A0A087YRV5_POEFO Loading...

Fucosyltransferase

Protein O-fucosyltransferase that specifically catalyzes O-fucosylation of serine or threonine residues in EMI domains of target proteins. Attaches fucose through an O-glycosidic linkage. O-fucosylation of EMI domain-containing proteins may be required for facilitating protein folding and secretion.

AlphaFold DB , UniProt , Accession A0A087YRV5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 344 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	L	58.2	Low	70.8	Confident	191 Å²	191	118.7 Å²	118.7	100%	1	62%	0.62	S	S	*	*				0	-44.9	0	-79.2	104.4	0	0	0	114.4	L5	L1-L5 PolarHBondContact O-N 2.93Å
2	R	63.4	Low	70.7	Confident	228 Å²	228	118.6 Å²	118.6	86%	0.86	62%	0.619	S	S	*	*	H	α-helix	trans	-60	-41.1	-179.7	-72.8	-177.2	176.6	-176.9	-1.9	117.4	L5 L6	R2-L5 PolarHBondContact O-N 3Å; R2-L6 PolarHBondContact O-N 3.43Å
3	P	67.7	Low	70.5	Confident	96 Å²	96	117.5 Å²	117.5	62%	0.623	61%	0.614	S	S	*	*	H	α-helix	trans	-74.1	-31.4	-176.7	25.7	-32	0	0	0	113.3	L6 L7	P3-L6 PolarHBondContact O-N 3.19Å; P3-L7 PolarHBondContact O-N 3.34Å; P3-L7 VanDerWaalsContact O-N 3.08Å
4	L	68.4	Low	70.4	Confident	130 Å²	130	116.4 Å²	116.4	68%	0.681	61%	0.608	S	S	*	*	H	α-helix	trans	-68.5	-35.6	175.8	-78.8	151.1	0	0	0	112	A8	L4-A8 WeakPolarHBondContact O-CB 3.29Å; L4-A8 PolarHBondContact O-N 3.36Å
5	L	73.1	Confident	70.4	Confident	129 Å²	129	113.7 Å²	113.7	68%	0.675	60%	0.603	S	S	*	*	H	α-helix	trans	-67.1	-40.1	175.3	-148.5	88.7	0	0	0	111.4	L1 R2 A8 V9	L1-L5 PolarHBondContact O-N 2.93Å; R2-L5 PolarHBondContact O-N 3Å; L5-A8 PolarHBondContact O-N 3.02Å; L5-V9 VanDerWaalsContact O-CG2 3.32Å; L5-V9 WeakPolarHBondContact O-CG2 3.46Å; L5-V9 PolarHBondContact O-N 2.92Å
6	L	74.9	Confident	70.1	Confident	118 Å²	118	109.5 Å²	109.5	62%	0.618	59%	0.586	S	S	*	*	H	α-helix	trans	-66	-41.6	178	-152.4	86.9	0	0	0	111.4	R2 P3 A8 V9 I10	R2-L6 PolarHBondContact O-N 3.43Å; P3-L6 PolarHBondContact O-N 3.19Å; L6-A8 VanDerWaalsContact C-N 3.35Å; L6-V9 PolarHBondContact O-N 3.07Å; L6-I10 HydrophobicContact CD2-CD1 4.42Å; L6-I10 HydrophobicContact CG-CD1 4.4Å; L6-I10 VanDerWaalsContact O-CG1 3.29Å; L6-I10 WeakPolarHBondContact O-CG1 3.41Å; L6-I10 PolarHBondContact O-N 2.88Å
7	L	74.7	Confident	70.1	Confident	107 Å²	107	108.7 Å²	108.7	56%	0.56	58%	0.581	S	S	*	*	H	α-helix	trans	-63.7	-41	176.6	-149.5	86.9	0	0	0	111.7	P3 I10 L11	P3-L7 PolarHBondContact O-N 3.34Å; P3-L7 VanDerWaalsContact O-N 3.08Å; L7-I10 PolarHBondContact O-N 3.33Å; L7-L11 HydrophobicContact CD2-CD1 4.45Å; L7-L11 HydrophobicContact CG-CD1 4.48Å; L7-L11 WeakPolarHBondContact O-CB 3.4Å; L7-L11 WeakPolarHBondContact O-CG 3.34Å; L7-L11 PolarHBondContact O-N 2.81Å
8	A	73.4	Confident	70.3	Confident	47 Å²	47	107.2 Å²	107.2	39%	0.388	58%	0.578	S	S	.	*	H	α-helix	trans	-64.4	-40.6	176.9	0	0	0	0	0	112.3	L4 L5 L6 L11 L12	L4-A8 WeakPolarHBondContact O-CB 3.29Å; L4-A8 PolarHBondContact O-N 3.36Å; L5-A8 PolarHBondContact O-N 3.02Å; L6-A8 VanDerWaalsContact C-N 3.35Å; A8-L11 PolarHBondContact O-N 2.95Å; A8-L12 WeakPolarHBondContact O-CB 3.35Å; A8-L12 WeakPolarHBondContact O-CD1 3.42Å; A8-L12 WeakPolarHBondContact O-CG 3.39Å; A8-L12 PolarHBondContact O-N 3.3Å
9	V	76.3	Confident	70.3	Confident	75 Å²	75	107.4 Å²	107.4	46%	0.455	58%	0.578	S	S	.	*	H	α-helix	trans	-66.6	-41.8	176.2	172.5	0	0	0	0	111.3	L5 L6 L12 L13	L5-V9 VanDerWaalsContact O-CG2 3.32Å; L5-V9 WeakPolarHBondContact O-CG2 3.46Å; L5-V9 PolarHBondContact O-N 2.92Å; L6-V9 PolarHBondContact O-N 3.07Å; V9-L12 PolarHBondContact O-N 3.2Å; V9-L13 HydrophobicContact CG1-CD1 4.03Å; V9-L13 WeakPolarHBondContact O-CG 3.37Å; V9-L13 PolarHBondContact O-N 3.36Å
10	I	76.3	Confident	70.3	Confident	79 Å²	79	107.9 Å²	107.9	41%	0.405	58%	0.58	S	S	.	*	H	α-helix	trans	-63.7	-42.1	176.4	-68.9	166.5	0	0	0	110.8	L6 L7 L12 L13 L14	L6-I10 HydrophobicContact CD2-CD1 4.42Å; L6-I10 HydrophobicContact CG-CD1 4.4Å; L6-I10 VanDerWaalsContact O-CG1 3.29Å; L6-I10 WeakPolarHBondContact O-CG1 3.41Å; L6-I10 PolarHBondContact O-N 2.88Å; L7-I10 PolarHBondContact O-N 3.33Å; I10-L12 PolarHBondContact O-N 3.05Å; I10-L13 PolarHBondContact O-N 3.31Å; I10-L14 HydrophobicContact CG2-CD1 3.68Å; I10-L14 HydrophobicContact CG2-CG 4.31Å; I10-L14 WeakPolarHBondContact O-CB 3.39Å; I10-L14 VanDerWaalsContact O-CG 3.28Å; I10-L14 WeakPolarHBondContact O-CG 3.39Å; I10-L14 PolarHBondContact O-N 3.14Å
11	L	72.8	Confident	70.5	Confident	106 Å²	106	106.5 Å²	106.5	56%	0.555	58%	0.575	S	S	*	*	H	α-helix	trans	-64.6	-36.7	176.5	-78.3	162.8	0	0	0	112.7	L7 A8 S15	L7-L11 HydrophobicContact CD2-CD1 4.45Å; L7-L11 HydrophobicContact CG-CD1 4.48Å; L7-L11 WeakPolarHBondContact O-CB 3.4Å; L7-L11 WeakPolarHBondContact O-CG 3.34Å; L7-L11 PolarHBondContact O-N 2.81Å; A8-L11 PolarHBondContact O-N 2.95Å; L11-S15 WeakPolarHBondContact O-CB 2.97Å; L11-S15 PolarHBondContact O-N 3.37Å; L11-S15 PolarHBondContact O-OG 3.37Å
12	L	69.7	Low	71.5	Confident	117 Å²	117	104.8 Å²	104.8	61%	0.613	56%	0.556	S	S	*	*	H	α-helix	trans	-68.8	-36.2	174.1	-81.3	159.8	0	0	0	112.8	A8 V9 I10 S15 S16	A8-L12 WeakPolarHBondContact O-CB 3.35Å; A8-L12 WeakPolarHBondContact O-CD1 3.42Å; A8-L12 WeakPolarHBondContact O-CG 3.39Å; A8-L12 PolarHBondContact O-N 3.3Å; V9-L12 PolarHBondContact O-N 3.2Å; I10-L12 PolarHBondContact O-N 3.05Å; L12-S15 PolarHBondContact O-OG 2.88Å; L12-S15 VanDerWaalsContact O-OG 3.1Å; L12-S16 WeakPolarHBondContact O-CB 3.38Å; L12-S16 PolarHBondContact O-N 3.27Å; L12-S16 PolarHBondContact O-OG 3.3Å
