Q77-N79 WeakPolarHBondContact CB-OD1 3.45Å; Q77-N79 PolarHBondContact O-N 2.94Å; Q77-N79 PolarHBondContact OE1-OD1 3.14Å; N79-S81 PolarHBondContact O-N 3.39Å
80	C	69.9	Low	67.3	Low	126 Å²	126	89.8 Å²	89.8	85%	0.851	54%	0.536	S	S	*	.			trans	-51.7	128.4	-174.6	65.6	0	0	0	0	111.4
81	S	68.9	Low	65.5	Low	62 Å²	62	89.4 Å²	89.4	43%	0.434	53%	0.533	S	S	.	.			trans	-125.3	147.7	179.4	68.6	0	0	0	0	110	N79 E83	N79-S81 PolarHBondContact O-N 3.39Å; S81-E83 PolarHBondContact O-N 2.9Å; S81-E83 WeakPolarHBondContact OG-CG 3.38Å
82	C	65.9	Low	63.7	Low	83 Å²	83	94.8 Å²	94.8	56%	0.561	57%	0.568	S	S	*	*			trans	-80.2	43.5	173.6	-73	0	0	0	0	111.2	A99	C82-A99 HydrophobicContact CB-CB 3.87Å; C82-A99 WeakPolarHBondContact O-CB 3.4Å
83	E	63.3	Low	62.1	Low	109 Å²	109	104.1 Å²	104.1	51%	0.509	61%	0.609	S	S	.	*			trans	-88.7	139.2	178.7	-71.3	178.8	-171.9	0	0	111.3	W40 S81 R85	W40-E83 HydrophobicContact CZ3-CG 4.28Å; S81-E83 PolarHBondContact O-N 2.9Å; S81-E83 WeakPolarHBondContact OG-CG 3.38Å; E83-R85 PolarHBondContact O-N 3.32Å; E83-R85 VanDerWaalsContact O-N 3.07Å
84	S	56.2	Low	60.6	Low	71 Å²	71	108 Å²	108	50%	0.497	62%	0.615	S	S	.	*			trans	-69.3	103.8	168	173	0	0	0	0	108.4	G86	S84-G86 VanDerWaalsContact C-N 3.32Å; S84-G86 PolarHBondContact O-N 3.46Å
85	R	49.6	Very low	59	Low	217 Å²	217	115 Å²	115	82%	0.819	64%	0.635	S	S	*	*			trans	-65.3	91.3	170.4	-77	-173.8	174.8	-168.8	-2.5	109.4	E83	E83-R85 PolarHBondContact O-N 3.32Å; E83-R85 VanDerWaalsContact O-N 3.07Å
86	G	49.1	Very low	57.7	Low	53 Å²	53	122.8 Å²	122.8	55%	0.546	67%	0.672	S	S	.	*	S	Bend	trans	176	119.9	174.7	0	0	0	0	0	111.9	S84 S88	S84-G86 VanDerWaalsContact C-N 3.32Å; S84-G86 PolarHBondContact O-N 3.46Å; G86-S88 PolarHBondContact O-N 2.87Å
87	G	45.4	Very low	57.2	Low	75 Å²	75	122.8 Å²	122.8	77%	0.773	67%	0.671	S	S	*	*			trans	-53.4	136.5	170.1	0	0	0	0	0	110.8	F89	G87-F89 PolarHBondContact O-N 2.89Å
88	S	42.6	Very low	57.3	Low	116 Å²	116	130.7 Å²	130.7	81%	0.811	70%	0.698	S	S	*	*	S	Bend	trans	-61.3	88.9	-178.6	170.8	0	0	0	0	112.1	G86	G86-S88 PolarHBondContact O-N 2.87Å
89	F	47.2	Very low	57.7	Low	164 Å²	164	126.2 Å²	126.2	72%	0.719	68%	0.682	S	S	*	*			trans	-133.8	103.8	152.8	-78.3	-78.9	0	0	0	108.3	G87 F91 Q94	G87-F89 PolarHBondContact O-N 2.89Å; F89-F91 HydrophobicContact CB-CD2 4.49Å; F89-F91 HydrophobicContact CB-CE2 4.2Å; F89-F91 PolarHBondContact O-N 3.45Å; F89-Q94 PolarHBondContact O-OE1 2.92Å
90	A	47.8	Very low	58.3	Low	103 Å²	103	126.7 Å²	126.7	85%	0.851	69%	0.688	S	S	*	*			trans	-75.3	93.2	179	0	0	0	0	0	109.9
91	F	51.7	Low	59	Low	146 Å²	146	123 Å²	123	64%	0.64	66%	0.66	S	S	*	*			trans	-78.9	140.7	163.4	-74.4	-82.2	0	0	0	109.8	F89 F93 Q94	F89-F91 HydrophobicContact CB-CD2 4.49Å; F89-F91 HydrophobicContact CB-CE2 4.2Å; F89-F91 PolarHBondContact O-N 3.45Å; F91-F93 PolarHBondContact O-N 3.5Å; F91-Q94 HydrophobicContact CB-CB 4.49Å; F91-Q94 PolarHBondContact O-N 3.41Å; F91-Q94 VanDerWaalsContact O-N 3.11Å
92	P	53.1	Low	59.9	Low	116 Å²	116	126.5 Å²	126.5	75%	0.753	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	-1.5	-173.9	19.6	-29.3	0	0	0	115.7
93	F	55.1	Low	60.9	Low	197 Å²	197	125.3 Å²	125.3	86%	0.864	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.3	6.8	179.6	-61.6	-77.3	0	0	0	114.4	F91 R95	F91-F93 PolarHBondContact O-N 3.5Å; F93-R95 PolarHBondContact O-N 2.93Å
94	Q	54	Low	62.1	Low	123 Å²	123	124.6 Å²	124.6	58%	0.575	66%	0.658	S	S	*	*			trans	-81.5	119	-179.1	-152.1	167.3	-11.3	0	0	110	F89 F91 Q96	F89-Q94 PolarHBondContact O-OE1 2.92Å; F91-Q94 HydrophobicContact CB-CB 4.49Å; F91-Q94 PolarHBondContact O-N 3.41Å; F91-Q94 VanDerWaalsContact O-N 3.11Å; Q94-Q96 PolarHBondContact O-N 3.4Å
95	R	54.4	Low	63.7	Low	241 Å²	241	125.1 Å²	125.1	91%	0.909	67%	0.666	S	S	*	*			trans	-56.9	109.9	174.1	-80.4	-179.2	174.1	177.6	-1.6	108.8	F93 V97	F93-R95 PolarHBondContact O-N 2.93Å; R95-V97 PolarHBondContact O-N 3.36Å
96	Q	59.1	Low	65.5	Low	176 Å²	176	118.5 Å²	118.5	82%	0.822	64%	0.644	S	S	*	*			trans	-62.3	126.9	172.9	-72.1	-178.3	-20.7	0	0	109.3	Q94 R98	Q94-Q96 PolarHBondContact O-N 3.4Å; Q96-R98 PolarHBondContact O-N 3.33Å
97	V	64.2	Low	67.5	Low	89 Å²	89	122.1 Å²	122.1	54%	0.539	65%	0.65	S	S	.	*			trans	-67.1	114.9	171.7	179.1	0	0	0	0	107.4	R95	R95-V97 PolarHBondContact O-N 3.36Å
98	R	70.6	Confident	69.7	Low	236 Å²	236	123.5 Å²	123.5	89%	0.891	64%	0.644	S	S	*	*			trans	-86.6	113.1	172.6	-70	-175.7	-179.8	177	-0.2	108.5	Q96	Q96-R98 PolarHBondContact O-N 3.33Å
99	A	75.9	Confident	71.8	Confident	53 Å²	53	124.1 Å²	124.1	44%	0.438	63%	0.634	S	S	.	*			trans	-107.8	135.8	171.4	0	0	0	0	0	109.1	C82	C82-A99 HydrophobicContact CB-CB 3.87Å; C82-A99 WeakPolarHBondContact O-CB 3.4Å
100	V	81	Confident	73.7	Confident	105 Å²	105	121 Å²	121	64%	0.636	62%	0.622	S	S	*	*			trans	-119.1	119.2	-177.9	-178.1	0	0	0	0	108.4	L102	V100-L102 HydrophobicContact CG1-CD2 4.07Å; V100-L102 PolarHBondContact O-N 3.48Å
101	D	83	Confident	75.7	Confident	49 Å²	49	117.9 Å²	117.9	26%	0.262	59%	0.591	S	S	.	*			trans	-84.4	105.2	171.3	179.8	-0.2	0	0	0	109.3	T103 K104	D101-T103 VanDerWaalsContact CG-OG1 3.26Å; D101-T103 PolarHBondContact O-N 3.45Å; D101-T103 WeakPolarHBondContact OD1-CB 3.45Å; D101-T103 PolarHBondContact OD1-N 3.03Å; D101-T103 PolarHBondContact OD1-OG1 3.41Å; D101-T103 PolarHBondContact OD2-OG1 3.09Å; D101-K104 HydrophobicContact CB-CD 4.17Å; D101-K104 HydrophobicContact CB-CG 4.21Å; D101-K104 PolarHBondContact O-N 2.79Å; D101-K104 WeakPolarHBondContact OD2-CE 3.47Å
102	L	88.3	Confident	77.4	Confident	134 Å²	134	116.5 Å²	116.5	70%	0.702	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-70.3	-15.7	-178.4	-61.4	177.4	0	0	0	113	V100 K104 A105	V100-L102 HydrophobicContact CG1-CD2 4.07Å; V100-L102 PolarHBondContact O-N 3.48Å; L102-K104 VanDerWaalsContact C-N 3.25Å; L102-K104 PolarHBondContact O-N 2.99Å; L102-A105 WeakPolarHBondContact O-CB 3.22Å; L102-A105 PolarHBondContact O-N 2.85Å
103	T	87.9	Confident	79	Confident	58 Å²	58	113.9 Å²	113.9	36%	0.356	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-70.8	-25.4	178.1	69.1	0	0	0	0	112.2	D101 A105 F106 L111	D101-T103 VanDerWaalsContact CG-OG1 3.26Å; D101-T103 PolarHBondContact O-N 3.45Å; D101-T103 WeakPolarHBondContact OD1-CB 3.45Å; D101-T103 PolarHBondContact OD1-N 3.03Å; D101-T103 PolarHBondContact OD1-OG1 3.41Å; D101-T103 PolarHBondContact OD2-OG1 3.09Å; T103-A105 PolarHBondContact O-N 3.36Å; T103-A105 VanDerWaalsContact O-N 3.16Å; T103-F106 PolarHBondContact O-N 3.49Å; T103-L111 HydrophobicContact CG2-CD1 4.36Å
104	K	88.5	Confident	80.5	Confident	95 Å²	95	106.4 Å²	106.4	41%	0.413	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-70.1	-5.1	176.3	-63.6	-176.6	-179.5	179.2	0	114	A38 D101 L102 F106	A38-K104 PolarHBondContact O-NZ 3.29Å; D101-K104 HydrophobicContact CB-CD 4.17Å; D101-K104 HydrophobicContact CB-CG 4.21Å; D101-K104 PolarHBondContact O-N 2.79Å; D101-K104 WeakPolarHBondContact OD2-CE 3.47Å; L102-K104 VanDerWaalsContact C-N 3.25Å; L102-K104 PolarHBondContact O-N 2.99Å; K104-F106 PolarHBondContact O-N 2.94Å
105	A	90.1	Very high	82.3	Confident	81 Å²	81	104.2 Å²	104.2	67%	0.669	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-75.4	-9.8	171.2	0	0	0	0	0	112.9	L102 T103	L102-A105 WeakPolarHBondContact O-CB 3.22Å; L102-A105 PolarHBondContact O-N 2.85Å; T103-A105 PolarHBondContact O-N 3.36Å; T103-A105 VanDerWaalsContact O-N 3.16Å
106	F	87.5	Confident	83.9	Confident	78 Å²	78	96.8 Å²	96.8	34%	0.342	52%	0.516	S	S	.	.	S	Bend	trans	-122.4	146.5	-175.8	-55.4	-82.5	0	0	0	111	T103 K104 E110 L111 V114	T103-F106 PolarHBondContact O-N 3.49Å; K104-F106 PolarHBondContact O-N 2.94Å; F106-E110 HydrophobicContact CB-CG 4.47Å; F106-E110 HydrophobicContact CD1-CG 4.07Å; F106-L111 HydrophobicContact CB-CB 3.99Å; F106-L111 HydrophobicContact CB-CD1 4.34Å; F106-L111 HydrophobicContact CD2-CD1 4.12Å; F106-L111 HydrophobicContact CG-CD1 4.49Å; F106-V114 HydrophobicContact CD1-CG2 4.22Å; F106-V114 HydrophobicContact CE1-CG1 4.4Å; F106-V114 HydrophobicContact CE1-CG2 4.19Å; F106-V114 HydrophobicContact CZ-CG1 4.34Å
107	D	91.3	Very high	85.1	Confident	129 Å²	129	90 Å²	90	69%	0.69	49%	0.486	S	S	*	.			trans	-70.4	160.4	168.2	-69.8	-29.5	0	0	0	110.8	E109 E110 L111	D107-E109 PolarHBondContact O-N 3.45Å; D107-E110 HydrophobicContact CB-CB 4.48Å; D107-E110 PolarHBondContact O-N 3.32Å; D107-L111 WeakPolarHBondContact O-CB 3.42Å; D107-L111 PolarHBondContact O-N 3.23Å
108	T	90.2	Very high	86.4	Confident	104 Å²	104	92.4 Å²	92.4	64%	0.638	49%	0.486	S	S	*	.	H	α-helix	trans	-60.1	-41.4	-170.1	-51.8	0	0	0	0	114.2	K112	T108-K112 WeakPolarHBondContact O-CG 3.49Å; T108-K112 PolarHBondContact O-N 3.38Å
109	E	87.7	Confident	87.3	Confident	129 Å²	129	85.3 Å²	85.3	60%	0.603	46%	0.463	S	S	*	.	H	α-helix	trans	-74.4	-37	178.5	-66.5	-53.2	126.3	0	0	112.1	D107 K112 A113	D107-E109 PolarHBondContact O-N 3.45Å; E109-K112 PolarHBondContact O-N 2.88Å; E109-K112 IonicContact OE1-NZ 2.71Å; E109-K112 PolarHBondContact OE1-NZ 3.01Å; E109-K112 IonicContact OE2-NZ 3.53Å; E109-A113 PolarHBondContact O-N 3.18Å
110	E	86.9	Confident	87.9	Confident	98 Å²	98	88.3 Å²	88.3	46%	0.458	47%	0.468	S	S	.	.	H	α-helix	trans	-62.6	-45.9	174.4	-175.5	-176.1	-168.5	0	0	110.8	F106 D107 K112 A113 V114	F106-E110 HydrophobicContact CB-CG 4.47Å; F106-E110 HydrophobicContact CD1-CG 4.07Å; D107-E110 HydrophobicContact CB-CB 4.48Å; D107-E110 PolarHBondContact O-N 3.32Å; E110-K112 VanDerWaalsContact C-N 3.29Å; E110-K112 PolarHBondContact O-N 3.39Å; E110-A113 PolarHBondContact O-N 3.4Å; E110-A113 VanDerWaalsContact O-N 3.1Å; E110-V114 HydrophobicContact CG-CG2 4.08Å; E110-V114 WeakPolarHBondContact O-CG2 3.34Å; E110-V114 PolarHBondContact O-N 2.9Å
111	L	88.8	Confident	88.3	Confident	39 Å²	39	84.4 Å²	84.4	20%	0.204	44%	0.443	C	S	.	.	H	α-helix	trans	-56.9	-41.9	179.2	-178	61.5	0	0	0	111.8	T103 F106 D107 A113 V114 L115	T103-L111 HydrophobicContact CG2-CD1 4.36Å; F106-L111 HydrophobicContact CB-CB 3.99Å; F106-L111 HydrophobicContact CB-CD1 4.34Å; F106-L111 HydrophobicContact CD2-CD1 4.12Å; F106-L111 HydrophobicContact CG-CD1 4.49Å; D107-L111 WeakPolarHBondContact O-CB 3.42Å; D107-L111 PolarHBondContact O-N 3.23Å; L111-A113 PolarHBondContact O-N 3.46Å; L111-V114 PolarHBondContact O-N 2.83Å; L111-L115 HydrophobicContact CD1-CD1 4.26Å; L111-L115 HydrophobicContact CD1-CG 4.13Å; L111-L115 HydrophobicContact CG-CD1 4.07Å; L111-L115 HydrophobicContact CG-CG 4.37Å; L111-L115 WeakPolarHBondContact O-CB 3.43Å; L111-L115 WeakPolarHBondContact O-CG 3.39Å; L111-L115 PolarHBondContact O-N 3.49Å
112	K	88.8	Confident	88.7	Confident	117 Å²	117	86.2 Å²	86.2	51%	0.509	45%	0.446	S	S	.	.	H	α-helix	trans	-59.1	-46.7	176.7	-71.5	171.4	-174.7	167.4	0	111.5	T108 E109 E110 V116	T108-K112 WeakPolarHBondContact O-CG 3.49Å; T108-K112 PolarHBondContact O-N 3.38Å; E109-K112 PolarHBondContact O-N 2.88Å; E109-K112 IonicContact OE1-NZ 2.71Å; E109-K112 PolarHBondContact OE1-NZ 3.01Å; E109-K112 IonicContact OE2-NZ 3.53Å; E110-K112 VanDerWaalsContact C-N 3.29Å; E110-K112 PolarHBondContact O-N 3.39Å; K112-V116 PolarHBondContact O-N 2.86Å
113	A	85.8	Confident	88.7	Confident	61 Å²	61	84.5 Å²	84.5	50%	0.504	44%	0.435	S	S	.	.	H	α-helix	trans	-67.8	-42.1	179.1	0	0	0	0	0	112.3	E109 E110 L111 L115 V116 T117	E109-A113 PolarHBondContact O-N 3.18Å; E110-A113 PolarHBondContact O-N 3.4Å; E110-A113 VanDerWaalsContact O-N 3.1Å; L111-A113 PolarHBondContact O-N 3.46Å; A113-L115 VanDerWaalsContact C-N 3.33Å; A113-L115 PolarHBondContact O-N 3.47Å; A113-V116 PolarHBondContact O-N 3.1Å; A113-T117 WeakPolarHBondContact O-CG2 3.25Å; A113-T117 PolarHBondContact O-N 3.35Å; A113-T117 PolarHBondContact O-OG1 3.38Å
114	V	87.6	Confident	88.7	Confident	39 Å²	39	83 Å²	83	24%	0.236	43%	0.428	C	S	.	.	H	α-helix	trans	-63.2	-38.9	177.6	171.5	0	0	0	0	111.2	F106 E110 L111 T117 R118	F106-V114 HydrophobicContact CD1-CG2 4.22Å; F106-V114 HydrophobicContact CE1-CG1 4.4Å; F106-V114 HydrophobicContact CE1-CG2 4.19Å; F106-V114 HydrophobicContact CZ-CG1 4.34Å; E110-V114 HydrophobicContact CG-CG2 4.08Å; E110-V114 WeakPolarHBondContact O-CG2 3.34Å; E110-V114 PolarHBondContact O-N 2.9Å; L111-V114 PolarHBondContact O-N 2.83Å; V114-T117 WeakPolarHBondContact CA-OG1 3.44Å; V114-T117 PolarHBondContact O-N 3.24Å; V114-T117 PolarHBondContact O-OG1 3.41Å; V114-T117 VanDerWaalsContact O-OG1 3.05Å; V114-R118 WeakPolarHBondContact O-CB 3.37Å; V114-R118 PolarHBondContact O-N 3.05Å
115	L	90.3	Very high	88.8	Confident	78 Å²	78	79.6 Å²	79.6	41%	0.408	41%	0.413	S	S	.	.	H	α-helix	trans	-63.9	-43.9	178.1	-74.7	172.3	0	0	0	112.6	L111 A113 E119	L111-L115 HydrophobicContact CD1-CD1 4.26Å; L111-L115 HydrophobicContact CD1-CG 4.13Å; L111-L115 HydrophobicContact CG-CD1 4.07Å; L111-L115 HydrophobicContact CG-CG 4.37Å; L111-L115 WeakPolarHBondContact O-CB 3.43Å; L111-L115 WeakPolarHBondContact O-CG 3.39Å; L111-L115 PolarHBondContact O-N 3.49Å; A113-L115 VanDerWaalsContact C-N 3.33Å; A113-L115 PolarHBondContact O-N 3.47Å; L115-E119 WeakPolarHBondContact O-CB 3.34Å; L115-E119 PolarHBondContact O-N 2.85Å
116	V	87.9	Confident	88.7	Confident	84 Å²	84	77 Å²	77	51%	0.509	39%	0.388	S	S	.	.	H	α-helix	trans	-61.4	-47.3	178.1	173.1	0	0	0	0	110.9	K112 A113 E119 Q120	K112-V116 PolarHBondContact O-N 2.86Å; A113-V116 PolarHBondContact O-N 3.1Å; V116-E119 PolarHBondContact O-N 3.26Å; V116-Q120 WeakPolarHBondContact O-CG 3.45Å; V116-Q120 PolarHBondContact O-N 3.05Å
117	T	85.3	Confident	88.6	Confident	33 Å²	33	77 Å²	77	20%	0.202	40%	0.403	C	S	.	.	H	α-helix	trans	-72.2	-37.1	-177.5	53.3	0	0	0	0	112.6	A113 V114 E119 Q120 E121 P264	A113-T117 WeakPolarHBondContact O-CG2 3.25Å; A113-T117 PolarHBondContact O-N 3.35Å; A113-T117 PolarHBondContact O-OG1 3.38Å; V114-T117 WeakPolarHBondContact CA-OG1 3.44Å; V114-T117 PolarHBondContact O-N 3.24Å; V114-T117 PolarHBondContact O-OG1 3.41Å; V114-T117 VanDerWaalsContact O-OG1 3.05Å; T117-E119 VanDerWaalsContact C-N 3.29Å; T117-E119 PolarHBondContact O-N 3.44Å; T117-Q120 PolarHBondContact O-N 2.88Å; T117-E121 PolarHBondContact O-N 2.91Å; T117-P264 HydrophobicContact CG2-CB 4.01Å; T117-P264 HydrophobicContact CG2-CG 3.83Å; T117-P264 WeakPolarHBondContact OG1-CG 3.15Å
118	R	90.6	Very high	88.4	Confident	141 Å²	141	72 Å²	72	53%	0.532	37%	0.374	S	S	.	.	H	α-helix	trans	-59.3	-42.8	171.9	-170.7	-175.6	95.5	-177.8	6.8	111.1	V114 Y122 L261	V114-R118 WeakPolarHBondContact O-CB 3.37Å; V114-R118 PolarHBondContact O-N 3.05Å; R118-Y122 VanDerWaalsContact O-CB 3.29Å; R118-Y122 WeakPolarHBondContact O-CB 3.39Å; R118-Y122 PolarHBondContact O-N 3.43Å; R118-L261 HydrophobicContact CG-CD1 3.84Å
119	E	91.1	Very high	88.1	Confident	86 Å²	86	68.9 Å²	68.9	40%	0.402	36%	0.357	S	S	.	.	H	α-helix	trans	-65.3	-44.3	177.8	-172.4	55.9	-148.8	0	0	111.3	L115 V116 T117 E121 Y122 Q123	L115-E119 WeakPolarHBondContact O-CB 3.34Å; L115-E119 PolarHBondContact O-N 2.85Å; V116-E119 PolarHBondContact O-N 3.26Å; T117-E119 VanDerWaalsContact C-N 3.29Å; T117-E119 PolarHBondContact O-N 3.44Å; E119-E121 PolarHBondContact O-N 2.81Å; E119-Y122 PolarHBondContact O-N 3.3Å; E119-Q123 WeakPolarHBondContact O-CG 3.42Å; E119-Q123 PolarHBondContact O-N 3.19Å; E119-Q123 PolarHBondContact OE1-NE2 2.76Å
120	Q	87.8	Confident	87.9	Confident	117 Å²	117	68.5 Å²	68.5	55%	0.547	36%	0.355	S	S	.	.	H	α-helix	trans	-58.6	-47.5	175.5	-71.8	171.4	-10.1	0	0	112.6	V116 T117 Y122 Q123 A124	V116-Q120 WeakPolarHBondContact O-CG 3.45Å; V116-Q120 PolarHBondContact O-N 3.05Å; T117-Q120 PolarHBondContact O-N 2.88Å; Q120-Y122 VanDerWaalsContact C-N 3.3Å; Q120-Y122 PolarHBondContact O-N 2.79Å; Q120-Q123 PolarHBondContact O-N 2.96Å; Q120-A124 WeakPolarHBondContact O-CB 3.47Å; Q120-A124 PolarHBondContact O-N 3.33Å
121	E	88.9	Confident	87.7	Confident	23 Å²	23	66.2 Å²	66.2	11%	0.107	35%	0.35	C	S	.	.	H	α-helix	trans	-65.7	-34.8	177.6	-177.1	60.6	-160.8	0	0	111.6	T117 E119 A124 F125 R128 L261 K350	T117-E121 PolarHBondContact O-N 2.91Å; E119-E121 PolarHBondContact O-N 2.81Å; E121-A124 PolarHBondContact O-N 3.49Å; E121-F125 WeakPolarHBondContact O-CB 3.32Å; E121-F125 PolarHBondContact O-N 3.43Å; E121-R128 IonicContact OE1-NH2 3.62Å; E121-L261 HydrophobicContact CB-CD2 4.49Å; E121-L261 HydrophobicContact CG-CB 3.94Å; E121-L261 HydrophobicContact CG-CD2 3.91Å; E121-L261 HydrophobicContact CG-CG 4.46Å; E121-K350 VanDerWaalsContact CD-NZ 3.32Å; E121-K350 WeakPolarHBondContact OE1-CE 3.4Å; E121-K350 IonicContact OE1-NZ 2.95Å; E121-K350 PolarHBondContact OE1-NZ 3.34Å; E121-K350 VanDerWaalsContact OE1-NZ 3.08Å; E121-K350 IonicContact OE2-NZ 2.73Å; E121-K350 PolarHBondContact OE2-NZ 2.05Å
122	Y	90.9	Very high	87.4	Confident	87 Å²	87	70.6 Å²	70.6	34%	0.341	37%	0.373	S	S	.	.	H	α-helix	trans	-66.7	-44.5	175.3	-175.7	-122.5	0	0	0	112.1	R118 E119 Q120 A124 F125 L126 P259 L261	R118-Y122 VanDerWaalsContact O-CB 3.29Å; R118-Y122 WeakPolarHBondContact O-CB 3.39Å; R118-Y122 PolarHBondContact O-N 3.43Å; E119-Y122 PolarHBondContact O-N 3.3Å; Q120-Y122 VanDerWaalsContact C-N 3.3Å; Q120-Y122 PolarHBondContact O-N 2.79Å; Y122-A124 VanDerWaalsContact C-N 3.32Å; Y122-A124 PolarHBondContact O-N 3.4Å; Y122-F125 HydrophobicContact CD2-CD1 4.22Å; Y122-F125 HydrophobicContact CE2-CD1 4.17Å; Y122-F125 WeakPolarHBondContact O-CA 3.34Å; Y122-F125 WeakPolarHBondContact O-CB 3.42Å; Y122-F125 PolarHBondContact O-N 3.16Å; Y122-F125 VanDerWaalsContact O-N 3.12Å; Y122-L126 HydrophobicContact CD1-CD1 4.14Å; Y122-L126 HydrophobicContact CE1-CD1 3.72Å; Y122-L126 HydrophobicContact CE1-CG 4.23Å; Y122-L126 HydrophobicContact CE2-CD2 4.13Å; Y122-L126 HydrophobicContact CE2-CG 4.24Å; Y122-L126 WeakPolarHBondContact O-CG 3.36Å; Y122-L126 PolarHBondContact O-N 2.9Å; Y122-P259 HydrophobicContact CD2-CB 4.07Å; Y122-P259 HydrophobicContact CD2-CG 4.5Å; Y122-P259 HydrophobicContact CE2-CB 4.1Å; Y122-P259 HydrophobicContact CE2-CG 4.21Å; Y122-L261 HydrophobicContact CD2-CD1 4.4Å; Y122-L261 HydrophobicContact CD2-CD2 4.28Å
123	Q	89.6	Confident	87.1	Confident	97 Å²	97	66.9 Å²	66.9	45%	0.453	36%	0.364	S	S	.	.	H	α-helix	trans	-62.1	-40.9	174.3	-67.9	-57.4	-33.1	0	0	111.6	E119 Q120 F125 L126 A127	E119-Q123 WeakPolarHBondContact O-CG 3.42Å; E119-Q123 PolarHBondContact O-N 3.19Å; E119-Q123 PolarHBondContact OE1-NE2 2.76Å; Q120-Q123 PolarHBondContact O-N 2.96Å; Q123-F125 VanDerWaalsContact C-N 3.31Å; Q123-F125 PolarHBondContact O-N 2.77Å; Q123-L126 PolarHBondContact O-N 2.94Å; Q123-A127 WeakPolarHBondContact O-CB 3.42Å; Q123-A127 PolarHBondContact O-N 2.95Å
124	A	87.6	Confident	87	Confident	27 Å²	27	66 Å²	66	22%	0.223	35%	0.351	C	S	.	.	H	α-helix	trans	-62.6	-38.3	173.8	0	0	0	0	0	111.8	Q120 E121 Y122 R128	Q120-A124 WeakPolarHBondContact O-CB 3.47Å; Q120-A124 PolarHBondContact O-N 3.33Å; E121-A124 PolarHBondContact O-N 3.49Å; Y122-A124 VanDerWaalsContact C-N 3.32Å; Y122-A124 PolarHBondContact O-N 3.4Å; A124-R128 VanDerWaalsContact C-CZ 3.47Å; A124-R128 VanDerWaalsContact C-NH2 3.32Å; A124-R128 WeakPolarHBondContact O-CG 3.38Å; A124-R128 PolarHBondContact O-N 2.86Å; A124-R128 PolarHBondContact O-NE 3.16Å; A124-R128 PolarHBondContact O-NH1 2.87Å; A124-R128 PolarHBondContact O-NH2 2.93Å
125	F	89.8	Confident	86.9	Confident	23 Å²	23	69.2 Å²	69.2	10%	0.101	36%	0.363	C	S	.	.	H	α-helix	trans	-61.7	-50	172.2	167.9	-96.4	0	0	0	111.7	E121 Y122 Q123 A127 R128 S129 P257 P259 L261	E121-F125 WeakPolarHBondContact O-CB 3.32Å; E121-F125 PolarHBondContact O-N 3.43Å; Y122-F125 HydrophobicContact CD2-CD1 4.22Å; Y122-F125 HydrophobicContact CE2-CD1 4.17Å; Y122-F125 WeakPolarHBondContact O-CA 3.34Å; Y122-F125 WeakPolarHBondContact O-CB 3.42Å; Y122-F125 PolarHBondContact O-N 3.16Å; Y122-F125 VanDerWaalsContact O-N 3.12Å; Q123-F125 VanDerWaalsContact C-N 3.31Å; Q123-F125 PolarHBondContact O-N 2.77Å; F125-A127 PolarHBondContact O-N 3.03Å; F125-R128 PolarHBondContact O-N 2.97Å; F125-R128 VanDerWaalsContact O-N 3.08Å; F125-S129 PolarHBondContact O-N 3.4Å; F125-S129 PolarHBondContact O-OG 3.31Å; F125-S129 VanDerWaalsContact O-OG 3.09Å; F125-P257 HydrophobicContact CE1-CB 4.28Å; F125-P257 HydrophobicContact CZ-CB 3.78Å; F125-P259 HydrophobicContact CD1-CB 3.93Å; F125-P259 HydrophobicContact CE1-CB 3.86Å; F125-P259 HydrophobicContact CG-CB 4.33Å; F125-P259 HydrophobicContact CZ-CB 4.2Å; F125-L261 HydrophobicContact CB-CD2 4.13Å
126	L	88.3	Confident	86.8	Confident	26 Å²	26	69.7 Å²	69.7	14%	0.136	37%	0.366	C	S	.	.	H	α-helix	trans	-58.3	-46	179.7	-68.9	-179.9	0	0	0	112	Y122 Q123 R128 S129 Q130	Y122-L126 HydrophobicContact CD1-CD1 4.14Å; Y122-L126 HydrophobicContact CE1-CD1 3.72Å; Y122-L126 HydrophobicContact CE1-CG 4.23Å; Y122-L126 HydrophobicContact CE2-CD2 4.13Å; Y122-L126 HydrophobicContact CE2-CG 4.24Å; Y122-L126 WeakPolarHBondContact O-CG 3.36Å; Y122-L126 PolarHBondContact O-N 2.9Å; Q123-L126 PolarHBondContact O-N 2.94Å; L126-R128 PolarHBondContact O-N 2.99Å; L126-R128 VanDerWaalsContact O-N 3.13Å; L126-S129 PolarHBondContact O-N 2.92Å; L126-S129 PolarHBondContact O-OG 2.9Å; L126-Q130 HydrophobicContact CD2-CG 4.42Å; L126-Q130 VanDerWaalsContact O-CB 3.32Å; L126-Q130 WeakPolarHBondContact O-CB 3.47Å; L126-Q130 PolarHBondContact O-N 3.3Å
127	A	86.2	Confident	86.9	Confident	80 Å²	80	69.6 Å²	69.6	66%	0.661	36%	0.362	S	S	*	.	H	α-helix	trans	-59.1	-26.3	178.5	0	0	0	0	0	113.4	Q123 F125	Q123-A127 WeakPolarHBondContact O-CB 3.42Å; Q123-A127 PolarHBondContact O-N 2.95Å; F125-A127 PolarHBondContact O-N 3.03Å
128	R	86.3	Confident	87.2	Confident	23 Å²	23	71 Å²	71	9%	0.087	37%	0.367	C	S	.	.	H	α-helix	trans	-90.2	-37.9	177.2	-66.2	-175.9	-68.5	-98.9	-5.7	113	E121 A124 F125 L126 A378 R472	E121-R128 IonicContact OE1-NH2 3.62Å; A124-R128 VanDerWaalsContact C-CZ 3.47Å; A124-R128 VanDerWaalsContact C-NH2 3.32Å; A124-R128 WeakPolarHBondContact O-CG 3.38Å; A124-R128 PolarHBondContact O-N 2.86Å; A124-R128 PolarHBondContact O-NE 3.16Å; A124-R128 PolarHBondContact O-NH1 2.87Å; A124-R128 PolarHBondContact O-NH2 2.93Å; F125-R128 PolarHBondContact O-N 2.97Å; F125-R128 VanDerWaalsContact O-N 3.08Å; L126-R128 PolarHBondContact O-N 2.99Å; L126-R128 VanDerWaalsContact O-N 3.13Å; R128-A378 HydrophobicContact CG-CB 4.43Å; R128-R472 PolarHBondContact O-NH1 2.92Å
129	S	84.4	Confident	87.2	Confident	39 Å²	39	64.9 Å²	64.9	27%	0.273	35%	0.348	S	S	.	.	H	α-helix	trans	-86.4	-32.1	-172.8	63.2	0	0	0	0	113.8	F125 L126	F125-S129 PolarHBondContact O-N 3.4Å; F125-S129 PolarHBondContact O-OG 3.31Å; F125-S129 VanDerWaalsContact O-OG 3.09Å; L126-S129 PolarHBondContact O-N 2.92Å; L126-S129 PolarHBondContact O-OG 2.9Å
130	Q	82.9	Confident	87	Confident	121 Å²	121	64.7 Å²	64.7	57%	0.565	35%	0.354	S	S	*	.			trans	-82.4	141.4	-179.2	-67.4	-176.6	-19.4	0	0	110.7	L126	L126-Q130 HydrophobicContact CD2-CG 4.42Å; L126-Q130 VanDerWaalsContact O-CB 3.32Å; L126-Q130 WeakPolarHBondContact O-CB 3.47Å; L126-Q130 PolarHBondContact O-N 3.3Å
131	S	82.1	Confident	86.7	Confident	50 Å²	50	60.6 Å²	60.6	35%	0.35	34%	0.34	S	S	.	.			trans	-117.1	165.5	176	71.3	0	0	0	0	110.9	A133 D134	S131-A133 PolarHBondContact O-N 3Å; S131-A133 VanDerWaalsContact O-N 3.13Å; S131-A133 WeakPolarHBondContact OG-CB 3.36Å; S131-A133 PolarHBondContact OG-N 3.04Å; S131-D134 PolarHBondContact N-OD2 3.31Å; S131-D134 WeakPolarHBondContact O-CB 3.43Å; S131-D134 PolarHBondContact O-N 3.36Å; S131-D134 PolarHBondContact OG-OD2 3.48Å
132	L	82.7	Confident	85.9	Confident	131 Å²	131	66.9 Å²	66.9	69%	0.686	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-58.7	-23.1	169.2	-64.1	179.7	0	0	0	112.2	D134 Q135 Q150	L132-D134 PolarHBondContact O-N 2.95Å; L132-Q135 PolarHBondContact O-N 3.44Å; L132-Q150 PolarHBondContact O-NE2 3.35Å
133	A	82.5	Confident	85	Confident	39 Å²	39	64.4 Å²	64.4	32%	0.322	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-73.5	-8	176.3	0	0	0	0	0	113.4	S131 Q150 R252	S131-A133 PolarHBondContact O-N 3Å; S131-A133 VanDerWaalsContact O-N 3.13Å; S131-A133 WeakPolarHBondContact OG-CB 3.36Å; S131-A133 PolarHBondContact OG-N 3.04Å; A133-Q150 VanDerWaalsContact CA-NE2 3.3Å; A133-Q150 VanDerWaalsContact O-CD 3.3Å; A133-Q150 WeakPolarHBondContact O-CG 3.31Å; A133-Q150 PolarHBondContact O-NE2 2.93Å; A133-R252 PolarHBondContact O-NH1 3.41Å; A133-R252 PolarHBondContact O-NH2 3.19Å
134	D	83.8	Confident	85.1	Confident	42 Å²	42	60.7 Å²	60.7	23%	0.225	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-101.6	-9	177.1	-53.9	-55.6	0	0	0	112.2	S131 L132 R252 R254	S131-D134 PolarHBondContact N-OD2 3.31Å; S131-D134 WeakPolarHBondContact O-CB 3.43Å; S131-D134 PolarHBondContact O-N 3.36Å; S131-D134 PolarHBondContact OG-OD2 3.48Å; L132-D134 PolarHBondContact O-N 2.95Å; D134-R252 IonicContact OD1-NH1 3.68Å; D134-R252 PolarHBondContact OD1-NH1 2.91Å; D134-R254 IonicContact OD1-CZ 2.87Å; D134-R254 IonicContact OD1-NH1 2.82Å; D134-R254 IonicContact OD1-NH2 3.19Å; D134-R254 PolarHBondContact OD1-NH2 3.05Å
135	Q	86.4	Confident	85.5	Confident	106 Å²	106	59.4 Å²	59.4	50%	0.495	34%	0.343	S	S	.	.	S	Bend	trans	-71.9	138.9	178.2	-67.7	-176.9	-8	0	0	111.4	L132 L137 Q150 G151	L132-Q135 PolarHBondContact O-N 3.44Å; Q135-L137 PolarHBondContact O-N 3.38Å; Q135-Q150 PolarHBondContact O-NE2 3.19Å; Q135-G151 WeakPolarHBondContact O-CA 3.46Å
136	L	88.4	Confident	85.7	Confident	89 Å²	89	60.3 Å²	60.3	47%	0.466	35%	0.348	S	S	.	.			trans	-68.9	117.7	173.4	-179.6	64.8	0	0	0	109.7	I138 P148 Q150 V152 P163	L136-I138 HydrophobicContact CD1-CD1 3.83Å; L136-I138 HydrophobicContact CD2-CD1 4.34Å; L136-I138 HydrophobicContact CG-CD1 4.04Å; L136-P148 HydrophobicContact CD1-CB 4.12Å; L136-Q150 WeakPolarHBondContact CA-O 3.48Å; L136-Q150 WeakPolarHBondContact CD1-O 3.1Å; L136-V152 HydrophobicContact CD1-CG2 3.95Å; L136-P163 HydrophobicContact CD1-CG 3.74Å; L136-P163 HydrophobicContact CD2-CB 3.97Å; L136-P163 HydrophobicContact CD2-CG 3.75Å; L136-P163 HydrophobicContact CG-CG 4.43Å
137	L	89.4	Confident	86.1	Confident	81 Å²	81	61.2 Å²	61.2	42%	0.424	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	126.3	174.3	-63.1	177.6	0	0	0	108.4	Q135 P148 L149 Q150	Q135-L137 PolarHBondContact O-N 3.38Å; L137-P148 CarbonylContact O-C 3.53Å; L137-L149 HydrophobicContact CB-CB 4.45Å; L137-L149 PolarHBondContact O-N 2.92Å; L137-Q150 HydrophobicContact CB-CB 4.28Å; L137-Q150 HydrophobicContact CD1-CB 4.4Å; L137-Q150 PolarHBondContact N-O 2.74Å; L137-Q150 PolarHBondContact O-N 3.24Å
138	I	91.4	Very high	86.4	Confident	62 Å²	62	57.4 Å²	57.4	32%	0.318	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	125.1	176.1	-56	-53.7	0	0	0	108.5	L136 Q146 P148	L136-I138 HydrophobicContact CD1-CD1 3.83Å; L136-I138 HydrophobicContact CD2-CD1 4.34Å; L136-I138 HydrophobicContact CG-CD1 4.04Å; I138-Q146 HydrophobicContact CG2-CG 3.64Å; I138-P148 HydrophobicContact CD1-CB 3.7Å
139	A	91.3	Very high	86.6	Confident	14 Å²	14	61 Å²	61	12%	0.116	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	123.7	171.4	0	0	0	0	0	108.6	Q146 Y147 L149	A139-Q146 WeakPolarHBondContact O-CG 3.29Å; A139-Y147 HydrophobicContact CB-CD1 4.38Å; A139-Y147 HydrophobicContact CB-CD2 4.43Å; A139-Y147 HydrophobicContact CB-CE1 4.04Å; A139-Y147 HydrophobicContact CB-CE2 4.12Å; A139-Y147 PolarHBondContact N-O 3.45Å; A139-L149 HydrophobicContact CB-CB 4.48Å
140	P	86.8	Confident	86.9	Confident	82 Å²	82	61.4 Å²	61.4	53%	0.532	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-64.2	158.6	172	29.9	-34.8	0	0	0	109.7	N142	P140-N142 PolarHBondContact O-N 2.8Å
141	A	82.1	Confident	87.1	Confident	31 Å²	31	56.8 Å²	56.8	26%	0.256	32%	0.321	S	S	.	.	S	Bend	trans	-73.4	67.6	-178.2	0	0	0	0	0	113.2	S143 Q146 Q168	A141-S143 CarbonylContact C-O 3.56Å; A141-S143 WeakPolarHBondContact CA-O 3.48Å; A141-S143 WeakPolarHBondContact CB-O 3.37Å; A141-Q146 HydrophobicContact CB-CB 4.33Å; A141-Q168 HydrophobicContact CB-CB 3.59Å; A141-Q168 HydrophobicContact CB-CG 3.39Å
142	N	72	Confident	87.6	Confident	155 Å²	155	54.6 Å²	54.6	83%	0.829	31%	0.306	S	S	*	.	S	Bend	trans	-82.5	-23.2	168.8	-66.1	-21.6	0	0	0	111.9	P140	P140-N142 PolarHBondContact O-N 2.8Å
143	S	71.2	Confident	88.1	Confident	35 Å²	35	51 Å²	51	25%	0.245	29%	0.285	C	S	.	.	S	Bend	trans	-95.3	152.8	148.2	169.2	0	0	0	0	105.4	A141 L145	A141-S143 CarbonylContact C-O 3.56Å; A141-S143 WeakPolarHBondContact CA-O 3.48Å; A141-S143 WeakPolarHBondContact CB-O 3.37Å; S143-L145 CarbonylContact O-C 3.59Å; S143-L145 PolarHBondContact O-N 3.16Å
144	P	92.4	Very high	88.6	Confident	19 Å²	19	49.4 Å²	49.4	12%	0.123	27%	0.271	C	S	.	.	S	Bend	trans	-55.6	-10.6	-179.6	24.5	-35.8	0	0	0	113.4	L167 Q168 T242 H245	P144-L167 HydrophobicContact CB-CD1 4.05Å; P144-L167 CarbonylContact O-C 3.55Å; P144-L167 WeakPolarHBondContact O-CA 3.32Å; P144-Q168 VanDerWaalsContact CA-O 3.23Å; P144-Q168 WeakPolarHBondContact CA-O 3.46Å; P144-Q168 WeakPolarHBondContact CB-O 3.39Å; P144-Q168 PolarHBondContact O-N 2.88Å; P144-T242 HydrophobicContact CG-CG2 3.97Å; P144-H245 WeakPolarHBondContact CD-CD2 3.44Å; P144-H245 HydrophobicContact CG-CB 4.07Å
145	L	94.9	Very high	89	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	123.9	175.1	-54.7	173.6	0	0	0	112.1	S143 Y147 L167 V178 F240 T242 H245 A247	S143-L145 CarbonylContact O-C 3.59Å; S143-L145 PolarHBondContact O-N 3.16Å; L145-Y147 HydrophobicContact CB-CD1 4.26Å; L145-Y147 WeakPolarHBondContact O-CD1 3.37Å; L145-L167 HydrophobicContact CD2-CD1 4.02Å; L145-V178 HydrophobicContact CD2-CG1 4.49Å; L145-F240 HydrophobicContact CB-CD1 3.78Å; L145-F240 HydrophobicContact CB-CE1 3.75Å; L145-F240 HydrophobicContact CD1-CD1 4.14Å; L145-F240 HydrophobicContact CD1-CG 4.41Å; L145-F240 WeakPolarHBondContact CD1-O 3.36Å; L145-F240 HydrophobicContact CD2-CD1 3.81Å; L145-F240 HydrophobicContact CD2-CD2 4.45Å; L145-F240 HydrophobicContact CD2-CE1 3.49Å; L145-F240 VanDerWaalsContact CD2-CE1 3.49Å; L145-F240 HydrophobicContact CD2-CE2 4.18Å; L145-F240 HydrophobicContact CD2-CG 4.29Å; L145-F240 HydrophobicContact CD2-CZ 3.69Å; L145-F240 HydrophobicContact CG-CD1 4.12Å; L145-F240 HydrophobicContact CG-CE1 4.13Å; L145-T242 HydrophobicContact CD2-CG2 3.54Å; L145-T242 HydrophobicContact CG-CG2 4.02Å; L145-H245 HydrophobicContact CD1-CB 4.42Å; L145-A247 HydrophobicContact CB-CB 4.43Å; L145-A247 HydrophobicContact CD1-CB 3.96Å
146	Q	95.1	Very high	89.5	Confident	42 Å²	42	46.2 Å²	46.2	20%	0.196	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	133.2	161.7	-166.1	-173.3	-85.5	0	0	108.7	I138 A139 A141 G164 L165 S166 F240	I138-Q146 HydrophobicContact CG2-CG 3.64Å; A139-Q146 WeakPolarHBondContact O-CG 3.29Å; A141-Q146 HydrophobicContact CB-CB 4.33Å; Q146-G164 CarbonylContact C-O 3.6Å; Q146-G164 WeakPolarHBondContact CG-O 3.12Å; Q146-G164 PolarHBondContact NE2-O 3.05Å; Q146-L165 WeakPolarHBondContact O-CA 3.44Å; Q146-S166 PolarHBondContact N-O 2.74Å; Q146-S166 PolarHBondContact O-N 2.92Å; Q146-F240 WeakPolarHBondContact O-CE1 3.42Å
147	Y	94.9	Very high	89.7	Confident	45 Å²	45	46.6 Å²	46.6	18%	0.176	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	158.1	-175.4	59.4	-85.3	0	0	0	111.8	A139 L145 L149 A247 F249	A139-Y147 HydrophobicContact CB-CD1 4.38Å; A139-Y147 HydrophobicContact CB-CD2 4.43Å; A139-Y147 HydrophobicContact CB-CE1 4.04Å; A139-Y147 HydrophobicContact CB-CE2 4.12Å; A139-Y147 PolarHBondContact N-O 3.45Å; L145-Y147 HydrophobicContact CB-CD1 4.26Å; L145-Y147 WeakPolarHBondContact O-CD1 3.37Å; Y147-L149 HydrophobicContact CE2-CD1 4.37Å; Y147-L149 PolarHBondContact O-N 3.01Å; Y147-A247 HydrophobicContact CD1-CB 3.49Å; Y147-A247 VanDerWaalsContact CD1-CB 3.49Å; Y147-A247 HydrophobicContact CD2-CB 4.31Å; Y147-A247 HydrophobicContact CE1-CB 3.32Å; Y147-A247 HydrophobicContact CE2-CB 4.14Å; Y147-A247 HydrophobicContact CG-CB 4Å; Y147-F249 HydrophobicContact CD2-CB 4.04Å; Y147-F249 HydrophobicContact CD2-CD1 4.1Å; Y147-F249 HydrophobicContact CD2-CG 4.39Å; Y147-F249 HydrophobicContact CG-CD1 4.46Å
148	P	94.1	Very high	90	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	120.6	175.7	28.4	-31.7	0	0	0	110.3	L136 L137 I138 V152 V162 P163 F249	L136-P148 HydrophobicContact CD1-CB 4.12Å; L137-P148 CarbonylContact O-C 3.53Å; I138-P148 HydrophobicContact CD1-CB 3.7Å; P148-V152 HydrophobicContact CB-CG2 3.41Å; P148-V152 VanDerWaalsContact CB-CG2 3.41Å; P148-V152 HydrophobicContact CG-CG2 3.66Å; P148-V162 HydrophobicContact CG-CG1 4.09Å; P148-P163 WeakPolarHBondContact CD-O 3.41Å; P148-P163 WeakPolarHBondContact CG-O 3.3Å; P148-F249 HydrophobicContact CG-CD2 3.76Å; P148-F249 HydrophobicContact CG-CE2 3.68Å; P148-F249 HydrophobicContact CG-CG 4.28Å; P148-F249 HydrophobicContact CG-CZ 4.15Å; P148-F249 WeakPolarHBondContact O-CB 3.41Å; P148-F249 WeakPolarHBondContact O-CG 3.34Å
149	L	90.5	Very high	90.1	Very high	99 Å²	99	46.9 Å²	46.9	52%	0.518	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-35.4	177.3	-174.3	67.8	0	0	0	111.8	L137 A139 Y147	L137-L149 HydrophobicContact CB-CB 4.45Å; L137-L149 PolarHBondContact O-N 2.92Å; A139-L149 HydrophobicContact CB-CB 4.48Å; Y147-L149 HydrophobicContact CE2-CD1 4.37Å; Y147-L149 PolarHBondContact O-N 3.01Å
150	Q	89.8	Confident	90.2	Very high	47 Å²	47	47.5 Å²	47.5	22%	0.22	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	159.3	-173.3	-165.4	-166.8	-96.9	0	0	110.3	L132 A133 Q135 L136 L137	L132-Q150 PolarHBondContact O-NE2 3.35Å; A133-Q150 VanDerWaalsContact CA-NE2 3.3Å; A133-Q150 VanDerWaalsContact O-CD 3.3Å; A133-Q150 WeakPolarHBondContact O-CG 3.31Å; A133-Q150 PolarHBondContact O-NE2 2.93Å; Q135-Q150 PolarHBondContact O-NE2 3.19Å; L136-Q150 WeakPolarHBondContact CA-O 3.48Å; L136-Q150 WeakPolarHBondContact CD1-O 3.1Å; L137-Q150 HydrophobicContact CB-CB 4.28Å; L137-Q150 HydrophobicContact CD1-CB 4.4Å; L137-Q150 PolarHBondContact N-O 2.74Å; L137-Q150 PolarHBondContact O-N 3.24Å
151	G	87.9	Confident	90.6	Very high	23 Å²	23	44.9 Å²	44.9	24%	0.237	23%	0.233	C	C	.	.			trans	91.5	1.3	165.5	0	0	0	0	0	114.8	Q135 E153	Q135-G151 WeakPolarHBondContact O-CA 3.46Å; G151-E153 PolarHBondContact O-N 2.83Å
152	V	92.8	Very high	91.2	Very high	5 Å²	5	43.5 Å²	43.5	3%	0.03	22%	0.222	C	C	.	.			trans	-79.6	121	172.1	-171.4	0	0	0	0	109.2	L136 P148 I160 P163 I251 R252	L136-V152 HydrophobicContact CD1-CG2 3.95Å; P148-V152 HydrophobicContact CB-CG2 3.41Å; P148-V152 VanDerWaalsContact CB-CG2 3.41Å; P148-V152 HydrophobicContact CG-CG2 3.66Å; V152-I160 HydrophobicContact CG1-CD1 3.4Å; V152-I160 VanDerWaalsContact CG1-CD1 3.4Å; V152-P163 HydrophobicContact CG2-CG 4.21Å; V152-I251 HydrophobicContact CB-CG1 4.39Å; V152-I251 HydrophobicContact CG1-CB 4.45Å; V152-I251 HydrophobicContact CG1-CD1 4.44Å; V152-I251 HydrophobicContact CG1-CG1 3.94Å; V152-I251 HydrophobicContact CG1-CG2 4.11Å; V152-R252 PolarHBondContact O-N 2.92Å
153	E	92.4	Very high	92.1	Very high	56 Å²	56	38.4 Å²	38.4	26%	0.262	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	139.9	-178.3	-176.4	174.8	136.7	0	0	110.8	G151 R252 R254	G151-E153 PolarHBondContact O-N 2.83Å; E153-R252 CarbonylContact C-O 3.46Å; E153-R252 WeakPolarHBondContact CA-O 3.42Å; E153-R252 HydrophobicContact CG-CB 4.5Å; E153-R254 VanDerWaalsContact CD-NE 3.35Å; E153-R254 HydrophobicContact CG-CG 4.02Å; E153-R254 IonicContact OE1-NE 3.65Å; E153-R254 IonicContact OE2-CZ 2.8Å; E153-R254 IonicContact OE2-NE 3.78Å; E153-R254 PolarHBondContact OE2-NE 3.23Å; E153-R254 IonicContact OE2-NH2 3.08Å; E153-R254 PolarHBondContact OE2-NH2 2.99Å
