A0A096MKP7_PAPAN Loading...

Protein HTATIP2

Represses translation by preventing reactivation of elongation factor eEF1A. May also inhibit nuclear import by competing with nuclear import substrates for binding to a subset of nuclear transport receptors. Has additionally been proposed to act as a redox sensor involved in cellular oxidative stress surveillance.

AlphaFold DB , UniProt , Accession A0A096MKP7, Species PAPAN (Papio anubis, Olive baboon), Gene HTATIP2, Length 275 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	43.2	Very low	45.9	Very low	251 Å²	251	96.6 Å²	96.6	100%	1.236	66%	0.662	S	S	*	*				0	95	0	-68.7	-179.8	-169.5	0	0	107.9
2	A	40	Very low	46.6	Very low	100 Å²	100	93.7 Å²	93.7	83%	0.826	65%	0.649	S	S	*	*			trans	-92.2	121.6	171.3	0	0	0	0	0	107.3
3	G	39.6	Very low	47	Very low	43 Å²	43	91.1 Å²	91.1	44%	0.443	64%	0.637	S	S	.	*			trans	-72	162.5	-172.1	0	0	0	0	0	113.9	A5 A6	G3-A5 PolarHBondContact O-N 2.84Å; G3-A6 PolarHBondContact O-N 3.21Å
4	P	45.6	Very low	46.9	Very low	126 Å²	126	92.9 Å²	92.9	82%	0.818	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-7.9	-176.9	20.7	-28.4	0	0	0	114.9
5	A	47.9	Very low	47.2	Very low	76 Å²	76	92.4 Å²	92.4	63%	0.628	63%	0.627	S	S	*	*	H	α-helix	trans	-75	-23.2	175.7	0	0	0	0	0	114.3	G3 S8	G3-A5 PolarHBondContact O-N 2.84Å; A5-S8 PolarHBondContact O-OG 3.42Å
6	A	45.6	Very low	47.4	Very low	64 Å²	64	89.5 Å²	89.5	53%	0.529	61%	0.612	S	S	.	*	H	α-helix	trans	-78.5	-28.9	-178.3	0	0	0	0	0	113.1	G3	G3-A6 PolarHBondContact O-N 3.21Å
7	L	41.4	Very low	47.2	Very low	143 Å²	143	86.8 Å²	86.8	75%	0.749	60%	0.597	S	S	*	*	H	α-helix	trans	-74.4	-29.3	176.9	-101.3	91.7	0	0	0	112.9	A11	L7-A11 WeakPolarHBondContact O-CB 3.3Å; L7-A11 PolarHBondContact O-N 3.23Å
8	S	50.4	Low	47	Very low	78 Å²	78	88.2 Å²	88.2	55%	0.545	60%	0.596	S	S	.	*	H	α-helix	trans	-74.9	-35.4	-179.1	72.1	0	0	0	0	112.5	A5 A11 A12	A5-S8 PolarHBondContact O-OG 3.42Å; S8-A11 PolarHBondContact O-N 3.09Å; S8-A12 WeakPolarHBondContact O-CB 3.42Å; S8-A12 PolarHBondContact O-N 3.37Å
9	A	51.8	Low	46.8	Very low	62 Å²	62	89.2 Å²	89.2	51%	0.512	59%	0.594	S	S	.	*	H	α-helix	trans	-68.9	-39.1	177.5	0	0	0	0	0	112.2	A12 A13	A9-A12 PolarHBondContact O-N 3.5Å; A9-A13 WeakPolarHBondContact O-CB 3.37Å; A9-A13 PolarHBondContact O-N 3.07Å
10	A	49.7	Very low	46.7	Very low	65 Å²	65	92.4 Å²	92.4	54%	0.537	61%	0.605	S	S	.	*	H	α-helix	trans	-67.7	-38.5	176	0	0	0	0	0	112.2	L14	A10-L14 WeakPolarHBondContact O-CB 3.46Å; A10-L14 PolarHBondContact O-N 3.43Å
11	A	50.2	Low	46.5	Very low	55 Å²	55	95.1 Å²	95.1	46%	0.455	61%	0.613	S	S	.	*	H	α-helix	trans	-68.2	-40.8	175	0	0	0	0	0	112.3	L7 S8 L14 V15	L7-A11 WeakPolarHBondContact O-CB 3.3Å; L7-A11 PolarHBondContact O-N 3.23Å; S8-A11 PolarHBondContact O-N 3.09Å; A11-L14 PolarHBondContact O-N 2.72Å; A11-V15 VanDerWaalsContact O-CG2 3.27Å; A11-V15 WeakPolarHBondContact O-CG2 3.49Å; A11-V15 PolarHBondContact O-N 3.2Å
12	A	53.4	Low	46.4	Very low	61 Å²	61	91.9 Å²	91.9	50%	0.504	59%	0.587	S	S	.	*	H	α-helix	trans	-66	-39.5	176.4	0	0	0	0	0	112.3	S8 A9 V15 A16	S8-A12 WeakPolarHBondContact O-CB 3.42Å; S8-A12 PolarHBondContact O-N 3.37Å; A9-A12 PolarHBondContact O-N 3.5Å; A12-V15 PolarHBondContact O-N 2.94Å; A12-A16 WeakPolarHBondContact O-CB 3.38Å; A12-A16 PolarHBondContact O-N 3.32Å
13	A	51.8	Low	46.4	Very low	60 Å²	60	97.8 Å²	97.8	50%	0.496	59%	0.588	S	S	.	*	H	α-helix	trans	-67.6	-36.6	175.6	0	0	0	0	0	112.3	A9 A16 A17	A9-A13 WeakPolarHBondContact O-CB 3.37Å; A9-A13 PolarHBondContact O-N 3.07Å; A13-A16 PolarHBondContact O-N 3.04Å; A13-A17 VanDerWaalsContact O-CB 3.24Å; A13-A17 WeakPolarHBondContact O-CB 3.3Å; A13-A17 PolarHBondContact O-N 3.37Å
14	L	46.2	Very low	46.3	Very low	116 Å²	116	104.8 Å²	104.8	61%	0.607	61%	0.609	S	S	*	*	H	α-helix	trans	-68.4	-40.3	175.6	-154.4	83	0	0	0	111.5	A10 A11 A17 L18	A10-L14 WeakPolarHBondContact O-CB 3.46Å; A10-L14 PolarHBondContact O-N 3.43Å; A11-L14 PolarHBondContact O-N 2.72Å; L14-A17 PolarHBondContact O-N 3.48Å; L14-L18 HydrophobicContact CD2-CD1 4.43Å; L14-L18 HydrophobicContact CG-CD1 4.27Å; L14-L18 VanDerWaalsContact O-CB 3.29Å; L14-L18 WeakPolarHBondContact O-CB 3.46Å; L14-L18 WeakPolarHBondContact O-CD1 3.28Å; L14-L18 PolarHBondContact O-N 3.21Å
15	V	50.8	Low	46	Very low	86 Å²	86	105.3 Å²	105.3	52%	0.521	61%	0.605	S	S	.	*	H	α-helix	trans	-66.8	-41.4	174.8	172.7	0	0	0	0	111.1	A11 A12 L18 L19	A11-V15 VanDerWaalsContact O-CG2 3.27Å; A11-V15 WeakPolarHBondContact O-CG2 3.49Å; A11-V15 PolarHBondContact O-N 3.2Å; A12-V15 PolarHBondContact O-N 2.94Å; V15-L18 PolarHBondContact O-N 3.37Å; V15-L19 HydrophobicContact CG1-CD1 3.94Å; V15-L19 HydrophobicContact CG1-CG 4.48Å; V15-L19 WeakPolarHBondContact O-CB 3.34Å; V15-L19 WeakPolarHBondContact O-CG 3.4Å; V15-L19 PolarHBondContact O-N 3.14Å
16	A	51.1	Low	45.6	Very low	46 Å²	46	106.5 Å²	106.5	38%	0.38	61%	0.606	S	S	.	*	H	α-helix	trans	-65.7	-39.7	174.6	0	0	0	0	0	112.2	A12 A13 L19 L20	A12-A16 WeakPolarHBondContact O-CB 3.38Å; A12-A16 PolarHBondContact O-N 3.32Å; A13-A16 PolarHBondContact O-N 3.04Å; A16-L19 PolarHBondContact O-N 3.01Å; A16-L20 WeakPolarHBondContact O-CB 3.37Å; A16-L20 VanDerWaalsContact O-CG 3.24Å; A16-L20 WeakPolarHBondContact O-CG 3.24Å; A16-L20 PolarHBondContact O-N 2.91Å
17	A	44.1	Very low	45	Very low	43 Å²	43	105.8 Å²	105.8	36%	0.355	61%	0.605	S	S	.	*	H	α-helix	trans	-68	-37.2	174.6	0	0	0	0	0	112.4	A13 L14 L19 L20 L21	A13-A17 VanDerWaalsContact O-CB 3.24Å; A13-A17 WeakPolarHBondContact O-CB 3.3Å; A13-A17 PolarHBondContact O-N 3.37Å; L14-A17 PolarHBondContact O-N 3.48Å; A17-L19 VanDerWaalsContact C-N 3.34Å; A17-L20 PolarHBondContact O-N 3.34Å; A17-L21 WeakPolarHBondContact O-CB 3.24Å; A17-L21 VanDerWaalsContact O-CG 3.28Å; A17-L21 WeakPolarHBondContact O-CG 3.45Å; A17-L21 PolarHBondContact O-N 3.35Å
18	L	43.6	Very low	44.9	Very low	112 Å²	112	105.8 Å²	105.8	59%	0.586	61%	0.614	S	S	*	*	H	α-helix	trans	-67.9	-32.1	172.2	-92.3	148.1	0	0	0	112.6	L14 V15 R22	L14-L18 HydrophobicContact CD2-CD1 4.43Å; L14-L18 HydrophobicContact CG-CD1 4.27Å; L14-L18 VanDerWaalsContact O-CB 3.29Å; L14-L18 WeakPolarHBondContact O-CB 3.46Å; L14-L18 WeakPolarHBondContact O-CD1 3.28Å; L14-L18 PolarHBondContact O-N 3.21Å; V15-L18 PolarHBondContact O-N 3.37Å; L18-R22 PolarHBondContact O-N 3.13Å
19	L	43.5	Very low	44.5	Very low	107 Å²	107	105.6 Å²	105.6	56%	0.56	62%	0.624	S	S	*	*	H	α-helix	trans	-73.6	-32.6	173	-74	166.9	0	0	0	112.2	V15 A16 A17 R22	V15-L19 HydrophobicContact CG1-CD1 3.94Å; V15-L19 HydrophobicContact CG1-CG 4.48Å; V15-L19 WeakPolarHBondContact O-CB 3.34Å; V15-L19 WeakPolarHBondContact O-CG 3.4Å; V15-L19 PolarHBondContact O-N 3.14Å; A16-L19 PolarHBondContact O-N 3.01Å; A17-L19 VanDerWaalsContact C-N 3.34Å; L19-R22 WeakPolarHBondContact O-CB 3.35Å
20	L	44.2	Very low	44.2	Very low	154 Å²	154	105.5 Å²	105.5	81%	0.806	62%	0.624	S	S	*	*	H	α-helix	trans	-79.4	-23.9	175.1	-70.4	167.5	0	0	0	113.3	A16 A17 R22	A16-L20 WeakPolarHBondContact O-CB 3.37Å; A16-L20 VanDerWaalsContact O-CG 3.24Å; A16-L20 WeakPolarHBondContact O-CG 3.24Å; A16-L20 PolarHBondContact O-N 2.91Å; A17-L20 PolarHBondContact O-N 3.34Å; L20-R22 VanDerWaalsContact C-N 3.33Å
21	L	42.1	Very low	44.4	Very low	149 Å²	149	105 Å²	105	78%	0.78	62%	0.624	S	S	*	*	S	Bend	trans	-86.9	-3.8	171.9	-71.9	169.7	0	0	0	113.1	A17 R23	A17-L21 WeakPolarHBondContact O-CB 3.24Å; A17-L21 VanDerWaalsContact O-CG 3.28Å; A17-L21 WeakPolarHBondContact O-CG 3.45Å; A17-L21 PolarHBondContact O-N 3.35Å; L21-R23 VanDerWaalsContact C-N 3.34Å; L21-R23 PolarHBondContact O-N 3.34Å
22	R	40.5	Very low	44.9	Very low	184 Å²	184	103.4 Å²	103.4	69%	0.694	61%	0.61	S	S	*	*			trans	-75.6	93.1	170.3	-153.8	177.6	-167.8	-179.3	2.9	107.3	L18 L19 L20 E24	L18-R22 PolarHBondContact O-N 3.13Å; L19-R22 WeakPolarHBondContact O-CB 3.35Å; L20-R22 VanDerWaalsContact C-N 3.33Å; R22-E24 PolarHBondContact O-N 2.72Å; R22-E24 VanDerWaalsContact O-N 3.16Å
23	R	40.6	Very low	45.7	Very low	223 Å²	223	103.2 Å²	103.2	84%	0.842	60%	0.604	S	S	*	*			trans	-46.4	125.2	159.1	-147.5	175.7	-178.9	167.1	-1.3	105.7	L21 D25	L21-R23 VanDerWaalsContact C-N 3.34Å; L21-R23 PolarHBondContact O-N 3.34Å; R23-D25 PolarHBondContact O-N 3.3Å
24	E	37.7	Very low	46.6	Very low	190 Å²	190	108.5 Å²	108.5	89%	0.888	62%	0.621	S	S	*	*			trans	-58	92	175.6	-76.3	179	126.4	0	0	107.9	R22 P26	R22-E24 PolarHBondContact O-N 2.72Å; R22-E24 VanDerWaalsContact O-N 3.16Å; E24-P26 WeakPolarHBondContact O-CD 3.42Å
25	D	39.2	Very low	47.9	Very low	138 Å²	138	106.2 Å²	106.2	74%	0.738	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-66	117.5	158.9	-82.4	-33.5	0	0	0	104.9	R23 G27	R23-D25 PolarHBondContact O-N 3.3Å; D25-G27 PolarHBondContact O-N 3.38Å; D25-G27 VanDerWaalsContact O-N 3.1Å
26	P	38.9	Very low	49.1	Very low	100 Å²	100	107.2 Å²	107.2	65%	0.649	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-57	125.8	177.8	22	-29.7	0	0	0	107.6	E24 A30	E24-P26 WeakPolarHBondContact O-CD 3.42Å; P26-A30 HydrophobicContact CB-CB 3.84Å
27	G	35	Very low	50.3	Low	49 Å²	49	106.9 Å²	106.9	51%	0.505	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-53.7	164.1	179.4	0	0	0	0	0	111.9	D25 G29 A30	D25-G27 PolarHBondContact O-N 3.38Å; D25-G27 VanDerWaalsContact O-N 3.1Å; G27-G29 VanDerWaalsContact C-N 3.29Å; G27-G29 PolarHBondContact O-N 3.17Å; G27-A30 PolarHBondContact O-N 3.35Å
28	P	37.8	Very low	52.1	Low	144 Å²	144	112 Å²	112	94%	0.935	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	91.2	178.2	29.8	-31.3	0	0	0	108.3
29	G	42.6	Very low	54.2	Low	73 Å²	73	109.2 Å²	109.2	75%	0.753	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	157.8	-13.7	-176.3	0	0	0	0	0	116.1	G27 G31	G27-G29 VanDerWaalsContact C-N 3.29Å; G27-G29 PolarHBondContact O-N 3.17Å; G29-G31 PolarHBondContact O-N 3.25Å
30	A	45	Very low	56.4	Low	61 Å²	61	104.2 Å²	104.2	50%	0.504	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-76.3	121.3	173.7	0	0	0	0	0	110.4	P26 G27	P26-A30 HydrophobicContact CB-CB 3.84Å; G27-A30 PolarHBondContact O-N 3.35Å
31	G	54.7	Low	58.6	Low	53 Å²	53	99.5 Å²	99.5	55%	0.546	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-62	170.5	165.2	0	0	0	0	0	111.5	G29 S33	G29-G31 PolarHBondContact O-N 3.25Å; G31-S33 PolarHBondContact O-N 3.13Å
32	P	60.2	Low	61.1	Low	23 Å²	23	97.4 Å²	97.4	15%	0.149	56%	0.559	C	S	.	*	P	Polyproline II helix	trans	-55.6	142.3	176.1	26.4	-34.4	0	0	0	110.5	E36 K268	P32-E36 HydrophobicContact CB-CB 4.41Å; P32-K268 WeakPolarHBondContact CD-O 3.42Å; P32-K268 WeakPolarHBondContact CG-O 3.44Å
33	S	71.3	Confident	63.7	Low	56 Å²	56	90.8 Å²	90.8	39%	0.392	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-63.4	151.2	175.3	64.5	0	0	0	0	110.3	G31 A35 E36 T37	G31-S33 PolarHBondContact O-N 3.13Å; S33-A35 PolarHBondContact O-N 2.98Å; S33-A35 VanDerWaalsContact O-N 3.1Å; S33-E36 PolarHBondContact N-OE2 2.84Å; S33-E36 WeakPolarHBondContact O-CB 3.4Å; S33-E36 PolarHBondContact O-N 3.14Å; S33-E36 VanDerWaalsContact OG-CD 3.3Å; S33-E36 VanDerWaalsContact OG-CG 3.24Å; S33-E36 WeakPolarHBondContact OG-CG 3.22Å; S33-E36 PolarHBondContact OG-N 2.97Å; S33-E36 PolarHBondContact OG-OE2 3.48Å; S33-T37 PolarHBondContact O-N 2.75Å; S33-T37 VanDerWaalsContact O-N 3.1Å; S33-T37 PolarHBondContact O-OG1 3.34Å
34	M	70.3	Confident	66.3	Low	171 Å²	171	81.6 Å²	81.6	84%	0.842	50%	0.502	S	S	*	.	H	α-helix	trans	-53.1	-36.4	178.4	-66.9	-165.3	-51.3	0	0	112.4	T37 E38	M34-T37 PolarHBondContact O-N 2.99Å; M34-E38 WeakPolarHBondContact O-CB 3.38Å; M34-E38 PolarHBondContact O-N 3.14Å
35	A	73.6	Confident	69	Low	68 Å²	68	77 Å²	77	56%	0.562	48%	0.481	S	S	*	.	H	α-helix	trans	-65.2	-38.4	177	0	0	0	0	0	113	S33 A39	S33-A35 PolarHBondContact O-N 2.98Å; S33-A35 VanDerWaalsContact O-N 3.1Å; A35-A39 VanDerWaalsContact O-CB 3.3Å; A35-A39 WeakPolarHBondContact O-CB 3.37Å; A35-A39 PolarHBondContact O-N 3.19Å
36	E	74.8	Confident	71.8	Confident	107 Å²	107	73.5 Å²	73.5	50%	0.5	46%	0.462	S	S	.	.	H	α-helix	trans	-69.2	-37.8	176.3	-73.3	167.1	138.2	0	0	111.8	P32 S33 L40	P32-E36 HydrophobicContact CB-CB 4.41Å; S33-E36 PolarHBondContact N-OE2 2.84Å; S33-E36 WeakPolarHBondContact O-CB 3.4Å; S33-E36 PolarHBondContact O-N 3.14Å; S33-E36 VanDerWaalsContact OG-CD 3.3Å; S33-E36 VanDerWaalsContact OG-CG 3.24Å; S33-E36 WeakPolarHBondContact OG-CG 3.22Å; S33-E36 PolarHBondContact OG-N 2.97Å; S33-E36 PolarHBondContact OG-OE2 3.48Å; E36-L40 WeakPolarHBondContact O-CB 3.41Å; E36-L40 PolarHBondContact O-N 3.01Å
37	T	76.6	Confident	74.5	Confident	40 Å²	40	69.3 Å²	69.3	25%	0.245	43%	0.434	C	S	.	.	H	α-helix	trans	-66	-44.7	176.5	-58.5	0	0	0	0	111.4	S33 M34 L40 S41	S33-T37 PolarHBondContact O-N 2.75Å; S33-T37 VanDerWaalsContact O-N 3.1Å; S33-T37 PolarHBondContact O-OG1 3.34Å; M34-T37 PolarHBondContact O-N 2.99Å; T37-L40 PolarHBondContact O-N 2.8Å; T37-S41 PolarHBondContact O-N 2.66Å
38	E	82.3	Confident	77.4	Confident	150 Å²	150	71.7 Å²	71.7	70%	0.701	43%	0.428	S	S	*	.	H	α-helix	trans	-63.7	-45.4	177.2	-171.8	174.4	-175.5	0	0	111.5	M34 L40 S41 K42	M34-E38 WeakPolarHBondContact O-CB 3.38Å; M34-E38 PolarHBondContact O-N 3.14Å; E38-L40 VanDerWaalsContact C-N 3.31Å; E38-L40 PolarHBondContact O-N 3.01Å; E38-S41 WeakPolarHBondContact O-CB 3.4Å; E38-S41 PolarHBondContact O-N 2.64Å; E38-K42 PolarHBondContact O-N 2.92Å
39	A	88.3	Confident	80.2	Confident	54 Å²	54	72.5 Å²	72.5	45%	0.446	42%	0.421	S	S	.	.	H	α-helix	trans	-59.1	-41.3	175.5	0	0	0	0	0	112.1	A35 K42 L43	A35-A39 VanDerWaalsContact O-CB 3.3Å; A35-A39 WeakPolarHBondContact O-CB 3.37Å; A35-A39 PolarHBondContact O-N 3.19Å; A39-K42 PolarHBondContact O-N 2.97Å; A39-L43 WeakPolarHBondContact O-CG 3.41Å; A39-L43 PolarHBondContact O-N 2.93Å
40	L	89.3	Confident	82.8	Confident	2 Å²	2	74.2 Å²	74.2	1%	0.01	41%	0.409	C	S	.	.	H	α-helix	trans	-69.6	-36	178.4	-173.1	64	0	0	0	112.7	E36 T37 E38 K42 L43 R44 N245 V248 A269	E36-L40 WeakPolarHBondContact O-CB 3.41Å; E36-L40 PolarHBondContact O-N 3.01Å; T37-L40 PolarHBondContact O-N 2.8Å; E38-L40 VanDerWaalsContact C-N 3.31Å; E38-L40 PolarHBondContact O-N 3.01Å; L40-K42 VanDerWaalsContact C-N 3.3Å; L40-K42 PolarHBondContact O-N 3.45Å; L40-L43 HydrophobicContact CD1-CD1 4.43Å; L40-L43 PolarHBondContact O-N 2.79Å; L40-R44 VanDerWaalsContact CD2-NH2 3.29Å; L40-R44 WeakPolarHBondContact O-CG 3.3Å; L40-R44 PolarHBondContact O-N 3.36Å; L40-N245 HydrophobicContact CD1-CB 4.41Å; L40-V248 HydrophobicContact CD1-CG2 3.85Å; L40-A269 HydrophobicContact CD2-CB 3.88Å; L40-A269 WeakPolarHBondContact CD2-O 3.43Å
41	S	90.9	Very high	85.3	Confident	54 Å²	54	76.7 Å²	76.7	38%	0.378	41%	0.414	S	S	.	.	H	α-helix	trans	-59.1	-46	173	-167.4	0	0	0	0	110.8	T37 E38 L43 R44 E45	T37-S41 PolarHBondContact O-N 2.66Å; E38-S41 WeakPolarHBondContact O-CB 3.4Å; E38-S41 PolarHBondContact O-N 2.64Å; S41-L43 PolarHBondContact O-N 3.33Å; S41-R44 PolarHBondContact O-N 3.04Å; S41-E45 PolarHBondContact O-N 2.97Å
42	K	93.9	Very high	87.3	Confident	106 Å²	106	76.8 Å²	76.8	46%	0.461	40%	0.4	S	S	.	.	H	α-helix	trans	-60.9	-45.4	177.5	-177.3	53.5	177.3	154.5	0	112.4	E38 A39 L40 R44 E45 D46	E38-K42 PolarHBondContact O-N 2.92Å; A39-K42 PolarHBondContact O-N 2.97Å; L40-K42 VanDerWaalsContact C-N 3.3Å; L40-K42 PolarHBondContact O-N 3.45Å; K42-R44 VanDerWaalsContact C-N 3.29Å; K42-R44 PolarHBondContact O-N 3.27Å; K42-E45 PolarHBondContact O-N 3.43Å; K42-D46 WeakPolarHBondContact CE-OD1 3.14Å; K42-D46 WeakPolarHBondContact CE-OD2 3.32Å; K42-D46 IonicContact NZ-OD1 3.14Å; K42-D46 PolarHBondContact NZ-OD1 3.33Å; K42-D46 IonicContact NZ-OD2 2.69Å; K42-D46 PolarHBondContact O-N 3.36Å
43	L	95	Very high	89.2	Confident	45 Å²	45	76.2 Å²	76.2	24%	0.236	40%	0.396	C	S	.	.	H	α-helix	trans	-58.1	-40.3	175.2	-71.7	174	0	0	0	112.5	A39 L40 S41 F47 V248 R249	A39-L43 WeakPolarHBondContact O-CG 3.41Å; A39-L43 PolarHBondContact O-N 2.93Å; L40-L43 HydrophobicContact CD1-CD1 4.43Å; L40-L43 PolarHBondContact O-N 2.79Å; S41-L43 PolarHBondContact O-N 3.33Å; L43-F47 VanDerWaalsContact O-CB 3.27Å; L43-F47 WeakPolarHBondContact O-CB 3.31Å; L43-F47 PolarHBondContact O-N 3.17Å; L43-V248 HydrophobicContact CB-CB 4.45Å; L43-V248 HydrophobicContact CB-CG2 4.18Å; L43-R249 HydrophobicContact CD1-CG 3.86Å
44	R	95.1	Very high	90.5	Very high	29 Å²	29	73.6 Å²	73.6	11%	0.109	38%	0.378	C	S	.	.	H	α-helix	trans	-66.9	-41.6	177.2	-71.7	176.8	180	138.6	4.6	112	L40 S41 K42 F47 R48 L76 N245 V248 H270	L40-R44 VanDerWaalsContact CD2-NH2 3.29Å; L40-R44 WeakPolarHBondContact O-CG 3.3Å; L40-R44 PolarHBondContact O-N 3.36Å; S41-R44 PolarHBondContact O-N 3.04Å; K42-R44 VanDerWaalsContact C-N 3.29Å; K42-R44 PolarHBondContact O-N 3.27Å; R44-F47 PolarHBondContact O-N 3.03Å; R44-R48 WeakPolarHBondContact O-CG 3.27Å; R44-R48 PolarHBondContact O-N 3.18Å; R44-L76 HydrophobicContact CB-CD2 4.08Å; R44-L76 HydrophobicContact CG-CD2 3.94Å; R44-N245 PolarHBondContact NH2-OD1 2.73Å; R44-V248 HydrophobicContact CG-CG1 4.17Å; R44-V248 HydrophobicContact CG-CG2 4.22Å; R44-H270 PolarHBondContact NH2-CD2 2.9Å
45	E	95.2	Very high	91.8	Very high	93 Å²	93	65.4 Å²	65.4	44%	0.435	34%	0.337	S	S	.	.	H	α-helix	trans	-60.2	-49.8	174.4	-71.8	172.3	-172.5	0	0	111.3	S41 K42 F47 R48 M49	S41-E45 PolarHBondContact O-N 2.97Å; K42-E45 PolarHBondContact O-N 3.43Å; E45-F47 VanDerWaalsContact C-N 3.25Å; E45-F47 PolarHBondContact O-N 3.38Å; E45-R48 PolarHBondContact O-N 3.01Å; E45-R48 VanDerWaalsContact O-N 3.14Å; E45-M49 WeakPolarHBondContact O-CG 2.85Å; E45-M49 PolarHBondContact O-N 3.07Å; E45-M49 VanDerWaalsContact O-N 3.07Å
46	D	96.2	Very high	93	Very high	65 Å²	65	62.2 Å²	62.2	35%	0.348	31%	0.311	S	S	.	.	H	α-helix	trans	-62.2	-35.4	178.9	-66.2	-17.4	0	0	0	111.5	K42 M49 Q50	K42-D46 WeakPolarHBondContact CE-OD1 3.14Å; K42-D46 WeakPolarHBondContact CE-OD2 3.32Å; K42-D46 IonicContact NZ-OD1 3.14Å; K42-D46 PolarHBondContact NZ-OD1 3.33Å; K42-D46 IonicContact NZ-OD2 2.69Å; K42-D46 PolarHBondContact O-N 3.36Å; D46-M49 PolarHBondContact O-N 3.21Å; D46-Q50 WeakPolarHBondContact O-CG 3.4Å; D46-Q50 PolarHBondContact O-NE2 3.1Å
47	F	96.9	Very high	94.2	Very high	13 Å²	13	57.1 Å²	57.1	6%	0.057	29%	0.287	C	S	.	.	H	α-helix	trans	-65.7	-44.3	173.9	-171.1	-91.8	0	0	0	112.4	L43 R44 E45 M49 Q50 K52 L76 F77 V247 V248	L43-F47 VanDerWaalsContact O-CB 3.27Å; L43-F47 WeakPolarHBondContact O-CB 3.31Å; L43-F47 PolarHBondContact O-N 3.17Å; R44-F47 PolarHBondContact O-N 3.03Å; E45-F47 VanDerWaalsContact C-N 3.25Å; E45-F47 PolarHBondContact O-N 3.38Å; F47-M49 VanDerWaalsContact C-N 3.28Å; F47-M49 PolarHBondContact O-N 2.99Å; F47-Q50 WeakPolarHBondContact O-CB 3.36Å; F47-Q50 PolarHBondContact O-N 2.87Å; F47-Q50 VanDerWaalsContact O-N 3.09Å; F47-K52 HydrophobicContact CE1-CB 4.28Å; F47-K52 HydrophobicContact CE2-CG 4.38Å; F47-K52 HydrophobicContact CZ-CB 4.13Å; F47-K52 HydrophobicContact CZ-CG 4.16Å; F47-L76 HydrophobicContact CD1-CB 4.27Å; F47-L76 VanDerWaalsContact CD1-O 3.31Å; F47-L76 WeakPolarHBondContact CD1-O 3.27Å; F47-L76 HydrophobicContact CE1-CB 4.26Å; F47-L76 WeakPolarHBondContact CE1-O 3.24Å; F47-F77 AromaticContact CE1-CD1 3.93Å; F47-F77 HydrophobicContact CE1-CD1 3.93Å; F47-F77 AromaticContact CE1-CE1 3.57Å; F47-F77 HydrophobicContact CE1-CE1 3.57Å; F47-F77 HydrophobicContact CE1-CE2 4.36Å; F47-F77 HydrophobicContact CE1-CG 4.48Å; F47-F77 AromaticContact CE1-CZ 3.81Å; F47-F77 HydrophobicContact CE1-CZ 3.81Å; F47-F77 HydrophobicContact CZ-CD1 4.22Å; F47-F77 AromaticContact CZ-CE1 3.47Å; F47-F77 HydrophobicContact CZ-CE1 3.47Å; F47-F77 VanDerWaalsContact CZ-CE1 3.47Å; F47-F77 AromaticContact CZ-CZ 3.76Å; F47-F77 HydrophobicContact CZ-CZ 3.76Å; F47-V247 HydrophobicContact CE2-CG2 4.38Å; F47-V247 HydrophobicContact CZ-CG1 4.37Å; F47-V247 HydrophobicContact CZ-CG2 4.25Å; F47-V248 HydrophobicContact CB-CB 4.14Å; F47-V248 HydrophobicContact CB-CG1 3.89Å; F47-V248 HydrophobicContact CD1-CG1 4.07Å; F47-V248 HydrophobicContact CD2-CB 4.33Å; F47-V248 HydrophobicContact CD2-CG1 4.11Å; F47-V248 HydrophobicContact CG-CB 4.28Å; F47-V248 HydrophobicContact CG-CG1 3.76Å
48	R	96.6	Very high	95.2	Very high	98 Å²	98	55.7 Å²	55.7	37%	0.37	28%	0.28	S	S	.	.	H	α-helix	trans	-60.7	-38.7	176.9	-71.5	-176.3	-159.6	105.8	-4.5	111.9	R44 E45 Q50 N51 Q74 G75	R44-R48 WeakPolarHBondContact O-CG 3.27Å; R44-R48 PolarHBondContact O-N 3.18Å; E45-R48 PolarHBondContact O-N 3.01Å; E45-R48 VanDerWaalsContact O-N 3.14Å; R48-Q50 PolarHBondContact O-N 2.87Å; R48-N51 PolarHBondContact O-N 2.95Å; R48-Q74 PolarHBondContact NE-O 3.24Å; R48-Q74 PolarHBondContact NH2-O 3.12Å; R48-G75 VanDerWaalsContact CD-O 3.31Å; R48-G75 WeakPolarHBondContact CD-O 3.34Å; R48-G75 WeakPolarHBondContact CG-O 3.31Å; R48-G75 PolarHBondContact NE-O 3.49Å
49	M	96.4	Very high	95.8	Very high	162 Å²	162	48.8 Å²	48.8	80%	0.798	25%	0.249	S	C	*	.	H	α-helix	trans	-64.1	-19.7	177.8	-66.8	-57.5	-63.2	0	0	113.5	E45 D46 F47 N51	E45-M49 WeakPolarHBondContact O-CG 2.85Å; E45-M49 PolarHBondContact O-N 3.07Å; E45-M49 VanDerWaalsContact O-N 3.07Å; D46-M49 PolarHBondContact O-N 3.21Å; F47-M49 VanDerWaalsContact C-N 3.28Å; F47-M49 PolarHBondContact O-N 2.99Å; M49-N51 PolarHBondContact O-N 3.01Å