13	L	67.8	Low	71.9	Confident	104 Å²	104	99 Å²	99	55%	0.545	54%	0.539	S	S	.	.	H	α-helix	trans	-70.8	-41	174.6	-72	169.3	0	0	0	111.3	V9 I10 S15 S16 L17	V9-L13 HydrophobicContact CG1-CD1 4.03Å; V9-L13 WeakPolarHBondContact O-CG 3.37Å; V9-L13 PolarHBondContact O-N 3.36Å; I10-L13 PolarHBondContact O-N 3.31Å; L13-S15 VanDerWaalsContact C-N 3.34Å; L13-S15 PolarHBondContact O-N 2.8Å; L13-S16 WeakPolarHBondContact CA-OG 3.48Å; L13-S16 PolarHBondContact O-N 3.37Å; L13-S16 PolarHBondContact O-OG 3.47Å; L13-L17 WeakPolarHBondContact O-CD1 3.23Å; L13-L17 PolarHBondContact O-N 3Å
14	L	68.8	Low	72	Confident	103 Å²	103	97.4 Å²	97.4	54%	0.539	53%	0.53	S	S	.	.	H	α-helix	trans	-68.9	-30.1	177.3	-73	168.9	0	0	0	112.9	I10 L17 P18	I10-L14 HydrophobicContact CG2-CD1 3.68Å; I10-L14 HydrophobicContact CG2-CG 4.31Å; I10-L14 WeakPolarHBondContact O-CB 3.39Å; I10-L14 VanDerWaalsContact O-CG 3.28Å; I10-L14 WeakPolarHBondContact O-CG 3.39Å; I10-L14 PolarHBondContact O-N 3.14Å; L14-L17 HydrophobicContact CD2-CD1 4.39Å; L14-P18 WeakPolarHBondContact O-CD 3.17Å
15	S	70.2	Confident	72	Confident	75 Å²	75	95.2 Å²	95.2	52%	0.524	52%	0.518	S	S	.	.	H	α-helix	trans	-79.5	-21.2	176.2	66.7	0	0	0	0	113.8	L11 L12 L13	L11-S15 WeakPolarHBondContact O-CB 2.97Å; L11-S15 PolarHBondContact O-N 3.37Å; L11-S15 PolarHBondContact O-OG 3.37Å; L12-S15 PolarHBondContact O-OG 2.88Å; L12-S15 VanDerWaalsContact O-OG 3.1Å; L13-S15 VanDerWaalsContact C-N 3.34Å; L13-S15 PolarHBondContact O-N 2.8Å
16	S	66.8	Low	71.8	Confident	47 Å²	47	91.3 Å²	91.3	33%	0.329	50%	0.5	S	S	.	.	H	α-helix	trans	-91.7	-23.6	179.3	50.6	0	0	0	0	114	L12 L13 L19 L20	L12-S16 WeakPolarHBondContact O-CB 3.38Å; L12-S16 PolarHBondContact O-N 3.27Å; L12-S16 PolarHBondContact O-OG 3.3Å; L13-S16 WeakPolarHBondContact CA-OG 3.48Å; L13-S16 PolarHBondContact O-N 3.37Å; L13-S16 PolarHBondContact O-OG 3.47Å; S16-L19 WeakPolarHBondContact O-CB 3.47Å; S16-L19 PolarHBondContact O-N 3.48Å; S16-L20 PolarHBondContact O-N 3.46Å
17	L	70	Confident	71.4	Confident	96 Å²	96	90 Å²	90	50%	0.503	49%	0.492	S	S	.	.	H	α-helix	trans	-54.6	-46.9	174.1	-94.9	151.1	0	0	0	114.1	L13 L14 L19 L20 V21	L13-L17 WeakPolarHBondContact O-CD1 3.23Å; L13-L17 PolarHBondContact O-N 3Å; L14-L17 HydrophobicContact CD2-CD1 4.39Å; L17-L19 VanDerWaalsContact C-N 3.29Å; L17-L19 PolarHBondContact O-N 2.93Å; L17-L20 PolarHBondContact O-N 3.23Å; L17-V21 WeakPolarHBondContact O-CG2 3.39Å; L17-V21 PolarHBondContact O-N 3.15Å
18	P	72.9	Confident	70.6	Confident	81 Å²	81	90.4 Å²	90.4	53%	0.526	49%	0.492	S	S	.	.	H	α-helix	trans	-63.5	-34.9	176.9	-19.9	30.6	0	0	0	112.5	L14 Y22	L14-P18 WeakPolarHBondContact O-CD 3.17Å; P18-Y22 VanDerWaalsContact O-CB 3.23Å; P18-Y22 WeakPolarHBondContact O-CB 3.47Å; P18-Y22 PolarHBondContact O-N 3.04Å
19	L	70.6	Confident	69.8	Low	112 Å²	112	94.6 Å²	94.6	59%	0.586	51%	0.505	S	S	*	.	H	α-helix	trans	-69.5	-39.9	178.9	-130	90.5	0	0	0	111.6	S16 L17 Y22 H23	S16-L19 WeakPolarHBondContact O-CB 3.47Å; S16-L19 PolarHBondContact O-N 3.48Å; L17-L19 VanDerWaalsContact C-N 3.29Å; L17-L19 PolarHBondContact O-N 2.93Å; L19-Y22 PolarHBondContact O-N 2.96Å; L19-H23 WeakPolarHBondContact O-CB 3.44Å; L19-H23 PolarHBondContact O-CD2 2.91Å; L19-H23 PolarHBondContact O-N 3.24Å
20	L	70.7	Confident	68.6	Low	116 Å²	116	96 Å²	96	61%	0.607	51%	0.509	S	S	*	.	H	α-helix	trans	-68.5	-40.2	175.9	-79.2	162.4	0	0	0	112	S16 L17 H23 S24	S16-L20 PolarHBondContact O-N 3.46Å; L17-L20 PolarHBondContact O-N 3.23Å; L20-H23 PolarHBondContact O-N 3.39Å; L20-S24 WeakPolarHBondContact O-CB 3.5Å; L20-S24 PolarHBondContact O-N 3.07Å
21	V	74.7	Confident	67.3	Low	80 Å²	80	98.4 Å²	98.4	49%	0.485	52%	0.518	S	S	.	.	H	α-helix	trans	-67	-41.2	174.5	174.4	0	0	0	0	110.6	L17 S24 L25	L17-V21 WeakPolarHBondContact O-CG2 3.39Å; L17-V21 PolarHBondContact O-N 3.15Å; V21-S24 PolarHBondContact O-N 3.31Å; V21-L25 HydrophobicContact CG1-CD1 3.86Å; V21-L25 HydrophobicContact CG1-CG 4.42Å; V21-L25 WeakPolarHBondContact O-CB 3.37Å; V21-L25 WeakPolarHBondContact O-CG 3.34Å; V21-L25 PolarHBondContact O-N 3.46Å
22	Y	78.6	Confident	66.1	Low	155 Å²	155	98.5 Å²	98.5	61%	0.608	52%	0.523	S	S	*	.	H	α-helix	trans	-62.2	-45.9	174.3	-177.6	-101.2	0	0	0	111.7	P18 L19 S24 L25 V26	P18-Y22 VanDerWaalsContact O-CB 3.23Å; P18-Y22 WeakPolarHBondContact O-CB 3.47Å; P18-Y22 PolarHBondContact O-N 3.04Å; L19-Y22 PolarHBondContact O-N 2.96Å; Y22-S24 PolarHBondContact O-N 3.39Å; Y22-L25 PolarHBondContact O-N 3.47Å; Y22-V26 HydrophobicContact CD1-CG2 4.12Å; Y22-V26 HydrophobicContact CD2-CG2 4.45Å; Y22-V26 HydrophobicContact CE1-CG2 3.79Å; Y22-V26 HydrophobicContact CE2-CG2 4.15Å; Y22-V26 HydrophobicContact CG-CG2 4.44Å; Y22-V26 WeakPolarHBondContact O-CB 3.45Å; Y22-V26 VanDerWaalsContact O-CG2 3.22Å; Y22-V26 WeakPolarHBondContact O-CG2 3.21Å; Y22-V26 PolarHBondContact O-N 2.95Å
23	H	71.8	Confident	64.8	Low	106 Å²	106	100.8 Å²	100.8	49%	0.491	53%	0.531	S	S	.	.	H	α-helix	trans	-63.3	-39.6	174.8	-90.3	-57.9	0	0	0	112.6	L19 L20 V26 I27	L19-H23 WeakPolarHBondContact O-CB 3.44Å; L19-H23 PolarHBondContact O-CD2 2.91Å; L19-H23 PolarHBondContact O-N 3.24Å; L20-H23 PolarHBondContact O-N 3.39Å; H23-V26 PolarHBondContact O-N 2.9Å; H23-I27 WeakPolarHBondContact O-CB 3.35Å; H23-I27 WeakPolarHBondContact O-CD1 3.31Å; H23-I27 WeakPolarHBondContact O-CG1 3.25Å; H23-I27 PolarHBondContact O-N 3.13Å