154	V	92.8	Very high	93	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.024	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	144.8	174	63.7	0	0	0	0	109.9	R158 I160 Y225 I251 R252 I253 R254	V154-R158 HydrophobicContact CG2-CB 4.06Å; V154-R158 WeakPolarHBondContact CG2-O 3.49Å; V154-I160 HydrophobicContact CB-CD1 4Å; V154-I160 HydrophobicContact CB-CG1 4.01Å; V154-I160 HydrophobicContact CB-CG2 3.85Å; V154-I160 HydrophobicContact CG2-CB 4.44Å; V154-I160 HydrophobicContact CG2-CG1 4.16Å; V154-I160 HydrophobicContact CG2-CG2 3.67Å; V154-Y225 HydrophobicContact CG1-CD1 4.07Å; V154-Y225 HydrophobicContact CG1-CE1 3.8Å; V154-I251 HydrophobicContact CB-CG2 4.41Å; V154-I251 HydrophobicContact CG1-CG2 3.66Å; V154-R252 PolarHBondContact N-O 2.98Å; V154-I253 HydrophobicContact CG1-CG1 3.86Å; V154-I253 VanDerWaalsContact O-CA 3.3Å; V154-I253 WeakPolarHBondContact O-CA 3.38Å; V154-R254 PolarHBondContact O-N 2.86Å; V154-R254 VanDerWaalsContact O-N 3.08Å
155	Q	93.3	Very high	93.1	Very high	72 Å²	72	37 Å²	37	34%	0.336	19%	0.191	S	C	.	.			trans	-71.3	152.3	172.4	-68.7	-178.2	4.8	0	0	110.9	L157 R158 R254	Q155-L157 PolarHBondContact O-N 3.2Å; Q155-R158 HydrophobicContact CB-CB 3.97Å; Q155-R158 HydrophobicContact CB-CG 3.64Å; Q155-R158 WeakPolarHBondContact O-CB 3.48Å; Q155-R158 PolarHBondContact O-N 3.47Å; Q155-R254 WeakPolarHBondContact CA-O 3.29Å
156	P	95.1	Very high	93.1	Very high	10 Å²	10	37.2 Å²	37.2	7%	0.065	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	132.4	173	-27.2	34.8	0	0	0	111.9	R158 S229 I253	P156-R158 PolarHBondContact O-N 3.05Å; P156-R158 VanDerWaalsContact O-N 3.16Å; P156-S229 WeakPolarHBondContact CA-O 3.24Å; P156-S229 WeakPolarHBondContact CB-O 3.2Å; P156-I253 HydrophobicContact CB-CG2 4.35Å; P156-I253 HydrophobicContact CG-CG2 4.14Å
157	L	94.5	Very high	93.1	Very high	97 Å²	97	35.2 Å²	35.2	51%	0.508	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	21.3	-179.1	-49.2	177.5	0	0	0	115.3	Q155 S227 S229 Y230	Q155-L157 PolarHBondContact O-N 3.2Å; L157-S227 WeakPolarHBondContact CA-O 3.47Å; L157-S229 PolarHBondContact N-O 3.46Å; L157-Y230 HydrophobicContact CD1-CD2 3.96Å
158	R	94.2	Very high	93	Very high	140 Å²	140	36.5 Å²	36.5	53%	0.528	19%	0.19	S	C	.	.			trans	-109.8	169.7	174.6	-63.4	-58.2	-169.7	162.5	-0.1	112	V154 Q155 P156 S227	V154-R158 HydrophobicContact CG2-CB 4.06Å; V154-R158 WeakPolarHBondContact CG2-O 3.49Å; Q155-R158 HydrophobicContact CB-CB 3.97Å; Q155-R158 HydrophobicContact CB-CG 3.64Å; Q155-R158 WeakPolarHBondContact O-CB 3.48Å; Q155-R158 PolarHBondContact O-N 3.47Å; P156-R158 PolarHBondContact O-N 3.05Å; P156-R158 VanDerWaalsContact O-N 3.16Å; R158-S227 PolarHBondContact O-N 3.36Å
159	S	94.6	Very high	92.6	Very high	9 Å²	9	38.8 Å²	38.8	6%	0.063	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	143.8	-178.8	-50.7	0	0	0	0	111	Y225 S226	S159-Y225 CarbonylContact C-O 3.46Å; S159-Y225 WeakPolarHBondContact CA-O 3.16Å; S159-S226 WeakPolarHBondContact CB-OG 3.42Å; S159-S226 WeakPolarHBondContact OG-CB 3.49Å; S159-S226 PolarHBondContact OG-OG 2.96Å
160	I	93.8	Very high	92.1	Very high	26 Å²	26	39.2 Å²	39.2	13%	0.133	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	158.2	176.1	56.7	162.8	0	0	0	110.1	L75 V152 V154 T224 Y225 I251	L75-I160 VanDerWaalsContact CD2-C 3.49Å; V152-I160 HydrophobicContact CG1-CD1 3.4Å; V152-I160 VanDerWaalsContact CG1-CD1 3.4Å; V154-I160 HydrophobicContact CB-CD1 4Å; V154-I160 HydrophobicContact CB-CG1 4.01Å; V154-I160 HydrophobicContact CB-CG2 3.85Å; V154-I160 HydrophobicContact CG2-CB 4.44Å; V154-I160 HydrophobicContact CG2-CG1 4.16Å; V154-I160 HydrophobicContact CG2-CG2 3.67Å; I160-T224 CarbonylContact O-C 3.56Å; I160-T224 WeakPolarHBondContact O-CA 3.43Å; I160-T224 WeakPolarHBondContact O-CB 3.37Å; I160-Y225 HydrophobicContact CG1-CD1 4.42Å; I160-Y225 PolarHBondContact N-O 2.97Å; I160-Y225 PolarHBondContact O-N 3.08Å; I160-I251 HydrophobicContact CD1-CG2 4.29Å
161	L	93.4	Very high	91.8	Very high	27 Å²	27	40.2 Å²	40.2	14%	0.141	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	138.6	159.2	-75.3	157.4	0	0	0	108.8	D53 L54 L75 P163 A190 I223 T224	D53-L161 HydrophobicContact CB-CD1 3.81Å; L54-L161 HydrophobicContact CD2-CD1 3.42Å; L54-L161 VanDerWaalsContact CD2-CD1 3.42Å; L54-L161 HydrophobicContact CD2-CD2 3.65Å; L54-L161 HydrophobicContact CD2-CG 4.18Å; L54-L161 HydrophobicContact CG-CD1 3.64Å; L75-L161 HydrophobicContact CD1-CD1 3.77Å; L75-L161 HydrophobicContact CD1-CD2 4.27Å; L75-L161 HydrophobicContact CD1-CG 3.74Å; L75-L161 HydrophobicContact CD2-CG 4.22Å; L161-P163 WeakPolarHBondContact O-CD 3.43Å; L161-A190 HydrophobicContact CD2-CB 4.08Å; L161-I223 WeakPolarHBondContact CA-O 3.49Å; L161-T224 HydrophobicContact CD2-CG2 3.71Å; L161-T224 HydrophobicContact CG-CG2 4.3Å
162	V	94.6	Very high	91.5	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.018	26%	0.257	C	S	.	.			trans	-93.1	111.5	177.1	-178.4	0	0	0	0	109.4	P148 L165 W187 I223 F249 I251	P148-V162 HydrophobicContact CG-CG1 4.09Å; V162-L165 HydrophobicContact CB-CD1 4.1Å; V162-L165 HydrophobicContact CG1-CD1 3.82Å; V162-L165 HydrophobicContact CG1-CD2 4.48Å; V162-L165 HydrophobicContact CG1-CG 4Å; V162-W187 HydrophobicContact CB-CZ3 4.46Å; V162-W187 HydrophobicContact CG2-CH2 4.26Å; V162-W187 HydrophobicContact CG2-CZ3 3.68Å; V162-I223 PolarHBondContact N-O 3.35Å; V162-F249 HydrophobicContact CG1-CE2 4.16Å; V162-F249 HydrophobicContact CG1-CZ 4.14Å; V162-I251 HydrophobicContact CG2-CD1 4.14Å
163	P	92.1	Very high	91.1	Very high	47 Å²	47	46.7 Å²	46.7	31%	0.305	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	150.2	-174.4	31.4	-36.6	0	0	0	112.2	L136 P148 V152 L161 L165	L136-P163 HydrophobicContact CD1-CG 3.74Å; L136-P163 HydrophobicContact CD2-CB 3.97Å; L136-P163 HydrophobicContact CD2-CG 3.75Å; L136-P163 HydrophobicContact CG-CG 4.43Å; P148-P163 WeakPolarHBondContact CD-O 3.41Å; P148-P163 WeakPolarHBondContact CG-O 3.3Å; V152-P163 HydrophobicContact CG2-CG 4.21Å; L161-P163 WeakPolarHBondContact O-CD 3.43Å; P163-L165 PolarHBondContact O-N 2.93Å
164	G	90.8	Very high	90.9	Very high	22 Å²	22	52.6 Å²	52.6	23%	0.227	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	8.7	163.5	0	0	0	0	0	116.7	Q146 S166	Q146-G164 CarbonylContact C-O 3.6Å; Q146-G164 WeakPolarHBondContact CG-O 3.12Å; Q146-G164 PolarHBondContact NE2-O 3.05Å; G164-S166 PolarHBondContact O-N 2.93Å
165	L	94.6	Very high	91	Very high	4 Å²	4	55.8 Å²	55.8	2%	0.021	32%	0.318	C	S	.	.			trans	-70.1	124.4	171.7	-64.2	176.8	0	0	0	110.8	Q146 V162 P163 L180 L220 I223 F240 F249	Q146-L165 WeakPolarHBondContact O-CA 3.44Å; V162-L165 HydrophobicContact CB-CD1 4.1Å; V162-L165 HydrophobicContact CG1-CD1 3.82Å; V162-L165 HydrophobicContact CG1-CD2 4.48Å; V162-L165 HydrophobicContact CG1-CG 4Å; P163-L165 PolarHBondContact O-N 2.93Å; L165-L180 HydrophobicContact CD1-CD1 4.29Å; L165-L180 HydrophobicContact CD1-CD2 4.36Å; L165-L220 HydrophobicContact CB-CB 4.19Å; L165-L220 HydrophobicContact CB-CD2 4.47Å; L165-L220 WeakPolarHBondContact O-CB 3.21Å; L165-I223 HydrophobicContact CD1-CB 4.27Å; L165-I223 HydrophobicContact CD1-CD1 3.83Å; L165-I223 HydrophobicContact CD1-CG2 4.23Å; L165-F240 HydrophobicContact CD2-CD1 4.11Å; L165-F240 HydrophobicContact CD2-CE1 4.21Å; L165-F240 HydrophobicContact CD2-CG 4.44Å; L165-F249 HydrophobicContact CD2-CE1 4.05Å; L165-F249 HydrophobicContact CD2-CZ 4.13Å
166	S	94.6	Very high	91.1	Very high	3 Å²	3	53.5 Å²	53.5	2%	0.021	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	155.2	174.2	-170.5	0	0	0	0	110.7	Q146 G164 N217	Q146-S166 PolarHBondContact N-O 2.74Å; Q146-S166 PolarHBondContact O-N 2.92Å; G164-S166 PolarHBondContact O-N 2.93Å; S166-N217 VanDerWaalsContact OG-CG 3.25Å; S166-N217 PolarHBondContact OG-ND2 2.85Å; S166-N217 PolarHBondContact OG-OD1 3.27Å
167	L	95.1	Very high	91.2	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	127.3	165.7	-176.7	69.4	0	0	0	109.3	P144 L145 Y176 V178 L213 L216 N217 T242	P144-L167 HydrophobicContact CB-CD1 4.05Å; P144-L167 CarbonylContact O-C 3.55Å; P144-L167 WeakPolarHBondContact O-CA 3.32Å; L145-L167 HydrophobicContact CD2-CD1 4.02Å; L167-Y176 HydrophobicContact CD2-CD1 3.94Å; L167-Y176 HydrophobicContact CD2-CG 4.41Å; L167-V178 HydrophobicContact CB-CG1 4.31Å; L167-V178 HydrophobicContact CD1-CG1 4.25Å; L167-V178 HydrophobicContact CD2-CG1 4.12Å; L167-V178 HydrophobicContact CG-CG1 4.48Å; L167-L213 HydrophobicContact CB-CD1 3.97Å; L167-L213 HydrophobicContact CD2-CD1 3.77Å; L167-L213 HydrophobicContact CG-CD1 3.92Å; L167-L216 HydrophobicContact CB-CD2 4.48Å; L167-L216 HydrophobicContact CD2-CD2 3.76Å; L167-N217 PolarHBondContact N-OD1 3.48Å; L167-N217 PolarHBondContact O-ND2 3.31Å; L167-N217 PolarHBondContact O-OD1 3.27Å; L167-T242 HydrophobicContact CD1-CG2 3.68Å
168	Q	92.3	Very high	91.4	Very high	71 Å²	71	52.2 Å²	52.2	33%	0.332	30%	0.297	S	S	.	.			trans	-113.7	111.6	168.5	-61.2	-66.1	-15.4	0	0	107.5	A141 P144	A141-Q168 HydrophobicContact CB-CB 3.59Å; A141-Q168 HydrophobicContact CB-CG 3.39Å; P144-Q168 VanDerWaalsContact CA-O 3.23Å; P144-Q168 WeakPolarHBondContact CA-O 3.46Å; P144-Q168 WeakPolarHBondContact CB-O 3.39Å; P144-Q168 PolarHBondContact O-N 2.88Å
169	E	86.3	Confident	91.5	Very high	48 Å²	48	47.9 Å²	47.9	22%	0.224	28%	0.284	C	S	.	.			trans	-126.6	122.1	-179.1	-177	61.9	-106.3	0	0	108.4	S171 Q173 Y176 L213	E169-S171 WeakPolarHBondContact CG-O 3.27Å; E169-Q173 HydrophobicContact CG-CG 4.06Å; E169-Y176 HydrophobicContact CB-CD1 4.23Å; E169-Y176 HydrophobicContact CB-CE1 3.84Å; E169-Y176 HydrophobicContact CG-CD1 4.33Å; E169-Y176 HydrophobicContact CG-CE1 3.82Å; E169-L213 HydrophobicContact CB-CD2 4.46Å
170	A	79.9	Confident	91.7	Very high	108 Å²	108	47.6 Å²	47.6	89%	0.893	28%	0.282	S	S	*	.	S	Bend	trans	-78.7	-28.6	-176.5	0	0	0	0	0	112
171	S	82.5	Confident	91.9	Very high	69 Å²	69	48.2 Å²	48.2	48%	0.483	29%	0.289	S	S	.	.	S	Bend	trans	-93.6	138.3	-178.9	-59.6	0	0	0	0	111.2	E169 Q173	E169-S171 WeakPolarHBondContact CG-O 3.27Å; S171-Q173 PolarHBondContact O-N 3.07Å
172	A	82.8	Confident	92.1	Very high	95 Å²	95	47.3 Å²	47.3	79%	0.785	29%	0.285	S	S	*	.			trans	-61.7	132.9	170.7	0	0	0	0	0	109.8
173	Q	83.7	Confident	92.2	Very high	68 Å²	68	50.9 Å²	50.9	32%	0.318	31%	0.31	S	S	.	.			trans	-122.8	145.7	178.1	-61.7	-69.8	-27.4	0	0	108.6	E169 S171 V175 Y176	E169-Q173 HydrophobicContact CG-CG 4.06Å; S171-Q173 PolarHBondContact O-N 3.07Å; Q173-V175 VanDerWaalsContact C-N 3.28Å; Q173-V175 PolarHBondContact O-N 2.83Å; Q173-Y176 HydrophobicContact CB-CD1 4Å; Q173-Y176 HydrophobicContact CB-CE1 3.7Å; Q173-Y176 HydrophobicContact CB-CE2 4.26Å; Q173-Y176 HydrophobicContact CB-CG 4.41Å; Q173-Y176 HydrophobicContact CG-CD1 4.13Å; Q173-Y176 HydrophobicContact CG-CE1 3.74Å; Q173-Y176 PolarHBondContact N-OH 2.79Å
174	E	88.9	Confident	92.4	Very high	181 Å²	181	51.5 Å²	51.5	85%	0.846	31%	0.311	S	S	*	.	S	Bend	trans	-63.6	-40.1	173	-66.3	-173.8	165.6	0	0	111.2
175	V	94.1	Very high	92.7	Very high	70 Å²	70	50.6 Å²	50.6	42%	0.424	30%	0.301	S	S	.	.			trans	-138.8	128.2	175.5	-177.2	0	0	0	0	109.4	Q173 A209 K243	Q173-V175 VanDerWaalsContact C-N 3.28Å; Q173-V175 PolarHBondContact O-N 2.83Å; V175-A209 HydrophobicContact CG1-CB 4.07Å; V175-K243 PolarHBondContact O-NZ 2.93Å
176	Y	95.9	Very high	92.9	Very high	24 Å²	24	51.5 Å²	51.5	9%	0.094	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	126.6	167.6	-59	-85.1	0	0	0	108.1	L167 E169 Q173 A209 S210 L213	L167-Y176 HydrophobicContact CD2-CD1 3.94Å; L167-Y176 HydrophobicContact CD2-CG 4.41Å; E169-Y176 HydrophobicContact CB-CD1 4.23Å; E169-Y176 HydrophobicContact CB-CE1 3.84Å; E169-Y176 HydrophobicContact CG-CD1 4.33Å; E169-Y176 HydrophobicContact CG-CE1 3.82Å; Q173-Y176 HydrophobicContact CB-CD1 4Å; Q173-Y176 HydrophobicContact CB-CE1 3.7Å; Q173-Y176 HydrophobicContact CB-CE2 4.26Å; Q173-Y176 HydrophobicContact CB-CG 4.41Å; Q173-Y176 HydrophobicContact CG-CD1 4.13Å; Q173-Y176 HydrophobicContact CG-CE1 3.74Å; Q173-Y176 PolarHBondContact N-OH 2.79Å; Y176-A209 CarbonylContact O-C 3.31Å; Y176-A209 VanDerWaalsContact O-CA 3.25Å; Y176-A209 WeakPolarHBondContact O-CA 3.36Å; Y176-S210 PolarHBondContact N-O 2.82Å; Y176-S210 PolarHBondContact O-N 3.34Å; Y176-L213 HydrophobicContact CD1-CB 4.42Å; Y176-L213 HydrophobicContact CD1-CD1 3.88Å; Y176-L213 HydrophobicContact CD2-CB 4.13Å; Y176-L213 HydrophobicContact CE1-CB 4.2Å; Y176-L213 HydrophobicContact CE1-CD1 4.18Å; Y176-L213 HydrophobicContact CE1-CD2 4.46Å; Y176-L213 HydrophobicContact CE2-CB 3.92Å; Y176-L213 HydrophobicContact CG-CB 4.38Å; Y176-L213 HydrophobicContact CG-CD1 4.19Å
177	Q	96.7	Very high	93	Very high	81 Å²	81	51.3 Å²	51.3	38%	0.379	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	138.6	179.5	-179.1	-178.3	-27.8	0	0	110	N179 T207 L208 A209 T242	Q177-N179 PolarHBondContact NE2-OD1 2.84Å; Q177-T207 HydrophobicContact CG-CG2 3.92Å; Q177-L208 CarbonylContact C-O 3.55Å; Q177-L208 VanDerWaalsContact CA-O 3.29Å; Q177-L208 WeakPolarHBondContact CA-O 3.17Å; Q177-A209 HydrophobicContact CB-CB 4.36Å; Q177-A209 HydrophobicContact CG-CB 4.36Å; Q177-T242 WeakPolarHBondContact O-CB 2.99Å; Q177-T242 PolarHBondContact O-OG1 3.22Å
178	V	97.5	Very high	93.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	148.8	172	-62	0	0	0	0	110.2	L145 L167 L208 L216 L220 F240 S241	L145-V178 HydrophobicContact CD2-CG1 4.49Å; L167-V178 HydrophobicContact CB-CG1 4.31Å; L167-V178 HydrophobicContact CD1-CG1 4.25Å; L167-V178 HydrophobicContact CD2-CG1 4.12Å; L167-V178 HydrophobicContact CG-CG1 4.48Å; V178-L208 HydrophobicContact CG2-CB 3.94Å; V178-L208 HydrophobicContact CG2-CD1 3.99Å; V178-L208 PolarHBondContact N-O 2.95Å; V178-L208 PolarHBondContact O-N 3.27Å; V178-L216 HydrophobicContact CG1-CD2 4.24Å; V178-L216 HydrophobicContact CG2-CD1 4.23Å; V178-L220 HydrophobicContact CG2-CD2 3.88Å; V178-F240 HydrophobicContact CB-CD2 4.43Å; V178-F240 HydrophobicContact CB-CE2 3.63Å; V178-F240 HydrophobicContact CB-CZ 4.34Å; V178-F240 HydrophobicContact CG1-CE2 3.96Å; V178-F240 HydrophobicContact CG1-CZ 4.18Å; V178-F240 HydrophobicContact CG2-CE2 3.98Å; V178-S241 CarbonylContact C-O 3.55Å; V178-S241 VanDerWaalsContact CA-O 3.24Å; V178-S241 WeakPolarHBondContact CA-O 3.42Å
179	N	98.3	Very high	93.3	Very high	49 Å²	49	49.5 Å²	49.5	26%	0.262	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	140.4	178.1	-43.6	-57.2	0	0	0	109.8	Q177 L206 T207 F240 S241	Q177-N179 PolarHBondContact NE2-OD1 2.84Å; N179-L206 CarbonylContact C-O 3.48Å; N179-L206 WeakPolarHBondContact CA-O 3.4Å; N179-T207 VanDerWaalsContact OD1-CG2 3.3Å; N179-T207 WeakPolarHBondContact OD1-CG2 3.47Å; N179-T207 PolarHBondContact OD1-OG1 3.44Å; N179-F240 CarbonylContact O-C 3.56Å; N179-F240 WeakPolarHBondContact O-CA 3.34Å; N179-S241 PolarHBondContact N-O 2.87Å; N179-S241 PolarHBondContact O-N 3.08Å
180	L	98.3	Very high	93.7	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	136.3	174.1	-72.2	158.9	0	0	0	109	L165 W187 D205 L206 L208 I223 V238 R239 F240	L165-L180 HydrophobicContact CD1-CD1 4.29Å; L165-L180 HydrophobicContact CD1-CD2 4.36Å; L180-W187 HydrophobicContact CB-CD2 4.22Å; L180-W187 HydrophobicContact CB-CG 4.39Å; L180-W187 HydrophobicContact CB-CZ2 4.47Å; L180-D205 CarbonylContact O-C 3.5Å; L180-D205 VanDerWaalsContact O-CA 3.3Å; L180-D205 WeakPolarHBondContact O-CA 3.47Å; L180-L206 HydrophobicContact CB-CB 4.49Å; L180-L206 PolarHBondContact N-O 2.96Å; L180-L206 PolarHBondContact O-N 3.44Å; L180-L208 HydrophobicContact CD1-CD1 4.19Å; L180-I223 HydrophobicContact CD1-CD1 3.37Å; L180-I223 HydrophobicContact CD1-CG1 4.41Å; L180-I223 HydrophobicContact CD1-CG2 4.22Å; L180-V238 HydrophobicContact CD2-CG1 4.37Å; L180-R239 CarbonylContact C-O 3.52Å; L180-R239 VanDerWaalsContact CA-O 3.28Å; L180-R239 WeakPolarHBondContact CA-O 3.32Å; L180-F240 HydrophobicContact CD2-CB 3.85Å; L180-F240 HydrophobicContact CD2-CD2 3.5Å; L180-F240 HydrophobicContact CD2-CE2 4.31Å; L180-F240 HydrophobicContact CD2-CG 3.95Å; L180-F240 HydrophobicContact CG-CD2 3.94Å; L180-F240 HydrophobicContact CG-CE2 4.48Å
181	S	98.3	Very high	94.4	Very high	40 Å²	40	42 Å²	42	28%	0.28	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	129.6	177.2	-173.2	0	0	0	0	109.3	P204 D205 V238 R239	S181-P204 CarbonylContact C-O 3.59Å; S181-P204 WeakPolarHBondContact CA-O 3.33Å; S181-D205 WeakPolarHBondContact CB-OD1 3.46Å; S181-D205 PolarHBondContact OG-OD1 3.37Å; S181-V238 CarbonylContact O-C 3.42Å; S181-V238 VanDerWaalsContact O-CA 3.29Å; S181-V238 WeakPolarHBondContact O-CA 3.22Å; S181-R239 PolarHBondContact N-O 2.8Å; S181-R239 PolarHBondContact O-N 3.28Å
182	A	97.6	Very high	95	Very high	7 Å²	7	42.2 Å²	42.2	6%	0.058	24%	0.238	C	C	.	.			trans	-118.2	146.5	177.6	0	0	0	0	0	110.4	W187 P204 Y225 V238	A182-W187 HydrophobicContact CB-CZ2 3.91Å; A182-P204 PolarHBondContact N-O 3.02Å; A182-P204 WeakPolarHBondContact O-CB 3.42Å; A182-Y225 HydrophobicContact CB-CE2 3.96Å; A182-V238 HydrophobicContact CB-CG2 4.39Å
183	S	96.4	Very high	95.6	Very high	79 Å²	79	37.9 Å²	37.9	55%	0.552	20%	0.202	S	C	*	.	S	Bend	trans	-95	-24.9	179.7	67.5	0	0	0	0	113.8	D236	S183-D236 WeakPolarHBondContact CA-OD1 3.43Å; S183-D236 WeakPolarHBondContact CB-OD1 3.4Å; S183-D236 PolarHBondContact N-OD1 3.08Å; S183-D236 PolarHBondContact OG-OD1 3.44Å
184	L	96.6	Very high	96.1	Very high	59 Å²	59	39.7 Å²	39.7	31%	0.309	22%	0.218	S	C	.	.	S	Bend	trans	-127.2	3.1	-174.8	-58.3	178.4	0	0	0	113.8	R228 T234 A235 D236 I253	L184-R228 WeakPolarHBondContact O-CB 3.35Å; L184-R228 PolarHBondContact O-N 3.42Å; L184-T234 HydrophobicContact CD1-CG2 4.2Å; L184-A235 WeakPolarHBondContact CD1-O 3.38Å; L184-D236 WeakPolarHBondContact CA-OD2 3.14Å; L184-D236 HydrophobicContact CB-CB 3.99Å; L184-D236 WeakPolarHBondContact CB-OD2 3.04Å; L184-D236 HydrophobicContact CD1-CB 4.33Å; L184-D236 HydrophobicContact CG-CB 4.38Å; L184-D236 PolarHBondContact N-OD1 3.24Å; L184-D236 PolarHBondContact N-OD2 3.14Å; L184-I253 HydrophobicContact CB-CD1 4.14Å; L184-I253 HydrophobicContact CD1-CD1 4.13Å
185	G	96.5	Very high	96.3	Very high	3 Å²	3	32.8 Å²	32.8	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	-177.2	-175.3	0	0	0	0	0	113.5	Y225 S226 D236	G185-Y225 WeakPolarHBondContact CA-OH 3.45Å; G185-Y225 PolarHBondContact N-OH 3.42Å; G185-S226 CarbonylContact C-O 3.6Å; G185-S226 WeakPolarHBondContact CA-O 3.28Å; G185-D236 PolarHBondContact N-OD2 2.7Å
186	T	97.9	Very high	96.5	Very high	23 Å²	23	30.4 Å²	30.4	14%	0.141	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	149.7	177.3	57	0	0	0	0	110.4	G202 Q203 S226 R228	T186-G202 WeakPolarHBondContact CG2-O 3.34Å; T186-Q203 WeakPolarHBondContact CA-O 3.49Å; T186-S226 PolarHBondContact N-O 3.33Å; T186-S226 PolarHBondContact O-N 2.97Å; T186-R228 HydrophobicContact CG2-CG 4.15Å
187	W	98.3	Very high	96.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	140.6	179.5	-60.5	105.5	0	0	0	111.5	V162 L180 A182 G202 Q203 P204 L206 I223 T224 Y225 V238 I251	V162-W187 HydrophobicContact CB-CZ3 4.46Å; V162-W187 HydrophobicContact CG2-CH2 4.26Å; V162-W187 HydrophobicContact CG2-CZ3 3.68Å; L180-W187 HydrophobicContact CB-CD2 4.22Å; L180-W187 HydrophobicContact CB-CG 4.39Å; L180-W187 HydrophobicContact CB-CZ2 4.47Å; A182-W187 HydrophobicContact CB-CZ2 3.91Å; W187-G202 WeakPolarHBondContact O-CA 3.2Å; W187-G202 PolarHBondContact O-N 3.31Å; W187-Q203 PolarHBondContact N-O 2.81Å; W187-P204 PolarHBondContact NE1-O 2.96Å; W187-L206 HydrophobicContact CB-CB 3.57Å; W187-L206 HydrophobicContact CB-CD2 3.7Å; W187-L206 HydrophobicContact CB-CG 4.22Å; W187-L206 HydrophobicContact CG-CB 3.99Å; W187-L206 HydrophobicContact CG-CD2 4.5Å; W187-I223 HydrophobicContact CE3-CG2 3.45Å; W187-I223 VanDerWaalsContact CE3-CG2 3.45Å; W187-I223 HydrophobicContact CZ3-CG2 3.68Å; W187-T224 WeakPolarHBondContact CA-O 3.42Å; W187-Y225 HydrophobicContact CE3-CD2 4.41Å; W187-Y225 AromaticContact CH2-CD2 3.8Å; W187-Y225 HydrophobicContact CH2-CD2 3.8Å; W187-Y225 HydrophobicContact CH2-CG 4.43Å; W187-Y225 AromaticContact CZ2-CD2 3.94Å; W187-Y225 HydrophobicContact CZ2-CD2 3.94Å; W187-Y225 HydrophobicContact CZ3-CD2 4.07Å; W187-Y225 HydrophobicContact CZ3-CG 4.4Å; W187-V238 HydrophobicContact CH2-CG1 3.75Å; W187-V238 HydrophobicContact CH2-CG2 4.03Å; W187-V238 HydrophobicContact CZ2-CB 4.15Å; W187-V238 HydrophobicContact CZ2-CG1 3.35Å; W187-V238 HydrophobicContact CZ2-CG2 3.68Å; W187-I251 HydrophobicContact CH2-CD1 4.02Å
188	D	97.4	Very high	96.6	Very high	33 Å²	33	31.2 Å²	31.2	18%	0.176	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	173.7	172.3	-154.7	-28.9	0	0	0	108.3	V71 T224	V71-D188 HydrophobicContact CG1-CB 4.15Å; V71-D188 WeakPolarHBondContact CG2-OD2 3.37Å; D188-T224 WeakPolarHBondContact CB-OG1 3.13Å; D188-T224 PolarHBondContact N-O 3.42Å; D188-T224 VanDerWaalsContact N-O 3.07Å; D188-T224 PolarHBondContact O-N 3.16Å; D188-T224 PolarHBondContact O-OG1 3.13Å
189	V	96.4	Very high	96.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	135.9	176.5	-56.9	0	0	0	0	111.8	K68 G191 L198 L206 L222 I223	K68-V189 HydrophobicContact CD-CG2 4.07Å; K68-V189 WeakPolarHBondContact CD-O 3.38Å; V189-G191 WeakPolarHBondContact CG2-O 3.48Å; V189-G191 PolarHBondContact O-N 3.03Å; V189-L198 HydrophobicContact CG1-CD1 4.18Å; V189-L198 HydrophobicContact CG1-CD2 4.35Å; V189-L198 HydrophobicContact CG2-CD1 3.58Å; V189-L206 HydrophobicContact CG1-CD2 4.46Å; V189-L222 CarbonylContact C-O 3.57Å; V189-L222 WeakPolarHBondContact CA-O 3.36Å; V189-I223 HydrophobicContact CG1-CG1 4.38Å
190	A	94.3	Very high	96.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	22%	0.218	C	C	.	.	S	Bend	trans	-67.6	-16.9	176.3	0	0	0	0	0	112.9	L54 K68 V72 L75 L161 L222 T224	L54-A190 HydrophobicContact CD1-CB 4.34Å; L54-A190 HydrophobicContact CD2-CB 3.95Å; K68-A190 PolarHBondContact N-O 3.27Å; V72-A190 HydrophobicContact CG2-CB 3.97Å; L75-A190 HydrophobicContact CD1-CB 4.46Å; L161-A190 HydrophobicContact CD2-CB 4.08Å; A190-L222 HydrophobicContact CB-CB 4.46Å; A190-L222 PolarHBondContact N-O 2.95Å; A190-T224 HydrophobicContact CB-CG2 3.95Å
191	G	93.9	Very high	96.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168	162	174.1	0	0	0	0	0	112.2	K66 V189 Q219 L222	K66-G191 CarbonylContact O-C 3.46Å; K66-G191 WeakPolarHBondContact O-CA 3.47Å; V189-G191 WeakPolarHBondContact CG2-O 3.48Å; V189-G191 PolarHBondContact O-N 3.03Å; G191-Q219 PolarHBondContact O-NE2 2.59Å; G191-L222 WeakPolarHBondContact O-CD1 3.3Å
192	E	95.3	Very high	96.5	Very high	72 Å²	72	37 Å²	37	34%	0.336	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	133.9	-178.5	-65.6	175.8	170.5	0	0	111.2	V65 K66 K68 L198	V65-E192 WeakPolarHBondContact CA-O 3.37Å; K66-E192 PolarHBondContact N-O 2.91Å; K66-E192 PolarHBondContact O-N 2.86Å; K68-E192 HydrophobicContact CD-CG 4.3Å; K68-E192 VanDerWaalsContact CE-CD 3.49Å; K68-E192 WeakPolarHBondContact CE-OE1 3.29Å; K68-E192 IonicContact NZ-OE1 2.78Å; K68-E192 PolarHBondContact NZ-OE1 3.09Å; E192-L198 HydrophobicContact CG-CD1 4.45Å
193	V	96.2	Very high	96.5	Very high	4 Å²	4	42 Å²	42	2%	0.024	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	127.3	173.8	179.5	0	0	0	0	109.7	I63 V65 G195 V196 R215 R218 Q219 L222	I63-V193 HydrophobicContact CG2-CG1 3.58Å; V65-V193 HydrophobicContact CG2-CG2 4.16Å; V193-G195 PolarHBondContact O-N 3.38Å; V193-V196 HydrophobicContact CB-CG2 3.96Å; V193-V196 HydrophobicContact CG1-CG2 4.02Å; V193-V196 PolarHBondContact O-N 2.9Å; V193-V196 VanDerWaalsContact O-N 3.14Å; V193-R215 HydrophobicContact CG1-CB 4.06Å; V193-R215 HydrophobicContact CG1-CG 4.46Å; V193-R218 HydrophobicContact CG1-CG 4.49Å; V193-R218 HydrophobicContact CG2-CB 4.17Å; V193-R218 HydrophobicContact CG2-CG 3.72Å; V193-Q219 HydrophobicContact CB-CB 4.21Å; V193-Q219 HydrophobicContact CG2-CB 3.96Å; V193-L222 HydrophobicContact CG2-CD1 4.08Å
194	T	94.3	Very high	96.6	Very high	106 Å²	106	40.6 Å²	40.6	65%	0.65	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	127	-179.1	-52.1	0	0	0	0	112.1	R215	T194-R215 WeakPolarHBondContact O-CD 3.28Å; T194-R215 PolarHBondContact O-NH1 3.08Å
195	G	93	Very high	96.6	Very high	37 Å²	37	42.2 Å²	42.2	38%	0.381	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	14.9	-177.5	0	0	0	0	0	113.9	V193 S210 P211	V193-G195 PolarHBondContact O-N 3.38Å; G195-S210 WeakPolarHBondContact O-CB 3.38Å; G195-S210 PolarHBondContact O-OG 2.73Å; G195-P211 WeakPolarHBondContact O-CD 3.03Å
196	V	97.6	Very high	96.7	Very high	19 Å²	19	42.1 Å²	42.1	12%	0.115	26%	0.255	C	S	.	.			trans	-111.1	128.2	164	-171.1	0	0	0	0	108.8	V193 L198 L208 A209 R215 L216 Q219	V193-V196 HydrophobicContact CB-CG2 3.96Å; V193-V196 HydrophobicContact CG1-CG2 4.02Å; V193-V196 PolarHBondContact O-N 2.9Å; V193-V196 VanDerWaalsContact O-N 3.14Å; V196-L198 HydrophobicContact CG1-CD2 4.32Å; V196-L208 HydrophobicContact CG1-CB 4.36Å; V196-A209 CarbonylContact C-O 3.56Å; V196-A209 WeakPolarHBondContact CA-O 3.11Å; V196-R215 HydrophobicContact CG2-CB 4.01Å; V196-R215 WeakPolarHBondContact CG2-O 3.35Å; V196-L216 HydrophobicContact CG1-CD1 4.24Å; V196-Q219 HydrophobicContact CB-CB 4.31Å; V196-Q219 HydrophobicContact CB-CG 4.3Å; V196-Q219 HydrophobicContact CG1-CB 4.06Å; V196-Q219 HydrophobicContact CG1-CG 3.85Å; V196-Q219 HydrophobicContact CG2-CB 4.01Å
197	T	97.8	Very high	96.8	Very high	90 Å²	90	43 Å²	43	55%	0.552	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	129.3	174.3	-55	0	0	0	0	108.7	L208 A209	T197-L208 WeakPolarHBondContact O-CA 3.41Å; T197-A209 PolarHBondContact N-O 2.84Å; T197-A209 PolarHBondContact O-N 3.27Å
198	L	97.7	Very high	96.8	Very high	32 Å²	32	43 Å²	43	17%	0.168	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	131.3	177.9	-58.6	173	0	0	0	109.3	V189 E192 V196 E201 L208 Q219	V189-L198 HydrophobicContact CG1-CD1 4.18Å; V189-L198 HydrophobicContact CG1-CD2 4.35Å; V189-L198 HydrophobicContact CG2-CD1 3.58Å; E192-L198 HydrophobicContact CG-CD1 4.45Å; V196-L198 HydrophobicContact CG1-CD2 4.32Å; L198-E201 HydrophobicContact CB-CG 4.17Å; L198-L208 HydrophobicContact CD2-CB 4.25Å; L198-L208 HydrophobicContact CD2-CD2 3.56Å; L198-L208 HydrophobicContact CD2-CG 3.62Å; L198-Q219 HydrophobicContact CD2-CG 3.96Å
199	T	98	Very high	96.8	Very high	87 Å²	87	42.2 Å²	42.2	53%	0.534	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	124.3	176.4	-53.8	0	0	0	0	109.2	L206 T207	T199-L206 WeakPolarHBondContact O-CA 3.46Å; T199-T207 PolarHBondContact N-O 3.45Å; T199-T207 PolarHBondContact O-N 3.44Å
200	G	96.8	Very high	96.8	Very high	26 Å²	26	42.3 Å²	42.3	27%	0.268	26%	0.259	S	S	.	.			trans	97.5	24.5	179.6	0	0	0	0	0	115.1	G202 Q203 D205	G200-G202 PolarHBondContact O-N 3.08Å; G200-Q203 VanDerWaalsContact O-CB 3.27Å; G200-Q203 WeakPolarHBondContact O-CB 3.23Å; G200-Q203 PolarHBondContact O-N 3.1Å; G200-Q203 VanDerWaalsContact O-N 3.08Å; G200-D205 WeakPolarHBondContact CA-O 3.47Å; G200-D205 VanDerWaalsContact O-O 3.13Å
201	E	97.2	Very high	96.9	Very high	66 Å²	66	46.8 Å²	46.8	31%	0.308	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	138.5	172.4	-60.1	-170.6	77.4	0	0	111.7	K68 L198 Q203 L206	K68-E201 IonicContact NZ-OE1 2.58Å; K68-E201 PolarHBondContact NZ-OE1 2.78Å; K68-E201 IonicContact NZ-OE2 3.09Å; K68-E201 PolarHBondContact NZ-OE2 3.46Å; K68-E201 VanDerWaalsContact NZ-OE2 3.09Å; L198-E201 HydrophobicContact CB-CG 4.17Å; E201-Q203 PolarHBondContact O-N 3.48Å; E201-L206 HydrophobicContact CG-CD1 4.1Å
202	G	96.3	Very high	96.9	Very high	33 Å²	33	47.8 Å²	47.8	34%	0.34	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	6.3	-173.9	0	0	0	0	0	114.5	T186 W187 G200	T186-G202 WeakPolarHBondContact CG2-O 3.34Å; W187-G202 WeakPolarHBondContact O-CA 3.2Å; W187-G202 PolarHBondContact O-N 3.31Å; G200-G202 PolarHBondContact O-N 3.08Å
203	Q	98.1	Very high	96.9	Very high	112 Å²	112	45.6 Å²	45.6	52%	0.523	29%	0.289	S	S	.	.	B	Isolated β-bridge	trans	-108.3	166.2	179.3	-56.8	-58.8	-43.4	0	0	111.8	T186 W187 G200 E201 D205	T186-Q203 WeakPolarHBondContact CA-O 3.49Å; W187-Q203 PolarHBondContact N-O 2.81Å; G200-Q203 VanDerWaalsContact O-CB 3.27Å; G200-Q203 WeakPolarHBondContact O-CB 3.23Å; G200-Q203 PolarHBondContact O-N 3.1Å; G200-Q203 VanDerWaalsContact O-N 3.08Å; E201-Q203 PolarHBondContact O-N 3.48Å; Q203-D205 PolarHBondContact O-N 2.92Å
204	P	98.1	Very high	96.8	Very high	51 Å²	51	48.1 Å²	48.1	33%	0.331	30%	0.302	S	S	.	.	S	Bend	trans	-65.2	-23.9	173.6	-21.7	34.5	0	0	0	113.6	S181 A182 W187	S181-P204 CarbonylContact C-O 3.59Å; S181-P204 WeakPolarHBondContact CA-O 3.33Å; A182-P204 PolarHBondContact N-O 3.02Å; A182-P204 WeakPolarHBondContact O-CB 3.42Å; W187-P204 PolarHBondContact NE1-O 2.96Å
205	D	98.4	Very high	96.8	Very high	93 Å²	93	48.6 Å²	48.6	50%	0.497	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	127.4	178.7	-58.6	-61.8	0	0	0	110.4	L180 S181 G200 Q203	L180-D205 CarbonylContact O-C 3.5Å; L180-D205 VanDerWaalsContact O-CA 3.3Å; L180-D205 WeakPolarHBondContact O-CA 3.47Å; S181-D205 WeakPolarHBondContact CB-OD1 3.46Å; S181-D205 PolarHBondContact OG-OD1 3.37Å; G200-D205 WeakPolarHBondContact CA-O 3.47Å; G200-D205 VanDerWaalsContact O-O 3.13Å; Q203-D205 PolarHBondContact O-N 2.92Å
206	L	98.6	Very high	97	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	127.9	177	175.8	69.4	0	0	0	110.3	N179 L180 W187 V189 T199 E201 L208	N179-L206 CarbonylContact C-O 3.48Å; N179-L206 WeakPolarHBondContact CA-O 3.4Å; L180-L206 HydrophobicContact CB-CB 4.49Å; L180-L206 PolarHBondContact N-O 2.96Å; L180-L206 PolarHBondContact O-N 3.44Å; W187-L206 HydrophobicContact CB-CB 3.57Å; W187-L206 HydrophobicContact CB-CD2 3.7Å; W187-L206 HydrophobicContact CB-CG 4.22Å; W187-L206 HydrophobicContact CG-CB 3.99Å; W187-L206 HydrophobicContact CG-CD2 4.5Å; V189-L206 HydrophobicContact CG1-CD2 4.46Å; T199-L206 WeakPolarHBondContact O-CA 3.46Å; E201-L206 HydrophobicContact CG-CD1 4.1Å; L206-L208 HydrophobicContact CD2-CD1 3.9Å; L206-L208 HydrophobicContact CD2-CG 4.47Å; L206-L208 HydrophobicContact CG-CD1 3.83Å; L206-L208 HydrophobicContact CG-CG 4.41Å
207	T	98.4	Very high	96.9	Very high	41 Å²	41	46 Å²	46	25%	0.252	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133.1	174	-59.6	0	0	0	0	109.9	Q177 N179 T199	Q177-T207 HydrophobicContact CG-CG2 3.92Å; N179-T207 VanDerWaalsContact OD1-CG2 3.3Å; N179-T207 WeakPolarHBondContact OD1-CG2 3.47Å; N179-T207 PolarHBondContact OD1-OG1 3.44Å; T199-T207 PolarHBondContact N-O 3.45Å; T199-T207 PolarHBondContact O-N 3.44Å
208	L	98.3	Very high	96.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	131.8	174.2	-53.2	88.2	0	0	0	109.4	Q177 V178 L180 V196 T197 L198 L206 L216 Q219 L220 I223	Q177-L208 CarbonylContact C-O 3.55Å; Q177-L208 VanDerWaalsContact CA-O 3.29Å; Q177-L208 WeakPolarHBondContact CA-O 3.17Å; V178-L208 HydrophobicContact CG2-CB 3.94Å; V178-L208 HydrophobicContact CG2-CD1 3.99Å; V178-L208 PolarHBondContact N-O 2.95Å; V178-L208 PolarHBondContact O-N 3.27Å; L180-L208 HydrophobicContact CD1-CD1 4.19Å; V196-L208 HydrophobicContact CG1-CB 4.36Å; T197-L208 WeakPolarHBondContact O-CA 3.41Å; L198-L208 HydrophobicContact CD2-CB 4.25Å; L198-L208 HydrophobicContact CD2-CD2 3.56Å; L198-L208 HydrophobicContact CD2-CG 3.62Å; L206-L208 HydrophobicContact CD2-CD1 3.9Å; L206-L208 HydrophobicContact CD2-CG 4.47Å; L206-L208 HydrophobicContact CG-CD1 3.83Å; L206-L208 HydrophobicContact CG-CG 4.41Å; L208-L216 HydrophobicContact CB-CD1 3.74Å; L208-Q219 HydrophobicContact CD2-CB 4.34Å; L208-Q219 HydrophobicContact CD2-CG 3.52Å; L208-L220 HydrophobicContact CD2-CD2 4.3Å; L208-I223 HydrophobicContact CD1-CD1 4.27Å; L208-I223 HydrophobicContact CD2-CD1 4.2Å; L208-I223 HydrophobicContact CD2-CG1 4.44Å
209	A	97.7	Very high	96.7	Very high	17 Å²	17	41.2 Å²	41.2	14%	0.14	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	139.8	178.5	0	0	0	0	0	112	V175 Y176 Q177 V196 T197	V175-A209 HydrophobicContact CG1-CB 4.07Å; Y176-A209 CarbonylContact O-C 3.31Å; Y176-A209 VanDerWaalsContact O-CA 3.25Å; Y176-A209 WeakPolarHBondContact O-CA 3.36Å; Q177-A209 HydrophobicContact CB-CB 4.36Å; Q177-A209 HydrophobicContact CG-CB 4.36Å; V196-A209 CarbonylContact C-O 3.56Å; V196-A209 WeakPolarHBondContact CA-O 3.11Å; T197-A209 PolarHBondContact N-O 2.84Å; T197-A209 PolarHBondContact O-N 3.27Å
210	S	97.1	Very high	96.7	Very high	2 Å²	2	37 Å²	37	1%	0.014	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	146.7	177.4	-169.6	0	0	0	0	111.7	Y176 G195 G212	Y176-S210 PolarHBondContact N-O 2.82Å; Y176-S210 PolarHBondContact O-N 3.34Å; G195-S210 WeakPolarHBondContact O-CB 3.38Å; G195-S210 PolarHBondContact O-OG 2.73Å; S210-G212 PolarHBondContact O-N 3.02Å; S210-G212 PolarHBondContact OG-N 3.3Å; S210-G212 PolarHBondContact OG-O 3.12Å
211	P	95.3	Very high	96.5	Very high	93 Å²	93	37.3 Å²	37.3	60%	0.604	21%	0.208	S	C	*	.	S	Bend	trans	-72.6	-10.1	167.3	31.6	-35.9	0	0	0	113	G195	G195-P211 WeakPolarHBondContact O-CD 3.03Å
212	G	94.9	Very high	96.4	Very high	22 Å²	22	34.3 Å²	34.3	23%	0.227	19%	0.193	C	C	.	.			trans	-121.9	120.5	-179	0	0	0	0	0	112.8	S210 D214 R215 L216	S210-G212 PolarHBondContact O-N 3.02Å; S210-G212 PolarHBondContact OG-N 3.3Å; S210-G212 PolarHBondContact OG-O 3.12Å; G212-D214 PolarHBondContact O-N 2.73Å; G212-R215 PolarHBondContact O-N 2.88Å; G212-L216 PolarHBondContact O-N 2.88Å
213	L	94.3	Very high	96.4	Very high	25 Å²	25	32.7 Å²	32.7	13%	0.131	18%	0.177	C	C	.	.	H	α-helix	trans	-59.9	-45.3	-179.1	-176.8	60.6	0	0	0	112.9	L167 E169 Y176 R215 L216 N217	L167-L213 HydrophobicContact CB-CD1 3.97Å; L167-L213 HydrophobicContact CD2-CD1 3.77Å; L167-L213 HydrophobicContact CG-CD1 3.92Å; E169-L213 HydrophobicContact CB-CD2 4.46Å; Y176-L213 HydrophobicContact CD1-CB 4.42Å; Y176-L213 HydrophobicContact CD1-CD1 3.88Å; Y176-L213 HydrophobicContact CD2-CB 4.13Å; Y176-L213 HydrophobicContact CE1-CB 4.2Å; Y176-L213 HydrophobicContact CE1-CD1 4.18Å; Y176-L213 HydrophobicContact CE1-CD2 4.46Å; Y176-L213 HydrophobicContact CE2-CB 3.92Å; Y176-L213 HydrophobicContact CG-CB 4.38Å; Y176-L213 HydrophobicContact CG-CD1 4.19Å; L213-R215 VanDerWaalsContact C-N 3.26Å; L213-R215 PolarHBondContact O-N 2.9Å; L213-L216 WeakPolarHBondContact O-CB 3.36Å; L213-L216 PolarHBondContact O-N 3.49Å; L213-N217 PolarHBondContact O-N 2.64Å
214	D	94.8	Very high	96.3	Very high	58 Å²	58	27.4 Å²	27.4	31%	0.31	15%	0.152	S	C	.	.	H	α-helix	trans	-64.3	-32.9	-179.6	-70.3	-19.3	0	0	0	111.9	R59 Y60 I63 G212 R218	R59-D214 IonicContact CZ-OD1 3.72Å; R59-D214 IonicContact NE-OD1 3.68Å; R59-D214 IonicContact NH2-OD1 2.99Å; R59-D214 PolarHBondContact NH2-OD1 3.48Å; Y60-D214 HydrophobicContact CD1-CB 4.02Å; Y60-D214 HydrophobicContact CE1-CB 4.05Å; I63-D214 HydrophobicContact CD1-CB 3.89Å; I63-D214 WeakPolarHBondContact CD1-O 3.3Å; G212-D214 PolarHBondContact O-N 2.73Å; D214-R218 WeakPolarHBondContact O-CB 3.33Å; D214-R218 PolarHBondContact O-N 3.02Å
215	R	95.5	Very high	96.3	Very high	116 Å²	116	25 Å²	25	44%	0.438	14%	0.137	S	C	.	.	H	α-helix	trans	-70.9	-41.2	175	-65	-178.4	-179	-163.2	9.8	111.5	I63 V193 T194 V196 G212 L213 R218 Q219	I63-R215 HydrophobicContact CD1-CG 4.27Å; I63-R215 HydrophobicContact CG2-CG 4.42Å; V193-R215 HydrophobicContact CG1-CB 4.06Å; V193-R215 HydrophobicContact CG1-CG 4.46Å; T194-R215 WeakPolarHBondContact O-CD 3.28Å; T194-R215 PolarHBondContact O-NH1 3.08Å; V196-R215 HydrophobicContact CG2-CB 4.01Å; V196-R215 WeakPolarHBondContact CG2-O 3.35Å; G212-R215 PolarHBondContact O-N 2.88Å; L213-R215 VanDerWaalsContact C-N 3.26Å; L213-R215 PolarHBondContact O-N 2.9Å; R215-R218 PolarHBondContact O-N 2.92Å; R215-Q219 PolarHBondContact O-N 2.87Å
216	L	96.5	Very high	96.3	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.5	-48.5	173.9	-176.4	66	0	0	0	110.9	L167 V178 V196 L208 G212 L213 R218 Q219 L220	L167-L216 HydrophobicContact CB-CD2 4.48Å; L167-L216 HydrophobicContact CD2-CD2 3.76Å; V178-L216 HydrophobicContact CG1-CD2 4.24Å; V178-L216 HydrophobicContact CG2-CD1 4.23Å; V196-L216 HydrophobicContact CG1-CD1 4.24Å; L208-L216 HydrophobicContact CB-CD1 3.74Å; G212-L216 PolarHBondContact O-N 2.88Å; L213-L216 WeakPolarHBondContact O-CB 3.36Å; L213-L216 PolarHBondContact O-N 3.49Å; L216-R218 VanDerWaalsContact C-N 3.32Å; L216-R218 PolarHBondContact O-N 2.91Å; L216-Q219 WeakPolarHBondContact O-CA 3.45Å; L216-Q219 WeakPolarHBondContact O-CB 3.3Å; L216-Q219 PolarHBondContact O-N 3.43Å; L216-L220 WeakPolarHBondContact O-CG 3.22Å; L216-L220 PolarHBondContact O-N 2.99Å