50	Q	96.7	Very high	96.1	Very high	108 Å²	108	48.7 Å²	48.7	51%	0.505	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-5.4	175.2	-64	167	44.8	0	0	113.4	D46 F47 R48 K52	D46-Q50 WeakPolarHBondContact O-CG 3.4Å; D46-Q50 PolarHBondContact O-NE2 3.1Å; F47-Q50 WeakPolarHBondContact O-CB 3.36Å; F47-Q50 PolarHBondContact O-N 2.87Å; F47-Q50 VanDerWaalsContact O-N 3.09Å; R48-Q50 PolarHBondContact O-N 2.87Å; Q50-K52 VanDerWaalsContact C-N 3.26Å; Q50-K52 HydrophobicContact CB-CD 4.23Å; Q50-K52 HydrophobicContact CB-CG 3.86Å; Q50-K52 PolarHBondContact O-N 3.38Å
51	N	96.7	Very high	96.2	Very high	114 Å²	114	50.1 Å²	50.1	61%	0.61	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	38.4	173.6	-164.9	44.2	0	0	0	114	R48 M49 S78	R48-N51 PolarHBondContact O-N 2.95Å; M49-N51 PolarHBondContact O-N 3.01Å; N51-S78 PolarHBondContact O-OG 3.4Å; N51-S78 WeakPolarHBondContact OD1-CB 3.39Å; N51-S78 PolarHBondContact OD1-OG 2.98Å; N51-S78 VanDerWaalsContact OD1-OG 3.14Å
52	K	98	Very high	96.2	Very high	55 Å²	55	50.3 Å²	50.3	24%	0.239	26%	0.255	C	S	.	.			trans	-70.5	146	-173.4	-63.1	-60	-168	-178	0	113.1	F47 Q50 F77 S78 D119	F47-K52 HydrophobicContact CE1-CB 4.28Å; F47-K52 HydrophobicContact CE2-CG 4.38Å; F47-K52 HydrophobicContact CZ-CB 4.13Å; F47-K52 HydrophobicContact CZ-CG 4.16Å; Q50-K52 VanDerWaalsContact C-N 3.26Å; Q50-K52 HydrophobicContact CB-CD 4.23Å; Q50-K52 HydrophobicContact CB-CG 3.86Å; Q50-K52 PolarHBondContact O-N 3.38Å; K52-F77 HydrophobicContact CB-CD1 3.99Å; K52-F77 HydrophobicContact CB-CE1 4.25Å; K52-F77 WeakPolarHBondContact O-CA 3.24Å; K52-F77 WeakPolarHBondContact O-CB 3.5Å; K52-F77 WeakPolarHBondContact O-CD1 3.48Å; K52-S78 PolarHBondContact O-N 2.71Å; K52-S78 PolarHBondContact O-OG 3.5Å; K52-D119 WeakPolarHBondContact CA-OD2 3.44Å; K52-D119 HydrophobicContact CB-CB 4.32Å; K52-D119 HydrophobicContact CD-CB 3.79Å; K52-D119 WeakPolarHBondContact CD-OD1 3.46Å; K52-D119 WeakPolarHBondContact CD-OD2 3.35Å; K52-D119 IonicContact NZ-OD1 3.71Å; K52-D119 PolarHBondContact NZ-OD1 2.77Å
53	S	98.4	Very high	96.2	Very high	11 Å²	11	46 Å²	46	8%	0.077	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	150.6	172	59	0	0	0	0	112.1	K79 G117 H118 D119 V120	S53-K79 WeakPolarHBondContact CA-O 3.43Å; S53-G117 PolarHBondContact OG-O 2.67Å; S53-G117 VanDerWaalsContact OG-O 3.09Å; S53-H118 VanDerWaalsContact OG-CA 3.27Å; S53-H118 WeakPolarHBondContact OG-CA 3.44Å; S53-D119 PolarHBondContact N-OD2 3.13Å; S53-D119 PolarHBondContact O-N 3.48Å; S53-D119 PolarHBondContact OG-N 2.9Å; S53-D119 VanDerWaalsContact OG-N 3.12Å; S53-D119 PolarHBondContact OG-OD2 3.1Å; S53-V120 PolarHBondContact O-N 3.1Å; S53-V120 VanDerWaalsContact O-N 3.09Å
54	V	98.8	Very high	96.3	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	144.1	-179.6	66	0	0	0	0	112.7	F77 K79 V80 T81 V120 F122	V54-F77 HydrophobicContact CB-CB 4.37Å; V54-F77 HydrophobicContact CB-CD1 3.58Å; V54-F77 HydrophobicContact CB-CD2 4Å; V54-F77 HydrophobicContact CB-CE1 3.71Å; V54-F77 HydrophobicContact CB-CE2 4.13Å; V54-F77 HydrophobicContact CB-CG 3.72Å; V54-F77 HydrophobicContact CB-CZ 3.99Å; V54-F77 HydrophobicContact CG1-CB 3.71Å; V54-F77 HydrophobicContact CG1-CD1 3.86Å; V54-F77 HydrophobicContact CG1-CD2 3.59Å; V54-F77 HydrophobicContact CG1-CE1 4.35Å; V54-F77 HydrophobicContact CG1-CE2 4.12Å; V54-F77 HydrophobicContact CG1-CG 3.44Å; V54-F77 VanDerWaalsContact CG1-CG 3.44Å; V54-F77 HydrophobicContact CG1-CZ 4.47Å; V54-F77 HydrophobicContact CG2-CE1 4.24Å; V54-F77 HydrophobicContact CG2-CE2 4.25Å; V54-F77 HydrophobicContact CG2-CZ 4.09Å; V54-K79 PolarHBondContact N-O 2.91Å; V54-V80 HydrophobicContact CG1-CB 4.22Å; V54-V80 HydrophobicContact CG1-CG1 4.16Å; V54-V80 HydrophobicContact CG1-CG2 3.88Å; V54-T81 PolarHBondContact O-N 3.44Å; V54-V120 CarbonylContact C-O 3.55Å; V54-V120 VanDerWaalsContact CA-O 3.26Å; V54-V120 WeakPolarHBondContact CA-O 3.37Å; V54-V120 HydrophobicContact CB-CB 4.46Å; V54-V120 HydrophobicContact CG2-CB 4.2Å; V54-V120 HydrophobicContact CG2-CG1 4.27Å; V54-F122 HydrophobicContact CG2-CD2 3.62Å; V54-F122 HydrophobicContact CG2-CE2 3.9Å
55	F	98.9	Very high	96.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	150.9	161.1	75.8	-93	0	0	0	113	L57 T81 I83 F115 H118 V120 F122 A152 C157 F160	F55-L57 HydrophobicContact CD2-CD1 4.4Å; F55-L57 HydrophobicContact CD2-CG 4.17Å; F55-L57 HydrophobicContact CE2-CD1 3.78Å; F55-L57 HydrophobicContact CE2-CG 4.05Å; F55-T81 CarbonylContact C-O 3.51Å; F55-T81 WeakPolarHBondContact CA-O 3.37Å; F55-I83 HydrophobicContact CB-CD1 3.93Å; F55-I83 HydrophobicContact CB-CG1 4.32Å; F55-I83 HydrophobicContact CD2-CD1 3.91Å; F55-I83 HydrophobicContact CG-CD1 3.98Å; F55-F115 HydrophobicContact CE2-CD1 4.38Å; F55-F115 HydrophobicContact CE2-CE1 4.34Å; F55-F115 HydrophobicContact CZ-CD1 4.35Å; F55-H118 HydrophobicContact CD1-CB 3.61Å; F55-H118 AromaticContact CD1-CD2 3.77Å; F55-H118 AromaticContact CD1-CG 3.82Å; F55-H118 HydrophobicContact CE1-CB 4.35Å; F55-V120 PolarHBondContact N-O 2.76Å; F55-F122 PolarHBondContact O-N 3.19Å; F55-A152 HydrophobicContact CE1-CB 3.81Å; F55-A152 HydrophobicContact CZ-CB 3.5Å; F55-C157 HydrophobicContact CE1-CB 4.24Å; F55-F160 HydrophobicContact CE2-CE2 4.31Å; F55-F160 HydrophobicContact CZ-CD2 4.12Å; F55-F160 AromaticContact CZ-CE2 3.93Å; F55-F160 HydrophobicContact CZ-CE2 3.93Å
56	I	98.9	Very high	96.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	122.3	177.4	-51.6	174.5	0	0	0	109.8	A59 L67 L68 I71 V80 T81 L82 I83 F122	I56-A59 HydrophobicContact CB-CB 4.45Å; I56-A59 HydrophobicContact CG2-CB 4.03Å; I56-L67 HydrophobicContact CD1-CD2 4.44Å; I56-L67 HydrophobicContact CD1-CG 4.46Å; I56-L67 HydrophobicContact CG2-CD2 4.3Å; I56-L68 HydrophobicContact CD1-CB 4.17Å; I56-L68 HydrophobicContact CD1-CD1 4.16Å; I56-I71 HydrophobicContact CD1-CD1 3.84Å; I56-V80 HydrophobicContact CD1-CG1 4.4Å; I56-T81 PolarHBondContact N-O 3.18Å; I56-L82 HydrophobicContact CB-CD2 4.15Å; I56-L82 HydrophobicContact CD1-CD2 4.2Å; I56-L82 HydrophobicContact CG1-CD2 4.49Å; I56-I83 PolarHBondContact O-N 3.44Å; I56-F122 WeakPolarHBondContact CA-O 3.4Å
57	L	98.8	Very high	96.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	136.3	167	-62.6	153.8	0	0	0	109.5	F55 I83 F105 F115 F122 C123 C124 L125 S148	F55-L57 HydrophobicContact CD2-CD1 4.4Å; F55-L57 HydrophobicContact CD2-CG 4.17Å; F55-L57 HydrophobicContact CE2-CD1 3.78Å; F55-L57 HydrophobicContact CE2-CG 4.05Å; L57-I83 HydrophobicContact CD2-CB 3.69Å; L57-I83 HydrophobicContact CD2-CG2 3.72Å; L57-I83 HydrophobicContact CG-CB 4.48Å; L57-F105 HydrophobicContact CD2-CE1 4.13Å; L57-F105 HydrophobicContact CD2-CZ 4.03Å; L57-F115 HydrophobicContact CD1-CE1 4.35Å; L57-F115 HydrophobicContact CD2-CE1 4.2Å; L57-F115 HydrophobicContact CD2-CZ 4.22Å; L57-F122 PolarHBondContact N-O 3.38Å; L57-C123 HydrophobicContact CD1-CB 4.25Å; L57-C124 WeakPolarHBondContact O-CA 3.38Å; L57-C124 WeakPolarHBondContact O-CB 3.26Å; L57-C124 PolarHBondContact O-N 3.05Å; L57-L125 HydrophobicContact CB-CD1 3.99Å; L57-L125 HydrophobicContact CB-CD2 4.4Å; L57-L125 HydrophobicContact CB-CG 3.83Å; L57-L125 HydrophobicContact CD2-CD1 4.43Å; L57-S148 VanDerWaalsContact CD1-CB 3.47Å
58	G	97.3	Very high	96.3	Very high	10 Å²	10	41.7 Å²	41.7	10%	0.103	21%	0.214	C	C	.	.	S	Bend	trans	80.3	22.6	179.9	0	0	0	0	0	114.4	S60 G61	G58-S60 PolarHBondContact O-N 3.25Å; G58-G61 PolarHBondContact O-N 3Å
59	A	96.3	Very high	96.2	Very high	6 Å²	6	41.1 Å²	41.1	5%	0.05	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-15.6	177.8	0	0	0	0	0	114.6	I56 G64 R65 L82 L88	I56-A59 HydrophobicContact CB-CB 4.45Å; I56-A59 HydrophobicContact CG2-CB 4.03Å; A59-G64 CarbonylContact O-C 3.55Å; A59-R65 WeakPolarHBondContact O-CG 3.44Å; A59-R65 PolarHBondContact O-N 2.85Å; A59-L82 HydrophobicContact CB-CB 4.29Å; A59-L82 HydrophobicContact CB-CD1 3.98Å; A59-L82 HydrophobicContact CB-CD2 3.78Å; A59-L82 HydrophobicContact CB-CG 4.22Å; A59-L88 HydrophobicContact CB-CD1 4.25Å
60	S	93.8	Very high	96.2	Very high	52 Å²	52	34.4 Å²	34.4	36%	0.364	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-16.8	175.4	76.9	0	0	0	0	114.4	G58 R86	G58-S60 PolarHBondContact O-N 3.25Å; S60-R86 PolarHBondContact OG-NH2 3.18Å
61	G	91.8	Very high	96.1	Very high	31 Å²	31	29.4 Å²	29.4	32%	0.32	16%	0.158	S	C	.	.	S	Bend	trans	-81.8	165.8	176.7	0	0	0	0	0	111.6	G58 T63 G64 R65	G58-G61 PolarHBondContact O-N 3Å; G61-T63 PolarHBondContact O-N 3.16Å; G61-G64 PolarHBondContact O-N 2.98Å; G61-G64 VanDerWaalsContact O-N 3.17Å; G61-R65 WeakPolarHBondContact O-CB 3.2Å; G61-R65 WeakPolarHBondContact O-CG 3.35Å; G61-R65 PolarHBondContact O-N 3.23Å
62	E	90.9	Very high	96.1	Very high	59 Å²	59	26.1 Å²	26.1	28%	0.276	14%	0.14	S	C	.	.	H	α-helix	trans	-54.3	-51.3	-174.7	-58.4	-61.6	162	0	0	112.7	G64 R65 A66 R207 L236	E62-G64 PolarHBondContact O-N 3.49Å; E62-R65 PolarHBondContact O-N 3.44Å; E62-A66 WeakPolarHBondContact O-CB 3.29Å; E62-A66 PolarHBondContact O-N 3.49Å; E62-R207 HydrophobicContact CG-CG 4.13Å; E62-L236 HydrophobicContact CB-CD2 3.91Å
63	T	93.9	Very high	95.9	Very high	16 Å²	16	29 Å²	29	10%	0.098	16%	0.155	C	C	.	.	H	α-helix	trans	-62.3	-44.4	177.4	-46.1	0	0	0	0	112.6	G61 A66 L67 V163 L236 V240	G61-T63 PolarHBondContact O-N 3.16Å; T63-A66 PolarHBondContact O-N 3.37Å; T63-L67 VanDerWaalsContact O-CB 3.26Å; T63-L67 WeakPolarHBondContact O-CB 3.46Å; T63-L67 PolarHBondContact O-N 3.03Å; T63-V163 HydrophobicContact CG2-CG2 4.46Å; T63-L236 HydrophobicContact CG2-CD1 3.98Å; T63-L236 WeakPolarHBondContact OG1-CD1 3.43Å; T63-V240 HydrophobicContact CG2-CG2 4.45Å
64	G	96	Very high	95.6	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-66.8	-36.8	-179.3	0	0	0	0	0	113	A59 G61 E62 L68	A59-G64 CarbonylContact O-C 3.55Å; G61-G64 PolarHBondContact O-N 2.98Å; G61-G64 VanDerWaalsContact O-N 3.17Å; E62-G64 PolarHBondContact O-N 3.49Å; G64-L68 WeakPolarHBondContact O-CB 3.27Å; G64-L68 PolarHBondContact O-N 2.97Å
65	R	94.6	Very high	95.4	Very high	127 Å²	127	31.2 Å²	31.2	48%	0.479	17%	0.174	S	C	.	.	H	α-helix	trans	-65.1	-47.8	174.8	-72.8	177.5	68.1	-174.2	1.3	111.2	A59 G61 E62 L67 L68 K69	A59-R65 WeakPolarHBondContact O-CG 3.44Å; A59-R65 PolarHBondContact O-N 2.85Å; G61-R65 WeakPolarHBondContact O-CB 3.2Å; G61-R65 WeakPolarHBondContact O-CG 3.35Å; G61-R65 PolarHBondContact O-N 3.23Å; E62-R65 PolarHBondContact O-N 3.44Å; R65-L67 VanDerWaalsContact C-N 3.33Å; R65-L68 PolarHBondContact O-N 3.47Å; R65-K69 WeakPolarHBondContact O-CB 3.38Å; R65-K69 PolarHBondContact O-N 2.86Å
66	A	94.8	Very high	95.2	Very high	23 Å²	23	31.3 Å²	31.3	19%	0.19	17%	0.174	C	C	.	.	H	α-helix	trans	-63	-40.9	177.8	0	0	0	0	0	111.6	E62 T63 K69 E70 L236 V240	E62-A66 WeakPolarHBondContact O-CB 3.29Å; E62-A66 PolarHBondContact O-N 3.49Å; T63-A66 PolarHBondContact O-N 3.37Å; A66-K69 PolarHBondContact O-N 2.89Å; A66-E70 WeakPolarHBondContact O-CG 3.34Å; A66-E70 PolarHBondContact O-N 2.87Å; A66-E70 VanDerWaalsContact O-N 3.07Å; A66-L236 HydrophobicContact CB-CD2 4.14Å; A66-L236 HydrophobicContact CB-CG 4.31Å; A66-V240 HydrophobicContact CB-CG2 3.87Å
67	L	97.6	Very high	95.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.7	-48.3	175.1	179.1	65.1	0	0	0	112.3	I56 T63 R65 K69 E70 I71 F122 V240 M243 L244	I56-L67 HydrophobicContact CD1-CD2 4.44Å; I56-L67 HydrophobicContact CD1-CG 4.46Å; I56-L67 HydrophobicContact CG2-CD2 4.3Å; T63-L67 VanDerWaalsContact O-CB 3.26Å; T63-L67 WeakPolarHBondContact O-CB 3.46Å; T63-L67 PolarHBondContact O-N 3.03Å; R65-L67 VanDerWaalsContact C-N 3.33Å; L67-K69 VanDerWaalsContact C-N 3.33Å; L67-K69 PolarHBondContact O-N 3.44Å; L67-E70 PolarHBondContact O-N 2.92Å; L67-I71 HydrophobicContact CD1-CD1 3.95Å; L67-I71 HydrophobicContact CD1-CG1 4.29Å; L67-I71 HydrophobicContact CG-CD1 3.87Å; L67-I71 WeakPolarHBondContact O-CB 3.3Å; L67-I71 WeakPolarHBondContact O-CG1 3.48Å; L67-I71 PolarHBondContact O-N 3.31Å; L67-F122 HydrophobicContact CD2-CB 3.62Å; L67-F122 HydrophobicContact CD2-CD1 3.97Å; L67-F122 HydrophobicContact CD2-CD2 4.16Å; L67-F122 HydrophobicContact CD2-CG 3.66Å; L67-V240 HydrophobicContact CB-CG1 4.31Å; L67-V240 HydrophobicContact CB-CG2 4.23Å; L67-V240 HydrophobicContact CD1-CG1 4.01Å; L67-M243 HydrophobicContact CD1-CE 4.32Å; L67-M243 HydrophobicContact CD2-CE 3.86Å; L67-L244 HydrophobicContact CD1-CD1 4.49Å; L67-L244 HydrophobicContact CD1-CD2 3.7Å; L67-L244 HydrophobicContact CD1-CG 4.05Å
68	L	97.2	Very high	95.1	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-58.9	-46.3	177.8	175.7	58.6	0	0	0	111.2	I56 G64 R65 E70 I71 L72 V80 L82 F90 Y95 V98	I56-L68 HydrophobicContact CD1-CB 4.17Å; I56-L68 HydrophobicContact CD1-CD1 4.16Å; G64-L68 WeakPolarHBondContact O-CB 3.27Å; G64-L68 PolarHBondContact O-N 2.97Å; R65-L68 PolarHBondContact O-N 3.47Å; L68-E70 PolarHBondContact O-N 2.96Å; L68-I71 PolarHBondContact O-N 3.18Å; L68-L72 HydrophobicContact CD1-CD1 3.94Å; L68-L72 HydrophobicContact CD1-CG 4.06Å; L68-L72 HydrophobicContact CG-CD1 4.12Å; L68-L72 WeakPolarHBondContact O-CG 3.33Å; L68-L72 PolarHBondContact O-N 2.93Å; L68-V80 HydrophobicContact CD1-CG1 3.75Å; L68-L82 HydrophobicContact CD1-CD2 3.96Å; L68-L82 HydrophobicContact CD2-CD1 3.83Å; L68-L82 HydrophobicContact CD2-CD2 3.97Å; L68-F90 HydrophobicContact CD2-CE1 4Å; L68-F90 HydrophobicContact CD2-CZ 3.69Å; L68-Y95 HydrophobicContact CD2-CD1 3.96Å; L68-Y95 HydrophobicContact CD2-CE1 3.74Å; L68-Y95 HydrophobicContact CG-CD1 4.33Å; L68-Y95 HydrophobicContact CG-CE1 3.86Å; L68-V98 HydrophobicContact CD1-CG1 4.5Å; L68-V98 HydrophobicContact CD1-CG2 4.31Å
69	K	94.9	Very high	95.1	Very high	87 Å²	87	39.6 Å²	39.6	38%	0.378	22%	0.216	S	C	.	.	H	α-helix	trans	-56.4	-51.9	177.9	-179.3	178	176.6	-69.7	0	111.5	R65 A66 L67 I71 L72 E73	R65-K69 WeakPolarHBondContact O-CB 3.38Å; R65-K69 PolarHBondContact O-N 2.86Å; A66-K69 PolarHBondContact O-N 2.89Å; L67-K69 VanDerWaalsContact C-N 3.33Å; L67-K69 PolarHBondContact O-N 3.44Å; K69-I71 PolarHBondContact O-N 3.23Å; K69-L72 PolarHBondContact O-N 2.96Å; K69-E73 WeakPolarHBondContact CE-OE1 3.1Å; K69-E73 HydrophobicContact CG-CG 4.45Å; K69-E73 IonicContact NZ-OE1 2.53Å; K69-E73 PolarHBondContact NZ-OE1 2.81Å; K69-E73 IonicContact NZ-OE2 3.86Å; K69-E73 PolarHBondContact NZ-OE2 3.22Å; K69-E73 WeakPolarHBondContact O-CB 3.43Å; K69-E73 WeakPolarHBondContact O-CG 3.47Å; K69-E73 PolarHBondContact O-N 3.5Å
70	E	95.3	Very high	95.2	Very high	21 Å²	21	39.8 Å²	39.8	10%	0.098	22%	0.217	C	C	.	.	H	α-helix	trans	-65.8	-35.9	-179.2	-74.6	-84.8	-175.5	0	0	112.6	A66 L67 L68 L72 E73 Q74 V240 R241 L244	A66-E70 WeakPolarHBondContact O-CG 3.34Å; A66-E70 PolarHBondContact O-N 2.87Å; A66-E70 VanDerWaalsContact O-N 3.07Å; L67-E70 PolarHBondContact O-N 2.92Å; L68-E70 PolarHBondContact O-N 2.96Å; E70-L72 VanDerWaalsContact C-N 3.34Å; E70-L72 PolarHBondContact O-N 3.46Å; E70-E73 PolarHBondContact O-N 3.33Å; E70-Q74 WeakPolarHBondContact O-CB 3.46Å; E70-Q74 VanDerWaalsContact O-CG 3.31Å; E70-Q74 WeakPolarHBondContact O-CG 3.49Å; E70-Q74 PolarHBondContact O-N 3.41Å; E70-Q74 PolarHBondContact OE2-NE2 3.37Å; E70-V240 HydrophobicContact CB-CG1 3.77Å; E70-V240 HydrophobicContact CG-CG1 3.76Å; E70-R241 IonicContact OE1-NE 3.81Å; E70-L244 HydrophobicContact CB-CD1 3.6Å
71	I	96.4	Very high	95.5	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-59.9	-45.1	173.3	-79.7	172.1	0	0	0	111.3	I56 L67 L68 K69 G75 F77 V80 F122 L244	I56-I71 HydrophobicContact CD1-CD1 3.84Å; L67-I71 HydrophobicContact CD1-CD1 3.95Å; L67-I71 HydrophobicContact CD1-CG1 4.29Å; L67-I71 HydrophobicContact CG-CD1 3.87Å; L67-I71 WeakPolarHBondContact O-CB 3.3Å; L67-I71 WeakPolarHBondContact O-CG1 3.48Å; L67-I71 PolarHBondContact O-N 3.31Å; L68-I71 PolarHBondContact O-N 3.18Å; K69-I71 PolarHBondContact O-N 3.23Å; I71-G75 PolarHBondContact O-N 3.43Å; I71-F77 HydrophobicContact CD1-CD2 4.37Å; I71-F77 HydrophobicContact CD1-CE2 4.13Å; I71-F77 HydrophobicContact CG1-CD2 4.28Å; I71-F77 HydrophobicContact CG1-CE2 4.18Å; I71-F77 HydrophobicContact CG2-CD2 3.86Å; I71-V80 HydrophobicContact CG2-CG2 3.78Å; I71-F122 HydrophobicContact CD1-CD2 4.47Å; I71-F122 HydrophobicContact CD1-CE2 4.38Å; I71-L244 HydrophobicContact CD1-CD2 4.18Å; I71-L244 HydrophobicContact CG1-CD1 4.28Å; I71-L244 HydrophobicContact CG1-CD2 3.66Å
72	L	95.3	Very high	95.8	Very high	45 Å²	45	36.3 Å²	36.3	24%	0.236	19%	0.187	C	C	.	.	H	α-helix	trans	-71	-41.2	-179.8	-65.6	174.9	0	0	0	111.7	L68 K69 E70 Q74 G75 V80 Y95 V98	L68-L72 HydrophobicContact CD1-CD1 3.94Å; L68-L72 HydrophobicContact CD1-CG 4.06Å; L68-L72 HydrophobicContact CG-CD1 4.12Å; L68-L72 WeakPolarHBondContact O-CG 3.33Å; L68-L72 PolarHBondContact O-N 2.93Å; K69-L72 PolarHBondContact O-N 2.96Å; E70-L72 VanDerWaalsContact C-N 3.34Å; E70-L72 PolarHBondContact O-N 3.46Å; L72-Q74 VanDerWaalsContact C-N 3.33Å; L72-Q74 PolarHBondContact O-N 3.33Å; L72-G75 PolarHBondContact O-N 3.21Å; L72-V80 HydrophobicContact CD2-CG2 4.35Å; L72-Y95 HydrophobicContact CD1-CD1 3.51Å; L72-Y95 HydrophobicContact CD1-CD2 4.16Å; L72-Y95 HydrophobicContact CD1-CE1 3.52Å; L72-Y95 HydrophobicContact CD1-CE2 4.17Å; L72-Y95 HydrophobicContact CD1-CG 3.85Å; L72-V98 HydrophobicContact CD1-CG2 4.01Å; L72-V98 HydrophobicContact CD2-CG2 3.93Å
73	E	93.9	Very high	96.2	Very high	117 Å²	117	33.6 Å²	33.6	55%	0.547	17%	0.174	S	C	.	.	H	α-helix	trans	-63.9	-37.6	177.5	-75.4	178.1	148.6	0	0	112.5	K69 E70	K69-E73 WeakPolarHBondContact CE-OE1 3.1Å; K69-E73 HydrophobicContact CG-CG 4.45Å; K69-E73 IonicContact NZ-OE1 2.53Å; K69-E73 PolarHBondContact NZ-OE1 2.81Å; K69-E73 IonicContact NZ-OE2 3.86Å; K69-E73 PolarHBondContact NZ-OE2 3.22Å; K69-E73 WeakPolarHBondContact O-CB 3.43Å; K69-E73 WeakPolarHBondContact O-CG 3.47Å; K69-E73 PolarHBondContact O-N 3.5Å; E70-E73 PolarHBondContact O-N 3.33Å
74	Q	92.8	Very high	96.4	Very high	17 Å²	17	33.6 Å²	33.6	8%	0.079	18%	0.178	C	C	.	.	H	α-helix	trans	-87.5	-13.2	179.8	-64.6	-179	43	0	0	113.3	R48 E70 L72 L76	R48-Q74 PolarHBondContact NE-O 3.24Å; R48-Q74 PolarHBondContact NH2-O 3.12Å; E70-Q74 WeakPolarHBondContact O-CB 3.46Å; E70-Q74 VanDerWaalsContact O-CG 3.31Å; E70-Q74 WeakPolarHBondContact O-CG 3.49Å; E70-Q74 PolarHBondContact O-N 3.41Å; E70-Q74 PolarHBondContact OE2-NE2 3.37Å; L72-Q74 VanDerWaalsContact C-N 3.33Å; L72-Q74 PolarHBondContact O-N 3.33Å; Q74-L76 VanDerWaalsContact C-N 3.26Å; Q74-L76 HydrophobicContact CB-CD1 4.24Å; Q74-L76 HydrophobicContact CB-CD2 4.15Å; Q74-L76 HydrophobicContact CB-CG 3.74Å; Q74-L76 PolarHBondContact O-N 2.88Å
75	G	94.9	Very high	96.4	Very high	39 Å²	39	42.8 Å²	42.8	40%	0.402	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	39.8	-179.5	0	0	0	0	0	113	R48 I71 L72	R48-G75 VanDerWaalsContact CD-O 3.31Å; R48-G75 WeakPolarHBondContact CD-O 3.34Å; R48-G75 WeakPolarHBondContact CG-O 3.31Å; R48-G75 PolarHBondContact NE-O 3.49Å; I71-G75 PolarHBondContact O-N 3.43Å; L72-G75 PolarHBondContact O-N 3.21Å
76	L	94.3	Very high	96.4	Very high	2 Å²	2	43 Å²	43	1%	0.01	21%	0.213	C	C	.	.			trans	-73.5	-27.2	-173	-66	178.4	0	0	0	113.3	R44 F47 Q74 L244 V248	R44-L76 HydrophobicContact CB-CD2 4.08Å; R44-L76 HydrophobicContact CG-CD2 3.94Å; F47-L76 HydrophobicContact CD1-CB 4.27Å; F47-L76 VanDerWaalsContact CD1-O 3.31Å; F47-L76 WeakPolarHBondContact CD1-O 3.27Å; F47-L76 HydrophobicContact CE1-CB 4.26Å; F47-L76 WeakPolarHBondContact CE1-O 3.24Å; Q74-L76 VanDerWaalsContact C-N 3.26Å; Q74-L76 HydrophobicContact CB-CD1 4.24Å; Q74-L76 HydrophobicContact CB-CD2 4.15Å; Q74-L76 HydrophobicContact CB-CG 3.74Å; Q74-L76 PolarHBondContact O-N 2.88Å; L76-L244 HydrophobicContact CD1-CB 4.16Å; L76-L244 HydrophobicContact CD1-CD1 4.32Å; L76-L244 HydrophobicContact CD1-CD2 4.13Å; L76-L244 HydrophobicContact CD1-CG 4.43Å; L76-V248 HydrophobicContact CD1-CG1 4.32Å; L76-V248 HydrophobicContact CD2-CG1 4.19Å
77	F	97.8	Very high	96.5	Very high	19 Å²	19	49.3 Å²	49.3	8%	0.083	24%	0.236	C	C	.	.			trans	-121.1	144	-174	-63.3	-83.9	0	0	0	110.7	F47 K52 V54 I71 V80 V120 F122 V247	F47-F77 AromaticContact CE1-CD1 3.93Å; F47-F77 HydrophobicContact CE1-CD1 3.93Å; F47-F77 AromaticContact CE1-CE1 3.57Å; F47-F77 HydrophobicContact CE1-CE1 3.57Å; F47-F77 HydrophobicContact CE1-CE2 4.36Å; F47-F77 HydrophobicContact CE1-CG 4.48Å; F47-F77 AromaticContact CE1-CZ 3.81Å; F47-F77 HydrophobicContact CE1-CZ 3.81Å; F47-F77 HydrophobicContact CZ-CD1 4.22Å; F47-F77 AromaticContact CZ-CE1 3.47Å; F47-F77 HydrophobicContact CZ-CE1 3.47Å; F47-F77 VanDerWaalsContact CZ-CE1 3.47Å; F47-F77 AromaticContact CZ-CZ 3.76Å; F47-F77 HydrophobicContact CZ-CZ 3.76Å; K52-F77 HydrophobicContact CB-CD1 3.99Å; K52-F77 HydrophobicContact CB-CE1 4.25Å; K52-F77 WeakPolarHBondContact O-CA 3.24Å; K52-F77 WeakPolarHBondContact O-CB 3.5Å; K52-F77 WeakPolarHBondContact O-CD1 3.48Å; V54-F77 HydrophobicContact CB-CB 4.37Å; V54-F77 HydrophobicContact CB-CD1 3.58Å; V54-F77 HydrophobicContact CB-CD2 4Å; V54-F77 HydrophobicContact CB-CE1 3.71Å; V54-F77 HydrophobicContact CB-CE2 4.13Å; V54-F77 HydrophobicContact CB-CG 3.72Å; V54-F77 HydrophobicContact CB-CZ 3.99Å; V54-F77 HydrophobicContact CG1-CB 3.71Å; V54-F77 HydrophobicContact CG1-CD1 3.86Å; V54-F77 HydrophobicContact CG1-CD2 3.59Å; V54-F77 HydrophobicContact CG1-CE1 4.35Å; V54-F77 HydrophobicContact CG1-CE2 4.12Å; V54-F77 HydrophobicContact CG1-CG 3.44Å; V54-F77 VanDerWaalsContact CG1-CG 3.44Å; V54-F77 HydrophobicContact CG1-CZ 4.47Å; V54-F77 HydrophobicContact CG2-CE1 4.24Å; V54-F77 HydrophobicContact CG2-CE2 4.25Å; V54-F77 HydrophobicContact CG2-CZ 4.09Å; I71-F77 HydrophobicContact CD1-CD2 4.37Å; I71-F77 HydrophobicContact CD1-CE2 4.13Å; I71-F77 HydrophobicContact CG1-CD2 4.28Å; I71-F77 HydrophobicContact CG1-CE2 4.18Å; I71-F77 HydrophobicContact CG2-CD2 3.86Å; F77-V80 HydrophobicContact CB-CG2 4.24Å; F77-V120 HydrophobicContact CE1-CB 3.92Å; F77-V120 HydrophobicContact CE1-CG1 4.43Å; F77-V120 HydrophobicContact CE1-CG2 3.79Å; F77-V120 HydrophobicContact CZ-CB 4.27Å; F77-V120 HydrophobicContact CZ-CG1 4.29Å; F77-V120 HydrophobicContact CZ-CG2 4.34Å; F77-F122 HydrophobicContact CE2-CE2 4.42Å; F77-F122 HydrophobicContact CZ-CE2 4.22Å; F77-V247 HydrophobicContact CZ-CG1 4.33Å; F77-V247 HydrophobicContact CZ-CG2 4.29Å