24	S	69.2	Low	63.6	Low	62 Å²	62	103.6 Å²	103.6	43%	0.434	54%	0.541	S	S	.	.	H	α-helix	trans	-64.1	-42.8	175.3	-173.4	0	0	0	0	111.9	L20 V21 Y22 I27 Q28	L20-S24 WeakPolarHBondContact O-CB 3.5Å; L20-S24 PolarHBondContact O-N 3.07Å; V21-S24 PolarHBondContact O-N 3.31Å; Y22-S24 PolarHBondContact O-N 3.39Å; S24-I27 PolarHBondContact O-N 2.94Å; S24-Q28 WeakPolarHBondContact O-CB 3.46Å; S24-Q28 WeakPolarHBondContact O-CG 3.39Å; S24-Q28 PolarHBondContact O-N 3.21Å
25	L	69.8	Low	62.1	Low	84 Å²	84	108 Å²	108	44%	0.44	55%	0.552	S	S	.	*	H	α-helix	trans	-66.5	-39.9	175.4	-75.2	167.2	0	0	0	111.9	V21 Y22 Q28 M29	V21-L25 HydrophobicContact CG1-CD1 3.86Å; V21-L25 HydrophobicContact CG1-CG 4.42Å; V21-L25 WeakPolarHBondContact O-CB 3.37Å; V21-L25 WeakPolarHBondContact O-CG 3.34Å; V21-L25 PolarHBondContact O-N 3.46Å; Y22-L25 PolarHBondContact O-N 3.47Å; L25-Q28 PolarHBondContact O-N 3.17Å; L25-M29 WeakPolarHBondContact O-CB 3.46Å; L25-M29 VanDerWaalsContact O-CG 3.32Å; L25-M29 WeakPolarHBondContact O-CG 3.42Å; L25-M29 PolarHBondContact O-N 3Å
26	V	69.1	Low	60.6	Low	48 Å²	48	110 Å²	110	29%	0.291	56%	0.563	S	S	.	*	H	α-helix	trans	-67	-40.3	174.8	171	0	0	0	0	110.8	Y22 H23 M29 L30	Y22-V26 HydrophobicContact CD1-CG2 4.12Å; Y22-V26 HydrophobicContact CD2-CG2 4.45Å; Y22-V26 HydrophobicContact CE1-CG2 3.79Å; Y22-V26 HydrophobicContact CE2-CG2 4.15Å; Y22-V26 HydrophobicContact CG-CG2 4.44Å; Y22-V26 WeakPolarHBondContact O-CB 3.45Å; Y22-V26 VanDerWaalsContact O-CG2 3.22Å; Y22-V26 WeakPolarHBondContact O-CG2 3.21Å; Y22-V26 PolarHBondContact O-N 2.95Å; H23-V26 PolarHBondContact O-N 2.9Å; V26-M29 PolarHBondContact O-N 3.39Å; V26-L30 HydrophobicContact CG1-CD1 3.81Å; V26-L30 HydrophobicContact CG1-CG 4.29Å; V26-L30 WeakPolarHBondContact O-CB 3.45Å; V26-L30 WeakPolarHBondContact O-CG 3.31Å; V26-L30 PolarHBondContact O-N 2.95Å
27	I	64.9	Low	59.3	Low	89 Å²	89	111.9 Å²	111.9	46%	0.456	58%	0.582	S	S	.	*	H	α-helix	trans	-64.3	-41	173.8	-70.3	164.9	0	0	0	110.6	H23 S24 L30 H31	H23-I27 WeakPolarHBondContact O-CB 3.35Å; H23-I27 WeakPolarHBondContact O-CD1 3.31Å; H23-I27 WeakPolarHBondContact O-CG1 3.25Å; H23-I27 PolarHBondContact O-N 3.13Å; S24-I27 PolarHBondContact O-N 2.94Å; I27-L30 PolarHBondContact O-N 3.29Å; I27-H31 WeakPolarHBondContact O-CB 3.37Å; I27-H31 PolarHBondContact O-N 3.16Å; I27-H31 PolarHBondContact O-ND1 2.92Å
28	Q	58.5	Low	58.2	Low	117 Å²	117	112.4 Å²	112.4	55%	0.547	59%	0.591	S	S	.	*	H	α-helix	trans	-63.9	-42.4	173.2	-80.4	-177.9	-19.7	0	0	111.8	S24 L25 H31 V32	S24-Q28 WeakPolarHBondContact O-CB 3.46Å; S24-Q28 WeakPolarHBondContact O-CG 3.39Å; S24-Q28 PolarHBondContact O-N 3.21Å; L25-Q28 PolarHBondContact O-N 3.17Å; Q28-H31 PolarHBondContact O-N 2.94Å; Q28-V32 VanDerWaalsContact O-CG2 3.22Å; Q28-V32 WeakPolarHBondContact O-CG2 3.48Å; Q28-V32 PolarHBondContact O-N 3.39Å
29	M	55.8	Low	57	Low	134 Å²	134	112.5 Å²	112.5	66%	0.66	60%	0.599	S	S	*	*	H	α-helix	trans	-67	-35.3	176	-73.3	-165.3	177.9	0	0	112.6	L25 V26 V32 Q33	L25-M29 WeakPolarHBondContact O-CB 3.46Å; L25-M29 VanDerWaalsContact O-CG 3.32Å; L25-M29 WeakPolarHBondContact O-CG 3.42Å; L25-M29 PolarHBondContact O-N 3Å; V26-M29 PolarHBondContact O-N 3.39Å; M29-V32 PolarHBondContact O-N 3.36Å; M29-Q33 PolarHBondContact O-N 3.4Å
30	L	51.1	Low	55.8	Low	105 Å²	105	113.2 Å²	113.2	55%	0.55	61%	0.613	S	S	.	*	H	α-helix	trans	-69.9	-33.8	173.1	-71.4	168.3	0	0	0	112.2	V26 I27 Q33	V26-L30 HydrophobicContact CG1-CD1 3.81Å; V26-L30 HydrophobicContact CG1-CG 4.29Å; V26-L30 WeakPolarHBondContact O-CB 3.45Å; V26-L30 WeakPolarHBondContact O-CG 3.31Å; V26-L30 PolarHBondContact O-N 2.95Å; I27-L30 PolarHBondContact O-N 3.29Å; L30-Q33 PolarHBondContact O-N 3.03Å
31	H	50.1	Low	55.5	Low	129 Å²	129	112.6 Å²	112.6	60%	0.597	61%	0.607	S	S	*	*	H	α-helix	trans	-73.4	-27	172.2	-80.2	76.1	0	0	0	112.9	I27 Q28 Q33	I27-H31 WeakPolarHBondContact O-CB 3.37Å; I27-H31 PolarHBondContact O-N 3.16Å; I27-H31 PolarHBondContact O-ND1 2.92Å; Q28-H31 PolarHBondContact O-N 2.94Å; H31-Q33 VanDerWaalsContact C-N 3.33Å
32	V	47.1	Very low	55.9	Low	109 Å²	109	117.6 Å²	117.6	66%	0.661	62%	0.617	S	S	*	*	H	α-helix	trans	-75.3	-22.9	174.8	170.5	0	0	0	0	111.7	Q28 M29	Q28-V32 VanDerWaalsContact O-CG2 3.22Å; Q28-V32 WeakPolarHBondContact O-CG2 3.48Å; Q28-V32 PolarHBondContact O-N 3.39Å; M29-V32 PolarHBondContact O-N 3.36Å
33	Q	42.9	Very low	56.5	Low	165 Å²	165	114.5 Å²	114.5	77%	0.771	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	10.2	-179.7	-84.9	-164.9	-36.8	0	0	116.2	M29 L30 H31	M29-Q33 PolarHBondContact O-N 3.4Å; L30-Q33 PolarHBondContact O-N 3.03Å; H31-Q33 VanDerWaalsContact C-N 3.33Å
34	Q	41.6	Very low	57.6	Low	163 Å²	163	110 Å²	110	76%	0.762	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	17.2	173.8	-88.5	-169.5	-20	0	0	115.3	P36	Q34-P36 VanDerWaalsContact O-CD 3.23Å; Q34-P36 WeakPolarHBondContact O-CD 3.37Å
35	Y	38.4	Very low	58.9	Low	194 Å²	194	108.5 Å²	108.5	76%	0.761	58%	0.58	S	S	*	*	S	Bend	trans	-90	105.8	158.4	-65.7	-77.9	0	0	0	107.7	A37	Y35-A37 PolarHBondContact O-N 2.61Å