217	N	95.8	Very high	96.2	Very high	2 Å²	2	21.6 Å²	21.6	1%	0.011	12%	0.12	C	C	.	.	H	α-helix	trans	-64.3	-36.8	177.9	-73.7	-21.6	0	0	0	112.3	Y60 S166 L167 L213 Q219 L220 Q221	Y60-N217 HydrophobicContact CE1-CB 4.05Å; Y60-N217 HydrophobicContact CE2-CB 3.92Å; Y60-N217 PolarHBondContact OH-ND2 3.18Å; S166-N217 VanDerWaalsContact OG-CG 3.25Å; S166-N217 PolarHBondContact OG-ND2 2.85Å; S166-N217 PolarHBondContact OG-OD1 3.27Å; L167-N217 PolarHBondContact N-OD1 3.48Å; L167-N217 PolarHBondContact O-ND2 3.31Å; L167-N217 PolarHBondContact O-OD1 3.27Å; L213-N217 PolarHBondContact O-N 2.64Å; N217-Q219 VanDerWaalsContact C-N 3.28Å; N217-Q219 PolarHBondContact O-N 2.87Å; N217-L220 PolarHBondContact O-N 2.6Å; N217-Q221 PolarHBondContact O-N 3.08Å
218	R	95.1	Very high	96	Very high	19 Å²	19	28.4 Å²	28.4	7%	0.072	14%	0.141	C	C	.	.	H	α-helix	trans	-60.1	-40.4	170.9	-176.8	61.9	179.9	138	0	112	P56 I63 V65 V193 D214 R215 L216 Q221	P56-R218 VanDerWaalsContact CA-NH1 3.28Å; P56-R218 VanDerWaalsContact CB-CZ 3.48Å; P56-R218 VanDerWaalsContact CB-NH1 3.32Å; I63-R218 HydrophobicContact CB-CB 4.34Å; I63-R218 HydrophobicContact CB-CG 3.97Å; I63-R218 HydrophobicContact CD1-CB 4.11Å; I63-R218 HydrophobicContact CG2-CB 4.19Å; I63-R218 HydrophobicContact CG2-CG 3.9Å; V65-R218 HydrophobicContact CG2-CG 4.24Å; V193-R218 HydrophobicContact CG1-CG 4.49Å; V193-R218 HydrophobicContact CG2-CB 4.17Å; V193-R218 HydrophobicContact CG2-CG 3.72Å; D214-R218 WeakPolarHBondContact O-CB 3.33Å; D214-R218 PolarHBondContact O-N 3.02Å; R215-R218 PolarHBondContact O-N 2.92Å; L216-R218 VanDerWaalsContact C-N 3.32Å; L216-R218 PolarHBondContact O-N 2.91Å; R218-Q221 PolarHBondContact O-N 2.94Å
219	Q	96.6	Very high	95.8	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-69	-36.1	177.5	-175.3	64.1	74.6	0	0	111.9	G191 V193 V196 L198 L208 R215 L216 N217 Q221 L222	G191-Q219 PolarHBondContact O-NE2 2.59Å; V193-Q219 HydrophobicContact CB-CB 4.21Å; V193-Q219 HydrophobicContact CG2-CB 3.96Å; V196-Q219 HydrophobicContact CB-CB 4.31Å; V196-Q219 HydrophobicContact CB-CG 4.3Å; V196-Q219 HydrophobicContact CG1-CB 4.06Å; V196-Q219 HydrophobicContact CG1-CG 3.85Å; V196-Q219 HydrophobicContact CG2-CB 4.01Å; L198-Q219 HydrophobicContact CD2-CG 3.96Å; L208-Q219 HydrophobicContact CD2-CB 4.34Å; L208-Q219 HydrophobicContact CD2-CG 3.52Å; R215-Q219 PolarHBondContact O-N 2.87Å; L216-Q219 WeakPolarHBondContact O-CA 3.45Å; L216-Q219 WeakPolarHBondContact O-CB 3.3Å; L216-Q219 PolarHBondContact O-N 3.43Å; N217-Q219 VanDerWaalsContact C-N 3.28Å; N217-Q219 PolarHBondContact O-N 2.87Å; Q219-Q221 VanDerWaalsContact C-N 3.26Å; Q219-Q221 PolarHBondContact O-N 2.77Å; Q219-L222 PolarHBondContact O-N 2.91Å
220	L	96.1	Very high	95.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.1	-32.1	177.7	-72.1	174.3	0	0	0	112.7	L165 V178 L208 L216 N217 L222 I223 F240	L165-L220 HydrophobicContact CB-CB 4.19Å; L165-L220 HydrophobicContact CB-CD2 4.47Å; L165-L220 WeakPolarHBondContact O-CB 3.21Å; V178-L220 HydrophobicContact CG2-CD2 3.88Å; L208-L220 HydrophobicContact CD2-CD2 4.3Å; L216-L220 WeakPolarHBondContact O-CG 3.22Å; L216-L220 PolarHBondContact O-N 2.99Å; N217-L220 PolarHBondContact O-N 2.6Å; L220-L222 PolarHBondContact O-N 2.73Å; L220-I223 HydrophobicContact CB-CD1 4.33Å; L220-I223 HydrophobicContact CD2-CD1 3.31Å; L220-I223 HydrophobicContact CG-CD1 4.38Å; L220-I223 PolarHBondContact O-N 3.31Å; L220-F240 HydrophobicContact CD1-CZ 4.22Å; L220-F240 HydrophobicContact CD2-CE2 4.3Å; L220-F240 HydrophobicContact CD2-CZ 4.42Å
221	Q	93.5	Very high	94.8	Very high	32 Å²	32	43.1 Å²	43.1	15%	0.15	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-14.8	174.5	-68.8	179.7	-25.9	0	0	114.1	E57 N217 R218 Q219	E57-Q221 PolarHBondContact OE1-NE2 3.03Å; N217-Q221 PolarHBondContact O-N 3.08Å; R218-Q221 PolarHBondContact O-N 2.94Å; Q219-Q221 VanDerWaalsContact C-N 3.26Å; Q219-Q221 PolarHBondContact O-N 2.77Å
222	L	95.1	Very high	93.6	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	4.6	-176.6	-56.4	171.1	0	0	0	112	L54 V65 V189 A190 G191 V193 Q219 L220 T224	L54-L222 HydrophobicContact CD2-CD2 3.64Å; V65-L222 HydrophobicContact CB-CD1 4.27Å; V65-L222 HydrophobicContact CG1-CD1 3.36Å; V65-L222 HydrophobicContact CG2-CD1 3.86Å; V189-L222 CarbonylContact C-O 3.57Å; V189-L222 WeakPolarHBondContact CA-O 3.36Å; A190-L222 HydrophobicContact CB-CB 4.46Å; A190-L222 PolarHBondContact N-O 2.95Å; G191-L222 WeakPolarHBondContact O-CD1 3.3Å; V193-L222 HydrophobicContact CG2-CD1 4.08Å; Q219-L222 PolarHBondContact O-N 2.91Å; L220-L222 PolarHBondContact O-N 2.73Å; L222-T224 PolarHBondContact O-N 3.43Å
223	I	96.4	Very high	93.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	132.1	179.5	-71.4	167.5	0	0	0	110	L161 V162 L165 L180 W187 V189 L208 L220	L161-I223 WeakPolarHBondContact CA-O 3.49Å; V162-I223 PolarHBondContact N-O 3.35Å; L165-I223 HydrophobicContact CD1-CB 4.27Å; L165-I223 HydrophobicContact CD1-CD1 3.83Å; L165-I223 HydrophobicContact CD1-CG2 4.23Å; L180-I223 HydrophobicContact CD1-CD1 3.37Å; L180-I223 HydrophobicContact CD1-CG1 4.41Å; L180-I223 HydrophobicContact CD1-CG2 4.22Å; W187-I223 HydrophobicContact CE3-CG2 3.45Å; W187-I223 VanDerWaalsContact CE3-CG2 3.45Å; W187-I223 HydrophobicContact CZ3-CG2 3.68Å; V189-I223 HydrophobicContact CG1-CG1 4.38Å; L208-I223 HydrophobicContact CD1-CD1 4.27Å; L208-I223 HydrophobicContact CD2-CD1 4.2Å; L208-I223 HydrophobicContact CD2-CG1 4.44Å; L220-I223 HydrophobicContact CB-CD1 4.33Å; L220-I223 HydrophobicContact CD2-CD1 3.31Å; L220-I223 HydrophobicContact CG-CD1 4.38Å; L220-I223 PolarHBondContact O-N 3.31Å
224	T	96.9	Very high	93.2	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	141.5	174.1	67	0	0	0	0	110.4	V71 L75 I160 L161 W187 D188 A190 L222	V71-T224 HydrophobicContact CG1-CG2 3.97Å; L75-T224 HydrophobicContact CD1-CG2 4.31Å; L75-T224 HydrophobicContact CD2-CG2 3.84Å; L75-T224 HydrophobicContact CG-CG2 4.45Å; I160-T224 CarbonylContact O-C 3.56Å; I160-T224 WeakPolarHBondContact O-CA 3.43Å; I160-T224 WeakPolarHBondContact O-CB 3.37Å; L161-T224 HydrophobicContact CD2-CG2 3.71Å; L161-T224 HydrophobicContact CG-CG2 4.3Å; W187-T224 WeakPolarHBondContact CA-O 3.42Å; D188-T224 WeakPolarHBondContact CB-OG1 3.13Å; D188-T224 PolarHBondContact N-O 3.42Å; D188-T224 VanDerWaalsContact N-O 3.07Å; D188-T224 PolarHBondContact O-N 3.16Å; D188-T224 PolarHBondContact O-OG1 3.13Å; A190-T224 HydrophobicContact CB-CG2 3.95Å; L222-T224 PolarHBondContact O-N 3.43Å
225	Y	97.6	Very high	93.3	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.5	170.3	172.3	-91.1	0	0	0	108.6	V154 S159 I160 A182 G185 W187 D236 I251	V154-Y225 HydrophobicContact CG1-CD1 4.07Å; V154-Y225 HydrophobicContact CG1-CE1 3.8Å; S159-Y225 CarbonylContact C-O 3.46Å; S159-Y225 WeakPolarHBondContact CA-O 3.16Å; I160-Y225 HydrophobicContact CG1-CD1 4.42Å; I160-Y225 PolarHBondContact N-O 2.97Å; I160-Y225 PolarHBondContact O-N 3.08Å; A182-Y225 HydrophobicContact CB-CE2 3.96Å; G185-Y225 WeakPolarHBondContact CA-OH 3.45Å; G185-Y225 PolarHBondContact N-OH 3.42Å; W187-Y225 HydrophobicContact CE3-CD2 4.41Å; W187-Y225 AromaticContact CH2-CD2 3.8Å; W187-Y225 HydrophobicContact CH2-CD2 3.8Å; W187-Y225 HydrophobicContact CH2-CG 4.43Å; W187-Y225 AromaticContact CZ2-CD2 3.94Å; W187-Y225 HydrophobicContact CZ2-CD2 3.94Å; W187-Y225 HydrophobicContact CZ3-CD2 4.07Å; W187-Y225 HydrophobicContact CZ3-CG 4.4Å; Y225-D236 HydrophobicContact CE2-CB 4.42Å; Y225-D236 WeakPolarHBondContact CE2-OD2 3.45Å; Y225-D236 VanDerWaalsContact CZ-OD2 3.29Å; Y225-D236 VanDerWaalsContact OH-CB 3.31Å; Y225-D236 WeakPolarHBondContact OH-CB 3.47Å; Y225-D236 PolarHBondContact OH-OD2 3.13Å; Y225-I251 HydrophobicContact CD1-CD1 3.94Å; Y225-I251 HydrophobicContact CD1-CG2 4Å; Y225-I251 HydrophobicContact CD2-CD1 3.62Å; Y225-I251 HydrophobicContact CE1-CD1 4.4Å; Y225-I251 HydrophobicContact CE1-CG2 3.94Å; Y225-I251 HydrophobicContact CE2-CD1 4.08Å; Y225-I251 HydrophobicContact CG-CD1 3.52Å
226	S	97.1	Very high	93.3	Very high	17 Å²	17	40.3 Å²	40.3	12%	0.119	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	119.2	173.4	-61.1	0	0	0	0	110.4	S159 G185 T186	S159-S226 WeakPolarHBondContact CB-OG 3.42Å; S159-S226 WeakPolarHBondContact OG-CB 3.49Å; S159-S226 PolarHBondContact OG-OG 2.96Å; G185-S226 CarbonylContact C-O 3.6Å; G185-S226 WeakPolarHBondContact CA-O 3.28Å; T186-S226 PolarHBondContact N-O 3.33Å; T186-S226 PolarHBondContact O-N 2.97Å
227	S	96.6	Very high	93.3	Very high	5 Å²	5	43.7 Å²	43.7	4%	0.035	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	136.4	177.3	-173.7	0	0	0	0	111	L157 R158 S229 I253	L157-S227 WeakPolarHBondContact CA-O 3.47Å; R158-S227 PolarHBondContact O-N 3.36Å; S227-S229 PolarHBondContact OG-N 3.02Å; S227-S229 PolarHBondContact OG-O 3.07Å; S227-I253 WeakPolarHBondContact OG-CD1 3.29Å
228	R	95.3	Very high	93.3	Very high	184 Å²	184	43.6 Å²	43.6	69%	0.694	22%	0.223	S	C	*	.			trans	-102.8	-1.1	169.3	-56.7	-61	-63.8	-164.3	-4.3	112.5	L184 T186	L184-R228 WeakPolarHBondContact O-CB 3.35Å; L184-R228 PolarHBondContact O-N 3.42Å; T186-R228 HydrophobicContact CG2-CG 4.15Å
229	S	92.9	Very high	93.4	Very high	15 Å²	15	49.2 Å²	49.2	11%	0.105	24%	0.244	C	C	.	.			trans	-92.2	135.8	179.6	-173.3	0	0	0	0	111.5	P156 L157 S227 Q231	P156-S229 WeakPolarHBondContact CA-O 3.24Å; P156-S229 WeakPolarHBondContact CB-O 3.2Å; L157-S229 PolarHBondContact N-O 3.46Å; S227-S229 PolarHBondContact OG-N 3.02Å; S227-S229 PolarHBondContact OG-O 3.07Å; S229-Q231 PolarHBondContact OG-N 2.74Å
230	Y	90.7	Very high	93.4	Very high	185 Å²	185	49.2 Å²	49.2	73%	0.725	24%	0.244	S	C	*	.			trans	-89.5	-8.3	169	-177.4	-103.8	0	0	0	112.6	L157 G232	L157-Y230 HydrophobicContact CD1-CD2 3.96Å; Y230-G232 PolarHBondContact O-N 3.25Å
231	Q	82.9	Confident	93.4	Very high	128 Å²	128	50.5 Å²	50.5	60%	0.598	25%	0.253	S	S	*	.			trans	-69	126.6	-175.9	-64.6	179.3	-9.2	0	0	111.1	S229 N233 T234	S229-Q231 PolarHBondContact OG-N 2.74Å; Q231-N233 VanDerWaalsContact C-N 3.34Å; Q231-N233 PolarHBondContact O-N 3.45Å; Q231-T234 HydrophobicContact CB-CG2 4.02Å
232	G	71.8	Confident	93.5	Very high	44 Å²	44	49.1 Å²	49.1	45%	0.454	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	8.1	-169.1	0	0	0	0	0	117.2	Y230 R254	Y230-G232 PolarHBondContact O-N 3.25Å; G232-R254 WeakPolarHBondContact O-CA 3.35Å; G232-R254 VanDerWaalsContact O-CB 3.25Å; G232-R254 WeakPolarHBondContact O-CB 3.31Å
233	N	86.6	Confident	93.2	Very high	137 Å²	137	53.9 Å²	53.9	73%	0.733	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-162.1	66.1	176	-169.7	33.1	0	0	0	110.5	Q231 I253	Q231-N233 VanDerWaalsContact C-N 3.34Å; Q231-N233 PolarHBondContact O-N 3.45Å; N233-I253 PolarHBondContact N-O 2.98Å
234	T	94.3	Very high	92.7	Very high	38 Å²	38	58.2 Å²	58.2	23%	0.233	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	179.3	176.8	-168.3	0	0	0	0	110	L184 Q231 I253	L184-T234 HydrophobicContact CD1-CG2 4.2Å; Q231-T234 HydrophobicContact CB-CG2 4.02Å; T234-I253 HydrophobicContact CG2-CB 3.84Å; T234-I253 HydrophobicContact CG2-CD1 4.05Å; T234-I253 HydrophobicContact CG2-CG2 4.36Å; T234-I253 PolarHBondContact N-O 2.83Å; T234-I253 PolarHBondContact O-N 2.95Å
235	A	95.1	Very high	92.6	Very high	37 Å²	37	62.2 Å²	62.2	31%	0.306	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	138.9	174.1	0	0	0	0	0	110.1	L184 I250 I251	L184-A235 WeakPolarHBondContact CD1-O 3.38Å; A235-I250 HydrophobicContact CB-CB 4.4Å; A235-I251 CarbonylContact C-O 3.51Å; A235-I251 WeakPolarHBondContact CA-O 3.39Å
236	D	96.1	Very high	92.4	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	129.2	169.7	-163	-9.7	0	0	0	109.4	S183 L184 G185 Y225 I250 I251 I253	S183-D236 WeakPolarHBondContact CA-OD1 3.43Å; S183-D236 WeakPolarHBondContact CB-OD1 3.4Å; S183-D236 PolarHBondContact N-OD1 3.08Å; S183-D236 PolarHBondContact OG-OD1 3.44Å; L184-D236 WeakPolarHBondContact CA-OD2 3.14Å; L184-D236 HydrophobicContact CB-CB 3.99Å; L184-D236 WeakPolarHBondContact CB-OD2 3.04Å; L184-D236 HydrophobicContact CD1-CB 4.33Å; L184-D236 HydrophobicContact CG-CB 4.38Å; L184-D236 PolarHBondContact N-OD1 3.24Å; L184-D236 PolarHBondContact N-OD2 3.14Å; G185-D236 PolarHBondContact N-OD2 2.7Å; Y225-D236 HydrophobicContact CE2-CB 4.42Å; Y225-D236 WeakPolarHBondContact CE2-OD2 3.45Å; Y225-D236 VanDerWaalsContact CZ-OD2 3.29Å; Y225-D236 VanDerWaalsContact OH-CB 3.31Å; Y225-D236 WeakPolarHBondContact OH-CB 3.47Å; Y225-D236 PolarHBondContact OH-OD2 3.13Å; D236-I250 VanDerWaalsContact O-CA 3.28Å; D236-I250 WeakPolarHBondContact O-CA 3.33Å; D236-I251 PolarHBondContact N-O 2.72Å; D236-I251 PolarHBondContact O-N 2.74Å; D236-I253 HydrophobicContact CB-CD1 4.15Å
237	T	95.7	Very high	92.3	Very high	71 Å²	71	67.1 Å²	67.1	44%	0.436	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	112.6	171.9	-59.4	0	0	0	0	108.4	T248	T237-T248 HydrophobicContact CG2-CG2 3.42Å; T237-T248 VanDerWaalsContact CG2-CG2 3.42Å
238	V	96.4	Very high	92.3	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	135.8	-178.5	173.1	0	0	0	0	110.2	L180 S181 A182 W187 T248 F249 I251	L180-V238 HydrophobicContact CD2-CG1 4.37Å; S181-V238 CarbonylContact O-C 3.42Å; S181-V238 VanDerWaalsContact O-CA 3.29Å; S181-V238 WeakPolarHBondContact O-CA 3.22Å; A182-V238 HydrophobicContact CB-CG2 4.39Å; W187-V238 HydrophobicContact CH2-CG1 3.75Å; W187-V238 HydrophobicContact CH2-CG2 4.03Å; W187-V238 HydrophobicContact CZ2-CB 4.15Å; W187-V238 HydrophobicContact CZ2-CG1 3.35Å; W187-V238 HydrophobicContact CZ2-CG2 3.68Å; V238-T248 VanDerWaalsContact O-CA 3.28Å; V238-T248 WeakPolarHBondContact O-CA 3.36Å; V238-F249 HydrophobicContact CB-CD1 4.41Å; V238-F249 HydrophobicContact CB-CD2 4.36Å; V238-F249 HydrophobicContact CB-CE1 4.1Å; V238-F249 HydrophobicContact CB-CE2 4.05Å; V238-F249 HydrophobicContact CB-CZ 3.92Å; V238-F249 HydrophobicContact CG1-CD1 4.28Å; V238-F249 HydrophobicContact CG1-CE1 3.57Å; V238-F249 HydrophobicContact CG1-CE2 4.11Å; V238-F249 HydrophobicContact CG1-CZ 3.47Å; V238-F249 VanDerWaalsContact CG1-CZ 3.47Å; V238-F249 HydrophobicContact CG2-CE2 4.43Å; V238-F249 PolarHBondContact N-O 3.42Å; V238-F249 PolarHBondContact O-N 3.27Å; V238-I251 HydrophobicContact CG2-CD1 3.91Å; V238-I251 HydrophobicContact CG2-CG1 4.13Å
239	R	97.4	Very high	92.3	Very high	137 Å²	137	61.7 Å²	61.7	52%	0.517	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	134.9	170.5	-58.8	-177.1	-174.2	173.2	2.1	110.2	L180 S181 A247	L180-R239 CarbonylContact C-O 3.52Å; L180-R239 VanDerWaalsContact CA-O 3.28Å; L180-R239 WeakPolarHBondContact CA-O 3.32Å; S181-R239 PolarHBondContact N-O 2.8Å; S181-R239 PolarHBondContact O-N 3.28Å; R239-A247 WeakPolarHBondContact CA-O 3.25Å
240	F	97.2	Very high	92.4	Very high	0 Å²	0	64 Å²	64	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	123.7	172	-179.2	-143	0	0	0	107.9	L145 Q146 L165 V178 N179 L180 L220 A247 F249	L145-F240 HydrophobicContact CB-CD1 3.78Å; L145-F240 HydrophobicContact CB-CE1 3.75Å; L145-F240 HydrophobicContact CD1-CD1 4.14Å; L145-F240 HydrophobicContact CD1-CG 4.41Å; L145-F240 WeakPolarHBondContact CD1-O 3.36Å; L145-F240 HydrophobicContact CD2-CD1 3.81Å; L145-F240 HydrophobicContact CD2-CD2 4.45Å; L145-F240 HydrophobicContact CD2-CE1 3.49Å; L145-F240 VanDerWaalsContact CD2-CE1 3.49Å; L145-F240 HydrophobicContact CD2-CE2 4.18Å; L145-F240 HydrophobicContact CD2-CG 4.29Å; L145-F240 HydrophobicContact CD2-CZ 3.69Å; L145-F240 HydrophobicContact CG-CD1 4.12Å; L145-F240 HydrophobicContact CG-CE1 4.13Å; Q146-F240 WeakPolarHBondContact O-CE1 3.42Å; L165-F240 HydrophobicContact CD2-CD1 4.11Å; L165-F240 HydrophobicContact CD2-CE1 4.21Å; L165-F240 HydrophobicContact CD2-CG 4.44Å; V178-F240 HydrophobicContact CB-CD2 4.43Å; V178-F240 HydrophobicContact CB-CE2 3.63Å; V178-F240 HydrophobicContact CB-CZ 4.34Å; V178-F240 HydrophobicContact CG1-CE2 3.96Å; V178-F240 HydrophobicContact CG1-CZ 4.18Å; V178-F240 HydrophobicContact CG2-CE2 3.98Å; N179-F240 CarbonylContact O-C 3.56Å; N179-F240 WeakPolarHBondContact O-CA 3.34Å; L180-F240 HydrophobicContact CD2-CB 3.85Å; L180-F240 HydrophobicContact CD2-CD2 3.5Å; L180-F240 HydrophobicContact CD2-CE2 4.31Å; L180-F240 HydrophobicContact CD2-CG 3.95Å; L180-F240 HydrophobicContact CG-CD2 3.94Å; L180-F240 HydrophobicContact CG-CE2 4.48Å; L220-F240 HydrophobicContact CD1-CZ 4.22Å; L220-F240 HydrophobicContact CD2-CE2 4.3Å; L220-F240 HydrophobicContact CD2-CZ 4.42Å; F240-A247 PolarHBondContact N-O 3.03Å; F240-A247 PolarHBondContact O-N 2.93Å; F240-F249 HydrophobicContact CB-CE1 4.25Å
241	S	96.6	Very high	92.6	Very high	27 Å²	27	55.2 Å²	55.2	19%	0.189	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	153.2	-172.7	66.2	0	0	0	0	113.8	V178 N179 H245	V178-S241 CarbonylContact C-O 3.55Å; V178-S241 VanDerWaalsContact CA-O 3.24Å; V178-S241 WeakPolarHBondContact CA-O 3.42Å; N179-S241 PolarHBondContact N-O 2.87Å; N179-S241 PolarHBondContact O-N 3.08Å; S241-H245 CarbonylContact C-O 3.55Å; S241-H245 VanDerWaalsContact CA-O 3.23Å; S241-H245 WeakPolarHBondContact CA-O 3.28Å; S241-H245 VanDerWaalsContact CB-O 3.3Å; S241-H245 WeakPolarHBondContact CB-O 3.28Å
242	T	95	Very high	93.2	Very high	4 Å²	4	51.8 Å²	51.8	3%	0.025	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	140.2	171.1	-169.9	0	0	0	0	109.3	P144 L145 L167 Q177 G244 H245	P144-T242 HydrophobicContact CG-CG2 3.97Å; L145-T242 HydrophobicContact CD2-CG2 3.54Å; L145-T242 HydrophobicContact CG-CG2 4.02Å; L167-T242 HydrophobicContact CD1-CG2 3.68Å; Q177-T242 WeakPolarHBondContact O-CB 2.99Å; Q177-T242 PolarHBondContact O-OG1 3.22Å; T242-G244 PolarHBondContact O-N 3.47Å; T242-H245 HydrophobicContact CG2-CB 4.24Å; T242-H245 PolarHBondContact N-O 2.71Å; T242-H245 WeakPolarHBondContact O-CA 3.3Å; T242-H245 WeakPolarHBondContact O-CB 3.23Å; T242-H245 PolarHBondContact O-N 3.09Å; T242-H245 VanDerWaalsContact O-O 3.08Å
243	K	87.7	Confident	94.3	Very high	101 Å²	101	49.7 Å²	49.7	44%	0.439	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	28.2	65.4	167.9	-65	-177.5	179.1	168.3	0	115.6	V175 H245	V175-K243 PolarHBondContact O-NZ 2.93Å; K243-H245 VanDerWaalsContact C-N 3.25Å; K243-H245 PolarHBondContact O-N 3.06Å; K243-H245 PolarHBondContact O-ND1 2.77Å
244	G	87.6	Confident	94.5	Very high	92 Å²	92	45.6 Å²	45.6	95%	0.948	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.8	-3.3	176.9	0	0	0	0	0	116.4	T242	T242-G244 PolarHBondContact O-N 3.47Å
245	H	92.9	Very high	94.3	Very high	84 Å²	84	47.8 Å²	47.8	39%	0.389	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	137.5	173.2	-56.5	83.2	0	0	0	110	P144 L145 S241 T242 K243	P144-H245 WeakPolarHBondContact CD-CD2 3.44Å; P144-H245 HydrophobicContact CG-CB 4.07Å; L145-H245 HydrophobicContact CD1-CB 4.42Å; S241-H245 CarbonylContact C-O 3.55Å; S241-H245 VanDerWaalsContact CA-O 3.23Å; S241-H245 WeakPolarHBondContact CA-O 3.28Å; S241-H245 VanDerWaalsContact CB-O 3.3Å; S241-H245 WeakPolarHBondContact CB-O 3.28Å; T242-H245 HydrophobicContact CG2-CB 4.24Å; T242-H245 PolarHBondContact N-O 2.71Å; T242-H245 WeakPolarHBondContact O-CA 3.3Å; T242-H245 WeakPolarHBondContact O-CB 3.23Å; T242-H245 PolarHBondContact O-N 3.09Å; T242-H245 VanDerWaalsContact O-O 3.08Å; K243-H245 VanDerWaalsContact C-N 3.25Å; K243-H245 PolarHBondContact O-N 3.06Å; K243-H245 PolarHBondContact O-ND1 2.77Å
246	E	94.9	Very high	93.7	Very high	117 Å²	117	48.7 Å²	48.7	55%	0.547	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	135.8	175.8	-175.4	174.3	102.8	0	0	109.4
247	A	94.9	Very high	93.1	Very high	4 Å²	4	52 Å²	52	3%	0.033	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	144.1	169.7	0	0	0	0	0	108.8	L145 Y147 R239 F240	L145-A247 HydrophobicContact CB-CB 4.43Å; L145-A247 HydrophobicContact CD1-CB 3.96Å; Y147-A247 HydrophobicContact CD1-CB 3.49Å; Y147-A247 VanDerWaalsContact CD1-CB 3.49Å; Y147-A247 HydrophobicContact CD2-CB 4.31Å; Y147-A247 HydrophobicContact CE1-CB 3.32Å; Y147-A247 HydrophobicContact CE2-CB 4.14Å; Y147-A247 HydrophobicContact CG-CB 4Å; R239-A247 WeakPolarHBondContact CA-O 3.25Å; F240-A247 PolarHBondContact N-O 3.03Å; F240-A247 PolarHBondContact O-N 2.93Å
248	T	95.3	Very high	92.6	Very high	68 Å²	68	55.6 Å²	55.6	42%	0.417	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134.3	173.3	-64.7	0	0	0	0	109.2	T237 V238	T237-T248 HydrophobicContact CG2-CG2 3.42Å; T237-T248 VanDerWaalsContact CG2-CG2 3.42Å; V238-T248 VanDerWaalsContact O-CA 3.28Å; V238-T248 WeakPolarHBondContact O-CA 3.36Å
249	F	95.3	Very high	92.3	Very high	6 Å²	6	58.6 Å²	58.6	3%	0.026	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	169.9	172.6	66.4	-86.8	0	0	0	111.2	Y147 P148 V162 L165 V238 F240 I251	Y147-F249 HydrophobicContact CD2-CB 4.04Å; Y147-F249 HydrophobicContact CD2-CD1 4.1Å; Y147-F249 HydrophobicContact CD2-CG 4.39Å; Y147-F249 HydrophobicContact CG-CD1 4.46Å; P148-F249 HydrophobicContact CG-CD2 3.76Å; P148-F249 HydrophobicContact CG-CE2 3.68Å; P148-F249 HydrophobicContact CG-CG 4.28Å; P148-F249 HydrophobicContact CG-CZ 4.15Å; P148-F249 WeakPolarHBondContact O-CB 3.41Å; P148-F249 WeakPolarHBondContact O-CG 3.34Å; V162-F249 HydrophobicContact CG1-CE2 4.16Å; V162-F249 HydrophobicContact CG1-CZ 4.14Å; L165-F249 HydrophobicContact CD2-CE1 4.05Å; L165-F249 HydrophobicContact CD2-CZ 4.13Å; V238-F249 HydrophobicContact CB-CD1 4.41Å; V238-F249 HydrophobicContact CB-CD2 4.36Å; V238-F249 HydrophobicContact CB-CE1 4.1Å; V238-F249 HydrophobicContact CB-CE2 4.05Å; V238-F249 HydrophobicContact CB-CZ 3.92Å; V238-F249 HydrophobicContact CG1-CD1 4.28Å; V238-F249 HydrophobicContact CG1-CE1 3.57Å; V238-F249 HydrophobicContact CG1-CE2 4.11Å; V238-F249 HydrophobicContact CG1-CZ 3.47Å; V238-F249 VanDerWaalsContact CG1-CZ 3.47Å; V238-F249 HydrophobicContact CG2-CE2 4.43Å; V238-F249 PolarHBondContact N-O 3.42Å; V238-F249 PolarHBondContact O-N 3.27Å; F240-F249 HydrophobicContact CB-CE1 4.25Å; F249-I251 HydrophobicContact CD2-CG1 4.36Å; F249-I251 HydrophobicContact CE2-CD1 4.16Å; F249-I251 HydrophobicContact CE2-CG1 3.92Å
250	I	95.6	Very high	91.8	Very high	64 Å²	64	58.5 Å²	58.5	33%	0.328	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	142.1	-177.1	61.8	170.2	0	0	0	111.7	A235 D236 R252	A235-I250 HydrophobicContact CB-CB 4.4Å; D236-I250 VanDerWaalsContact O-CA 3.28Å; D236-I250 WeakPolarHBondContact O-CA 3.33Å; I250-R252 HydrophobicContact CD1-CG 4.49Å
251	I	95.4	Very high	91.5	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	113.7	165.7	-61.6	179.7	0	0	0	107.2	V152 V154 I160 V162 W187 Y225 A235 D236 V238 F249 I253	V152-I251 HydrophobicContact CB-CG1 4.39Å; V152-I251 HydrophobicContact CG1-CB 4.45Å; V152-I251 HydrophobicContact CG1-CD1 4.44Å; V152-I251 HydrophobicContact CG1-CG1 3.94Å; V152-I251 HydrophobicContact CG1-CG2 4.11Å; V154-I251 HydrophobicContact CB-CG2 4.41Å; V154-I251 HydrophobicContact CG1-CG2 3.66Å; I160-I251 HydrophobicContact CD1-CG2 4.29Å; V162-I251 HydrophobicContact CG2-CD1 4.14Å; W187-I251 HydrophobicContact CH2-CD1 4.02Å; Y225-I251 HydrophobicContact CD1-CD1 3.94Å; Y225-I251 HydrophobicContact CD1-CG2 4Å; Y225-I251 HydrophobicContact CD2-CD1 3.62Å; Y225-I251 HydrophobicContact CE1-CD1 4.4Å; Y225-I251 HydrophobicContact CE1-CG2 3.94Å; Y225-I251 HydrophobicContact CE2-CD1 4.08Å; Y225-I251 HydrophobicContact CG-CD1 3.52Å; A235-I251 CarbonylContact C-O 3.51Å; A235-I251 WeakPolarHBondContact CA-O 3.39Å; D236-I251 PolarHBondContact N-O 2.72Å; D236-I251 PolarHBondContact O-N 2.74Å; V238-I251 HydrophobicContact CG2-CD1 3.91Å; V238-I251 HydrophobicContact CG2-CG1 4.13Å; F249-I251 HydrophobicContact CD2-CG1 4.36Å; F249-I251 HydrophobicContact CE2-CD1 4.16Å; F249-I251 HydrophobicContact CE2-CG1 3.92Å; I251-I253 PolarHBondContact O-N 2.83Å
252	R	94.9	Very high	90.9	Very high	57 Å²	57	61.9 Å²	61.9	22%	0.215	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	127.8	178.3	-69.2	-175.3	-179.5	157.4	7.2	109.6	A133 D134 V152 E153 V154 I250	A133-R252 PolarHBondContact O-NH1 3.41Å; A133-R252 PolarHBondContact O-NH2 3.19Å; D134-R252 IonicContact OD1-NH1 3.68Å; D134-R252 PolarHBondContact OD1-NH1 2.91Å; V152-R252 PolarHBondContact O-N 2.92Å; E153-R252 CarbonylContact C-O 3.46Å; E153-R252 WeakPolarHBondContact CA-O 3.42Å; E153-R252 HydrophobicContact CG-CB 4.5Å; V154-R252 PolarHBondContact N-O 2.98Å; I250-R252 HydrophobicContact CD1-CG 4.49Å
253	I	94.9	Very high	89.8	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	100.8	175.7	-57.6	160.2	0	0	0	107.5	V154 P156 L184 S227 N233 T234 D236 I251	V154-I253 HydrophobicContact CG1-CG1 3.86Å; V154-I253 VanDerWaalsContact O-CA 3.3Å; V154-I253 WeakPolarHBondContact O-CA 3.38Å; P156-I253 HydrophobicContact CB-CG2 4.35Å; P156-I253 HydrophobicContact CG-CG2 4.14Å; L184-I253 HydrophobicContact CB-CD1 4.14Å; L184-I253 HydrophobicContact CD1-CD1 4.13Å; S227-I253 WeakPolarHBondContact OG-CD1 3.29Å; N233-I253 PolarHBondContact N-O 2.98Å; T234-I253 HydrophobicContact CG2-CB 3.84Å; T234-I253 HydrophobicContact CG2-CD1 4.05Å; T234-I253 HydrophobicContact CG2-CG2 4.36Å; T234-I253 PolarHBondContact N-O 2.83Å; T234-I253 PolarHBondContact O-N 2.95Å; D236-I253 HydrophobicContact CB-CD1 4.15Å; I251-I253 PolarHBondContact O-N 2.83Å
254	R	92.3	Very high	88.5	Confident	51 Å²	51	65.5 Å²	65.5	19%	0.192	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	161	178.8	65.9	178.8	-175.1	-172.3	-1.5	111.6	D134 E153 V154 Q155 G232	D134-R254 IonicContact OD1-CZ 2.87Å; D134-R254 IonicContact OD1-NH1 2.82Å; D134-R254 IonicContact OD1-NH2 3.19Å; D134-R254 PolarHBondContact OD1-NH2 3.05Å; E153-R254 VanDerWaalsContact CD-NE 3.35Å; E153-R254 HydrophobicContact CG-CG 4.02Å; E153-R254 IonicContact OE1-NE 3.65Å; E153-R254 IonicContact OE2-CZ 2.8Å; E153-R254 IonicContact OE2-NE 3.78Å; E153-R254 PolarHBondContact OE2-NE 3.23Å; E153-R254 IonicContact OE2-NH2 3.08Å; E153-R254 PolarHBondContact OE2-NH2 2.99Å; V154-R254 PolarHBondContact O-N 2.86Å; V154-R254 VanDerWaalsContact O-N 3.08Å; Q155-R254 WeakPolarHBondContact CA-O 3.29Å; G232-R254 WeakPolarHBondContact O-CA 3.35Å; G232-R254 VanDerWaalsContact O-CB 3.25Å; G232-R254 WeakPolarHBondContact O-CB 3.31Å
255	H	88.9	Confident	87	Confident	84 Å²	84	62.2 Å²	62.2	39%	0.389	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-76.3	142.4	165.4	-72	-72.8	0	0	0	109.6
256	P	83.2	Confident	84.8	Confident	55 Å²	55	61.5 Å²	61.5	36%	0.357	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-60.8	150.4	172.3	26.7	-34.5	0	0	0	109.6	H258	P256-H258 PolarHBondContact O-N 3.42Å
257	P	83.4	Confident	82.5	Confident	69 Å²	69	61.7 Å²	61.7	45%	0.448	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-51.1	127.4	177.3	-27.6	35.1	0	0	0	111.7	F125 P259	F125-P257 HydrophobicContact CE1-CB 4.28Å; F125-P257 HydrophobicContact CZ-CB 3.78Å; P257-P259 VanDerWaalsContact O-CD 3.3Å; P257-P259 WeakPolarHBondContact O-CD 3.29Å
258	H	85	Confident	80.1	Confident	148 Å²	148	65.2 Å²	65.2	69%	0.685	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-73.5	117.4	-179	-71.2	-66.2	0	0	0	110.8	P256 R260	P256-H258 PolarHBondContact O-N 3.42Å; H258-R260 PolarHBondContact O-N 3.46Å
259	P	89.8	Confident	77.5	Confident	63 Å²	63	71.8 Å²	71.8	41%	0.409	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-71.6	128.9	179.7	28.7	-33.3	0	0	0	110.8	Y122 F125 P257 L261	Y122-P259 HydrophobicContact CD2-CB 4.07Å; Y122-P259 HydrophobicContact CD2-CG 4.5Å; Y122-P259 HydrophobicContact CE2-CB 4.1Å; Y122-P259 HydrophobicContact CE2-CG 4.21Å; F125-P259 HydrophobicContact CD1-CB 3.93Å; F125-P259 HydrophobicContact CE1-CB 3.86Å; F125-P259 HydrophobicContact CG-CB 4.33Å; F125-P259 HydrophobicContact CZ-CB 4.2Å; P257-P259 VanDerWaalsContact O-CD 3.3Å; P257-P259 WeakPolarHBondContact O-CD 3.29Å; P259-L261 HydrophobicContact CB-CD2 3.86Å; P259-L261 HydrophobicContact CB-CG 4.07Å
260	R	87.9	Confident	75	Confident	135 Å²	135	74.9 Å²	74.9	51%	0.509	41%	0.41	S	S	.	.			trans	-107.4	87.6	165.3	-71.7	-174.2	179.4	-166.7	4.5	108.6	H258 D444	H258-R260 PolarHBondContact O-N 3.46Å; R260-D444 VanDerWaalsContact CD-CB 3.49Å
261	L	89.6	Confident	73.1	Confident	56 Å²	56	76.7 Å²	76.7	29%	0.293	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-86.7	138.8	-179.3	-48.8	-176.7	0	0	0	109.1	R118 E121 Y122 F125 P259	R118-L261 HydrophobicContact CG-CD1 3.84Å; E121-L261 HydrophobicContact CB-CD2 4.49Å; E121-L261 HydrophobicContact CG-CB 3.94Å; E121-L261 HydrophobicContact CG-CD2 3.91Å; E121-L261 HydrophobicContact CG-CG 4.46Å; Y122-L261 HydrophobicContact CD2-CD1 4.4Å; Y122-L261 HydrophobicContact CD2-CD2 4.28Å; F125-L261 HydrophobicContact CB-CD2 4.13Å; P259-L261 HydrophobicContact CB-CD2 3.86Å; P259-L261 HydrophobicContact CB-CG 4.07Å
262	Y	83.9	Confident	71.8	Confident	41 Å²	41	82.8 Å²	82.8	16%	0.161	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-102.4	136.5	174	-69.8	-93.3	0	0	0	108.4	K350	Y262-K350 HydrophobicContact CD1-CB 3.8Å; Y262-K350 HydrophobicContact CD1-CG 4.38Å; Y262-K350 HydrophobicContact CD2-CB 3.95Å; Y262-K350 HydrophobicContact CD2-CD 4.13Å; Y262-K350 HydrophobicContact CD2-CG 3.58Å; Y262-K350 HydrophobicContact CE1-CB 4.16Å; Y262-K350 HydrophobicContact CE2-CB 4.29Å; Y262-K350 HydrophobicContact CE2-CG 3.94Å; Y262-K350 HydrophobicContact CG-CB 3.68Å; Y262-K350 HydrophobicContact CG-CD 4.26Å; Y262-K350 HydrophobicContact CG-CG 3.81Å
263	P	71.6	Confident	71.1	Confident	109 Å²	109	82.7 Å²	82.7	71%	0.708	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-58	144.5	173.2	26	-32.4	0	0	0	108.4	S265	P263-S265 PolarHBondContact O-N 2.8Å
264	P	62	Low	70.8	Confident	72 Å²	72	85.6 Å²	85.6	47%	0.468	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-56.7	119.4	177.9	27.8	-37.8	0	0	0	108.6	T117 S266	T117-P264 HydrophobicContact CG2-CB 4.01Å; T117-P264 HydrophobicContact CG2-CG 3.83Å; T117-P264 WeakPolarHBondContact OG1-CG 3.15Å; P264-S266 PolarHBondContact O-N 2.87Å
265	S	55.5	Low	70.8	Confident	24 Å²	24	83.8 Å²	83.8	17%	0.168	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-67.4	118.5	150.2	46.4	0	0	0	0	104.8	P263 L267 L278	P263-S265 PolarHBondContact O-N 2.8Å; S265-L267 PolarHBondContact O-N 3.05Å; S265-L278 WeakPolarHBondContact OG-CD2 3.47Å; S265-L278 WeakPolarHBondContact OG-CG 3.38Å
266	S	47.4	Very low	71	Confident	68 Å²	68	81 Å²	81	48%	0.476	46%	0.463	S	S	.	.			trans	-40.2	112.3	-177.1	55.5	0	0	0	0	110.3	P264 T268	P264-S266 PolarHBondContact O-N 2.87Å; S266-T268 PolarHBondContact O-N 2.56Å
267	L	46.5	Very low	71.4	Confident	122 Å²	122	80.5 Å²	80.5	64%	0.639	46%	0.463	S	S	*	.			trans	-61.1	93.2	159.6	-73.3	168.2	0	0	0	104.7	S265 Q269 Y273	S265-L267 PolarHBondContact O-N 3.05Å; L267-Q269 PolarHBondContact O-N 2.78Å; L267-Y273 HydrophobicContact CD2-CD1 4.25Å; L267-Y273 HydrophobicContact CD2-CE1 4.44Å
268	T	43	Very low	71.9	Confident	77 Å²	77	77.7 Å²	77.7	47%	0.472	44%	0.444	S	S	.	.	B	Isolated β-bridge	trans	-62.6	139.1	173.6	42	0	0	0	0	107.8	S266 G270	S266-T268 PolarHBondContact O-N 2.56Å; T268-G270 PolarHBondContact O-N 2.86Å; T268-G270 VanDerWaalsContact O-N 3.1Å
269	Q	40.6	Very low	72.5	Confident	206 Å²	206	70.6 Å²	70.6	96%	0.963	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-38.4	117.2	177.8	-75.6	165.3	-22.7	0	0	110.6	L267	L267-Q269 PolarHBondContact O-N 2.78Å
270	G	44.5	Very low	72.9	Confident	71 Å²	71	67.7 Å²	67.7	73%	0.732	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	116.9	28.4	177.6	0	0	0	0	0	117.5	T268 Q272	T268-G270 PolarHBondContact O-N 2.86Å; T268-G270 VanDerWaalsContact O-N 3.1Å; G270-Q272 PolarHBondContact O-N 3.36Å; G270-Q272 VanDerWaalsContact O-N 3.08Å
271	A	54	Low	73.5	Confident	102 Å²	102	61.3 Å²	61.3	84%	0.843	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	21.8	169.1	0	0	0	0	0	116
272	Q	68.1	Low	73.9	Confident	129 Å²	129	58.6 Å²	58.6	60%	0.603	36%	0.355	S	S	*	.	B	Isolated β-bridge	trans	-112.4	127	179.2	-157.2	172.8	2.9	0	0	110.6	G270	G270-Q272 PolarHBondContact O-N 3.36Å; G270-Q272 VanDerWaalsContact O-N 3.08Å
273	Y	81.1	Confident	74.6	Confident	54 Å²	54	56.7 Å²	56.7	21%	0.212	35%	0.347	C	S	.	.			trans	-66.9	139.1	178.4	-60	-70.2	0	0	0	111.6	L267 I275 L278 V371 D372 E375	L267-Y273 HydrophobicContact CD2-CD1 4.25Å; L267-Y273 HydrophobicContact CD2-CE1 4.44Å; Y273-I275 VanDerWaalsContact C-N 3.35Å; Y273-I275 PolarHBondContact O-N 3.31Å; Y273-L278 HydrophobicContact CD1-CD1 4Å; Y273-L278 HydrophobicContact CG-CD1 4.24Å; Y273-V371 HydrophobicContact CD1-CG1 4.13Å; Y273-V371 HydrophobicContact CD2-CB 4.42Å; Y273-V371 HydrophobicContact CD2-CG1 3.8Å; Y273-V371 HydrophobicContact CE1-CG1 4.39Å; Y273-V371 HydrophobicContact CE2-CG1 4.09Å; Y273-V371 HydrophobicContact CG-CG1 3.83Å; Y273-D372 HydrophobicContact CE2-CB 3.92Å; Y273-D372 PolarHBondContact OH-OD1 2.68Å; Y273-E375 HydrophobicContact CE1-CB 4.47Å; Y273-E375 HydrophobicContact CE1-CG 3.97Å
274	N	88.6	Confident	75.8	Confident	61 Å²	61	52 Å²	52	33%	0.326	32%	0.315	S	S	.	.			trans	-77	88	165.3	-176.9	-10.8	0	0	0	109.4	S276 A277 L278	N274-S276 VanDerWaalsContact C-N 3.28Å; N274-S276 PolarHBondContact O-N 2.87Å; N274-S276 PolarHBondContact OD1-N 3.18Å; N274-A277 HydrophobicContact CB-CB 4.3Å; N274-A277 PolarHBondContact O-N 2.79Å; N274-A277 VanDerWaalsContact O-N 3.08Å; N274-A277 PolarHBondContact OD1-N 3.06Å; N274-L278 PolarHBondContact O-N 3.09Å
275	I	92.9	Very high	77.4	Confident	13 Å²	13	48.5 Å²	48.5	7%	0.067	29%	0.293	C	S	.	.	H	α-helix	trans	-57.7	-39.4	-174.3	-59.1	-59.5	0	0	0	112.2	Y273 A277 L278 V279 Y303 I306 L367 E368 V371	Y273-I275 VanDerWaalsContact C-N 3.35Å; Y273-I275 PolarHBondContact O-N 3.31Å; I275-A277 PolarHBondContact O-N 3.46Å; I275-L278 PolarHBondContact O-N 3.03Å; I275-L278 VanDerWaalsContact O-N 3.14Å; I275-V279 HydrophobicContact CG2-CB 4.21Å; I275-V279 HydrophobicContact CG2-CG2 4.02Å; I275-V279 WeakPolarHBondContact O-CB 3.48Å; I275-V279 PolarHBondContact O-N 3.49Å; I275-Y303 HydrophobicContact CB-CE1 4.45Å; I275-Y303 HydrophobicContact CG2-CD1 4.08Å; I275-Y303 HydrophobicContact CG2-CE1 4Å; I275-I306 HydrophobicContact CG2-CD1 4.22Å; I275-L367 HydrophobicContact CG2-CB 4.05Å; I275-L367 HydrophobicContact CG2-CD1 4.09Å; I275-E368 HydrophobicContact CD1-CB 4.26Å; I275-E368 HydrophobicContact CD1-CG 3.94Å; I275-E368 HydrophobicContact CG1-CG 3.91Å; I275-V371 HydrophobicContact CD1-CB 4.28Å; I275-V371 HydrophobicContact CD1-CG2 3.91Å
276	S	93.3	Very high	79.3	Confident	25 Å²	25	47.7 Å²	47.7	18%	0.175	29%	0.287	C	S	.	.	H	α-helix	trans	-64.7	-25.3	-179.9	-64.2	0	0	0	0	113.8	N274 T305 I306	N274-S276 VanDerWaalsContact C-N 3.28Å; N274-S276 PolarHBondContact O-N 2.87Å; N274-S276 PolarHBondContact OD1-N 3.18Å; S276-T305 VanDerWaalsContact OG-C 3.3Å; S276-T305 PolarHBondContact OG-O 2.9Å; S276-T305 PolarHBondContact OG-OG1 3.29Å; S276-I306 PolarHBondContact OG-N 3.35Å
277	A	91.8	Very high	81.5	Confident	45 Å²	45	46.3 Å²	46.3	37%	0.372	27%	0.273	S	S	.	.	H	α-helix	trans	-88.7	-21.1	176.1	0	0	0	0	0	112.9	N274 I275	N274-A277 HydrophobicContact CB-CB 4.3Å; N274-A277 PolarHBondContact O-N 2.79Å; N274-A277 VanDerWaalsContact O-N 3.08Å; N274-A277 PolarHBondContact OD1-N 3.06Å; I275-A277 PolarHBondContact O-N 3.46Å