78	S	96.9	Very high	96.3	Very high	68 Å²	68	50.4 Å²	50.4	48%	0.476	24%	0.242	S	C	.	.	S	Bend	trans	-80.1	-25.5	178.6	61.1	0	0	0	0	113.1	N51 K52	N51-S78 PolarHBondContact O-OG 3.4Å; N51-S78 WeakPolarHBondContact OD1-CB 3.39Å; N51-S78 PolarHBondContact OD1-OG 2.98Å; N51-S78 VanDerWaalsContact OD1-OG 3.14Å; K52-S78 PolarHBondContact O-N 2.71Å; K52-S78 PolarHBondContact O-OG 3.5Å
79	K	98.1	Very high	96.1	Very high	97 Å²	97	56.3 Å²	56.3	42%	0.422	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	129.7	176.7	-177.2	-178.4	177.8	-173.6	0	109.8	S53 V54	S53-K79 WeakPolarHBondContact CA-O 3.43Å; V54-K79 PolarHBondContact N-O 2.91Å
80	V	98.5	Very high	95.9	Very high	10 Å²	10	55.1 Å²	55.1	6%	0.061	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	123.1	177.9	-177.4	0	0	0	0	109.1	V54 I56 L68 I71 L72 F77 L82 V98 N99	V54-V80 HydrophobicContact CG1-CB 4.22Å; V54-V80 HydrophobicContact CG1-CG1 4.16Å; V54-V80 HydrophobicContact CG1-CG2 3.88Å; I56-V80 HydrophobicContact CD1-CG1 4.4Å; L68-V80 HydrophobicContact CD1-CG1 3.75Å; I71-V80 HydrophobicContact CG2-CG2 3.78Å; L72-V80 HydrophobicContact CD2-CG2 4.35Å; F77-V80 HydrophobicContact CB-CG2 4.24Å; V80-L82 HydrophobicContact CG1-CD2 4.37Å; V80-V98 HydrophobicContact CG1-CG1 4.35Å; V80-N99 PolarHBondContact O-N 2.92Å
81	T	98.8	Very high	95.3	Very high	3 Å²	3	61.5 Å²	61.5	2%	0.018	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	129.1	179.1	-55.5	0	0	0	0	110.9	V54 F55 I56 I83 N99 E101 H118	V54-T81 PolarHBondContact O-N 3.44Å; F55-T81 CarbonylContact C-O 3.51Å; F55-T81 WeakPolarHBondContact CA-O 3.37Å; I56-T81 PolarHBondContact N-O 3.18Å; T81-I83 HydrophobicContact CG2-CG1 4.28Å; T81-N99 CarbonylContact C-O 3.57Å; T81-N99 WeakPolarHBondContact CA-O 3.2Å; T81-N99 HydrophobicContact CG2-CB 4.12Å; T81-E101 HydrophobicContact CG2-CG 3.79Å; T81-H118 PolarHBondContact OG1-CE1 2.81Å; T81-H118 VanDerWaalsContact OG1-CE1 3.25Å
82	L	98.8	Very high	94.9	Very high	7 Å²	7	67.3 Å²	67.3	4%	0.037	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	128.6	172	-45.3	-175.8	0	0	0	108.2	I56 A59 L68 V80 L88 F90 V98 N99 Q100 E101	I56-L82 HydrophobicContact CB-CD2 4.15Å; I56-L82 HydrophobicContact CD1-CD2 4.2Å; I56-L82 HydrophobicContact CG1-CD2 4.49Å; A59-L82 HydrophobicContact CB-CB 4.29Å; A59-L82 HydrophobicContact CB-CD1 3.98Å; A59-L82 HydrophobicContact CB-CD2 3.78Å; A59-L82 HydrophobicContact CB-CG 4.22Å; L68-L82 HydrophobicContact CD1-CD2 3.96Å; L68-L82 HydrophobicContact CD2-CD1 3.83Å; L68-L82 HydrophobicContact CD2-CD2 3.97Å; V80-L82 HydrophobicContact CG1-CD2 4.37Å; L82-L88 HydrophobicContact CD1-CD1 4.02Å; L82-F90 HydrophobicContact CD1-CE2 3.9Å; L82-F90 HydrophobicContact CD1-CZ 3.77Å; L82-V98 HydrophobicContact CD1-CG1 3.76Å; L82-V98 HydrophobicContact CD2-CG1 3.9Å; L82-V98 HydrophobicContact CG-CG1 3.5Å; L82-N99 PolarHBondContact N-O 2.99Å; L82-Q100 HydrophobicContact CB-CG 4.33Å; L82-Q100 HydrophobicContact CD1-CG 4.16Å; L82-Q100 HydrophobicContact CG-CG 4.35Å; L82-Q100 WeakPolarHBondContact O-CA 3.27Å; L82-E101 PolarHBondContact O-N 2.78Å
83	I	98.8	Very high	94.4	Very high	2 Å²	2	71.3 Å²	71.3	1%	0.01	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	121.7	173.9	-55	175.9	0	0	0	107.2	F55 I56 L57 T81 E101 V103 A114 F115	F55-I83 HydrophobicContact CB-CD1 3.93Å; F55-I83 HydrophobicContact CB-CG1 4.32Å; F55-I83 HydrophobicContact CD2-CD1 3.91Å; F55-I83 HydrophobicContact CG-CD1 3.98Å; I56-I83 PolarHBondContact O-N 3.44Å; L57-I83 HydrophobicContact CD2-CB 3.69Å; L57-I83 HydrophobicContact CD2-CG2 3.72Å; L57-I83 HydrophobicContact CG-CB 4.48Å; T81-I83 HydrophobicContact CG2-CG1 4.28Å; I83-E101 HydrophobicContact CG1-CB 4.24Å; I83-V103 HydrophobicContact CG2-CG1 3.89Å; I83-V103 HydrophobicContact CG2-CG2 3.86Å; I83-A114 HydrophobicContact CD1-CB 4.27Å; I83-A114 WeakPolarHBondContact CD1-O 3.36Å; I83-F115 HydrophobicContact CD1-CD1 3.75Å; I83-F115 HydrophobicContact CD1-CD2 4.41Å; I83-F115 HydrophobicContact CD1-CE1 3.75Å; I83-F115 HydrophobicContact CD1-CE2 4.41Å; I83-F115 HydrophobicContact CD1-CG 4.1Å; I83-F115 HydrophobicContact CD1-CZ 4.09Å; I83-F115 HydrophobicContact CG2-CE1 4.46Å; I83-F115 HydrophobicContact CG2-CE2 4.25Å; I83-F115 HydrophobicContact CG2-CZ 3.89Å
84	G	98.2	Very high	94	Very high	17 Å²	17	68.5 Å²	68.5	18%	0.175	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	172	-176.8	0	0	0	0	0	114.4	R86 E101 V102 V103	G84-R86 PolarHBondContact O-N 3.02Å; G84-E101 PolarHBondContact N-O 3.46Å; G84-E101 VanDerWaalsContact N-O 3.09Å; G84-V102 VanDerWaalsContact O-CA 3.3Å; G84-V102 WeakPolarHBondContact O-CA 3.48Å; G84-V103 PolarHBondContact O-N 3.46Å
85	R	96.4	Very high	93.9	Very high	193 Å²	193	69.1 Å²	69.1	73%	0.728	35%	0.351	S	S	*	.	S	Bend	trans	-76.2	-2.5	-173.5	68.7	-178.5	178.9	-177.9	1.6	115.8	V103 F105	R85-V103 WeakPolarHBondContact CA-O 3.38Å; R85-F105 HydrophobicContact CB-CD2 4.08Å; R85-F105 HydrophobicContact CB-CE2 4.18Å
86	R	95.4	Very high	93.5	Very high	131 Å²	131	73.9 Å²	73.9	49%	0.494	36%	0.361	S	S	.	.	S	Bend	trans	-158	149.4	-177.2	62.1	-176.6	175	94.3	-5.6	111.1	S60 G84 L88	S60-R86 PolarHBondContact OG-NH2 3.18Å; G84-R86 PolarHBondContact O-N 3.02Å; R86-L88 HydrophobicContact CG-CD2 4.5Å; R86-L88 VanDerWaalsContact NH1-CD2 3.3Å
87	K	95.8	Very high	93.3	Very high	156 Å²	156	80.6 Å²	80.6	68%	0.678	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-67.8	139.1	171.1	-164.1	170.2	-176.6	174.8	0	110.3	V102	K87-V102 HydrophobicContact CB-CG2 4.05Å
88	L	95	Very high	93.2	Very high	23 Å²	23	80.4 Å²	80.4	12%	0.12	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-102.3	139.8	173.7	-58	-177.2	0	0	0	109.9	A59 L82 R86 F90 Q100	A59-L88 HydrophobicContact CB-CD1 4.25Å; L82-L88 HydrophobicContact CD1-CD1 4.02Å; R86-L88 HydrophobicContact CG-CD2 4.5Å; R86-L88 VanDerWaalsContact NH1-CD2 3.3Å; L88-F90 HydrophobicContact CB-CE1 4.33Å; L88-F90 HydrophobicContact CB-CE2 3.73Å; L88-F90 HydrophobicContact CB-CZ 3.62Å; L88-F90 HydrophobicContact CD1-CZ 3.83Å; L88-F90 HydrophobicContact CG-CZ 4.38Å; L88-Q100 PolarHBondContact O-NE2 3.28Å; L88-Q100 PolarHBondContact O-OE1 3.13Å
89	T	92.6	Very high	93.3	Very high	126 Å²	126	80.5 Å²	80.5	77%	0.773	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-99.4	127.8	174.4	-51.5	0	0	0	0	108.6
90	F	89.7	Confident	93.3	Very high	63 Å²	63	78.2 Å²	78.2	28%	0.276	38%	0.383	S	S	.	.			trans	-122.3	140.4	175.1	-55.6	-73.9	0	0	0	108.6	L68 L82 L88 Y95	L68-F90 HydrophobicContact CD2-CE1 4Å; L68-F90 HydrophobicContact CD2-CZ 3.69Å; L82-F90 HydrophobicContact CD1-CE2 3.9Å; L82-F90 HydrophobicContact CD1-CZ 3.77Å; L88-F90 HydrophobicContact CB-CE1 4.33Å; L88-F90 HydrophobicContact CB-CE2 3.73Å; L88-F90 HydrophobicContact CB-CZ 3.62Å; L88-F90 HydrophobicContact CD1-CZ 3.83Å; L88-F90 HydrophobicContact CG-CZ 4.38Å; F90-Y95 VanDerWaalsContact CB-CB 3.4Å; F90-Y95 HydrophobicContact CB-CD1 4.1Å; F90-Y95 HydrophobicContact CB-CD2 4.29Å; F90-Y95 HydrophobicContact CB-CG 3.69Å; F90-Y95 AromaticContact CD1-CD1 3.38Å; F90-Y95 HydrophobicContact CD1-CD1 3.38Å; F90-Y95 AromaticContact CD1-CE1 3.75Å; F90-Y95 HydrophobicContact CD1-CE1 3.75Å; F90-Y95 AromaticContact CD1-CG 3.88Å; F90-Y95 HydrophobicContact CD1-CG 3.88Å; F90-Y95 AromaticContact CD2-CD1 3.96Å; F90-Y95 HydrophobicContact CD2-CD1 3.96Å; F90-Y95 HydrophobicContact CD2-CG 4.22Å; F90-Y95 AromaticContact CE1-CD1 3.66Å; F90-Y95 HydrophobicContact CE1-CD1 3.66Å; F90-Y95 AromaticContact CE1-CE1 3.83Å; F90-Y95 HydrophobicContact CE1-CE1 3.83Å; F90-Y95 HydrophobicContact CE2-CD1 4.19Å; F90-Y95 AromaticContact CG-CD1 3.55Å; F90-Y95 HydrophobicContact CG-CD1 3.55Å; F90-Y95 HydrophobicContact CG-CE1 4.36Å; F90-Y95 AromaticContact CG-CG 3.68Å; F90-Y95 HydrophobicContact CG-CG 3.68Å; F90-Y95 HydrophobicContact CZ-CD1 4.05Å; F90-Y95 HydrophobicContact CZ-CE1 4.5Å
91	N	83.2	Confident	93.3	Very high	155 Å²	155	81.7 Å²	81.7	83%	0.829	40%	0.398	S	S	*	.			trans	-100.1	-15	-178.7	-62.1	-20.2	0	0	0	112.4
92	E	87.4	Confident	93.3	Very high	123 Å²	123	84.9 Å²	84.9	58%	0.575	42%	0.418	S	S	*	.	S	Bend	trans	-90.9	138.5	-175.3	-68.4	168.4	-131.1	0	0	111.2	A94 Y95	E92-A94 PolarHBondContact O-N 3.12Å; E92-Y95 HydrophobicContact CB-CD2 3.65Å; E92-Y95 HydrophobicContact CB-CE2 3.88Å; E92-Y95 HydrophobicContact CG-CE2 4.49Å; E92-Y95 PolarHBondContact O-N 3.25Å; E92-Y95 VanDerWaalsContact O-N 3.09Å; E92-Y95 WeakPolarHBondContact OE2-CE2 3.27Å
93	E	85.6	Confident	93.3	Very high	129 Å²	129	84.9 Å²	84.9	60%	0.603	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-54.8	-36.1	-178.7	-71	-65.9	137.3	0	0	113.4	Y95 K96	E93-Y95 PolarHBondContact O-N 2.79Å; E93-K96 WeakPolarHBondContact O-CB 3.38Å; E93-K96 PolarHBondContact O-N 2.82Å; E93-K96 WeakPolarHBondContact OE1-CE 3.49Å; E93-K96 IonicContact OE1-NZ 2.74Å; E93-K96 PolarHBondContact OE1-NZ 2.93Å; E93-K96 VanDerWaalsContact OE2-CD 3.23Å; E93-K96 WeakPolarHBondContact OE2-CD 3.26Å; E93-K96 WeakPolarHBondContact OE2-CE 3.42Å; E93-K96 IonicContact OE2-NZ 3.82Å; E93-K96 PolarHBondContact OE2-NZ 3.09Å
94	A	85.2	Confident	93.2	Very high	59 Å²	59	88 Å²	88	49%	0.488	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-57.9	-22.9	-179.7	0	0	0	0	0	113.6	E92	E92-A94 PolarHBondContact O-N 3.12Å
95	Y	89.8	Confident	93.2	Very high	29 Å²	29	87.9 Å²	87.9	11%	0.114	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-92.5	-6.4	-178.3	-64.5	-102.3	0	0	0	113.4	L68 L72 F90 E92 E93 N97 V98	L68-Y95 HydrophobicContact CD2-CD1 3.96Å; L68-Y95 HydrophobicContact CD2-CE1 3.74Å; L68-Y95 HydrophobicContact CG-CD1 4.33Å; L68-Y95 HydrophobicContact CG-CE1 3.86Å; L72-Y95 HydrophobicContact CD1-CD1 3.51Å; L72-Y95 HydrophobicContact CD1-CD2 4.16Å; L72-Y95 HydrophobicContact CD1-CE1 3.52Å; L72-Y95 HydrophobicContact CD1-CE2 4.17Å; L72-Y95 HydrophobicContact CD1-CG 3.85Å; F90-Y95 VanDerWaalsContact CB-CB 3.4Å; F90-Y95 HydrophobicContact CB-CD1 4.1Å; F90-Y95 HydrophobicContact CB-CD2 4.29Å; F90-Y95 HydrophobicContact CB-CG 3.69Å; F90-Y95 AromaticContact CD1-CD1 3.38Å; F90-Y95 HydrophobicContact CD1-CD1 3.38Å; F90-Y95 AromaticContact CD1-CE1 3.75Å; F90-Y95 HydrophobicContact CD1-CE1 3.75Å; F90-Y95 AromaticContact CD1-CG 3.88Å; F90-Y95 HydrophobicContact CD1-CG 3.88Å; F90-Y95 AromaticContact CD2-CD1 3.96Å; F90-Y95 HydrophobicContact CD2-CD1 3.96Å; F90-Y95 HydrophobicContact CD2-CG 4.22Å; F90-Y95 AromaticContact CE1-CD1 3.66Å; F90-Y95 HydrophobicContact CE1-CD1 3.66Å; F90-Y95 AromaticContact CE1-CE1 3.83Å; F90-Y95 HydrophobicContact CE1-CE1 3.83Å; F90-Y95 HydrophobicContact CE2-CD1 4.19Å; F90-Y95 AromaticContact CG-CD1 3.55Å; F90-Y95 HydrophobicContact CG-CD1 3.55Å; F90-Y95 HydrophobicContact CG-CE1 4.36Å; F90-Y95 AromaticContact CG-CG 3.68Å; F90-Y95 HydrophobicContact CG-CG 3.68Å; F90-Y95 HydrophobicContact CZ-CD1 4.05Å; F90-Y95 HydrophobicContact CZ-CE1 4.5Å; E92-Y95 HydrophobicContact CB-CD2 3.65Å; E92-Y95 HydrophobicContact CB-CE2 3.88Å; E92-Y95 HydrophobicContact CG-CE2 4.49Å; E92-Y95 PolarHBondContact O-N 3.25Å; E92-Y95 VanDerWaalsContact O-N 3.09Å; E92-Y95 WeakPolarHBondContact OE2-CE2 3.27Å; E93-Y95 PolarHBondContact O-N 2.79Å; Y95-N97 PolarHBondContact O-N 3.38Å; Y95-V98 WeakPolarHBondContact O-CB 3.49Å; Y95-V98 PolarHBondContact O-N 3.46Å; Y95-V98 VanDerWaalsContact O-N 3.1Å
96	K	87.8	Confident	93.2	Very high	140 Å²	140	83.5 Å²	83.5	61%	0.609	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-31	-178.3	-75.3	-172.5	177	171.6	0	113.3	E93 V98	E93-K96 WeakPolarHBondContact O-CB 3.38Å; E93-K96 PolarHBondContact O-N 2.82Å; E93-K96 WeakPolarHBondContact OE1-CE 3.49Å; E93-K96 IonicContact OE1-NZ 2.74Å; E93-K96 PolarHBondContact OE1-NZ 2.93Å; E93-K96 VanDerWaalsContact OE2-CD 3.23Å; E93-K96 WeakPolarHBondContact OE2-CD 3.26Å; E93-K96 WeakPolarHBondContact OE2-CE 3.42Å; E93-K96 IonicContact OE2-NZ 3.82Å; E93-K96 PolarHBondContact OE2-NZ 3.09Å; K96-V98 VanDerWaalsContact C-N 3.31Å
97	N	89.6	Confident	93.3	Very high	143 Å²	143	83 Å²	83	77%	0.765	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	4.6	-178.8	-61.3	-26	0	0	0	113	Y95 N99	Y95-N97 PolarHBondContact O-N 3.38Å; N97-N99 PolarHBondContact O-N 3.42Å
98	V	96.6	Very high	93.3	Very high	14 Å²	14	75.7 Å²	75.7	9%	0.085	39%	0.387	C	S	.	.			trans	-81.5	116.8	178.1	177.7	0	0	0	0	109.5	L68 L72 V80 L82 Y95 K96	L68-V98 HydrophobicContact CD1-CG1 4.5Å; L68-V98 HydrophobicContact CD1-CG2 4.31Å; L72-V98 HydrophobicContact CD1-CG2 4.01Å; L72-V98 HydrophobicContact CD2-CG2 3.93Å; V80-V98 HydrophobicContact CG1-CG1 4.35Å; L82-V98 HydrophobicContact CD1-CG1 3.76Å; L82-V98 HydrophobicContact CD2-CG1 3.9Å; L82-V98 HydrophobicContact CG-CG1 3.5Å; Y95-V98 WeakPolarHBondContact O-CB 3.49Å; Y95-V98 PolarHBondContact O-N 3.46Å; Y95-V98 VanDerWaalsContact O-N 3.1Å; K96-V98 VanDerWaalsContact C-N 3.31Å
99	N	97.8	Very high	93.4	Very high	70 Å²	70	79.2 Å²	79.2	37%	0.374	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	144.9	173.4	-60.9	101.4	0	0	0	110	V80 T81 L82 N97	V80-N99 PolarHBondContact O-N 2.92Å; T81-N99 CarbonylContact C-O 3.57Å; T81-N99 WeakPolarHBondContact CA-O 3.2Å; T81-N99 HydrophobicContact CG2-CB 4.12Å; L82-N99 PolarHBondContact N-O 2.99Å; N97-N99 PolarHBondContact O-N 3.42Å
100	Q	98.3	Very high	93.7	Very high	50 Å²	50	79.1 Å²	79.1	23%	0.234	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	116.5	177.7	-62	-169.5	52.6	0	0	110.2	L82 L88	L82-Q100 HydrophobicContact CB-CG 4.33Å; L82-Q100 HydrophobicContact CD1-CG 4.16Å; L82-Q100 HydrophobicContact CG-CG 4.35Å; L82-Q100 WeakPolarHBondContact O-CA 3.27Å; L88-Q100 PolarHBondContact O-NE2 3.28Å; L88-Q100 PolarHBondContact O-OE1 3.13Å
101	E	98.4	Very high	94.1	Very high	82 Å²	82	80.1 Å²	80.1	38%	0.383	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	110.8	173.3	-62.7	-60.1	155.7	0	0	108.6	T81 L82 I83 G84 V103 A114	T81-E101 HydrophobicContact CG2-CG 3.79Å; L82-E101 PolarHBondContact O-N 2.78Å; I83-E101 HydrophobicContact CG1-CB 4.24Å; G84-E101 PolarHBondContact N-O 3.46Å; G84-E101 VanDerWaalsContact N-O 3.09Å; E101-V103 HydrophobicContact CB-CG1 4.42Å; E101-A114 HydrophobicContact CB-CB 3.77Å; E101-A114 HydrophobicContact CG-CB 3.81Å
102	V	98.4	Very high	94.8	Very high	70 Å²	70	74.3 Å²	74.3	42%	0.424	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	114.2	177	-177	0	0	0	0	108.5	G84 K87	G84-V102 VanDerWaalsContact O-CA 3.3Å; G84-V102 WeakPolarHBondContact O-CA 3.48Å; K87-V102 HydrophobicContact CB-CG2 4.05Å
103	V	98.3	Very high	95.3	Very high	7 Å²	7	72.3 Å²	72.3	4%	0.042	37%	0.373	C	S	.	.			trans	-121.1	154.5	-172.3	-55.6	0	0	0	0	111.9	I83 G84 R85 E101 F105 L108 Y111 A114	I83-V103 HydrophobicContact CG2-CG1 3.89Å; I83-V103 HydrophobicContact CG2-CG2 3.86Å; G84-V103 PolarHBondContact O-N 3.46Å; R85-V103 WeakPolarHBondContact CA-O 3.38Å; E101-V103 HydrophobicContact CB-CG1 4.42Å; V103-F105 HydrophobicContact CG2-CD2 4.26Å; V103-F105 HydrophobicContact CG2-CE2 4Å; V103-F105 HydrophobicContact CG2-CZ 4.13Å; V103-L108 HydrophobicContact CB-CD1 3.97Å; V103-L108 HydrophobicContact CG2-CD1 3.64Å; V103-Y111 HydrophobicContact CB-CD1 4Å; V103-Y111 HydrophobicContact CB-CD2 4.2Å; V103-Y111 HydrophobicContact CB-CG 3.81Å; V103-Y111 HydrophobicContact CG1-CD1 3.75Å; V103-Y111 HydrophobicContact CG1-CG 3.77Å; V103-A114 HydrophobicContact CG1-CB 4.24Å
104	D	98	Very high	95.9	Very high	67 Å²	67	66.4 Å²	66.4	36%	0.358	35%	0.347	S	S	.	.			trans	-94.7	115.2	164.7	-173.5	-3	0	0	0	109.3	E106 K107 L108 Y111	D104-E106 PolarHBondContact O-N 2.88Å; D104-E106 PolarHBondContact OD1-N 2.97Å; D104-K107 CarbonylContact O-C 3.54Å; D104-K107 VanDerWaalsContact O-C 3.29Å; D104-K107 PolarHBondContact O-N 3.09Å; D104-L108 WeakPolarHBondContact O-CA 3.36Å; D104-L108 PolarHBondContact O-N 2.96Å; D104-L108 VanDerWaalsContact O-N 3.16Å; D104-Y111 HydrophobicContact CB-CE2 3.84Å
105	F	97.4	Very high	96.5	Very high	16 Å²	16	63.6 Å²	63.6	7%	0.07	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-70.7	-19.9	-179.7	-78.6	-81.5	0	0	0	113.4	L57 R85 V103 K107 L108 L125 Y144	L57-F105 HydrophobicContact CD2-CE1 4.13Å; L57-F105 HydrophobicContact CD2-CZ 4.03Å; R85-F105 HydrophobicContact CB-CD2 4.08Å; R85-F105 HydrophobicContact CB-CE2 4.18Å; V103-F105 HydrophobicContact CG2-CD2 4.26Å; V103-F105 HydrophobicContact CG2-CE2 4Å; V103-F105 HydrophobicContact CG2-CZ 4.13Å; F105-K107 PolarHBondContact O-N 2.92Å; F105-L108 HydrophobicContact CD1-CD1 3.95Å; F105-L108 HydrophobicContact CD1-CD2 4.04Å; F105-L108 HydrophobicContact CE1-CD1 4.21Å; F105-L108 HydrophobicContact CE1-CD2 4.33Å; F105-L108 HydrophobicContact CG-CD1 4.49Å; F105-L125 HydrophobicContact CE1-CD1 3.9Å; F105-L125 HydrophobicContact CZ-CD1 4.07Å; F105-L125 HydrophobicContact CZ-CD2 4.37Å; F105-Y144 HydrophobicContact CB-CD1 3.81Å; F105-Y144 HydrophobicContact CB-CD2 3.68Å; F105-Y144 HydrophobicContact CB-CE1 3.7Å; F105-Y144 HydrophobicContact CB-CE2 3.58Å; F105-Y144 HydrophobicContact CB-CG 3.8Å; F105-Y144 HydrophobicContact CD1-CD1 4.48Å; F105-Y144 HydrophobicContact CD1-CD2 4.15Å; F105-Y144 AromaticContact CD1-CG 3.94Å; F105-Y144 HydrophobicContact CD1-CG 3.94Å; F105-Y144 AromaticContact CG-CD2 3.94Å; F105-Y144 HydrophobicContact CG-CD2 3.94Å; F105-Y144 HydrophobicContact CG-CE2 4.25Å; F105-Y144 HydrophobicContact CG-CG 4.1Å; F105-Y144 VanDerWaalsContact O-CE1 3.32Å; F105-Y144 WeakPolarHBondContact O-CE1 3.43Å
106	E	97.2	Very high	96.9	Very high	100 Å²	100	67.8 Å²	67.8	47%	0.467	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-75.1	-16.6	174.5	-66.8	-68.6	179.8	0	0	112.2	D104 R139 Y144	D104-E106 PolarHBondContact O-N 2.88Å; D104-E106 PolarHBondContact OD1-N 2.97Å; E106-R139 IonicContact OE1-NE 3.01Å; E106-R139 IonicContact OE2-CZ 2.9Å; E106-R139 IonicContact OE2-NE 3.95Å; E106-R139 PolarHBondContact OE2-NE 2.9Å; E106-R139 VanDerWaalsContact OE2-NE 3.14Å; E106-R139 IonicContact OE2-NH2 3.15Å; E106-R139 PolarHBondContact OE2-NH2 2.95Å; E106-Y144 WeakPolarHBondContact CG-OH 3.4Å; E106-Y144 PolarHBondContact OE1-OH 3.01Å
107	K	97.1	Very high	97.4	Very high	122 Å²	122	64 Å²	64	53%	0.53	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-134.6	41.9	-179.8	-59.6	-177.7	-178.4	178.8	0	111.4	D104 F105 E109 D110 Y111	D104-K107 CarbonylContact O-C 3.54Å; D104-K107 VanDerWaalsContact O-C 3.29Å; D104-K107 PolarHBondContact O-N 3.09Å; F105-K107 PolarHBondContact O-N 2.92Å; K107-E109 PolarHBondContact O-N 3.16Å; K107-E109 VanDerWaalsContact O-N 3.09Å; K107-D110 WeakPolarHBondContact O-CB 3.4Å; K107-D110 PolarHBondContact O-N 3.05Å; K107-Y111 WeakPolarHBondContact O-CD2 3.49Å
108	L	96.9	Very high	97.8	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.005	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-62.6	-24.7	-166.9	-163.7	65.4	0	0	0	112.9	V103 D104 F105 D110 Y111 F115 K147 S148 L151	V103-L108 HydrophobicContact CB-CD1 3.97Å; V103-L108 HydrophobicContact CG2-CD1 3.64Å; D104-L108 WeakPolarHBondContact O-CA 3.36Å; D104-L108 PolarHBondContact O-N 2.96Å; D104-L108 VanDerWaalsContact O-N 3.16Å; F105-L108 HydrophobicContact CD1-CD1 3.95Å; F105-L108 HydrophobicContact CD1-CD2 4.04Å; F105-L108 HydrophobicContact CE1-CD1 4.21Å; F105-L108 HydrophobicContact CE1-CD2 4.33Å; F105-L108 HydrophobicContact CG-CD1 4.49Å; L108-D110 VanDerWaalsContact C-N 3.27Å; L108-D110 PolarHBondContact O-N 3.48Å; L108-Y111 CarbonylContact O-C 3.59Å; L108-Y111 WeakPolarHBondContact O-CA 3.48Å; L108-Y111 PolarHBondContact O-N 3.34Å; L108-F115 HydrophobicContact CD1-CE2 3.98Å; L108-F115 HydrophobicContact CD1-CZ 4.21Å; L108-F115 HydrophobicContact CD2-CE2 4.19Å; L108-F115 HydrophobicContact CD2-CZ 4.01Å; L108-F115 HydrophobicContact CG-CE2 4.02Å; L108-F115 HydrophobicContact CG-CZ 4.3Å; L108-K147 HydrophobicContact CB-CG 4.06Å; L108-K147 HydrophobicContact CD2-CB 4.14Å; L108-K147 HydrophobicContact CD2-CG 3.89Å; L108-K147 HydrophobicContact CG-CG 4.5Å; L108-S148 WeakPolarHBondContact CD2-OG 3.23Å; L108-L151 HydrophobicContact CB-CD1 4.17Å; L108-L151 HydrophobicContact CD2-CD1 3.86Å; L108-L151 HydrophobicContact CG-CD1 3.59Å; L108-L151 WeakPolarHBondContact O-CD1 3.34Å