36	P	38.9	Very low	60.3	Low	118 Å²	118	104.6 Å²	104.6	77%	0.766	56%	0.559	S	S	*	*			trans	-53.3	132.4	168.5	22.1	-29.9	0	0	0	107.6	Q34	Q34-P36 VanDerWaalsContact O-CD 3.23Å; Q34-P36 WeakPolarHBondContact O-CD 3.37Å
37	A	39	Very low	61.7	Low	87 Å²	87	102.3 Å²	102.3	72%	0.719	55%	0.546	S	S	*	.			trans	-46.1	132.6	169.5	0	0	0	0	0	108.2	Y35 A39	Y35-A37 PolarHBondContact O-N 2.61Å; A37-A39 PolarHBondContact O-N 2.94Å
38	P	46.2	Very low	63.2	Low	106 Å²	106	98.2 Å²	98.2	69%	0.688	53%	0.525	S	S	*	.			trans	-60.8	108.1	-178.9	22.2	-29.4	0	0	0	107.4	S40	P38-S40 PolarHBondContact O-N 3.34Å; P38-S40 VanDerWaalsContact O-N 3.16Å
39	A	47.5	Very low	65.1	Low	84 Å²	84	93.4 Å²	93.4	69%	0.694	50%	0.501	S	S	*	.			trans	-48.8	126.3	164	0	0	0	0	0	106.1	A37 Q41	A37-A39 PolarHBondContact O-N 2.94Å; A39-Q41 WeakPolarHBondContact O-CA 3.34Å; A39-Q41 PolarHBondContact O-N 3.01Å
40	S	45.6	Very low	67	Low	126 Å²	126	89.6 Å²	89.6	88%	0.881	48%	0.482	S	S	*	.			trans	-31.1	102.4	-179.9	179.8	0	0	0	0	110.6	P38 R42	P38-S40 PolarHBondContact O-N 3.34Å; P38-S40 VanDerWaalsContact O-N 3.16Å; S40-R42 PolarHBondContact O-N 3.39Å
41	Q	64.6	Low	69.1	Low	103 Å²	103	85.5 Å²	85.5	48%	0.481	46%	0.459	S	S	.	.			trans	-73.9	103.3	-169	-94.5	176.1	-19	0	0	108.1	A39 N43 H72	A39-Q41 WeakPolarHBondContact O-CA 3.34Å; A39-Q41 PolarHBondContact O-N 3.01Å; Q41-N43 PolarHBondContact O-N 3.23Å; Q41-H72 HydrophobicContact CB-CB 4.08Å; Q41-H72 PolarHBondContact O-ND1 3.25Å
42	R	83.1	Confident	71.2	Confident	186 Å²	186	79.4 Å²	79.4	70%	0.702	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-47.7	131.7	166.6	173.1	-174.9	166.8	108.8	-3.4	108.6	S40 L44 D86	S40-R42 PolarHBondContact O-N 3.39Å; R42-L44 PolarHBondContact O-N 3.27Å; R42-D86 IonicContact CZ-OD1 3.43Å; R42-D86 IonicContact NE-OD1 3.31Å; R42-D86 PolarHBondContact NE-OD1 2.67Å; R42-D86 IonicContact NH2-OD1 3.3Å; R42-D86 PolarHBondContact NH2-OD1 3.28Å
43	N	90.5	Very high	73.3	Confident	90 Å²	90	79 Å²	79	48%	0.481	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-60.4	119.3	172.1	-70.9	-19.1	0	0	0	109.5	Q41 H72 F74	Q41-N43 PolarHBondContact O-N 3.23Å; N43-H72 PolarHBondContact OD1-ND1 3.36Å; N43-F74 HydrophobicContact CB-CD2 4.05Å; N43-F74 HydrophobicContact CB-CE2 3.71Å
44	L	95.5	Very high	75.3	Confident	11 Å²	11	74.1 Å²	74.1	6%	0.058	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	128.6	177.8	-166.3	74.2	0	0	0	110.2	R42 I46 H72 F74 D86 V87 C323 Y326	R42-L44 PolarHBondContact O-N 3.27Å; L44-I46 HydrophobicContact CD2-CD1 4.16Å; L44-I46 HydrophobicContact CD2-CG1 4.04Å; L44-I46 HydrophobicContact CG-CG1 4.34Å; L44-H72 PolarHBondContact N-O 2.87Å; L44-F74 PolarHBondContact O-N 2.82Å; L44-D86 HydrophobicContact CD1-CB 3.42Å; L44-D86 VanDerWaalsContact CD1-CB 3.42Å; L44-D86 HydrophobicContact CG-CB 4.24Å; L44-V87 HydrophobicContact CD1-CG2 4.42Å; L44-V87 HydrophobicContact CD2-CG2 4.32Å; L44-C323 HydrophobicContact CD2-CB 4.39Å; L44-Y326 HydrophobicContact CD1-CD1 3.73Å; L44-Y326 HydrophobicContact CD1-CD2 3.86Å; L44-Y326 HydrophobicContact CD1-CE1 3.54Å; L44-Y326 HydrophobicContact CD1-CE2 3.67Å; L44-Y326 HydrophobicContact CD1-CG 3.88Å; L44-Y326 VanDerWaalsContact CD1-CZ 3.5Å; L44-Y326 HydrophobicContact CD2-CD1 4.22Å; L44-Y326 HydrophobicContact CD2-CD2 3.8Å; L44-Y326 HydrophobicContact CD2-CE2 4.41Å; L44-Y326 HydrophobicContact CD2-CG 3.68Å; L44-Y326 HydrophobicContact CG-CG 4.47Å
45	S	96.9	Very high	77.5	Confident	31 Å²	31	74.3 Å²	74.3	22%	0.217	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	120.7	171.8	-175.3	0	0	0	0	110.7	D86 V87	S45-D86 PolarHBondContact N-OD2 3.39Å; S45-D86 PolarHBondContact O-N 3.4Å; S45-V87 PolarHBondContact O-N 3.38Å; S45-V87 VanDerWaalsContact O-N 3.13Å
46	I	98.3	Very high	80.1	Confident	1 Å²	1	69.2 Å²	69.2	1%	0.005	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	115.7	178.1	-59.2	168.9	0	0	0	108.7	L44 F74 L75 T76 V87 V89 I322 C323	L44-I46 HydrophobicContact CD2-CD1 4.16Å; L44-I46 HydrophobicContact CD2-CG1 4.04Å; L44-I46 HydrophobicContact CG-CG1 4.34Å; I46-F74 PolarHBondContact N-O 3.07Å; I46-L75 HydrophobicContact CB-CD2 3.84Å; I46-L75 HydrophobicContact CD1-CD2 3.94Å; I46-L75 HydrophobicContact CG1-CD2 4.45Å; I46-L75 HydrophobicContact CG2-CD2 4.11Å; I46-L75 WeakPolarHBondContact O-CA 3.31Å; I46-T76 PolarHBondContact O-N 2.9Å; I46-V87 WeakPolarHBondContact CA-O 3.49Å; I46-V87 HydrophobicContact CG1-CB 4.26Å; I46-V89 HydrophobicContact CG2-CG2 3.73Å; I46-I322 HydrophobicContact CD1-CB 3.74Å; I46-I322 HydrophobicContact CD1-CD1 4.35Å; I46-I322 HydrophobicContact CD1-CG2 3.87Å; I46-I322 HydrophobicContact CG1-CG2 4.38Å; I46-I322 HydrophobicContact CG2-CD1 4.09Å; I46-C323 WeakPolarHBondContact CD1-SG 3.21Å
47	L	98.5	Very high	82.8	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	118.8	172.5	173	59.8	0	0	0	110.4	W49 T76 D78 Y82 A85 V87 V88 V89	L47-W49 HydrophobicContact CD2-CE3 4.05Å; L47-W49 HydrophobicContact CD2-CZ3 4.26Å; L47-T76 CarbonylContact C-O 3.56Å; L47-T76 WeakPolarHBondContact CA-O 3.43Å; L47-T76 HydrophobicContact CB-CG2 4.22Å; L47-T76 HydrophobicContact CD1-CG2 4.06Å; L47-D78 WeakPolarHBondContact CD1-O 3.3Å; L47-Y82 HydrophobicContact CD2-CD2 4.35Å; L47-A85 HydrophobicContact CB-CB 3.78Å; L47-V87 PolarHBondContact N-O 3.05Å; L47-V88 HydrophobicContact CB-CG1 4.39Å; L47-V88 HydrophobicContact CB-CG2 4.31Å; L47-V88 HydrophobicContact CD2-CG1 4.16Å; L47-V88 HydrophobicContact CD2-CG2 4.3Å; L47-V88 HydrophobicContact CG-CG1 4.18Å; L47-V88 CarbonylContact O-C 3.08Å; L47-V88 WeakPolarHBondContact O-CA 3.31Å; L47-V89 PolarHBondContact O-N 3.41Å