278	L	93.6	Very high	83.6	Confident	10 Å²	10	42.2 Å²	42.2	5%	0.052	25%	0.25	C	C	.	.	H	α-helix	trans	-95.4	-28.6	-179.4	-74	178.8	0	0	0	114	S265 Y273 N274 I275 T349 K350 Y351 V371	S265-L278 WeakPolarHBondContact OG-CD2 3.47Å; S265-L278 WeakPolarHBondContact OG-CG 3.38Å; Y273-L278 HydrophobicContact CD1-CD1 4Å; Y273-L278 HydrophobicContact CG-CD1 4.24Å; N274-L278 PolarHBondContact O-N 3.09Å; I275-L278 PolarHBondContact O-N 3.03Å; I275-L278 VanDerWaalsContact O-N 3.14Å; L278-T349 WeakPolarHBondContact O-CB 3.33Å; L278-K350 HydrophobicContact CD2-CB 4.18Å; L278-K350 HydrophobicContact CD2-CD 4.16Å; L278-K350 PolarHBondContact O-N 2.9Å; L278-Y351 HydrophobicContact CB-CD2 4.29Å; L278-Y351 PolarHBondContact O-N 3.46Å; L278-V371 HydrophobicContact CD1-CG1 3.81Å
279	V	97.4	Very high	86	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	132.1	-168.8	-173.4	0	0	0	0	110.1	I275 I306 Y351 L353 V371 L440	I275-V279 HydrophobicContact CG2-CB 4.21Å; I275-V279 HydrophobicContact CG2-CG2 4.02Å; I275-V279 WeakPolarHBondContact O-CB 3.48Å; I275-V279 PolarHBondContact O-N 3.49Å; V279-I306 HydrophobicContact CB-CD1 3.88Å; V279-I306 HydrophobicContact CG1-CD1 3.92Å; V279-I306 WeakPolarHBondContact O-CD1 3.01Å; V279-I306 WeakPolarHBondContact O-CG1 3.5Å; V279-Y351 WeakPolarHBondContact CA-O 3.35Å; V279-L353 HydrophobicContact CG1-CB 3.91Å; V279-V371 HydrophobicContact CG2-CG2 3.67Å; V279-L440 HydrophobicContact CB-CD1 4.46Å; V279-L440 HydrophobicContact CG1-CD1 3.62Å; V279-L440 HydrophobicContact CG2-CD1 4Å
280	T	98.7	Very high	88.5	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.012	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	135.7	162.2	-68.7	0	0	0	0	108.1	T307 V309 V347 T349 Y351 V352 L353	T280-T307 HydrophobicContact CG2-CG2 4.24Å; T280-V309 HydrophobicContact CG2-CB 4.39Å; T280-V309 HydrophobicContact CG2-CG2 3.64Å; T280-V347 HydrophobicContact CG2-CG1 4.34Å; T280-V347 HydrophobicContact CG2-CG2 3.88Å; T280-T349 WeakPolarHBondContact CB-OG1 3.41Å; T280-T349 PolarHBondContact N-OG1 3.02Å; T280-T349 VanDerWaalsContact OG1-CG2 3.25Å; T280-T349 WeakPolarHBondContact OG1-CG2 3.3Å; T280-T349 PolarHBondContact OG1-OG1 3.03Å; T280-T349 VanDerWaalsContact OG1-OG1 3.1Å; T280-Y351 PolarHBondContact N-O 2.84Å; T280-Y351 VanDerWaalsContact N-O 3.12Å; T280-V352 WeakPolarHBondContact O-CA 3.06Å; T280-L353 PolarHBondContact O-N 3.05Å
281	I	98.9	Very high	90.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	124	174.8	-58.2	-178.5	0	0	0	108.1	I299 I306 T307 I308 V309 L353 V355 F361	I281-I299 HydrophobicContact CD1-CB 4.49Å; I281-I299 HydrophobicContact CD1-CD1 3.85Å; I281-I299 HydrophobicContact CD1-CG1 3.96Å; I281-I299 HydrophobicContact CD1-CG2 3.68Å; I281-I299 HydrophobicContact CG2-CD1 3.99Å; I281-I306 HydrophobicContact CD1-CD1 3.98Å; I281-I306 HydrophobicContact CD1-CG2 3.79Å; I281-I306 HydrophobicContact CG1-CD1 3.75Å; I281-I306 HydrophobicContact CG1-CG1 4.27Å; I281-I306 HydrophobicContact CG1-CG2 4.25Å; I281-T307 PolarHBondContact N-O 3.28Å; I281-I308 CarbonylContact O-C 3.39Å; I281-I308 VanDerWaalsContact O-CA 3.31Å; I281-I308 WeakPolarHBondContact O-CA 3.34Å; I281-V309 PolarHBondContact O-N 3.22Å; I281-L353 HydrophobicContact CD1-CD2 4.08Å; I281-L353 HydrophobicContact CG1-CB 4.27Å; I281-L353 HydrophobicContact CG1-CD2 3.89Å; I281-L353 HydrophobicContact CG2-CD2 4.4Å; I281-V355 HydrophobicContact CG2-CG1 4.18Å; I281-V355 HydrophobicContact CG2-CG2 3.54Å; I281-F361 HydrophobicContact CD1-CE2 4Å; I281-F361 HydrophobicContact CD1-CZ 3.81Å
282	A	98.8	Very high	92.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133.8	176.7	0	0	0	0	0	109.9	V309 A343 V347 V352 L353 W354 V355	A282-V309 WeakPolarHBondContact CA-O 3.39Å; A282-A343 HydrophobicContact CB-CB 4.05Å; A282-V347 HydrophobicContact CB-CG2 4.49Å; A282-V352 HydrophobicContact CB-CG2 3.55Å; A282-L353 PolarHBondContact N-O 3.13Å; A282-W354 HydrophobicContact CB-CE3 4.09Å; A282-W354 HydrophobicContact CB-CZ3 4.2Å; A282-V355 PolarHBondContact O-N 3.37Å; A282-V355 VanDerWaalsContact O-N 3.09Å
283	T	98.4	Very high	94.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	163.9	175	-165.3	0	0	0	0	111.4	L292 L295 V309 I310 A311 V355 D357	T283-L292 HydrophobicContact CG2-CD1 4.01Å; T283-L295 HydrophobicContact CG2-CD2 4.22Å; T283-V309 PolarHBondContact N-O 2.73Å; T283-I310 HydrophobicContact CG2-CB 4.4Å; T283-I310 HydrophobicContact CG2-CG1 3.93Å; T283-I310 HydrophobicContact CG2-CG2 4.32Å; T283-A311 PolarHBondContact O-N 3.32Å; T283-V355 WeakPolarHBondContact CA-O 3.44Å; T283-V355 WeakPolarHBondContact CB-O 3.43Å; T283-V355 PolarHBondContact OG1-O 2.98Å; T283-D357 PolarHBondContact OG1-N 2.88Å
284	K	96.5	Very high	94.8	Very high	10 Å²	10	30.4 Å²	30.4	4%	0.043	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	130.4	174.4	-178	-86.1	176.7	-176	0	109.1	A311 D313 W336 W354	K284-A311 CarbonylContact C-O 3.58Å; K284-A311 VanDerWaalsContact CA-O 3.23Å; K284-A311 WeakPolarHBondContact CA-O 3.42Å; K284-A311 HydrophobicContact CG-CB 4.43Å; K284-D313 VanDerWaalsContact CE-CG 3.4Å; K284-D313 WeakPolarHBondContact CE-OD1 3.38Å; K284-D313 WeakPolarHBondContact CE-OD2 3.47Å; K284-D313 IonicContact NZ-OD1 2.73Å; K284-D313 PolarHBondContact NZ-OD1 2.91Å; K284-D313 IonicContact NZ-OD2 3.59Å; K284-D313 PolarHBondContact NZ-OD2 2.82Å; K284-D313 VanDerWaalsContact NZ-OD2 3.08Å; K284-W336 HydrophobicContact CD-CE3 3.99Å; K284-W336 HydrophobicContact CD-CZ3 4.12Å; K284-W354 HydrophobicContact CB-CH2 3.76Å; K284-W354 HydrophobicContact CB-CZ2 4.06Å
285	T	95.8	Very high	95.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	159.9	175.6	-162	0	0	0	0	112.3	L292 I310 A311 D312 D313 D357	T285-L292 HydrophobicContact CG2-CD2 3.79Å; T285-I310 HydrophobicContact CG2-CG2 4.09Å; T285-A311 PolarHBondContact N-O 3.05Å; T285-D312 HydrophobicContact CG2-CB 3.89Å; T285-D312 WeakPolarHBondContact CG2-OD2 3.31Å; T285-D313 VanDerWaalsContact O-OD1 3.08Å; T285-D357 WeakPolarHBondContact CA-OD2 3.29Å; T285-D357 WeakPolarHBondContact CB-OD2 3.46Å; T285-D357 PolarHBondContact OG1-OD2 3.23Å
286	F	95.3	Very high	95.5	Very high	7 Å²	7	27.5 Å²	27.5	3%	0.031	14%	0.141	C	C	.	.	S	Bend	trans	-156.1	108.2	171.7	-178.8	-120.4	0	0	0	109.5	R288 D313 F332 Y501 Y504	F286-R288 WeakPolarHBondContact O-CG 3.45Å; F286-R288 PolarHBondContact O-N 3.38Å; F286-R288 VanDerWaalsContact O-N 3.13Å; F286-D313 WeakPolarHBondContact CB-OD1 3.48Å; F286-D313 VanDerWaalsContact CD2-O 3.27Å; F286-D313 WeakPolarHBondContact CD2-O 3.41Å; F286-D313 WeakPolarHBondContact CD2-OD1 3.39Å; F286-D313 VanDerWaalsContact CE2-O 3.29Å; F286-D313 WeakPolarHBondContact CE2-O 3.28Å; F286-F332 AromaticContact CE2-CD2 3.75Å; F286-F332 HydrophobicContact CE2-CD2 3.75Å; F286-F332 AromaticContact CE2-CE2 3.35Å; F286-F332 HydrophobicContact CE2-CE2 3.35Å; F286-F332 HydrophobicContact CE2-CZ 4.18Å; F286-F332 HydrophobicContact CZ-CD2 4.36Å; F286-F332 AromaticContact CZ-CE2 3.56Å; F286-F332 HydrophobicContact CZ-CE2 3.56Å; F286-F332 AromaticContact CZ-CZ 3.96Å; F286-F332 HydrophobicContact CZ-CZ 3.96Å; F286-Y501 AromaticContact CD1-CD2 3.84Å; F286-Y501 HydrophobicContact CD1-CD2 3.84Å; F286-Y501 HydrophobicContact CD1-CE2 4.45Å; F286-Y501 VanDerWaalsContact O-CD2 3.26Å; F286-Y501 WeakPolarHBondContact O-CD2 3.44Å; F286-Y504 AromaticContact CE1-CD2 3.47Å; F286-Y504 HydrophobicContact CE1-CD2 3.47Å; F286-Y504 VanDerWaalsContact CE1-CD2 3.47Å; F286-Y504 HydrophobicContact CE1-CE2 4.15Å; F286-Y504 AromaticContact CE1-CG 3.7Å; F286-Y504 HydrophobicContact CE1-CG 3.7Å; F286-Y504 AromaticContact CZ-CD2 3.63Å; F286-Y504 HydrophobicContact CZ-CD2 3.63Å; F286-Y504 AromaticContact CZ-CE2 3.82Å; F286-Y504 HydrophobicContact CZ-CE2 3.82Å; F286-Y504 HydrophobicContact CZ-CG 4.05Å
287	L	93.4	Very high	95.8	Very high	38 Å²	38	29.4 Å²	29.4	20%	0.199	16%	0.158	C	C	.	.	S	Bend	trans	56.7	26.3	175.4	-49.6	177	0	0	0	114.5	S314 T500	L287-S314 PolarHBondContact N-OG 3.1Å; L287-T500 HydrophobicContact CD1-CG2 3.69Å
288	R	91.4	Very high	96.1	Very high	37 Å²	37	27.9 Å²	27.9	14%	0.14	14%	0.144	C	C	.	.			trans	-130.7	46.7	-174.4	-69	-165.2	-65	-178.6	-10.2	113.6	F286 D290 R291 L292 D357 D358 Y501	F286-R288 WeakPolarHBondContact O-CG 3.45Å; F286-R288 PolarHBondContact O-N 3.38Å; F286-R288 VanDerWaalsContact O-N 3.13Å; R288-D290 VanDerWaalsContact C-N 3.32Å; R288-D290 PolarHBondContact O-N 3.45Å; R288-R291 HydrophobicContact CB-CB 4.27Å; R288-R291 HydrophobicContact CB-CG 4.33Å; R288-R291 WeakPolarHBondContact O-CB 3.39Å; R288-R291 PolarHBondContact O-N 2.86Å; R288-L292 PolarHBondContact O-N 3.43Å; R288-D357 IonicContact CZ-OD1 2.72Å; R288-D357 IonicContact CZ-OD2 3.98Å; R288-D357 IonicContact NE-OD1 2.92Å; R288-D357 PolarHBondContact NE-OD1 3.22Å; R288-D357 IonicContact NE-OD2 3.95Å; R288-D357 PolarHBondContact NE-OD2 3.38Å; R288-D357 IonicContact NH1-OD1 3.18Å; R288-D357 IonicContact NH2-OD1 2.93Å; R288-D357 PolarHBondContact NH2-OD1 2.77Å; R288-D357 IonicContact NH2-OD2 3.88Å; R288-D358 IonicContact CZ-OD2 3.73Å; R288-D358 IonicContact NH1-OD2 3.15Å; R288-D358 PolarHBondContact NH1-OD2 2.81Å; R288-Y501 HydrophobicContact CG-CD2 3.85Å; R288-Y501 HydrophobicContact CG-CE2 3.93Å; R288-Y501 HydrophobicContact CG-CG 4.24Å; R288-Y501 VanDerWaalsContact CZ-CZ 3.46Å; R288-Y501 VanDerWaalsContact NE-CE2 3.31Å; R288-Y501 PolarHBondContact NH1-OH 2.87Å; R288-Y501 PolarHBondContact NH2-OH 3.35Å
289	Y	93.4	Very high	96.3	Very high	11 Å²	11	27.4 Å²	27.4	4%	0.043	14%	0.142	C	C	.	.	H	α-helix	trans	-59.3	-35	-175.5	-75.9	-73.5	0	0	0	114.9	R291 L292 R293 D312 P317 E318 I320	Y289-R291 VanDerWaalsContact C-N 3.27Å; Y289-R291 PolarHBondContact O-N 2.75Å; Y289-L292 HydrophobicContact CD1-CD2 4.06Å; Y289-L292 HydrophobicContact CE1-CD2 4.13Å; Y289-L292 PolarHBondContact O-N 3.17Å; Y289-R293 WeakPolarHBondContact O-CB 3.36Å; Y289-R293 VanDerWaalsContact O-CG 3.25Å; Y289-R293 WeakPolarHBondContact O-CG 3.5Å; Y289-R293 PolarHBondContact O-N 2.93Å; Y289-D312 PolarHBondContact OH-OD2 3.39Å; Y289-P317 WeakPolarHBondContact OH-CA 3.31Å; Y289-P317 WeakPolarHBondContact OH-CB 3.48Å; Y289-E318 WeakPolarHBondContact CB-OE1 3.42Å; Y289-E318 HydrophobicContact CD1-CB 3.75Å; Y289-E318 HydrophobicContact CD1-CG 4.29Å; Y289-E318 HydrophobicContact CD2-CB 3.87Å; Y289-E318 HydrophobicContact CD2-CG 3.52Å; Y289-E318 WeakPolarHBondContact CD2-OE1 3.44Å; Y289-E318 HydrophobicContact CE1-CB 3.72Å; Y289-E318 HydrophobicContact CE1-CG 4.46Å; Y289-E318 HydrophobicContact CE2-CB 3.81Å; Y289-E318 HydrophobicContact CE2-CG 3.7Å; Y289-E318 HydrophobicContact CG-CB 3.84Å; Y289-E318 HydrophobicContact CG-CG 3.84Å; Y289-E318 PolarHBondContact OH-N 3.49Å; Y289-I320 HydrophobicContact CD1-CD1 4.04Å; Y289-I320 HydrophobicContact CE1-CD1 4.24Å
290	D	91.8	Very high	96.3	Very high	124 Å²	124	29.4 Å²	29.4	66%	0.663	15%	0.149	S	C	*	.	H	α-helix	trans	-60.7	-38.5	175.6	-65.6	-28.4	0	0	0	112.4	R288 S294	R288-D290 VanDerWaalsContact C-N 3.32Å; R288-D290 PolarHBondContact O-N 3.45Å; D290-S294 PolarHBondContact O-N 2.86Å; D290-S294 VanDerWaalsContact O-N 3.16Å; D290-S294 PolarHBondContact O-OG 2.79Å
291	R	92.8	Very high	96.3	Very high	97 Å²	97	38.9 Å²	38.9	37%	0.366	19%	0.185	S	C	.	.	H	α-helix	trans	-71	-47.7	176.7	-58.6	-54.1	-173.8	-175.6	5.9	110.3	R288 Y289 R293 S294 L295 D357 D358 S485	R288-R291 HydrophobicContact CB-CB 4.27Å; R288-R291 HydrophobicContact CB-CG 4.33Å; R288-R291 WeakPolarHBondContact O-CB 3.39Å; R288-R291 PolarHBondContact O-N 2.86Å; Y289-R291 VanDerWaalsContact C-N 3.27Å; Y289-R291 PolarHBondContact O-N 2.75Å; R291-R293 VanDerWaalsContact C-N 3.33Å; R291-R293 PolarHBondContact O-N 2.85Å; R291-S294 CarbonylContact O-C 3.56Å; R291-S294 WeakPolarHBondContact O-CA 3.4Å; R291-S294 WeakPolarHBondContact O-CB 3.46Å; R291-S294 PolarHBondContact O-N 2.73Å; R291-L295 PolarHBondContact O-N 3.12Å; R291-D357 CarbonylContact C-O 3.54Å; R291-D357 WeakPolarHBondContact CB-O 3.43Å; R291-D357 VanDerWaalsContact O-O 3.11Å; R291-D358 HydrophobicContact CB-CB 4.14Å; R291-D358 HydrophobicContact CG-CB 4.27Å; R291-S485 PolarHBondContact NH2-O 2.68Å
292	L	95.8	Very high	96.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-57.8	-43.8	177.4	180	61.4	0	0	0	112.2	T283 T285 R288 Y289 S294 L295 I296 I310 I320 D357	T283-L292 HydrophobicContact CG2-CD1 4.01Å; T285-L292 HydrophobicContact CG2-CD2 3.79Å; R288-L292 PolarHBondContact O-N 3.43Å; Y289-L292 HydrophobicContact CD1-CD2 4.06Å; Y289-L292 HydrophobicContact CE1-CD2 4.13Å; Y289-L292 PolarHBondContact O-N 3.17Å; L292-S294 VanDerWaalsContact C-N 3.32Å; L292-S294 PolarHBondContact O-N 2.87Å; L292-L295 HydrophobicContact CD1-CD2 4.46Å; L292-L295 WeakPolarHBondContact O-CB 3.29Å; L292-L295 PolarHBondContact O-N 3.1Å; L292-I296 HydrophobicContact CD1-CD1 4.14Å; L292-I296 HydrophobicContact CD1-CG1 4.36Å; L292-I296 HydrophobicContact CG-CD1 3.92Å; L292-I296 VanDerWaalsContact O-CG1 3.27Å; L292-I296 WeakPolarHBondContact O-CG1 3.25Å; L292-I296 PolarHBondContact O-N 2.77Å; L292-I310 HydrophobicContact CD1-CD1 4.04Å; L292-I310 HydrophobicContact CD1-CG1 4.46Å; L292-I310 HydrophobicContact CD1-CG2 4.44Å; L292-I310 HydrophobicContact CD2-CD1 4.13Å; L292-I310 HydrophobicContact CD2-CG2 4.11Å; L292-I310 HydrophobicContact CG-CD1 4.42Å; L292-I320 HydrophobicContact CD2-CD1 4.11Å; L292-I320 HydrophobicContact CD2-CG1 4.44Å; L292-D357 HydrophobicContact CD1-CB 4.33Å; L292-D357 PolarHBondContact N-O 2.86Å
293	R	96.6	Very high	96.2	Very high	99 Å²	99	43.1 Å²	43.1	37%	0.374	20%	0.203	S	C	.	.	H	α-helix	trans	-63.4	-38.7	176	-71.1	177.2	-165.5	-68.3	-2.1	111.6	Y289 R291 I296 A297 E318 R319	Y289-R293 WeakPolarHBondContact O-CB 3.36Å; Y289-R293 VanDerWaalsContact O-CG 3.25Å; Y289-R293 WeakPolarHBondContact O-CG 3.5Å; Y289-R293 PolarHBondContact O-N 2.93Å; R291-R293 VanDerWaalsContact C-N 3.33Å; R291-R293 PolarHBondContact O-N 2.85Å; R293-I296 PolarHBondContact O-N 3.35Å; R293-A297 VanDerWaalsContact O-CB 3.28Å; R293-A297 WeakPolarHBondContact O-CB 3.36Å; R293-A297 PolarHBondContact O-N 3.33Å; R293-E318 IonicContact CZ-OE2 3.36Å; R293-E318 IonicContact NE-OE2 3.39Å; R293-E318 IonicContact NH2-OE2 3.08Å; R293-E318 PolarHBondContact NH2-OE2 2.63Å; R293-R319 PolarHBondContact NH2-O 3.35Å
294	S	96.2	Very high	96.2	Very high	59 Å²	59	46.8 Å²	46.8	41%	0.413	23%	0.227	S	C	.	.	H	α-helix	trans	-65	-42.7	174.8	-58.2	0	0	0	0	111.9	D290 R291 L292 S298	D290-S294 PolarHBondContact O-N 2.86Å; D290-S294 VanDerWaalsContact O-N 3.16Å; D290-S294 PolarHBondContact O-OG 2.79Å; R291-S294 CarbonylContact O-C 3.56Å; R291-S294 WeakPolarHBondContact O-CA 3.4Å; R291-S294 WeakPolarHBondContact O-CB 3.46Å; R291-S294 PolarHBondContact O-N 2.73Å; L292-S294 VanDerWaalsContact C-N 3.32Å; L292-S294 PolarHBondContact O-N 2.87Å; S294-S298 WeakPolarHBondContact O-CB 3.41Å; S294-S298 PolarHBondContact O-N 3.32Å; S294-S298 PolarHBondContact O-OG 3.18Å
295	L	97.9	Very high	96.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-58.1	-55.4	173.2	171.2	64.7	0	0	0	110.2	T283 R291 L292 A297 S298 I299 V355 F359 F361	T283-L295 HydrophobicContact CG2-CD2 4.22Å; R291-L295 PolarHBondContact O-N 3.12Å; L292-L295 HydrophobicContact CD1-CD2 4.46Å; L292-L295 WeakPolarHBondContact O-CB 3.29Å; L292-L295 PolarHBondContact O-N 3.1Å; L295-A297 PolarHBondContact O-N 3.05Å; L295-S298 PolarHBondContact O-N 3.4Å; L295-S298 VanDerWaalsContact O-N 3.14Å; L295-S298 PolarHBondContact O-OG 3.26Å; L295-I299 HydrophobicContact CD1-CD1 3.7Å; L295-I299 HydrophobicContact CD1-CG1 4.05Å; L295-I299 HydrophobicContact CD2-CD1 4.43Å; L295-I299 HydrophobicContact CG-CD1 3.76Å; L295-I299 HydrophobicContact CG-CG1 4.46Å; L295-I299 WeakPolarHBondContact O-CG1 3.23Å; L295-I299 PolarHBondContact O-N 3.28Å; L295-V355 HydrophobicContact CD1-CG2 4.27Å; L295-V355 HydrophobicContact CD2-CG2 3.82Å; L295-F359 WeakPolarHBondContact CA-O 3.33Å; L295-F359 WeakPolarHBondContact CB-O 3.22Å; L295-F359 HydrophobicContact CD1-CB 4.17Å; L295-F359 VanDerWaalsContact CD1-O 3.31Å; L295-F359 WeakPolarHBondContact CD1-O 3.46Å; L295-F361 HydrophobicContact CD1-CD1 3.98Å; L295-F361 HydrophobicContact CD1-CE1 3.85Å
296	I	98.4	Very high	96.3	Very high	14 Å²	14	50.5 Å²	50.5	7%	0.072	25%	0.25	C	S	.	.	H	α-helix	trans	-56.6	-48.3	-179.6	-66.7	163.9	0	0	0	110.8	L292 R293 S298 I299 R300 I308 I310 I320	L292-I296 HydrophobicContact CD1-CD1 4.14Å; L292-I296 HydrophobicContact CD1-CG1 4.36Å; L292-I296 HydrophobicContact CG-CD1 3.92Å; L292-I296 VanDerWaalsContact O-CG1 3.27Å; L292-I296 WeakPolarHBondContact O-CG1 3.25Å; L292-I296 PolarHBondContact O-N 2.77Å; R293-I296 PolarHBondContact O-N 3.35Å; I296-S298 VanDerWaalsContact C-N 3.31Å; I296-S298 PolarHBondContact O-N 3.31Å; I296-I299 PolarHBondContact O-N 3.32Å; I296-R300 HydrophobicContact CG2-CG 4.29Å; I296-R300 VanDerWaalsContact O-CG 3.31Å; I296-R300 WeakPolarHBondContact O-CG 3.49Å; I296-R300 PolarHBondContact O-N 2.6Å; I296-I308 HydrophobicContact CG1-CD1 4.3Å; I296-I308 HydrophobicContact CG2-CD1 4.26Å; I296-I310 HydrophobicContact CD1-CD1 3.93Å; I296-I320 HydrophobicContact CD1-CD1 4.4Å; I296-I320 HydrophobicContact CD1-CG2 3.79Å
297	A	98.1	Very high	96.4	Very high	64 Å²	64	51.9 Å²	51.9	53%	0.529	26%	0.259	S	S	.	.	H	α-helix	trans	-60.1	-41.4	179.1	0	0	0	0	0	112.1	R293 L295 R300 R301	R293-A297 VanDerWaalsContact O-CB 3.28Å; R293-A297 WeakPolarHBondContact O-CB 3.36Å; R293-A297 PolarHBondContact O-N 3.33Å; L295-A297 PolarHBondContact O-N 3.05Å; A297-R300 PolarHBondContact O-N 2.97Å; A297-R301 PolarHBondContact O-N 3.04Å; A297-R301 VanDerWaalsContact O-N 3.13Å
298	S	98.4	Very high	96.7	Very high	13 Å²	13	50 Å²	50	9%	0.091	25%	0.25	C	C	.	.	H	α-helix	trans	-68.4	-40	176.8	74.9	0	0	0	0	112.4	S294 L295 I296 R301 F302 F361	S294-S298 WeakPolarHBondContact O-CB 3.41Å; S294-S298 PolarHBondContact O-N 3.32Å; S294-S298 PolarHBondContact O-OG 3.18Å; L295-S298 PolarHBondContact O-N 3.4Å; L295-S298 VanDerWaalsContact O-N 3.14Å; L295-S298 PolarHBondContact O-OG 3.26Å; I296-S298 VanDerWaalsContact C-N 3.31Å; I296-S298 PolarHBondContact O-N 3.31Å; S298-R301 WeakPolarHBondContact O-CB 3.49Å; S298-R301 PolarHBondContact O-N 3.36Å; S298-F302 WeakPolarHBondContact O-CD2 3.34Å; S298-F302 PolarHBondContact O-N 3.07Å; S298-F361 PolarHBondContact OG-N 2.9Å
299	I	98.6	Very high	97	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59	-50.2	173.3	-70.6	166.6	0	0	0	109.3	I281 L295 I296 R301 F302 Y303 I306 I308 F361	I281-I299 HydrophobicContact CD1-CB 4.49Å; I281-I299 HydrophobicContact CD1-CD1 3.85Å; I281-I299 HydrophobicContact CD1-CG1 3.96Å; I281-I299 HydrophobicContact CD1-CG2 3.68Å; I281-I299 HydrophobicContact CG2-CD1 3.99Å; L295-I299 HydrophobicContact CD1-CD1 3.7Å; L295-I299 HydrophobicContact CD1-CG1 4.05Å; L295-I299 HydrophobicContact CD2-CD1 4.43Å; L295-I299 HydrophobicContact CG-CD1 3.76Å; L295-I299 HydrophobicContact CG-CG1 4.46Å; L295-I299 WeakPolarHBondContact O-CG1 3.23Å; L295-I299 PolarHBondContact O-N 3.28Å; I296-I299 PolarHBondContact O-N 3.32Å; I299-R301 PolarHBondContact O-N 3.27Å; I299-F302 PolarHBondContact O-N 3.34Å; I299-Y303 CarbonylContact O-C 3.59Å; I299-Y303 WeakPolarHBondContact O-CA 3.31Å; I299-Y303 PolarHBondContact O-N 3.04Å; I299-I306 HydrophobicContact CG2-CG2 3.56Å; I299-I308 HydrophobicContact CB-CD1 4.15Å; I299-I308 HydrophobicContact CD1-CD1 3.88Å; I299-I308 HydrophobicContact CD1-CG1 4.37Å; I299-I308 HydrophobicContact CG2-CD1 3.78Å; I299-I308 HydrophobicContact CG2-CG1 4.23Å; I299-F361 HydrophobicContact CD1-CE1 4.12Å; I299-F361 HydrophobicContact CD1-CZ 4.43Å; I299-F361 HydrophobicContact CG1-CD1 3.64Å; I299-F361 HydrophobicContact CG1-CD2 4.26Å; I299-F361 HydrophobicContact CG1-CE1 3.6Å; I299-F361 HydrophobicContact CG1-CE2 4.21Å; I299-F361 HydrophobicContact CG1-CG 4Å; I299-F361 HydrophobicContact CG1-CZ 3.89Å
300	R	98	Very high	97.3	Very high	43 Å²	43	47.8 Å²	47.8	16%	0.162	24%	0.241	C	C	.	.	H	α-helix	trans	-61.3	-27.8	-178.5	-69.1	-68.7	173.2	-113.3	-0.3	113.4	I296 A297 P304 I306 D322 L324	I296-R300 HydrophobicContact CG2-CG 4.29Å; I296-R300 VanDerWaalsContact O-CG 3.31Å; I296-R300 WeakPolarHBondContact O-CG 3.49Å; I296-R300 PolarHBondContact O-N 2.6Å; A297-R300 PolarHBondContact O-N 2.97Å; R300-P304 VanDerWaalsContact CD-O 3.31Å; R300-P304 WeakPolarHBondContact CD-O 3.47Å; R300-P304 PolarHBondContact NH1-O 3.34Å; R300-P304 VanDerWaalsContact O-CA 3.31Å; R300-P304 WeakPolarHBondContact O-CA 3.28Å; R300-P304 WeakPolarHBondContact O-CB 3.46Å; R300-I306 PolarHBondContact NH1-O 3.1Å; R300-I306 PolarHBondContact NH2-O 3.42Å; R300-D322 IonicContact CZ-OD1 2.56Å; R300-D322 IonicContact CZ-OD2 3.69Å; R300-D322 IonicContact NE-OD1 2.92Å; R300-D322 PolarHBondContact NE-OD1 2.89Å; R300-D322 IonicContact NE-OD2 3.74Å; R300-D322 PolarHBondContact NE-OD2 2.81Å; R300-D322 IonicContact NH2-OD1 3.24Å; R300-D322 PolarHBondContact NH2-OD1 3.22Å; R300-D322 IonicContact NH2-OD2 3.22Å; R300-D322 PolarHBondContact NH2-OD2 2.73Å; R300-L324 VanDerWaalsContact NH2-CB 3.35Å; R300-L324 PolarHBondContact NH2-O 2.75Å; R300-L324 VanDerWaalsContact NH2-O 3.15Å
301	R	98.1	Very high	97.6	Very high	201 Å²	201	41.9 Å²	41.9	76%	0.758	21%	0.21	S	C	*	.	H	α-helix	trans	-66.5	-36.4	174.6	-178.5	176.7	176.6	171.5	1.5	113.4	A297 S298 I299	A297-R301 PolarHBondContact O-N 3.04Å; A297-R301 VanDerWaalsContact O-N 3.13Å; S298-R301 WeakPolarHBondContact O-CB 3.49Å; S298-R301 PolarHBondContact O-N 3.36Å; I299-R301 PolarHBondContact O-N 3.27Å
302	F	97.9	Very high	97.8	Very high	71 Å²	71	37.2 Å²	37.2	31%	0.311	19%	0.192	S	C	.	.	H	α-helix	trans	-106.4	-30.6	-174.6	-68.3	-80.6	0	0	0	113.3	S298 I299 F361 T362 A363	S298-F302 WeakPolarHBondContact O-CD2 3.34Å; S298-F302 PolarHBondContact O-N 3.07Å; I299-F302 PolarHBondContact O-N 3.34Å; F302-F361 HydrophobicContact CD2-CB 3.97Å; F302-F361 VanDerWaalsContact CE2-O 3.27Å; F302-F361 WeakPolarHBondContact CE2-O 3.33Å; F302-T362 VanDerWaalsContact CE2-CA 3.5Å; F302-A363 HydrophobicContact CE1-CB 4.08Å; F302-A363 VanDerWaalsContact CZ-N 3.32Å
303	Y	97.8	Very high	97.9	Very high	18 Å²	18	37.2 Å²	37.2	7%	0.071	19%	0.192	C	C	.	.			trans	-134.1	69.6	-178	-63.3	-72.9	0	0	0	109.7	I275 I299 T305 I306 F361 T365 L367 E368	I275-Y303 HydrophobicContact CB-CE1 4.45Å; I275-Y303 HydrophobicContact CG2-CD1 4.08Å; I275-Y303 HydrophobicContact CG2-CE1 4Å; I299-Y303 CarbonylContact O-C 3.59Å; I299-Y303 WeakPolarHBondContact O-CA 3.31Å; I299-Y303 PolarHBondContact O-N 3.04Å; Y303-T305 PolarHBondContact O-N 3.12Å; Y303-T305 VanDerWaalsContact O-N 3.17Å; Y303-I306 WeakPolarHBondContact O-CG2 3.15Å; Y303-I306 PolarHBondContact O-N 2.92Å; Y303-F361 AromaticContact CD2-CD2 3.96Å; Y303-F361 HydrophobicContact CD2-CD2 3.96Å; Y303-F361 HydrophobicContact CD2-CE2 4.1Å; Y303-F361 HydrophobicContact CE2-CD2 4.13Å; Y303-F361 HydrophobicContact CE2-CE2 4.29Å; Y303-T365 WeakPolarHBondContact CE2-O 3.48Å; Y303-T365 PolarHBondContact OH-O 3.07Å; Y303-L367 HydrophobicContact CD1-CD1 4.23Å; Y303-L367 HydrophobicContact CD2-CD1 3.86Å; Y303-L367 HydrophobicContact CD2-CG 4.28Å; Y303-L367 HydrophobicContact CE1-CB 4.17Å; Y303-L367 HydrophobicContact CE1-CD1 4.08Å; Y303-L367 HydrophobicContact CE1-CG 4.2Å; Y303-L367 HydrophobicContact CE2-CB 4.34Å; Y303-L367 HydrophobicContact CE2-CD1 3.7Å; Y303-L367 HydrophobicContact CE2-CG 3.59Å; Y303-L367 HydrophobicContact CG-CD1 4.14Å; Y303-L367 PolarHBondContact OH-N 3.43Å; Y303-E368 WeakPolarHBondContact CE1-OE1 3.46Å; Y303-E368 VanDerWaalsContact OH-CD 3.31Å; Y303-E368 PolarHBondContact OH-OE1 3.46Å; Y303-E368 PolarHBondContact OH-OE2 2.82Å; Y303-E368 VanDerWaalsContact OH-OE2 3.12Å
304	P	97.1	Very high	97.8	Very high	77 Å²	77	32.8 Å²	32.8	50%	0.5	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-30.9	-169.8	22.3	-33.5	0	0	0	113.9	R300	R300-P304 VanDerWaalsContact CD-O 3.31Å; R300-P304 WeakPolarHBondContact CD-O 3.47Å; R300-P304 PolarHBondContact NH1-O 3.34Å; R300-P304 VanDerWaalsContact O-CA 3.31Å; R300-P304 WeakPolarHBondContact O-CA 3.28Å; R300-P304 WeakPolarHBondContact O-CB 3.46Å
305	T	96.9	Very high	97.7	Very high	87 Å²	87	34.7 Å²	34.7	53%	0.534	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	4.5	-172.1	49.2	0	0	0	0	114.4	S276 Y303	S276-T305 VanDerWaalsContact OG-C 3.3Å; S276-T305 PolarHBondContact OG-O 2.9Å; S276-T305 PolarHBondContact OG-OG1 3.29Å; Y303-T305 PolarHBondContact O-N 3.12Å; Y303-T305 VanDerWaalsContact O-N 3.17Å
306	I	97.5	Very high	97.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.216	C	C	.	.			trans	-75.6	138.1	-179.2	-158.9	162.5	0	0	0	111.3	I275 S276 V279 I281 I299 R300 Y303 I308 L367	I275-I306 HydrophobicContact CG2-CD1 4.22Å; S276-I306 PolarHBondContact OG-N 3.35Å; V279-I306 HydrophobicContact CB-CD1 3.88Å; V279-I306 HydrophobicContact CG1-CD1 3.92Å; V279-I306 WeakPolarHBondContact O-CD1 3.01Å; V279-I306 WeakPolarHBondContact O-CG1 3.5Å; I281-I306 HydrophobicContact CD1-CD1 3.98Å; I281-I306 HydrophobicContact CD1-CG2 3.79Å; I281-I306 HydrophobicContact CG1-CD1 3.75Å; I281-I306 HydrophobicContact CG1-CG1 4.27Å; I281-I306 HydrophobicContact CG1-CG2 4.25Å; I299-I306 HydrophobicContact CG2-CG2 3.56Å; R300-I306 PolarHBondContact NH1-O 3.1Å; R300-I306 PolarHBondContact NH2-O 3.42Å; Y303-I306 WeakPolarHBondContact O-CG2 3.15Å; Y303-I306 PolarHBondContact O-N 2.92Å; I306-I308 HydrophobicContact CG2-CG1 4.48Å; I306-L367 HydrophobicContact CD1-CD1 4.02Å
307	T	98.6	Very high	97.2	Very high	36 Å²	36	44.5 Å²	44.5	22%	0.221	23%	0.23	C	C	.	.			trans	-70	138	173.1	-57.6	0	0	0	0	110.3	T280 I281 L324 E326	T280-T307 HydrophobicContact CG2-CG2 4.24Å; I281-T307 PolarHBondContact N-O 3.28Å; T307-L324 WeakPolarHBondContact CA-O 3.31Å; T307-E326 HydrophobicContact CG2-CG 4.32Å
308	I	98.8	Very high	97.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	121.5	175	-53.9	172.6	0	0	0	108.5	I281 I296 I299 I306 I310 L324 V325 E326	I281-I308 CarbonylContact O-C 3.39Å; I281-I308 VanDerWaalsContact O-CA 3.31Å; I281-I308 WeakPolarHBondContact O-CA 3.34Å; I296-I308 HydrophobicContact CG1-CD1 4.3Å; I296-I308 HydrophobicContact CG2-CD1 4.26Å; I299-I308 HydrophobicContact CB-CD1 4.15Å; I299-I308 HydrophobicContact CD1-CD1 3.88Å; I299-I308 HydrophobicContact CD1-CG1 4.37Å; I299-I308 HydrophobicContact CG2-CD1 3.78Å; I299-I308 HydrophobicContact CG2-CG1 4.23Å; I306-I308 HydrophobicContact CG2-CG1 4.48Å; I308-I310 HydrophobicContact CG2-CD1 4.44Å; I308-I310 HydrophobicContact CG2-CG1 3.98Å; I308-L324 PolarHBondContact N-O 3.41Å; I308-V325 HydrophobicContact CB-CG2 4.02Å; I308-V325 HydrophobicContact CD1-CG2 4.21Å; I308-V325 CarbonylContact O-C 3.51Å; I308-V325 VanDerWaalsContact O-CA 3.32Å; I308-V325 WeakPolarHBondContact O-CA 3.21Å; I308-E326 PolarHBondContact O-N 3.39Å
309	V	98.9	Very high	96.8	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	126.5	173.6	177.1	0	0	0	0	109.2	T280 I281 A282 T283 E326 Y328 A343 Q346	T280-V309 HydrophobicContact CG2-CB 4.39Å; T280-V309 HydrophobicContact CG2-CG2 3.64Å; I281-V309 PolarHBondContact O-N 3.22Å; A282-V309 WeakPolarHBondContact CA-O 3.39Å; T283-V309 PolarHBondContact N-O 2.73Å; V309-E326 WeakPolarHBondContact CA-O 3.43Å; V309-E326 HydrophobicContact CG2-CB 4.34Å; V309-Y328 HydrophobicContact CG1-CD2 4Å; V309-Y328 HydrophobicContact CG1-CE2 4.07Å; V309-A343 HydrophobicContact CG1-CB 3.94Å; V309-Q346 HydrophobicContact CG1-CB 4.06Å; V309-Q346 HydrophobicContact CG1-CG 4.47Å; V309-Q346 HydrophobicContact CG2-CB 4.44Å
310	I	98.7	Very high	96.6	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	118.2	-178.1	-53.6	172.2	0	0	0	108.7	T283 T285 L292 I296 I308 I320 V325 E326 Y328	T283-I310 HydrophobicContact CG2-CB 4.4Å; T283-I310 HydrophobicContact CG2-CG1 3.93Å; T283-I310 HydrophobicContact CG2-CG2 4.32Å; T285-I310 HydrophobicContact CG2-CG2 4.09Å; L292-I310 HydrophobicContact CD1-CD1 4.04Å; L292-I310 HydrophobicContact CD1-CG1 4.46Å; L292-I310 HydrophobicContact CD1-CG2 4.44Å; L292-I310 HydrophobicContact CD2-CD1 4.13Å; L292-I310 HydrophobicContact CD2-CG2 4.11Å; L292-I310 HydrophobicContact CG-CD1 4.42Å; I296-I310 HydrophobicContact CD1-CD1 3.93Å; I308-I310 HydrophobicContact CG2-CD1 4.44Å; I308-I310 HydrophobicContact CG2-CG1 3.98Å; I310-I320 HydrophobicContact CD1-CG1 4.42Å; I310-V325 HydrophobicContact CD1-CG1 3.45Å; I310-V325 VanDerWaalsContact CD1-CG1 3.45Å; I310-V325 HydrophobicContact CG1-CG1 4.13Å; I310-E326 PolarHBondContact N-O 3.49Å; I310-Y328 PolarHBondContact O-N 2.83Å
311	A	98.4	Very high	96.3	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	127	164.2	0	0	0	0	0	109.8	T283 K284 T285 M330 G339 L342 A343	T283-A311 PolarHBondContact O-N 3.32Å; K284-A311 CarbonylContact C-O 3.58Å; K284-A311 VanDerWaalsContact CA-O 3.23Å; K284-A311 WeakPolarHBondContact CA-O 3.42Å; K284-A311 HydrophobicContact CG-CB 4.43Å; T285-A311 PolarHBondContact N-O 3.05Å; A311-M330 HydrophobicContact CB-SD 4.04Å; A311-G339 WeakPolarHBondContact CB-O 3.24Å; A311-L342 HydrophobicContact CB-CB 4.28Å; A311-L342 HydrophobicContact CB-CD2 4.2Å; A311-L342 HydrophobicContact CB-CG 4.38Å; A311-A343 HydrophobicContact CB-CB 4.02Å
312	D	97.9	Very high	96.2	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	113.7	-171.1	-167.8	-17.1	0	0	0	111.4	T285 Y289 S314 H327 Y328 L329 M330	T285-D312 HydrophobicContact CG2-CB 3.89Å; T285-D312 WeakPolarHBondContact CG2-OD2 3.31Å; Y289-D312 PolarHBondContact OH-OD2 3.39Å; D312-S314 WeakPolarHBondContact OD1-CB 3.33Å; D312-S314 PolarHBondContact OD1-N 3.24Å; D312-S314 PolarHBondContact OD1-OG 2.94Å; D312-H327 VanDerWaalsContact CB-NE2 3.33Å; D312-H327 WeakPolarHBondContact CB-NE2 3.37Å; D312-H327 IonicContact OD2-CD2 3.92Å; D312-H327 IonicContact OD2-CE1 3.67Å; D312-H327 PolarHBondContact OD2-CE1 2.9Å; D312-H327 IonicContact OD2-NE2 2.72Å; D312-H327 PolarHBondContact OD2-NE2 3.42Å; D312-Y328 PolarHBondContact N-O 2.82Å; D312-L329 HydrophobicContact CB-CD2 4.1Å; D312-L329 CarbonylContact O-C 3.53Å; D312-L329 WeakPolarHBondContact O-CA 3.38Å; D312-M330 WeakPolarHBondContact O-CB 3.1Å; D312-M330 PolarHBondContact O-N 3.15Å
313	D	96.8	Very high	96.1	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.286	C	S	.	.			trans	-106.6	26.8	176.8	68.7	-14	0	0	0	112.6	K284 T285 F286 M330 P331 F332 G333 K334 G335	K284-D313 VanDerWaalsContact CE-CG 3.4Å; K284-D313 WeakPolarHBondContact CE-OD1 3.38Å; K284-D313 WeakPolarHBondContact CE-OD2 3.47Å; K284-D313 IonicContact NZ-OD1 2.73Å; K284-D313 PolarHBondContact NZ-OD1 2.91Å; K284-D313 IonicContact NZ-OD2 3.59Å; K284-D313 PolarHBondContact NZ-OD2 2.82Å; K284-D313 VanDerWaalsContact NZ-OD2 3.08Å; T285-D313 VanDerWaalsContact O-OD1 3.08Å; F286-D313 WeakPolarHBondContact CB-OD1 3.48Å; F286-D313 VanDerWaalsContact CD2-O 3.27Å; F286-D313 WeakPolarHBondContact CD2-O 3.41Å; F286-D313 WeakPolarHBondContact CD2-OD1 3.39Å; F286-D313 VanDerWaalsContact CE2-O 3.29Å; F286-D313 WeakPolarHBondContact CE2-O 3.28Å; D313-M330 HydrophobicContact CB-CB 3.83Å; D313-M330 HydrophobicContact CB-SD 4.44Å; D313-P331 WeakPolarHBondContact CB-O 3.31Å; D313-F332 CarbonylContact O-C 3.58Å; D313-F332 WeakPolarHBondContact O-CA 3.32Å; D313-G333 PolarHBondContact O-N 2.98Å; D313-K334 HydrophobicContact CB-CB 4.32Å; D313-K334 PolarHBondContact OD2-N 3.13Å; D313-G335 PolarHBondContact OD2-N 2.84Å
314	S	95.8	Very high	96.1	Very high	5 Å²	5	55.7 Å²	55.7	4%	0.035	30%	0.299	C	S	.	.			trans	-71	148.6	174.4	-55.2	0	0	0	0	112.4	L287 D312	L287-S314 PolarHBondContact N-OG 3.1Å; D312-S314 WeakPolarHBondContact OD1-CB 3.33Å; D312-S314 PolarHBondContact OD1-N 3.24Å; D312-S314 PolarHBondContact OD1-OG 2.94Å
315	D	92.8	Very high	96.1	Very high	100 Å²	100	53.1 Å²	53.1	54%	0.535	28%	0.281	S	S	.	.	S	Bend	trans	-68.8	-38.9	179.7	-175.9	45.7	0	0	0	111.9	P317 F332	D315-P317 WeakPolarHBondContact O-CD 3.27Å; D315-F332 HydrophobicContact CB-CD2 3.45Å; D315-F332 VanDerWaalsContact CB-CD2 3.45Å; D315-F332 HydrophobicContact CB-CE2 3.61Å; D315-F332 HydrophobicContact CB-CG 4.03Å; D315-F332 HydrophobicContact CB-CZ 4.35Å; D315-F332 VanDerWaalsContact N-CD2 3.27Å
316	K	93.2	Very high	96.2	Very high	165 Å²	165	52.5 Å²	52.5	72%	0.717	27%	0.272	S	S	*	.	S	Bend	trans	-124.7	84.9	-179.7	-63.6	179.7	-175.6	177.3	0	109.2	E318	K316-E318 PolarHBondContact O-N 3.44Å
317	P	93.9	Very high	96.2	Very high	55 Å²	55	55.1 Å²	55.1	36%	0.357	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-67.7	134.4	-176	-23.4	34.7	0	0	0	113.2	Y289 D315 L329	Y289-P317 WeakPolarHBondContact OH-CA 3.31Å; Y289-P317 WeakPolarHBondContact OH-CB 3.48Å; D315-P317 WeakPolarHBondContact O-CD 3.27Å; P317-L329 HydrophobicContact CB-CD1 4.37Å; P317-L329 HydrophobicContact CB-CD2 3.58Å; P317-L329 HydrophobicContact CG-CD1 4.21Å; P317-L329 HydrophobicContact CG-CD2 3.76Å
318	E	94.4	Very high	96.2	Very high	85 Å²	85	56.8 Å²	56.8	40%	0.397	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-87.8	142.9	172	-65.2	178.4	-149	0	0	111	Y289 R293 K316 I320 H327	Y289-E318 WeakPolarHBondContact CB-OE1 3.42Å; Y289-E318 HydrophobicContact CD1-CB 3.75Å; Y289-E318 HydrophobicContact CD1-CG 4.29Å; Y289-E318 HydrophobicContact CD2-CB 3.87Å; Y289-E318 HydrophobicContact CD2-CG 3.52Å; Y289-E318 WeakPolarHBondContact CD2-OE1 3.44Å; Y289-E318 HydrophobicContact CE1-CB 3.72Å; Y289-E318 HydrophobicContact CE1-CG 4.46Å; Y289-E318 HydrophobicContact CE2-CB 3.81Å; Y289-E318 HydrophobicContact CE2-CG 3.7Å; Y289-E318 HydrophobicContact CG-CB 3.84Å; Y289-E318 HydrophobicContact CG-CG 3.84Å; Y289-E318 PolarHBondContact OH-N 3.49Å; R293-E318 IonicContact CZ-OE2 3.36Å; R293-E318 IonicContact NE-OE2 3.39Å; R293-E318 IonicContact NH2-OE2 3.08Å; R293-E318 PolarHBondContact NH2-OE2 2.63Å; K316-E318 PolarHBondContact O-N 3.44Å; E318-I320 PolarHBondContact O-N 3.5Å; E318-H327 PolarHBondContact O-CE1 3.19Å
319	R	92.5	Very high	96.1	Very high	208 Å²	208	62 Å²	62	79%	0.785	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-68.1	128.1	175.1	-171.9	176.7	179.1	177.6	0.1	110.8	R293	R293-R319 PolarHBondContact NH2-O 3.35Å
320	I	94.9	Very high	96	Very high	22 Å²	22	63.3 Å²	63.3	11%	0.113	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-93.8	123.8	166.6	-55.6	-57.8	0	0	0	108.6	Y289 L292 I296 I310 E318 D322 V325	Y289-I320 HydrophobicContact CD1-CD1 4.04Å; Y289-I320 HydrophobicContact CE1-CD1 4.24Å; L292-I320 HydrophobicContact CD2-CD1 4.11Å; L292-I320 HydrophobicContact CD2-CG1 4.44Å; I296-I320 HydrophobicContact CD1-CD1 4.4Å; I296-I320 HydrophobicContact CD1-CG2 3.79Å; I310-I320 HydrophobicContact CD1-CG1 4.42Å; E318-I320 PolarHBondContact O-N 3.5Å; I320-D322 HydrophobicContact CG2-CB 4.33Å; I320-V325 HydrophobicContact CB-CG1 4.37Å; I320-V325 HydrophobicContact CG2-CB 4.28Å; I320-V325 HydrophobicContact CG2-CG1 3.92Å; I320-V325 HydrophobicContact CG2-CG2 4.23Å
321	S	91.5	Very high	95.9	Very high	104 Å²	104	67.7 Å²	67.7	73%	0.727	35%	0.35	S	S	*	.			trans	-104.6	82.9	179.4	-61.4	0	0	0	0	109.6
322	D	96.1	Very high	95.8	Very high	33 Å²	33	71.8 Å²	71.8	18%	0.176	37%	0.368	C	S	.	.			trans	-149	125.6	176.3	-177.6	-54.6	0	0	0	108.2	R300 I320 L324 V325	R300-D322 IonicContact CZ-OD1 2.56Å; R300-D322 IonicContact CZ-OD2 3.69Å; R300-D322 IonicContact NE-OD1 2.92Å; R300-D322 PolarHBondContact NE-OD1 2.89Å; R300-D322 IonicContact NE-OD2 3.74Å; R300-D322 PolarHBondContact NE-OD2 2.81Å; R300-D322 IonicContact NH2-OD1 3.24Å; R300-D322 PolarHBondContact NH2-OD1 3.22Å; R300-D322 IonicContact NH2-OD2 3.22Å; R300-D322 PolarHBondContact NH2-OD2 2.73Å; I320-D322 HydrophobicContact CG2-CB 4.33Å; D322-L324 PolarHBondContact O-N 3.36Å; D322-L324 PolarHBondContact OD1-N 2.85Å; D322-V325 HydrophobicContact CB-CB 3.94Å; D322-V325 HydrophobicContact CB-CG2 3.54Å; D322-V325 PolarHBondContact O-N 3.18Å; D322-V325 PolarHBondContact OD1-N 2.91Å
323	P	95.4	Very high	95.5	Very high	129 Å²	129	72.1 Å²	72.1	84%	0.838	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-16.7	-172.3	29	-35.7	0	0	0	114