109	E	96.3	Very high	97.9	Very high	98 Å²	98	58.9 Å²	58.9	46%	0.458	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-56.6	-37.3	173.5	-66.2	80.5	-177.6	0	0	113	K107 Y111 A112 K147	K107-E109 PolarHBondContact O-N 3.16Å; K107-E109 VanDerWaalsContact O-N 3.09Å; E109-Y111 PolarHBondContact O-N 2.82Å; E109-Y111 VanDerWaalsContact O-N 3.12Å; E109-A112 WeakPolarHBondContact O-CB 3.31Å; E109-A112 PolarHBondContact O-N 3.07Å; E109-A112 VanDerWaalsContact O-N 3.16Å; E109-K147 VanDerWaalsContact CD-CE 3.48Å; E109-K147 WeakPolarHBondContact OE1-CD 3.22Å; E109-K147 WeakPolarHBondContact OE1-CE 3.07Å; E109-K147 IonicContact OE1-NZ 4Å; E109-K147 PolarHBondContact OE1-NZ 3.43Å
110	D	98.1	Very high	97.9	Very high	123 Å²	123	55.9 Å²	55.9	66%	0.658	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-65.3	-16.3	178.3	-64.4	-18.4	0	0	0	111.8	K107 L108	K107-D110 WeakPolarHBondContact O-CB 3.4Å; K107-D110 PolarHBondContact O-N 3.05Å; L108-D110 VanDerWaalsContact C-N 3.27Å; L108-D110 PolarHBondContact O-N 3.48Å
111	Y	98.3	Very high	98	Very high	85 Å²	85	53.5 Å²	53.5	33%	0.333	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-111.3	20.9	-178.7	-59.9	-91.6	0	0	0	112.5	V103 D104 K107 L108 E109 S113 A114	V103-Y111 HydrophobicContact CB-CD1 4Å; V103-Y111 HydrophobicContact CB-CD2 4.2Å; V103-Y111 HydrophobicContact CB-CG 3.81Å; V103-Y111 HydrophobicContact CG1-CD1 3.75Å; V103-Y111 HydrophobicContact CG1-CG 3.77Å; D104-Y111 HydrophobicContact CB-CE2 3.84Å; K107-Y111 WeakPolarHBondContact O-CD2 3.49Å; L108-Y111 CarbonylContact O-C 3.59Å; L108-Y111 WeakPolarHBondContact O-CA 3.48Å; L108-Y111 PolarHBondContact O-N 3.34Å; E109-Y111 PolarHBondContact O-N 2.82Å; E109-Y111 VanDerWaalsContact O-N 3.12Å; Y111-S113 PolarHBondContact O-N 3.44Å; Y111-A114 VanDerWaalsContact O-CB 3.25Å; Y111-A114 WeakPolarHBondContact O-CB 3.49Å; Y111-A114 PolarHBondContact O-N 2.81Å
112	A	98	Very high	98	Very high	32 Å²	32	49.6 Å²	49.6	26%	0.264	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-53.3	-30.5	-179.9	0	0	0	0	0	113.6	E109 A114 F115 L151	E109-A112 WeakPolarHBondContact O-CB 3.31Å; E109-A112 PolarHBondContact O-N 3.07Å; E109-A112 VanDerWaalsContact O-N 3.16Å; A112-A114 PolarHBondContact O-N 2.89Å; A112-F115 PolarHBondContact O-N 3.47Å; A112-L151 HydrophobicContact CB-CD2 3.92Å
113	S	98.2	Very high	98	Very high	82 Å²	82	46.2 Å²	46.2	57%	0.573	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-60.1	-30.2	175.9	55.7	0	0	0	0	113.5	Y111 F115 Q116	Y111-S113 PolarHBondContact O-N 3.44Å; S113-F115 PolarHBondContact O-N 2.99Å; S113-Q116 PolarHBondContact O-N 2.83Å
114	A	98.4	Very high	98	Very high	5 Å²	5	46.8 Å²	46.8	4%	0.041	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-61.7	-25.7	178.1	0	0	0	0	0	112.6	I83 E101 V103 Y111 A112 H118	I83-A114 HydrophobicContact CD1-CB 4.27Å; I83-A114 WeakPolarHBondContact CD1-O 3.36Å; E101-A114 HydrophobicContact CB-CB 3.77Å; E101-A114 HydrophobicContact CG-CB 3.81Å; V103-A114 HydrophobicContact CG1-CB 4.24Å; Y111-A114 VanDerWaalsContact O-CB 3.25Å; Y111-A114 WeakPolarHBondContact O-CB 3.49Å; Y111-A114 PolarHBondContact O-N 2.81Å; A112-A114 PolarHBondContact O-N 2.89Å; A114-H118 PolarHBondContact O-NE2 3.29Å
115	F	98.7	Very high	97.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-94.9	-3.1	-177.5	-65.7	-90.1	0	0	0	113.9	F55 L57 I83 L108 A112 S113 L151 A152	F55-F115 HydrophobicContact CE2-CD1 4.38Å; F55-F115 HydrophobicContact CE2-CE1 4.34Å; F55-F115 HydrophobicContact CZ-CD1 4.35Å; L57-F115 HydrophobicContact CD1-CE1 4.35Å; L57-F115 HydrophobicContact CD2-CE1 4.2Å; L57-F115 HydrophobicContact CD2-CZ 4.22Å; I83-F115 HydrophobicContact CD1-CD1 3.75Å; I83-F115 HydrophobicContact CD1-CD2 4.41Å; I83-F115 HydrophobicContact CD1-CE1 3.75Å; I83-F115 HydrophobicContact CD1-CE2 4.41Å; I83-F115 HydrophobicContact CD1-CG 4.1Å; I83-F115 HydrophobicContact CD1-CZ 4.09Å; I83-F115 HydrophobicContact CG2-CE1 4.46Å; I83-F115 HydrophobicContact CG2-CE2 4.25Å; I83-F115 HydrophobicContact CG2-CZ 3.89Å; L108-F115 HydrophobicContact CD1-CE2 3.98Å; L108-F115 HydrophobicContact CD1-CZ 4.21Å; L108-F115 HydrophobicContact CD2-CE2 4.19Å; L108-F115 HydrophobicContact CD2-CZ 4.01Å; L108-F115 HydrophobicContact CG-CE2 4.02Å; L108-F115 HydrophobicContact CG-CZ 4.3Å; A112-F115 PolarHBondContact O-N 3.47Å; S113-F115 PolarHBondContact O-N 2.99Å; F115-L151 HydrophobicContact CB-CB 4.09Å; F115-L151 HydrophobicContact CD1-CB 4.27Å; F115-L151 HydrophobicContact CD2-CB 3.72Å; F115-L151 HydrophobicContact CD2-CD1 3.93Å; F115-L151 HydrophobicContact CD2-CG 4.48Å; F115-L151 HydrophobicContact CE2-CB 4.19Å; F115-L151 HydrophobicContact CE2-CD1 3.79Å; F115-L151 HydrophobicContact CG-CB 3.76Å; F115-A152 HydrophobicContact CD1-CB 4.13Å
116	Q	98.1	Very high	97.5	Very high	117 Å²	117	46.3 Å²	46.3	55%	0.547	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	138.1	-174.4	-67	179.3	5	0	0	113.1	S113 H118	S113-Q116 PolarHBondContact O-N 2.83Å; Q116-H118 VanDerWaalsContact C-N 3.35Å; Q116-H118 PolarHBondContact O-N 3.38Å
117	G	96.9	Very high	97.1	Very high	61 Å²	61	43 Å²	43	63%	0.629	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	16.8	167.9	0	0	0	0	0	115.4	S53 G155	S53-G117 PolarHBondContact OG-O 2.67Å; S53-G117 VanDerWaalsContact OG-O 3.09Å; G117-G155 PolarHBondContact N-O 3.46Å
118	H	98.6	Very high	96.3	Very high	7 Å²	7	38.7 Å²	38.7	3%	0.032	24%	0.235	C	C	.	.			trans	-94.1	132.6	172.8	-57.2	-65.6	0	0	0	110.9	S53 F55 T81 A114 Q116 C157	S53-H118 VanDerWaalsContact OG-CA 3.27Å; S53-H118 WeakPolarHBondContact OG-CA 3.44Å; F55-H118 HydrophobicContact CD1-CB 3.61Å; F55-H118 AromaticContact CD1-CD2 3.77Å; F55-H118 AromaticContact CD1-CG 3.82Å; F55-H118 HydrophobicContact CE1-CB 4.35Å; T81-H118 PolarHBondContact OG1-CE1 2.81Å; T81-H118 VanDerWaalsContact OG1-CE1 3.25Å; A114-H118 PolarHBondContact O-NE2 3.29Å; Q116-H118 VanDerWaalsContact C-N 3.35Å; Q116-H118 PolarHBondContact O-N 3.38Å; H118-C157 WeakPolarHBondContact O-CA 3.29Å
119	D	98.6	Very high	95.5	Very high	42 Å²	42	46.8 Å²	46.8	23%	0.225	27%	0.266	C	S	.	.	S	Bend	trans	-74.2	-41.1	176.9	-66.8	-87.2	0	0	0	112.4	K52 S53 K158 H159	K52-D119 WeakPolarHBondContact CA-OD2 3.44Å; K52-D119 HydrophobicContact CB-CB 4.32Å; K52-D119 HydrophobicContact CD-CB 3.79Å; K52-D119 WeakPolarHBondContact CD-OD1 3.46Å; K52-D119 WeakPolarHBondContact CD-OD2 3.35Å; K52-D119 IonicContact NZ-OD1 3.71Å; K52-D119 PolarHBondContact NZ-OD1 2.77Å; S53-D119 PolarHBondContact N-OD2 3.13Å; S53-D119 PolarHBondContact O-N 3.48Å; S53-D119 PolarHBondContact OG-N 2.9Å; S53-D119 VanDerWaalsContact OG-N 3.12Å; S53-D119 PolarHBondContact OG-OD2 3.1Å; D119-K158 PolarHBondContact O-N 3.23Å; D119-H159 PolarHBondContact O-N 3.41Å; D119-H159 VanDerWaalsContact O-N 3.14Å
120	V	98.8	Very high	94.6	Very high	6 Å²	6	46.9 Å²	46.9	4%	0.036	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	138.8	-172.9	-175.8	0	0	0	0	111	S53 V54 F55 F77 F122 H159 V247	S53-V120 PolarHBondContact O-N 3.1Å; S53-V120 VanDerWaalsContact O-N 3.09Å; V54-V120 CarbonylContact C-O 3.55Å; V54-V120 VanDerWaalsContact CA-O 3.26Å; V54-V120 WeakPolarHBondContact CA-O 3.37Å; V54-V120 HydrophobicContact CB-CB 4.46Å; V54-V120 HydrophobicContact CG2-CB 4.2Å; V54-V120 HydrophobicContact CG2-CG1 4.27Å; F55-V120 PolarHBondContact N-O 2.76Å; F77-V120 HydrophobicContact CE1-CB 3.92Å; F77-V120 HydrophobicContact CE1-CG1 4.43Å; F77-V120 HydrophobicContact CE1-CG2 3.79Å; F77-V120 HydrophobicContact CZ-CB 4.27Å; F77-V120 HydrophobicContact CZ-CG1 4.29Å; F77-V120 HydrophobicContact CZ-CG2 4.34Å; V120-F122 HydrophobicContact CG1-CD2 4.2Å; V120-F122 HydrophobicContact CG1-CE2 3.72Å; V120-F122 HydrophobicContact CG1-CZ 4.21Å; V120-H159 CarbonylContact C-O 3.58Å; V120-H159 WeakPolarHBondContact CA-O 3.35Å; V120-H159 HydrophobicContact CG1-CB 4.48Å; V120-H159 HydrophobicContact CG2-CB 4.28Å; V120-V247 HydrophobicContact CG1-CG2 3.9Å; V120-V247 HydrophobicContact CG2-CG2 4.3Å
121	G	98.8	Very high	93.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	134.1	173.4	0	0	0	0	0	112.4	H159 N161	G121-H159 PolarHBondContact N-O 3Å; G121-N161 WeakPolarHBondContact O-CB 3.49Å; G121-N161 PolarHBondContact O-N 3.21Å; G121-N161 PolarHBondContact O-ND2 2.74Å
122	F	98.9	Very high	93.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	123.6	168.8	-70.9	-82.2	0	0	0	111	V54 F55 I56 L57 L67 I71 F77 V120 N161 M243 L244 V247	V54-F122 HydrophobicContact CG2-CD2 3.62Å; V54-F122 HydrophobicContact CG2-CE2 3.9Å; F55-F122 PolarHBondContact O-N 3.19Å; I56-F122 WeakPolarHBondContact CA-O 3.4Å; L57-F122 PolarHBondContact N-O 3.38Å; L67-F122 HydrophobicContact CD2-CB 3.62Å; L67-F122 HydrophobicContact CD2-CD1 3.97Å; L67-F122 HydrophobicContact CD2-CD2 4.16Å; L67-F122 HydrophobicContact CD2-CG 3.66Å; I71-F122 HydrophobicContact CD1-CD2 4.47Å; I71-F122 HydrophobicContact CD1-CE2 4.38Å; F77-F122 HydrophobicContact CE2-CE2 4.42Å; F77-F122 HydrophobicContact CZ-CE2 4.22Å; V120-F122 HydrophobicContact CG1-CD2 4.2Å; V120-F122 HydrophobicContact CG1-CE2 3.72Å; V120-F122 HydrophobicContact CG1-CZ 4.21Å; F122-N161 HydrophobicContact CD1-CB 3.3Å; F122-N161 HydrophobicContact CE1-CB 3.53Å; F122-N161 VanDerWaalsContact CE1-CG 3.44Å; F122-N161 HydrophobicContact CG-CB 4.13Å; F122-M243 HydrophobicContact CD1-CE 3.32Å; F122-M243 HydrophobicContact CE1-CB 4.1Å; F122-M243 HydrophobicContact CE1-CE 3.77Å; F122-M243 HydrophobicContact CG-CE 4.29Å; F122-L244 HydrophobicContact CZ-CD2 4.36Å; F122-V247 HydrophobicContact CZ-CB 4.21Å; F122-V247 HydrophobicContact CZ-CG2 4.15Å
123	C	98.8	Very high	92.8	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	103.9	174.4	-174.8	0	0	0	0	111.1	L57 F160 N161 L162 V163	L57-C123 HydrophobicContact CD1-CB 4.25Å; C123-F160 HydrophobicContact CB-CE1 4.14Å; C123-F160 HydrophobicContact CB-CE2 4.5Å; C123-F160 HydrophobicContact CB-CZ 3.7Å; C123-N161 PolarHBondContact N-O 2.93Å; C123-L162 HydrophobicContact CB-CD1 4.04Å; C123-V163 PolarHBondContact O-N 2.99Å
124	C	98	Very high	92.4	Very high	18 Å²	18	43.5 Å²	43.5	12%	0.122	27%	0.273	C	S	.	.			trans	-108.2	19.7	173.7	-56.9	0	0	0	0	112	L57	L57-C124 WeakPolarHBondContact O-CA 3.38Å; L57-C124 WeakPolarHBondContact O-CB 3.26Å; L57-C124 PolarHBondContact O-N 3.05Å
125	L	96.1	Very high	92.3	Very high	25 Å²	25	51.4 Å²	51.4	13%	0.131	31%	0.309	C	S	.	.			trans	-65.9	142.1	174.6	-68	174	0	0	0	110.7	L57 F105 V145	L57-L125 HydrophobicContact CB-CD1 3.99Å; L57-L125 HydrophobicContact CB-CD2 4.4Å; L57-L125 HydrophobicContact CB-CG 3.83Å; L57-L125 HydrophobicContact CD2-CD1 4.43Å; F105-L125 HydrophobicContact CE1-CD1 3.9Å; F105-L125 HydrophobicContact CZ-CD1 4.07Å; F105-L125 HydrophobicContact CZ-CD2 4.37Å; L125-V145 HydrophobicContact CB-CG2 4.1Å; L125-V145 HydrophobicContact CD1-CG2 4.45Å
126	G	89.3	Confident	92.1	Very high	49 Å²	49	52.5 Å²	52.5	51%	0.505	32%	0.32	S	S	.	.			trans	179.4	144.6	171.3	0	0	0	0	0	110.8	D141	G126-D141 WeakPolarHBondContact CA-OD1 3.33Å; G126-D141 WeakPolarHBondContact CA-OD2 3.35Å
127	T	87.6	Confident	91.8	Very high	30 Å²	30	47 Å²	47	18%	0.184	30%	0.295	C	S	.	.			trans	-122.8	-175.9	170.1	-165.1	0	0	0	0	109.8	A132 F137 V140 D141	T127-A132 HydrophobicContact CG2-CB 3.65Å; T127-F137 HydrophobicContact CG2-CB 4.17Å; T127-F137 HydrophobicContact CG2-CD2 3.97Å; T127-V140 HydrophobicContact CG2-CB 3.75Å; T127-V140 HydrophobicContact CG2-CG1 4.06Å; T127-V140 HydrophobicContact CG2-CG2 4.11Å; T127-D141 WeakPolarHBondContact CG2-OD2 3.23Å; T127-D141 PolarHBondContact N-OD2 3.47Å
128	T	80.3	Confident	91.8	Very high	32 Å²	32	45.4 Å²	45.4	20%	0.196	27%	0.273	C	S	.	.			trans	-123.3	150.1	171.6	65.5	0	0	0	0	109.4	A130 K131 A132	T128-A130 PolarHBondContact O-N 3.17Å; T128-A130 VanDerWaalsContact O-N 3.15Å; T128-K131 PolarHBondContact O-N 3.48Å; T128-K131 WeakPolarHBondContact OG1-CG 3.42Å; T128-K131 PolarHBondContact OG1-N 3.3Å; T128-A132 PolarHBondContact O-N 3.37Å
129	R	80.3	Confident	91.8	Very high	170 Å²	170	49.4 Å²	49.4	64%	0.642	29%	0.287	S	S	*	.	H	α-helix	trans	-53.2	-34.6	171.5	-178.2	179.8	173	-174.5	-0.5	112.1	K131 G133	R129-K131 VanDerWaalsContact C-N 3.26Å; R129-K131 PolarHBondContact O-N 3.48Å; R129-G133 WeakPolarHBondContact CA-O 3.49Å; R129-G133 VanDerWaalsContact O-CA 3.22Å; R129-G133 WeakPolarHBondContact O-CA 3.48Å; R129-G133 PolarHBondContact O-N 2.94Å
130	A	77.4	Confident	91.7	Very high	100 Å²	100	48.7 Å²	48.7	83%	0.826	28%	0.284	S	S	*	.	H	α-helix	trans	-63.1	-30	177.6	0	0	0	0	0	113.4	T128	T128-A130 PolarHBondContact O-N 3.17Å; T128-A130 VanDerWaalsContact O-N 3.15Å
131	K	80.2	Confident	91.6	Very high	137 Å²	137	48.5 Å²	48.5	60%	0.596	28%	0.283	S	S	*	.	H	α-helix	trans	-94.8	-36.7	-179.5	-70.7	-177.8	178.6	-172.8	0	113.7	T128 R129 E209	T128-K131 PolarHBondContact O-N 3.48Å; T128-K131 WeakPolarHBondContact OG1-CG 3.42Å; T128-K131 PolarHBondContact OG1-N 3.3Å; R129-K131 VanDerWaalsContact C-N 3.26Å; R129-K131 PolarHBondContact O-N 3.48Å; K131-E209 IonicContact NZ-OE1 3.36Å; K131-E209 IonicContact NZ-OE2 2.77Å; K131-E209 PolarHBondContact NZ-OE2 3.24Å
132	A	85.2	Confident	91.6	Very high	38 Å²	38	51.2 Å²	51.2	31%	0.314	29%	0.293	S	S	.	.	H	α-helix	trans	-115.9	1	-168.9	0	0	0	0	0	113.8	T127 T128 G136	T127-A132 HydrophobicContact CG2-CB 3.65Å; T128-A132 PolarHBondContact O-N 3.37Å; A132-G136 VanDerWaalsContact O-CA 3.24Å; A132-G136 WeakPolarHBondContact O-CA 3.23Å; A132-G136 PolarHBondContact O-N 3.05Å
133	G	91	Very high	91.6	Very high	36 Å²	36	53.1 Å²	53.1	37%	0.371	30%	0.303	S	S	.	.	H	α-helix	trans	67.9	-176.7	-167.6	0	0	0	0	0	112.1	R129 F137	R129-G133 WeakPolarHBondContact CA-O 3.49Å; R129-G133 VanDerWaalsContact O-CA 3.22Å; R129-G133 WeakPolarHBondContact O-CA 3.48Å; R129-G133 PolarHBondContact O-N 2.94Å; G133-F137 VanDerWaalsContact O-CB 3.26Å; G133-F137 WeakPolarHBondContact O-CB 3.24Å; G133-F137 PolarHBondContact O-N 3.29Å
134	A	91.6	Very high	91.5	Very high	40 Å²	40	54.5 Å²	54.5	33%	0.331	31%	0.309	S	S	.	.	H	α-helix	trans	-70.7	-48.8	179.7	0	0	0	0	0	111.5	F137 V138 L175	A134-F137 WeakPolarHBondContact O-CB 3.35Å; A134-F137 PolarHBondContact O-N 3.47Å; A134-V138 WeakPolarHBondContact O-CG2 3.43Å; A134-V138 PolarHBondContact O-N 3.42Å; A134-L175 HydrophobicContact CB-CD2 3.84Å
135	E	94.6	Very high	91.6	Very high	171 Å²	171	53.6 Å²	53.6	80%	0.799	30%	0.303	S	S	*	.	H	α-helix	trans	-63.9	-46.9	-179.7	-66.3	177	-176.7	0	0	111.9	F137 V138 R139	E135-F137 PolarHBondContact O-N 3.42Å; E135-V138 PolarHBondContact O-N 3.01Å; E135-V138 VanDerWaalsContact O-N 3.16Å; E135-R139 WeakPolarHBondContact O-CB 3.14Å; E135-R139 PolarHBondContact O-N 3.05Å
136	G	94.8	Very high	91.7	Very high	23 Å²	23	53.7 Å²	53.7	24%	0.237	30%	0.304	C	S	.	.	H	α-helix	trans	-65.2	-28.6	176.9	0	0	0	0	0	113	A132 V140	A132-G136 VanDerWaalsContact O-CA 3.24Å; A132-G136 WeakPolarHBondContact O-CA 3.23Å; A132-G136 PolarHBondContact O-N 3.05Å; G136-V140 WeakPolarHBondContact O-CB 3.4Å; G136-V140 VanDerWaalsContact O-CG2 3.31Å; G136-V140 WeakPolarHBondContact O-CG2 3.44Å; G136-V140 PolarHBondContact O-N 3.18Å
137	F	93	Very high	92.2	Very high	3 Å²	3	53.9 Å²	53.9	1%	0.013	29%	0.29	C	S	.	.	H	α-helix	trans	-66.3	-48.1	170.5	171.2	-105	0	0	0	111.8	T127 G133 A134 E135 R139 V140 D141 L175 Y176 V179	T127-F137 HydrophobicContact CG2-CB 4.17Å; T127-F137 HydrophobicContact CG2-CD2 3.97Å; G133-F137 VanDerWaalsContact O-CB 3.26Å; G133-F137 WeakPolarHBondContact O-CB 3.24Å; G133-F137 PolarHBondContact O-N 3.29Å; A134-F137 WeakPolarHBondContact O-CB 3.35Å; A134-F137 PolarHBondContact O-N 3.47Å; E135-F137 PolarHBondContact O-N 3.42Å; F137-R139 VanDerWaalsContact C-N 3.32Å; F137-R139 PolarHBondContact O-N 3.31Å; F137-V140 PolarHBondContact O-N 2.94Å; F137-D141 HydrophobicContact CD2-CB 4.16Å; F137-D141 WeakPolarHBondContact CD2-OD2 3.33Å; F137-D141 HydrophobicContact CE2-CB 3.75Å; F137-D141 WeakPolarHBondContact CE2-OD1 3.4Å; F137-D141 HydrophobicContact CZ-CB 4.05Å; F137-D141 WeakPolarHBondContact O-CB 3.24Å; F137-D141 PolarHBondContact O-N 2.94Å; F137-L175 HydrophobicContact CD1-CD2 4.16Å; F137-L175 HydrophobicContact CD1-CG 4.16Å; F137-L175 HydrophobicContact CE1-CG 4.29Å; F137-Y176 HydrophobicContact CE1-CD2 4.41Å; F137-Y176 AromaticContact CE2-CD2 3.77Å; F137-Y176 HydrophobicContact CE2-CD2 3.77Å; F137-Y176 HydrophobicContact CE2-CE2 4.18Å; F137-Y176 AromaticContact CZ-CD2 3.46Å; F137-Y176 HydrophobicContact CZ-CD2 3.46Å; F137-Y176 VanDerWaalsContact CZ-CD2 3.46Å; F137-Y176 HydrophobicContact CZ-CE2 4.16Å; F137-Y176 HydrophobicContact CZ-CG 4.25Å; F137-V179 HydrophobicContact CD1-CB 4.49Å; F137-V179 HydrophobicContact CD1-CG1 4.5Å; F137-V179 HydrophobicContact CD1-CG2 4.2Å; F137-V179 HydrophobicContact CE1-CB 3.61Å; F137-V179 HydrophobicContact CE1-CG1 3.79Å; F137-V179 HydrophobicContact CE1-CG2 3.71Å; F137-V179 HydrophobicContact CZ-CB 4.1Å; F137-V179 HydrophobicContact CZ-CG1 4Å
138	V	97	Very high	92.7	Very high	27 Å²	27	52.4 Å²	52.4	16%	0.164	28%	0.282	C	S	.	.	H	α-helix	trans	-60	-45	175.2	178.1	0	0	0	0	110.5	A134 E135 V140 R142 D143 L175 V179	A134-V138 WeakPolarHBondContact O-CG2 3.43Å; A134-V138 PolarHBondContact O-N 3.42Å; E135-V138 PolarHBondContact O-N 3.01Å; E135-V138 VanDerWaalsContact O-N 3.16Å; V138-V140 VanDerWaalsContact C-N 3.34Å; V138-V140 PolarHBondContact O-N 3.33Å; V138-R142 HydrophobicContact CG1-CB 4.39Å; V138-R142 VanDerWaalsContact CG1-NH2 3.25Å; V138-R142 WeakPolarHBondContact O-CA 3.46Å; V138-R142 WeakPolarHBondContact O-CB 3.28Å; V138-R142 PolarHBondContact O-N 3.17Å; V138-D143 PolarHBondContact O-N 2.87Å; V138-L175 HydrophobicContact CG2-CD1 4.08Å; V138-V179 HydrophobicContact CG2-CG2 3.8Å
139	R	97.6	Very high	93.6	Very high	90 Å²	90	50.9 Å²	50.9	34%	0.34	27%	0.272	S	S	.	.	I	π-helix	trans	-56.6	-46.7	179.7	-170.5	65	176.4	159.6	1.1	111.9	E106 E135 F137 D143 Y144	E106-R139 IonicContact OE1-NE 3.01Å; E106-R139 IonicContact OE2-CZ 2.9Å; E106-R139 IonicContact OE2-NE 3.95Å; E106-R139 PolarHBondContact OE2-NE 2.9Å; E106-R139 VanDerWaalsContact OE2-NE 3.14Å; E106-R139 IonicContact OE2-NH2 3.15Å; E106-R139 PolarHBondContact OE2-NH2 2.95Å; E135-R139 WeakPolarHBondContact O-CB 3.14Å; E135-R139 PolarHBondContact O-N 3.05Å; F137-R139 VanDerWaalsContact C-N 3.32Å; F137-R139 PolarHBondContact O-N 3.31Å; R139-D143 WeakPolarHBondContact CD-OD2 3.37Å; R139-D143 IonicContact NH1-OD2 3.93Å; R139-D143 PolarHBondContact NH1-OD2 2.9Å; R139-D143 VanDerWaalsContact NH1-OD2 3.13Å; R139-D143 WeakPolarHBondContact O-CB 3.43Å; R139-D143 PolarHBondContact O-N 2.85Å; R139-Y144 HydrophobicContact CG-CD1 4.47Å; R139-Y144 HydrophobicContact CG-CE1 3.81Å; R139-Y144 HydrophobicContact CG-CE2 4.4Å; R139-Y144 PolarHBondContact O-N 3.15Å
140	V	96.7	Very high	94.5	Very high	27 Å²	27	46.2 Å²	46.2	16%	0.164	26%	0.258	C	S	.	.	I	π-helix	trans	-78.1	-51.5	-178.4	174.1	0	0	0	0	112.3	T127 G136 F137 V138 Y144	T127-V140 HydrophobicContact CG2-CB 3.75Å; T127-V140 HydrophobicContact CG2-CG1 4.06Å; T127-V140 HydrophobicContact CG2-CG2 4.11Å; G136-V140 WeakPolarHBondContact O-CB 3.4Å; G136-V140 VanDerWaalsContact O-CG2 3.31Å; G136-V140 WeakPolarHBondContact O-CG2 3.44Å; G136-V140 PolarHBondContact O-N 3.18Å; F137-V140 PolarHBondContact O-N 2.94Å; V138-V140 VanDerWaalsContact C-N 3.34Å; V138-V140 PolarHBondContact O-N 3.33Å; V140-Y144 HydrophobicContact CB-CD2 4.2Å; V140-Y144 HydrophobicContact CG1-CD2 4.46Å; V140-Y144 HydrophobicContact CG2-CD2 3.88Å; V140-Y144 HydrophobicContact CG2-CE2 3.81Å
141	D	96.8	Very high	95.5	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.011	22%	0.223	C	C	.	.	I	π-helix	trans	-81.6	-17.1	-169.5	-77.5	-114.8	0	0	0	113.3	G126 T127 F137 V179 K180	G126-D141 WeakPolarHBondContact CA-OD1 3.33Å; G126-D141 WeakPolarHBondContact CA-OD2 3.35Å; T127-D141 WeakPolarHBondContact CG2-OD2 3.23Å; T127-D141 PolarHBondContact N-OD2 3.47Å; F137-D141 HydrophobicContact CD2-CB 4.16Å; F137-D141 WeakPolarHBondContact CD2-OD2 3.33Å; F137-D141 HydrophobicContact CE2-CB 3.75Å; F137-D141 WeakPolarHBondContact CE2-OD1 3.4Å; F137-D141 HydrophobicContact CZ-CB 4.05Å; F137-D141 WeakPolarHBondContact O-CB 3.24Å; F137-D141 PolarHBondContact O-N 2.94Å; D141-V179 HydrophobicContact CB-CG1 3.78Å; D141-K180 WeakPolarHBondContact OD1-CE 3.49Å; D141-K180 IonicContact OD1-NZ 3.56Å; D141-K180 PolarHBondContact OD1-NZ 3.18Å
142	R	98.3	Very high	96.4	Very high	57 Å²	57	35.9 Å²	35.9	22%	0.215	20%	0.195	C	C	.	.	I	π-helix	trans	-111.7	-63.6	173.4	-169.5	-172.6	65.9	-164.9	-4	112.3	V138 V145 L146 V179 E182 V183	V138-R142 HydrophobicContact CG1-CB 4.39Å; V138-R142 VanDerWaalsContact CG1-NH2 3.25Å; V138-R142 WeakPolarHBondContact O-CA 3.46Å; V138-R142 WeakPolarHBondContact O-CB 3.28Å; V138-R142 PolarHBondContact O-N 3.17Å; R142-V145 PolarHBondContact O-N 2.85Å; R142-L146 VanDerWaalsContact O-CB 3.26Å; R142-L146 WeakPolarHBondContact O-CB 3.36Å; R142-L146 PolarHBondContact O-N 2.81Å; R142-V179 HydrophobicContact CB-CG1 4.09Å; R142-E182 WeakPolarHBondContact CD-OE1 3.46Å; R142-E182 IonicContact CZ-OE1 3.89Å; R142-E182 IonicContact NE-OE1 3.85Å; R142-E182 IonicContact NH1-OE1 2.64Å; R142-E182 PolarHBondContact NH1-OE1 3.25Å; R142-E182 VanDerWaalsContact NH1-OE1 3.09Å; R142-E182 IonicContact NH1-OE2 3.89Å; R142-E182 PolarHBondContact NH1-OE2 2.64Å; R142-V183 HydrophobicContact CG-CB 4.23Å