48	L	98.1	Very high	85.4	Confident	3 Å²	3	66.2 Å²	66.2	2%	0.016	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	114.5	164.8	179.9	65.5	0	0	0	109.2	H50 W51 T76 V89 L319	L48-H50 WeakPolarHBondContact CD1-O 3.27Å; L48-H50 PolarHBondContact O-N 3.37Å; L48-W51 HydrophobicContact CD2-CD2 3.41Å; L48-W51 VanDerWaalsContact CD2-CD2 3.41Å; L48-W51 HydrophobicContact CD2-CE3 3.41Å; L48-W51 VanDerWaalsContact CD2-CE3 3.41Å; L48-W51 HydrophobicContact CD2-CG 3.98Å; L48-W51 HydrophobicContact CD2-CH2 3.98Å; L48-W51 HydrophobicContact CD2-CZ2 4.01Å; L48-W51 HydrophobicContact CD2-CZ3 3.68Å; L48-T76 PolarHBondContact N-O 2.89Å; L48-V89 HydrophobicContact CD1-CB 4.21Å; L48-V89 HydrophobicContact CD1-CG1 4.31Å; L48-L319 HydrophobicContact CB-CD1 4.33Å; L48-L319 HydrophobicContact CD1-CD1 4.31Å; L48-L319 HydrophobicContact CD1-CD2 4.17Å; L48-L319 HydrophobicContact CD2-CD1 3.95Å; L48-L319 HydrophobicContact CG-CD1 4.43Å
49	W	97.2	Very high	87.8	Confident	16 Å²	16	62 Å²	62	6%	0.061	34%	0.338	C	S	.	.	S	Bend	trans	-70.2	-33	-174.4	-171.1	-113.1	0	0	0	113.7	L47 R79 Y82 V88 V89 F90 S100 A101 P103	L47-W49 HydrophobicContact CD2-CE3 4.05Å; L47-W49 HydrophobicContact CD2-CZ3 4.26Å; W49-R79 HydrophobicContact CE3-CG 4Å; W49-R79 HydrophobicContact CH2-CB 4.29Å; W49-R79 HydrophobicContact CH2-CG 4.14Å; W49-R79 HydrophobicContact CZ3-CB 3.97Å; W49-R79 HydrophobicContact CZ3-CG 3.78Å; W49-R79 PolarHBondContact O-NE 2.89Å; W49-R79 VanDerWaalsContact O-NE 3.11Å; W49-R79 PolarHBondContact O-NH2 2.85Å; W49-Y82 HydrophobicContact CE3-CD2 4.45Å; W49-Y82 AromaticContact CZ3-CD2 3.95Å; W49-Y82 HydrophobicContact CZ3-CD2 3.95Å; W49-Y82 HydrophobicContact CZ3-CG 4.29Å; W49-V88 HydrophobicContact CB-CG1 4.15Å; W49-V88 HydrophobicContact CE3-CG1 4.27Å; W49-V89 WeakPolarHBondContact CB-O 3.48Å; W49-V89 PolarHBondContact N-O 3.07Å; W49-F90 HydrophobicContact CB-CD1 3.57Å; W49-F90 HydrophobicContact CB-CE1 3.62Å; W49-F90 HydrophobicContact CB-CG 4.22Å; W49-F90 HydrophobicContact CB-CZ 4.32Å; W49-F90 AromaticContact CD1-CD1 3.44Å; W49-F90 VanDerWaalsContact CD1-CD1 3.44Å; W49-F90 AromaticContact CD1-CE1 3.38Å; W49-F90 AromaticContact CD2-CE1 3.81Å; W49-F90 HydrophobicContact CD2-CE1 3.81Å; W49-F90 HydrophobicContact CD2-CZ 4.49Å; W49-F90 AromaticContact CG-CD1 3.57Å; W49-F90 HydrophobicContact CG-CD1 3.57Å; W49-F90 AromaticContact CG-CE1 3.31Å; W49-F90 HydrophobicContact CG-CE1 3.31Å; W49-F90 HydrophobicContact CG-CZ 4.23Å; W49-F90 AromaticContact NE1-CE1 3.9Å; W49-S100 PolarHBondContact NE1-OG 3.38Å; W49-A101 PolarHBondContact NE1-O 2.96Å; W49-P103 HydrophobicContact CD2-CG 4.45Å; W49-P103 HydrophobicContact CE3-CG 4.44Å; W49-P103 HydrophobicContact CH2-CB 3.54Å; W49-P103 HydrophobicContact CH2-CG 3.71Å; W49-P103 HydrophobicContact CZ2-CB 3.55Å; W49-P103 HydrophobicContact CZ2-CG 3.7Å; W49-P103 HydrophobicContact CZ3-CB 4.35Å; W49-P103 HydrophobicContact CZ3-CG 4.09Å
50	H	95.2	Very high	89.9	Confident	54 Å²	54	61.6 Å²	61.6	25%	0.25	33%	0.331	C	S	.	.	S	Bend	trans	-156.7	141	174.2	-165.7	-69.1	0	0	0	110.2	L48 E94	L48-H50 WeakPolarHBondContact CD1-O 3.27Å; L48-H50 PolarHBondContact O-N 3.37Å; H50-E94 HydrophobicContact CB-CB 4.36Å; H50-E94 HydrophobicContact CB-CG 4.26Å; H50-E94 WeakPolarHBondContact ND1-CG 2.97Å
51	W	95.9	Very high	92	Very high	19 Å²	19	58 Å²	58	7%	0.072	31%	0.314	C	S	.	.			trans	-68	134.9	177.4	-79.9	103.9	0	0	0	113.2	L48 F53 Y57 L59 D77 W315 R316	L48-W51 HydrophobicContact CD2-CD2 3.41Å; L48-W51 VanDerWaalsContact CD2-CD2 3.41Å; L48-W51 HydrophobicContact CD2-CE3 3.41Å; L48-W51 VanDerWaalsContact CD2-CE3 3.41Å; L48-W51 HydrophobicContact CD2-CG 3.98Å; L48-W51 HydrophobicContact CD2-CH2 3.98Å; L48-W51 HydrophobicContact CD2-CZ2 4.01Å; L48-W51 HydrophobicContact CD2-CZ3 3.68Å; W51-F53 PolarHBondContact O-N 2.75Å; W51-Y57 AromaticContact CE3-CD2 3.86Å; W51-Y57 HydrophobicContact CE3-CD2 3.86Å; W51-Y57 HydrophobicContact CE3-CE2 4.47Å; W51-Y57 AromaticContact CH2-CD2 3.93Å; W51-Y57 HydrophobicContact CH2-CD2 3.93Å; W51-Y57 HydrophobicContact CH2-CG 4.35Å; W51-Y57 VanDerWaalsContact CZ2-O 3.26Å; W51-Y57 WeakPolarHBondContact CZ2-O 2.9Å; W51-Y57 AromaticContact CZ3-CD2 3.5Å; W51-Y57 HydrophobicContact CZ3-CD2 3.5Å; W51-Y57 VanDerWaalsContact CZ3-CD2 3.5Å; W51-Y57 HydrophobicContact CZ3-CE2 4.31Å; W51-Y57 HydrophobicContact CZ3-CG 4.33Å; W51-L59 HydrophobicContact CH2-CD1 4.27Å; W51-L59 HydrophobicContact CH2-CD2 3.89Å; W51-L59 HydrophobicContact CH2-CG 4.2Å; W51-L59 HydrophobicContact CZ2-CD1 3.74Å; W51-L59 HydrophobicContact CZ2-CD2 4Å; W51-L59 HydrophobicContact CZ2-CG 3.77Å; W51-D77 PolarHBondContact NE1-OD2 3.33Å; W51-W315 HydrophobicContact CE3-CB 4.5Å; W51-W315 HydrophobicContact CZ3-CB 3.85Å; W51-R316 HydrophobicContact CH2-CG 4.27Å