324	L	97.6	Very high	95.4	Very high	64 Å²	64	77.4 Å²	77.4	34%	0.335	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	21.1	179.1	-61.7	175.9	0	0	0	111.2	R300 T307 I308 D322	R300-L324 VanDerWaalsContact NH2-CB 3.35Å; R300-L324 PolarHBondContact NH2-O 2.75Å; R300-L324 VanDerWaalsContact NH2-O 3.15Å; T307-L324 WeakPolarHBondContact CA-O 3.31Å; I308-L324 PolarHBondContact N-O 3.41Å; D322-L324 PolarHBondContact O-N 3.36Å; D322-L324 PolarHBondContact OD1-N 2.85Å
325	V	98.4	Very high	95.2	Very high	22 Å²	22	77.2 Å²	77.2	13%	0.133	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.1	169.6	168	0	0	0	0	109.3	I308 I310 I320 D322 H327	I308-V325 HydrophobicContact CB-CG2 4.02Å; I308-V325 HydrophobicContact CD1-CG2 4.21Å; I308-V325 CarbonylContact O-C 3.51Å; I308-V325 VanDerWaalsContact O-CA 3.32Å; I308-V325 WeakPolarHBondContact O-CA 3.21Å; I310-V325 HydrophobicContact CD1-CG1 3.45Å; I310-V325 VanDerWaalsContact CD1-CG1 3.45Å; I310-V325 HydrophobicContact CG1-CG1 4.13Å; I320-V325 HydrophobicContact CB-CG1 4.37Å; I320-V325 HydrophobicContact CG2-CB 4.28Å; I320-V325 HydrophobicContact CG2-CG1 3.92Å; I320-V325 HydrophobicContact CG2-CG2 4.23Å; D322-V325 HydrophobicContact CB-CB 3.94Å; D322-V325 HydrophobicContact CB-CG2 3.54Å; D322-V325 PolarHBondContact O-N 3.18Å; D322-V325 PolarHBondContact OD1-N 2.91Å; V325-H327 HydrophobicContact CG1-CB 4.33Å
326	E	98.3	Very high	95	Very high	74 Å²	74	74.4 Å²	74.4	35%	0.346	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	112.7	167.9	-57.4	177.6	-176	0	0	108.8	T307 I308 V309 I310 Y328	T307-E326 HydrophobicContact CG2-CG 4.32Å; I308-E326 PolarHBondContact O-N 3.39Å; V309-E326 WeakPolarHBondContact CA-O 3.43Å; V309-E326 HydrophobicContact CG2-CB 4.34Å; I310-E326 PolarHBondContact N-O 3.49Å; E326-Y328 HydrophobicContact CB-CD2 4.27Å; E326-Y328 HydrophobicContact CB-CE2 3.54Å; E326-Y328 PolarHBondContact OE2-OH 3.49Å
327	H	97.9	Very high	95.1	Very high	56 Å²	56	66.6 Å²	66.6	26%	0.259	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	110.1	-173.4	-173.7	-166.1	0	0	0	110.8	D312 E318 V325	D312-H327 VanDerWaalsContact CB-NE2 3.33Å; D312-H327 WeakPolarHBondContact CB-NE2 3.37Å; D312-H327 IonicContact OD2-CD2 3.92Å; D312-H327 IonicContact OD2-CE1 3.67Å; D312-H327 PolarHBondContact OD2-CE1 2.9Å; D312-H327 IonicContact OD2-NE2 2.72Å; D312-H327 PolarHBondContact OD2-NE2 3.42Å; E318-H327 PolarHBondContact O-CE1 3.19Å; V325-H327 HydrophobicContact CG1-CB 4.33Å
328	Y	97.9	Very high	95.2	Very high	70 Å²	70	64.5 Å²	64.5	28%	0.275	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	126.5	-176.7	-66.3	-92.4	0	0	0	111.3	V309 I310 D312 E326 Q346	V309-Y328 HydrophobicContact CG1-CD2 4Å; V309-Y328 HydrophobicContact CG1-CE2 4.07Å; I310-Y328 PolarHBondContact O-N 2.83Å; D312-Y328 PolarHBondContact N-O 2.82Å; E326-Y328 HydrophobicContact CB-CD2 4.27Å; E326-Y328 HydrophobicContact CB-CE2 3.54Å; E326-Y328 PolarHBondContact OE2-OH 3.49Å; Y328-Q346 HydrophobicContact CD1-CG 4.26Å; Y328-Q346 HydrophobicContact CD2-CG 4.01Å; Y328-Q346 HydrophobicContact CE1-CG 3.83Å; Y328-Q346 VanDerWaalsContact CE1-OE1 3.31Å; Y328-Q346 HydrophobicContact CE2-CB 3.84Å; Y328-Q346 HydrophobicContact CE2-CG 3.55Å; Y328-Q346 HydrophobicContact CG-CG 4.33Å; Y328-Q346 VanDerWaalsContact CZ-CG 3.45Å; Y328-Q346 VanDerWaalsContact CZ-OE1 3.3Å; Y328-Q346 PolarHBondContact OH-OE1 2.7Å
329	L	97.3	Very high	95.4	Very high	109 Å²	109	60.5 Å²	60.5	57%	0.571	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	143.5	-178	-54	-176.8	0	0	0	111.7	D312 P317	D312-L329 HydrophobicContact CB-CD2 4.1Å; D312-L329 CarbonylContact O-C 3.53Å; D312-L329 WeakPolarHBondContact O-CA 3.38Å; P317-L329 HydrophobicContact CB-CD1 4.37Å; P317-L329 HydrophobicContact CB-CD2 3.58Å; P317-L329 HydrophobicContact CG-CD1 4.21Å; P317-L329 HydrophobicContact CG-CD2 3.76Å
330	M	96.3	Very high	95.6	Very high	28 Å²	28	50.6 Å²	50.6	14%	0.138	27%	0.272	C	S	.	.			trans	-125.1	160.1	-179.8	-64.7	-179.8	75	0	0	110.9	A311 D312 D313 F332 K334 A338 G339 L342	A311-M330 HydrophobicContact CB-SD 4.04Å; D312-M330 WeakPolarHBondContact O-CB 3.1Å; D312-M330 PolarHBondContact O-N 3.15Å; D313-M330 HydrophobicContact CB-CB 3.83Å; D313-M330 HydrophobicContact CB-SD 4.44Å; M330-F332 PolarHBondContact O-N 2.92Å; M330-K334 HydrophobicContact CB-CB 4.41Å; M330-K334 HydrophobicContact CE-CB 3.82Å; M330-K334 HydrophobicContact CE-CG 3.6Å; M330-A338 HydrophobicContact CE-CB 3.85Å; M330-G339 WeakPolarHBondContact SD-CA 3.44Å; M330-L342 HydrophobicContact CE-CD2 4.48Å; M330-L342 HydrophobicContact CG-CD2 3.26Å; M330-L342 HydrophobicContact SD-CB 4.32Å; M330-L342 HydrophobicContact SD-CD2 3.7Å
331	P	96.1	Very high	95.7	Very high	93 Å²	93	52.1 Å²	52.1	60%	0.604	28%	0.28	S	S	*	.	S	Bend	trans	-53.4	141.4	168.2	-25.2	34.7	0	0	0	111.5	D313 G333 K334	D313-P331 WeakPolarHBondContact CB-O 3.31Å; P331-G333 PolarHBondContact O-N 2.8Å; P331-K334 VanDerWaalsContact O-CB 3.25Å; P331-K334 WeakPolarHBondContact O-CB 3.11Å; P331-K334 PolarHBondContact O-N 3.15Å
332	F	96	Very high	96	Very high	86 Å²	86	49.2 Å²	49.2	38%	0.377	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	125.8	-176.5	174.1	-119.3	0	0	0	112.6	F286 D313 D315 M330 K334 T500 Y504	F286-F332 AromaticContact CE2-CD2 3.75Å; F286-F332 HydrophobicContact CE2-CD2 3.75Å; F286-F332 AromaticContact CE2-CE2 3.35Å; F286-F332 HydrophobicContact CE2-CE2 3.35Å; F286-F332 HydrophobicContact CE2-CZ 4.18Å; F286-F332 HydrophobicContact CZ-CD2 4.36Å; F286-F332 AromaticContact CZ-CE2 3.56Å; F286-F332 HydrophobicContact CZ-CE2 3.56Å; F286-F332 AromaticContact CZ-CZ 3.96Å; F286-F332 HydrophobicContact CZ-CZ 3.96Å; D313-F332 CarbonylContact O-C 3.58Å; D313-F332 WeakPolarHBondContact O-CA 3.32Å; D315-F332 HydrophobicContact CB-CD2 3.45Å; D315-F332 VanDerWaalsContact CB-CD2 3.45Å; D315-F332 HydrophobicContact CB-CE2 3.61Å; D315-F332 HydrophobicContact CB-CG 4.03Å; D315-F332 HydrophobicContact CB-CZ 4.35Å; D315-F332 VanDerWaalsContact N-CD2 3.27Å; M330-F332 PolarHBondContact O-N 2.92Å; F332-K334 PolarHBondContact O-N 3.3Å; F332-T500 HydrophobicContact CZ-CG2 4.48Å; F332-Y504 HydrophobicContact CE1-CE2 4.47Å; F332-Y504 WeakPolarHBondContact CE1-OH 3.28Å; F332-Y504 HydrophobicContact CZ-CE2 4.04Å
333	G	92.8	Very high	96.2	Very high	6 Å²	6	47.7 Å²	47.7	6%	0.062	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	26.2	177.1	0	0	0	0	0	114	D313 P331 G335 R457	D313-G333 PolarHBondContact O-N 2.98Å; P331-G333 PolarHBondContact O-N 2.8Å; G333-G335 PolarHBondContact O-N 3.26Å; G333-G335 VanDerWaalsContact O-N 3.09Å; G333-R457 PolarHBondContact O-NH1 2.92Å; G333-R457 PolarHBondContact O-NH2 2.88Å
334	K	94.7	Very high	96.3	Very high	112 Å²	112	41.8 Å²	41.8	49%	0.487	21%	0.209	S	C	.	.			trans	-52.5	-31.9	179.7	-175.3	62.2	175.1	-176.5	0	112.8	D313 M330 P331 F332 A338	D313-K334 HydrophobicContact CB-CB 4.32Å; D313-K334 PolarHBondContact OD2-N 3.13Å; M330-K334 HydrophobicContact CB-CB 4.41Å; M330-K334 HydrophobicContact CE-CB 3.82Å; M330-K334 HydrophobicContact CE-CG 3.6Å; P331-K334 VanDerWaalsContact O-CB 3.25Å; P331-K334 WeakPolarHBondContact O-CB 3.11Å; P331-K334 PolarHBondContact O-N 3.15Å; F332-K334 PolarHBondContact O-N 3.3Å; K334-A338 HydrophobicContact CG-CB 3.8Å
335	G	91.1	Very high	96.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.213	C	C	.	.			trans	115.1	173	165.9	0	0	0	0	0	115.1	D313 G333 G339 N456	D313-G335 PolarHBondContact OD2-N 2.84Å; G333-G335 PolarHBondContact O-N 3.26Å; G333-G335 VanDerWaalsContact O-N 3.09Å; G335-G339 PolarHBondContact O-N 3.42Å; G335-G339 VanDerWaalsContact O-N 3.13Å; G335-N456 CarbonylContact C-O 3.5Å; G335-N456 VanDerWaalsContact CA-O 3.24Å; G335-N456 WeakPolarHBondContact CA-O 3.26Å
336	W	88.1	Confident	96.3	Very high	42 Å²	42	43.5 Å²	43.5	16%	0.159	22%	0.221	C	C	.	.	H	α-helix	trans	-60.3	-64	-167	-167.4	-116.3	0	0	0	113.5	K284 A338 G339 R340 D356 N456	K284-W336 HydrophobicContact CD-CE3 3.99Å; K284-W336 HydrophobicContact CD-CZ3 4.12Å; W336-A338 PolarHBondContact O-N 2.83Å; W336-G339 PolarHBondContact O-N 2.91Å; W336-R340 VanDerWaalsContact CE2-NH2 3.33Å; W336-R340 VanDerWaalsContact NE1-CZ 3.34Å; W336-R340 WeakPolarHBondContact O-CG 3.39Å; W336-R340 PolarHBondContact O-N 3.25Å; W336-R340 VanDerWaalsContact O-N 3.1Å; W336-D356 VanDerWaalsContact CH2-OD1 3.29Å; W336-D356 WeakPolarHBondContact CH2-OD1 3.33Å; W336-D356 VanDerWaalsContact CZ2-OD1 3.32Å; W336-D356 WeakPolarHBondContact CZ2-OD1 3.43Å; W336-N456 PolarHBondContact N-O 2.65Å
337	F	95.6	Very high	96.3	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-68.9	-31.5	-176	-84.2	10.4	0	0	0	113.8	G339 R340 N341 F451 D452 L455 A459 E462 F463	F337-G339 VanDerWaalsContact C-N 3.35Å; F337-G339 PolarHBondContact O-N 3.1Å; F337-R340 HydrophobicContact CD1-CG 4.4Å; F337-R340 PolarHBondContact O-N 3.33Å; F337-N341 PolarHBondContact O-N 3.22Å; F337-F451 HydrophobicContact CB-CB 3.67Å; F337-F451 HydrophobicContact CD1-CB 4.13Å; F337-F451 AromaticContact CD1-CD1 3.94Å; F337-F451 HydrophobicContact CD1-CD1 3.94Å; F337-F451 HydrophobicContact CD1-CG 4.39Å; F337-F451 HydrophobicContact CD2-CB 3.85Å; F337-F451 HydrophobicContact CD2-CD1 4.39Å; F337-F451 AromaticContact CE1-CD1 3.8Å; F337-F451 HydrophobicContact CE1-CD1 3.8Å; F337-F451 HydrophobicContact CE1-CE1 4.48Å; F337-F451 HydrophobicContact CE2-CB 4.46Å; F337-F451 HydrophobicContact CE2-CD1 4.26Å; F337-F451 HydrophobicContact CG-CB 3.65Å; F337-F451 HydrophobicContact CG-CD1 4.24Å; F337-F451 HydrophobicContact CG-CG 4.38Å; F337-F451 AromaticContact CZ-CD1 3.95Å; F337-F451 HydrophobicContact CZ-CD1 3.95Å; F337-D452 WeakPolarHBondContact CB-O 3.09Å; F337-D452 WeakPolarHBondContact CD2-O 3.21Å; F337-L455 HydrophobicContact CD2-CB 3.88Å; F337-L455 HydrophobicContact CD2-CD1 4.02Å; F337-L455 HydrophobicContact CE2-CB 4.38Å; F337-L455 HydrophobicContact CE2-CD1 3.83Å; F337-L455 HydrophobicContact CG-CB 4.42Å; F337-A459 HydrophobicContact CD1-CB 3.94Å; F337-A459 HydrophobicContact CD2-CB 3.92Å; F337-A459 HydrophobicContact CE1-CB 3.44Å; F337-A459 VanDerWaalsContact CE1-CB 3.44Å; F337-A459 HydrophobicContact CE2-CB 3.43Å; F337-A459 VanDerWaalsContact CE2-CB 3.43Å; F337-A459 HydrophobicContact CG-CB 4.18Å; F337-A459 HydrophobicContact CZ-CB 3.17Å; F337-E462 HydrophobicContact CE2-CB 4.34Å; F337-F463 HydrophobicContact CZ-CB 4.1Å
338	A	97.1	Very high	96.1	Very high	12 Å²	12	43.1 Å²	43.1	10%	0.099	23%	0.227	C	C	.	.	H	α-helix	trans	-61.6	-42.7	171.6	0	0	0	0	0	111.9	M330 K334 W336 N341 L342 P453	M330-A338 HydrophobicContact CE-CB 3.85Å; K334-A338 HydrophobicContact CG-CB 3.8Å; W336-A338 PolarHBondContact O-N 2.83Å; A338-N341 PolarHBondContact O-N 3.4Å; A338-L342 PolarHBondContact O-N 3.12Å; A338-P453 HydrophobicContact CB-CB 4.05Å
339	G	96.9	Very high	96	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-67.6	-36.1	176.1	0	0	0	0	0	113.3	A311 M330 G335 W336 F337 L342 A343	A311-G339 WeakPolarHBondContact CB-O 3.24Å; M330-G339 WeakPolarHBondContact SD-CA 3.44Å; G335-G339 PolarHBondContact O-N 3.42Å; G335-G339 VanDerWaalsContact O-N 3.13Å; W336-G339 PolarHBondContact O-N 2.91Å; F337-G339 VanDerWaalsContact C-N 3.35Å; F337-G339 PolarHBondContact O-N 3.1Å; G339-L342 PolarHBondContact O-N 3.3Å; G339-A343 PolarHBondContact O-N 3.3Å
340	R	97.1	Very high	95.9	Very high	1 Å²	1	35.6 Å²	35.6	0%	0.004	19%	0.193	C	C	.	.	H	α-helix	trans	-59.3	-48.4	172.5	-55.6	-148.7	169.1	173.7	-9.1	112	W336 F337 L342 A343 V344 W354 N437 F451	W336-R340 VanDerWaalsContact CE2-NH2 3.33Å; W336-R340 VanDerWaalsContact NE1-CZ 3.34Å; W336-R340 WeakPolarHBondContact O-CG 3.39Å; W336-R340 PolarHBondContact O-N 3.25Å; W336-R340 VanDerWaalsContact O-N 3.1Å; F337-R340 HydrophobicContact CD1-CG 4.4Å; F337-R340 PolarHBondContact O-N 3.33Å; R340-L342 VanDerWaalsContact C-N 3.34Å; R340-L342 PolarHBondContact O-N 3.28Å; R340-A343 PolarHBondContact O-N 2.87Å; R340-V344 WeakPolarHBondContact O-CB 3.27Å; R340-V344 VanDerWaalsContact O-CG2 3.29Å; R340-V344 WeakPolarHBondContact O-CG2 3.37Å; R340-V344 PolarHBondContact O-N 2.95Å; R340-W354 HydrophobicContact CB-CH2 3.85Å; R340-W354 HydrophobicContact CB-CZ2 4.47Å; R340-W354 HydrophobicContact CB-CZ3 3.88Å; R340-W354 HydrophobicContact CG-CE3 4.46Å; R340-W354 HydrophobicContact CG-CH2 3.39Å; R340-W354 HydrophobicContact CG-CZ2 3.57Å; R340-W354 HydrophobicContact CG-CZ3 3.87Å; R340-W354 VanDerWaalsContact NE-CE2 3.32Å; R340-W354 VanDerWaalsContact NE-CZ2 3.33Å; R340-N437 PolarHBondContact NH2-ND2 2.87Å; R340-N437 PolarHBondContact NH2-OD1 3.19Å; R340-F451 HydrophobicContact CB-CB 4.26Å; R340-F451 HydrophobicContact CB-CD1 4.27Å; R340-F451 HydrophobicContact CB-CD2 3.43Å; R340-F451 VanDerWaalsContact CB-CD2 3.43Å; R340-F451 HydrophobicContact CB-CE2 3.73Å; R340-F451 HydrophobicContact CB-CG 3.73Å; R340-F451 HydrophobicContact CB-CZ 4.28Å; R340-F451 HydrophobicContact CG-CD1 4.45Å; R340-F451 HydrophobicContact CG-CD2 4.41Å; R340-F451 HydrophobicContact CG-CG 4.36Å
341	N	98.1	Very high	96	Very high	54 Å²	54	34.3 Å²	34.3	29%	0.289	19%	0.186	S	C	.	.	H	α-helix	trans	-60	-44.2	177.4	-76.9	-24.1	0	0	0	111.9	F337 A338 S345 F451	F337-N341 PolarHBondContact O-N 3.22Å; A338-N341 PolarHBondContact O-N 3.4Å; N341-S345 WeakPolarHBondContact O-CB 3.47Å; N341-S345 PolarHBondContact O-N 3.18Å; N341-S345 PolarHBondContact O-OG 3.02Å; N341-F451 PolarHBondContact ND2-O 2.88Å; N341-F451 WeakPolarHBondContact OD1-CB 3.43Å; N341-F451 WeakPolarHBondContact OD1-CD2 3.46Å; N341-F451 PolarHBondContact OD1-N 3.22Å
342	L	98.3	Very high	96.1	Very high	43 Å²	43	29.9 Å²	29.9	23%	0.225	16%	0.158	C	C	.	.	H	α-helix	trans	-58.7	-54.9	177.4	178.5	60.5	0	0	0	110.3	A311 M330 A338 G339 R340 V344 S345 Q346	A311-L342 HydrophobicContact CB-CB 4.28Å; A311-L342 HydrophobicContact CB-CD2 4.2Å; A311-L342 HydrophobicContact CB-CG 4.38Å; M330-L342 HydrophobicContact CE-CD2 4.48Å; M330-L342 HydrophobicContact CG-CD2 3.26Å; M330-L342 HydrophobicContact SD-CB 4.32Å; M330-L342 HydrophobicContact SD-CD2 3.7Å; A338-L342 PolarHBondContact O-N 3.12Å; G339-L342 PolarHBondContact O-N 3.3Å; R340-L342 VanDerWaalsContact C-N 3.34Å; R340-L342 PolarHBondContact O-N 3.28Å; L342-V344 PolarHBondContact O-N 3.25Å; L342-S345 PolarHBondContact O-N 2.63Å; L342-S345 PolarHBondContact O-OG 3.19Å; L342-Q346 WeakPolarHBondContact O-CG 3.3Å
343	A	98.4	Very high	96.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-59.1	-49	-178.8	0	0	0	0	0	112.1	A282 V309 A311 G339 R340 S345 Q346 W354	A282-A343 HydrophobicContact CB-CB 4.05Å; V309-A343 HydrophobicContact CG1-CB 3.94Å; A311-A343 HydrophobicContact CB-CB 4.02Å; G339-A343 PolarHBondContact O-N 3.3Å; R340-A343 PolarHBondContact O-N 2.87Å; A343-S345 VanDerWaalsContact C-N 3.27Å; A343-S345 PolarHBondContact O-N 2.63Å; A343-Q346 PolarHBondContact O-N 3.01Å; A343-Q346 VanDerWaalsContact O-N 3.1Å; A343-W354 HydrophobicContact CB-CZ3 4.29Å
344	V	98.3	Very high	96.5	Very high	5 Å²	5	25.7 Å²	25.7	3%	0.03	14%	0.137	C	C	.	.	H	α-helix	trans	-64.4	-31	-179.8	175	0	0	0	0	111.8	R340 L342 Q346 V347 V352 V446 R447 F451	R340-V344 WeakPolarHBondContact O-CB 3.27Å; R340-V344 VanDerWaalsContact O-CG2 3.29Å; R340-V344 WeakPolarHBondContact O-CG2 3.37Å; R340-V344 PolarHBondContact O-N 2.95Å; L342-V344 PolarHBondContact O-N 3.25Å; V344-Q346 PolarHBondContact O-N 2.69Å; V344-V347 PolarHBondContact O-N 2.91Å; V344-V352 HydrophobicContact CG2-CG2 4.37Å; V344-V446 HydrophobicContact CG1-CB 4.28Å; V344-V446 HydrophobicContact CG1-CG1 3.95Å; V344-V446 HydrophobicContact CG2-CG1 4.15Å; V344-R447 HydrophobicContact CG1-CG 3.75Å; V344-R447 PolarHBondContact O-NE 3.12Å; V344-R447 PolarHBondContact O-NH2 3.39Å; V344-F451 HydrophobicContact CG2-CE2 4.33Å
345	S	98	Very high	96.7	Very high	59 Å²	59	20.3 Å²	20.3	41%	0.413	11%	0.114	S	C	.	.	H	α-helix	trans	-65.4	-20.2	176.4	72.6	0	0	0	0	114	N341 L342 A343 R447	N341-S345 WeakPolarHBondContact O-CB 3.47Å; N341-S345 PolarHBondContact O-N 3.18Å; N341-S345 PolarHBondContact O-OG 3.02Å; L342-S345 PolarHBondContact O-N 2.63Å; L342-S345 PolarHBondContact O-OG 3.19Å; A343-S345 VanDerWaalsContact C-N 3.27Å; A343-S345 PolarHBondContact O-N 2.63Å; S345-R447 VanDerWaalsContact C-NH2 3.31Å; S345-R447 PolarHBondContact O-NH2 3.3Å
346	Q	98.2	Very high	96.9	Very high	64 Å²	64	21.2 Å²	21.2	30%	0.299	12%	0.119	S	C	.	.	H	α-helix	trans	-93.1	-13.7	178.9	-49.4	-56.5	-61.3	0	0	112.8	V309 Y328 L342 A343 V344 T348	V309-Q346 HydrophobicContact CG1-CB 4.06Å; V309-Q346 HydrophobicContact CG1-CG 4.47Å; V309-Q346 HydrophobicContact CG2-CB 4.44Å; Y328-Q346 HydrophobicContact CD1-CG 4.26Å; Y328-Q346 HydrophobicContact CD2-CG 4.01Å; Y328-Q346 HydrophobicContact CE1-CG 3.83Å; Y328-Q346 VanDerWaalsContact CE1-OE1 3.31Å; Y328-Q346 HydrophobicContact CE2-CB 3.84Å; Y328-Q346 HydrophobicContact CE2-CG 3.55Å; Y328-Q346 HydrophobicContact CG-CG 4.33Å; Y328-Q346 VanDerWaalsContact CZ-CG 3.45Å; Y328-Q346 VanDerWaalsContact CZ-OE1 3.3Å; Y328-Q346 PolarHBondContact OH-OE1 2.7Å; L342-Q346 WeakPolarHBondContact O-CG 3.3Å; A343-Q346 PolarHBondContact O-N 3.01Å; A343-Q346 VanDerWaalsContact O-N 3.1Å; V344-Q346 PolarHBondContact O-N 2.69Å; Q346-T348 PolarHBondContact O-N 3.21Å
347	V	97.8	Very high	97.2	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.006	11%	0.112	C	C	.	.			trans	-68	121.5	-179	177	0	0	0	0	112.4	T280 A282 V344 T349 V352 T443 R447	T280-V347 HydrophobicContact CG2-CG1 4.34Å; T280-V347 HydrophobicContact CG2-CG2 3.88Å; A282-V347 HydrophobicContact CB-CG2 4.49Å; V344-V347 PolarHBondContact O-N 2.91Å; V347-T349 VanDerWaalsContact CG1-OG1 3.29Å; V347-T349 WeakPolarHBondContact CG1-OG1 3.28Å; V347-V352 HydrophobicContact CG1-CB 4.16Å; V347-V352 HydrophobicContact CG2-CB 4.25Å; V347-V352 HydrophobicContact CG2-CG2 3.85Å; V347-T443 HydrophobicContact CB-CG2 3.95Å; V347-T443 HydrophobicContact CG1-CG2 3.79Å; V347-R447 VanDerWaalsContact O-CZ 3.28Å; V347-R447 PolarHBondContact O-NH1 3.46Å; V347-R447 PolarHBondContact O-NH2 2.85Å
348	T	94.1	Very high	97.2	Very high	120 Å²	120	20.1 Å²	20.1	74%	0.736	12%	0.116	S	C	*	.			trans	-99.4	-15.2	178.5	54.3	0	0	0	0	113.7	Q346	Q346-T348 PolarHBondContact O-N 3.21Å
349	T	95.7	Very high	97.2	Very high	15 Å²	15	19.7 Å²	19.7	9%	0.092	11%	0.112	C	C	.	.	S	Bend	trans	-77	162.8	-177.5	56.9	0	0	0	0	113.1	L278 T280 V347 Y351 T443	L278-T349 WeakPolarHBondContact O-CB 3.33Å; T280-T349 WeakPolarHBondContact CB-OG1 3.41Å; T280-T349 PolarHBondContact N-OG1 3.02Å; T280-T349 VanDerWaalsContact OG1-CG2 3.25Å; T280-T349 WeakPolarHBondContact OG1-CG2 3.3Å; T280-T349 PolarHBondContact OG1-OG1 3.03Å; T280-T349 VanDerWaalsContact OG1-OG1 3.1Å; V347-T349 VanDerWaalsContact CG1-OG1 3.29Å; V347-T349 WeakPolarHBondContact CG1-OG1 3.28Å; T349-Y351 VanDerWaalsContact C-N 3.26Å; T349-Y351 PolarHBondContact O-N 2.89Å; T349-Y351 PolarHBondContact OG1-O 2.84Å; T349-T443 WeakPolarHBondContact O-CB 3.29Å; T349-T443 PolarHBondContact O-OG1 3.21Å
350	K	95.6	Very high	97.2	Very high	7 Å²	7	21.9 Å²	21.9	3%	0.03	13%	0.125	C	C	.	.	S	Bend	trans	-55.9	-40.7	177.8	-172.3	172	-172.7	-179.4	0	112.6	E121 Y262 L278 E375 T443	E121-K350 VanDerWaalsContact CD-NZ 3.32Å; E121-K350 WeakPolarHBondContact OE1-CE 3.4Å; E121-K350 IonicContact OE1-NZ 2.95Å; E121-K350 PolarHBondContact OE1-NZ 3.34Å; E121-K350 VanDerWaalsContact OE1-NZ 3.08Å; E121-K350 IonicContact OE2-NZ 2.73Å; E121-K350 PolarHBondContact OE2-NZ 2.05Å; Y262-K350 HydrophobicContact CD1-CB 3.8Å; Y262-K350 HydrophobicContact CD1-CG 4.38Å; Y262-K350 HydrophobicContact CD2-CB 3.95Å; Y262-K350 HydrophobicContact CD2-CD 4.13Å; Y262-K350 HydrophobicContact CD2-CG 3.58Å; Y262-K350 HydrophobicContact CE1-CB 4.16Å; Y262-K350 HydrophobicContact CE2-CB 4.29Å; Y262-K350 HydrophobicContact CE2-CG 3.94Å; Y262-K350 HydrophobicContact CG-CB 3.68Å; Y262-K350 HydrophobicContact CG-CD 4.26Å; Y262-K350 HydrophobicContact CG-CG 3.81Å; L278-K350 HydrophobicContact CD2-CB 4.18Å; L278-K350 HydrophobicContact CD2-CD 4.16Å; L278-K350 PolarHBondContact O-N 2.9Å; K350-E375 WeakPolarHBondContact CD-OE1 3.47Å; K350-E375 VanDerWaalsContact CE-OE1 3.29Å; K350-E375 WeakPolarHBondContact CE-OE1 3.45Å; K350-E375 VanDerWaalsContact NZ-CD 3.25Å; K350-E375 IonicContact NZ-OE1 3.31Å; K350-E375 PolarHBondContact NZ-OE1 2.89Å; K350-E375 IonicContact NZ-OE2 3.42Å; K350-E375 PolarHBondContact NZ-OE2 2.79Å; K350-T443 PolarHBondContact O-N 3.21Å; K350-T443 PolarHBondContact O-OG1 2.8Å
351	Y	98	Very high	97.3	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	146.5	-178.7	-55.9	-72.8	0	0	0	112	L278 V279 T280 T349 V371 L374 E375 L440 A441 R442 T443	L278-Y351 HydrophobicContact CB-CD2 4.29Å; L278-Y351 PolarHBondContact O-N 3.46Å; V279-Y351 WeakPolarHBondContact CA-O 3.35Å; T280-Y351 PolarHBondContact N-O 2.84Å; T280-Y351 VanDerWaalsContact N-O 3.12Å; T349-Y351 VanDerWaalsContact C-N 3.26Å; T349-Y351 PolarHBondContact O-N 2.89Å; T349-Y351 PolarHBondContact OG1-O 2.84Å; Y351-V371 HydrophobicContact CD2-CG2 4.5Å; Y351-V371 HydrophobicContact CE2-CG1 4.38Å; Y351-L374 HydrophobicContact CD1-CB 4.33Å; Y351-L374 HydrophobicContact CD1-CD1 3.46Å; Y351-L374 VanDerWaalsContact CD1-CD1 3.46Å; Y351-L374 HydrophobicContact CE1-CB 3.49Å; Y351-L374 VanDerWaalsContact CE1-CB 3.49Å; Y351-L374 HydrophobicContact CE1-CD1 3.46Å; Y351-L374 VanDerWaalsContact CE1-CD1 3.46Å; Y351-L374 HydrophobicContact CE1-CG 4.12Å; Y351-L374 HydrophobicContact CG-CD1 4.41Å; Y351-L374 PolarHBondContact OH-O 3.11Å; Y351-E375 HydrophobicContact CE2-CG 4.48Å; Y351-E375 VanDerWaalsContact CE2-OE1 3.28Å; Y351-E375 WeakPolarHBondContact CE2-OE1 3.31Å; Y351-E375 VanDerWaalsContact OH-CD 3.22Å; Y351-E375 PolarHBondContact OH-OE1 3Å; Y351-L440 HydrophobicContact CG-CD2 4.39Å; Y351-L440 HydrophobicContact CG-CG 4.46Å; Y351-A441 CarbonylContact C-O 3.57Å; Y351-A441 VanDerWaalsContact CA-O 3.23Å; Y351-A441 WeakPolarHBondContact CA-O 3.38Å; Y351-R442 HydrophobicContact CD1-CG 4.06Å; Y351-R442 HydrophobicContact CE1-CG 3.64Å; Y351-T443 VanDerWaalsContact C-OG1 3.27Å
352	V	98.8	Very high	97.2	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.006	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	130.5	168.3	58.9	0	0	0	0	108.9	T280 A282 V344 V347 L440 A441 T443 V446	T280-V352 WeakPolarHBondContact O-CA 3.06Å; A282-V352 HydrophobicContact CB-CG2 3.55Å; V344-V352 HydrophobicContact CG2-CG2 4.37Å; V347-V352 HydrophobicContact CG1-CB 4.16Å; V347-V352 HydrophobicContact CG2-CB 4.25Å; V347-V352 HydrophobicContact CG2-CG2 3.85Å; V352-L440 WeakPolarHBondContact O-CA 3.47Å; V352-A441 PolarHBondContact N-O 2.94Å; V352-A441 PolarHBondContact O-N 3.26Å; V352-T443 PolarHBondContact N-OG1 2.99Å; V352-V446 HydrophobicContact CG1-CB 4.49Å; V352-V446 HydrophobicContact CG1-CG2 4.07Å
353	L	98.9	Very high	97.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	116.9	167.2	-177.8	78.3	0	0	0	108.6	V279 T280 I281 A282 V355 F361 L367 L370 F438 F439 L440	V279-L353 HydrophobicContact CG1-CB 3.91Å; T280-L353 PolarHBondContact O-N 3.05Å; I281-L353 HydrophobicContact CD1-CD2 4.08Å; I281-L353 HydrophobicContact CG1-CB 4.27Å; I281-L353 HydrophobicContact CG1-CD2 3.89Å; I281-L353 HydrophobicContact CG2-CD2 4.4Å; A282-L353 PolarHBondContact N-O 3.13Å; L353-V355 HydrophobicContact CD2-CG1 3.82Å; L353-V355 HydrophobicContact CG-CG1 3.98Å; L353-F361 HydrophobicContact CD2-CE2 4.18Å; L353-F361 HydrophobicContact CD2-CZ 3.68Å; L353-L367 HydrophobicContact CD1-CD2 3.89Å; L353-L367 HydrophobicContact CD2-CD1 4.14Å; L353-L367 HydrophobicContact CD2-CD2 3.51Å; L353-L367 HydrophobicContact CD2-CG 4.49Å; L353-L367 HydrophobicContact CG-CD2 4.3Å; L353-L370 HydrophobicContact CD1-CD1 4.31Å; L353-F438 HydrophobicContact CD1-CD2 4.34Å; L353-F438 HydrophobicContact CD1-CE2 3.9Å; L353-F438 HydrophobicContact CD2-CE2 4.23Å; L353-F438 HydrophobicContact CG-CE2 4.43Å; L353-F439 CarbonylContact C-O 3.56Å; L353-F439 WeakPolarHBondContact CA-O 3.43Å; L353-L440 HydrophobicContact CB-CD1 3.89Å; L353-L440 HydrophobicContact CD1-CB 4.06Å; L353-L440 HydrophobicContact CD1-CD1 4.21Å
354	W	98.6	Very high	97.1	Very high	3 Å²	3	26.3 Å²	26.3	1%	0.011	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	130.7	171.1	-174.4	-90.1	0	0	0	110.9	A282 K284 R340 A343 D356 F439	A282-W354 HydrophobicContact CB-CE3 4.09Å; A282-W354 HydrophobicContact CB-CZ3 4.2Å; K284-W354 HydrophobicContact CB-CH2 3.76Å; K284-W354 HydrophobicContact CB-CZ2 4.06Å; R340-W354 HydrophobicContact CB-CH2 3.85Å; R340-W354 HydrophobicContact CB-CZ2 4.47Å; R340-W354 HydrophobicContact CB-CZ3 3.88Å; R340-W354 HydrophobicContact CG-CE3 4.46Å; R340-W354 HydrophobicContact CG-CH2 3.39Å; R340-W354 HydrophobicContact CG-CZ2 3.57Å; R340-W354 HydrophobicContact CG-CZ3 3.87Å; R340-W354 VanDerWaalsContact NE-CE2 3.32Å; R340-W354 VanDerWaalsContact NE-CZ2 3.33Å; A343-W354 HydrophobicContact CB-CZ3 4.29Å; W354-D356 PolarHBondContact NE1-OD1 3.28Å; W354-F439 HydrophobicContact CB-CD1 4.27Å; W354-F439 HydrophobicContact CB-CD2 4.23Å; W354-F439 HydrophobicContact CB-CE1 3.84Å; W354-F439 HydrophobicContact CB-CE2 3.79Å; W354-F439 HydrophobicContact CB-CG 4.46Å; W354-F439 HydrophobicContact CB-CZ 3.58Å; W354-F439 HydrophobicContact CG-CE1 4.11Å; W354-F439 HydrophobicContact CG-CZ 4.03Å; W354-F439 PolarHBondContact N-O 2.8Å; W354-F439 PolarHBondContact O-N 2.81Å
355	V	98.3	Very high	97.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	146.1	174.3	-58.6	0	0	0	0	111.3	I281 A282 T283 L295 L353 F359 F361 F438	I281-V355 HydrophobicContact CG2-CG1 4.18Å; I281-V355 HydrophobicContact CG2-CG2 3.54Å; A282-V355 PolarHBondContact O-N 3.37Å; A282-V355 VanDerWaalsContact O-N 3.09Å; T283-V355 WeakPolarHBondContact CA-O 3.44Å; T283-V355 WeakPolarHBondContact CB-O 3.43Å; T283-V355 PolarHBondContact OG1-O 2.98Å; L295-V355 HydrophobicContact CD1-CG2 4.27Å; L295-V355 HydrophobicContact CD2-CG2 3.82Å; L353-V355 HydrophobicContact CD2-CG1 3.82Å; L353-V355 HydrophobicContact CG-CG1 3.98Å; V355-F359 HydrophobicContact CB-CD2 3.89Å; V355-F359 HydrophobicContact CG1-CD2 4.38Å; V355-F361 HydrophobicContact CG1-CE1 4.06Å; V355-F361 HydrophobicContact CG1-CZ 4.09Å; V355-F438 HydrophobicContact CG1-CD2 4.09Å; V355-F438 HydrophobicContact CG1-CE2 4.39Å
356	D	95.8	Very high	97.1	Very high	19 Å²	19	30.1 Å²	30.1	10%	0.102	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	149.3	168.2	-65.5	-15.1	0	0	0	109.7	W336 W354 D358 F359 N437	W336-D356 VanDerWaalsContact CH2-OD1 3.29Å; W336-D356 WeakPolarHBondContact CH2-OD1 3.33Å; W336-D356 VanDerWaalsContact CZ2-OD1 3.32Å; W336-D356 WeakPolarHBondContact CZ2-OD1 3.43Å; W354-D356 PolarHBondContact NE1-OD1 3.28Å; D356-D358 PolarHBondContact O-N 3.37Å; D356-D358 VanDerWaalsContact O-N 3.08Å; D356-F359 HydrophobicContact CB-CD1 4.19Å; D356-F359 HydrophobicContact CB-CD2 4.39Å; D356-F359 HydrophobicContact CB-CE1 3.84Å; D356-F359 HydrophobicContact CB-CE2 4.06Å; D356-F359 HydrophobicContact CB-CG 4.45Å; D356-F359 HydrophobicContact CB-CZ 3.76Å; D356-F359 WeakPolarHBondContact O-CB 3.45Å; D356-F359 PolarHBondContact O-N 3.14Å; D356-F359 VanDerWaalsContact O-N 3.15Å; D356-N437 WeakPolarHBondContact OD2-CB 3.27Å; D356-N437 PolarHBondContact OD2-ND2 3.45Å
357	D	94.4	Very high	97.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-5.6	-172.9	63.6	-17.1	0	0	0	114.5	T283 T285 R288 R291 L292	T283-D357 PolarHBondContact OG1-N 2.88Å; T285-D357 WeakPolarHBondContact CA-OD2 3.29Å; T285-D357 WeakPolarHBondContact CB-OD2 3.46Å; T285-D357 PolarHBondContact OG1-OD2 3.23Å; R288-D357 IonicContact CZ-OD1 2.72Å; R288-D357 IonicContact CZ-OD2 3.98Å; R288-D357 IonicContact NE-OD1 2.92Å; R288-D357 PolarHBondContact NE-OD1 3.22Å; R288-D357 IonicContact NE-OD2 3.95Å; R288-D357 PolarHBondContact NE-OD2 3.38Å; R288-D357 IonicContact NH1-OD1 3.18Å; R288-D357 IonicContact NH2-OD1 2.93Å; R288-D357 PolarHBondContact NH2-OD1 2.77Å; R288-D357 IonicContact NH2-OD2 3.88Å; R291-D357 CarbonylContact C-O 3.54Å; R291-D357 WeakPolarHBondContact CB-O 3.43Å; R291-D357 VanDerWaalsContact O-O 3.11Å; L292-D357 HydrophobicContact CD1-CB 4.33Å; L292-D357 PolarHBondContact N-O 2.86Å
358	D	93.9	Very high	97	Very high	18 Å²	18	29.1 Å²	29.1	10%	0.096	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	15.5	175.8	57.3	4.1	0	0	0	113.9	R288 R291 D356 H483 A484	R288-D358 IonicContact CZ-OD2 3.73Å; R288-D358 IonicContact NH1-OD2 3.15Å; R288-D358 PolarHBondContact NH1-OD2 2.81Å; R291-D358 HydrophobicContact CB-CB 4.14Å; R291-D358 HydrophobicContact CG-CB 4.27Å; D356-D358 PolarHBondContact O-N 3.37Å; D356-D358 VanDerWaalsContact O-N 3.08Å; D358-H483 IonicContact OD1-CE1 2.97Å; D358-H483 IonicContact OD1-NE2 2.7Å; D358-H483 IonicContact OD2-CE1 3.02Å; D358-H483 PolarHBondContact OD2-CE1 2.85Å; D358-H483 IonicContact OD2-NE2 3.61Å; D358-A484 HydrophobicContact CB-CB 4.32Å; D358-A484 WeakPolarHBondContact O-CB 3.47Å; D358-A484 PolarHBondContact O-N 3.29Å
359	F	97.4	Very high	97.1	Very high	3 Å²	3	25 Å²	25	1%	0.013	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	155.7	171.3	-69.4	-4.5	0	0	0	113	L295 V355 D356 V386 N437 F438 V481 D482 H483	L295-F359 WeakPolarHBondContact CA-O 3.33Å; L295-F359 WeakPolarHBondContact CB-O 3.22Å; L295-F359 HydrophobicContact CD1-CB 4.17Å; L295-F359 VanDerWaalsContact CD1-O 3.31Å; L295-F359 WeakPolarHBondContact CD1-O 3.46Å; V355-F359 HydrophobicContact CB-CD2 3.89Å; V355-F359 HydrophobicContact CG1-CD2 4.38Å; D356-F359 HydrophobicContact CB-CD1 4.19Å; D356-F359 HydrophobicContact CB-CD2 4.39Å; D356-F359 HydrophobicContact CB-CE1 3.84Å; D356-F359 HydrophobicContact CB-CE2 4.06Å; D356-F359 HydrophobicContact CB-CG 4.45Å; D356-F359 HydrophobicContact CB-CZ 3.76Å; D356-F359 WeakPolarHBondContact O-CB 3.45Å; D356-F359 PolarHBondContact O-N 3.14Å; D356-F359 VanDerWaalsContact O-N 3.15Å; F359-V386 HydrophobicContact CE1-CG1 3.91Å; F359-V386 HydrophobicContact CE1-CG2 4.21Å; F359-V386 HydrophobicContact CE2-CG2 4.15Å; F359-V386 HydrophobicContact CZ-CG1 4.26Å; F359-V386 HydrophobicContact CZ-CG2 3.71Å; F359-N437 VanDerWaalsContact CE2-O 3.27Å; F359-N437 WeakPolarHBondContact CE2-O 3.5Å; F359-F438 HydrophobicContact CE2-CB 3.85Å; F359-V481 HydrophobicContact CB-CG2 3.78Å; F359-V481 HydrophobicContact CD2-CG1 3.8Å; F359-V481 HydrophobicContact CD2-CG2 4.29Å; F359-V481 HydrophobicContact CE2-CG1 4.12Å; F359-V481 HydrophobicContact CG-CG1 4.12Å; F359-V481 HydrophobicContact CG-CG2 4.22Å; F359-D482 CarbonylContact C-O 3.57Å; F359-D482 WeakPolarHBondContact CA-O 3.5Å; F359-H483 AromaticContact CE1-CD2 3.74Å
360	V	97.5	Very high	97.2	Very high	46 Å²	46	24.3 Å²	24.3	28%	0.279	12%	0.122	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	118.6	179.8	-176.2	0	0	0	0	109.1	V481 D482 A484	V360-V481 WeakPolarHBondContact O-CG2 3.27Å; V360-D482 HydrophobicContact CB-CB 4.32Å; V360-D482 PolarHBondContact N-O 2.88Å; V360-D482 PolarHBondContact O-N 2.87Å; V360-A484 HydrophobicContact CG2-CB 4.39Å
361	F	98.3	Very high	97.3	Very high	4 Å²	4	24 Å²	24	2%	0.018	12%	0.121	C	C	.	.			trans	-72.7	141	177.6	-80.1	53.1	0	0	0	110.2	I281 L295 S298 I299 F302 Y303 L353 V355 T365 L367 V481	I281-F361 HydrophobicContact CD1-CE2 4Å; I281-F361 HydrophobicContact CD1-CZ 3.81Å; L295-F361 HydrophobicContact CD1-CD1 3.98Å; L295-F361 HydrophobicContact CD1-CE1 3.85Å; S298-F361 PolarHBondContact OG-N 2.9Å; I299-F361 HydrophobicContact CD1-CE1 4.12Å; I299-F361 HydrophobicContact CD1-CZ 4.43Å; I299-F361 HydrophobicContact CG1-CD1 3.64Å; I299-F361 HydrophobicContact CG1-CD2 4.26Å; I299-F361 HydrophobicContact CG1-CE1 3.6Å; I299-F361 HydrophobicContact CG1-CE2 4.21Å; I299-F361 HydrophobicContact CG1-CG 4Å; I299-F361 HydrophobicContact CG1-CZ 3.89Å; F302-F361 HydrophobicContact CD2-CB 3.97Å; F302-F361 VanDerWaalsContact CE2-O 3.27Å; F302-F361 WeakPolarHBondContact CE2-O 3.33Å; Y303-F361 AromaticContact CD2-CD2 3.96Å; Y303-F361 HydrophobicContact CD2-CD2 3.96Å; Y303-F361 HydrophobicContact CD2-CE2 4.1Å; Y303-F361 HydrophobicContact CE2-CD2 4.13Å; Y303-F361 HydrophobicContact CE2-CE2 4.29Å; L353-F361 HydrophobicContact CD2-CE2 4.18Å; L353-F361 HydrophobicContact CD2-CZ 3.68Å; V355-F361 HydrophobicContact CG1-CE1 4.06Å; V355-F361 HydrophobicContact CG1-CZ 4.09Å; F361-T365 HydrophobicContact CD1-CG2 4.41Å; F361-T365 HydrophobicContact CD2-CG2 3.46Å; F361-T365 VanDerWaalsContact CD2-CG2 3.46Å; F361-T365 HydrophobicContact CE2-CG2 3.62Å; F361-T365 HydrophobicContact CG-CG2 3.89Å; F361-T365 HydrophobicContact CZ-CG2 4.16Å; F361-L367 HydrophobicContact CE2-CD1 4.43Å; F361-L367 HydrophobicContact CE2-CD2 4.47Å; F361-V481 HydrophobicContact CD1-CG2 4.21Å; F361-V481 HydrophobicContact CE1-CG2 4.39Å
362	T	97.5	Very high	97.1	Very high	20 Å²	20	25.8 Å²	25.8	12%	0.123	13%	0.13	C	C	.	.			trans	-136	178.2	178.8	72.1	0	0	0	0	110.2	F302 R364 T365 D482	F302-T362 VanDerWaalsContact CE2-CA 3.5Å; T362-R364 PolarHBondContact O-N 3.09Å; T362-R364 PolarHBondContact OG1-N 2.85Å; T362-R364 PolarHBondContact OG1-NH2 2.83Å; T362-T365 PolarHBondContact N-OG1 2.9Å; T362-T365 WeakPolarHBondContact O-CB 3.41Å; T362-T365 PolarHBondContact O-N 2.85Å; T362-T365 PolarHBondContact O-OG1 3.48Å; T362-D482 HydrophobicContact CG2-CB 4.1Å
363	A	97.4	Very high	97	Very high	79 Å²	79	25.7 Å²	25.7	65%	0.653	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-15.2	173.4	0	0	0	0	0	113.8	F302	F302-A363 HydrophobicContact CE1-CB 4.08Å; F302-A363 VanDerWaalsContact CZ-N 3.32Å
364	R	97.4	Very high	96.8	Very high	89 Å²	89	25.7 Å²	25.7	34%	0.336	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-10.6	174.1	-63.1	178.7	-63.6	-76.8	-17.6	113.2	T362 R366 V480 D482	T362-R364 PolarHBondContact O-N 3.09Å; T362-R364 PolarHBondContact OG1-N 2.85Å; T362-R364 PolarHBondContact OG1-NH2 2.83Å; R364-R366 VanDerWaalsContact C-N 3.27Å; R364-R366 PolarHBondContact O-N 2.97Å; R364-V480 CarbonylContact C-O 3.58Å; R364-V480 VanDerWaalsContact C-O 3.31Å; R364-V480 HydrophobicContact CB-CB 3.82Å; R364-V480 HydrophobicContact CB-CG2 4.25Å; R364-V480 PolarHBondContact O-N 3.16Å; R364-D482 IonicContact CZ-OD1 2.9Å; R364-D482 IonicContact NH2-OD1 3.55Å; R364-D482 PolarHBondContact NH2-OD1 3.04Å; R364-D482 IonicContact NH2-OD2 3.7Å; R364-D482 PolarHBondContact NH2-OD2 3.22Å
365	T	98.2	Very high	96.5	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.012	14%	0.138	C	C	.	.			trans	-85.4	70.5	-178.9	-43.4	0	0	0	0	109.6	Y303 F361 T362 L367 F438 V480 V481	Y303-T365 WeakPolarHBondContact CE2-O 3.48Å; Y303-T365 PolarHBondContact OH-O 3.07Å; F361-T365 HydrophobicContact CD1-CG2 4.41Å; F361-T365 HydrophobicContact CD2-CG2 3.46Å; F361-T365 VanDerWaalsContact CD2-CG2 3.46Å; F361-T365 HydrophobicContact CE2-CG2 3.62Å; F361-T365 HydrophobicContact CG-CG2 3.89Å; F361-T365 HydrophobicContact CZ-CG2 4.16Å; T362-T365 PolarHBondContact N-OG1 2.9Å; T362-T365 WeakPolarHBondContact O-CB 3.41Å; T362-T365 PolarHBondContact O-N 2.85Å; T362-T365 PolarHBondContact O-OG1 3.48Å; T365-L367 PolarHBondContact O-N 2.87Å; T365-F438 HydrophobicContact CG2-CE2 4.1Å; T365-F438 HydrophobicContact CG2-CZ 3.66Å; T365-V480 VanDerWaalsContact CA-O 3.3Å; T365-V480 WeakPolarHBondContact CA-O 3.36Å; T365-V480 WeakPolarHBondContact CB-O 3.1Å; T365-V480 PolarHBondContact N-O 2.93Å; T365-V480 PolarHBondContact OG1-O 3.15Å; T365-V481 HydrophobicContact CG2-CB 4.27Å; T365-V481 HydrophobicContact CG2-CG2 4.31Å
366	R	97.2	Very high	96.2	Very high	142 Å²	142	34.9 Å²	34.9	54%	0.536	17%	0.166	S	C	.	.			trans	-91.5	93	-172.8	-61.5	-170.1	65.4	-168	-0.7	112.5	R364 E368 K369	R364-R366 VanDerWaalsContact C-N 3.27Å; R364-R366 PolarHBondContact O-N 2.97Å; R366-E368 VanDerWaalsContact C-N 3.25Å; R366-E368 PolarHBondContact O-N 3.32Å; R366-K369 HydrophobicContact CB-CB 4.49Å; R366-K369 PolarHBondContact O-N 2.98Å