143	D	98.4	Very high	97	Very high	40 Å²	40	37.2 Å²	37.2	21%	0.214	19%	0.193	C	C	.	.	I	π-helix	trans	-69.7	-48.2	-164.2	-55.8	-12.4	0	0	0	111.1	V138 R139 V145 L146 K147	V138-D143 PolarHBondContact O-N 2.87Å; R139-D143 WeakPolarHBondContact CD-OD2 3.37Å; R139-D143 IonicContact NH1-OD2 3.93Å; R139-D143 PolarHBondContact NH1-OD2 2.9Å; R139-D143 VanDerWaalsContact NH1-OD2 3.13Å; R139-D143 WeakPolarHBondContact O-CB 3.43Å; R139-D143 PolarHBondContact O-N 2.85Å; D143-V145 VanDerWaalsContact C-N 3.34Å; D143-V145 PolarHBondContact O-N 3.42Å; D143-L146 PolarHBondContact O-N 2.79Å; D143-K147 VanDerWaalsContact O-CB 3.27Å; D143-K147 WeakPolarHBondContact O-CB 3.21Å; D143-K147 PolarHBondContact O-N 2.94Å
144	Y	98.6	Very high	97.4	Very high	29 Å²	29	39.7 Å²	39.7	11%	0.114	21%	0.21	C	C	.	.	I	π-helix	trans	-64.3	-39.7	177.9	-64.5	-12.8	0	0	0	112.4	F105 E106 R139 V140 S148	F105-Y144 HydrophobicContact CB-CD1 3.81Å; F105-Y144 HydrophobicContact CB-CD2 3.68Å; F105-Y144 HydrophobicContact CB-CE1 3.7Å; F105-Y144 HydrophobicContact CB-CE2 3.58Å; F105-Y144 HydrophobicContact CB-CG 3.8Å; F105-Y144 HydrophobicContact CD1-CD1 4.48Å; F105-Y144 HydrophobicContact CD1-CD2 4.15Å; F105-Y144 AromaticContact CD1-CG 3.94Å; F105-Y144 HydrophobicContact CD1-CG 3.94Å; F105-Y144 AromaticContact CG-CD2 3.94Å; F105-Y144 HydrophobicContact CG-CD2 3.94Å; F105-Y144 HydrophobicContact CG-CE2 4.25Å; F105-Y144 HydrophobicContact CG-CG 4.1Å; F105-Y144 VanDerWaalsContact O-CE1 3.32Å; F105-Y144 WeakPolarHBondContact O-CE1 3.43Å; E106-Y144 WeakPolarHBondContact CG-OH 3.4Å; E106-Y144 PolarHBondContact OE1-OH 3.01Å; R139-Y144 HydrophobicContact CG-CD1 4.47Å; R139-Y144 HydrophobicContact CG-CE1 3.81Å; R139-Y144 HydrophobicContact CG-CE2 4.4Å; R139-Y144 PolarHBondContact O-N 3.15Å; V140-Y144 HydrophobicContact CB-CD2 4.2Å; V140-Y144 HydrophobicContact CG1-CD2 4.46Å; V140-Y144 HydrophobicContact CG2-CD2 3.88Å; V140-Y144 HydrophobicContact CG2-CE2 3.81Å; Y144-S148 VanDerWaalsContact O-CB 3.23Å; Y144-S148 WeakPolarHBondContact O-CB 3.48Å; Y144-S148 PolarHBondContact O-N 2.93Å; Y144-S148 PolarHBondContact O-OG 3.02Å
145	V	98.7	Very high	97.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.3	-50	177.8	172.4	0	0	0	0	110.5	L125 R142 D143 S148 A149 L162 V183	L125-V145 HydrophobicContact CB-CG2 4.1Å; L125-V145 HydrophobicContact CD1-CG2 4.45Å; R142-V145 PolarHBondContact O-N 2.85Å; D143-V145 VanDerWaalsContact C-N 3.34Å; D143-V145 PolarHBondContact O-N 3.42Å; V145-S148 PolarHBondContact O-N 2.93Å; V145-A149 WeakPolarHBondContact O-CB 3.32Å; V145-A149 PolarHBondContact O-N 3.36Å; V145-L162 HydrophobicContact CG1-CD1 3.68Å; V145-V183 HydrophobicContact CB-CG2 3.87Å; V145-V183 HydrophobicContact CG1-CG2 3.54Å
146	L	98.8	Very high	97.9	Very high	27 Å²	27	32.3 Å²	32.3	14%	0.141	18%	0.184	C	C	.	.	H	α-helix	trans	-62	-48.3	179.5	179.7	60.9	0	0	0	111.2	R142 D143 S148 A149 E150 K186 V187 L190	R142-L146 VanDerWaalsContact O-CB 3.26Å; R142-L146 WeakPolarHBondContact O-CB 3.36Å; R142-L146 PolarHBondContact O-N 2.81Å; D143-L146 PolarHBondContact O-N 2.79Å; L146-S148 VanDerWaalsContact C-N 3.28Å; L146-S148 PolarHBondContact O-N 2.92Å; L146-A149 WeakPolarHBondContact O-CA 3.47Å; L146-A149 WeakPolarHBondContact O-CB 3.31Å; L146-A149 PolarHBondContact O-N 2.87Å; L146-E150 WeakPolarHBondContact O-CG 3.45Å; L146-E150 PolarHBondContact O-N 3.47Å; L146-K186 HydrophobicContact CD1-CB 3.75Å; L146-K186 HydrophobicContact CD2-CB 4.06Å; L146-K186 HydrophobicContact CD2-CD 3.72Å; L146-K186 HydrophobicContact CD2-CG 4.47Å; L146-V187 HydrophobicContact CD1-CG2 4.16Å; L146-L190 HydrophobicContact CD1-CD1 4.34Å
147	K	98.8	Very high	98.1	Very high	52 Å²	52	31.2 Å²	31.2	23%	0.226	17%	0.173	C	C	.	.	H	α-helix	trans	-59.3	-41.5	178.6	-169.6	71.3	-141	-175	0	112	L108 E109 D143 A149 E150 L151	L108-K147 HydrophobicContact CB-CG 4.06Å; L108-K147 HydrophobicContact CD2-CB 4.14Å; L108-K147 HydrophobicContact CD2-CG 3.89Å; L108-K147 HydrophobicContact CG-CG 4.5Å; E109-K147 VanDerWaalsContact CD-CE 3.48Å; E109-K147 WeakPolarHBondContact OE1-CD 3.22Å; E109-K147 WeakPolarHBondContact OE1-CE 3.07Å; E109-K147 IonicContact OE1-NZ 4Å; E109-K147 PolarHBondContact OE1-NZ 3.43Å; D143-K147 VanDerWaalsContact O-CB 3.27Å; D143-K147 WeakPolarHBondContact O-CB 3.21Å; D143-K147 PolarHBondContact O-N 2.94Å; K147-A149 VanDerWaalsContact C-N 3.32Å; K147-A149 PolarHBondContact O-N 2.87Å; K147-E150 WeakPolarHBondContact CD-OE2 3.32Å; K147-E150 WeakPolarHBondContact CE-OE2 3.24Å; K147-E150 IonicContact NZ-OE2 3.38Å; K147-E150 PolarHBondContact NZ-OE2 3.39Å; K147-E150 PolarHBondContact O-N 3.05Å; K147-L151 HydrophobicContact CG-CD1 4.47Å; K147-L151 WeakPolarHBondContact O-CG 3.38Å; K147-L151 PolarHBondContact O-N 3.17Å
148	S	98.8	Very high	98.3	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.3	-38.8	176	-59.5	0	0	0	0	111.8	L57 L108 Y144 V145 L146 A152	L57-S148 VanDerWaalsContact CD1-CB 3.47Å; L108-S148 WeakPolarHBondContact CD2-OG 3.23Å; Y144-S148 VanDerWaalsContact O-CB 3.23Å; Y144-S148 WeakPolarHBondContact O-CB 3.48Å; Y144-S148 PolarHBondContact O-N 2.93Å; Y144-S148 PolarHBondContact O-OG 3.02Å; V145-S148 PolarHBondContact O-N 2.93Å; L146-S148 VanDerWaalsContact C-N 3.28Å; L146-S148 PolarHBondContact O-N 2.92Å; S148-A152 VanDerWaalsContact O-CB 3.24Å; S148-A152 WeakPolarHBondContact O-CB 2.87Å; S148-A152 PolarHBondContact O-N 3.42Å
149	A	98.9	Very high	98.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-67.3	-41.5	176	0	0	0	0	0	111.8	V145 L146 K147 L151 A152 K153 F160 V187 L190 F192	V145-A149 WeakPolarHBondContact O-CB 3.32Å; V145-A149 PolarHBondContact O-N 3.36Å; L146-A149 WeakPolarHBondContact O-CA 3.47Å; L146-A149 WeakPolarHBondContact O-CB 3.31Å; L146-A149 PolarHBondContact O-N 2.87Å; K147-A149 VanDerWaalsContact C-N 3.32Å; K147-A149 PolarHBondContact O-N 2.87Å; A149-L151 PolarHBondContact O-N 2.95Å; A149-A152 PolarHBondContact O-N 3.22Å; A149-K153 WeakPolarHBondContact O-CB 3.43Å; A149-K153 PolarHBondContact O-N 2.9Å; A149-F160 HydrophobicContact CB-CD1 4.46Å; A149-F160 HydrophobicContact CB-CE1 3.91Å; A149-F160 HydrophobicContact CB-CE2 4.08Å; A149-F160 HydrophobicContact CB-CZ 3.7Å; A149-V187 HydrophobicContact CB-CG1 4.11Å; A149-V187 HydrophobicContact CB-CG2 3.93Å; A149-L190 HydrophobicContact CB-CD1 3.55Å; A149-F192 HydrophobicContact CB-CE2 4.25Å; A149-F192 HydrophobicContact CB-CZ 4.39Å; A149-F192 VanDerWaalsContact O-CZ 3.3Å; A149-F192 WeakPolarHBondContact O-CZ 3.45Å
150	E	98.9	Very high	98.5	Very high	72 Å²	72	31 Å²	31	34%	0.336	17%	0.173	S	C	.	.	H	α-helix	trans	-57.2	-49.8	174.1	-71.2	170.4	-178.4	0	0	111.3	L146 K147 A152 K153 A154 L190	L146-E150 WeakPolarHBondContact O-CG 3.45Å; L146-E150 PolarHBondContact O-N 3.47Å; K147-E150 WeakPolarHBondContact CD-OE2 3.32Å; K147-E150 WeakPolarHBondContact CE-OE2 3.24Å; K147-E150 IonicContact NZ-OE2 3.38Å; K147-E150 PolarHBondContact NZ-OE2 3.39Å; K147-E150 PolarHBondContact O-N 3.05Å; E150-A152 PolarHBondContact O-N 2.99Å; E150-K153 PolarHBondContact O-N 3.46Å; E150-A154 WeakPolarHBondContact O-CB 3.42Å; E150-A154 PolarHBondContact O-N 3.47Å; E150-L190 HydrophobicContact CG-CD1 4.19Å; E150-L190 HydrophobicContact CG-CD2 3.94Å
151	L	98.8	Very high	98.6	Very high	20 Å²	20	29.8 Å²	29.8	11%	0.105	17%	0.165	C	C	.	.	H	α-helix	trans	-66	-38.1	178.9	-66.3	175.1	0	0	0	112	L108 A112 F115 K147 A149 A154 G155	L108-L151 HydrophobicContact CB-CD1 4.17Å; L108-L151 HydrophobicContact CD2-CD1 3.86Å; L108-L151 HydrophobicContact CG-CD1 3.59Å; L108-L151 WeakPolarHBondContact O-CD1 3.34Å; A112-L151 HydrophobicContact CB-CD2 3.92Å; F115-L151 HydrophobicContact CB-CB 4.09Å; F115-L151 HydrophobicContact CD1-CB 4.27Å; F115-L151 HydrophobicContact CD2-CB 3.72Å; F115-L151 HydrophobicContact CD2-CD1 3.93Å; F115-L151 HydrophobicContact CD2-CG 4.48Å; F115-L151 HydrophobicContact CE2-CB 4.19Å; F115-L151 HydrophobicContact CE2-CD1 3.79Å; F115-L151 HydrophobicContact CG-CB 3.76Å; K147-L151 HydrophobicContact CG-CD1 4.47Å; K147-L151 WeakPolarHBondContact O-CG 3.38Å; K147-L151 PolarHBondContact O-N 3.17Å; A149-L151 PolarHBondContact O-N 2.95Å; L151-A154 PolarHBondContact O-N 2.9Å; L151-G155 PolarHBondContact O-N 3Å
152	A	98.8	Very high	98.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62	-46.4	174.1	0	0	0	0	0	111.8	F55 F115 S148 A149 E150 G155 G156 C157 F160 F192	F55-A152 HydrophobicContact CE1-CB 3.81Å; F55-A152 HydrophobicContact CZ-CB 3.5Å; F115-A152 HydrophobicContact CD1-CB 4.13Å; S148-A152 VanDerWaalsContact O-CB 3.24Å; S148-A152 WeakPolarHBondContact O-CB 2.87Å; S148-A152 PolarHBondContact O-N 3.42Å; A149-A152 PolarHBondContact O-N 3.22Å; E150-A152 PolarHBondContact O-N 2.99Å; A152-G155 CarbonylContact O-C 3.29Å; A152-G155 PolarHBondContact O-N 3.34Å; A152-G156 PolarHBondContact O-N 3.47Å; A152-C157 HydrophobicContact CB-CB 3.93Å; A152-C157 WeakPolarHBondContact O-CB 3.13Å; A152-C157 PolarHBondContact O-N 3.48Å; A152-F160 HydrophobicContact CB-CD2 4.28Å; A152-F160 HydrophobicContact CB-CE2 4.32Å; A152-F192 HydrophobicContact CB-CE1 4.48Å; A152-F192 HydrophobicContact CB-CZ 4.33Å
153	K	98.7	Very high	98.7	Very high	65 Å²	65	27.7 Å²	27.7	28%	0.283	16%	0.159	S	C	.	.	H	α-helix	trans	-61.6	-46.7	177.6	-177.6	66.8	-177	-174.4	0	110.8	A149 E150 G155 G156 L190 K191 F192 D193	A149-K153 WeakPolarHBondContact O-CB 3.43Å; A149-K153 PolarHBondContact O-N 2.9Å; E150-K153 PolarHBondContact O-N 3.46Å; K153-G155 VanDerWaalsContact C-N 3.27Å; K153-G155 PolarHBondContact O-N 2.97Å; K153-G156 PolarHBondContact O-N 3.42Å; K153-L190 WeakPolarHBondContact CE-O 3.05Å; K153-K191 PolarHBondContact NZ-O 3.21Å; K153-F192 HydrophobicContact CB-CD1 4.47Å; K153-F192 HydrophobicContact CB-CE1 3.73Å; K153-F192 HydrophobicContact CB-CE2 4.34Å; K153-F192 HydrophobicContact CB-CZ 3.68Å; K153-F192 HydrophobicContact CD-CD1 3.8Å; K153-F192 HydrophobicContact CD-CE1 3.93Å; K153-F192 HydrophobicContact CD-CG 4.2Å; K153-F192 HydrophobicContact CD-CZ 4.45Å; K153-F192 HydrophobicContact CG-CE1 4.42Å; K153-D193 IonicContact NZ-OD1 2.72Å; K153-D193 PolarHBondContact NZ-OD1 3.35Å
154	A	98.6	Very high	98.6	Very high	88 Å²	88	26.1 Å²	26.1	73%	0.727	15%	0.151	S	C	*	.	H	α-helix	trans	-63.1	-33.8	176.3	0	0	0	0	0	112.5	E150 L151 G156	E150-A154 WeakPolarHBondContact O-CB 3.42Å; E150-A154 PolarHBondContact O-N 3.47Å; L151-A154 PolarHBondContact O-N 2.9Å; A154-G156 PolarHBondContact O-N 3.47Å
155	G	98.4	Very high	98.3	Very high	17 Å²	17	25.5 Å²	25.5	18%	0.175	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-1.2	176.5	0	0	0	0	0	115	G117 L151 A152 K153	G117-G155 PolarHBondContact N-O 3.46Å; L151-G155 PolarHBondContact O-N 3Å; A152-G155 CarbonylContact O-C 3.29Å; A152-G155 PolarHBondContact O-N 3.34Å; K153-G155 VanDerWaalsContact C-N 3.27Å; K153-G155 PolarHBondContact O-N 2.97Å
156	G	98.4	Very high	98.1	Very high	39 Å²	39	28.8 Å²	28.8	40%	0.402	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.9	8.2	176.5	0	0	0	0	0	115.3	A152 K153 A154 K158	A152-G156 PolarHBondContact O-N 3.47Å; K153-G156 PolarHBondContact O-N 3.42Å; A154-G156 PolarHBondContact O-N 3.47Å; G156-K158 WeakPolarHBondContact O-CD 3.47Å; G156-K158 PolarHBondContact O-N 2.91Å
157	C	98.7	Very high	97.7	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.007	18%	0.177	C	C	.	.			trans	-59.5	129.2	175.2	-180	0	0	0	0	111.2	F55 H118 A152 F192	F55-C157 HydrophobicContact CE1-CB 4.24Å; H118-C157 WeakPolarHBondContact O-CA 3.29Å; A152-C157 HydrophobicContact CB-CB 3.93Å; A152-C157 WeakPolarHBondContact O-CB 3.13Å; A152-C157 PolarHBondContact O-N 3.48Å; C157-F192 HydrophobicContact CB-CE1 4.07Å; C157-F192 WeakPolarHBondContact O-CD1 3.27Å
158	K	98.3	Very high	97.6	Very high	103 Å²	103	27 Å²	27	45%	0.448	17%	0.168	S	C	.	.			trans	-97.3	-41.6	-175	-60.7	-48.4	-155.6	154.8	0	111.8	D119 G156 D193 R194	D119-K158 PolarHBondContact O-N 3.23Å; G156-K158 WeakPolarHBondContact O-CD 3.47Å; G156-K158 PolarHBondContact O-N 2.91Å; K158-D193 HydrophobicContact CB-CB 4.45Å; K158-D193 VanDerWaalsContact CD-OD2 3.3Å; K158-D193 WeakPolarHBondContact CD-OD2 3.48Å; K158-D193 WeakPolarHBondContact CE-OD2 3.37Å; K158-D193 IonicContact NZ-OD1 3.79Å; K158-D193 IonicContact NZ-OD2 2.84Å; K158-D193 PolarHBondContact NZ-OD2 3.45Å; K158-D193 PolarHBondContact O-N 3.43Å; K158-R194 PolarHBondContact O-N 2.89Å
159	H	98.8	Very high	97.4	Very high	13 Å²	13	30.4 Å²	30.4	6%	0.06	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	107.8	-178.7	-173.7	-173.4	0	0	0	111.4	D119 V120 G121 N161 R194 S196	D119-H159 PolarHBondContact O-N 3.41Å; D119-H159 VanDerWaalsContact O-N 3.14Å; V120-H159 CarbonylContact C-O 3.58Å; V120-H159 WeakPolarHBondContact CA-O 3.35Å; V120-H159 HydrophobicContact CG1-CB 4.48Å; V120-H159 HydrophobicContact CG2-CB 4.28Å; G121-H159 PolarHBondContact N-O 3Å; H159-N161 PolarHBondContact CD2-ND2 3.34Å; H159-N161 PolarHBondContact CE1-OD1 3.19Å; H159-N161 PolarHBondContact NE2-ND2 3.44Å; H159-N161 PolarHBondContact NE2-OD1 3.28Å; H159-N161 VanDerWaalsContact NE2-OD1 3.13Å; H159-R194 VanDerWaalsContact CA-O 3.27Å; H159-R194 WeakPolarHBondContact CA-O 3.49Å; H159-R194 HydrophobicContact CB-CB 4.23Å; H159-R194 PolarHBondContact CD2-O 3.4Å; H159-R194 PolarHBondContact CE1-NE 3.05Å; H159-S196 PolarHBondContact NE2-OG 3.39Å
160	F	98.9	Very high	97.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	131.8	175.5	-165.4	-98.7	0	0	0	111.1	F55 C123 A149 A152 L162 V187 F192 R194 Y195 S196	F55-F160 HydrophobicContact CE2-CE2 4.31Å; F55-F160 HydrophobicContact CZ-CD2 4.12Å; F55-F160 AromaticContact CZ-CE2 3.93Å; F55-F160 HydrophobicContact CZ-CE2 3.93Å; C123-F160 HydrophobicContact CB-CE1 4.14Å; C123-F160 HydrophobicContact CB-CE2 4.5Å; C123-F160 HydrophobicContact CB-CZ 3.7Å; A149-F160 HydrophobicContact CB-CD1 4.46Å; A149-F160 HydrophobicContact CB-CE1 3.91Å; A149-F160 HydrophobicContact CB-CE2 4.08Å; A149-F160 HydrophobicContact CB-CZ 3.7Å; A152-F160 HydrophobicContact CB-CD2 4.28Å; A152-F160 HydrophobicContact CB-CE2 4.32Å; F160-L162 HydrophobicContact CE1-CB 4.41Å; F160-V187 HydrophobicContact CD1-CG1 3.81Å; F160-V187 HydrophobicContact CE1-CG1 3.99Å; F160-F192 HydrophobicContact CB-CD1 3.78Å; F160-F192 HydrophobicContact CB-CD2 3.71Å; F160-F192 HydrophobicContact CB-CE1 3.75Å; F160-F192 HydrophobicContact CB-CE2 3.67Å; F160-F192 HydrophobicContact CB-CG 3.76Å; F160-F192 HydrophobicContact CB-CZ 3.66Å; F160-F192 HydrophobicContact CD1-CE2 4.29Å; F160-F192 HydrophobicContact CD2-CE1 4.36Å; F160-F192 HydrophobicContact CD2-CE2 4.38Å; F160-F192 AromaticContact CD2-CZ 3.91Å; F160-F192 HydrophobicContact CD2-CZ 3.91Å; F160-F192 HydrophobicContact CG-CD2 4.38Å; F160-F192 HydrophobicContact CG-CE1 4.32Å; F160-F192 AromaticContact CG-CE2 3.88Å; F160-F192 HydrophobicContact CG-CE2 3.88Å; F160-F192 AromaticContact CG-CZ 3.83Å; F160-F192 HydrophobicContact CG-CZ 3.83Å; F160-R194 PolarHBondContact N-O 2.87Å; F160-Y195 HydrophobicContact CB-CD2 4.47Å; F160-Y195 HydrophobicContact CD1-CD2 4.2Å; F160-Y195 HydrophobicContact CD1-CE2 4.04Å; F160-Y195 WeakPolarHBondContact O-CA 3.31Å; F160-Y195 WeakPolarHBondContact O-CD2 3.35Å; F160-S196 PolarHBondContact O-N 3.33Å
161	N	98.9	Very high	97.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	119.2	-176.9	-64.9	-94.4	0	0	0	109.2	G121 F122 C123 H159 S196 F198	G121-N161 WeakPolarHBondContact O-CB 3.49Å; G121-N161 PolarHBondContact O-N 3.21Å; G121-N161 PolarHBondContact O-ND2 2.74Å; F122-N161 HydrophobicContact CD1-CB 3.3Å; F122-N161 HydrophobicContact CE1-CB 3.53Å; F122-N161 VanDerWaalsContact CE1-CG 3.44Å; F122-N161 HydrophobicContact CG-CB 4.13Å; C123-N161 PolarHBondContact N-O 2.93Å; H159-N161 PolarHBondContact CD2-ND2 3.34Å; H159-N161 PolarHBondContact CE1-OD1 3.19Å; H159-N161 PolarHBondContact NE2-ND2 3.44Å; H159-N161 PolarHBondContact NE2-OD1 3.28Å; H159-N161 VanDerWaalsContact NE2-OD1 3.13Å; N161-S196 CarbonylContact C-O 3.6Å; N161-S196 WeakPolarHBondContact CA-O 3.32Å; N161-S196 WeakPolarHBondContact OD1-CB 3.34Å; N161-F198 HydrophobicContact CB-CE2 4.17Å
162	L	98.8	Very high	96.9	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.016	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	123.4	-179.6	179.1	62.9	0	0	0	111.2	C123 V145 F160 S164 V183 E184 Y195 S196 F198	C123-L162 HydrophobicContact CB-CD1 4.04Å; V145-L162 HydrophobicContact CG1-CD1 3.68Å; F160-L162 HydrophobicContact CE1-CB 4.41Å; L162-S164 PolarHBondContact O-N 2.85Å; L162-V183 HydrophobicContact CD2-CG1 4.27Å; L162-E184 HydrophobicContact CD2-CG 4.07Å; L162-Y195 HydrophobicContact CB-CE2 3.92Å; L162-Y195 VanDerWaalsContact CD2-OH 3.23Å; L162-Y195 WeakPolarHBondContact CD2-OH 3.42Å; L162-S196 PolarHBondContact N-O 3.04Å; L162-F198 PolarHBondContact O-N 3.18Å
163	V	98.2	Very high	96.6	Very high	13 Å²	13	46.5 Å²	46.5	8%	0.079	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	106.8	167.4	-175.5	0	0	0	0	109.2	T63 C123 P200 M243	T63-V163 HydrophobicContact CG2-CG2 4.46Å; C123-V163 PolarHBondContact O-N 2.99Å; V163-P200 HydrophobicContact CG1-CG 4.44Å; V163-M243 HydrophobicContact CG2-CE 3.64Å; V163-M243 HydrophobicContact CG2-SD 3.83Å
164	S	97.1	Very high	96.2	Very high	7 Å²	7	49.3 Å²	49.3	5%	0.049	29%	0.29	C	S	.	.			trans	-104.7	-138.8	178	-170.7	0	0	0	0	110.7	L162 E184 F198	L162-S164 PolarHBondContact O-N 2.85Å; S164-E184 WeakPolarHBondContact CB-OE1 3.46Å; S164-E184 PolarHBondContact OG-OE1 2.91Å; S164-F198 CarbonylContact C-O 3.57Å; S164-F198 WeakPolarHBondContact CA-O 3.39Å; S164-F198 PolarHBondContact N-O 3.4Å
165	S	93.1	Very high	95.9	Very high	16 Å²	16	47.6 Å²	47.6	11%	0.112	27%	0.268	C	S	.	.			trans	-152.6	149.8	179.2	-168.8	0	0	0	0	111.9	G167 A168 Y176 R199	S165-G167 PolarHBondContact O-N 2.81Å; S165-A168 VanDerWaalsContact O-CB 3.31Å; S165-A168 WeakPolarHBondContact O-CB 3.35Å; S165-A168 PolarHBondContact O-N 3.02Å; S165-A168 VanDerWaalsContact O-N 3.15Å; S165-Y176 WeakPolarHBondContact CB-OH 3.34Å; S165-Y176 WeakPolarHBondContact OG-CE1 3.24Å; S165-Y176 PolarHBondContact OG-OH 2.88Å; S165-R199 WeakPolarHBondContact O-CB 3.25Å; S165-R199 WeakPolarHBondContact O-CG 3.21Å
166	K	93.2	Very high	95.5	Very high	68 Å²	68	50 Å²	50	30%	0.296	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	129.4	170	-177.2	-177.1	177.6	-173.1	0	110.4	P200 G231 N260	K166-P200 WeakPolarHBondContact CB-O 3.1Å; K166-P200 PolarHBondContact N-O 2.75Å; K166-G231 PolarHBondContact NZ-O 3.41Å; K166-N260 HydrophobicContact CD-CB 4.45Å
167	G	91.1	Very high	95.3	Very high	38 Å²	38	50 Å²	50	39%	0.392	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	10.7	179.4	0	0	0	0	0	114.6	S165 D169	S165-G167 PolarHBondContact O-N 2.81Å; G167-D169 PolarHBondContact O-N 3.37Å
168	A	95.4	Very high	95.1	Very high	4 Å²	4	52.2 Å²	52.2	3%	0.033	27%	0.273	C	S	.	.			trans	-54	125	170.5	0	0	0	0	0	110.3	S165 K180 E184 R199	S165-A168 VanDerWaalsContact O-CB 3.31Å; S165-A168 WeakPolarHBondContact O-CB 3.35Å; S165-A168 PolarHBondContact O-N 3.02Å; S165-A168 VanDerWaalsContact O-N 3.15Å; A168-K180 HydrophobicContact CB-CB 3.73Å; A168-E184 VanDerWaalsContact CB-OE1 3.29Å; A168-E184 WeakPolarHBondContact CB-OE1 3.26Å; A168-R199 VanDerWaalsContact O-CZ 3.29Å; A168-R199 PolarHBondContact O-NH2 2.78Å
169	D	96.1	Very high	95.1	Very high	71 Å²	71	47.3 Å²	47.3	38%	0.38	25%	0.251	S	S	.	.			trans	-157.6	114.7	-173.1	177.9	-4.8	0	0	0	108.8	G167 S171 S172 L177 Q178	G167-D169 PolarHBondContact O-N 3.37Å; D169-S171 VanDerWaalsContact CG-OG 3.27Å; D169-S171 PolarHBondContact O-N 3.16Å; D169-S171 VanDerWaalsContact O-N 3.08Å; D169-S171 WeakPolarHBondContact OD1-CB 3.18Å; D169-S171 PolarHBondContact OD1-N 3.09Å; D169-S171 PolarHBondContact OD1-OG 2.69Å; D169-S171 PolarHBondContact OD2-OG 3.03Å; D169-S172 WeakPolarHBondContact O-CB 3.23Å; D169-S172 PolarHBondContact O-N 3.12Å; D169-L177 PolarHBondContact N-O 3.35Å; D169-L177 CarbonylContact O-C 3.55Å; D169-Q178 VanDerWaalsContact O-CA 3.24Å; D169-Q178 WeakPolarHBondContact O-CA 3.44Å
170	K	96.1	Very high	94.9	Very high	137 Å²	137	47.1 Å²	47.1	60%	0.596	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-17	-179.2	66.3	-177.8	179	-176.5	0	113.9	A185	K170-A185 HydrophobicContact CD-CB 4.29Å
171	S	96.3	Very high	94.9	Very high	89 Å²	89	47.3 Å²	47.3	62%	0.622	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	0.7	176.7	72.3	0	0	0	0	113.9	D169	D169-S171 VanDerWaalsContact CG-OG 3.27Å; D169-S171 PolarHBondContact O-N 3.16Å; D169-S171 VanDerWaalsContact O-N 3.08Å; D169-S171 WeakPolarHBondContact OD1-CB 3.18Å; D169-S171 PolarHBondContact OD1-N 3.09Å; D169-S171 PolarHBondContact OD1-OG 2.69Å; D169-S171 PolarHBondContact OD2-OG 3.03Å