52	P	94.4	Very high	93.4	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.006	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-58.3	132	172.5	-28.9	37.6	0	0	0	113.7	G54 R55 H91 E94 W315	P52-G54 PolarHBondContact O-N 3.09Å; P52-G54 VanDerWaalsContact O-N 3.12Å; P52-R55 PolarHBondContact O-N 3.04Å; P52-R55 VanDerWaalsContact O-N 3.12Å; P52-H91 WeakPolarHBondContact CA-ND1 3.37Å; P52-H91 WeakPolarHBondContact CB-ND1 3.44Å; P52-H91 HydrophobicContact CG-CB 4.06Å; P52-E94 WeakPolarHBondContact CA-OE1 3.47Å; P52-W315 HydrophobicContact CB-CD2 4.1Å; P52-W315 VanDerWaalsContact CB-CE2 3.49Å; P52-W315 HydrophobicContact CB-CH2 4.09Å; P52-W315 HydrophobicContact CB-CZ2 3.49Å; P52-W315 VanDerWaalsContact CB-CZ2 3.49Å; P52-W315 HydrophobicContact CG-CD2 3.75Å; P52-W315 HydrophobicContact CG-CE3 3.96Å; P52-W315 HydrophobicContact CG-CG 4.31Å; P52-W315 HydrophobicContact CG-CH2 4.05Å; P52-W315 HydrophobicContact CG-CZ2 3.84Å; P52-W315 HydrophobicContact CG-CZ3 4.12Å
53	F	90.3	Very high	94	Very high	102 Å²	102	47.1 Å²	47.1	45%	0.447	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	54.8	27.2	175.6	-49.5	-69.9	0	0	0	114.4	W51 R55 H91 Q93 E94 W315	W51-F53 PolarHBondContact O-N 2.75Å; F53-R55 PolarHBondContact O-N 2.96Å; F53-H91 AromaticContact CE2-CE1 3.78Å; F53-H91 AromaticContact CZ-CE1 3.69Å; F53-Q93 HydrophobicContact CD1-CG 4.29Å; F53-Q93 HydrophobicContact CE1-CB 4.3Å; F53-Q93 HydrophobicContact CE1-CG 3.95Å; F53-E94 PolarHBondContact N-OE1 3.4Å; F53-W315 HydrophobicContact CD2-CZ2 4.38Å; F53-W315 HydrophobicContact CE2-CZ2 4.08Å
54	G	85.1	Confident	94.3	Very high	61 Å²	61	42.9 Å²	42.9	63%	0.629	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	66.5	16.6	-178.8	0	0	0	0	0	114.4	P52	P52-G54 PolarHBondContact O-N 3.09Å; P52-G54 VanDerWaalsContact O-N 3.12Å
55	R	88.9	Confident	94.3	Very high	168 Å²	168	46.7 Å²	46.7	63%	0.634	27%	0.268	S	S	*	.			trans	-101.5	104.4	177.5	-67	-173.9	179.6	-161.6	-1.5	110.1	P52 F53 Y57	P52-R55 PolarHBondContact O-N 3.04Å; P52-R55 VanDerWaalsContact O-N 3.12Å; F53-R55 PolarHBondContact O-N 2.96Å; R55-Y57 HydrophobicContact CB-CE2 4.34Å; R55-Y57 WeakPolarHBondContact O-CE2 3.33Å
56	S	93.3	Very high	94.3	Very high	87 Å²	87	50.5 Å²	50.5	61%	0.608	28%	0.283	S	S	*	.			trans	-91.7	155.8	176.4	59.7	0	0	0	0	112.6
57	Y	94.1	Very high	94.1	Very high	69 Å²	69	54.4 Å²	54.4	27%	0.271	30%	0.302	S	S	.	.			trans	-133.5	149.6	176.4	-60	-99.9	0	0	0	108.3	W51 R55 L59 W315	W51-Y57 AromaticContact CE3-CD2 3.86Å; W51-Y57 HydrophobicContact CE3-CD2 3.86Å; W51-Y57 HydrophobicContact CE3-CE2 4.47Å; W51-Y57 AromaticContact CH2-CD2 3.93Å; W51-Y57 HydrophobicContact CH2-CD2 3.93Å; W51-Y57 HydrophobicContact CH2-CG 4.35Å; W51-Y57 VanDerWaalsContact CZ2-O 3.26Å; W51-Y57 WeakPolarHBondContact CZ2-O 2.9Å; W51-Y57 AromaticContact CZ3-CD2 3.5Å; W51-Y57 HydrophobicContact CZ3-CD2 3.5Å; W51-Y57 VanDerWaalsContact CZ3-CD2 3.5Å; W51-Y57 HydrophobicContact CZ3-CE2 4.31Å; W51-Y57 HydrophobicContact CZ3-CG 4.33Å; R55-Y57 HydrophobicContact CB-CE2 4.34Å; R55-Y57 WeakPolarHBondContact O-CE2 3.33Å; Y57-L59 PolarHBondContact O-N 3.19Å; Y57-W315 HydrophobicContact CE2-CB 4.43Å; Y57-W315 AromaticContact CE2-CD1 3.86Å
58	S	94.4	Very high	94	Very high	72 Å²	72	57 Å²	57	50%	0.503	31%	0.312	S	S	.	.			trans	-66	128.8	173.3	178.3	0	0	0	0	110.9	S60	S58-S60 PolarHBondContact OG-N 3.03Å; S58-S60 PolarHBondContact OG-OG 3.39Å
59	L	95.7	Very high	93.8	Very high	17 Å²	17	59.8 Å²	59.8	9%	0.089	34%	0.341	C	S	.	.			trans	-105	12.8	172.7	-60.2	-178.6	0	0	0	112.8	W51 Y57 G61 L75 D77 R316	W51-L59 HydrophobicContact CH2-CD1 4.27Å; W51-L59 HydrophobicContact CH2-CD2 3.89Å; W51-L59 HydrophobicContact CH2-CG 4.2Å; W51-L59 HydrophobicContact CZ2-CD1 3.74Å; W51-L59 HydrophobicContact CZ2-CD2 4Å; W51-L59 HydrophobicContact CZ2-CG 3.77Å; Y57-L59 PolarHBondContact O-N 3.19Å; L59-G61 PolarHBondContact O-N 3Å; L59-L75 HydrophobicContact CD1-CB 4.06Å; L59-L75 HydrophobicContact CD2-CB 3.94Å; L59-L75 HydrophobicContact CD2-CD1 4.02Å; L59-L75 HydrophobicContact CG-CB 4.42Å; L59-D77 HydrophobicContact CD1-CB 3.92Å; L59-R316 HydrophobicContact CD2-CG 3.72Å
60	S	91.8	Very high	93.7	Very high	76 Å²	76	59.9 Å²	59.9	53%	0.531	34%	0.343	S	S	.	.			trans	-63.1	131	178.4	64	0	0	0	0	111.8	S58 K63	S58-S60 PolarHBondContact OG-N 3.03Å; S58-S60 PolarHBondContact OG-OG 3.39Å; S60-K63 WeakPolarHBondContact O-CE 3.45Å; S60-K63 PolarHBondContact O-NZ 3.23Å; S60-K63 VanDerWaalsContact O-NZ 3.12Å
61	G	91	Very high	93.6	Very high	52 Å²	52	58.7 Å²	58.7	54%	0.536	35%	0.345	S	S	.	.	S	Bend	trans	83.8	-168.3	-177.4	0	0	0	0	0	112.8	L59 K63	L59-G61 PolarHBondContact O-N 3Å; G61-K63 PolarHBondContact O-N 2.9Å
62	N	93.6	Very high	93.4	Very high	23 Å²	23	61.8 Å²	61.8	12%	0.123	36%	0.36	C	S	.	.			trans	-95.5	78.6	-179.9	-172.5	-23.8	0	0	0	109.8	C64 L65 E66 C73 F74	N62-C64 VanDerWaalsContact C-N 3.25Å; N62-C64 PolarHBondContact O-N 3.13Å; N62-L65 HydrophobicContact CB-CB 4.17Å; N62-L65 VanDerWaalsContact CG-CB 3.45Å; N62-L65 PolarHBondContact O-N 2.65Å; N62-L65 WeakPolarHBondContact OD1-CB 3.11Å; N62-L65 PolarHBondContact OD1-N 2.85Å; N62-E66 PolarHBondContact N-OE1 3.12Å; N62-E66 VanDerWaalsContact O-CB 3.28Å; N62-E66 WeakPolarHBondContact O-CB 3.25Å; N62-E66 WeakPolarHBondContact O-CG 3.22Å; N62-E66 PolarHBondContact O-N 3.33Å; N62-C73 PolarHBondContact OD1-O 2.96Å; N62-F74 HydrophobicContact CB-CD1 4.43Å; N62-F74 HydrophobicContact CB-CE1 4.08Å