367	L	97.9	Very high	96	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65.4	-29.1	179	-58.5	-173.7	0	0	0	112.7	I275 Y303 I306 L353 F361 T365 K369 L370 V371	I275-L367 HydrophobicContact CG2-CB 4.05Å; I275-L367 HydrophobicContact CG2-CD1 4.09Å; Y303-L367 HydrophobicContact CD1-CD1 4.23Å; Y303-L367 HydrophobicContact CD2-CD1 3.86Å; Y303-L367 HydrophobicContact CD2-CG 4.28Å; Y303-L367 HydrophobicContact CE1-CB 4.17Å; Y303-L367 HydrophobicContact CE1-CD1 4.08Å; Y303-L367 HydrophobicContact CE1-CG 4.2Å; Y303-L367 HydrophobicContact CE2-CB 4.34Å; Y303-L367 HydrophobicContact CE2-CD1 3.7Å; Y303-L367 HydrophobicContact CE2-CG 3.59Å; Y303-L367 HydrophobicContact CG-CD1 4.14Å; Y303-L367 PolarHBondContact OH-N 3.43Å; I306-L367 HydrophobicContact CD1-CD1 4.02Å; L353-L367 HydrophobicContact CD1-CD2 3.89Å; L353-L367 HydrophobicContact CD2-CD1 4.14Å; L353-L367 HydrophobicContact CD2-CD2 3.51Å; L353-L367 HydrophobicContact CD2-CG 4.49Å; L353-L367 HydrophobicContact CG-CD2 4.3Å; F361-L367 HydrophobicContact CE2-CD1 4.43Å; F361-L367 HydrophobicContact CE2-CD2 4.47Å; T365-L367 PolarHBondContact O-N 2.87Å; L367-K369 PolarHBondContact O-N 3.38Å; L367-L370 HydrophobicContact CD2-CD1 4.48Å; L367-L370 PolarHBondContact O-N 3.38Å; L367-L370 VanDerWaalsContact O-N 3.1Å; L367-V371 WeakPolarHBondContact O-CG2 3.39Å; L367-V371 PolarHBondContact O-N 3.41Å
368	E	96.1	Very high	95.9	Very high	43 Å²	43	36.9 Å²	36.9	20%	0.201	18%	0.183	C	C	.	.	H	α-helix	trans	-59.4	-38	179	-52.3	70	-154.9	0	0	111	I275 Y303 R366 D372	I275-E368 HydrophobicContact CD1-CB 4.26Å; I275-E368 HydrophobicContact CD1-CG 3.94Å; I275-E368 HydrophobicContact CG1-CG 3.91Å; Y303-E368 WeakPolarHBondContact CE1-OE1 3.46Å; Y303-E368 VanDerWaalsContact OH-CD 3.31Å; Y303-E368 PolarHBondContact OH-OE1 3.46Å; Y303-E368 PolarHBondContact OH-OE2 2.82Å; Y303-E368 VanDerWaalsContact OH-OE2 3.12Å; R366-E368 VanDerWaalsContact C-N 3.25Å; R366-E368 PolarHBondContact O-N 3.32Å; E368-D372 WeakPolarHBondContact O-CB 3.35Å; E368-D372 PolarHBondContact O-N 2.77Å
369	K	96.3	Very high	96	Very high	35 Å²	35	36.6 Å²	36.6	15%	0.152	18%	0.181	C	C	.	.	H	α-helix	trans	-67.2	-41.6	177.5	-177.6	173.3	-178.3	-171.7	0	111.3	R366 L367 D372 V373 P427 D478 V479	R366-K369 HydrophobicContact CB-CB 4.49Å; R366-K369 PolarHBondContact O-N 2.98Å; L367-K369 PolarHBondContact O-N 3.38Å; K369-D372 PolarHBondContact O-N 3.33Å; K369-V373 WeakPolarHBondContact O-CG2 3.35Å; K369-V373 PolarHBondContact O-N 2.77Å; K369-V373 VanDerWaalsContact O-N 3.1Å; K369-P427 PolarHBondContact NZ-O 3.44Å; K369-D478 IonicContact NZ-OD1 2.74Å; K369-D478 PolarHBondContact NZ-OD1 3.45Å; K369-D478 IonicContact NZ-OD2 3.72Å; K369-D478 PolarHBondContact NZ-OD2 2.93Å; K369-V479 HydrophobicContact CB-CG2 4.04Å; K369-V479 HydrophobicContact CD-CG2 3.79Å; K369-V479 HydrophobicContact CG-CG2 4.11Å
370	L	98.1	Very high	96	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-67.5	-40.1	178.5	-59.6	-176.6	0	0	0	111.3	L353 L367 V373 L374 V382 L440 C476 V479	L353-L370 HydrophobicContact CD1-CD1 4.31Å; L367-L370 HydrophobicContact CD2-CD1 4.48Å; L367-L370 PolarHBondContact O-N 3.38Å; L367-L370 VanDerWaalsContact O-N 3.1Å; L370-V373 PolarHBondContact O-N 3.27Å; L370-L374 PolarHBondContact O-N 3.07Å; L370-V382 HydrophobicContact CB-CG1 3.84Å; L370-V382 HydrophobicContact CD2-CG1 3.91Å; L370-V382 HydrophobicContact CD2-CG2 3.93Å; L370-V382 HydrophobicContact CG-CG1 4.37Å; L370-L440 HydrophobicContact CB-CB 3.94Å; L370-L440 HydrophobicContact CB-CD2 3.63Å; L370-L440 HydrophobicContact CB-CG 4.42Å; L370-L440 HydrophobicContact CD1-CB 3.97Å; L370-C476 HydrophobicContact CD2-CB 4.36Å; L370-V479 HydrophobicContact CD1-CG1 4.03Å; L370-V479 HydrophobicContact CD2-CB 4.04Å; L370-V479 HydrophobicContact CD2-CG1 4.15Å; L370-V479 HydrophobicContact CD2-CG2 3.82Å; L370-V479 HydrophobicContact CG-CB 4.42Å; L370-V479 HydrophobicContact CG-CG1 3.99Å; L370-V479 HydrophobicContact CG-CG2 4.24Å
371	V	96.6	Very high	96.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.4	-47.2	173.4	170.8	0	0	0	0	110.4	Y273 I275 L278 V279 Y351 L367 V373 L374 E375 L440	Y273-V371 HydrophobicContact CD1-CG1 4.13Å; Y273-V371 HydrophobicContact CD2-CB 4.42Å; Y273-V371 HydrophobicContact CD2-CG1 3.8Å; Y273-V371 HydrophobicContact CE1-CG1 4.39Å; Y273-V371 HydrophobicContact CE2-CG1 4.09Å; Y273-V371 HydrophobicContact CG-CG1 3.83Å; I275-V371 HydrophobicContact CD1-CB 4.28Å; I275-V371 HydrophobicContact CD1-CG2 3.91Å; L278-V371 HydrophobicContact CD1-CG1 3.81Å; V279-V371 HydrophobicContact CG2-CG2 3.67Å; Y351-V371 HydrophobicContact CD2-CG2 4.5Å; Y351-V371 HydrophobicContact CE2-CG1 4.38Å; L367-V371 WeakPolarHBondContact O-CG2 3.39Å; L367-V371 PolarHBondContact O-N 3.41Å; V371-V373 VanDerWaalsContact C-N 3.27Å; V371-V373 PolarHBondContact O-N 3.38Å; V371-L374 PolarHBondContact O-N 3.43Å; V371-E375 HydrophobicContact CG1-CG 4.03Å; V371-E375 WeakPolarHBondContact O-CG 3.4Å; V371-E375 PolarHBondContact O-N 3.06Å; V371-L440 HydrophobicContact CB-CD2 4.42Å; V371-L440 HydrophobicContact CG2-CD2 3.67Å
372	D	94.5	Very high	96.1	Very high	37 Å²	37	34.8 Å²	34.8	20%	0.198	17%	0.171	C	C	.	.	H	α-helix	trans	-59.6	-38.5	-179.9	-163.1	50.3	0	0	0	112.5	Y273 E368 K369 E375 R376 F426	Y273-D372 HydrophobicContact CE2-CB 3.92Å; Y273-D372 PolarHBondContact OH-OD1 2.68Å; E368-D372 WeakPolarHBondContact O-CB 3.35Å; E368-D372 PolarHBondContact O-N 2.77Å; K369-D372 PolarHBondContact O-N 3.33Å; D372-E375 PolarHBondContact O-N 2.94Å; D372-R376 WeakPolarHBondContact O-CB 3.46Å; D372-R376 PolarHBondContact O-N 2.94Å; D372-R376 WeakPolarHBondContact OD1-CD 3.45Å; D372-R376 WeakPolarHBondContact OD2-CD 3.27Å; D372-R376 IonicContact OD2-CZ 3.06Å; D372-R376 IonicContact OD2-NH1 3.61Å; D372-R376 PolarHBondContact OD2-NH1 2.89Å; D372-F426 HydrophobicContact CB-CE1 4.23Å; D372-F426 WeakPolarHBondContact O-CZ 3.27Å; D372-F426 WeakPolarHBondContact OD2-CE1 3.35Å
373	V	96.3	Very high	96.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-59.2	-48	172.9	169.7	0	0	0	0	111.1	K369 L370 V371 T377 L379 V382 L423 F426	K369-V373 WeakPolarHBondContact O-CG2 3.35Å; K369-V373 PolarHBondContact O-N 2.77Å; K369-V373 VanDerWaalsContact O-N 3.1Å; L370-V373 PolarHBondContact O-N 3.27Å; V371-V373 VanDerWaalsContact C-N 3.27Å; V371-V373 PolarHBondContact O-N 3.38Å; V373-T377 VanDerWaalsContact O-CB 3.31Å; V373-T377 WeakPolarHBondContact O-CB 3.38Å; V373-T377 WeakPolarHBondContact O-CG2 3.27Å; V373-T377 PolarHBondContact O-N 2.84Å; V373-T377 VanDerWaalsContact O-N 3.09Å; V373-T377 PolarHBondContact O-OG1 3.21Å; V373-L379 HydrophobicContact CG1-CD1 3.87Å; V373-V382 HydrophobicContact CB-CG1 4.5Å; V373-V382 HydrophobicContact CG1-CB 4.16Å; V373-V382 HydrophobicContact CG1-CG1 4.36Å; V373-V382 HydrophobicContact CG1-CG2 4.09Å; V373-L423 HydrophobicContact CG1-CD2 3.8Å; V373-F426 HydrophobicContact CB-CD1 4.45Å; V373-F426 HydrophobicContact CB-CE1 4.29Å; V373-F426 HydrophobicContact CG2-CB 4.44Å; V373-F426 HydrophobicContact CG2-CD1 3.35Å; V373-F426 HydrophobicContact CG2-CD2 4.43Å; V373-F426 HydrophobicContact CG2-CE1 3.56Å; V373-F426 HydrophobicContact CG2-CG 3.83Å; V373-F426 HydrophobicContact CG2-CZ 4.2Å
374	L	95.3	Very high	96.2	Very high	0 Å²	0	30 Å²	30	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-76.3	-21.7	-177	-62.4	-176.2	0	0	0	113.9	Y351 L370 V371 L379 V382 L440	Y351-L374 HydrophobicContact CD1-CB 4.33Å; Y351-L374 HydrophobicContact CD1-CD1 3.46Å; Y351-L374 VanDerWaalsContact CD1-CD1 3.46Å; Y351-L374 HydrophobicContact CE1-CB 3.49Å; Y351-L374 VanDerWaalsContact CE1-CB 3.49Å; Y351-L374 HydrophobicContact CE1-CD1 3.46Å; Y351-L374 VanDerWaalsContact CE1-CD1 3.46Å; Y351-L374 HydrophobicContact CE1-CG 4.12Å; Y351-L374 HydrophobicContact CG-CD1 4.41Å; Y351-L374 PolarHBondContact OH-O 3.11Å; L370-L374 PolarHBondContact O-N 3.07Å; V371-L374 PolarHBondContact O-N 3.43Å; L374-L379 HydrophobicContact CD2-CB 3.97Å; L374-L379 WeakPolarHBondContact CD2-O 3.23Å; L374-V382 HydrophobicContact CD1-CG1 4.16Å; L374-V382 HydrophobicContact CD2-CB 4.24Å; L374-V382 HydrophobicContact CD2-CG1 3.92Å; L374-V382 HydrophobicContact CG-CG1 3.81Å; L374-L440 HydrophobicContact CD1-CB 4.38Å; L374-L440 HydrophobicContact CD1-CD2 3.85Å; L374-L440 HydrophobicContact CD1-CG 3.94Å
375	E	92.2	Very high	96.2	Very high	40 Å²	40	26 Å²	26	19%	0.187	12%	0.119	C	C	.	.	H	α-helix	trans	-80.6	-34.4	175	-71.3	-65.4	164.8	0	0	111.9	Y273 K350 Y351 V371 D372	Y273-E375 HydrophobicContact CE1-CB 4.47Å; Y273-E375 HydrophobicContact CE1-CG 3.97Å; K350-E375 WeakPolarHBondContact CD-OE1 3.47Å; K350-E375 VanDerWaalsContact CE-OE1 3.29Å; K350-E375 WeakPolarHBondContact CE-OE1 3.45Å; K350-E375 VanDerWaalsContact NZ-CD 3.25Å; K350-E375 IonicContact NZ-OE1 3.31Å; K350-E375 PolarHBondContact NZ-OE1 2.89Å; K350-E375 IonicContact NZ-OE2 3.42Å; K350-E375 PolarHBondContact NZ-OE2 2.79Å; Y351-E375 HydrophobicContact CE2-CG 4.48Å; Y351-E375 VanDerWaalsContact CE2-OE1 3.28Å; Y351-E375 WeakPolarHBondContact CE2-OE1 3.31Å; Y351-E375 VanDerWaalsContact OH-CD 3.22Å; Y351-E375 PolarHBondContact OH-OE1 3Å; V371-E375 HydrophobicContact CG1-CG 4.03Å; V371-E375 WeakPolarHBondContact O-CG 3.4Å; V371-E375 PolarHBondContact O-N 3.06Å; D372-E375 PolarHBondContact O-N 2.94Å
376	R	91.2	Very high	96.1	Very high	156 Å²	156	26.1 Å²	26.1	59%	0.589	12%	0.119	S	C	*	.	H	α-helix	trans	-104.9	-0.4	-172.4	-62.8	172.6	61.1	-149.4	-2.6	114.8	D372 F426	D372-R376 WeakPolarHBondContact O-CB 3.46Å; D372-R376 PolarHBondContact O-N 2.94Å; D372-R376 WeakPolarHBondContact OD1-CD 3.45Å; D372-R376 WeakPolarHBondContact OD2-CD 3.27Å; D372-R376 IonicContact OD2-CZ 3.06Å; D372-R376 IonicContact OD2-NH1 3.61Å; D372-R376 PolarHBondContact OD2-NH1 2.89Å; R376-F426 HydrophobicContact CB-CE2 4.16Å; R376-F426 HydrophobicContact CB-CZ 3.97Å
377	T	92.6	Very high	96	Very high	22 Å²	22	22.7 Å²	22.7	14%	0.135	11%	0.107	C	C	.	.	S	Bend	trans	-128.2	172	177.2	75.3	0	0	0	0	111.1	V373 L379 L423 F426	V373-T377 VanDerWaalsContact O-CB 3.31Å; V373-T377 WeakPolarHBondContact O-CB 3.38Å; V373-T377 WeakPolarHBondContact O-CG2 3.27Å; V373-T377 PolarHBondContact O-N 2.84Å; V373-T377 VanDerWaalsContact O-N 3.09Å; V373-T377 PolarHBondContact O-OG1 3.21Å; T377-L379 VanDerWaalsContact C-N 3.25Å; T377-L379 PolarHBondContact O-N 2.79Å; T377-L379 WeakPolarHBondContact OG1-CB 3.41Å; T377-L379 WeakPolarHBondContact OG1-CG 3.3Å; T377-L379 PolarHBondContact OG1-N 2.71Å; T377-L423 HydrophobicContact CG2-CD1 4.21Å; T377-L423 HydrophobicContact CG2-CD2 4.15Å; T377-L423 HydrophobicContact CG2-CG 4.35Å; T377-F426 HydrophobicContact CG2-CD2 3.85Å; T377-F426 HydrophobicContact CG2-CE2 3.5Å; T377-F426 HydrophobicContact CG2-CZ 4.47Å
378	A	92.3	Very high	95.6	Very high	39 Å²	39	24.9 Å²	24.9	32%	0.322	12%	0.117	S	C	.	.	S	Bend	trans	-88.9	12.6	176.7	0	0	0	0	0	113.4	R128 R472	R128-A378 HydrophobicContact CG-CB 4.43Å; A378-R472 WeakPolarHBondContact O-CD 3.22Å; A378-R472 PolarHBondContact O-NH1 2.98Å
379	L	96.3	Very high	94.9	Very high	11 Å²	11	28.7 Å²	28.7	6%	0.058	14%	0.137	C	C	.	.			trans	-72.5	146	176.3	-63.6	-179.7	0	0	0	111.2	V373 L374 T377 L423 V431 R472	V373-L379 HydrophobicContact CG1-CD1 3.87Å; L374-L379 HydrophobicContact CD2-CB 3.97Å; L374-L379 WeakPolarHBondContact CD2-O 3.23Å; T377-L379 VanDerWaalsContact C-N 3.25Å; T377-L379 PolarHBondContact O-N 2.79Å; T377-L379 WeakPolarHBondContact OG1-CB 3.41Å; T377-L379 WeakPolarHBondContact OG1-CG 3.3Å; T377-L379 PolarHBondContact OG1-N 2.71Å; L379-L423 HydrophobicContact CD1-CD1 4.16Å; L379-L423 HydrophobicContact CD1-CD2 3.73Å; L379-V431 HydrophobicContact CD2-CG2 4.47Å; L379-R472 HydrophobicContact CD2-CB 4.05Å
380	D	97.2	Very high	94.2	Very high	13 Å²	13	31.9 Å²	31.9	7%	0.07	16%	0.164	C	C	.	.	S	Bend	trans	-98.8	-24.1	175.7	-60.3	-61.5	0	0	0	112.1	A441 R442 K445 L471 R472	D380-A441 CarbonylContact O-C 2.92Å; D380-A441 WeakPolarHBondContact O-CA 3.32Å; D380-R442 PolarHBondContact O-N 2.9Å; D380-K445 HydrophobicContact CB-CB 4.19Å; D380-K445 HydrophobicContact CB-CG 3.99Å; D380-L471 HydrophobicContact CB-CD2 4.07Å; D380-R472 PolarHBondContact N-O 3.02Å; D380-R472 PolarHBondContact OD2-N 2.83Å
381	L	98.4	Very high	93.5	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	137.5	-175.7	-177.1	156.5	0	0	0	110.7	V435 F439 L440 A441 F463 F464 R472 V473 G474	L381-V435 HydrophobicContact CD2-CG2 3.58Å; L381-F439 HydrophobicContact CD1-CD2 3.46Å; L381-F439 VanDerWaalsContact CD1-CD2 3.46Å; L381-F439 HydrophobicContact CD1-CE2 3.66Å; L381-F439 HydrophobicContact CD1-CG 4.03Å; L381-F439 HydrophobicContact CD1-CZ 4.35Å; L381-F439 HydrophobicContact CD2-CB 3.82Å; L381-F439 HydrophobicContact CD2-CD2 4.18Å; L381-F439 HydrophobicContact CD2-CG 4.05Å; L381-F439 HydrophobicContact CG-CB 4.19Å; L381-F439 HydrophobicContact CG-CD2 3.72Å; L381-F439 HydrophobicContact CG-CE2 4.4Å; L381-F439 HydrophobicContact CG-CG 4.12Å; L381-L440 CarbonylContact C-O 3.57Å; L381-L440 WeakPolarHBondContact CA-O 3.44Å; L381-A441 HydrophobicContact CB-CB 3.92Å; L381-A441 HydrophobicContact CD1-CB 3.83Å; L381-A441 HydrophobicContact CG-CB 3.79Å; L381-F463 HydrophobicContact CD1-CE1 3.9Å; L381-F463 HydrophobicContact CD1-CZ 4.47Å; L381-F464 HydrophobicContact CD1-CE1 4.02Å; L381-F464 HydrophobicContact CD2-CE1 4.02Å; L381-F464 HydrophobicContact CD2-CZ 4.46Å; L381-R472 PolarHBondContact N-O 2.87Å; L381-V473 HydrophobicContact CB-CG2 4.32Å; L381-V473 HydrophobicContact CD2-CG1 3.77Å; L381-V473 HydrophobicContact CD2-CG2 4.37Å; L381-V473 CarbonylContact O-C 3.59Å; L381-V473 WeakPolarHBondContact O-CA 3.45Å; L381-G474 PolarHBondContact O-N 3.24Å
382	V	98.8	Very high	93.2	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	122.1	174.6	60.9	0	0	0	0	111.5	L370 V373 L374 F439 L440 G474	L370-V382 HydrophobicContact CB-CG1 3.84Å; L370-V382 HydrophobicContact CD2-CG1 3.91Å; L370-V382 HydrophobicContact CD2-CG2 3.93Å; L370-V382 HydrophobicContact CG-CG1 4.37Å; V373-V382 HydrophobicContact CB-CG1 4.5Å; V373-V382 HydrophobicContact CG1-CB 4.16Å; V373-V382 HydrophobicContact CG1-CG1 4.36Å; V373-V382 HydrophobicContact CG1-CG2 4.09Å; L374-V382 HydrophobicContact CD1-CG1 4.16Å; L374-V382 HydrophobicContact CD2-CB 4.24Å; L374-V382 HydrophobicContact CD2-CG1 3.92Å; L374-V382 HydrophobicContact CG-CG1 3.81Å; V382-F439 CarbonylContact O-C 3.57Å; V382-F439 WeakPolarHBondContact O-CA 3.46Å; V382-L440 HydrophobicContact CG1-CB 4.22Å; V382-L440 PolarHBondContact N-O 2.83Å; V382-L440 PolarHBondContact O-N 2.88Å; V382-G474 CarbonylContact C-O 3.02Å; V382-G474 VanDerWaalsContact CA-O 3.3Å; V382-G474 WeakPolarHBondContact CA-O 3.25Å
383	G	98.5	Very high	93.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	149.8	176.2	0	0	0	0	0	113.5	F438 G474 S475 C476	G383-F438 CarbonylContact C-O 3.47Å; G383-F438 WeakPolarHBondContact CA-O 3.46Å; G383-G474 PolarHBondContact N-O 3.25Å; G383-S475 CarbonylContact O-C 3.56Å; G383-S475 VanDerWaalsContact O-CA 3.27Å; G383-S475 WeakPolarHBondContact O-CA 3.29Å; G383-C476 PolarHBondContact O-N 3.43Å
384	G	98.2	Very high	93	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-156.4	167.6	0	0	0	0	0	112.7	V436 F438 C476 V479	G384-V436 WeakPolarHBondContact O-CG1 3.33Å; G384-F438 PolarHBondContact N-O 3.15Å; G384-C476 WeakPolarHBondContact CA-O 3.1Å; G384-V479 CarbonylContact C-O 3.57Å; G384-V479 VanDerWaalsContact CA-O 3.27Å; G384-V479 WeakPolarHBondContact CA-O 3.49Å
385	S	97.6	Very high	93	Very high	3 Å²	3	44.6 Å²	44.6	2%	0.021	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	146.1	167.9	63.2	0	0	0	0	111.4	T394 S477 V479 V480 V481	S385-T394 CarbonylContact C-O 3.59Å; S385-T394 WeakPolarHBondContact CA-O 3.46Å; S385-S477 PolarHBondContact OG-O 3.32Å; S385-V479 PolarHBondContact N-O 3.45Å; S385-V480 CarbonylContact O-C 3.56Å; S385-V480 WeakPolarHBondContact O-CA 3.35Å; S385-V480 VanDerWaalsContact OG-CG2 3.27Å; S385-V480 WeakPolarHBondContact OG-CG2 3.46Å; S385-V481 PolarHBondContact O-N 2.72Å
386	V	96.9	Very high	93.1	Very high	5 Å²	5	46.8 Å²	46.8	3%	0.03	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	122.8	173.8	178.4	0	0	0	0	108.1	F359 S393 T394 V436 F438 V481 H483	F359-V386 HydrophobicContact CE1-CG1 3.91Å; F359-V386 HydrophobicContact CE1-CG2 4.21Å; F359-V386 HydrophobicContact CE2-CG2 4.15Å; F359-V386 HydrophobicContact CZ-CG1 4.26Å; F359-V386 HydrophobicContact CZ-CG2 3.71Å; V386-S393 CarbonylContact O-C 3.53Å; V386-S393 WeakPolarHBondContact O-CA 3.45Å; V386-T394 HydrophobicContact CB-CG2 4.39Å; V386-T394 PolarHBondContact N-O 3.28Å; V386-T394 PolarHBondContact O-N 2.82Å; V386-V436 HydrophobicContact CB-CG2 4.17Å; V386-V436 HydrophobicContact CG2-CB 4.38Å; V386-V436 HydrophobicContact CG2-CG1 3.86Å; V386-V436 HydrophobicContact CG2-CG2 3.57Å; V386-F438 HydrophobicContact CG2-CB 3.81Å; V386-V481 CarbonylContact C-O 3.53Å; V386-V481 WeakPolarHBondContact CA-O 3.2Å; V386-V481 HydrophobicContact CB-CG1 4.42Å; V386-V481 HydrophobicContact CG2-CG1 3.82Å; V386-H483 HydrophobicContact CG1-CB 3.88Å
387	R	95.4	Very high	93.4	Very high	71 Å²	71	41.5 Å²	41.5	27%	0.268	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	116.1	-178.3	-174.2	172.5	74.9	137.3	24.9	111	F392 S393 V480 V481 D482 H483	R387-F392 CarbonylContact C-O 3.29Å; R387-F392 WeakPolarHBondContact CA-O 3.38Å; R387-S393 WeakPolarHBondContact CB-OG 3.33Å; R387-S393 WeakPolarHBondContact CG-OG 3.34Å; R387-V480 HydrophobicContact CB-CG1 3.56Å; R387-V481 PolarHBondContact N-O 2.87Å; R387-D482 IonicContact CZ-OD1 3.94Å; R387-D482 IonicContact CZ-OD2 3.92Å; R387-D482 IonicContact NE-OD1 2.95Å; R387-D482 PolarHBondContact NE-OD1 2.95Å; R387-D482 IonicContact NE-OD2 2.92Å; R387-D482 IonicContact NH2-OD1 3.46Å; R387-D482 PolarHBondContact NH2-OD1 2.92Å; R387-D482 IonicContact NH2-OD2 2.77Å; R387-D482 PolarHBondContact NH2-OD2 3.33Å; R387-D482 CarbonylContact O-C 3.56Å; R387-D482 WeakPolarHBondContact O-CA 2.95Å; R387-H483 PolarHBondContact O-N 3.48Å
388	E	89.3	Confident	93.6	Very high	46 Å²	46	41 Å²	41	22%	0.215	23%	0.226	C	C	.	.			trans	-70.7	160.4	173.2	-69.2	-74.9	-176.9	0	0	110.8	S390 G391 F392 H483 K486	E388-S390 PolarHBondContact O-N 2.77Å; E388-S390 VanDerWaalsContact O-N 3.1Å; E388-G391 PolarHBondContact O-N 2.71Å; E388-F392 PolarHBondContact N-O 2.95Å; E388-H483 IonicContact OE1-CD2 2.73Å; E388-H483 IonicContact OE2-CG 2.65Å; E388-K486 IonicContact OE1-NZ 3.08Å; E388-K486 PolarHBondContact OE1-NZ 3.4Å; E388-K486 IonicContact OE2-NZ 2.68Å
389	I	81.3	Confident	93.8	Very high	123 Å²	123	40.9 Å²	40.9	63%	0.631	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.5	-179.7	-156.3	163.4	0	0	0	113.3	G391	I389-G391 PolarHBondContact O-N 3.42Å
390	S	81.1	Confident	93.9	Very high	101 Å²	101	41 Å²	41	71%	0.706	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-8.1	172.3	59.8	0	0	0	0	113.6	E388 F392	E388-S390 PolarHBondContact O-N 2.77Å; E388-S390 VanDerWaalsContact O-N 3.1Å; S390-F392 VanDerWaalsContact C-N 3.31Å
391	G	84.3	Confident	93.8	Very high	43 Å²	43	42.8 Å²	42.8	44%	0.443	23%	0.234	S	C	.	.	S	Bend	trans	89.2	-11	-174.1	0	0	0	0	0	113.9	E388 I389 S393	E388-G391 PolarHBondContact O-N 2.71Å; I389-G391 PolarHBondContact O-N 3.42Å; G391-S393 PolarHBondContact O-N 3.22Å
392	F	88.8	Confident	93.7	Very high	136 Å²	136	45.5 Å²	45.5	60%	0.596	25%	0.251	S	S	*	.			trans	-65.9	129.1	175.7	-179.8	-100.6	0	0	0	110.8	R387 E388 S390	R387-F392 CarbonylContact C-O 3.29Å; R387-F392 WeakPolarHBondContact CA-O 3.38Å; E388-F392 PolarHBondContact N-O 2.95Å; S390-F392 VanDerWaalsContact C-N 3.31Å
393	S	92.6	Very high	93.5	Very high	55 Å²	55	48.7 Å²	48.7	39%	0.385	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	132.9	179	-57.6	0	0	0	0	110.7	V386 R387 G391	V386-S393 CarbonylContact O-C 3.53Å; V386-S393 WeakPolarHBondContact O-CA 3.45Å; R387-S393 WeakPolarHBondContact CB-OG 3.33Å; R387-S393 WeakPolarHBondContact CG-OG 3.34Å; G391-S393 PolarHBondContact O-N 3.22Å
394	T	94.4	Very high	93.3	Very high	46 Å²	46	54.2 Å²	54.2	28%	0.282	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	133.2	177.2	-176	0	0	0	0	111.1	S385 V386 Y396	S385-T394 CarbonylContact C-O 3.59Å; S385-T394 WeakPolarHBondContact CA-O 3.46Å; V386-T394 HydrophobicContact CB-CG2 4.39Å; V386-T394 PolarHBondContact N-O 3.28Å; V386-T394 PolarHBondContact O-N 2.82Å; T394-Y396 PolarHBondContact OG1-N 3.16Å
395	T	95.1	Very high	93.1	Very high	24 Å²	24	55.4 Å²	55.4	15%	0.147	31%	0.314	C	S	.	.			trans	-96.1	-14.7	169.7	50.8	0	0	0	0	112.1	R397 V436	T395-R397 PolarHBondContact O-N 2.82Å; T395-R397 WeakPolarHBondContact OG1-CD 3.42Å; T395-R397 WeakPolarHBondContact OG1-CG 3.05Å; T395-R397 PolarHBondContact OG1-NE 3.04Å; T395-V436 WeakPolarHBondContact O-CB 3.49Å; T395-V436 PolarHBondContact O-N 2.83Å
396	Y	95.1	Very high	92.8	Very high	87 Å²	87	58 Å²	58	34%	0.341	34%	0.335	S	S	.	.			trans	49.5	37.2	-174.3	-159.9	-99.3	0	0	0	113.6	T394 Q398 H460 L461	T394-Y396 PolarHBondContact OG1-N 3.16Å; Y396-Q398 HydrophobicContact CD1-CG 4.14Å; Y396-Q398 HydrophobicContact CE1-CG 4.03Å; Y396-Q398 PolarHBondContact O-N 3.29Å; Y396-H460 AromaticContact CD1-CE1 3.17Å; Y396-H460 WeakPolarHBondContact CD1-CE1 3.35Å; Y396-H460 AromaticContact CD1-ND1 3.49Å; Y396-H460 WeakPolarHBondContact CD1-ND1 3.5Å; Y396-H460 AromaticContact CE1-CE1 3.35Å; Y396-H460 WeakPolarHBondContact CE1-CE1 3.42Å; Y396-H460 AromaticContact CE1-ND1 3.1Å; Y396-H460 WeakPolarHBondContact CE1-ND1 3.25Å; Y396-H460 AromaticContact CG-CE1 3.85Å; Y396-H460 AromaticContact CZ-ND1 3.65Å; Y396-L461 HydrophobicContact CD1-CD2 4.43Å; Y396-L461 HydrophobicContact CE1-CD1 4.26Å; Y396-L461 HydrophobicContact CE1-CD2 3.81Å; Y396-L461 HydrophobicContact CE1-CG 4Å
397	R	96.9	Very high	92.5	Very high	44 Å²	44	64.2 Å²	64.2	17%	0.166	38%	0.376	C	S	.	.			trans	-61.3	125.3	178	-67	163.3	-174.6	173.5	-4.7	110.8	T395 G418 T432 G434 S475 S477	T395-R397 PolarHBondContact O-N 2.82Å; T395-R397 WeakPolarHBondContact OG1-CD 3.42Å; T395-R397 WeakPolarHBondContact OG1-CG 3.05Å; T395-R397 PolarHBondContact OG1-NE 3.04Å; R397-G418 CarbonylContact C-O 3.58Å; R397-G418 VanDerWaalsContact CB-O 3.3Å; R397-G418 WeakPolarHBondContact CB-O 3.37Å; R397-G418 PolarHBondContact O-N 3.46Å; R397-T432 HydrophobicContact CG-CG2 4.47Å; R397-G434 VanDerWaalsContact CA-O 3.3Å; R397-G434 WeakPolarHBondContact CA-O 3.23Å; R397-S475 PolarHBondContact NE-OG 3.29Å; R397-S475 VanDerWaalsContact NE-OG 3.1Å; R397-S477 PolarHBondContact NH2-OG 3.21Å; R397-S477 VanDerWaalsContact NH2-OG 3.11Å
398	Q	97	Very high	92.2	Very high	11 Å²	11	64.4 Å²	64.4	5%	0.051	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	146.8	178.2	-59.2	-55.6	-35.6	0	0	111.5	Y396 L400 K416 T432 D433 G434 L461	Y396-Q398 HydrophobicContact CD1-CG 4.14Å; Y396-Q398 HydrophobicContact CE1-CG 4.03Å; Y396-Q398 PolarHBondContact O-N 3.29Å; Q398-L400 HydrophobicContact CB-CD2 4.34Å; Q398-K416 CarbonylContact C-O 3.55Å; Q398-K416 PolarHBondContact OE1-O 2.47Å; Q398-T432 PolarHBondContact N-OG1 3.49Å; Q398-T432 PolarHBondContact O-OG1 2.71Å; Q398-D433 WeakPolarHBondContact O-CA 3.34Å; Q398-D433 WeakPolarHBondContact O-CB 3.3Å; Q398-D433 PolarHBondContact O-N 3.08Å; Q398-G434 PolarHBondContact N-O 2.85Å; Q398-G434 PolarHBondContact O-N 2.75Å; Q398-L461 HydrophobicContact CB-CD2 4.13Å; Q398-L461 HydrophobicContact CG-CD1 3.97Å; Q398-L461 HydrophobicContact CG-CD2 3.61Å; Q398-L461 HydrophobicContact CG-CG 4.42Å
399	L	97.4	Very high	92.3	Very high	38 Å²	38	66.6 Å²	66.6	20%	0.199	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	127.9	164.2	-61.1	178.1	0	0	0	107.7	Q415 K416 D433	L399-Q415 WeakPolarHBondContact O-CA 3.48Å; L399-K416 HydrophobicContact CB-CB 4.39Å; L399-K416 PolarHBondContact N-O 2.61Å; L399-K416 PolarHBondContact O-N 3.35Å; L399-D433 VanDerWaalsContact CA-OD2 3.29Å; L399-D433 WeakPolarHBondContact CA-OD2 3.17Å
400	L	96.8	Very high	92.9	Very high	12 Å²	12	61.3 Å²	61.3	6%	0.063	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.1	-178.4	-58.1	180	0	0	0	108.8	Q398 R414 Q415 D433 L461 F464 L468	Q398-L400 HydrophobicContact CB-CD2 4.34Å; L400-R414 WeakPolarHBondContact CA-O 3.06Å; L400-Q415 HydrophobicContact CD2-CB 4.17Å; L400-Q415 HydrophobicContact CD2-CG 3.8Å; L400-D433 HydrophobicContact CB-CB 3.92Å; L400-D433 HydrophobicContact CD1-CB 4.19Å; L400-D433 HydrophobicContact CG-CB 3.85Å; L400-D433 PolarHBondContact N-OD2 3.47Å; L400-L461 HydrophobicContact CD2-CD1 4.45Å; L400-F464 HydrophobicContact CD1-CB 3.91Å; L400-L468 HydrophobicContact CB-CD1 4.36Å
401	S	95.4	Very high	93.7	Very high	52 Å²	52	58.1 Å²	58.1	36%	0.364	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	145	169.8	65.5	0	0	0	0	111.1	L413 R414	S401-L413 CarbonylContact O-C 3.55Å; S401-L413 WeakPolarHBondContact O-CA 3.39Å; S401-L413 WeakPolarHBondContact O-CD1 3.47Å; S401-R414 PolarHBondContact N-O 3.47Å; S401-R414 PolarHBondContact O-N 3.15Å
402	V	96	Very high	94.3	Very high	58 Å²	58	57 Å²	57	35%	0.352	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	113.4	173.7	179.8	0	0	0	0	107.4	D411 C412 L413 L465 L468 L527	V402-D411 HydrophobicContact CG1-CB 3.63Å; V402-C412 WeakPolarHBondContact CA-O 3.01Å; V402-L413 HydrophobicContact CG2-CD1 4.18Å; V402-L465 HydrophobicContact CG2-CD1 3.97Å; V402-L468 HydrophobicContact CG2-CD2 4.01Å; V402-L527 HydrophobicContact CG1-CD2 4.14Å
403	E	95	Very high	94.6	Very high	68 Å²	68	50.7 Å²	50.7	32%	0.318	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	127.5	-179.3	-66.3	-177.7	171.7	0	0	110.1	G405 D411 C412 R414	E403-G405 PolarHBondContact O-N 2.76Å; E403-D411 WeakPolarHBondContact O-CA 3.47Å; E403-D411 WeakPolarHBondContact O-CB 3.4Å; E403-C412 PolarHBondContact N-O 3.08Å; E403-C412 PolarHBondContact O-N 3.27Å; E403-R414 WeakPolarHBondContact OE1-CD 3.25Å; E403-R414 IonicContact OE1-CZ 3.83Å; E403-R414 IonicContact OE1-NE 3.81Å; E403-R414 PolarHBondContact OE1-NE 2.7Å; E403-R414 IonicContact OE1-NH1 2.95Å; E403-R414 PolarHBondContact OE1-NH1 2.97Å; E403-R414 IonicContact OE1-NH2 3.71Å; E403-R414 PolarHBondContact OE1-NH2 2.83Å; E403-R414 IonicContact OE2-CZ 3.37Å; E403-R414 IonicContact OE2-NE 2.71Å; E403-R414 PolarHBondContact OE2-NE 3.02Å; E403-R414 IonicContact OE2-NH1 3.23Å; E403-R414 IonicContact OE2-NH2 3.4Å; E403-R414 PolarHBondContact OE2-NH2 3.49Å
404	P	95.1	Very high	94.8	Very high	116 Å²	116	53.5 Å²	53.5	75%	0.753	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-59.8	133.9	179.9	-24.8	34.1	0	0	0	112.8	D411	P404-D411 WeakPolarHBondContact CA-OD1 3.02Å
405	G	93.3	Very high	94.9	Very high	25 Å²	25	52.5 Å²	52.5	26%	0.258	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-78.4	171.8	170.1	0	0	0	0	0	113.4	E403 G410 D411	E403-G405 PolarHBondContact O-N 2.76Å; G405-G410 VanDerWaalsContact CA-O 3.31Å; G405-G410 WeakPolarHBondContact CA-O 3.38Å; G405-D411 PolarHBondContact N-OD1 3.01Å
406	A	91.9	Very high	94.9	Very high	56 Å²	56	56.7 Å²	56.7	46%	0.463	33%	0.331	S	S	.	.	S	Bend	trans	-60.3	155.2	169.5	0	0	0	0	0	111.2	G408 L409	A406-G408 PolarHBondContact O-N 3.28Å; A406-L409 HydrophobicContact CB-CD1 4.17Å; A406-L409 WeakPolarHBondContact O-CB 3.36Å; A406-L409 PolarHBondContact O-N 3.05Å
407	P	90.3	Very high	95	Very high	137 Å²	137	61.6 Å²	61.6	89%	0.89	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	130	179	-27.9	35.4	0	0	0	112.5	L409	P407-L409 VanDerWaalsContact C-N 3.26Å; P407-L409 PolarHBondContact O-N 3.01Å
408	G	88.6	Confident	95	Very high	75 Å²	75	60.5 Å²	60.5	77%	0.773	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	-14.5	-177	0	0	0	0	0	115.5	A406	A406-G408 PolarHBondContact O-N 3.28Å
409	L	91.8	Very high	95	Very high	92 Å²	92	64.2 Å²	64.2	48%	0.482	37%	0.368	S	S	.	.	S	Bend	trans	-99.2	155.5	173.5	-63.5	-175.3	0	0	0	111.9	A406 P407 R526	A406-L409 HydrophobicContact CB-CD1 4.17Å; A406-L409 WeakPolarHBondContact O-CB 3.36Å; A406-L409 PolarHBondContact O-N 3.05Å; P407-L409 VanDerWaalsContact C-N 3.26Å; P407-L409 PolarHBondContact O-N 3.01Å; L409-R526 PolarHBondContact O-NH1 3.47Å; L409-R526 PolarHBondContact O-NH2 2.97Å
410	G	94.1	Very high	95	Very high	12 Å²	12	67.3 Å²	67.3	12%	0.124	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-71.4	172.2	178.5	0	0	0	0	0	114.4	G405 R526 Q528	G405-G410 VanDerWaalsContact CA-O 3.31Å; G405-G410 WeakPolarHBondContact CA-O 3.38Å; G410-R526 CarbonylContact C-O 3.59Å; G410-R526 VanDerWaalsContact C-O 3.29Å; G410-R526 WeakPolarHBondContact CA-O 3.42Å; G410-Q528 WeakPolarHBondContact O-CG 3.49Å; G410-Q528 PolarHBondContact O-NE2 3.21Å
411	D	97.1	Very high	95	Very high	34 Å²	34	71.9 Å²	71.9	18%	0.182	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	169.1	179.9	-54.7	-37.8	0	0	0	111.4	V402 E403 P404 G405 R526 L527 Q528 C529	V402-D411 HydrophobicContact CG1-CB 3.63Å; E403-D411 WeakPolarHBondContact O-CA 3.47Å; E403-D411 WeakPolarHBondContact O-CB 3.4Å; P404-D411 WeakPolarHBondContact CA-OD1 3.02Å; G405-D411 PolarHBondContact N-OD1 3.01Å; D411-R526 PolarHBondContact N-O 2.81Å; D411-R526 IonicContact OD1-NH1 3.56Å; D411-R526 PolarHBondContact OD1-NH1 2.74Å; D411-R526 IonicContact OD2-NH1 3.29Å; D411-L527 HydrophobicContact CB-CD2 4.12Å; D411-L527 CarbonylContact O-C 3.52Å; D411-L527 VanDerWaalsContact O-CA 3.25Å; D411-L527 WeakPolarHBondContact O-CA 3.17Å; D411-L527 WeakPolarHBondContact O-CD2 3.44Å; D411-Q528 PolarHBondContact O-N 3.34Å; D411-C529 PolarHBondContact O-N 3.29Å
412	C	96.8	Very high	95.2	Very high	20 Å²	20	76.6 Å²	76.6	14%	0.135	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	122.5	-177	-84.7	0	0	0	0	111.5	V402 E403 C529	V402-C412 WeakPolarHBondContact CA-O 3.01Å; E403-C412 PolarHBondContact N-O 3.08Å; E403-C412 PolarHBondContact O-N 3.27Å; C412-C529 WeakPolarHBondContact CA-O 3.28Å; C412-C529 HydrophobicContact CB-CB 4.35Å; C412-C529 WeakPolarHBondContact CB-SG 3.5Å; C412-C529 WeakPolarHBondContact SG-CB 3.35Å; C412-C529 CovalentContact SG-SG 2.03Å; C412-C529 PolarHBondContact SG-SG 3.1Å
413	L	96.8	Very high	95.2	Very high	2 Å²	2	74.9 Å²	74.9	1%	0.01	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	121.7	176.3	174.6	59.6	0	0	0	110.1	S401 V402 Q415 L465 L527 C529 M530 T531	S401-L413 CarbonylContact O-C 3.55Å; S401-L413 WeakPolarHBondContact O-CA 3.39Å; S401-L413 WeakPolarHBondContact O-CD1 3.47Å; V402-L413 HydrophobicContact CG2-CD1 4.18Å; L413-Q415 HydrophobicContact CD1-CG 4.43Å; L413-Q415 HydrophobicContact CD2-CG 4.33Å; L413-Q415 VanDerWaalsContact CD2-NE2 3.35Å; L413-Q415 HydrophobicContact CG-CG 4.05Å; L413-L465 HydrophobicContact CD1-CD1 3.79Å; L413-L465 HydrophobicContact CD2-CD1 4.28Å; L413-L465 HydrophobicContact CD2-CD2 3.82Å; L413-L527 HydrophobicContact CB-CD1 3.97Å; L413-L527 HydrophobicContact CB-CD2 4.09Å; L413-L527 HydrophobicContact CD2-CD1 4.3Å; L413-C529 PolarHBondContact N-O 3.06Å; L413-M530 HydrophobicContact CB-CB 4.42Å; L413-M530 HydrophobicContact CB-CG 4.22Å; L413-M530 HydrophobicContact CD2-CG 4.07Å; L413-M530 HydrophobicContact CD2-SD 4.05Å; L413-M530 HydrophobicContact CG-CG 4.2Å; L413-M530 CarbonylContact O-C 3.56Å; L413-M530 WeakPolarHBondContact O-CA 3.49Å; L413-T531 PolarHBondContact O-N 3.39Å
414	R	96	Very high	95.2	Very high	115 Å²	115	78.2 Å²	78.2	43%	0.434	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	132.8	167.8	-58.6	-160.9	172.8	153.8	8.1	110.6	L400 S401 E403	L400-R414 WeakPolarHBondContact CA-O 3.06Å; S401-R414 PolarHBondContact N-O 3.47Å; S401-R414 PolarHBondContact O-N 3.15Å; E403-R414 WeakPolarHBondContact OE1-CD 3.25Å; E403-R414 IonicContact OE1-CZ 3.83Å; E403-R414 IonicContact OE1-NE 3.81Å; E403-R414 PolarHBondContact OE1-NE 2.7Å; E403-R414 IonicContact OE1-NH1 2.95Å; E403-R414 PolarHBondContact OE1-NH1 2.97Å; E403-R414 IonicContact OE1-NH2 3.71Å; E403-R414 PolarHBondContact OE1-NH2 2.83Å; E403-R414 IonicContact OE2-CZ 3.37Å; E403-R414 IonicContact OE2-NE 2.71Å; E403-R414 PolarHBondContact OE2-NE 3.02Å; E403-R414 IonicContact OE2-NH1 3.23Å; E403-R414 IonicContact OE2-NH2 3.4Å; E403-R414 PolarHBondContact OE2-NH2 3.49Å
415	Q	95.5	Very high	95.2	Very high	24 Å²	24	75.4 Å²	75.4	11%	0.112	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	127.9	176.3	-51	-177.9	-1.8	0	0	108.3	L399 L400 L413 M530 T531 A532 E533	L399-Q415 WeakPolarHBondContact O-CA 3.48Å; L400-Q415 HydrophobicContact CD2-CB 4.17Å; L400-Q415 HydrophobicContact CD2-CG 3.8Å; L413-Q415 HydrophobicContact CD1-CG 4.43Å; L413-Q415 HydrophobicContact CD2-CG 4.33Å; L413-Q415 VanDerWaalsContact CD2-NE2 3.35Å; L413-Q415 HydrophobicContact CG-CG 4.05Å; Q415-M530 PolarHBondContact NE2-SD 2.73Å; Q415-M530 VanDerWaalsContact NE2-SD 3.38Å; Q415-T531 WeakPolarHBondContact CB-O 3.37Å; Q415-T531 PolarHBondContact N-O 3.43Å; Q415-A532 HydrophobicContact CB-CB 4.32Å; Q415-A532 CarbonylContact O-C 3.44Å; Q415-A532 WeakPolarHBondContact O-CA 3.25Å; Q415-E533 PolarHBondContact O-N 2.94Å
416	K	96.3	Very high	95.3	Very high	112 Å²	112	74.8 Å²	74.8	49%	0.487	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	137.2	178	178.9	175.6	179.6	175.1	0	110.5	Q398 L399 G418 E533	Q398-K416 CarbonylContact C-O 3.55Å; Q398-K416 PolarHBondContact OE1-O 2.47Å; L399-K416 HydrophobicContact CB-CB 4.39Å; L399-K416 PolarHBondContact N-O 2.61Å; L399-K416 PolarHBondContact O-N 3.35Å; K416-G418 PolarHBondContact O-N 2.9Å; K416-E533 HydrophobicContact CG-CB 4.5Å
417	R	96.6	Very high	95.5	Very high	190 Å²	190	76.8 Å²	76.8	72%	0.717	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.2	125.9	171.3	-65.2	-179.3	-178.1	-174.8	2.1	110.8	E533	R417-E533 PolarHBondContact N-O 2.92Å
418	G	96.8	Very high	95.8	Very high	21 Å²	21	74.6 Å²	74.6	22%	0.216	40%	0.403	C	S	.	.			trans	158.5	-170.5	179	0	0	0	0	0	114.7	R397 K416 T432	R397-G418 CarbonylContact C-O 3.58Å; R397-G418 VanDerWaalsContact CB-O 3.3Å; R397-G418 WeakPolarHBondContact CB-O 3.37Å; R397-G418 PolarHBondContact O-N 3.46Å; K416-G418 PolarHBondContact O-N 2.9Å; G418-T432 PolarHBondContact O-OG1 3.23Å
419	F	97.8	Very high	96.3	Very high	89 Å²	89	71.1 Å²	71.1	39%	0.39	37%	0.367	S	S	.	.			trans	-144.3	158.4	177.6	64.2	-92.6	0	0	0	109.3	V430 V431	F419-V430 HydrophobicContact CB-CB 3.8Å; F419-V430 HydrophobicContact CB-CG1 4.48Å; F419-V430 HydrophobicContact CB-CG2 3.5Å; F419-V430 HydrophobicContact CD1-CB 4.49Å; F419-V430 HydrophobicContact CD1-CG1 4.29Å; F419-V430 HydrophobicContact CD1-CG2 4.27Å; F419-V430 HydrophobicContact CD2-CB 3.65Å; F419-V430 HydrophobicContact CD2-CG1 3.63Å; F419-V430 HydrophobicContact CD2-CG2 4.23Å; F419-V430 HydrophobicContact CE1-CG1 4.44Å; F419-V430 HydrophobicContact CE2-CB 4.35Å; F419-V430 HydrophobicContact CE2-CG1 3.82Å; F419-V430 HydrophobicContact CG-CB 3.73Å; F419-V430 HydrophobicContact CG-CG1 3.88Å; F419-V430 HydrophobicContact CG-CG2 3.76Å; F419-V430 HydrophobicContact CZ-CG1 4.23Å; F419-V431 CarbonylContact C-O 3.58Å; F419-V431 WeakPolarHBondContact CA-O 3.34Å; F419-V431 WeakPolarHBondContact CB-O 3.48Å
420	H	97.3	Very high	96.6	Very high	103 Å²	103	67.1 Å²	67.1	48%	0.477	35%	0.346	S	S	.	.	S	Bend	trans	-78.1	-54.8	-176.1	-68	-72	0	0	0	111.5	V431 D433	H420-V431 PolarHBondContact N-O 2.86Å; H420-D433 IonicContact CD2-OD1 3.47Å; H420-D433 IonicContact CE1-OD2 2.73Å; H420-D433 IonicContact NE2-OD1 3.4Å; H420-D433 PolarHBondContact NE2-OD1 2.95Å; H420-D433 IonicContact NE2-OD2 3.32Å; H420-D433 PolarHBondContact NE2-OD2 3.13Å
421	H	97.5	Very high	96.8	Very high	108 Å²	108	67.9 Å²	67.9	50%	0.5	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	168.8	178	59.6	81.3	0	0	0	111.2	V430 V431	H421-V430 CarbonylContact O-C 3.59Å; H421-V430 WeakPolarHBondContact O-CA 3.4Å; H421-V430 WeakPolarHBondContact O-CB 3.37Å; H421-V431 WeakPolarHBondContact CE1-CG2 3.33Å; H421-V431 PolarHBondContact O-N 3.08Å