172	S	92.9	Very high	94.9	Very high	30 Å²	30	48.9 Å²	48.9	21%	0.21	26%	0.26	C	S	.	.			trans	-64.7	141.7	-179.2	-169.6	0	0	0	0	112.5	D169 F174 Q178	D169-S172 WeakPolarHBondContact O-CB 3.23Å; D169-S172 PolarHBondContact O-N 3.12Å; S172-F174 PolarHBondContact O-N 3.16Å; S172-F174 PolarHBondContact OG-N 2.85Å; S172-F174 VanDerWaalsContact OG-N 3.16Å; S172-Q178 WeakPolarHBondContact O-CB 3.49Å
173	N	92.6	Very high	94.8	Very high	175 Å²	175	48.8 Å²	48.8	94%	0.936	26%	0.26	S	S	*	.	S	Bend	trans	-76.2	-9	168.9	-67	-42.8	0	0	0	112.9
174	F	91.2	Very high	94.9	Very high	124 Å²	124	48.5 Å²	48.5	54%	0.544	26%	0.258	S	S	.	.	S	Bend	trans	-96.3	112.2	177.2	-175.9	-139.6	0	0	0	110.3	S172 Y176 L177 Q178	S172-F174 PolarHBondContact O-N 3.16Å; S172-F174 PolarHBondContact OG-N 2.85Å; S172-F174 VanDerWaalsContact OG-N 3.16Å; F174-Y176 HydrophobicContact CE1-CD1 4.23Å; F174-Y176 HydrophobicContact CE1-CG 4.29Å; F174-Y176 PolarHBondContact O-N 3.37Å; F174-L177 HydrophobicContact CD1-CD1 4.02Å; F174-L177 HydrophobicContact CD1-CG 3.84Å; F174-L177 PolarHBondContact O-N 2.89Å; F174-Q178 PolarHBondContact O-N 3.42Å
175	L	90.7	Very high	94.9	Very high	51 Å²	51	49 Å²	49	27%	0.267	26%	0.262	S	S	.	.	H	α-helix	trans	-44.3	-41.7	-175	-177.4	67.6	0	0	0	113.7	A134 F137 V138 V179	A134-L175 HydrophobicContact CB-CD2 3.84Å; F137-L175 HydrophobicContact CD1-CD2 4.16Å; F137-L175 HydrophobicContact CD1-CG 4.16Å; F137-L175 HydrophobicContact CE1-CG 4.29Å; V138-L175 HydrophobicContact CG2-CD1 4.08Å; L175-V179 HydrophobicContact CD1-CG2 3.89Å; L175-V179 HydrophobicContact CG-CG2 4.26Å; L175-V179 WeakPolarHBondContact O-CB 3.47Å; L175-V179 VanDerWaalsContact O-CG2 3.23Å; L175-V179 WeakPolarHBondContact O-CG2 3.29Å; L175-V179 PolarHBondContact O-N 3.44Å
176	Y	91.1	Very high	95.2	Very high	69 Å²	69	51.4 Å²	51.4	27%	0.271	27%	0.27	S	S	.	.	H	α-helix	trans	-60.3	-49.4	179.6	176.9	-99.6	0	0	0	112.8	F137 S165 F174 K180	F137-Y176 HydrophobicContact CE1-CD2 4.41Å; F137-Y176 AromaticContact CE2-CD2 3.77Å; F137-Y176 HydrophobicContact CE2-CD2 3.77Å; F137-Y176 HydrophobicContact CE2-CE2 4.18Å; F137-Y176 AromaticContact CZ-CD2 3.46Å; F137-Y176 HydrophobicContact CZ-CD2 3.46Å; F137-Y176 VanDerWaalsContact CZ-CD2 3.46Å; F137-Y176 HydrophobicContact CZ-CE2 4.16Å; F137-Y176 HydrophobicContact CZ-CG 4.25Å; S165-Y176 WeakPolarHBondContact CB-OH 3.34Å; S165-Y176 WeakPolarHBondContact OG-CE1 3.24Å; S165-Y176 PolarHBondContact OG-OH 2.88Å; F174-Y176 HydrophobicContact CE1-CD1 4.23Å; F174-Y176 HydrophobicContact CE1-CG 4.29Å; F174-Y176 PolarHBondContact O-N 3.37Å; Y176-K180 HydrophobicContact CE2-CG 4.49Å; Y176-K180 WeakPolarHBondContact O-CG 3.24Å; Y176-K180 PolarHBondContact O-N 2.94Å
177	L	93.7	Very high	95.5	Very high	39 Å²	39	48.2 Å²	48.2	20%	0.204	26%	0.257	C	S	.	.	H	α-helix	trans	-74.7	-34.4	-178.7	-61.4	176.8	0	0	0	111.4	D169 F174 K180 G181	D169-L177 PolarHBondContact N-O 3.35Å; D169-L177 CarbonylContact O-C 3.55Å; F174-L177 HydrophobicContact CD1-CD1 4.02Å; F174-L177 HydrophobicContact CD1-CG 3.84Å; F174-L177 PolarHBondContact O-N 2.89Å; L177-K180 PolarHBondContact O-N 3.18Å; L177-G181 PolarHBondContact O-N 2.7Å
178	Q	95.8	Very high	95.8	Very high	46 Å²	46	50 Å²	50	22%	0.215	26%	0.255	C	S	.	.	H	α-helix	trans	-58.8	-54.2	174.3	-173.2	-83.1	-48.2	0	0	111.3	D169 S172 F174 K180 G181 E182	D169-Q178 VanDerWaalsContact O-CA 3.24Å; D169-Q178 WeakPolarHBondContact O-CA 3.44Å; S172-Q178 WeakPolarHBondContact O-CB 3.49Å; F174-Q178 PolarHBondContact O-N 3.42Å; Q178-K180 PolarHBondContact O-N 3.45Å; Q178-G181 PolarHBondContact O-N 2.84Å; Q178-E182 PolarHBondContact NE2-OE2 2.84Å; Q178-E182 WeakPolarHBondContact O-CB 3.45Å; Q178-E182 PolarHBondContact O-N 3.08Å
179	V	96.4	Very high	96	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-61.2	-43.2	179.3	165.9	0	0	0	0	111.6	F137 V138 D141 R142 L175 E182 V183	F137-V179 HydrophobicContact CD1-CB 4.49Å; F137-V179 HydrophobicContact CD1-CG1 4.5Å; F137-V179 HydrophobicContact CD1-CG2 4.2Å; F137-V179 HydrophobicContact CE1-CB 3.61Å; F137-V179 HydrophobicContact CE1-CG1 3.79Å; F137-V179 HydrophobicContact CE1-CG2 3.71Å; F137-V179 HydrophobicContact CZ-CB 4.1Å; F137-V179 HydrophobicContact CZ-CG1 4Å; V138-V179 HydrophobicContact CG2-CG2 3.8Å; D141-V179 HydrophobicContact CB-CG1 3.78Å; R142-V179 HydrophobicContact CB-CG1 4.09Å; L175-V179 HydrophobicContact CD1-CG2 3.89Å; L175-V179 HydrophobicContact CG-CG2 4.26Å; L175-V179 WeakPolarHBondContact O-CB 3.47Å; L175-V179 VanDerWaalsContact O-CG2 3.23Å; L175-V179 WeakPolarHBondContact O-CG2 3.29Å; L175-V179 PolarHBondContact O-N 3.44Å; V179-E182 PolarHBondContact O-N 2.97Å; V179-V183 WeakPolarHBondContact O-CG1 3.31Å; V179-V183 PolarHBondContact O-N 2.66Å
180	K	96.4	Very high	96.1	Very high	9 Å²	9	55.2 Å²	55.2	4%	0.039	28%	0.278	C	S	.	.	H	α-helix	trans	-63.6	-42.7	177.4	-73.2	-63.3	-178.8	-168.7	0	112.3	D141 A168 Y176 L177 Q178 V183 E184	D141-K180 WeakPolarHBondContact OD1-CE 3.49Å; D141-K180 IonicContact OD1-NZ 3.56Å; D141-K180 PolarHBondContact OD1-NZ 3.18Å; A168-K180 HydrophobicContact CB-CB 3.73Å; Y176-K180 HydrophobicContact CE2-CG 4.49Å; Y176-K180 WeakPolarHBondContact O-CG 3.24Å; Y176-K180 PolarHBondContact O-N 2.94Å; L177-K180 PolarHBondContact O-N 3.18Å; Q178-K180 PolarHBondContact O-N 3.45Å; K180-V183 WeakPolarHBondContact O-CG1 3Å; K180-E184 VanDerWaalsContact O-CG 3.24Å; K180-E184 WeakPolarHBondContact O-CG 3.39Å; K180-E184 PolarHBondContact O-N 3.28Å; K180-E184 VanDerWaalsContact O-N 3.17Å
181	G	97.7	Very high	96.2	Very high	5 Å²	5	53.4 Å²	53.4	5%	0.052	27%	0.269	C	S	.	.	H	α-helix	trans	-70.2	-34.1	175.8	0	0	0	0	0	113.2	L177 Q178 A185	L177-G181 PolarHBondContact O-N 2.7Å; Q178-G181 PolarHBondContact O-N 2.84Å; G181-A185 PolarHBondContact O-N 3Å
182	E	98.3	Very high	96.3	Very high	32 Å²	32	49.2 Å²	49.2	15%	0.15	24%	0.24	C	C	.	.	H	α-helix	trans	-65.1	-46.7	176.9	-171.7	-173.7	159	0	0	111.2	R142 Q178 V179 A185 K186	R142-E182 WeakPolarHBondContact CD-OE1 3.46Å; R142-E182 IonicContact CZ-OE1 3.89Å; R142-E182 IonicContact NE-OE1 3.85Å; R142-E182 IonicContact NH1-OE1 2.64Å; R142-E182 PolarHBondContact NH1-OE1 3.25Å; R142-E182 VanDerWaalsContact NH1-OE1 3.09Å; R142-E182 IonicContact NH1-OE2 3.89Å; R142-E182 PolarHBondContact NH1-OE2 2.64Å; Q178-E182 PolarHBondContact NE2-OE2 2.84Å; Q178-E182 WeakPolarHBondContact O-CB 3.45Å; Q178-E182 PolarHBondContact O-N 3.08Å; V179-E182 PolarHBondContact O-N 2.97Å; E182-A185 PolarHBondContact O-N 3.35Å; E182-K186 HydrophobicContact CG-CD 4.26Å; E182-K186 WeakPolarHBondContact O-CG 3.35Å; E182-K186 PolarHBondContact O-N 2.99Å; E182-K186 VanDerWaalsContact OE1-CE 3.29Å; E182-K186 WeakPolarHBondContact OE1-CE 3.5Å; E182-K186 IonicContact OE1-NZ 3.29Å; E182-K186 PolarHBondContact OE1-NZ 2.8Å
183	V	98.5	Very high	96.5	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-69.5	-34.3	179.9	73	0	0	0	0	112.3	R142 V145 L162 V179 K180 K186 V187	R142-V183 HydrophobicContact CG-CB 4.23Å; V145-V183 HydrophobicContact CB-CG2 3.87Å; V145-V183 HydrophobicContact CG1-CG2 3.54Å; L162-V183 HydrophobicContact CD2-CG1 4.27Å; V179-V183 WeakPolarHBondContact O-CG1 3.31Å; V179-V183 PolarHBondContact O-N 2.66Å; K180-V183 WeakPolarHBondContact O-CG1 3Å; V183-K186 PolarHBondContact O-N 2.79Å; V183-V187 HydrophobicContact CG2-CG2 4.14Å; V183-V187 WeakPolarHBondContact O-CB 3.02Å; V183-V187 VanDerWaalsContact O-CG2 3.26Å; V183-V187 WeakPolarHBondContact O-CG2 3.39Å; V183-V187 PolarHBondContact O-N 2.86Å
184	E	98.6	Very high	96.8	Very high	8 Å²	8	44.7 Å²	44.7	4%	0.037	21%	0.212	C	C	.	.	H	α-helix	trans	-57.5	-49.7	172.1	-76.8	173.1	-174.8	0	0	111.4	L162 S164 A168 K180 V187 E188 Y195 V197 R199	L162-E184 HydrophobicContact CD2-CG 4.07Å; S164-E184 WeakPolarHBondContact CB-OE1 3.46Å; S164-E184 PolarHBondContact OG-OE1 2.91Å; A168-E184 VanDerWaalsContact CB-OE1 3.29Å; A168-E184 WeakPolarHBondContact CB-OE1 3.26Å; K180-E184 VanDerWaalsContact O-CG 3.24Å; K180-E184 WeakPolarHBondContact O-CG 3.39Å; K180-E184 PolarHBondContact O-N 3.28Å; K180-E184 VanDerWaalsContact O-N 3.17Å; E184-V187 PolarHBondContact O-N 3.25Å; E184-E188 WeakPolarHBondContact O-CB 3.32Å; E184-E188 PolarHBondContact O-N 3.15Å; E184-Y195 PolarHBondContact O-OH 3.05Å; E184-V197 HydrophobicContact CG-CG1 3.77Å; E184-V197 WeakPolarHBondContact OE1-CG1 3.23Å; E184-R199 IonicContact OE1-CZ 3.01Å; E184-R199 IonicContact OE1-NE 2.76Å; E184-R199 PolarHBondContact OE1-NE 3.09Å; E184-R199 IonicContact OE1-NH2 3.61Å; E184-R199 IonicContact OE2-CZ 2.84Å; E184-R199 VanDerWaalsContact OE2-CZ 3.29Å; E184-R199 IonicContact OE2-NE 3.5Å; E184-R199 PolarHBondContact OE2-NE 2.65Å; E184-R199 VanDerWaalsContact OE2-NE 3.15Å; E184-R199 IonicContact OE2-NH2 2.8Å; E184-R199 PolarHBondContact OE2-NH2 3.2Å
185	A	98.6	Very high	97.2	Very high	18 Å²	18	39 Å²	39	15%	0.149	19%	0.187	C	C	.	.	H	α-helix	trans	-63.3	-44	179.2	0	0	0	0	0	112	K170 G181 E182 V187 E188 E189	K170-A185 HydrophobicContact CD-CB 4.29Å; G181-A185 PolarHBondContact O-N 3Å; E182-A185 PolarHBondContact O-N 3.35Å; A185-V187 PolarHBondContact O-N 3.43Å; A185-E188 WeakPolarHBondContact O-CB 3.35Å; A185-E188 PolarHBondContact O-N 2.85Å; A185-E189 WeakPolarHBondContact O-CG 3.23Å; A185-E189 PolarHBondContact O-N 2.51Å
186	K	98.7	Very high	97.6	Very high	65 Å²	65	36.6 Å²	36.6	28%	0.283	17%	0.174	S	C	.	.	H	α-helix	trans	-66.4	-36.3	179.5	-71	-178.1	173.4	177.2	0	112.9	L146 E182 V183 E189	L146-K186 HydrophobicContact CD1-CB 3.75Å; L146-K186 HydrophobicContact CD2-CB 4.06Å; L146-K186 HydrophobicContact CD2-CD 3.72Å; L146-K186 HydrophobicContact CD2-CG 4.47Å; E182-K186 HydrophobicContact CG-CD 4.26Å; E182-K186 WeakPolarHBondContact O-CG 3.35Å; E182-K186 PolarHBondContact O-N 2.99Å; E182-K186 VanDerWaalsContact OE1-CE 3.29Å; E182-K186 WeakPolarHBondContact OE1-CE 3.5Å; E182-K186 IonicContact OE1-NZ 3.29Å; E182-K186 PolarHBondContact OE1-NZ 2.8Å; V183-K186 PolarHBondContact O-N 2.79Å; K186-E189 WeakPolarHBondContact O-CB 3.4Å; K186-E189 PolarHBondContact O-N 2.81Å
187	V	98.7	Very high	97.9	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-73.2	-33.3	176.1	175	0	0	0	0	111.2	L146 A149 F160 V183 E184 A185 E189 L190 F192 Y195	L146-V187 HydrophobicContact CD1-CG2 4.16Å; A149-V187 HydrophobicContact CB-CG1 4.11Å; A149-V187 HydrophobicContact CB-CG2 3.93Å; F160-V187 HydrophobicContact CD1-CG1 3.81Å; F160-V187 HydrophobicContact CE1-CG1 3.99Å; V183-V187 HydrophobicContact CG2-CG2 4.14Å; V183-V187 WeakPolarHBondContact O-CB 3.02Å; V183-V187 VanDerWaalsContact O-CG2 3.26Å; V183-V187 WeakPolarHBondContact O-CG2 3.39Å; V183-V187 PolarHBondContact O-N 2.86Å; E184-V187 PolarHBondContact O-N 3.25Å; A185-V187 PolarHBondContact O-N 3.43Å; V187-E189 PolarHBondContact O-N 3.05Å; V187-L190 WeakPolarHBondContact O-CB 3.26Å; V187-L190 PolarHBondContact O-N 2.91Å; V187-L190 VanDerWaalsContact O-N 3.12Å; V187-F192 HydrophobicContact CG1-CE2 4.21Å; V187-Y195 HydrophobicContact CB-CE1 4.43Å; V187-Y195 HydrophobicContact CB-CE2 4.24Å; V187-Y195 HydrophobicContact CG1-CD2 3.99Å; V187-Y195 HydrophobicContact CG1-CE1 4.23Å; V187-Y195 HydrophobicContact CG1-CE2 3.42Å; V187-Y195 VanDerWaalsContact CG1-CE2 3.42Å
188	E	98.4	Very high	98.2	Very high	77 Å²	77	31.4 Å²	31.4	36%	0.36	15%	0.151	S	C	.	.	H	α-helix	trans	-59.5	-36.2	172.4	-173	-169.4	162.2	0	0	112.2	E184 A185 L190 K191 Y195 M255	E184-E188 WeakPolarHBondContact O-CB 3.32Å; E184-E188 PolarHBondContact O-N 3.15Å; A185-E188 WeakPolarHBondContact O-CB 3.35Å; A185-E188 PolarHBondContact O-N 2.85Å; E188-L190 PolarHBondContact O-N 3.1Å; E188-K191 WeakPolarHBondContact O-CD 3.38Å; E188-K191 PolarHBondContact O-N 3.35Å; E188-K191 VanDerWaalsContact O-N 3.13Å; E188-K191 IonicContact OE1-NZ 3.76Å; E188-Y195 HydrophobicContact CB-CD1 4.21Å; E188-Y195 HydrophobicContact CB-CE1 4.01Å; E188-M255 HydrophobicContact CB-SD 4.34Å; E188-M255 HydrophobicContact CG-CE 4.46Å; E188-M255 HydrophobicContact CG-SD 3.6Å; E188-M255 VanDerWaalsContact CG-SD 3.6Å
189	E	98.4	Very high	98.3	Very high	143 Å²	143	31.1 Å²	31.1	67%	0.668	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-21	176.8	-69.9	170.6	-164	0	0	113.3	A185 K186 V187 K191	A185-E189 WeakPolarHBondContact O-CG 3.23Å; A185-E189 PolarHBondContact O-N 2.51Å; K186-E189 WeakPolarHBondContact O-CB 3.4Å; K186-E189 PolarHBondContact O-N 2.81Å; V187-E189 PolarHBondContact O-N 3.05Å; E189-K191 PolarHBondContact O-N 2.82Å
190	L	98.5	Very high	98.1	Very high	41 Å²	41	31.2 Å²	31.2	22%	0.215	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-11.6	176.3	-56.3	179.4	0	0	0	113.4	L146 A149 E150 K153 V187 E188 F192	L146-L190 HydrophobicContact CD1-CD1 4.34Å; A149-L190 HydrophobicContact CB-CD1 3.55Å; E150-L190 HydrophobicContact CG-CD1 4.19Å; E150-L190 HydrophobicContact CG-CD2 3.94Å; K153-L190 WeakPolarHBondContact CE-O 3.05Å; V187-L190 WeakPolarHBondContact O-CB 3.26Å; V187-L190 PolarHBondContact O-N 2.91Å; V187-L190 VanDerWaalsContact O-N 3.12Å; E188-L190 PolarHBondContact O-N 3.1Å; L190-F192 HydrophobicContact CB-CD2 4.23Å; L190-F192 HydrophobicContact CB-CE2 4.03Å; L190-F192 HydrophobicContact CD1-CE2 4.01Å; L190-F192 PolarHBondContact O-N 3.23Å
191	K	98.2	Very high	97.8	Very high	98 Å²	98	31.2 Å²	31.2	43%	0.426	15%	0.151	S	C	.	.			trans	49.6	53.1	173.9	-58.9	-59.9	172.1	-163.9	0	113	K153 E188 E189	K153-K191 PolarHBondContact NZ-O 3.21Å; E188-K191 WeakPolarHBondContact O-CD 3.38Å; E188-K191 PolarHBondContact O-N 3.35Å; E188-K191 VanDerWaalsContact O-N 3.13Å; E188-K191 IonicContact OE1-NZ 3.76Å; E189-K191 PolarHBondContact O-N 2.82Å
192	F	98.6	Very high	97.1	Very high	1 Å²	1	34 Å²	34	0%	0.004	17%	0.167	C	C	.	.			trans	-50.9	153.9	165.2	-75.2	-84.5	0	0	0	110.9	A149 A152 K153 C157 F160 V187 L190 R194 Q254	A149-F192 HydrophobicContact CB-CE2 4.25Å; A149-F192 HydrophobicContact CB-CZ 4.39Å; A149-F192 VanDerWaalsContact O-CZ 3.3Å; A149-F192 WeakPolarHBondContact O-CZ 3.45Å; A152-F192 HydrophobicContact CB-CE1 4.48Å; A152-F192 HydrophobicContact CB-CZ 4.33Å; K153-F192 HydrophobicContact CB-CD1 4.47Å; K153-F192 HydrophobicContact CB-CE1 3.73Å; K153-F192 HydrophobicContact CB-CE2 4.34Å; K153-F192 HydrophobicContact CB-CZ 3.68Å; K153-F192 HydrophobicContact CD-CD1 3.8Å; K153-F192 HydrophobicContact CD-CE1 3.93Å; K153-F192 HydrophobicContact CD-CG 4.2Å; K153-F192 HydrophobicContact CD-CZ 4.45Å; K153-F192 HydrophobicContact CG-CE1 4.42Å; C157-F192 HydrophobicContact CB-CE1 4.07Å; C157-F192 WeakPolarHBondContact O-CD1 3.27Å; F160-F192 HydrophobicContact CB-CD1 3.78Å; F160-F192 HydrophobicContact CB-CD2 3.71Å; F160-F192 HydrophobicContact CB-CE1 3.75Å; F160-F192 HydrophobicContact CB-CE2 3.67Å; F160-F192 HydrophobicContact CB-CG 3.76Å; F160-F192 HydrophobicContact CB-CZ 3.66Å; F160-F192 HydrophobicContact CD1-CE2 4.29Å; F160-F192 HydrophobicContact CD2-CE1 4.36Å; F160-F192 HydrophobicContact CD2-CE2 4.38Å; F160-F192 AromaticContact CD2-CZ 3.91Å; F160-F192 HydrophobicContact CD2-CZ 3.91Å; F160-F192 HydrophobicContact CG-CD2 4.38Å; F160-F192 HydrophobicContact CG-CE1 4.32Å; F160-F192 AromaticContact CG-CE2 3.88Å; F160-F192 HydrophobicContact CG-CE2 3.88Å; F160-F192 AromaticContact CG-CZ 3.83Å; F160-F192 HydrophobicContact CG-CZ 3.83Å; V187-F192 HydrophobicContact CG1-CE2 4.21Å; L190-F192 HydrophobicContact CB-CD2 4.23Å; L190-F192 HydrophobicContact CB-CE2 4.03Å; L190-F192 HydrophobicContact CD1-CE2 4.01Å; L190-F192 PolarHBondContact O-N 3.23Å; F192-R194 WeakPolarHBondContact CB-O 3.4Å; F192-R194 PolarHBondContact O-N 2.93Å; F192-Q254 VanDerWaalsContact O-CG 3.22Å; F192-Q254 WeakPolarHBondContact O-CG 3.24Å; F192-Q254 PolarHBondContact O-NE2 2.82Å; F192-Q254 VanDerWaalsContact O-NE2 3.13Å
193	D	98.2	Very high	96.5	Very high	84 Å²	84	33.8 Å²	33.8	45%	0.449	17%	0.167	S	C	.	.	S	Bend	trans	-62.5	-35.2	177.2	-59.3	23.2	0	0	0	108.8	K153 K158	K153-D193 IonicContact NZ-OD1 2.72Å; K153-D193 PolarHBondContact NZ-OD1 3.35Å; K158-D193 HydrophobicContact CB-CB 4.45Å; K158-D193 VanDerWaalsContact CD-OD2 3.3Å; K158-D193 WeakPolarHBondContact CD-OD2 3.48Å; K158-D193 WeakPolarHBondContact CE-OD2 3.37Å; K158-D193 IonicContact NZ-OD1 3.79Å; K158-D193 IonicContact NZ-OD2 2.84Å; K158-D193 PolarHBondContact NZ-OD2 3.45Å; K158-D193 PolarHBondContact O-N 3.43Å
194	R	98.5	Very high	95.5	Very high	27 Å²	27	36.6 Å²	36.6	10%	0.102	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	133.1	166	-171.4	178.6	176.4	-175.2	9.5	111	K158 H159 F160 F192 N246 R249 Q254 E256	K158-R194 PolarHBondContact O-N 2.89Å; H159-R194 VanDerWaalsContact CA-O 3.27Å; H159-R194 WeakPolarHBondContact CA-O 3.49Å; H159-R194 HydrophobicContact CB-CB 4.23Å; H159-R194 PolarHBondContact CD2-O 3.4Å; H159-R194 PolarHBondContact CE1-NE 3.05Å; F160-R194 PolarHBondContact N-O 2.87Å; F192-R194 WeakPolarHBondContact CB-O 3.4Å; F192-R194 PolarHBondContact O-N 2.93Å; R194-N246 PolarHBondContact NH1-O 3Å; R194-N246 PolarHBondContact NH2-ND2 3.45Å; R194-N246 PolarHBondContact NH2-O 3.37Å; R194-N246 PolarHBondContact NH2-OD1 2.92Å; R194-R249 PolarHBondContact NH1-O 3.45Å; R194-R249 PolarHBondContact NH2-O 3.48Å; R194-Q254 CarbonylContact C-O 3.53Å; R194-Q254 WeakPolarHBondContact CA-O 3.48Å; R194-E256 IonicContact CZ-OE1 3.62Å; R194-E256 IonicContact CZ-OE2 2.68Å; R194-E256 VanDerWaalsContact CZ-OE2 3.31Å; R194-E256 IonicContact NE-OE1 3.78Å; R194-E256 IonicContact NE-OE2 3.17Å; R194-E256 PolarHBondContact NE-OE2 3.18Å; R194-E256 IonicContact NH2-OE1 3.66Å; R194-E256 PolarHBondContact NH2-OE1 3.31Å; R194-E256 IonicContact NH2-OE2 2.63Å; R194-E256 PolarHBondContact NH2-OE2 3.29Å
195	Y	98.8	Very high	94.4	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.016	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	115.8	176.3	176.2	-138.2	0	0	0	109.9	F160 L162 E184 V187 E188 V197 Q254 M255 E256	F160-Y195 HydrophobicContact CB-CD2 4.47Å; F160-Y195 HydrophobicContact CD1-CD2 4.2Å; F160-Y195 HydrophobicContact CD1-CE2 4.04Å; F160-Y195 WeakPolarHBondContact O-CA 3.31Å; F160-Y195 WeakPolarHBondContact O-CD2 3.35Å; L162-Y195 HydrophobicContact CB-CE2 3.92Å; L162-Y195 VanDerWaalsContact CD2-OH 3.23Å; L162-Y195 WeakPolarHBondContact CD2-OH 3.42Å; E184-Y195 PolarHBondContact O-OH 3.05Å; V187-Y195 HydrophobicContact CB-CE1 4.43Å; V187-Y195 HydrophobicContact CB-CE2 4.24Å; V187-Y195 HydrophobicContact CG1-CD2 3.99Å; V187-Y195 HydrophobicContact CG1-CE1 4.23Å; V187-Y195 HydrophobicContact CG1-CE2 3.42Å; V187-Y195 VanDerWaalsContact CG1-CE2 3.42Å; E188-Y195 HydrophobicContact CB-CD1 4.21Å; E188-Y195 HydrophobicContact CB-CE1 4.01Å; Y195-V197 HydrophobicContact CD1-CG2 4.11Å; Y195-V197 HydrophobicContact CD2-CG2 4.41Å; Y195-V197 HydrophobicContact CE1-CG2 3.4Å; Y195-V197 HydrophobicContact CE2-CG2 3.73Å; Y195-V197 VanDerWaalsContact OH-CG2 3.24Å; Y195-V197 WeakPolarHBondContact OH-CG2 3.37Å; Y195-Q254 PolarHBondContact N-O 3.45Å; Y195-M255 HydrophobicContact CD1-CE 4.22Å; Y195-M255 HydrophobicContact CD1-CG 3.93Å; Y195-M255 HydrophobicContact CD1-SD 4.27Å; Y195-M255 HydrophobicContact CE1-CE 3.99Å; Y195-M255 CarbonylContact O-C 3.5Å; Y195-M255 VanDerWaalsContact O-CA 3.3Å; Y195-M255 WeakPolarHBondContact O-CA 3.34Å; Y195-E256 PolarHBondContact O-N 3.04Å
196	S	98.8	Very high	92.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	123.8	178.9	-48	0	0	0	0	111	H159 F160 N161 L162 N246 E256	H159-S196 PolarHBondContact NE2-OG 3.39Å; F160-S196 PolarHBondContact O-N 3.33Å; N161-S196 CarbonylContact C-O 3.6Å; N161-S196 WeakPolarHBondContact CA-O 3.32Å; N161-S196 WeakPolarHBondContact OD1-CB 3.34Å; L162-S196 PolarHBondContact N-O 3.04Å; S196-N246 PolarHBondContact OG-ND2 3.43Å; S196-N246 VanDerWaalsContact OG-ND2 3.07Å; S196-E256 CarbonylContact C-O 3.48Å; S196-E256 WeakPolarHBondContact CA-O 3.17Å; S196-E256 PolarHBondContact OG-OE2 3.16Å
197	V	98.8	Very high	90.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	125.3	177	-176.2	0	0	0	0	109.1	E184 Y195 R199 M255 E256 L257 L258	E184-V197 HydrophobicContact CG-CG1 3.77Å; E184-V197 WeakPolarHBondContact OE1-CG1 3.23Å; Y195-V197 HydrophobicContact CD1-CG2 4.11Å; Y195-V197 HydrophobicContact CD2-CG2 4.41Å; Y195-V197 HydrophobicContact CE1-CG2 3.4Å; Y195-V197 HydrophobicContact CE2-CG2 3.73Å; Y195-V197 VanDerWaalsContact OH-CG2 3.24Å; Y195-V197 WeakPolarHBondContact OH-CG2 3.37Å; V197-R199 HydrophobicContact CG1-CG 4.21Å; V197-M255 HydrophobicContact CG2-CE 4.08Å; V197-E256 PolarHBondContact N-O 2.86Å; V197-L257 HydrophobicContact CB-CG 4.47Å; V197-L258 PolarHBondContact O-N 2.62Å