63	K	95.1	Very high	93.5	Very high	37 Å²	37	61.8 Å²	61.8	16%	0.161	36%	0.36	C	S	.	.	H	α-helix	trans	-59.6	-34	-176.8	-66.6	-45.6	-176.4	-156.1	0	114	S60 G61 E66 M67	S60-K63 WeakPolarHBondContact O-CE 3.45Å; S60-K63 PolarHBondContact O-NZ 3.23Å; S60-K63 VanDerWaalsContact O-NZ 3.12Å; G61-K63 PolarHBondContact O-N 2.9Å; K63-E66 IonicContact NZ-OE2 2.72Å; K63-E66 PolarHBondContact NZ-OE2 2.91Å; K63-M67 HydrophobicContact CB-SD 4.43Å; K63-M67 HydrophobicContact CD-CG 4.39Å; K63-M67 HydrophobicContact CD-SD 3.93Å; K63-M67 VanDerWaalsContact O-CB 3.31Å; K63-M67 WeakPolarHBondContact O-CB 3.4Å; K63-M67 PolarHBondContact O-N 3.07Å
64	C	96.6	Very high	93.8	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-64.4	-43.4	177.8	-64.4	0	0	0	0	111.9	N62 Y68 G69 I70 C73 C320	N62-C64 VanDerWaalsContact C-N 3.25Å; N62-C64 PolarHBondContact O-N 3.13Å; C64-Y68 CarbonylContact O-C 3.18Å; C64-Y68 WeakPolarHBondContact O-CA 3.31Å; C64-Y68 WeakPolarHBondContact O-CB 3.45Å; C64-Y68 PolarHBondContact O-N 3.42Å; C64-Y68 VanDerWaalsContact O-N 3.16Å; C64-G69 PolarHBondContact O-N 2.83Å; C64-G69 VanDerWaalsContact O-N 3.1Å; C64-I70 CarbonylContact C-O 3.41Å; C64-I70 HydrophobicContact CB-CB 4.06Å; C64-I70 HydrophobicContact CB-CG2 4.37Å; C64-I70 WeakPolarHBondContact CB-O 3.34Å; C64-I70 PolarHBondContact O-N 2.95Å; C64-C73 HydrophobicContact CB-CB 3.69Å; C64-C73 WeakPolarHBondContact CB-O 3.38Å; C64-C73 PolarHBondContact SG-SG 3Å; C64-C320 WeakPolarHBondContact CA-SG 3.44Å; C64-C320 HydrophobicContact CB-CB 3.86Å; C64-C320 WeakPolarHBondContact CB-SG 3.23Å; C64-C320 WeakPolarHBondContact SG-CB 3.33Å; C64-C320 CovalentContact SG-SG 2.04Å; C64-C320 PolarHBondContact SG-SG 3Å
65	L	96.1	Very high	94.4	Very high	91 Å²	91	58.4 Å²	58.4	48%	0.476	33%	0.329	S	S	.	.	H	α-helix	trans	-72.8	-52.3	175.8	-179.2	61.5	0	0	0	111.8	N62 M67 G69 I70	N62-L65 HydrophobicContact CB-CB 4.17Å; N62-L65 VanDerWaalsContact CG-CB 3.45Å; N62-L65 PolarHBondContact O-N 2.65Å; N62-L65 WeakPolarHBondContact OD1-CB 3.11Å; N62-L65 PolarHBondContact OD1-N 2.85Å; L65-M67 VanDerWaalsContact C-N 3.34Å; L65-M67 PolarHBondContact O-N 2.79Å; L65-G69 WeakPolarHBondContact O-CA 3.09Å; L65-G69 PolarHBondContact O-N 3.5Å; L65-I70 WeakPolarHBondContact CA-O 3.36Å; L65-I70 PolarHBondContact N-O 2.84Å
66	E	95.9	Very high	94.8	Very high	111 Å²	111	52 Å²	52	52%	0.519	31%	0.308	S	S	.	.	H	α-helix	trans	-60.4	-39.9	-173.3	-72.1	164.3	-157.1	0	0	112.7	N62 K63	N62-E66 PolarHBondContact N-OE1 3.12Å; N62-E66 VanDerWaalsContact O-CB 3.28Å; N62-E66 WeakPolarHBondContact O-CB 3.25Å; N62-E66 WeakPolarHBondContact O-CG 3.22Å; N62-E66 PolarHBondContact O-N 3.33Å; K63-E66 IonicContact NZ-OE2 2.72Å; K63-E66 PolarHBondContact NZ-OE2 2.91Å
67	M	95.5	Very high	95	Very high	83 Å²	83	51.2 Å²	51.2	41%	0.409	30%	0.297	S	S	.	.	H	α-helix	trans	-103.8	-28.2	-172.3	-58.8	-176.8	61.3	0	0	113.5	K63 L65	K63-M67 HydrophobicContact CB-SD 4.43Å; K63-M67 HydrophobicContact CD-CG 4.39Å; K63-M67 HydrophobicContact CD-SD 3.93Å; K63-M67 VanDerWaalsContact O-CB 3.31Å; K63-M67 WeakPolarHBondContact O-CB 3.4Å; K63-M67 PolarHBondContact O-N 3.07Å; L65-M67 VanDerWaalsContact C-N 3.34Å; L65-M67 PolarHBondContact O-N 2.79Å
68	Y	95.1	Very high	95.1	Very high	55 Å²	55	52 Å²	52	22%	0.216	31%	0.306	C	S	.	.	H	α-helix	trans	-128.8	1.3	-170.3	-46.6	-65.1	0	0	0	113.7	C64 I70 D314 R316 E317 C320	C64-Y68 CarbonylContact O-C 3.18Å; C64-Y68 WeakPolarHBondContact O-CA 3.31Å; C64-Y68 WeakPolarHBondContact O-CB 3.45Å; C64-Y68 PolarHBondContact O-N 3.42Å; C64-Y68 VanDerWaalsContact O-N 3.16Å; Y68-I70 PolarHBondContact O-N 2.83Å; Y68-D314 WeakPolarHBondContact OH-CB 3.35Å; Y68-D314 PolarHBondContact OH-OD2 3.2Å; Y68-R316 HydrophobicContact CE2-CB 4.07Å; Y68-E317 HydrophobicContact CD1-CB 4Å; Y68-E317 HydrophobicContact CD1-CG 3.68Å; Y68-E317 HydrophobicContact CD2-CB 4.31Å; Y68-E317 HydrophobicContact CD2-CG 4.44Å; Y68-E317 HydrophobicContact CE1-CB 3.51Å; Y68-E317 HydrophobicContact CE1-CG 3.69Å; Y68-E317 VanDerWaalsContact CE2-CA 3.48Å; Y68-E317 HydrophobicContact CE2-CB 3.87Å; Y68-E317 HydrophobicContact CE2-CG 4.45Å; Y68-E317 HydrophobicContact CG-CB 4.38Å; Y68-E317 HydrophobicContact CG-CG 4.08Å; Y68-E317 VanDerWaalsContact CZ-CB 3.44Å; Y68-E317 PolarHBondContact OH-N 3.41Å; Y68-C320 HydrophobicContact CD2-CB 4.48Å
69	G	95.6	Very high	95.2	Very high	61 Å²	61	53.9 Å²	53.9	63%	0.629	30%	0.302	S	S	*	.			trans	68.3	16.9	179.5	0	0	0	0	0	114.4	C64 L65 G71	C64-G69 PolarHBondContact O-N 2.83Å; C64-G69 VanDerWaalsContact O-N 3.1Å; L65-G69 WeakPolarHBondContact O-CA 3.09Å; L65-G69 PolarHBondContact O-N 3.5Å; G69-G71 PolarHBondContact O-N 3.48Å
70	I	94.9	Very high	95.2	Very high	19 Å²	19	57.1 Å²	57.1	10%	0.097	33%	0.326	C	S	.	.			trans	-94.8	97.9	-179	-59.6	169.8	0	0	0	108.6	C64 L65 Y68 C73 C320 C323 L324	C64-I70 CarbonylContact C-O 3.41Å; C64-I70 HydrophobicContact CB-CB 4.06Å; C64-I70 HydrophobicContact CB-CG2 4.37Å; C64-I70 WeakPolarHBondContact CB-O 3.34Å; C64-I70 PolarHBondContact O-N 2.95Å; L65-I70 WeakPolarHBondContact CA-O 3.36Å; L65-I70 PolarHBondContact N-O 2.84Å; Y68-I70 PolarHBondContact O-N 2.83Å; I70-C73 HydrophobicContact CG2-CB 3.92Å; I70-C320 HydrophobicContact CD1-CB 3.72Å; I70-C323 HydrophobicContact CG2-CB 4.06Å; I70-L324 HydrophobicContact CD1-CD1 3.92Å; I70-L324 HydrophobicContact CD1-CD2 4.43Å; I70-L324 HydrophobicContact CD1-CG 4.13Å; I70-L324 HydrophobicContact CG1-CD1 4.45Å; I70-L324 HydrophobicContact CG1-CD2 4.23Å; I70-L324 HydrophobicContact CG1-CG 4.47Å; I70-L324 HydrophobicContact CG2-CD2 4.07Å; I70-L324 HydrophobicContact CG2-CG 4.45Å