422	E	97.9	Very high	96.9	Very high	152 Å²	152	66.3 Å²	66.3	71%	0.71	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	149.3	173.1	-62.4	-173.2	160	0	0	111.8	V430	E422-V430 HydrophobicContact CG-CG1 4.49Å
423	L	96.8	Very high	96.9	Very high	21 Å²	21	66.8 Å²	66.8	11%	0.11	34%	0.341	C	S	.	.			trans	-88.4	113.2	178.6	-171.4	64	0	0	0	110.1	V373 T377 L379 G425 F426 C429 V431	V373-L423 HydrophobicContact CG1-CD2 3.8Å; T377-L423 HydrophobicContact CG2-CD1 4.21Å; T377-L423 HydrophobicContact CG2-CD2 4.15Å; T377-L423 HydrophobicContact CG2-CG 4.35Å; L379-L423 HydrophobicContact CD1-CD1 4.16Å; L379-L423 HydrophobicContact CD1-CD2 3.73Å; L423-G425 PolarHBondContact O-N 3.48Å; L423-F426 HydrophobicContact CB-CB 4.35Å; L423-F426 HydrophobicContact CD2-CB 3.98Å; L423-F426 HydrophobicContact CD2-CD2 4.04Å; L423-F426 HydrophobicContact CD2-CG 4.21Å; L423-F426 HydrophobicContact CG-CB 4.2Å; L423-F426 HydrophobicContact CG-CD2 4.22Å; L423-F426 PolarHBondContact O-N 3.2Å; L423-C429 HydrophobicContact CB-CB 4.03Å; L423-C429 WeakPolarHBondContact CB-O 3.47Å; L423-C429 HydrophobicContact CD2-CB 4.01Å; L423-C429 PolarHBondContact N-O 3.04Å; L423-V431 HydrophobicContact CD1-CG2 4.14Å
424	V	94.4	Very high	96.9	Very high	138 Å²	138	66.7 Å²	66.7	84%	0.836	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	130.6	-178.3	-178.8	0	0	0	0	110.6	F426	V424-F426 VanDerWaalsContact C-N 3.28Å; V424-F426 PolarHBondContact O-N 3.32Å
425	G	95	Very high	97	Very high	57 Å²	57	61.2 Å²	61.2	59%	0.588	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-3.8	-179.6	0	0	0	0	0	115.4	L423	L423-G425 PolarHBondContact O-N 3.48Å
426	F	96.6	Very high	97.1	Very high	13 Å²	13	60.8 Å²	60.8	6%	0.057	32%	0.319	C	S	.	.			trans	-130	90.5	-178.9	-71.5	-82.6	0	0	0	111.5	D372 V373 R376 T377 L423 V424 C429	D372-F426 HydrophobicContact CB-CE1 4.23Å; D372-F426 WeakPolarHBondContact O-CZ 3.27Å; D372-F426 WeakPolarHBondContact OD2-CE1 3.35Å; V373-F426 HydrophobicContact CB-CD1 4.45Å; V373-F426 HydrophobicContact CB-CE1 4.29Å; V373-F426 HydrophobicContact CG2-CB 4.44Å; V373-F426 HydrophobicContact CG2-CD1 3.35Å; V373-F426 HydrophobicContact CG2-CD2 4.43Å; V373-F426 HydrophobicContact CG2-CE1 3.56Å; V373-F426 HydrophobicContact CG2-CG 3.83Å; V373-F426 HydrophobicContact CG2-CZ 4.2Å; R376-F426 HydrophobicContact CB-CE2 4.16Å; R376-F426 HydrophobicContact CB-CZ 3.97Å; T377-F426 HydrophobicContact CG2-CD2 3.85Å; T377-F426 HydrophobicContact CG2-CE2 3.5Å; T377-F426 HydrophobicContact CG2-CZ 4.47Å; L423-F426 HydrophobicContact CB-CB 4.35Å; L423-F426 HydrophobicContact CD2-CB 3.98Å; L423-F426 HydrophobicContact CD2-CD2 4.04Å; L423-F426 HydrophobicContact CD2-CG 4.21Å; L423-F426 HydrophobicContact CG-CB 4.2Å; L423-F426 HydrophobicContact CG-CD2 4.22Å; L423-F426 PolarHBondContact O-N 3.2Å; V424-F426 VanDerWaalsContact C-N 3.28Å; V424-F426 PolarHBondContact O-N 3.32Å; F426-C429 HydrophobicContact CB-CB 3.87Å; F426-C429 WeakPolarHBondContact O-CB 3.38Å; F426-C429 PolarHBondContact O-N 3.1Å
427	P	95.5	Very high	97	Very high	97 Å²	97	56.5 Å²	56.5	63%	0.63	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	147.2	178.4	26.8	-34.2	0	0	0	110.9	K369 C429	K369-P427 PolarHBondContact NZ-O 3.44Å; P427-C429 PolarHBondContact O-N 2.98Å
428	N	97.1	Very high	97.1	Very high	92 Å²	92	47.4 Å²	47.4	49%	0.492	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	6	-174.8	-49.8	-51.2	0	0	0	115.2	C476 S477 D478	N428-C476 WeakPolarHBondContact O-CA 3.4Å; N428-S477 PolarHBondContact O-N 2.83Å; N428-S477 PolarHBondContact O-OG 3.45Å; N428-D478 HydrophobicContact CB-CB 4.16Å; N428-D478 PolarHBondContact ND2-OD2 3.28Å
429	C	98.4	Very high	97.2	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.014	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	140.9	176.6	-54.3	0	0	0	0	110.8	L423 F426 P427 S475 C476	L423-C429 HydrophobicContact CB-CB 4.03Å; L423-C429 WeakPolarHBondContact CB-O 3.47Å; L423-C429 HydrophobicContact CD2-CB 4.01Å; L423-C429 PolarHBondContact N-O 3.04Å; F426-C429 HydrophobicContact CB-CB 3.87Å; F426-C429 WeakPolarHBondContact O-CB 3.38Å; F426-C429 PolarHBondContact O-N 3.1Å; P427-C429 PolarHBondContact O-N 2.98Å; C429-S475 CarbonylContact C-O 3.52Å; C429-S475 VanDerWaalsContact CA-O 3.24Å; C429-S475 WeakPolarHBondContact CA-O 3.34Å; C429-C476 HydrophobicContact CB-CB 4.18Å; C429-C476 WeakPolarHBondContact CB-SG 3.35Å; C429-C476 WeakPolarHBondContact SG-CB 3.26Å; C429-C476 CovalentContact SG-SG 2.05Å; C429-C476 PolarHBondContact SG-SG 3.1Å
430	V	98.6	Very high	97.2	Very high	8 Å²	8	42.3 Å²	42.3	5%	0.048	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	157.8	-177.3	-60.3	0	0	0	0	110.7	F419 H421 E422 G474 S475	F419-V430 HydrophobicContact CB-CB 3.8Å; F419-V430 HydrophobicContact CB-CG1 4.48Å; F419-V430 HydrophobicContact CB-CG2 3.5Å; F419-V430 HydrophobicContact CD1-CB 4.49Å; F419-V430 HydrophobicContact CD1-CG1 4.29Å; F419-V430 HydrophobicContact CD1-CG2 4.27Å; F419-V430 HydrophobicContact CD2-CB 3.65Å; F419-V430 HydrophobicContact CD2-CG1 3.63Å; F419-V430 HydrophobicContact CD2-CG2 4.23Å; F419-V430 HydrophobicContact CE1-CG1 4.44Å; F419-V430 HydrophobicContact CE2-CB 4.35Å; F419-V430 HydrophobicContact CE2-CG1 3.82Å; F419-V430 HydrophobicContact CG-CB 3.73Å; F419-V430 HydrophobicContact CG-CG1 3.88Å; F419-V430 HydrophobicContact CG-CG2 3.76Å; F419-V430 HydrophobicContact CZ-CG1 4.23Å; H421-V430 CarbonylContact O-C 3.59Å; H421-V430 WeakPolarHBondContact O-CA 3.4Å; H421-V430 WeakPolarHBondContact O-CB 3.37Å; E422-V430 HydrophobicContact CG-CG1 4.49Å; V430-G474 CarbonylContact O-C 3.56Å; V430-G474 WeakPolarHBondContact O-CA 3.41Å; V430-S475 PolarHBondContact N-O 2.88Å; V430-S475 PolarHBondContact O-N 2.65Å
431	V	98.3	Very high	97.3	Very high	27 Å²	27	37.4 Å²	37.4	16%	0.164	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	132.5	170.3	-179.5	0	0	0	0	109.5	L379 F419 H420 H421 L423	L379-V431 HydrophobicContact CD2-CG2 4.47Å; F419-V431 CarbonylContact C-O 3.58Å; F419-V431 WeakPolarHBondContact CA-O 3.34Å; F419-V431 WeakPolarHBondContact CB-O 3.48Å; H420-V431 PolarHBondContact N-O 2.86Å; H421-V431 WeakPolarHBondContact CE1-CG2 3.33Å; H421-V431 PolarHBondContact O-N 3.08Å; L423-V431 HydrophobicContact CD1-CG2 4.14Å
432	T	98.1	Very high	97.2	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	173.1	-174.8	-171.4	0	0	0	0	108.9	R397 Q398 G418 G434 V435 V473	R397-T432 HydrophobicContact CG-CG2 4.47Å; Q398-T432 PolarHBondContact N-OG1 3.49Å; Q398-T432 PolarHBondContact O-OG1 2.71Å; G418-T432 PolarHBondContact O-OG1 3.23Å; T432-G434 PolarHBondContact OG1-O 2.95Å; T432-V435 HydrophobicContact CG2-CG1 3.65Å; T432-V473 HydrophobicContact CG2-CG1 3.99Å; T432-V473 PolarHBondContact N-O 2.76Å; T432-V473 CarbonylContact O-C 3.6Å; T432-V473 VanDerWaalsContact O-CB 3.23Å; T432-V473 WeakPolarHBondContact O-CB 3.49Å
433	D	97.9	Very high	97.2	Very high	30 Å²	30	25.4 Å²	25.4	16%	0.16	16%	0.16	C	C	.	.	S	Bend	trans	-103.3	-20	-179.6	-57	-42.4	0	0	0	112.6	Q398 L399 L400 H420 F464	Q398-D433 WeakPolarHBondContact O-CA 3.34Å; Q398-D433 WeakPolarHBondContact O-CB 3.3Å; Q398-D433 PolarHBondContact O-N 3.08Å; L399-D433 VanDerWaalsContact CA-OD2 3.29Å; L399-D433 WeakPolarHBondContact CA-OD2 3.17Å; L400-D433 HydrophobicContact CB-CB 3.92Å; L400-D433 HydrophobicContact CD1-CB 4.19Å; L400-D433 HydrophobicContact CG-CB 3.85Å; L400-D433 PolarHBondContact N-OD2 3.47Å; H420-D433 IonicContact CD2-OD1 3.47Å; H420-D433 IonicContact CE1-OD2 2.73Å; H420-D433 IonicContact NE2-OD1 3.4Å; H420-D433 PolarHBondContact NE2-OD1 2.95Å; H420-D433 IonicContact NE2-OD2 3.32Å; H420-D433 PolarHBondContact NE2-OD2 3.13Å; D433-F464 VanDerWaalsContact O-CB 3.3Å; D433-F464 WeakPolarHBondContact O-CB 3.3Å; D433-F464 VanDerWaalsContact O-CD1 3.22Å; D433-F464 WeakPolarHBondContact O-CD1 3.49Å; D433-F464 WeakPolarHBondContact O-CG 3.19Å
434	G	97.4	Very high	97.1	Very high	0 Å²	0	25 Å²	25	0%	0	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-147.5	149.2	178.2	0	0	0	0	0	112.2	R397 Q398 T432	R397-G434 VanDerWaalsContact CA-O 3.3Å; R397-G434 WeakPolarHBondContact CA-O 3.23Å; Q398-G434 PolarHBondContact N-O 2.85Å; Q398-G434 PolarHBondContact O-N 2.75Å; T432-G434 PolarHBondContact OG1-O 2.95Å
435	V	98	Very high	97.2	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	13%	0.127	C	C	.	.			trans	-135.5	167.6	-179.6	-63.7	0	0	0	0	111.4	L381 T432 F439 H460 F464 V473 G474	L381-V435 HydrophobicContact CD2-CG2 3.58Å; T432-V435 HydrophobicContact CG2-CG1 3.65Å; V435-F439 HydrophobicContact CG2-CB 3.92Å; V435-F439 HydrophobicContact CG2-CD1 4.29Å; V435-F439 HydrophobicContact CG2-CG 4.39Å; V435-H460 PolarHBondContact O-CE1 3.31Å; V435-H460 PolarHBondContact O-NE2 2.82Å; V435-F464 HydrophobicContact CG2-CE1 4.08Å; V435-F464 HydrophobicContact CG2-CE2 4.48Å; V435-F464 HydrophobicContact CG2-CZ 3.57Å; V435-V473 HydrophobicContact CG1-CG1 3.93Å; V435-G474 WeakPolarHBondContact CG1-O 3.36Å
436	V	96.3	Very high	97.3	Very high	16 Å²	16	17.9 Å²	17.9	10%	0.097	10%	0.1	C	C	.	.			trans	-63	160.6	174.1	67.5	0	0	0	0	111.3	G384 V386 T395 F438	G384-V436 WeakPolarHBondContact O-CG1 3.33Å; V386-V436 HydrophobicContact CB-CG2 4.17Å; V386-V436 HydrophobicContact CG2-CB 4.38Å; V386-V436 HydrophobicContact CG2-CG1 3.86Å; V386-V436 HydrophobicContact CG2-CG2 3.57Å; T395-V436 WeakPolarHBondContact O-CB 3.49Å; T395-V436 PolarHBondContact O-N 2.83Å; V436-F438 HydrophobicContact CG1-CB 4.25Å; V436-F438 PolarHBondContact O-N 3.1Å
437	N	94.9	Very high	97.3	Very high	21 Å²	21	21.9 Å²	21.9	11%	0.112	11%	0.114	C	C	.	.	S	Bend	trans	-63.8	30.2	176.9	-70.9	-32.6	0	0	0	115.3	R340 D356 F359 H460	R340-N437 PolarHBondContact NH2-ND2 2.87Å; R340-N437 PolarHBondContact NH2-OD1 3.19Å; D356-N437 WeakPolarHBondContact OD2-CB 3.27Å; D356-N437 PolarHBondContact OD2-ND2 3.45Å; F359-N437 VanDerWaalsContact CE2-O 3.27Å; F359-N437 WeakPolarHBondContact CE2-O 3.5Å; N437-H460 PolarHBondContact OD1-CD2 3.35Å; N437-H460 PolarHBondContact OD1-NE2 2.87Å; N437-H460 VanDerWaalsContact OD1-NE2 3.16Å
438	F	98.1	Very high	97.3	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.112	C	C	.	.			trans	-129.9	94.1	169.4	174.9	-126.2	0	0	0	107.6	L353 V355 F359 T365 G383 G384 V386 V436 V479 V481	L353-F438 HydrophobicContact CD1-CD2 4.34Å; L353-F438 HydrophobicContact CD1-CE2 3.9Å; L353-F438 HydrophobicContact CD2-CE2 4.23Å; L353-F438 HydrophobicContact CG-CE2 4.43Å; V355-F438 HydrophobicContact CG1-CD2 4.09Å; V355-F438 HydrophobicContact CG1-CE2 4.39Å; F359-F438 HydrophobicContact CE2-CB 3.85Å; T365-F438 HydrophobicContact CG2-CE2 4.1Å; T365-F438 HydrophobicContact CG2-CZ 3.66Å; G383-F438 CarbonylContact C-O 3.47Å; G383-F438 WeakPolarHBondContact CA-O 3.46Å; G384-F438 PolarHBondContact N-O 3.15Å; V386-F438 HydrophobicContact CG2-CB 3.81Å; V436-F438 HydrophobicContact CG1-CB 4.25Å; V436-F438 PolarHBondContact O-N 3.1Å; F438-V479 HydrophobicContact CE1-CG1 4.06Å; F438-V479 HydrophobicContact CZ-CG1 4.2Å; F438-V481 HydrophobicContact CB-CG1 3.89Å; F438-V481 HydrophobicContact CD1-CB 4.04Å; F438-V481 HydrophobicContact CD1-CG1 3.59Å; F438-V481 HydrophobicContact CD2-CB 4.17Å; F438-V481 HydrophobicContact CD2-CG1 3.83Å; F438-V481 HydrophobicContact CE1-CB 3.97Å; F438-V481 HydrophobicContact CE1-CG1 4.06Å; F438-V481 HydrophobicContact CE2-CB 4.09Å; F438-V481 HydrophobicContact CE2-CG1 4.27Å; F438-V481 HydrophobicContact CG-CB 4.15Å; F438-V481 HydrophobicContact CG-CG1 3.48Å; F438-V481 VanDerWaalsContact CG-CG1 3.48Å; F438-V481 HydrophobicContact CZ-CB 4.02Å; F438-V481 HydrophobicContact CZ-CG1 4.4Å
439	F	98.6	Very high	97.3	Very high	2 Å²	2	20 Å²	20	1%	0.009	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	145.4	-177.3	63.8	-100.3	0	0	0	112.4	L353 W354 L381 V382 V435 A441 F451	L353-F439 CarbonylContact C-O 3.56Å; L353-F439 WeakPolarHBondContact CA-O 3.43Å; W354-F439 HydrophobicContact CB-CD1 4.27Å; W354-F439 HydrophobicContact CB-CD2 4.23Å; W354-F439 HydrophobicContact CB-CE1 3.84Å; W354-F439 HydrophobicContact CB-CE2 3.79Å; W354-F439 HydrophobicContact CB-CG 4.46Å; W354-F439 HydrophobicContact CB-CZ 3.58Å; W354-F439 HydrophobicContact CG-CE1 4.11Å; W354-F439 HydrophobicContact CG-CZ 4.03Å; W354-F439 PolarHBondContact N-O 2.8Å; W354-F439 PolarHBondContact O-N 2.81Å; L381-F439 HydrophobicContact CD1-CD2 3.46Å; L381-F439 VanDerWaalsContact CD1-CD2 3.46Å; L381-F439 HydrophobicContact CD1-CE2 3.66Å; L381-F439 HydrophobicContact CD1-CG 4.03Å; L381-F439 HydrophobicContact CD1-CZ 4.35Å; L381-F439 HydrophobicContact CD2-CB 3.82Å; L381-F439 HydrophobicContact CD2-CD2 4.18Å; L381-F439 HydrophobicContact CD2-CG 4.05Å; L381-F439 HydrophobicContact CG-CB 4.19Å; L381-F439 HydrophobicContact CG-CD2 3.72Å; L381-F439 HydrophobicContact CG-CE2 4.4Å; L381-F439 HydrophobicContact CG-CG 4.12Å; V382-F439 CarbonylContact O-C 3.57Å; V382-F439 WeakPolarHBondContact O-CA 3.46Å; V435-F439 HydrophobicContact CG2-CB 3.92Å; V435-F439 HydrophobicContact CG2-CD1 4.29Å; V435-F439 HydrophobicContact CG2-CG 4.39Å; F439-A441 HydrophobicContact CD2-CB 4.04Å; F439-A441 HydrophobicContact CE2-CB 4.19Å; F439-F451 HydrophobicContact CZ-CZ 4.41Å
440	L	98.8	Very high	97.2	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	136.1	168	-172.2	75.8	0	0	0	108.2	V279 Y351 V352 L353 L370 V371 L374 L381 V382	V279-L440 HydrophobicContact CB-CD1 4.46Å; V279-L440 HydrophobicContact CG1-CD1 3.62Å; V279-L440 HydrophobicContact CG2-CD1 4Å; Y351-L440 HydrophobicContact CG-CD2 4.39Å; Y351-L440 HydrophobicContact CG-CG 4.46Å; V352-L440 WeakPolarHBondContact O-CA 3.47Å; L353-L440 HydrophobicContact CB-CD1 3.89Å; L353-L440 HydrophobicContact CD1-CB 4.06Å; L353-L440 HydrophobicContact CD1-CD1 4.21Å; L370-L440 HydrophobicContact CB-CB 3.94Å; L370-L440 HydrophobicContact CB-CD2 3.63Å; L370-L440 HydrophobicContact CB-CG 4.42Å; L370-L440 HydrophobicContact CD1-CB 3.97Å; V371-L440 HydrophobicContact CB-CD2 4.42Å; V371-L440 HydrophobicContact CG2-CD2 3.67Å; L374-L440 HydrophobicContact CD1-CB 4.38Å; L374-L440 HydrophobicContact CD1-CD2 3.85Å; L374-L440 HydrophobicContact CD1-CG 3.94Å; L381-L440 CarbonylContact C-O 3.57Å; L381-L440 WeakPolarHBondContact CA-O 3.44Å; V382-L440 HydrophobicContact CG1-CB 4.22Å; V382-L440 PolarHBondContact N-O 2.83Å; V382-L440 PolarHBondContact O-N 2.88Å
441	A	98.5	Very high	97.1	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.008	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	154.5	180	0	0	0	0	0	111.9	Y351 V352 D380 L381 F439 T443 V446	Y351-A441 CarbonylContact C-O 3.57Å; Y351-A441 VanDerWaalsContact CA-O 3.23Å; Y351-A441 WeakPolarHBondContact CA-O 3.38Å; V352-A441 PolarHBondContact N-O 2.94Å; V352-A441 PolarHBondContact O-N 3.26Å; D380-A441 CarbonylContact O-C 2.92Å; D380-A441 WeakPolarHBondContact O-CA 3.32Å; L381-A441 HydrophobicContact CB-CB 3.92Å; L381-A441 HydrophobicContact CD1-CB 3.83Å; L381-A441 HydrophobicContact CG-CB 3.79Å; F439-A441 HydrophobicContact CD2-CB 4.04Å; F439-A441 HydrophobicContact CE2-CB 4.19Å; A441-T443 PolarHBondContact O-N 3.33Å; A441-V446 HydrophobicContact CB-CG2 3.31Å
442	R	96.9	Very high	97	Very high	7 Å²	7	20 Å²	20	3%	0.026	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	124	168.8	-63.6	-179.3	110	-103.8	-2.6	108.8	Y351 D380 D444 K445 V446	Y351-R442 HydrophobicContact CD1-CG 4.06Å; Y351-R442 HydrophobicContact CE1-CG 3.64Å; D380-R442 PolarHBondContact O-N 2.9Å; R442-D444 VanDerWaalsContact C-N 3.27Å; R442-D444 VanDerWaalsContact CB-OD1 3.28Å; R442-D444 WeakPolarHBondContact CB-OD1 3.44Å; R442-D444 IonicContact NH1-OD1 3.78Å; R442-D444 PolarHBondContact NH1-OD1 3.01Å; R442-D444 IonicContact NH1-OD2 2.76Å; R442-D444 PolarHBondContact NH1-OD2 2.94Å; R442-D444 PolarHBondContact O-N 3.2Å; R442-K445 HydrophobicContact CB-CB 4.13Å; R442-K445 HydrophobicContact CB-CG 4.06Å; R442-K445 PolarHBondContact O-N 2.8Å; R442-K445 VanDerWaalsContact O-N 3.13Å; R442-V446 PolarHBondContact O-N 3.02Å; R442-V446 VanDerWaalsContact O-N 3.15Å
443	T	97.2	Very high	96.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60.5	-39	-172.5	-59.8	0	0	0	0	111.7	V347 T349 K350 Y351 V352 A441 R447	V347-T443 HydrophobicContact CB-CG2 3.95Å; V347-T443 HydrophobicContact CG1-CG2 3.79Å; T349-T443 WeakPolarHBondContact O-CB 3.29Å; T349-T443 PolarHBondContact O-OG1 3.21Å; K350-T443 PolarHBondContact O-N 3.21Å; K350-T443 PolarHBondContact O-OG1 2.8Å; Y351-T443 VanDerWaalsContact C-OG1 3.27Å; V352-T443 PolarHBondContact N-OG1 2.99Å; A441-T443 PolarHBondContact O-N 3.33Å; T443-R447 WeakPolarHBondContact O-CD 3.34Å; T443-R447 VanDerWaalsContact O-CG 3.27Å; T443-R447 WeakPolarHBondContact O-CG 3.43Å; T443-R447 PolarHBondContact O-N 3.3Å
444	D	94.9	Very high	96.7	Very high	14 Å²	14	29.1 Å²	29.1	8%	0.075	14%	0.14	C	C	.	.	H	α-helix	trans	-63.4	-40	177.1	61.2	-24.3	0	0	0	112.9	R260 R442 R447 E448	R260-D444 VanDerWaalsContact CD-CB 3.49Å; R442-D444 VanDerWaalsContact C-N 3.27Å; R442-D444 VanDerWaalsContact CB-OD1 3.28Å; R442-D444 WeakPolarHBondContact CB-OD1 3.44Å; R442-D444 IonicContact NH1-OD1 3.78Å; R442-D444 PolarHBondContact NH1-OD1 3.01Å; R442-D444 IonicContact NH1-OD2 2.76Å; R442-D444 PolarHBondContact NH1-OD2 2.94Å; R442-D444 PolarHBondContact O-N 3.2Å; D444-R447 PolarHBondContact O-N 3.16Å; D444-E448 WeakPolarHBondContact O-CB 3.5Å; D444-E448 PolarHBondContact O-N 3.4Å
445	K	95.6	Very high	96.5	Very high	43 Å²	43	29.5 Å²	29.5	19%	0.187	14%	0.142	C	C	.	.	H	α-helix	trans	-69.7	-40.4	179.6	-70.6	-58.7	-165	178.7	0	113.8	D380 R442 R447 E448 V449 L471	D380-K445 HydrophobicContact CB-CB 4.19Å; D380-K445 HydrophobicContact CB-CG 3.99Å; R442-K445 HydrophobicContact CB-CB 4.13Å; R442-K445 HydrophobicContact CB-CG 4.06Å; R442-K445 PolarHBondContact O-N 2.8Å; R442-K445 VanDerWaalsContact O-N 3.13Å; K445-R447 VanDerWaalsContact C-N 3.26Å; K445-R447 PolarHBondContact O-N 2.74Å; K445-E448 VanDerWaalsContact CD-OE2 3.28Å; K445-E448 WeakPolarHBondContact CD-OE2 3.43Å; K445-E448 IonicContact NZ-OE1 3.16Å; K445-E448 IonicContact NZ-OE2 2.71Å; K445-E448 PolarHBondContact NZ-OE2 2.76Å; K445-E448 PolarHBondContact O-N 2.81Å; K445-V449 PolarHBondContact O-N 3.25Å; K445-V449 VanDerWaalsContact O-N 3.12Å; K445-L471 HydrophobicContact CB-CD2 3.78Å
446	V	97.4	Very high	96	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.012	16%	0.157	C	C	.	.	H	α-helix	trans	-63.5	-36.6	173.3	-178.1	0	0	0	0	111	V344 V352 A441 R442 G450 F451 F463	V344-V446 HydrophobicContact CG1-CB 4.28Å; V344-V446 HydrophobicContact CG1-CG1 3.95Å; V344-V446 HydrophobicContact CG2-CG1 4.15Å; V352-V446 HydrophobicContact CG1-CB 4.49Å; V352-V446 HydrophobicContact CG1-CG2 4.07Å; A441-V446 HydrophobicContact CB-CG2 3.31Å; R442-V446 PolarHBondContact O-N 3.02Å; R442-V446 VanDerWaalsContact O-N 3.15Å; V446-G450 WeakPolarHBondContact O-CA 3.37Å; V446-G450 PolarHBondContact O-N 3.05Å; V446-F451 HydrophobicContact CG1-CD2 4.5Å; V446-F451 HydrophobicContact CG1-CE2 3.47Å; V446-F451 VanDerWaalsContact CG1-CE2 3.47Å; V446-F451 HydrophobicContact CG1-CZ 3.85Å; V446-F463 HydrophobicContact CG1-CE2 4.19Å; V446-F463 HydrophobicContact CG1-CZ 4.19Å; V446-F463 HydrophobicContact CG2-CZ 4.42Å
447	R	96.3	Very high	95.6	Very high	96 Å²	96	34.6 Å²	34.6	36%	0.362	16%	0.164	S	C	.	.	H	α-helix	trans	-71.1	-35.7	176	-71.8	170.9	172.7	171.6	-6.6	113.2	V344 S345 V347 T443 D444 K445	V344-R447 HydrophobicContact CG1-CG 3.75Å; V344-R447 PolarHBondContact O-NE 3.12Å; V344-R447 PolarHBondContact O-NH2 3.39Å; S345-R447 VanDerWaalsContact C-NH2 3.31Å; S345-R447 PolarHBondContact O-NH2 3.3Å; V347-R447 VanDerWaalsContact O-CZ 3.28Å; V347-R447 PolarHBondContact O-NH1 3.46Å; V347-R447 PolarHBondContact O-NH2 2.85Å; T443-R447 WeakPolarHBondContact O-CD 3.34Å; T443-R447 VanDerWaalsContact O-CG 3.27Å; T443-R447 WeakPolarHBondContact O-CG 3.43Å; T443-R447 PolarHBondContact O-N 3.3Å; D444-R447 PolarHBondContact O-N 3.16Å; K445-R447 VanDerWaalsContact C-N 3.26Å; K445-R447 PolarHBondContact O-N 2.74Å
448	E	95.3	Very high	95.1	Very high	122 Å²	122	35.2 Å²	35.2	57%	0.57	17%	0.168	S	C	*	.	H	α-helix	trans	-62.8	-46.3	177.1	-173.6	-176.5	161.4	0	0	111	D444 K445	D444-E448 WeakPolarHBondContact O-CB 3.5Å; D444-E448 PolarHBondContact O-N 3.4Å; K445-E448 VanDerWaalsContact CD-OE2 3.28Å; K445-E448 WeakPolarHBondContact CD-OE2 3.43Å; K445-E448 IonicContact NZ-OE1 3.16Å; K445-E448 IonicContact NZ-OE2 2.71Å; K445-E448 PolarHBondContact NZ-OE2 2.76Å; K445-E448 PolarHBondContact O-N 2.81Å
449	V	97	Very high	94.7	Very high	29 Å²	29	36 Å²	36	18%	0.176	17%	0.174	C	C	.	.	H	α-helix	trans	-73.2	-48.7	176.3	177.4	0	0	0	0	111.6	K445 F463 D466 L471	K445-V449 PolarHBondContact O-N 3.25Å; K445-V449 VanDerWaalsContact O-N 3.12Å; V449-F463 HydrophobicContact CB-CD2 4.49Å; V449-F463 HydrophobicContact CB-CE2 3.88Å; V449-F463 HydrophobicContact CG1-CD2 3.81Å; V449-F463 HydrophobicContact CG1-CE2 3.68Å; V449-F463 HydrophobicContact CG1-CZ 4.46Å; V449-D466 HydrophobicContact CG1-CB 3.73Å; V449-L471 HydrophobicContact CB-CD1 4.35Å; V449-L471 HydrophobicContact CG1-CD1 4.45Å; V449-L471 HydrophobicContact CG2-CD1 3.66Å; V449-L471 HydrophobicContact CG2-CD2 3.95Å; V449-L471 HydrophobicContact CG2-CG 3.59Å
450	G	96.5	Very high	94.2	Very high	16 Å²	16	37.3 Å²	37.3	17%	0.165	18%	0.18	C	C	.	.			trans	69.5	163.4	-177.5	0	0	0	0	0	113.8	V446	V446-G450 WeakPolarHBondContact O-CA 3.37Å; V446-G450 PolarHBondContact O-N 3.05Å
451	F	97.1	Very high	94	Very high	5 Å²	5	37.7 Å²	37.7	2%	0.022	18%	0.182	C	C	.	.			trans	-106.6	118.3	175.6	-63.6	-82.9	0	0	0	109.9	F337 R340 N341 V344 F439 V446 P453 F463	F337-F451 HydrophobicContact CB-CB 3.67Å; F337-F451 HydrophobicContact CD1-CB 4.13Å; F337-F451 AromaticContact CD1-CD1 3.94Å; F337-F451 HydrophobicContact CD1-CD1 3.94Å; F337-F451 HydrophobicContact CD1-CG 4.39Å; F337-F451 HydrophobicContact CD2-CB 3.85Å; F337-F451 HydrophobicContact CD2-CD1 4.39Å; F337-F451 AromaticContact CE1-CD1 3.8Å; F337-F451 HydrophobicContact CE1-CD1 3.8Å; F337-F451 HydrophobicContact CE1-CE1 4.48Å; F337-F451 HydrophobicContact CE2-CB 4.46Å; F337-F451 HydrophobicContact CE2-CD1 4.26Å; F337-F451 HydrophobicContact CG-CB 3.65Å; F337-F451 HydrophobicContact CG-CD1 4.24Å; F337-F451 HydrophobicContact CG-CG 4.38Å; F337-F451 AromaticContact CZ-CD1 3.95Å; F337-F451 HydrophobicContact CZ-CD1 3.95Å; R340-F451 HydrophobicContact CB-CB 4.26Å; R340-F451 HydrophobicContact CB-CD1 4.27Å; R340-F451 HydrophobicContact CB-CD2 3.43Å; R340-F451 VanDerWaalsContact CB-CD2 3.43Å; R340-F451 HydrophobicContact CB-CE2 3.73Å; R340-F451 HydrophobicContact CB-CG 3.73Å; R340-F451 HydrophobicContact CB-CZ 4.28Å; R340-F451 HydrophobicContact CG-CD1 4.45Å; R340-F451 HydrophobicContact CG-CD2 4.41Å; R340-F451 HydrophobicContact CG-CG 4.36Å; N341-F451 PolarHBondContact ND2-O 2.88Å; N341-F451 WeakPolarHBondContact OD1-CB 3.43Å; N341-F451 WeakPolarHBondContact OD1-CD2 3.46Å; N341-F451 PolarHBondContact OD1-N 3.22Å; V344-F451 HydrophobicContact CG2-CE2 4.33Å; F439-F451 HydrophobicContact CZ-CZ 4.41Å; V446-F451 HydrophobicContact CG1-CD2 4.5Å; V446-F451 HydrophobicContact CG1-CE2 3.47Å; V446-F451 VanDerWaalsContact CG1-CE2 3.47Å; V446-F451 HydrophobicContact CG1-CZ 3.85Å; F451-P453 WeakPolarHBondContact O-CD 3.17Å; F451-F463 HydrophobicContact CD1-CB 3.87Å; F451-F463 AromaticContact CD1-CD2 3.56Å; F451-F463 HydrophobicContact CD1-CD2 3.56Å; F451-F463 HydrophobicContact CD1-CE2 4.34Å; F451-F463 AromaticContact CD1-CG 3.85Å; F451-F463 HydrophobicContact CD1-CG 3.85Å; F451-F463 HydrophobicContact CE1-CB 3.77Å; F451-F463 HydrophobicContact CE1-CD1 4.02Å; F451-F463 AromaticContact CE1-CD2 3.28Å; F451-F463 HydrophobicContact CE1-CD2 3.28Å; F451-F463 HydrophobicContact CE1-CE1 4.47Å; F451-F463 AromaticContact CE1-CE2 3.82Å; F451-F463 HydrophobicContact CE1-CE2 3.82Å; F451-F463 AromaticContact CE1-CG 3.39Å; F451-F463 HydrophobicContact CE1-CG 3.39Å; F451-F463 HydrophobicContact CE1-CZ 4.38Å; F451-F463 HydrophobicContact CE2-CD2 4.42Å; F451-F463 HydrophobicContact CE2-CE2 4.28Å; F451-F463 HydrophobicContact CG-CD2 4.23Å; F451-F463 AromaticContact CZ-CD2 3.77Å; F451-F463 HydrophobicContact CZ-CD2 3.77Å; F451-F463 AromaticContact CZ-CE2 3.79Å; F451-F463 HydrophobicContact CZ-CE2 3.79Å; F451-F463 HydrophobicContact CZ-CG 4.15Å; F451-F463 HydrophobicContact CZ-CZ 4.19Å
452	D	96.4	Very high	93.8	Very high	15 Å²	15	38.3 Å²	38.3	8%	0.08	19%	0.185	C	C	.	.			trans	-63.3	109.3	-177.1	-166.2	-33.7	0	0	0	112.4	F337 R454 L455 K524	F337-D452 WeakPolarHBondContact CB-O 3.09Å; F337-D452 WeakPolarHBondContact CD2-O 3.21Å; D452-R454 PolarHBondContact O-N 2.56Å; D452-R454 VanDerWaalsContact OD1-CB 3.25Å; D452-R454 WeakPolarHBondContact OD1-CB 3.33Å; D452-R454 WeakPolarHBondContact OD1-CG 3.12Å; D452-R454 IonicContact OD1-CZ 3.79Å; D452-R454 PolarHBondContact OD1-N 3.2Å; D452-R454 VanDerWaalsContact OD1-N 3.08Å; D452-R454 IonicContact OD1-NE 3.65Å; D452-R454 PolarHBondContact OD1-NE 2.73Å; D452-R454 IonicContact OD1-NH2 2.69Å; D452-R454 IonicContact OD2-CZ 2.84Å; D452-R454 IonicContact OD2-NE 3.54Å; D452-R454 PolarHBondContact OD2-NE 2.98Å; D452-R454 IonicContact OD2-NH2 2.63Å; D452-R454 PolarHBondContact OD2-NH2 3.22Å; D452-L455 HydrophobicContact CB-CD1 4.44Å; D452-L455 WeakPolarHBondContact O-CB 3.42Å; D452-L455 PolarHBondContact O-N 3.24Å; D452-K524 IonicContact OD2-NZ 2.83Å; D452-K524 PolarHBondContact OD2-NZ 3.33Å; D452-K524 VanDerWaalsContact OD2-NZ 3.08Å
453	P	95.2	Very high	93.8	Very high	71 Å²	71	38 Å²	38	46%	0.461	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-9.5	-172.7	29.9	-35.9	0	0	0	113.4	A338 F451 L455	A338-P453 HydrophobicContact CB-CB 4.05Å; F451-P453 WeakPolarHBondContact O-CD 3.17Å; P453-L455 PolarHBondContact O-N 2.91Å
454	R	93.8	Very high	93.9	Very high	152 Å²	152	38.2 Å²	38.2	57%	0.574	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-23.7	170.1	-65	177.4	-73.3	-170	-6	111.8	D452 N456 L520	D452-R454 PolarHBondContact O-N 2.56Å; D452-R454 VanDerWaalsContact OD1-CB 3.25Å; D452-R454 WeakPolarHBondContact OD1-CB 3.33Å; D452-R454 WeakPolarHBondContact OD1-CG 3.12Å; D452-R454 IonicContact OD1-CZ 3.79Å; D452-R454 PolarHBondContact OD1-N 3.2Å; D452-R454 VanDerWaalsContact OD1-N 3.08Å; D452-R454 IonicContact OD1-NE 3.65Å; D452-R454 PolarHBondContact OD1-NE 2.73Å; D452-R454 IonicContact OD1-NH2 2.69Å; D452-R454 IonicContact OD2-CZ 2.84Å; D452-R454 IonicContact OD2-NE 3.54Å; D452-R454 PolarHBondContact OD2-NE 2.98Å; D452-R454 IonicContact OD2-NH2 2.63Å; D452-R454 PolarHBondContact OD2-NH2 3.22Å; R454-N456 PolarHBondContact O-N 3.13Å; R454-L520 HydrophobicContact CB-CD2 4.06Å; R454-L520 VanDerWaalsContact NH1-CD1 3.31Å; R454-L520 VanDerWaalsContact NH2-CD1 3.29Å
455	L	93.1	Very high	94	Very high	7 Å²	7	38.1 Å²	38.1	4%	0.037	18%	0.184	C	C	.	.			trans	-89.1	75.8	174.8	-59.1	173.8	0	0	0	110.9	F337 D452 P453 A459 E462 K517 L520	F337-L455 HydrophobicContact CD2-CB 3.88Å; F337-L455 HydrophobicContact CD2-CD1 4.02Å; F337-L455 HydrophobicContact CE2-CB 4.38Å; F337-L455 HydrophobicContact CE2-CD1 3.83Å; F337-L455 HydrophobicContact CG-CB 4.42Å; D452-L455 HydrophobicContact CB-CD1 4.44Å; D452-L455 WeakPolarHBondContact O-CB 3.42Å; D452-L455 PolarHBondContact O-N 3.24Å; P453-L455 PolarHBondContact O-N 2.91Å; L455-A459 HydrophobicContact CB-CB 3.81Å; L455-A459 HydrophobicContact CD1-CB 3.96Å; L455-A459 HydrophobicContact CG-CB 4.46Å; L455-E462 HydrophobicContact CD1-CB 3.49Å; L455-E462 VanDerWaalsContact CD1-CB 3.49Å; L455-E462 HydrophobicContact CD1-CG 3.68Å; L455-K517 HydrophobicContact CD2-CB 3.9Å; L455-K517 HydrophobicContact CD2-CG 3.7Å; L455-L520 HydrophobicContact CD1-CD2 4.38Å; L455-L520 HydrophobicContact CD2-CD2 3.8Å; L455-L520 HydrophobicContact CG-CD2 3.84Å
456	N	88.9	Confident	94	Very high	61 Å²	61	37.8 Å²	37.8	33%	0.326	19%	0.185	S	C	.	.	S	Bend	trans	-81.3	-24.8	-173.1	61	-1.9	0	0	0	114.7	G335 W336 R454	G335-N456 CarbonylContact C-O 3.5Å; G335-N456 VanDerWaalsContact CA-O 3.24Å; G335-N456 WeakPolarHBondContact CA-O 3.26Å; W336-N456 PolarHBondContact N-O 2.65Å; R454-N456 PolarHBondContact O-N 3.13Å
457	R	87.3	Confident	94	Very high	63 Å²	63	37.7 Å²	37.7	24%	0.238	18%	0.184	C	C	.	.	S	Bend	trans	-122.1	-43.6	-175.5	-58.9	-57.8	169	-148.2	-8.8	114.5	G333	G333-R457 PolarHBondContact O-NH1 2.92Å; G333-R457 PolarHBondContact O-NH2 2.88Å
458	V	84.9	Confident	93.9	Very high	34 Å²	34	36.5 Å²	36.5	21%	0.206	19%	0.185	C	C	.	.	S	Bend	trans	-120.4	107.3	-174.9	-176.5	0	0	0	0	108.8	Q514 K517	V458-Q514 VanDerWaalsContact CG1-NE2 3.35Å; V458-K517 HydrophobicContact CG1-CD 4.15Å
459	A	88.3	Confident	93.6	Very high	15 Å²	15	34.8 Å²	34.8	12%	0.124	20%	0.2	C	C	.	.			trans	-163.3	147.4	169	0	0	0	0	0	111.4	F337 L455 E462	F337-A459 HydrophobicContact CD1-CB 3.94Å; F337-A459 HydrophobicContact CD2-CB 3.92Å; F337-A459 HydrophobicContact CE1-CB 3.44Å; F337-A459 VanDerWaalsContact CE1-CB 3.44Å; F337-A459 HydrophobicContact CE2-CB 3.43Å; F337-A459 VanDerWaalsContact CE2-CB 3.43Å; F337-A459 HydrophobicContact CG-CB 4.18Å; F337-A459 HydrophobicContact CZ-CB 3.17Å; L455-A459 HydrophobicContact CB-CB 3.81Å; L455-A459 HydrophobicContact CD1-CB 3.96Å; L455-A459 HydrophobicContact CG-CB 4.46Å; A459-E462 WeakPolarHBondContact CA-OE2 3.1Å
460	H	89.9	Confident	93.3	Very high	30 Å²	30	35.5 Å²	35.5	14%	0.139	21%	0.206	C	C	.	.	S	Bend	trans	-156	-63	166.4	-172.5	-163.8	0	0	0	110.1	Y396 V435 N437 E462	Y396-H460 AromaticContact CD1-CE1 3.17Å; Y396-H460 WeakPolarHBondContact CD1-CE1 3.35Å; Y396-H460 AromaticContact CD1-ND1 3.49Å; Y396-H460 WeakPolarHBondContact CD1-ND1 3.5Å; Y396-H460 AromaticContact CE1-CE1 3.35Å; Y396-H460 WeakPolarHBondContact CE1-CE1 3.42Å; Y396-H460 AromaticContact CE1-ND1 3.1Å; Y396-H460 WeakPolarHBondContact CE1-ND1 3.25Å; Y396-H460 AromaticContact CG-CE1 3.85Å; Y396-H460 AromaticContact CZ-ND1 3.65Å; V435-H460 PolarHBondContact O-CE1 3.31Å; V435-H460 PolarHBondContact O-NE2 2.82Å; N437-H460 PolarHBondContact OD1-CD2 3.35Å; N437-H460 PolarHBondContact OD1-NE2 2.87Å; N437-H460 VanDerWaalsContact OD1-NE2 3.16Å; H460-E462 VanDerWaalsContact C-N 3.26Å; H460-E462 PolarHBondContact N-OE2 3.4Å; H460-E462 PolarHBondContact O-N 3.08Å
461	L	93.4	Very high	93.3	Very high	8 Å²	8	35.8 Å²	35.8	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-74.7	-17	-177.5	-66.7	176.5	0	0	0	113.4	Y396 Q398 L400 F463 F464 L465	Y396-L461 HydrophobicContact CD1-CD2 4.43Å; Y396-L461 HydrophobicContact CE1-CD1 4.26Å; Y396-L461 HydrophobicContact CE1-CD2 3.81Å; Y396-L461 HydrophobicContact CE1-CG 4Å; Q398-L461 HydrophobicContact CB-CD2 4.13Å; Q398-L461 HydrophobicContact CG-CD1 3.97Å; Q398-L461 HydrophobicContact CG-CD2 3.61Å; Q398-L461 HydrophobicContact CG-CG 4.42Å; L400-L461 HydrophobicContact CD2-CD1 4.45Å; L461-F463 PolarHBondContact O-N 3.14Å; L461-F464 HydrophobicContact CD2-CD2 4.2Å; L461-F464 CarbonylContact O-C 3.43Å; L461-F464 WeakPolarHBondContact O-CB 3.21Å; L461-F464 PolarHBondContact O-N 3.4Å; L461-L465 PolarHBondContact O-N 3.11Å
462	E	95.6	Very high	93.3	Very high	14 Å²	14	41.1 Å²	41.1	7%	0.065	22%	0.224	C	C	.	.	H	α-helix	trans	-62.6	-32.4	-179.9	-64.5	74.5	-163.3	0	0	111.9	F337 L455 A459 H460 L465 D466 K517 L521	F337-E462 HydrophobicContact CE2-CB 4.34Å; L455-E462 HydrophobicContact CD1-CB 3.49Å; L455-E462 VanDerWaalsContact CD1-CB 3.49Å; L455-E462 HydrophobicContact CD1-CG 3.68Å; A459-E462 WeakPolarHBondContact CA-OE2 3.1Å; H460-E462 VanDerWaalsContact C-N 3.26Å; H460-E462 PolarHBondContact N-OE2 3.4Å; H460-E462 PolarHBondContact O-N 3.08Å; E462-L465 PolarHBondContact O-N 2.84Å; E462-D466 WeakPolarHBondContact O-CB 3.29Å; E462-D466 PolarHBondContact O-N 2.66Å; E462-K517 WeakPolarHBondContact OE1-CD 3.24Å; E462-K517 IonicContact OE1-NZ 2.75Å; E462-L521 HydrophobicContact CG-CD2 4.17Å
463	F	96.9	Very high	93.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64	-42.1	171.2	168.4	-104.4	0	0	0	112.2	F337 L381 V446 V449 F451 L461 D466 G467 L471	F337-F463 HydrophobicContact CZ-CB 4.1Å; L381-F463 HydrophobicContact CD1-CE1 3.9Å; L381-F463 HydrophobicContact CD1-CZ 4.47Å; V446-F463 HydrophobicContact CG1-CE2 4.19Å; V446-F463 HydrophobicContact CG1-CZ 4.19Å; V446-F463 HydrophobicContact CG2-CZ 4.42Å; V449-F463 HydrophobicContact CB-CD2 4.49Å; V449-F463 HydrophobicContact CB-CE2 3.88Å; V449-F463 HydrophobicContact CG1-CD2 3.81Å; V449-F463 HydrophobicContact CG1-CE2 3.68Å; V449-F463 HydrophobicContact CG1-CZ 4.46Å; F451-F463 HydrophobicContact CD1-CB 3.87Å; F451-F463 AromaticContact CD1-CD2 3.56Å; F451-F463 HydrophobicContact CD1-CD2 3.56Å; F451-F463 HydrophobicContact CD1-CE2 4.34Å; F451-F463 AromaticContact CD1-CG 3.85Å; F451-F463 HydrophobicContact CD1-CG 3.85Å; F451-F463 HydrophobicContact CE1-CB 3.77Å; F451-F463 HydrophobicContact CE1-CD1 4.02Å; F451-F463 AromaticContact CE1-CD2 3.28Å; F451-F463 HydrophobicContact CE1-CD2 3.28Å; F451-F463 HydrophobicContact CE1-CE1 4.47Å; F451-F463 AromaticContact CE1-CE2 3.82Å; F451-F463 HydrophobicContact CE1-CE2 3.82Å; F451-F463 AromaticContact CE1-CG 3.39Å; F451-F463 HydrophobicContact CE1-CG 3.39Å; F451-F463 HydrophobicContact CE1-CZ 4.38Å; F451-F463 HydrophobicContact CE2-CD2 4.42Å; F451-F463 HydrophobicContact CE2-CE2 4.28Å; F451-F463 HydrophobicContact CG-CD2 4.23Å; F451-F463 AromaticContact CZ-CD2 3.77Å; F451-F463 HydrophobicContact CZ-CD2 3.77Å; F451-F463 AromaticContact CZ-CE2 3.79Å; F451-F463 HydrophobicContact CZ-CE2 3.79Å; F451-F463 HydrophobicContact CZ-CG 4.15Å; F451-F463 HydrophobicContact CZ-CZ 4.19Å; L461-F463 PolarHBondContact O-N 3.14Å; F463-D466 PolarHBondContact O-N 2.83Å; F463-G467 PolarHBondContact O-N 3.28Å; F463-L471 HydrophobicContact CE1-CD1 3.91Å; F463-L471 HydrophobicContact CE2-CD1 4.48Å; F463-L471 HydrophobicContact CZ-CD1 3.74Å
464	F	97.6	Very high	93.5	Very high	5 Å²	5	37.3 Å²	37.3	2%	0.022	20%	0.2	C	C	.	.	H	α-helix	trans	-72.8	-34.1	179.7	-66.9	-72	0	0	0	112	L381 L400 D433 V435 L461 G467 L468 V473	L381-F464 HydrophobicContact CD1-CE1 4.02Å; L381-F464 HydrophobicContact CD2-CE1 4.02Å; L381-F464 HydrophobicContact CD2-CZ 4.46Å; L400-F464 HydrophobicContact CD1-CB 3.91Å; D433-F464 VanDerWaalsContact O-CB 3.3Å; D433-F464 WeakPolarHBondContact O-CB 3.3Å; D433-F464 VanDerWaalsContact O-CD1 3.22Å; D433-F464 WeakPolarHBondContact O-CD1 3.49Å; D433-F464 WeakPolarHBondContact O-CG 3.19Å; V435-F464 HydrophobicContact CG2-CE1 4.08Å; V435-F464 HydrophobicContact CG2-CE2 4.48Å; V435-F464 HydrophobicContact CG2-CZ 3.57Å; L461-F464 HydrophobicContact CD2-CD2 4.2Å; L461-F464 CarbonylContact O-C 3.43Å; L461-F464 WeakPolarHBondContact O-CB 3.21Å; L461-F464 PolarHBondContact O-N 3.4Å; F464-G467 CarbonylContact O-C 3.56Å; F464-G467 PolarHBondContact O-N 3.38Å; F464-L468 PolarHBondContact O-N 3.35Å; F464-V473 HydrophobicContact CD1-CG2 4.06Å; F464-V473 HydrophobicContact CE1-CG1 4.21Å; F464-V473 HydrophobicContact CE1-CG2 4.15Å
465	L	96.8	Very high	93.7	Very high	12 Å²	12	30.1 Å²	30.1	6%	0.063	17%	0.173	C	C	.	.	H	α-helix	trans	-64.6	-42.7	171.5	-177.5	64.2	0	0	0	111.6	V402 L413 L461 E462 G467 L468 L521 L527	V402-L465 HydrophobicContact CG2-CD1 3.97Å; L413-L465 HydrophobicContact CD1-CD1 3.79Å; L413-L465 HydrophobicContact CD2-CD1 4.28Å; L413-L465 HydrophobicContact CD2-CD2 3.82Å; L461-L465 PolarHBondContact O-N 3.11Å; E462-L465 PolarHBondContact O-N 2.84Å; L465-G467 PolarHBondContact O-N 3.18Å; L465-L468 WeakPolarHBondContact O-CB 3.38Å; L465-L468 PolarHBondContact O-N 3.02Å; L465-L521 HydrophobicContact CD2-CD2 3.88Å; L465-L527 HydrophobicContact CD2-CD1 4.27Å