198	F	98.6	Very high	88.5	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.5	175.9	-59.6	-94.4	0	0	0	108.7	N161 L162 S164 P200 M243 N246 L258 I263	N161-F198 HydrophobicContact CB-CE2 4.17Å; L162-F198 PolarHBondContact O-N 3.18Å; S164-F198 CarbonylContact C-O 3.57Å; S164-F198 WeakPolarHBondContact CA-O 3.39Å; S164-F198 PolarHBondContact N-O 3.4Å; F198-P200 WeakPolarHBondContact O-CD 3.45Å; F198-M243 HydrophobicContact CD1-CG 3.81Å; F198-M243 HydrophobicContact CD2-CG 3.97Å; F198-M243 HydrophobicContact CE1-CB 4.23Å; F198-M243 HydrophobicContact CE1-CG 3.7Å; F198-M243 HydrophobicContact CE2-CB 4.48Å; F198-M243 HydrophobicContact CE2-CG 3.88Å; F198-M243 HydrophobicContact CG-CG 3.95Å; F198-M243 HydrophobicContact CZ-CB 4.08Å; F198-M243 HydrophobicContact CZ-CG 3.75Å; F198-N246 HydrophobicContact CE1-CB 4.3Å; F198-N246 HydrophobicContact CZ-CB 4.05Å; F198-L258 HydrophobicContact CD1-CB 4.18Å; F198-L258 HydrophobicContact CD1-CD1 4.38Å; F198-L258 HydrophobicContact CD1-CD2 4.35Å; F198-L258 HydrophobicContact CE1-CD1 4.09Å; F198-L258 HydrophobicContact CE1-CD2 3.96Å; F198-L258 HydrophobicContact CE1-CG 4.44Å; F198-L258 HydrophobicContact CZ-CD1 4.39Å; F198-I263 HydrophobicContact CB-CD1 4.11Å; F198-I263 HydrophobicContact CD1-CG1 4.33Å
199	R	97.8	Very high	85.9	Confident	39 Å²	39	51.9 Å²	51.9	15%	0.147	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	73.2	177.3	-72.5	-173.2	176.9	-179.6	-8.9	111	S165 A168 E184 V197 L258 E259 N260	S165-R199 WeakPolarHBondContact O-CB 3.25Å; S165-R199 WeakPolarHBondContact O-CG 3.21Å; A168-R199 VanDerWaalsContact O-CZ 3.29Å; A168-R199 PolarHBondContact O-NH2 2.78Å; E184-R199 IonicContact OE1-CZ 3.01Å; E184-R199 IonicContact OE1-NE 2.76Å; E184-R199 PolarHBondContact OE1-NE 3.09Å; E184-R199 IonicContact OE1-NH2 3.61Å; E184-R199 IonicContact OE2-CZ 2.84Å; E184-R199 VanDerWaalsContact OE2-CZ 3.29Å; E184-R199 IonicContact OE2-NE 3.5Å; E184-R199 PolarHBondContact OE2-NE 2.65Å; E184-R199 VanDerWaalsContact OE2-NE 3.15Å; E184-R199 IonicContact OE2-NH2 2.8Å; E184-R199 PolarHBondContact OE2-NH2 3.2Å; V197-R199 HydrophobicContact CG1-CG 4.21Å; R199-L258 PolarHBondContact N-O 3.12Å; R199-E259 WeakPolarHBondContact CB-OE2 3.47Å; R199-E259 VanDerWaalsContact CD-OE1 3.23Å; R199-E259 WeakPolarHBondContact CD-OE1 3.26Å; R199-E259 IonicContact CZ-OE1 3.31Å; R199-E259 IonicContact NE-OE1 2.67Å; R199-E259 IonicContact NH1-OE1 2.92Å; R199-E259 PolarHBondContact NH1-OE1 2.71Å; R199-N260 PolarHBondContact O-N 3.04Å
200	P	94.3	Very high	83.3	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.019	26%	0.259	C	S	.	.			trans	-68.8	150.6	178.3	30.9	-36.3	0	0	0	111	V163 K166 F198 L203 V234 V239 I263	V163-P200 HydrophobicContact CG1-CG 4.44Å; K166-P200 WeakPolarHBondContact CB-O 3.1Å; K166-P200 PolarHBondContact N-O 2.75Å; F198-P200 WeakPolarHBondContact O-CD 3.45Å; P200-L203 HydrophobicContact CB-CD2 3.9Å; P200-L203 HydrophobicContact CG-CD2 4.15Å; P200-V234 HydrophobicContact CB-CG1 3.62Å; P200-V239 HydrophobicContact CB-CG2 3.98Å; P200-I263 HydrophobicContact CB-CD1 4.07Å
201	G	88.4	Confident	81.1	Confident	9 Å²	9	53.8 Å²	53.8	9%	0.093	27%	0.269	C	S	.	.			trans	-67.6	-161.6	162.4	0	0	0	0	0	111.5	L203 Q232 N260	G201-L203 PolarHBondContact O-N 3.4Å; G201-L203 VanDerWaalsContact O-N 3.11Å; G201-Q232 CarbonylContact C-O 3.46Å; G201-Q232 WeakPolarHBondContact CA-O 3.46Å; G201-N260 PolarHBondContact N-OD1 2.91Å
202	V	84.6	Confident	78.5	Confident	62 Å²	62	55.1 Å²	55.1	38%	0.376	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	118.8	175.4	-178.9	0	0	0	0	109.7	L204 V217 Q232 S233 V234	V202-L204 PolarHBondContact O-N 3.15Å; V202-V217 HydrophobicContact CG1-CG1 4.42Å; V202-Q232 PolarHBondContact N-O 2.94Å; V202-S233 CarbonylContact O-C 3.55Å; V202-S233 WeakPolarHBondContact O-CA 3.41Å; V202-S233 VanDerWaalsContact O-CB 3.27Å; V202-S233 WeakPolarHBondContact O-CB 3.3Å; V202-V234 PolarHBondContact O-N 3.08Å
203	L	83.9	Confident	76	Confident	28 Å²	28	57.2 Å²	57.2	15%	0.147	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	120.2	178.1	-61.8	176.7	0	0	0	110.1	P200 G201 V234 L236 V239	P200-L203 HydrophobicContact CB-CD2 3.9Å; P200-L203 HydrophobicContact CG-CD2 4.15Å; G201-L203 PolarHBondContact O-N 3.4Å; G201-L203 VanDerWaalsContact O-N 3.11Å; L203-V234 WeakPolarHBondContact CA-O 3.42Å; L203-V234 HydrophobicContact CD2-CG1 4.02Å; L203-L236 HydrophobicContact CD1-CD1 4.17Å; L203-L236 HydrophobicContact CD2-CD1 4.34Å; L203-V239 HydrophobicContact CD2-CG2 3.66Å
204	L	79.3	Confident	73.8	Confident	60 Å²	60	54 Å²	54	31%	0.314	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	110.3	170.7	-53.7	176.8	0	0	0	108.3	V202 R218 V234 L236	V202-L204 PolarHBondContact O-N 3.15Å; L204-R218 HydrophobicContact CD2-CG 4.33Å; L204-V234 PolarHBondContact N-O 3.37Å; L204-L236 PolarHBondContact O-N 3.47Å
205	C	74.3	Confident	71.4	Confident	15 Å²	15	60.4 Å²	60.4	10%	0.101	32%	0.316	C	S	.	.			trans	-150.3	146.8	175.6	44.2	0	0	0	0	110.1	R207 R218 L236	C205-R207 HydrophobicContact CB-CG 4.31Å; C205-R207 PolarHBondContact O-N 3.07Å; C205-R207 WeakPolarHBondContact SG-CG 3.33Å; C205-R207 PolarHBondContact SG-NE 2.83Å; C205-R218 PolarHBondContact O-NH1 3.44Å; C205-L236 HydrophobicContact CB-CB 3.93Å; C205-L236 HydrophobicContact CB-CD2 3.87Å
206	D	63.3	Low	69	Low	139 Å²	139	65.4 Å²	65.4	74%	0.743	34%	0.343	S	S	*	.			trans	-78.9	81.5	170.2	-65.9	-32.3	0	0	0	108.7	R218	D206-R218 IonicContact OD1-CZ 3.13Å; D206-R218 IonicContact OD1-NH1 3.33Å; D206-R218 PolarHBondContact OD1-NH1 3.09Å; D206-R218 IonicContact OD1-NH2 3.74Å; D206-R218 PolarHBondContact OD1-NH2 3.13Å
207	R	60.5	Low	66.9	Low	47 Å²	47	67.7 Å²	67.7	18%	0.177	36%	0.357	C	S	.	.			trans	-71.1	148.7	179.7	-59.3	-166.5	176.2	142.5	17.6	110.8	E62 C205 E209 E214	E62-R207 HydrophobicContact CG-CG 4.13Å; C205-R207 HydrophobicContact CB-CG 4.31Å; C205-R207 PolarHBondContact O-N 3.07Å; C205-R207 WeakPolarHBondContact SG-CG 3.33Å; C205-R207 PolarHBondContact SG-NE 2.83Å; R207-E209 WeakPolarHBondContact CB-O 3.33Å; R207-E209 PolarHBondContact O-N 3.35Å; R207-E214 IonicContact CZ-OE1 3.71Å; R207-E214 IonicContact CZ-OE2 2.69Å; R207-E214 IonicContact NE-OE1 3.09Å; R207-E214 IonicContact NE-OE2 3.35Å; R207-E214 IonicContact NH1-OE1 2.63Å; R207-E214 IonicContact NH1-OE2 2.8Å; R207-E214 PolarHBondContact NH1-OE2 3.29Å; R207-E214 IonicContact NH2-OE1 3.98Å; R207-E214 IonicContact NH2-OE2 2.65Å
208	Q	48.6	Very low	64.9	Low	171 Å²	171	72.9 Å²	72.9	80%	0.799	38%	0.376	S	S	*	.	S	Bend	trans	-68.8	-23.4	162.8	-70.8	-170.6	-17.8	0	0	112.3
209	E	43.6	Very low	62.8	Low	118 Å²	118	79.7 Å²	79.7	55%	0.551	41%	0.406	S	S	*	.	S	Bend	trans	-117.9	119.3	178.5	-66.5	179.5	162.9	0	0	111.4	K131 R207	K131-E209 IonicContact NZ-OE1 3.36Å; K131-E209 IonicContact NZ-OE2 2.77Å; K131-E209 PolarHBondContact NZ-OE2 3.24Å; R207-E209 WeakPolarHBondContact CB-O 3.33Å; R207-E209 PolarHBondContact O-N 3.35Å
210	S	43.7	Very low	60.5	Low	107 Å²	107	84.9 Å²	84.9	75%	0.748	43%	0.43	S	S	*	.			trans	-74.8	129.3	175.6	53.7	0	0	0	0	110.6
211	R	53.8	Low	58.5	Low	118 Å²	118	87.5 Å²	87.5	45%	0.445	44%	0.441	S	S	.	.			trans	-79.3	129.6	159.7	-69.2	-175.3	-175.6	172.6	5.3	107.1	G213 E214	R211-G213 PolarHBondContact O-N 3.29Å; R211-E214 HydrophobicContact CB-CB 3.92Å; R211-E214 WeakPolarHBondContact O-CB 3.45Å; R211-E214 PolarHBondContact O-N 2.98Å
212	P	43.3	Very low	56.7	Low	125 Å²	125	90.4 Å²	90.4	81%	0.812	47%	0.471	S	S	*	.	H	α-helix	trans	-54.6	-29.4	-174.7	-28.4	33.9	0	0	0	114.7
213	G	46.1	Very low	55.3	Low	45 Å²	45	92 Å²	92	46%	0.464	49%	0.485	S	S	.	.	H	α-helix	trans	-85.8	-17.6	175.9	0	0	0	0	0	115.3	R211 L216 V217	R211-G213 PolarHBondContact O-N 3.29Å; G213-L216 PolarHBondContact O-N 2.87Å; G213-V217 VanDerWaalsContact O-CB 3.3Å; G213-V217 WeakPolarHBondContact O-CB 3.46Å; G213-V217 WeakPolarHBondContact O-CG2 3.48Å; G213-V217 PolarHBondContact O-N 3.26Å
214	E	50.7	Low	53.8	Low	16 Å²	16	93.9 Å²	93.9	8%	0.075	50%	0.495	C	S	.	.	H	α-helix	trans	-74	-32.4	-175.1	-176.6	173.2	171.1	0	0	112.1	R207 R211 R218	R207-E214 IonicContact CZ-OE1 3.71Å; R207-E214 IonicContact CZ-OE2 2.69Å; R207-E214 IonicContact NE-OE1 3.09Å; R207-E214 IonicContact NE-OE2 3.35Å; R207-E214 IonicContact NH1-OE1 2.63Å; R207-E214 IonicContact NH1-OE2 2.8Å; R207-E214 PolarHBondContact NH1-OE2 3.29Å; R207-E214 IonicContact NH2-OE1 3.98Å; R207-E214 IonicContact NH2-OE2 2.65Å; R211-E214 HydrophobicContact CB-CB 3.92Å; R211-E214 WeakPolarHBondContact O-CB 3.45Å; R211-E214 PolarHBondContact O-N 2.98Å; E214-R218 HydrophobicContact CG-CG 4.38Å; E214-R218 VanDerWaalsContact O-CB 3.27Å; E214-R218 WeakPolarHBondContact O-CB 3.44Å; E214-R218 WeakPolarHBondContact O-CG 3.47Å; E214-R218 PolarHBondContact O-N 3.19Å
215	W	49.2	Very low	53	Low	162 Å²	162	94.8 Å²	94.8	61%	0.614	50%	0.504	S	S	*	.	H	α-helix	trans	-67.8	-43.9	173.6	-177.8	86.2	0	0	0	111.9	R218 K219	W215-R218 PolarHBondContact O-N 3.35Å; W215-K219 HydrophobicContact CH2-CD 3.85Å; W215-K219 HydrophobicContact CZ2-CD 3.93Å; W215-K219 HydrophobicContact CZ3-CD 4.38Å; W215-K219 WeakPolarHBondContact O-CB 3.07Å; W215-K219 PolarHBondContact O-N 2.69Å
216	L	48.1	Very low	52.2	Low	110 Å²	110	102.2 Å²	102.2	58%	0.576	54%	0.538	S	S	*	.	H	α-helix	trans	-63.8	-45.4	178.1	-151.1	85.8	0	0	0	110.1	G213 K219 F220	G213-L216 PolarHBondContact O-N 2.87Å; L216-K219 PolarHBondContact O-N 2.8Å; L216-F220 VanDerWaalsContact O-CB 3.28Å; L216-F220 WeakPolarHBondContact O-CB 3.49Å; L216-F220 PolarHBondContact O-N 2.63Å
217	V	54.3	Low	52.1	Low	47 Å²	47	100 Å²	100	29%	0.285	53%	0.533	S	S	.	.	H	α-helix	trans	-60.9	-49.6	174	166.9	0	0	0	0	110.8	V202 G213 K219 F220 F221	V202-V217 HydrophobicContact CG1-CG1 4.42Å; G213-V217 VanDerWaalsContact O-CB 3.3Å; G213-V217 WeakPolarHBondContact O-CB 3.46Å; G213-V217 WeakPolarHBondContact O-CG2 3.48Å; G213-V217 PolarHBondContact O-N 3.26Å; V217-K219 VanDerWaalsContact C-N 3.28Å; V217-K219 PolarHBondContact O-N 3.21Å; V217-F220 PolarHBondContact O-N 2.85Å; V217-F221 HydrophobicContact CB-CD2 4.1Å; V217-F221 HydrophobicContact CB-CE2 4.29Å; V217-F221 HydrophobicContact CG1-CD2 3.44Å; V217-F221 VanDerWaalsContact CG1-CD2 3.44Å; V217-F221 HydrophobicContact CG1-CE2 3.64Å; V217-F221 HydrophobicContact CG1-CG 4.34Å; V217-F221 HydrophobicContact CG2-CE2 4.26Å; V217-F221 VanDerWaalsContact O-CB 3.27Å; V217-F221 WeakPolarHBondContact O-CB 3.34Å; V217-F221 WeakPolarHBondContact O-CD2 3.08Å; V217-F221 PolarHBondContact O-N 3.47Å
218	R	56.2	Low	52	Low	109 Å²	109	105.4 Å²	105.4	41%	0.411	55%	0.553	S	S	.	*	H	α-helix	trans	-57.3	-40.9	177.8	-75.6	173.8	87.9	176.3	5.1	112.2	L204 C205 D206 E214 W215 G222	L204-R218 HydrophobicContact CD2-CG 4.33Å; C205-R218 PolarHBondContact O-NH1 3.44Å; D206-R218 IonicContact OD1-CZ 3.13Å; D206-R218 IonicContact OD1-NH1 3.33Å; D206-R218 PolarHBondContact OD1-NH1 3.09Å; D206-R218 IonicContact OD1-NH2 3.74Å; D206-R218 PolarHBondContact OD1-NH2 3.13Å; E214-R218 HydrophobicContact CG-CG 4.38Å; E214-R218 VanDerWaalsContact O-CB 3.27Å; E214-R218 WeakPolarHBondContact O-CB 3.44Å; E214-R218 WeakPolarHBondContact O-CG 3.47Å; E214-R218 PolarHBondContact O-N 3.19Å; W215-R218 PolarHBondContact O-N 3.35Å; R218-G222 PolarHBondContact O-N 3Å
219	K	54.1	Low	52.6	Low	144 Å²	144	98.1 Å²	98.1	63%	0.626	52%	0.522	S	S	*	.	H	α-helix	trans	-73.2	-37	179.1	-166.4	170.3	-176.6	176.8	0	113.1	W215 L216 V217	W215-K219 HydrophobicContact CH2-CD 3.85Å; W215-K219 HydrophobicContact CZ2-CD 3.93Å; W215-K219 HydrophobicContact CZ3-CD 4.38Å; W215-K219 WeakPolarHBondContact O-CB 3.07Å; W215-K219 PolarHBondContact O-N 2.69Å; L216-K219 PolarHBondContact O-N 2.8Å; V217-K219 VanDerWaalsContact C-N 3.28Å; V217-K219 PolarHBondContact O-N 3.21Å
220	F	51.1	Low	53.6	Low	147 Å²	147	94.9 Å²	94.9	65%	0.645	51%	0.513	S	S	*	.	H	α-helix	trans	-78.7	-32.6	179.5	-134.8	-89.8	0	0	0	112.9	L216 V217 S223	L216-F220 VanDerWaalsContact O-CB 3.28Å; L216-F220 WeakPolarHBondContact O-CB 3.49Å; L216-F220 PolarHBondContact O-N 2.63Å; V217-F220 PolarHBondContact O-N 2.85Å; F220-S223 PolarHBondContact O-OG 3.37Å; F220-S223 VanDerWaalsContact O-OG 3.08Å
221	F	50.8	Low	55	Low	58 Å²	58	91.3 Å²	91.3	25%	0.254	49%	0.493	S	S	.	.	H	α-helix	trans	-86.2	-19.8	178.2	-76.7	-94.4	0	0	0	112.9	V217 S223 L224 Q232	V217-F221 HydrophobicContact CB-CD2 4.1Å; V217-F221 HydrophobicContact CB-CE2 4.29Å; V217-F221 HydrophobicContact CG1-CD2 3.44Å; V217-F221 VanDerWaalsContact CG1-CD2 3.44Å; V217-F221 HydrophobicContact CG1-CE2 3.64Å; V217-F221 HydrophobicContact CG1-CG 4.34Å; V217-F221 HydrophobicContact CG2-CE2 4.26Å; V217-F221 VanDerWaalsContact O-CB 3.27Å; V217-F221 WeakPolarHBondContact O-CB 3.34Å; V217-F221 WeakPolarHBondContact O-CD2 3.08Å; V217-F221 PolarHBondContact O-N 3.47Å; F221-S223 PolarHBondContact O-N 3.14Å; F221-L224 HydrophobicContact CD1-CD1 3.83Å; F221-L224 HydrophobicContact CE1-CD1 4.16Å; F221-L224 HydrophobicContact CG-CD1 4.31Å; F221-L224 PolarHBondContact O-N 2.94Å; F221-Q232 HydrophobicContact CE1-CB 3.9Å; F221-Q232 HydrophobicContact CE1-CG 4.01Å; F221-Q232 HydrophobicContact CZ-CB 4.4Å
222	G	51.8	Low	56.1	Low	70 Å²	70	89.4 Å²	89.4	72%	0.722	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-16.9	172.4	0	0	0	0	0	114.4	R218	R218-G222 PolarHBondContact O-N 3Å
223	S	54.3	Low	58	Low	97 Å²	97	84 Å²	84	68%	0.678	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	1.5	176.7	55.5	0	0	0	0	114.1	F220 F221	F220-S223 PolarHBondContact O-OG 3.37Å; F220-S223 VanDerWaalsContact O-OG 3.08Å; F221-S223 PolarHBondContact O-N 3.14Å
224	L	53.7	Low	59.9	Low	66 Å²	66	81.9 Å²	81.9	35%	0.346	43%	0.432	S	S	.	.	S	Bend	trans	-94.1	158.8	177.4	-72.3	174.1	0	0	0	111.2	F221 E226 W228	F221-L224 HydrophobicContact CD1-CD1 3.83Å; F221-L224 HydrophobicContact CE1-CD1 4.16Å; F221-L224 HydrophobicContact CG-CD1 4.31Å; F221-L224 PolarHBondContact O-N 2.94Å; L224-E226 PolarHBondContact O-N 3.37Å; L224-W228 HydrophobicContact CD1-CE3 4.4Å
225	P	62	Low	61.8	Low	80 Å²	80	83.2 Å²	83.2	52%	0.519	44%	0.442	S	S	.	.			trans	-54.5	138.4	173.6	-22.2	31.9	0	0	0	111.4	S227 W228 A229	P225-S227 PolarHBondContact O-N 3.28Å; P225-S227 VanDerWaalsContact O-N 3.12Å; P225-W228 WeakPolarHBondContact O-CA 3.33Å; P225-W228 WeakPolarHBondContact O-CB 3.32Å; P225-W228 PolarHBondContact O-N 2.94Å; P225-A229 PolarHBondContact O-N 3.06Å; P225-A229 VanDerWaalsContact O-N 3.16Å
226	E	57.8	Low	63.7	Low	171 Å²	171	76.2 Å²	76.2	80%	0.799	42%	0.417	S	S	*	.	H	α-helix	trans	-56.9	-31.1	-176	-168.2	173.3	-171.9	0	0	113.3	L224 W228 A229 S230	L224-E226 PolarHBondContact O-N 3.37Å; E226-W228 VanDerWaalsContact C-N 3.31Å; E226-W228 PolarHBondContact O-N 3.24Å; E226-A229 PolarHBondContact O-N 3.39Å; E226-S230 WeakPolarHBondContact O-CB 3.5Å; E226-S230 PolarHBondContact O-N 3.09Å; E226-S230 PolarHBondContact O-OG 2.98Å
227	S	60.3	Low	65.7	Low	92 Å²	92	74.5 Å²	74.5	64%	0.643	41%	0.411	S	S	*	.	H	α-helix	trans	-66.1	-28.9	173.8	56	0	0	0	0	113.7	P225 S230	P225-S227 PolarHBondContact O-N 3.28Å; P225-S227 VanDerWaalsContact O-N 3.12Å; S227-S230 PolarHBondContact O-OG 2.94Å
228	W	58.8	Low	67.5	Low	161 Å²	161	73.3 Å²	73.3	61%	0.61	40%	0.404	S	S	*	.	H	α-helix	trans	-82.9	-40.1	176	-117.8	76.5	0	0	0	111.6	L224 P225 E226 G231 Q232	L224-W228 HydrophobicContact CD1-CE3 4.4Å; P225-W228 WeakPolarHBondContact O-CA 3.33Å; P225-W228 WeakPolarHBondContact O-CB 3.32Å; P225-W228 PolarHBondContact O-N 2.94Å; E226-W228 VanDerWaalsContact C-N 3.31Å; E226-W228 PolarHBondContact O-N 3.24Å; W228-G231 PolarHBondContact O-N 2.97Å; W228-Q232 PolarHBondContact O-N 3.48Å
229	A	60.8	Low	69.4	Low	18 Å²	18	68.1 Å²	68.1	15%	0.149	38%	0.384	C	S	.	.	H	α-helix	trans	-63.8	-43.3	176.7	0	0	0	0	0	112.2	P225 E226 G231 Q232 S233	P225-A229 PolarHBondContact O-N 3.06Å; P225-A229 VanDerWaalsContact O-N 3.16Å; E226-A229 PolarHBondContact O-N 3.39Å; A229-G231 PolarHBondContact O-N 3.42Å; A229-Q232 PolarHBondContact O-N 3.19Å; A229-Q232 VanDerWaalsContact O-N 3.16Å; A229-S233 PolarHBondContact O-N 3Å; A229-S233 PolarHBondContact O-OG 2.95Å
230	S	63.9	Low	71.4	Confident	50 Å²	50	61.3 Å²	61.3	35%	0.35	35%	0.354	S	S	.	.	H	α-helix	trans	-66.6	-23.3	175.3	54.7	0	0	0	0	113.5	E226 S227 N260 H264	E226-S230 WeakPolarHBondContact O-CB 3.5Å; E226-S230 PolarHBondContact O-N 3.09Å; E226-S230 PolarHBondContact O-OG 2.98Å; S227-S230 PolarHBondContact O-OG 2.94Å; S230-N260 PolarHBondContact O-ND2 3.04Å; S230-H264 PolarHBondContact O-NE2 3.22Å
231	G	74.3	Confident	73.5	Confident	32 Å²	32	56.9 Å²	56.9	33%	0.33	33%	0.334	S	S	.	.	H	α-helix	trans	-69.5	-29.3	172.1	0	0	0	0	0	113.7	K166 W228 A229	K166-G231 PolarHBondContact NZ-O 3.41Å; W228-G231 PolarHBondContact O-N 2.97Å; A229-G231 PolarHBondContact O-N 3.42Å
232	Q	76.8	Confident	75.7	Confident	78 Å²	78	54.1 Å²	54.1	36%	0.364	32%	0.321	S	S	.	.	H	α-helix	trans	-112.8	-14.8	-173	-60.2	-60.7	-15.4	0	0	114.3	G201 V202 F221 W228 A229	G201-Q232 CarbonylContact C-O 3.46Å; G201-Q232 WeakPolarHBondContact CA-O 3.46Å; V202-Q232 PolarHBondContact N-O 2.94Å; F221-Q232 HydrophobicContact CE1-CB 3.9Å; F221-Q232 HydrophobicContact CE1-CG 4.01Å; F221-Q232 HydrophobicContact CZ-CB 4.4Å; W228-Q232 PolarHBondContact O-N 3.48Å; A229-Q232 PolarHBondContact O-N 3.19Å; A229-Q232 VanDerWaalsContact O-N 3.16Å
233	S	83.6	Confident	77.9	Confident	12 Å²	12	50.8 Å²	50.8	8%	0.084	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	164.9	-177	70.5	0	0	0	0	111.9	V202 A229 N260 H264	V202-S233 CarbonylContact O-C 3.55Å; V202-S233 WeakPolarHBondContact O-CA 3.41Å; V202-S233 VanDerWaalsContact O-CB 3.27Å; V202-S233 WeakPolarHBondContact O-CB 3.3Å; A229-S233 PolarHBondContact O-N 3Å; A229-S233 PolarHBondContact O-OG 2.95Å; S233-N260 PolarHBondContact O-ND2 3.31Å; S233-H264 PolarHBondContact O-NE2 2.87Å
234	V	86.5	Confident	80	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	135.8	176.3	58.4	0	0	0	0	110.3	P200 V202 L203 L204 T238 V239 N260 I263	P200-V234 HydrophobicContact CB-CG1 3.62Å; V202-V234 PolarHBondContact O-N 3.08Å; L203-V234 WeakPolarHBondContact CA-O 3.42Å; L203-V234 HydrophobicContact CD2-CG1 4.02Å; L204-V234 PolarHBondContact N-O 3.37Å; V234-T238 HydrophobicContact CG2-CG2 4.02Å; V234-V239 HydrophobicContact CB-CG2 4.27Å; V234-V239 HydrophobicContact CG1-CG2 3.5Å; V234-V239 VanDerWaalsContact CG1-CG2 3.5Å; V234-V239 HydrophobicContact CG2-CG2 3.75Å; V234-N260 WeakPolarHBondContact CB-OD1 3.2Å; V234-N260 WeakPolarHBondContact CG1-OD1 3.16Å; V234-I263 HydrophobicContact CG2-CG2 4.08Å
235	P	88.9	Confident	82	Confident	44 Å²	44	43 Å²	43	29%	0.286	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	138.3	171.3	-21.4	32.5	0	0	0	111.4	V237 T238 V239	P235-V237 VanDerWaalsContact C-N 3.26Å; P235-V237 HydrophobicContact CB-CG2 4.06Å; P235-V237 PolarHBondContact O-N 2.68Å; P235-T238 VanDerWaalsContact O-CB 3.31Å; P235-T238 WeakPolarHBondContact O-CB 3.48Å; P235-T238 PolarHBondContact O-N 2.78Å; P235-V239 PolarHBondContact O-N 2.97Å
236	L	89.6	Confident	83.7	Confident	14 Å²	14	39.8 Å²	39.8	7%	0.073	22%	0.216	C	C	.	.	H	α-helix	trans	-55.5	-42.9	-179.5	-178.9	61.4	0	0	0	112.7	E62 T63 A66 L203 L204 C205 T238 V239 V240	E62-L236 HydrophobicContact CB-CD2 3.91Å; T63-L236 HydrophobicContact CG2-CD1 3.98Å; T63-L236 WeakPolarHBondContact OG1-CD1 3.43Å; A66-L236 HydrophobicContact CB-CD2 4.14Å; A66-L236 HydrophobicContact CB-CG 4.31Å; L203-L236 HydrophobicContact CD1-CD1 4.17Å; L203-L236 HydrophobicContact CD2-CD1 4.34Å; L204-L236 PolarHBondContact O-N 3.47Å; C205-L236 HydrophobicContact CB-CB 3.93Å; C205-L236 HydrophobicContact CB-CD2 3.87Å; L236-T238 VanDerWaalsContact C-N 3.26Å; L236-T238 PolarHBondContact O-N 3.34Å; L236-V239 WeakPolarHBondContact O-CB 3.08Å; L236-V239 PolarHBondContact O-N 3.01Å; L236-V239 VanDerWaalsContact O-N 3.15Å; L236-V240 PolarHBondContact O-N 3.26Å; L236-V240 VanDerWaalsContact O-N 3.08Å
237	V	90.6	Very high	85.6	Confident	75 Å²	75	31.9 Å²	31.9	46%	0.455	18%	0.18	S	C	.	.	H	α-helix	trans	-60.5	-35.7	176.9	-68	0	0	0	0	112.1	P235 V240 R241	P235-V237 VanDerWaalsContact C-N 3.26Å; P235-V237 HydrophobicContact CB-CG2 4.06Å; P235-V237 PolarHBondContact O-N 2.68Å; V237-V240 PolarHBondContact O-N 2.9Å; V237-R241 WeakPolarHBondContact O-CB 3.27Å; V237-R241 VanDerWaalsContact O-CG 3.24Å; V237-R241 WeakPolarHBondContact O-CG 3.41Å; V237-R241 PolarHBondContact O-N 3.5Å
238	T	92.1	Very high	87.3	Confident	22 Å²	22	27.9 Å²	27.9	14%	0.135	15%	0.152	C	C	.	.	H	α-helix	trans	-66.3	-39.7	176.1	-53.9	0	0	0	0	111.2	V234 P235 L236 R241 A242	V234-T238 HydrophobicContact CG2-CG2 4.02Å; P235-T238 VanDerWaalsContact O-CB 3.31Å; P235-T238 WeakPolarHBondContact O-CB 3.48Å; P235-T238 PolarHBondContact O-N 2.78Å; L236-T238 VanDerWaalsContact C-N 3.26Å; L236-T238 PolarHBondContact O-N 3.34Å; T238-R241 PolarHBondContact O-N 3.17Å; T238-A242 WeakPolarHBondContact O-CB 3.48Å; T238-A242 PolarHBondContact O-N 3.44Å
239	V	95.4	Very high	89	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.8	-48.9	175	-176.3	0	0	0	0	110.7	P200 L203 V234 P235 L236 R241 A242 M243 I263	P200-V239 HydrophobicContact CB-CG2 3.98Å; L203-V239 HydrophobicContact CD2-CG2 3.66Å; V234-V239 HydrophobicContact CB-CG2 4.27Å; V234-V239 HydrophobicContact CG1-CG2 3.5Å; V234-V239 VanDerWaalsContact CG1-CG2 3.5Å; V234-V239 HydrophobicContact CG2-CG2 3.75Å; P235-V239 PolarHBondContact O-N 2.97Å; L236-V239 WeakPolarHBondContact O-CB 3.08Å; L236-V239 PolarHBondContact O-N 3.01Å; L236-V239 VanDerWaalsContact O-N 3.15Å; V239-R241 PolarHBondContact O-N 3.35Å; V239-A242 WeakPolarHBondContact O-CB 3.39Å; V239-A242 PolarHBondContact O-N 2.84Å; V239-M243 HydrophobicContact CG1-SD 4.04Å; V239-M243 VanDerWaalsContact O-CG 3.28Å; V239-M243 WeakPolarHBondContact O-CG 3.4Å; V239-M243 PolarHBondContact O-N 2.63Å; V239-I263 HydrophobicContact CB-CG2 4.34Å; V239-I263 HydrophobicContact CG2-CG2 4.05Å