466	D	96.6	Very high	94	Very high	36 Å²	36	29.8 Å²	29.8	19%	0.193	17%	0.171	C	C	.	.	H	α-helix	trans	-61.5	-33.5	174	-73.3	-18.9	0	0	0	112	V449 E462 F463 K524 H525	V449-D466 HydrophobicContact CG1-CB 3.73Å; E462-D466 WeakPolarHBondContact O-CB 3.29Å; E462-D466 PolarHBondContact O-N 2.66Å; F463-D466 PolarHBondContact O-N 2.83Å; D466-K524 WeakPolarHBondContact OD1-CE 3.27Å; D466-K524 IonicContact OD1-NZ 3.68Å; D466-K524 PolarHBondContact OD1-NZ 3.24Å; D466-K524 IonicContact OD2-NZ 3.52Å; D466-K524 PolarHBondContact OD2-NZ 3.1Å; D466-H525 IonicContact OD1-CE1 2.65Å; D466-H525 PolarHBondContact OD1-CE1 3.09Å; D466-H525 IonicContact OD1-NE2 3.22Å; D466-H525 PolarHBondContact OD1-NE2 2.95Å
467	G	96.5	Very high	94.4	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.01	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	3.9	177.5	0	0	0	0	0	115.2	F463 F464 L465 G469 S470 L471	F463-G467 PolarHBondContact O-N 3.28Å; F464-G467 CarbonylContact O-C 3.56Å; F464-G467 PolarHBondContact O-N 3.38Å; L465-G467 PolarHBondContact O-N 3.18Å; G467-G469 PolarHBondContact O-N 2.73Å; G467-S470 PolarHBondContact O-N 3.36Å; G467-S470 PolarHBondContact O-OG 3.22Å; G467-L471 PolarHBondContact O-N 3.35Å
468	L	94.4	Very high	94.8	Very high	70 Å²	70	29.1 Å²	29.1	37%	0.366	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	123	-176.3	-166.4	68.6	0	0	0	110	L400 V402 F464 L465 S470	L400-L468 HydrophobicContact CB-CD1 4.36Å; V402-L468 HydrophobicContact CG2-CD2 4.01Å; F464-L468 PolarHBondContact O-N 3.35Å; L465-L468 WeakPolarHBondContact O-CB 3.38Å; L465-L468 PolarHBondContact O-N 3.02Å; L468-S470 VanDerWaalsContact C-N 3.34Å
469	G	89.3	Confident	95.5	Very high	86 Å²	86	27.6 Å²	27.6	89%	0.887	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.4	-10.5	-176.1	0	0	0	0	0	115.3	G467	G467-G469 PolarHBondContact O-N 2.73Å
470	S	91.4	Very high	95.9	Very high	45 Å²	45	27.4 Å²	27.4	32%	0.315	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.6	-25.8	176.9	64	0	0	0	0	113.9	G467 L468	G467-S470 PolarHBondContact O-N 3.36Å; G467-S470 PolarHBondContact O-OG 3.22Å; L468-S470 VanDerWaalsContact C-N 3.34Å
471	L	95.6	Very high	96.3	Very high	21 Å²	21	26 Å²	26	11%	0.11	16%	0.157	C	C	.	.			trans	-102.3	131.8	172.8	-69.9	180	0	0	0	111.4	D380 K445 V449 F463 G467 V473	D380-L471 HydrophobicContact CB-CD2 4.07Å; K445-L471 HydrophobicContact CB-CD2 3.78Å; V449-L471 HydrophobicContact CB-CD1 4.35Å; V449-L471 HydrophobicContact CG1-CD1 4.45Å; V449-L471 HydrophobicContact CG2-CD1 3.66Å; V449-L471 HydrophobicContact CG2-CD2 3.95Å; V449-L471 HydrophobicContact CG2-CG 3.59Å; F463-L471 HydrophobicContact CE1-CD1 3.91Å; F463-L471 HydrophobicContact CE2-CD1 4.48Å; F463-L471 HydrophobicContact CZ-CD1 3.74Å; G467-L471 PolarHBondContact O-N 3.35Å; L471-V473 HydrophobicContact CB-CG2 4.14Å
472	R	96.6	Very high	96.5	Very high	117 Å²	117	27.1 Å²	27.1	44%	0.442	16%	0.163	S	C	.	.			trans	-99.2	115.4	167.4	-65.6	168.4	179.5	165.8	3.3	109.6	R128 A378 L379 D380 L381	R128-R472 PolarHBondContact O-NH1 2.92Å; A378-R472 WeakPolarHBondContact O-CD 3.22Å; A378-R472 PolarHBondContact O-NH1 2.98Å; L379-R472 HydrophobicContact CD2-CB 4.05Å; D380-R472 PolarHBondContact N-O 3.02Å; D380-R472 PolarHBondContact OD2-N 2.83Å; L381-R472 PolarHBondContact N-O 2.87Å
473	V	98.4	Very high	96.3	Very high	6 Å²	6	27.4 Å²	27.4	4%	0.036	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	139.2	-169.8	175.7	0	0	0	0	111.4	L381 T432 V435 F464 L471	L381-V473 HydrophobicContact CB-CG2 4.32Å; L381-V473 HydrophobicContact CD2-CG1 3.77Å; L381-V473 HydrophobicContact CD2-CG2 4.37Å; L381-V473 CarbonylContact O-C 3.59Å; L381-V473 WeakPolarHBondContact O-CA 3.45Å; T432-V473 HydrophobicContact CG2-CG1 3.99Å; T432-V473 PolarHBondContact N-O 2.76Å; T432-V473 CarbonylContact O-C 3.6Å; T432-V473 VanDerWaalsContact O-CB 3.23Å; T432-V473 WeakPolarHBondContact O-CB 3.49Å; V435-V473 HydrophobicContact CG1-CG1 3.93Å; F464-V473 HydrophobicContact CD1-CG2 4.06Å; F464-V473 HydrophobicContact CE1-CG1 4.21Å; F464-V473 HydrophobicContact CE1-CG2 4.15Å; L471-V473 HydrophobicContact CB-CG2 4.14Å
474	G	98.4	Very high	95.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	171.1	172.3	0	0	0	0	0	113.1	L381 V382 G383 V430 V435	L381-G474 PolarHBondContact O-N 3.24Å; V382-G474 CarbonylContact C-O 3.02Å; V382-G474 VanDerWaalsContact CA-O 3.3Å; V382-G474 WeakPolarHBondContact CA-O 3.25Å; G383-G474 PolarHBondContact N-O 3.25Å; V430-G474 CarbonylContact O-C 3.56Å; V430-G474 WeakPolarHBondContact O-CA 3.41Å; V435-G474 WeakPolarHBondContact CG1-O 3.36Å
475	S	98.6	Very high	94.1	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.007	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	127.2	178.4	174.6	0	0	0	0	111.7	G383 R397 C429 V430	G383-S475 CarbonylContact O-C 3.56Å; G383-S475 VanDerWaalsContact O-CA 3.27Å; G383-S475 WeakPolarHBondContact O-CA 3.29Å; R397-S475 PolarHBondContact NE-OG 3.29Å; R397-S475 VanDerWaalsContact NE-OG 3.1Å; C429-S475 CarbonylContact C-O 3.52Å; C429-S475 VanDerWaalsContact CA-O 3.24Å; C429-S475 WeakPolarHBondContact CA-O 3.34Å; V430-S475 PolarHBondContact N-O 2.88Å; V430-S475 PolarHBondContact O-N 2.65Å
476	C	98.5	Very high	92.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	115.4	173.5	-61.7	0	0	0	0	110.5	L370 G383 G384 N428 C429 D478 V479	L370-C476 HydrophobicContact CD2-CB 4.36Å; G383-C476 PolarHBondContact O-N 3.43Å; G384-C476 WeakPolarHBondContact CA-O 3.1Å; N428-C476 WeakPolarHBondContact O-CA 3.4Å; C429-C476 HydrophobicContact CB-CB 4.18Å; C429-C476 WeakPolarHBondContact CB-SG 3.35Å; C429-C476 WeakPolarHBondContact SG-CB 3.26Å; C429-C476 CovalentContact SG-SG 2.05Å; C429-C476 PolarHBondContact SG-SG 3.1Å; C476-D478 VanDerWaalsContact C-N 3.3Å; C476-D478 PolarHBondContact O-N 2.73Å; C476-V479 HydrophobicContact CB-CG2 4.25Å
477	S	97.4	Very high	90.7	Very high	47 Å²	47	37.7 Å²	37.7	33%	0.329	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	-21.2	-175.3	32.3	0	0	0	0	114.5	S385 R397 N428	S385-S477 PolarHBondContact OG-O 3.32Å; R397-S477 PolarHBondContact NH2-OG 3.21Å; R397-S477 VanDerWaalsContact NH2-OG 3.11Å; N428-S477 PolarHBondContact O-N 2.83Å; N428-S477 PolarHBondContact O-OG 3.45Å
478	D	96.6	Very high	88.7	Confident	64 Å²	64	45.1 Å²	45.1	34%	0.342	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-3.3	-174.5	62.5	-19.9	0	0	0	114.3	K369 N428 C476	K369-D478 IonicContact NZ-OD1 2.74Å; K369-D478 PolarHBondContact NZ-OD1 3.45Å; K369-D478 IonicContact NZ-OD2 3.72Å; K369-D478 PolarHBondContact NZ-OD2 2.93Å; N428-D478 HydrophobicContact CB-CB 4.16Å; N428-D478 PolarHBondContact ND2-OD2 3.28Å; C476-D478 VanDerWaalsContact C-N 3.3Å; C476-D478 PolarHBondContact O-N 2.73Å
479	V	98.1	Very high	86.7	Confident	1 Å²	1	47 Å²	47	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	106.6	164.3	-174.5	0	0	0	0	107.8	K369 L370 G384 S385 F438 C476	K369-V479 HydrophobicContact CB-CG2 4.04Å; K369-V479 HydrophobicContact CD-CG2 3.79Å; K369-V479 HydrophobicContact CG-CG2 4.11Å; L370-V479 HydrophobicContact CD1-CG1 4.03Å; L370-V479 HydrophobicContact CD2-CB 4.04Å; L370-V479 HydrophobicContact CD2-CG1 4.15Å; L370-V479 HydrophobicContact CD2-CG2 3.82Å; L370-V479 HydrophobicContact CG-CB 4.42Å; L370-V479 HydrophobicContact CG-CG1 3.99Å; L370-V479 HydrophobicContact CG-CG2 4.24Å; G384-V479 CarbonylContact C-O 3.57Å; G384-V479 VanDerWaalsContact CA-O 3.27Å; G384-V479 WeakPolarHBondContact CA-O 3.49Å; S385-V479 PolarHBondContact N-O 3.45Å; F438-V479 HydrophobicContact CE1-CG1 4.06Å; F438-V479 HydrophobicContact CZ-CG1 4.2Å; C476-V479 HydrophobicContact CB-CG2 4.25Å
480	V	98.1	Very high	84.6	Confident	12 Å²	12	48.2 Å²	48.2	7%	0.073	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	133.7	-166.6	-172.4	0	0	0	0	110.2	R364 T365 S385 R387	R364-V480 CarbonylContact C-O 3.58Å; R364-V480 VanDerWaalsContact C-O 3.31Å; R364-V480 HydrophobicContact CB-CB 3.82Å; R364-V480 HydrophobicContact CB-CG2 4.25Å; R364-V480 PolarHBondContact O-N 3.16Å; T365-V480 VanDerWaalsContact CA-O 3.3Å; T365-V480 WeakPolarHBondContact CA-O 3.36Å; T365-V480 WeakPolarHBondContact CB-O 3.1Å; T365-V480 PolarHBondContact N-O 2.93Å; T365-V480 PolarHBondContact OG1-O 3.15Å; S385-V480 CarbonylContact O-C 3.56Å; S385-V480 WeakPolarHBondContact O-CA 3.35Å; S385-V480 VanDerWaalsContact OG-CG2 3.27Å; S385-V480 WeakPolarHBondContact OG-CG2 3.46Å; R387-V480 HydrophobicContact CB-CG1 3.56Å
481	V	97.9	Very high	82.8	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	140.8	164.2	72.4	0	0	0	0	109.4	F359 V360 F361 T365 S385 V386 R387 F438	F359-V481 HydrophobicContact CB-CG2 3.78Å; F359-V481 HydrophobicContact CD2-CG1 3.8Å; F359-V481 HydrophobicContact CD2-CG2 4.29Å; F359-V481 HydrophobicContact CE2-CG1 4.12Å; F359-V481 HydrophobicContact CG-CG1 4.12Å; F359-V481 HydrophobicContact CG-CG2 4.22Å; V360-V481 WeakPolarHBondContact O-CG2 3.27Å; F361-V481 HydrophobicContact CD1-CG2 4.21Å; F361-V481 HydrophobicContact CE1-CG2 4.39Å; T365-V481 HydrophobicContact CG2-CB 4.27Å; T365-V481 HydrophobicContact CG2-CG2 4.31Å; S385-V481 PolarHBondContact O-N 2.72Å; V386-V481 CarbonylContact C-O 3.53Å; V386-V481 WeakPolarHBondContact CA-O 3.2Å; V386-V481 HydrophobicContact CB-CG1 4.42Å; V386-V481 HydrophobicContact CG2-CG1 3.82Å; R387-V481 PolarHBondContact N-O 2.87Å; F438-V481 HydrophobicContact CB-CG1 3.89Å; F438-V481 HydrophobicContact CD1-CB 4.04Å; F438-V481 HydrophobicContact CD1-CG1 3.59Å; F438-V481 HydrophobicContact CD2-CB 4.17Å; F438-V481 HydrophobicContact CD2-CG1 3.83Å; F438-V481 HydrophobicContact CE1-CB 3.97Å; F438-V481 HydrophobicContact CE1-CG1 4.06Å; F438-V481 HydrophobicContact CE2-CB 4.09Å; F438-V481 HydrophobicContact CE2-CG1 4.27Å; F438-V481 HydrophobicContact CG-CB 4.15Å; F438-V481 HydrophobicContact CG-CG1 3.48Å; F438-V481 VanDerWaalsContact CG-CG1 3.48Å; F438-V481 HydrophobicContact CZ-CB 4.02Å; F438-V481 HydrophobicContact CZ-CG1 4.4Å
482	D	96.5	Very high	80.9	Confident	31 Å²	31	59.9 Å²	59.9	17%	0.166	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	148.6	177.9	-74.3	9.6	0	0	0	109.7	F359 V360 T362 R364 R387	F359-D482 CarbonylContact C-O 3.57Å; F359-D482 WeakPolarHBondContact CA-O 3.5Å; V360-D482 HydrophobicContact CB-CB 4.32Å; V360-D482 PolarHBondContact N-O 2.88Å; V360-D482 PolarHBondContact O-N 2.87Å; T362-D482 HydrophobicContact CG2-CB 4.1Å; R364-D482 IonicContact CZ-OD1 2.9Å; R364-D482 IonicContact NH2-OD1 3.55Å; R364-D482 PolarHBondContact NH2-OD1 3.04Å; R364-D482 IonicContact NH2-OD2 3.7Å; R364-D482 PolarHBondContact NH2-OD2 3.22Å; R387-D482 IonicContact CZ-OD1 3.94Å; R387-D482 IonicContact CZ-OD2 3.92Å; R387-D482 IonicContact NE-OD1 2.95Å; R387-D482 PolarHBondContact NE-OD1 2.95Å; R387-D482 IonicContact NE-OD2 2.92Å; R387-D482 IonicContact NH2-OD1 3.46Å; R387-D482 PolarHBondContact NH2-OD1 2.92Å; R387-D482 IonicContact NH2-OD2 2.77Å; R387-D482 PolarHBondContact NH2-OD2 3.33Å; R387-D482 CarbonylContact O-C 3.56Å; R387-D482 WeakPolarHBondContact O-CA 2.95Å
483	H	91.5	Very high	78.7	Confident	21 Å²	21	59.5 Å²	59.5	10%	0.097	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	131.8	175	-165.8	-57.9	0	0	0	109.5	D358 F359 V386 R387 E388 K486	D358-H483 IonicContact OD1-CE1 2.97Å; D358-H483 IonicContact OD1-NE2 2.7Å; D358-H483 IonicContact OD2-CE1 3.02Å; D358-H483 PolarHBondContact OD2-CE1 2.85Å; D358-H483 IonicContact OD2-NE2 3.61Å; F359-H483 AromaticContact CE1-CD2 3.74Å; V386-H483 HydrophobicContact CG1-CB 3.88Å; R387-H483 PolarHBondContact O-N 3.48Å; E388-H483 IonicContact OE1-CD2 2.73Å; E388-H483 IonicContact OE2-CG 2.65Å; H483-K486 WeakPolarHBondContact CE1-CE 3.42Å; H483-K486 WeakPolarHBondContact NE2-CE 3.41Å; H483-K486 PolarHBondContact NE2-NZ 3.18Å
484	A	80.9	Confident	76.7	Confident	15 Å²	15	68.1 Å²	68.1	12%	0.124	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-61.9	141.4	176	0	0	0	0	0	110.8	D358 V360 K486	D358-A484 HydrophobicContact CB-CB 4.32Å; D358-A484 WeakPolarHBondContact O-CB 3.47Å; D358-A484 PolarHBondContact O-N 3.29Å; V360-A484 HydrophobicContact CG2-CB 4.39Å; A484-K486 PolarHBondContact O-N 2.73Å
485	S	68.1	Low	75.2	Confident	28 Å²	28	72.3 Å²	72.3	20%	0.196	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-54.1	128.1	-175.9	-173.9	0	0	0	0	112.6	R291 V487	R291-S485 PolarHBondContact NH2-O 2.68Å; S485-V487 VanDerWaalsContact C-N 3.26Å; S485-V487 WeakPolarHBondContact OG-CB 3.38Å; S485-V487 PolarHBondContact OG-N 3.38Å; S485-V487 VanDerWaalsContact OG-N 3.08Å
486	K	65.3	Low	73.9	Confident	121 Å²	121	75.5 Å²	75.5	53%	0.526	40%	0.403	S	S	.	.			trans	-79.9	-8.5	168.2	-65.3	171.4	-177.2	149.9	0	112.5	E388 H483 A484 K488	E388-K486 IonicContact OE1-NZ 3.08Å; E388-K486 PolarHBondContact OE1-NZ 3.4Å; E388-K486 IonicContact OE2-NZ 2.68Å; H483-K486 WeakPolarHBondContact CE1-CE 3.42Å; H483-K486 WeakPolarHBondContact NE2-CE 3.41Å; H483-K486 PolarHBondContact NE2-NZ 3.18Å; A484-K486 PolarHBondContact O-N 2.73Å; K486-K488 PolarHBondContact O-N 2.87Å
487	V	55.7	Low	72.9	Confident	104 Å²	104	76.5 Å²	76.5	63%	0.63	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-74.2	117.2	-178.8	-176.3	0	0	0	0	109.4	S485	S485-V487 VanDerWaalsContact C-N 3.26Å; S485-V487 WeakPolarHBondContact OG-CB 3.38Å; S485-V487 PolarHBondContact OG-N 3.38Å; S485-V487 VanDerWaalsContact OG-N 3.08Å
488	K	54.5	Low	72.1	Confident	157 Å²	157	75.6 Å²	75.6	68%	0.683	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-85.7	128.4	169.4	-67.1	-172.6	177.2	-174.1	0	108.9	K486	K486-K488 PolarHBondContact O-N 2.87Å
489	L	52.6	Low	71.4	Confident	111 Å²	111	76.5 Å²	76.5	58%	0.581	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-74.6	146.9	171.9	-71.3	167.2	0	0	0	109.3	W491 T492	L489-W491 PolarHBondContact O-N 2.95Å; L489-T492 PolarHBondContact O-N 2.88Å; L489-T492 VanDerWaalsContact O-N 3.15Å; L489-T492 PolarHBondContact O-OG1 3.02Å
490	P	45.3	Very low	70.8	Confident	111 Å²	111	78.5 Å²	78.5	72%	0.721	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-25	-177	-23.5	31.4	0	0	0	114.2
491	W	53.2	Low	70.3	Confident	224 Å²	224	79.9 Å²	79.9	85%	0.848	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-4	-172.4	-21	97.7	0	0	0	114	L489 S493	L489-W491 PolarHBondContact O-N 2.95Å; W491-S493 PolarHBondContact O-N 3.45Å
492	T	56.4	Low	69.7	Low	87 Å²	87	81.5 Å²	81.5	53%	0.534	44%	0.441	S	S	.	.	S	Bend	trans	-75.8	123.1	176.1	35.2	0	0	0	0	110.6	L489	L489-T492 PolarHBondContact O-N 2.88Å; L489-T492 VanDerWaalsContact O-N 3.15Å; L489-T492 PolarHBondContact O-OG1 3.02Å
493	S	50.4	Low	69.2	Low	109 Å²	109	88.2 Å²	88.2	76%	0.762	46%	0.464	S	S	*	.			trans	-55.1	142.9	-179.8	54.8	0	0	0	0	111.9	W491 D495	W491-S493 PolarHBondContact O-N 3.45Å; S493-D495 PolarHBondContact O-N 3.48Å
494	K	57.7	Low	69	Low	186 Å²	186	90.7 Å²	90.7	81%	0.809	47%	0.473	S	S	*	.			trans	-65.9	96.3	170.1	-72.6	-176.3	175.6	-173.5	0	109.3
495	D	66.8	Low	69.2	Low	89 Å²	89	96.1 Å²	96.1	48%	0.476	49%	0.49	S	S	.	.			trans	-75.6	124.9	170.3	175.1	15.2	0	0	0	109.8	S493 G497 A498 E499	S493-D495 PolarHBondContact O-N 3.48Å; D495-G497 PolarHBondContact O-N 2.75Å; D495-G497 PolarHBondContact OD1-N 2.86Å; D495-A498 HydrophobicContact CB-CB 4.04Å; D495-A498 WeakPolarHBondContact O-CB 3.46Å; D495-A498 PolarHBondContact O-N 3.29Å; D495-E499 PolarHBondContact O-N 2.75Å; D495-E499 VanDerWaalsContact O-N 3.08Å
496	A	70.7	Confident	69.9	Low	68 Å²	68	102 Å²	102	56%	0.562	51%	0.509	S	S	*	.	H	α-helix	trans	-60.3	-30.1	177.4	0	0	0	0	0	112.4	T500	A496-T500 WeakPolarHBondContact O-CB 3.31Å; A496-T500 PolarHBondContact O-N 2.86Å; A496-T500 PolarHBondContact O-OG1 3.33Å
497	G	76.6	Confident	70.4	Confident	20 Å²	20	98.3 Å²	98.3	21%	0.206	50%	0.498	C	S	.	.	H	α-helix	trans	-63.8	-45	171.8	0	0	0	0	0	111.7	D495 E499 T500 Y501	D495-G497 PolarHBondContact O-N 2.75Å; D495-G497 PolarHBondContact OD1-N 2.86Å; G497-E499 PolarHBondContact O-N 2.95Å; G497-T500 PolarHBondContact O-N 3.3Å; G497-Y501 WeakPolarHBondContact O-CB 3.25Å; G497-Y501 PolarHBondContact O-N 3.06Å
498	A	80.4	Confident	71.4	Confident	29 Å²	29	96.1 Å²	96.1	24%	0.24	50%	0.496	C	S	.	.	H	α-helix	trans	-66.1	-35.4	177.6	0	0	0	0	0	113.5	D495 A502	D495-A498 HydrophobicContact CB-CB 4.04Å; D495-A498 WeakPolarHBondContact O-CB 3.46Å; D495-A498 PolarHBondContact O-N 3.29Å; A498-A502 WeakPolarHBondContact O-CB 3.19Å; A498-A502 PolarHBondContact O-N 3.48Å
499	E	83.3	Confident	72.3	Confident	83 Å²	83	94.8 Å²	94.8	39%	0.388	51%	0.506	S	S	.	.	H	α-helix	trans	-67.1	-43.4	172.8	-71.2	-169.4	174.1	0	0	111.9	D495 G497 A502 R503	D495-E499 PolarHBondContact O-N 2.75Å; D495-E499 VanDerWaalsContact O-N 3.08Å; G497-E499 PolarHBondContact O-N 2.95Å; E499-A502 PolarHBondContact O-N 2.93Å; E499-R503 PolarHBondContact O-N 2.84Å
500	T	85.3	Confident	73.6	Confident	43 Å²	43	97.3 Å²	97.3	26%	0.264	52%	0.52	S	S	.	.	H	α-helix	trans	-61.4	-49.6	176.5	-57.9	0	0	0	0	110.1	L287 F332 A496 G497 A502 R503 Y504	L287-T500 HydrophobicContact CD1-CG2 3.69Å; F332-T500 HydrophobicContact CZ-CG2 4.48Å; A496-T500 WeakPolarHBondContact O-CB 3.31Å; A496-T500 PolarHBondContact O-N 2.86Å; A496-T500 PolarHBondContact O-OG1 3.33Å; G497-T500 PolarHBondContact O-N 3.3Å; T500-A502 VanDerWaalsContact C-N 3.29Å; T500-A502 PolarHBondContact O-N 3.28Å; T500-R503 PolarHBondContact O-N 3.4Å; T500-R503 VanDerWaalsContact O-N 3.15Å; T500-Y504 HydrophobicContact CG2-CD2 4.14Å; T500-Y504 HydrophobicContact CG2-CE2 3.88Å; T500-Y504 VanDerWaalsContact O-CD2 3.28Å; T500-Y504 WeakPolarHBondContact O-CD2 3.39Å; T500-Y504 PolarHBondContact O-N 3.28Å
501	Y	87.1	Confident	75.4	Confident	40 Å²	40	95.2 Å²	95.2	16%	0.157	50%	0.502	C	S	.	.	H	α-helix	trans	-51.9	-46.6	174	174.3	-92.7	0	0	0	112.2	F286 R288 G497 R503 Y504 R505	F286-Y501 AromaticContact CD1-CD2 3.84Å; F286-Y501 HydrophobicContact CD1-CD2 3.84Å; F286-Y501 HydrophobicContact CD1-CE2 4.45Å; F286-Y501 VanDerWaalsContact O-CD2 3.26Å; F286-Y501 WeakPolarHBondContact O-CD2 3.44Å; R288-Y501 HydrophobicContact CG-CD2 3.85Å; R288-Y501 HydrophobicContact CG-CE2 3.93Å; R288-Y501 HydrophobicContact CG-CG 4.24Å; R288-Y501 VanDerWaalsContact CZ-CZ 3.46Å; R288-Y501 VanDerWaalsContact NE-CE2 3.31Å; R288-Y501 PolarHBondContact NH1-OH 2.87Å; R288-Y501 PolarHBondContact NH2-OH 3.35Å; G497-Y501 WeakPolarHBondContact O-CB 3.25Å; G497-Y501 PolarHBondContact O-N 3.06Å; Y501-R503 VanDerWaalsContact C-N 3.31Å; Y501-R503 PolarHBondContact O-N 2.89Å; Y501-Y504 PolarHBondContact O-N 3.1Å; Y501-Y504 VanDerWaalsContact O-N 3.1Å; Y501-R505 HydrophobicContact CD1-CB 4.37Å; Y501-R505 HydrophobicContact CE1-CB 3.82Å; Y501-R505 HydrophobicContact CE1-CG 4.09Å; Y501-R505 WeakPolarHBondContact O-CB 3.34Å; Y501-R505 PolarHBondContact O-N 3.49Å
502	A	85.6	Confident	77	Confident	35 Å²	35	90.6 Å²	90.6	29%	0.289	49%	0.49	S	S	.	.	H	α-helix	trans	-60	-38.6	-178.9	0	0	0	0	0	112.7	A498 E499 T500 Y504 R505 Y506	A498-A502 WeakPolarHBondContact O-CB 3.19Å; A498-A502 PolarHBondContact O-N 3.48Å; E499-A502 PolarHBondContact O-N 2.93Å; T500-A502 VanDerWaalsContact C-N 3.29Å; T500-A502 PolarHBondContact O-N 3.28Å; A502-Y504 VanDerWaalsContact C-N 3.3Å; A502-Y504 PolarHBondContact O-N 3.23Å; A502-R505 PolarHBondContact O-N 2.87Å; A502-Y506 PolarHBondContact O-N 3.35Å
503	R	86.4	Confident	78.5	Confident	171 Å²	171	87.3 Å²	87.3	65%	0.645	47%	0.471	S	S	*	.	H	α-helix	trans	-63	-36.3	176.1	-63.7	178.1	-155.4	172	6.4	112.5	E499 T500 Y501	E499-R503 PolarHBondContact O-N 2.84Å; T500-R503 PolarHBondContact O-N 3.4Å; T500-R503 VanDerWaalsContact O-N 3.15Å; Y501-R503 VanDerWaalsContact C-N 3.31Å; Y501-R503 PolarHBondContact O-N 2.89Å
504	Y	86.6	Confident	80.3	Confident	74 Å²	74	86 Å²	86	29%	0.29	45%	0.453	S	S	.	.	H	α-helix	trans	-78.3	-33	177.1	-76.9	-78.8	0	0	0	113	F286 F332 T500 Y501 A502	F286-Y504 AromaticContact CE1-CD2 3.47Å; F286-Y504 HydrophobicContact CE1-CD2 3.47Å; F286-Y504 VanDerWaalsContact CE1-CD2 3.47Å; F286-Y504 HydrophobicContact CE1-CE2 4.15Å; F286-Y504 AromaticContact CE1-CG 3.7Å; F286-Y504 HydrophobicContact CE1-CG 3.7Å; F286-Y504 AromaticContact CZ-CD2 3.63Å; F286-Y504 HydrophobicContact CZ-CD2 3.63Å; F286-Y504 AromaticContact CZ-CE2 3.82Å; F286-Y504 HydrophobicContact CZ-CE2 3.82Å; F286-Y504 HydrophobicContact CZ-CG 4.05Å; F332-Y504 HydrophobicContact CE1-CE2 4.47Å; F332-Y504 WeakPolarHBondContact CE1-OH 3.28Å; F332-Y504 HydrophobicContact CZ-CE2 4.04Å; T500-Y504 HydrophobicContact CG2-CD2 4.14Å; T500-Y504 HydrophobicContact CG2-CE2 3.88Å; T500-Y504 VanDerWaalsContact O-CD2 3.28Å; T500-Y504 WeakPolarHBondContact O-CD2 3.39Å; T500-Y504 PolarHBondContact O-N 3.28Å; Y501-Y504 PolarHBondContact O-N 3.1Å; Y501-Y504 VanDerWaalsContact O-N 3.1Å; A502-Y504 VanDerWaalsContact C-N 3.3Å; A502-Y504 PolarHBondContact O-N 3.23Å
505	R	84.6	Confident	81.9	Confident	129 Å²	129	80.3 Å²	80.3	49%	0.487	43%	0.433	S	S	.	.	H	α-helix	trans	-77.5	-38.2	-179.4	178.6	60.4	-172.5	95.5	-8.5	112.9	Y501 A502 P507	Y501-R505 HydrophobicContact CD1-CB 4.37Å; Y501-R505 HydrophobicContact CE1-CB 3.82Å; Y501-R505 HydrophobicContact CE1-CG 4.09Å; Y501-R505 WeakPolarHBondContact O-CB 3.34Å; Y501-R505 PolarHBondContact O-N 3.49Å; A502-R505 PolarHBondContact O-N 2.87Å; R505-P507 VanDerWaalsContact C-CD 3.48Å; R505-P507 WeakPolarHBondContact O-CD 3.39Å
506	Y	83.5	Confident	83.1	Confident	150 Å²	150	78.5 Å²	78.5	59%	0.588	43%	0.431	S	S	*	.	S	Bend	trans	-123.4	75.2	-178.8	-56	-71.1	0	0	0	108.5	A502	A502-Y506 PolarHBondContact O-N 3.35Å
507	P	75.8	Confident	84.2	Confident	45 Å²	45	76.3 Å²	76.3	29%	0.292	41%	0.408	S	S	.	.			trans	-60.2	141.9	178.8	24.5	-32.3	0	0	0	110.6	R505 D511	R505-P507 VanDerWaalsContact C-CD 3.48Å; R505-P507 WeakPolarHBondContact O-CD 3.39Å; P507-D511 HydrophobicContact CB-CB 3.47Å; P507-D511 VanDerWaalsContact CB-CB 3.47Å; P507-D511 HydrophobicContact CG-CB 4.39Å
508	G	75.9	Confident	85	Confident	57 Å²	57	79.6 Å²	79.6	59%	0.588	42%	0.418	S	S	*	.			trans	-70	176.2	-179.1	0	0	0	0	0	113.3	L510 D511	G508-L510 PolarHBondContact O-N 3.38Å; G508-L510 VanDerWaalsContact O-N 3.1Å; G508-D511 VanDerWaalsContact O-CB 3.28Å; G508-D511 WeakPolarHBondContact O-CB 3.43Å; G508-D511 PolarHBondContact O-N 3.18Å
509	S	73.9	Confident	85.7	Confident	130 Å²	130	86.1 Å²	86.1	91%	0.909	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-21.3	-177	53.6	0	0	0	0	115.2
510	L	79.3	Confident	86.3	Confident	164 Å²	164	82.9 Å²	82.9	86%	0.859	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-8.8	177.2	-64.3	173.4	0	0	0	113.5	G508	G508-L510 PolarHBondContact O-N 3.38Å; G508-L510 VanDerWaalsContact O-N 3.1Å
511	D	83.3	Confident	86.8	Confident	66 Å²	66	81.3 Å²	81.3	35%	0.353	41%	0.412	S	S	.	.			trans	-72.2	132.2	-179.6	-178.4	-94.6	0	0	0	111.8	P507 G508 S513	P507-D511 HydrophobicContact CB-CB 3.47Å; P507-D511 VanDerWaalsContact CB-CB 3.47Å; P507-D511 HydrophobicContact CG-CB 4.39Å; G508-D511 VanDerWaalsContact O-CB 3.28Å; G508-D511 WeakPolarHBondContact O-CB 3.43Å; G508-D511 PolarHBondContact O-N 3.18Å; D511-S513 WeakPolarHBondContact OD1-CA 3.3Å; D511-S513 WeakPolarHBondContact OD1-CB 3.29Å; D511-S513 PolarHBondContact OD1-N 3.37Å; D511-S513 PolarHBondContact OD1-OG 2.65Å; D511-S513 PolarHBondContact OD2-OG 2.86Å
512	Q	87.2	Confident	87.2	Confident	127 Å²	127	85.8 Å²	85.8	59%	0.593	43%	0.432	S	S	*	.			trans	-95.6	10.1	-176.3	-62.5	-171.3	2.8	0	0	113.2	Q514 V515 A516	Q512-Q514 VanDerWaalsContact C-N 3.32Å; Q512-Q514 PolarHBondContact O-N 3.44Å; Q512-V515 CarbonylContact O-C 3.56Å; Q512-V515 PolarHBondContact O-N 3.24Å; Q512-V515 VanDerWaalsContact O-N 3.11Å; Q512-A516 WeakPolarHBondContact O-CB 3.41Å; Q512-A516 PolarHBondContact O-N 2.91Å
513	S	87.7	Confident	87.7	Confident	18 Å²	18	92.2 Å²	92.2	13%	0.126	45%	0.454	C	S	.	.	H	α-helix	trans	-61.9	-38.8	-175.2	-56.5	0	0	0	0	112.3	D511 A516 K517	D511-S513 WeakPolarHBondContact OD1-CA 3.3Å; D511-S513 WeakPolarHBondContact OD1-CB 3.29Å; D511-S513 PolarHBondContact OD1-N 3.37Å; D511-S513 PolarHBondContact OD1-OG 2.65Å; D511-S513 PolarHBondContact OD2-OG 2.86Å; S513-A516 PolarHBondContact O-N 3.27Å; S513-K517 VanDerWaalsContact O-CB 3.28Å; S513-K517 WeakPolarHBondContact O-CB 3.03Å; S513-K517 PolarHBondContact O-N 3.32Å
514	Q	89	Confident	88.1	Confident	83 Å²	83	87.6 Å²	87.6	39%	0.388	44%	0.439	S	S	.	.	H	α-helix	trans	-66.6	-41.6	174.8	-65.9	-71.1	3.6	0	0	111.6	V458 Q512 K517 H518	V458-Q514 VanDerWaalsContact CG1-NE2 3.35Å; Q512-Q514 VanDerWaalsContact C-N 3.32Å; Q512-Q514 PolarHBondContact O-N 3.44Å; Q514-K517 WeakPolarHBondContact O-CB 3.48Å; Q514-K517 PolarHBondContact O-N 2.75Å; Q514-H518 VanDerWaalsContact O-CG 3.29Å; Q514-H518 PolarHBondContact O-N 2.03Å; Q514-H518 PolarHBondContact O-ND1 3.03Å; Q514-H518 VanDerWaalsContact O-ND1 3.1Å
515	V	91.3	Very high	88.5	Confident	66 Å²	66	86.1 Å²	86.1	40%	0.4	43%	0.434	S	S	.	.	H	α-helix	trans	-65	-43.4	176.8	177.2	0	0	0	0	110.7	Q512 K517 H518 R519	Q512-V515 CarbonylContact O-C 3.56Å; Q512-V515 PolarHBondContact O-N 3.24Å; Q512-V515 VanDerWaalsContact O-N 3.11Å; V515-K517 VanDerWaalsContact C-N 3.34Å; V515-H518 PolarHBondContact O-N 3.08Å; V515-R519 HydrophobicContact CG1-CG 4.48Å; V515-R519 WeakPolarHBondContact O-CB 3.34Å; V515-R519 WeakPolarHBondContact O-CG 2.92Å; V515-R519 PolarHBondContact O-N 3.23Å
516	A	92.6	Very high	89	Confident	51 Å²	51	85.4 Å²	85.4	42%	0.421	43%	0.432	S	S	.	.	H	α-helix	trans	-62	-42.1	175.6	0	0	0	0	0	111.3	Q512 S513 R519 L520	Q512-A516 WeakPolarHBondContact O-CB 3.41Å; Q512-A516 PolarHBondContact O-N 2.91Å; S513-A516 PolarHBondContact O-N 3.27Å; A516-R519 PolarHBondContact O-N 2.88Å; A516-L520 VanDerWaalsContact O-CB 3.25Å; A516-L520 WeakPolarHBondContact O-CB 2.96Å; A516-L520 PolarHBondContact O-N 3.08Å
517	K	93.1	Very high	89.6	Confident	21 Å²	21	78.7 Å²	78.7	9%	0.091	41%	0.406	C	S	.	.	H	α-helix	trans	-58.5	-49.2	172.2	-175.8	-171.8	87.7	172.5	0	111.5	L455 V458 E462 S513 Q514 V515 L520 L521	L455-K517 HydrophobicContact CD2-CB 3.9Å; L455-K517 HydrophobicContact CD2-CG 3.7Å; V458-K517 HydrophobicContact CG1-CD 4.15Å; E462-K517 WeakPolarHBondContact OE1-CD 3.24Å; E462-K517 IonicContact OE1-NZ 2.75Å; S513-K517 VanDerWaalsContact O-CB 3.28Å; S513-K517 WeakPolarHBondContact O-CB 3.03Å; S513-K517 PolarHBondContact O-N 3.32Å; Q514-K517 WeakPolarHBondContact O-CB 3.48Å; Q514-K517 PolarHBondContact O-N 2.75Å; V515-K517 VanDerWaalsContact C-N 3.34Å; K517-L520 WeakPolarHBondContact O-CB 3.28Å; K517-L520 PolarHBondContact O-N 3.36Å; K517-L521 HydrophobicContact CG-CD1 4.28Å; K517-L521 WeakPolarHBondContact O-CG 3.49Å; K517-L521 PolarHBondContact O-N 2.92Å
518	H	93.9	Very high	90.6	Very high	89 Å²	89	80.7 Å²	80.7	41%	0.412	41%	0.411	S	S	.	.	H	α-helix	trans	-64.5	-42.6	178.5	-62.5	139.2	0	0	0	112.7	Q514 V515 L520 L521 F522	Q514-H518 VanDerWaalsContact O-CG 3.29Å; Q514-H518 PolarHBondContact O-N 2.03Å; Q514-H518 PolarHBondContact O-ND1 3.03Å; Q514-H518 VanDerWaalsContact O-ND1 3.1Å; V515-H518 PolarHBondContact O-N 3.08Å; H518-L520 VanDerWaalsContact C-N 3.25Å; H518-L520 PolarHBondContact O-N 3.07Å; H518-L521 PolarHBondContact O-N 2.89Å; H518-F522 VanDerWaalsContact O-CB 3.3Å; H518-F522 WeakPolarHBondContact O-CB 3.34Å; H518-F522 PolarHBondContact O-N 3.42Å
519	R	95.3	Very high	91.5	Very high	166 Å²	166	80.5 Å²	80.5	63%	0.626	40%	0.4	S	S	*	.	H	α-helix	trans	-59	-40.1	173.6	-74.3	174.8	177.5	162.5	0.6	111.6	V515 A516 F523	V515-R519 HydrophobicContact CG1-CG 4.48Å; V515-R519 WeakPolarHBondContact O-CB 3.34Å; V515-R519 WeakPolarHBondContact O-CG 2.92Å; V515-R519 PolarHBondContact O-N 3.23Å; A516-R519 PolarHBondContact O-N 2.88Å; R519-F523 PolarHBondContact O-N 3.3Å
520	L	96	Very high	92.5	Very high	16 Å²	16	77.9 Å²	77.9	8%	0.084	38%	0.375	C	S	.	.	H	α-helix	trans	-63.9	-51.8	176.1	174	58.9	0	0	0	110.9	R454 L455 A516 K517 H518 F522 F523 K524	R454-L520 HydrophobicContact CB-CD2 4.06Å; R454-L520 VanDerWaalsContact NH1-CD1 3.31Å; R454-L520 VanDerWaalsContact NH2-CD1 3.29Å; L455-L520 HydrophobicContact CD1-CD2 4.38Å; L455-L520 HydrophobicContact CD2-CD2 3.8Å; L455-L520 HydrophobicContact CG-CD2 3.84Å; A516-L520 VanDerWaalsContact O-CB 3.25Å; A516-L520 WeakPolarHBondContact O-CB 2.96Å; A516-L520 PolarHBondContact O-N 3.08Å; K517-L520 WeakPolarHBondContact O-CB 3.28Å; K517-L520 PolarHBondContact O-N 3.36Å; H518-L520 VanDerWaalsContact C-N 3.25Å; H518-L520 PolarHBondContact O-N 3.07Å; L520-F522 VanDerWaalsContact C-N 3.3Å; L520-F522 PolarHBondContact O-N 3.28Å; L520-F523 PolarHBondContact O-N 3.15Å; L520-K524 HydrophobicContact CD1-CB 3.98Å; L520-K524 HydrophobicContact CD1-CD 4.18Å; L520-K524 HydrophobicContact CG-CB 4.48Å; L520-K524 HydrophobicContact CG-CD 4.44Å; L520-K524 WeakPolarHBondContact O-CB 3.43Å; L520-K524 PolarHBondContact O-N 3.37Å
521	L	95.1	Very high	93.2	Very high	9 Å²	9	72.8 Å²	72.8	5%	0.047	35%	0.35	C	S	.	.	H	α-helix	trans	-60.9	-39.5	179.2	-69.6	179.7	0	0	0	112.2	E462 L465 K517 H518 F523 H525 L527	E462-L521 HydrophobicContact CG-CD2 4.17Å; L465-L521 HydrophobicContact CD2-CD2 3.88Å; K517-L521 HydrophobicContact CG-CD1 4.28Å; K517-L521 WeakPolarHBondContact O-CG 3.49Å; K517-L521 PolarHBondContact O-N 2.92Å; H518-L521 PolarHBondContact O-N 2.89Å; L521-F523 VanDerWaalsContact C-N 3.32Å; L521-F523 PolarHBondContact O-N 3.32Å; L521-H525 PolarHBondContact O-N 3.11Å; L521-H525 VanDerWaalsContact O-N 3.14Å; L521-L527 HydrophobicContact CB-CD1 4.23Å
522	F	95.8	Very high	93.5	Very high	134 Å²	134	73.3 Å²	73.3	59%	0.588	36%	0.364	S	S	*	.	H	α-helix	trans	-55.5	-47	175.7	175.7	-89.1	0	0	0	111.8	H518 L520 R526 L527	H518-F522 VanDerWaalsContact O-CB 3.3Å; H518-F522 WeakPolarHBondContact O-CB 3.34Å; H518-F522 PolarHBondContact O-N 3.42Å; L520-F522 VanDerWaalsContact C-N 3.3Å; L520-F522 PolarHBondContact O-N 3.28Å; F522-R526 CarbonylContact O-C 3.45Å; F522-R526 WeakPolarHBondContact O-CA 3.15Å; F522-R526 PolarHBondContact O-N 2.76Å; F522-L527 VanDerWaalsContact CA-O 3.29Å; F522-L527 WeakPolarHBondContact CA-O 3.37Å; F522-L527 WeakPolarHBondContact CD2-O 3.41Å; F522-L527 PolarHBondContact O-N 3.01Å
523	F	95.1	Very high	93.3	Very high	171 Å²	171	75.1 Å²	75.1	75%	0.75	37%	0.372	S	S	*	.	H	α-helix	trans	-82	-52.4	-179.1	-171.2	-94.2	0	0	0	112.4	R519 L520 L521 H525 R526	R519-F523 PolarHBondContact O-N 3.3Å; L520-F523 PolarHBondContact O-N 3.15Å; L521-F523 VanDerWaalsContact C-N 3.32Å; L521-F523 PolarHBondContact O-N 3.32Å; F523-H525 PolarHBondContact O-N 2.87Å; F523-R526 PolarHBondContact O-N 3.15Å
524	K	94.9	Very high	93.6	Very high	73 Å²	73	78 Å²	78	32%	0.317	39%	0.385	S	S	.	.	H	α-helix	trans	-62	-41.5	-171	-177.1	-177.5	177.8	-176.2	0	112.8	D452 D466 L520	D452-K524 IonicContact OD2-NZ 2.83Å; D452-K524 PolarHBondContact OD2-NZ 3.33Å; D452-K524 VanDerWaalsContact OD2-NZ 3.08Å; D466-K524 WeakPolarHBondContact OD1-CE 3.27Å; D466-K524 IonicContact OD1-NZ 3.68Å; D466-K524 PolarHBondContact OD1-NZ 3.24Å; D466-K524 IonicContact OD2-NZ 3.52Å; D466-K524 PolarHBondContact OD2-NZ 3.1Å; L520-K524 HydrophobicContact CD1-CB 3.98Å; L520-K524 HydrophobicContact CD1-CD 4.18Å; L520-K524 HydrophobicContact CG-CB 4.48Å; L520-K524 HydrophobicContact CG-CD 4.44Å; L520-K524 WeakPolarHBondContact O-CB 3.43Å; L520-K524 PolarHBondContact O-N 3.37Å
525	H	94.5	Very high	93.8	Very high	43 Å²	43	77.7 Å²	77.7	20%	0.199	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	12.9	-178.4	-60.5	-74	0	0	0	112.3	D466 L521 F523 L527	D466-H525 IonicContact OD1-CE1 2.65Å; D466-H525 PolarHBondContact OD1-CE1 3.09Å; D466-H525 IonicContact OD1-NE2 3.22Å; D466-H525 PolarHBondContact OD1-NE2 2.95Å; L521-H525 PolarHBondContact O-N 3.11Å; L521-H525 VanDerWaalsContact O-N 3.14Å; F523-H525 PolarHBondContact O-N 2.87Å; H525-L527 HydrophobicContact CB-CD1 3.88Å; H525-L527 HydrophobicContact CB-CD2 4.49Å; H525-L527 HydrophobicContact CB-CG 3.7Å; H525-L527 PolarHBondContact O-N 2.84Å; H525-L527 VanDerWaalsContact O-N 3.11Å
526	R	95.6	Very high	93.9	Very high	115 Å²	115	78.4 Å²	78.4	43%	0.434	38%	0.384	S	S	.	.			trans	52	34.2	-176.6	-162.7	-174.9	168.3	-85.1	-8.1	112	L409 G410 D411 F522 F523	L409-R526 PolarHBondContact O-NH1 3.47Å; L409-R526 PolarHBondContact O-NH2 2.97Å; G410-R526 CarbonylContact C-O 3.59Å; G410-R526 VanDerWaalsContact C-O 3.29Å; G410-R526 WeakPolarHBondContact CA-O 3.42Å; D411-R526 PolarHBondContact N-O 2.81Å; D411-R526 IonicContact OD1-NH1 3.56Å; D411-R526 PolarHBondContact OD1-NH1 2.74Å; D411-R526 IonicContact OD2-NH1 3.29Å; F522-R526 CarbonylContact O-C 3.45Å; F522-R526 WeakPolarHBondContact O-CA 3.15Å; F522-R526 PolarHBondContact O-N 2.76Å; F523-R526 PolarHBondContact O-N 3.15Å
527	L	96.6	Very high	94	Very high	9 Å²	9	80 Å²	80	5%	0.047	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	141.9	-175.7	-66.7	173.2	0	0	0	111.7	V402 D411 L413 L465 L521 F522 H525	V402-L527 HydrophobicContact CG1-CD2 4.14Å; D411-L527 HydrophobicContact CB-CD2 4.12Å; D411-L527 CarbonylContact O-C 3.52Å; D411-L527 VanDerWaalsContact O-CA 3.25Å; D411-L527 WeakPolarHBondContact O-CA 3.17Å; D411-L527 WeakPolarHBondContact O-CD2 3.44Å; L413-L527 HydrophobicContact CB-CD1 3.97Å; L413-L527 HydrophobicContact CB-CD2 4.09Å; L413-L527 HydrophobicContact CD2-CD1 4.3Å; L465-L527 HydrophobicContact CD2-CD1 4.27Å; L521-L527 HydrophobicContact CB-CD1 4.23Å; F522-L527 VanDerWaalsContact CA-O 3.29Å; F522-L527 WeakPolarHBondContact CA-O 3.37Å; F522-L527 WeakPolarHBondContact CD2-O 3.41Å; F522-L527 PolarHBondContact O-N 3.01Å; H525-L527 HydrophobicContact CB-CD1 3.88Å; H525-L527 HydrophobicContact CB-CD2 4.49Å; H525-L527 HydrophobicContact CB-CG 3.7Å; H525-L527 PolarHBondContact O-N 2.84Å; H525-L527 VanDerWaalsContact O-N 3.11Å
528	Q	96	Very high	94.1	Very high	87 Å²	87	83.7 Å²	83.7	41%	0.407	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	-22.9	169	69.8	177.9	-17.4	0	0	113.1	G410 D411	G410-Q528 WeakPolarHBondContact O-CG 3.49Å; G410-Q528 PolarHBondContact O-NE2 3.21Å; D411-Q528 PolarHBondContact O-N 3.34Å
529	C	95.1	Very high	94.1	Very high	53 Å²	53	83.3 Å²	83.3	36%	0.358	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	160	-179.8	91.9	0	0	0	0	113	D411 C412 L413	D411-C529 PolarHBondContact O-N 3.29Å; C412-C529 WeakPolarHBondContact CA-O 3.28Å; C412-C529 HydrophobicContact CB-CB 4.35Å; C412-C529 WeakPolarHBondContact CB-SG 3.5Å; C412-C529 WeakPolarHBondContact SG-CB 3.35Å; C412-C529 CovalentContact SG-SG 2.03Å; C412-C529 PolarHBondContact SG-SG 3.1Å; L413-C529 PolarHBondContact N-O 3.06Å
530	M	94.5	Very high	94	Very high	74 Å²	74	77.4 Å²	77.4	37%	0.365	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	130	175.7	-177.7	179.6	68.8	0	0	109.5	L413 Q415	L413-M530 HydrophobicContact CB-CB 4.42Å; L413-M530 HydrophobicContact CB-CG 4.22Å; L413-M530 HydrophobicContact CD2-CG 4.07Å; L413-M530 HydrophobicContact CD2-SD 4.05Å; L413-M530 HydrophobicContact CG-CG 4.2Å; L413-M530 CarbonylContact O-C 3.56Å; L413-M530 WeakPolarHBondContact O-CA 3.49Å; Q415-M530 PolarHBondContact NE2-SD 2.73Å; Q415-M530 VanDerWaalsContact NE2-SD 3.38Å
531	T	94.1	Very high	93.9	Very high	57 Å²	57	82.2 Å²	82.2	35%	0.35	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	146.5	172.4	61.7	0	0	0	0	110.5	L413 Q415	L413-T531 PolarHBondContact O-N 3.39Å; Q415-T531 WeakPolarHBondContact CB-O 3.37Å; Q415-T531 PolarHBondContact N-O 3.43Å
532	A	89.9	Confident	93.7	Very high	77 Å²	77	88.3 Å²	88.3	64%	0.636	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.6	119.7	177.2	0	0	0	0	0	109.7	Q415	Q415-A532 HydrophobicContact CB-CB 4.32Å; Q415-A532 CarbonylContact O-C 3.44Å; Q415-A532 WeakPolarHBondContact O-CA 3.25Å
533	E	83.1	Confident	93.6	Very high	166 Å²	166	84.1 Å²	84.1	78%	0.776	42%	0.422	S	S	*	.			trans	-111.7	0	-178.1	-67.2	179.1	-170.8	0	0	113.1	Q415 K416 R417	Q415-E533 PolarHBondContact O-N 2.94Å; K416-E533 HydrophobicContact CG-CB 4.5Å; R417-E533 PolarHBondContact N-O 2.92Å

Retrieved 533 of 533 residues in 151 ms (Link to these results)

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