240	V	96.6	Very high	90.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.9	-45.6	179.1	170.4	0	0	0	0	111.3	T63 A66 L67 E70 L236 V237 A242 M243 L244	T63-V240 HydrophobicContact CG2-CG2 4.45Å; A66-V240 HydrophobicContact CB-CG2 3.87Å; L67-V240 HydrophobicContact CB-CG1 4.31Å; L67-V240 HydrophobicContact CB-CG2 4.23Å; L67-V240 HydrophobicContact CD1-CG1 4.01Å; E70-V240 HydrophobicContact CB-CG1 3.77Å; E70-V240 HydrophobicContact CG-CG1 3.76Å; L236-V240 PolarHBondContact O-N 3.26Å; L236-V240 VanDerWaalsContact O-N 3.08Å; V237-V240 PolarHBondContact O-N 2.9Å; V240-A242 VanDerWaalsContact C-N 3.33Å; V240-A242 PolarHBondContact O-N 3.18Å; V240-M243 WeakPolarHBondContact O-CB 3.38Å; V240-M243 PolarHBondContact O-N 2.82Å; V240-L244 HydrophobicContact CG1-CD1 4.27Å; V240-L244 WeakPolarHBondContact O-CG 3.4Å; V240-L244 PolarHBondContact O-N 3.31Å
241	R	94.9	Very high	91.6	Very high	55 Å²	55	29 Å²	29	21%	0.208	17%	0.165	C	C	.	.	H	α-helix	trans	-60.4	-42.4	175.9	-74.3	168.2	175.9	-163.5	-0.3	111.7	E70 V237 T238 V239 M243 L244 N245 H270	E70-R241 IonicContact OE1-NE 3.81Å; V237-R241 WeakPolarHBondContact O-CB 3.27Å; V237-R241 VanDerWaalsContact O-CG 3.24Å; V237-R241 WeakPolarHBondContact O-CG 3.41Å; V237-R241 PolarHBondContact O-N 3.5Å; T238-R241 PolarHBondContact O-N 3.17Å; V239-R241 PolarHBondContact O-N 3.35Å; R241-M243 VanDerWaalsContact C-N 3.33Å; R241-M243 PolarHBondContact O-N 3.11Å; R241-L244 PolarHBondContact O-N 2.87Å; R241-N245 WeakPolarHBondContact O-CB 3.17Å; R241-N245 PolarHBondContact O-N 2.91Å; R241-N245 PolarHBondContact O-ND2 3.07Å; R241-N245 PolarHBondContact O-OD1 3.02Å; R241-H270 HydrophobicContact CG-CB 4.17Å; R241-H270 PolarHBondContact NH1-O 2.79Å
242	A	96.9	Very high	92	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.4	-42.6	175.6	0	0	0	0	0	111.7	T238 V239 V240 N245 N246 I263 L266	T238-A242 WeakPolarHBondContact O-CB 3.48Å; T238-A242 PolarHBondContact O-N 3.44Å; V239-A242 WeakPolarHBondContact O-CB 3.39Å; V239-A242 PolarHBondContact O-N 2.84Å; V240-A242 VanDerWaalsContact C-N 3.33Å; V240-A242 PolarHBondContact O-N 3.18Å; A242-N245 PolarHBondContact O-N 3.16Å; A242-N246 VanDerWaalsContact O-CB 3.31Å; A242-N246 WeakPolarHBondContact O-CB 3.45Å; A242-N246 PolarHBondContact O-N 3.05Å; A242-I263 HydrophobicContact CB-CB 4.39Å; A242-I263 HydrophobicContact CB-CG2 3.84Å; A242-I263 WeakPolarHBondContact CB-O 3.47Å; A242-L266 HydrophobicContact CB-CB 4.08Å; A242-L266 HydrophobicContact CB-CD2 4.37Å; A242-L266 HydrophobicContact CB-CG 4.31Å; A242-L266 VanDerWaalsContact O-CD2 3.23Å; A242-L266 WeakPolarHBondContact O-CD2 3.27Å
243	M	98.1	Very high	92.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.9	-47.4	176.4	-67.5	166.6	66.9	0	0	111.9	L67 F122 V163 F198 V239 V240 R241 N246 V247	L67-M243 HydrophobicContact CD1-CE 4.32Å; L67-M243 HydrophobicContact CD2-CE 3.86Å; F122-M243 HydrophobicContact CD1-CE 3.32Å; F122-M243 HydrophobicContact CE1-CB 4.1Å; F122-M243 HydrophobicContact CE1-CE 3.77Å; F122-M243 HydrophobicContact CG-CE 4.29Å; V163-M243 HydrophobicContact CG2-CE 3.64Å; V163-M243 HydrophobicContact CG2-SD 3.83Å; F198-M243 HydrophobicContact CD1-CG 3.81Å; F198-M243 HydrophobicContact CD2-CG 3.97Å; F198-M243 HydrophobicContact CE1-CB 4.23Å; F198-M243 HydrophobicContact CE1-CG 3.7Å; F198-M243 HydrophobicContact CE2-CB 4.48Å; F198-M243 HydrophobicContact CE2-CG 3.88Å; F198-M243 HydrophobicContact CG-CG 3.95Å; F198-M243 HydrophobicContact CZ-CB 4.08Å; F198-M243 HydrophobicContact CZ-CG 3.75Å; V239-M243 HydrophobicContact CG1-SD 4.04Å; V239-M243 VanDerWaalsContact O-CG 3.28Å; V239-M243 WeakPolarHBondContact O-CG 3.4Å; V239-M243 PolarHBondContact O-N 2.63Å; V240-M243 WeakPolarHBondContact O-CB 3.38Å; V240-M243 PolarHBondContact O-N 2.82Å; R241-M243 VanDerWaalsContact C-N 3.33Å; R241-M243 PolarHBondContact O-N 3.11Å; M243-N246 PolarHBondContact O-N 2.94Å; M243-V247 PolarHBondContact O-N 2.85Å
244	L	97.7	Very high	93.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-73.4	-32.7	179.9	-62.2	-176.2	0	0	0	113.1	L67 E70 I71 L76 F122 V240 R241 N246 V247	L67-L244 HydrophobicContact CD1-CD1 4.49Å; L67-L244 HydrophobicContact CD1-CD2 3.7Å; L67-L244 HydrophobicContact CD1-CG 4.05Å; E70-L244 HydrophobicContact CB-CD1 3.6Å; I71-L244 HydrophobicContact CD1-CD2 4.18Å; I71-L244 HydrophobicContact CG1-CD1 4.28Å; I71-L244 HydrophobicContact CG1-CD2 3.66Å; L76-L244 HydrophobicContact CD1-CB 4.16Å; L76-L244 HydrophobicContact CD1-CD1 4.32Å; L76-L244 HydrophobicContact CD1-CD2 4.13Å; L76-L244 HydrophobicContact CD1-CG 4.43Å; F122-L244 HydrophobicContact CZ-CD2 4.36Å; V240-L244 HydrophobicContact CG1-CD1 4.27Å; V240-L244 WeakPolarHBondContact O-CG 3.4Å; V240-L244 PolarHBondContact O-N 3.31Å; R241-L244 PolarHBondContact O-N 2.87Å; L244-N246 VanDerWaalsContact C-N 3.3Å; L244-V247 WeakPolarHBondContact O-CG1 3.37Å; L244-V247 PolarHBondContact O-N 3.12Å
245	N	96.1	Very high	93.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-71.1	-29.8	173.5	-67.7	-10.3	0	0	0	111.3	L40 R44 R241 A242 R249 L266	L40-N245 HydrophobicContact CD1-CB 4.41Å; R44-N245 PolarHBondContact NH2-OD1 2.73Å; R241-N245 WeakPolarHBondContact O-CB 3.17Å; R241-N245 PolarHBondContact O-N 2.91Å; R241-N245 PolarHBondContact O-ND2 3.07Å; R241-N245 PolarHBondContact O-OD1 3.02Å; A242-N245 PolarHBondContact O-N 3.16Å; N245-R249 VanDerWaalsContact O-CD 3.27Å; N245-R249 WeakPolarHBondContact O-CD 3.31Å; N245-R249 VanDerWaalsContact O-CG 3.24Å; N245-R249 WeakPolarHBondContact O-CG 3.46Å; N245-R249 PolarHBondContact O-NE 3.49Å; N245-L266 HydrophobicContact CB-CD1 3.93Å; N245-L266 HydrophobicContact CB-CG 3.91Å; N245-L266 PolarHBondContact ND2-O 2.88Å
246	N	97.4	Very high	94.1	Very high	11 Å²	11	43.3 Å²	43.3	6%	0.059	22%	0.222	C	C	.	.	H	α-helix	trans	-70.8	-42.7	173.6	-166.1	62.9	0	0	0	111.9	R194 S196 F198 A242 M243 L244 V248 R249 E256 L266	R194-N246 PolarHBondContact NH1-O 3Å; R194-N246 PolarHBondContact NH2-ND2 3.45Å; R194-N246 PolarHBondContact NH2-O 3.37Å; R194-N246 PolarHBondContact NH2-OD1 2.92Å; S196-N246 PolarHBondContact OG-ND2 3.43Å; S196-N246 VanDerWaalsContact OG-ND2 3.07Å; F198-N246 HydrophobicContact CE1-CB 4.3Å; F198-N246 HydrophobicContact CZ-CB 4.05Å; A242-N246 VanDerWaalsContact O-CB 3.31Å; A242-N246 WeakPolarHBondContact O-CB 3.45Å; A242-N246 PolarHBondContact O-N 3.05Å; M243-N246 PolarHBondContact O-N 2.94Å; L244-N246 VanDerWaalsContact C-N 3.3Å; N246-V248 VanDerWaalsContact C-N 3.31Å; N246-V248 PolarHBondContact O-N 3.46Å; N246-R249 PolarHBondContact O-N 3.16Å; N246-R249 VanDerWaalsContact O-N 3.17Å; N246-E256 PolarHBondContact ND2-OE2 3.45Å; N246-L266 HydrophobicContact CB-CD2 3.77Å
247	V	97.6	Very high	94.5	Very high	5 Å²	5	46.2 Å²	46.2	3%	0.03	24%	0.237	C	C	.	.	H	α-helix	trans	-64.2	-35.6	-173.2	83.8	0	0	0	0	112.8	F47 F77 V120 F122 M243 L244 R249	F47-V247 HydrophobicContact CE2-CG2 4.38Å; F47-V247 HydrophobicContact CZ-CG1 4.37Å; F47-V247 HydrophobicContact CZ-CG2 4.25Å; F77-V247 HydrophobicContact CZ-CG1 4.33Å; F77-V247 HydrophobicContact CZ-CG2 4.29Å; V120-V247 HydrophobicContact CG1-CG2 3.9Å; V120-V247 HydrophobicContact CG2-CG2 4.3Å; F122-V247 HydrophobicContact CZ-CB 4.21Å; F122-V247 HydrophobicContact CZ-CG2 4.15Å; M243-V247 PolarHBondContact O-N 2.85Å; L244-V247 WeakPolarHBondContact O-CG1 3.37Å; L244-V247 PolarHBondContact O-N 3.12Å; V247-R249 VanDerWaalsContact C-N 3.33Å
248	V	96.6	Very high	94.8	Very high	9 Å²	9	43.3 Å²	43.3	6%	0.055	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-12.3	179.6	-56.8	0	0	0	0	113.5	L40 L43 R44 F47 L76 N246	L40-V248 HydrophobicContact CD1-CG2 3.85Å; L43-V248 HydrophobicContact CB-CB 4.45Å; L43-V248 HydrophobicContact CB-CG2 4.18Å; R44-V248 HydrophobicContact CG-CG1 4.17Å; R44-V248 HydrophobicContact CG-CG2 4.22Å; F47-V248 HydrophobicContact CB-CB 4.14Å; F47-V248 HydrophobicContact CB-CG1 3.89Å; F47-V248 HydrophobicContact CD1-CG1 4.07Å; F47-V248 HydrophobicContact CD2-CB 4.33Å; F47-V248 HydrophobicContact CD2-CG1 4.11Å; F47-V248 HydrophobicContact CG-CB 4.28Å; F47-V248 HydrophobicContact CG-CG1 3.76Å; L76-V248 HydrophobicContact CD1-CG1 4.32Å; L76-V248 HydrophobicContact CD2-CG1 4.19Å; N246-V248 VanDerWaalsContact C-N 3.31Å; N246-V248 PolarHBondContact O-N 3.46Å
249	R	95	Very high	95.1	Very high	96 Å²	96	45.6 Å²	45.6	36%	0.362	23%	0.228	S	C	.	.	S	Bend	trans	-81.2	132.8	176.7	-75.6	169.6	-176	-108.7	0.9	109.7	L43 R194 N245 N246 V247	L43-R249 HydrophobicContact CD1-CG 3.86Å; R194-R249 PolarHBondContact NH1-O 3.45Å; R194-R249 PolarHBondContact NH2-O 3.48Å; N245-R249 VanDerWaalsContact O-CD 3.27Å; N245-R249 WeakPolarHBondContact O-CD 3.31Å; N245-R249 VanDerWaalsContact O-CG 3.24Å; N245-R249 WeakPolarHBondContact O-CG 3.46Å; N245-R249 PolarHBondContact O-NE 3.49Å; N246-R249 PolarHBondContact O-N 3.16Å; N246-R249 VanDerWaalsContact O-N 3.17Å; V247-R249 VanDerWaalsContact C-N 3.33Å
250	P	90.1	Very high	95	Very high	113 Å²	113	45.9 Å²	45.9	73%	0.734	23%	0.23	S	C	*	.			trans	-63	143.8	167.4	28.5	-33.2	0	0	0	109.1
251	S	88.4	Confident	94.8	Very high	42 Å²	42	52.4 Å²	52.4	29%	0.294	26%	0.258	S	S	.	.			trans	-138.9	135.2	176.1	-168.3	0	0	0	0	109.2	K253 E256	S251-K253 PolarHBondContact OG-N 2.69Å; S251-E256 WeakPolarHBondContact CB-OE1 3.27Å; S251-E256 PolarHBondContact OG-OE1 3.25Å
252	D	82.3	Confident	94.7	Very high	157 Å²	157	51.7 Å²	51.7	84%	0.84	26%	0.264	S	S	*	.			trans	-90.4	-10.2	173	61.2	-24.9	0	0	0	112
253	K	91.8	Very high	94.7	Very high	136 Å²	136	51.7 Å²	51.7	59%	0.591	26%	0.264	S	S	*	.			trans	-87.6	131.4	180	-62.4	-177.9	-176.2	177.6	0	110.9	S251 M255 E256	S251-K253 PolarHBondContact OG-N 2.69Å; K253-M255 VanDerWaalsContact C-N 3.31Å; K253-M255 PolarHBondContact O-N 3.16Å; K253-E256 HydrophobicContact CB-CG 4.32Å
254	Q	94.5	Very high	94.3	Very high	93 Å²	93	53 Å²	53	44%	0.435	27%	0.27	S	S	.	.	S	Bend	trans	-64.5	-37.2	171.7	-171.7	176.4	42.4	0	0	111.9	F192 R194 Y195	F192-Q254 VanDerWaalsContact O-CG 3.22Å; F192-Q254 WeakPolarHBondContact O-CG 3.24Å; F192-Q254 PolarHBondContact O-NE2 2.82Å; F192-Q254 VanDerWaalsContact O-NE2 3.13Å; R194-Q254 CarbonylContact C-O 3.53Å; R194-Q254 WeakPolarHBondContact CA-O 3.48Å; Y195-Q254 PolarHBondContact N-O 3.45Å
255	M	96.9	Very high	94	Very high	55 Å²	55	56.6 Å²	56.6	27%	0.271	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	134.2	178.7	-176	-179	-178.3	0	0	111.2	E188 Y195 V197 K253 L257	E188-M255 HydrophobicContact CB-SD 4.34Å; E188-M255 HydrophobicContact CG-CE 4.46Å; E188-M255 HydrophobicContact CG-SD 3.6Å; E188-M255 VanDerWaalsContact CG-SD 3.6Å; Y195-M255 HydrophobicContact CD1-CE 4.22Å; Y195-M255 HydrophobicContact CD1-CG 3.93Å; Y195-M255 HydrophobicContact CD1-SD 4.27Å; Y195-M255 HydrophobicContact CE1-CE 3.99Å; Y195-M255 CarbonylContact O-C 3.5Å; Y195-M255 VanDerWaalsContact O-CA 3.3Å; Y195-M255 WeakPolarHBondContact O-CA 3.34Å; V197-M255 HydrophobicContact CG2-CE 4.08Å; K253-M255 VanDerWaalsContact C-N 3.31Å; K253-M255 PolarHBondContact O-N 3.16Å; M255-L257 HydrophobicContact CE-CD1 4.41Å
256	E	97.8	Very high	93.8	Very high	26 Å²	26	57.6 Å²	57.6	12%	0.121	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	125.3	175.5	-60.3	170.1	133.9	0	0	108.8	R194 Y195 S196 V197 N246 S251 K253 L258	R194-E256 IonicContact CZ-OE1 3.62Å; R194-E256 IonicContact CZ-OE2 2.68Å; R194-E256 VanDerWaalsContact CZ-OE2 3.31Å; R194-E256 IonicContact NE-OE1 3.78Å; R194-E256 IonicContact NE-OE2 3.17Å; R194-E256 PolarHBondContact NE-OE2 3.18Å; R194-E256 IonicContact NH2-OE1 3.66Å; R194-E256 PolarHBondContact NH2-OE1 3.31Å; R194-E256 IonicContact NH2-OE2 2.63Å; R194-E256 PolarHBondContact NH2-OE2 3.29Å; Y195-E256 PolarHBondContact O-N 3.04Å; S196-E256 CarbonylContact C-O 3.48Å; S196-E256 WeakPolarHBondContact CA-O 3.17Å; S196-E256 PolarHBondContact OG-OE2 3.16Å; V197-E256 PolarHBondContact N-O 2.86Å; N246-E256 PolarHBondContact ND2-OE2 3.45Å; S251-E256 WeakPolarHBondContact CB-OE1 3.27Å; S251-E256 PolarHBondContact OG-OE1 3.25Å; K253-E256 HydrophobicContact CB-CG 4.32Å; E256-L258 HydrophobicContact CB-CD1 4.02Å
257	L	97.9	Very high	93.4	Very high	75 Å²	75	57.2 Å²	57.2	39%	0.393	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	115.5	175	-170.8	150.9	0	0	0	108.7	V197 M255 E259	V197-L257 HydrophobicContact CB-CG 4.47Å; M255-L257 HydrophobicContact CE-CD1 4.41Å; L257-E259 HydrophobicContact CD2-CG 3.75Å; L257-E259 WeakPolarHBondContact CD2-OE1 3.22Å
258	L	97.8	Very high	92.6	Very high	14 Å²	14	62 Å²	62	7%	0.073	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	101.2	-178.1	-65.2	90	0	0	0	109.3	V197 F198 R199 E256 A262 I263 L266	V197-L258 PolarHBondContact O-N 2.62Å; F198-L258 HydrophobicContact CD1-CB 4.18Å; F198-L258 HydrophobicContact CD1-CD1 4.38Å; F198-L258 HydrophobicContact CD1-CD2 4.35Å; F198-L258 HydrophobicContact CE1-CD1 4.09Å; F198-L258 HydrophobicContact CE1-CD2 3.96Å; F198-L258 HydrophobicContact CE1-CG 4.44Å; F198-L258 HydrophobicContact CZ-CD1 4.39Å; R199-L258 PolarHBondContact N-O 3.12Å; E256-L258 HydrophobicContact CB-CD1 4.02Å; L258-A262 HydrophobicContact CB-CB 4.38Å; L258-I263 HydrophobicContact CB-CG1 4.09Å; L258-I263 WeakPolarHBondContact O-CD1 3.49Å; L258-L266 HydrophobicContact CD2-CD2 3.66Å
259	E	97.2	Very high	91	Very high	71 Å²	71	62 Å²	62	33%	0.332	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	164.5	170.2	-68.4	-65.1	170	0	0	111.4	R199 L257 K261 A262 I263	R199-E259 WeakPolarHBondContact CB-OE2 3.47Å; R199-E259 VanDerWaalsContact CD-OE1 3.23Å; R199-E259 WeakPolarHBondContact CD-OE1 3.26Å; R199-E259 IonicContact CZ-OE1 3.31Å; R199-E259 IonicContact NE-OE1 2.67Å; R199-E259 IonicContact NH1-OE1 2.92Å; R199-E259 PolarHBondContact NH1-OE1 2.71Å; L257-E259 HydrophobicContact CD2-CG 3.75Å; L257-E259 WeakPolarHBondContact CD2-OE1 3.22Å; E259-K261 PolarHBondContact O-N 2.96Å; E259-A262 WeakPolarHBondContact O-CB 3.3Å; E259-A262 PolarHBondContact O-N 3.45Å; E259-I263 PolarHBondContact O-N 3.35Å
260	N	92.8	Very high	88.9	Confident	6 Å²	6	58.5 Å²	58.5	3%	0.032	30%	0.302	C	S	.	.	H	α-helix	trans	-49.3	-38.6	-173.4	-167	63.2	0	0	0	114.8	K166 R199 G201 S230 S233 V234 I263 H264	K166-N260 HydrophobicContact CD-CB 4.45Å; R199-N260 PolarHBondContact O-N 3.04Å; G201-N260 PolarHBondContact N-OD1 2.91Å; S230-N260 PolarHBondContact O-ND2 3.04Å; S233-N260 PolarHBondContact O-ND2 3.31Å; V234-N260 WeakPolarHBondContact CB-OD1 3.2Å; V234-N260 WeakPolarHBondContact CG1-OD1 3.16Å; N260-I263 PolarHBondContact O-N 2.98Å; N260-H264 PolarHBondContact O-CD2 3.31Å; N260-H264 VanDerWaalsContact O-CD2 3.28Å; N260-H264 PolarHBondContact O-N 3.4Å
261	K	92.8	Very high	87	Confident	137 Å²	137	57.8 Å²	57.8	60%	0.596	29%	0.292	S	S	*	.	H	α-helix	trans	-63.7	-47	177.2	-179.9	67.8	174.3	71.2	0	111.8	E259 I263 H264 D265	E259-K261 PolarHBondContact O-N 2.96Å; K261-I263 VanDerWaalsContact C-N 3.28Å; K261-I263 PolarHBondContact O-N 2.94Å; K261-H264 WeakPolarHBondContact O-CB 3.4Å; K261-H264 PolarHBondContact O-N 2.53Å; K261-D265 IonicContact NZ-OD1 3.19Å; K261-D265 PolarHBondContact NZ-OD1 3.15Å; K261-D265 IonicContact NZ-OD2 2.62Å; K261-D265 PolarHBondContact NZ-OD2 2.79Å; K261-D265 PolarHBondContact O-N 3.48Å
262	A	94.1	Very high	84.7	Confident	40 Å²	40	59.1 Å²	59.1	33%	0.331	30%	0.301	S	S	.	.	H	α-helix	trans	-64.9	-34.8	177.9	0	0	0	0	0	111.7	L258 E259 D265 L266	L258-A262 HydrophobicContact CB-CB 4.38Å; E259-A262 WeakPolarHBondContact O-CB 3.3Å; E259-A262 PolarHBondContact O-N 3.45Å; A262-D265 PolarHBondContact O-N 2.97Å; A262-L266 WeakPolarHBondContact O-CB 3.16Å; A262-L266 PolarHBondContact O-N 3.22Å
263	I	95.2	Very high	82.3	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.9	-45.8	173	-65.6	172.9	0	0	0	110.8	F198 P200 V234 V239 A242 L258 E259 N260 K261 G267	F198-I263 HydrophobicContact CB-CD1 4.11Å; F198-I263 HydrophobicContact CD1-CG1 4.33Å; P200-I263 HydrophobicContact CB-CD1 4.07Å; V234-I263 HydrophobicContact CG2-CG2 4.08Å; V239-I263 HydrophobicContact CB-CG2 4.34Å; V239-I263 HydrophobicContact CG2-CG2 4.05Å; A242-I263 HydrophobicContact CB-CB 4.39Å; A242-I263 HydrophobicContact CB-CG2 3.84Å; A242-I263 WeakPolarHBondContact CB-O 3.47Å; L258-I263 HydrophobicContact CB-CG1 4.09Å; L258-I263 WeakPolarHBondContact O-CD1 3.49Å; E259-I263 PolarHBondContact O-N 3.35Å; N260-I263 PolarHBondContact O-N 2.98Å; K261-I263 VanDerWaalsContact C-N 3.28Å; K261-I263 PolarHBondContact O-N 2.94Å; I263-G267 PolarHBondContact O-N 3.37Å
264	H	91.3	Very high	79.2	Confident	28 Å²	28	61.6 Å²	61.6	13%	0.13	31%	0.312	C	S	.	.	H	α-helix	trans	-59.8	-48.5	175.4	-87.7	-75.4	0	0	0	111.9	S230 S233 N260 K261 L266 G267 K268	S230-H264 PolarHBondContact O-NE2 3.22Å; S233-H264 PolarHBondContact O-NE2 2.87Å; N260-H264 PolarHBondContact O-CD2 3.31Å; N260-H264 VanDerWaalsContact O-CD2 3.28Å; N260-H264 PolarHBondContact O-N 3.4Å; K261-H264 WeakPolarHBondContact O-CB 3.4Å; K261-H264 PolarHBondContact O-N 2.53Å; H264-L266 PolarHBondContact O-N 3.25Å; H264-G267 PolarHBondContact O-N 2.97Å; H264-K268 WeakPolarHBondContact O-CG 3.28Å; H264-K268 PolarHBondContact O-N 3.48Å
265	D	91	Very high	76.1	Confident	74 Å²	74	66.9 Å²	66.9	40%	0.396	35%	0.354	S	S	.	.	H	α-helix	trans	-63.6	-44	-177.2	-61.4	-24	0	0	0	111.1	K261 A262	K261-D265 IonicContact NZ-OD1 3.19Å; K261-D265 PolarHBondContact NZ-OD1 3.15Å; K261-D265 IonicContact NZ-OD2 2.62Å; K261-D265 PolarHBondContact NZ-OD2 2.79Å; K261-D265 PolarHBondContact O-N 3.48Å; A262-D265 PolarHBondContact O-N 2.97Å
266	L	91.6	Very high	75.1	Confident	22 Å²	22	67.5 Å²	67.5	12%	0.115	36%	0.358	C	S	.	.	H	α-helix	trans	-73.6	-31.4	-179.7	-169.9	60.8	0	0	0	112.9	A242 N245 N246 L258 A262 H264 K268	A242-L266 HydrophobicContact CB-CB 4.08Å; A242-L266 HydrophobicContact CB-CD2 4.37Å; A242-L266 HydrophobicContact CB-CG 4.31Å; A242-L266 VanDerWaalsContact O-CD2 3.23Å; A242-L266 WeakPolarHBondContact O-CD2 3.27Å; N245-L266 HydrophobicContact CB-CD1 3.93Å; N245-L266 HydrophobicContact CB-CG 3.91Å; N245-L266 PolarHBondContact ND2-O 2.88Å; N246-L266 HydrophobicContact CB-CD2 3.77Å; L258-L266 HydrophobicContact CD2-CD2 3.66Å; A262-L266 WeakPolarHBondContact O-CB 3.16Å; A262-L266 PolarHBondContact O-N 3.22Å; H264-L266 PolarHBondContact O-N 3.25Å; L266-K268 VanDerWaalsContact C-N 3.34Å
267	G	88.9	Confident	73.9	Confident	2 Å²	2	69.7 Å²	69.7	2%	0.021	37%	0.371	C	S	.	.	H	α-helix	trans	-74.1	-20.8	178.8	0	0	0	0	0	114.2	I263 H264 A269	I263-G267 PolarHBondContact O-N 3.37Å; H264-G267 PolarHBondContact O-N 2.97Å; G267-A269 VanDerWaalsContact C-N 3.32Å
268	K	81.3	Confident	72.6	Confident	106 Å²	106	69.4 Å²	69.4	46%	0.461	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-23.5	175.9	-76.9	171.6	-177.3	-177.3	0	113.8	P32 H264 L266 H270	P32-K268 WeakPolarHBondContact CD-O 3.42Å; P32-K268 WeakPolarHBondContact CG-O 3.44Å; H264-K268 WeakPolarHBondContact O-CG 3.28Å; H264-K268 PolarHBondContact O-N 3.48Å; L266-K268 VanDerWaalsContact C-N 3.34Å; K268-H270 PolarHBondContact O-N 3.37Å
269	A	62.9	Low	71.1	Confident	10 Å²	10	72.6 Å²	72.6	8%	0.083	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	10.1	-174.9	0	0	0	0	0	114.9	L40 G267	L40-A269 HydrophobicContact CD2-CB 3.88Å; L40-A269 WeakPolarHBondContact CD2-O 3.43Å; G267-A269 VanDerWaalsContact C-N 3.32Å
270	H	50.7	Low	69.4	Low	22 Å²	22	72.8 Å²	72.8	10%	0.102	39%	0.39	C	S	.	.			trans	-114.5	95	178.7	-168.4	-55.6	0	0	0	110.6	R44 R241 K268 S272	R44-H270 PolarHBondContact NH2-CD2 2.9Å; R241-H270 HydrophobicContact CG-CB 4.17Å; R241-H270 PolarHBondContact NH1-O 2.79Å; K268-H270 PolarHBondContact O-N 3.37Å; H270-S272 PolarHBondContact ND1-N 3.08Å; H270-S272 VanDerWaalsContact ND1-N 3.18Å; H270-S272 PolarHBondContact O-N 2.77Å
271	D	49.1	Very low	67.9	Low	97 Å²	97	77.2 Å²	77.2	52%	0.519	41%	0.414	S	S	.	.			trans	-81.8	106.8	155.5	-78.1	-22.1	0	0	0	107.9	L273	D271-L273 PolarHBondContact O-N 3.36Å
272	S	41.8	Very low	66.1	Low	70 Å²	70	72.9 Å²	72.9	49%	0.49	40%	0.401	S	S	.	.			trans	-69	92.8	156.2	44	0	0	0	0	105.9	H270 K274	H270-S272 PolarHBondContact ND1-N 3.08Å; H270-S272 VanDerWaalsContact ND1-N 3.18Å; H270-S272 PolarHBondContact O-N 2.77Å; S272-K274 PolarHBondContact O-N 3.01Å
273	L	31.9	Very low	64	Low	163 Å²	163	75.5 Å²	75.5	85%	0.853	41%	0.407	S	S	*	.			trans	-63	80.8	160	-87.8	164.3	0	0	0	107.9	D271	D271-L273 PolarHBondContact O-N 3.36Å
274	K	25.2	Very low	61.4	Low	183 Å²	183	81.8 Å²	81.8	80%	0.796	44%	0.441	S	S	*	.			trans	-145.7	119.5	149.3	-93.3	-175.8	-176.7	176	0	107.8	S272	S272-K274 PolarHBondContact O-N 3.01Å
275	P	30.6	Very low	58.6	Low	204 Å²	204	86.6 Å²	86.6	100%	1.325	47%	0.469	S	S	*	.			trans	-62.5	0	166.4	28.8	-32.9	0	0	0	111.4

Retrieved 275 of 275 residues in 160.4 ms (Link to these results)

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