71	G	93.3	Very high	95.5	Very high	28 Å²	28	54.3 Å²	54.3	29%	0.289	31%	0.307	S	S	.	.			trans	-69.9	167.6	177.8	0	0	0	0	0	113.7	G69 C73	G69-G71 PolarHBondContact O-N 3.48Å; G71-C73 PolarHBondContact O-N 3.14Å
72	H	91.2	Very high	95.8	Very high	85 Å²	85	52 Å²	52	39%	0.394	28%	0.283	S	S	.	.	S	Bend	trans	54.2	28.8	175.2	-55.6	-70.6	0	0	0	114.8	Q41 N43 L44	Q41-H72 HydrophobicContact CB-CB 4.08Å; Q41-H72 PolarHBondContact O-ND1 3.25Å; N43-H72 PolarHBondContact OD1-ND1 3.36Å; L44-H72 PolarHBondContact N-O 2.87Å
73	C	95.3	Very high	96	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	112.3	-172.6	-172.7	0	0	0	0	110.2	N62 C64 I70 G71 C323	N62-C73 PolarHBondContact OD1-O 2.96Å; C64-C73 HydrophobicContact CB-CB 3.69Å; C64-C73 WeakPolarHBondContact CB-O 3.38Å; C64-C73 PolarHBondContact SG-SG 3Å; I70-C73 HydrophobicContact CG2-CB 3.92Å; G71-C73 PolarHBondContact O-N 3.14Å; C73-C323 VanDerWaalsContact CA-SG 3.59Å; C73-C323 HydrophobicContact CB-CB 3.6Å; C73-C323 WeakPolarHBondContact CB-SG 3.46Å; C73-C323 WeakPolarHBondContact SG-CB 3.45Å; C73-C323 CovalentContact SG-SG 2Å; C73-C323 PolarHBondContact SG-SG 3.46Å
74	F	96.9	Very high	96	Very high	78 Å²	78	58.3 Å²	58.3	34%	0.342	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	123.5	-175	-63.5	-90.8	0	0	0	110	N43 L44 I46 N62	N43-F74 HydrophobicContact CB-CD2 4.05Å; N43-F74 HydrophobicContact CB-CE2 3.71Å; L44-F74 PolarHBondContact O-N 2.82Å; I46-F74 PolarHBondContact N-O 3.07Å; N62-F74 HydrophobicContact CB-CD1 4.43Å; N62-F74 HydrophobicContact CB-CE1 4.08Å
75	L	98.1	Very high	96.1	Very high	15 Å²	15	58.5 Å²	58.5	8%	0.079	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	140.5	175.5	-56.9	-175.5	0	0	0	109.7	I46 L59 R316 L319	I46-L75 HydrophobicContact CB-CD2 3.84Å; I46-L75 HydrophobicContact CD1-CD2 3.94Å; I46-L75 HydrophobicContact CG1-CD2 4.45Å; I46-L75 HydrophobicContact CG2-CD2 4.11Å; I46-L75 WeakPolarHBondContact O-CA 3.31Å; L59-L75 HydrophobicContact CD1-CB 4.06Å; L59-L75 HydrophobicContact CD2-CB 3.94Å; L59-L75 HydrophobicContact CD2-CD1 4.02Å; L59-L75 HydrophobicContact CG-CB 4.42Å; L75-R316 HydrophobicContact CD1-CB 4.2Å; L75-L319 HydrophobicContact CD1-CB 4.04Å; L75-L319 HydrophobicContact CD2-CB 3.89Å
76	T	97.7	Very high	96.1	Very high	32 Å²	32	55 Å²	55	20%	0.196	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	150.2	168.9	-178.1	0	0	0	0	110.1	I46 L47 L48 D78 A81	I46-T76 PolarHBondContact O-N 2.9Å; L47-T76 CarbonylContact C-O 3.56Å; L47-T76 WeakPolarHBondContact CA-O 3.43Å; L47-T76 HydrophobicContact CB-CG2 4.22Å; L47-T76 HydrophobicContact CD1-CG2 4.06Å; L48-T76 PolarHBondContact N-O 2.89Å; T76-D78 PolarHBondContact OG1-N 3.05Å; T76-D78 VanDerWaalsContact OG1-N 3.08Å; T76-A81 HydrophobicContact CG2-CB 3.88Å
77	D	97	Very high	96.2	Very high	72 Å²	72	49.7 Å²	49.7	39%	0.385	29%	0.285	S	S	.	.			trans	-115.6	7.4	168.4	60.3	-14.5	0	0	0	111.6	W51 L59 R79	W51-D77 PolarHBondContact NE1-OD2 3.33Å; L59-D77 HydrophobicContact CD1-CB 3.92Å; D77-R79 PolarHBondContact O-N 2.87Å
78	D	96.9	Very high	96.4	Very high	86 Å²	86	45.7 Å²	45.7	46%	0.46	27%	0.266	S	S	.	.			trans	-77.1	108.5	171.7	-178.5	3.2	0	0	0	110.4	L47 T76 S80 A81	L47-D78 WeakPolarHBondContact CD1-O 3.3Å; T76-D78 PolarHBondContact OG1-N 3.05Å; T76-D78 VanDerWaalsContact OG1-N 3.08Å; D78-S80 PolarHBondContact O-N 3.39Å; D78-S80 VanDerWaalsContact O-N 3.09Å; D78-S80 VanDerWaalsContact OD1-CB 3.24Å; D78-S80 WeakPolarHBondContact OD1-CB 3.49Å; D78-S80 PolarHBondContact OD1-N 3.02Å; D78-S80 PolarHBondContact OD1-OG 3.35Å; D78-S80 VanDerWaalsContact OD1-OG 3.08Å; D78-S80 PolarHBondContact OD2-OG 2.93Å; D78-A81 VanDerWaalsContact O-CB 3.3Å; D78-A81 WeakPolarHBondContact O-CB 3.34Å; D78-A81 PolarHBondContact O-N 2.04Å
79	R	96	Very high	96.5	Very high	111 Å²	111	43.1 Å²	43.1	42%	0.419	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-60.4	-19.3	179.2	-66.4	-175.5	174.9	-174.5	-3.8	113.5	W49 D77 A81 Y82 S100	W49-R79 HydrophobicContact CE3-CG 4Å; W49-R79 HydrophobicContact CH2-CB 4.29Å; W49-R79 HydrophobicContact CH2-CG 4.14Å; W49-R79 HydrophobicContact CZ3-CB 3.97Å; W49-R79 HydrophobicContact CZ3-CG 3.78Å; W49-R79 PolarHBondContact O-NE 2.89Å; W49-R79 VanDerWaalsContact O-NE 3.11Å; W49-R79 PolarHBondContact O-NH2 2.85Å; D77-R79 PolarHBondContact O-N 2.87Å; R79-A81 PolarHBondContact O-N 2.97Å; R79-Y82 VanDerWaalsContact O-CB 3.24Å; R79-Y82 WeakPolarHBondContact O-CB 3.43Å; R79-Y82 PolarHBondContact O-N 3.08Å; R79-Y82 VanDerWaalsContact O-N 3.07Å; R79-S100 PolarHBondContact NH2-OG 3.32Å; R79-S100 VanDerWaalsContact NH2-OG 3.13Å
80	S	96.8	Very high	96.6	Very high	85 Å²	85	40.3 Å²	40.3	59%	0.594	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-61.2	-23.8	173.5	84.6	0	0	0	0	112.6	D78 Y82 P83	D78-S80 PolarHBondContact O-N 3.39Å; D78-S80 VanDerWaalsContact O-N 3.09Å; D78-S80 VanDerWaalsContact OD1-CB 3.24Å; D78-S80 WeakPolarHBondContact OD1-CB 3.49Å; D78-S80 PolarHBondContact OD1-N 3.02Å; D78-S80 PolarHBondContact OD1-OG 3.35Å; D78-S80 VanDerWaalsContact OD1-OG 3.08Å; D78-S80 PolarHBondContact OD2-OG 2.93Å; S80-Y82 PolarHBondContact O-N 3.03Å; S80-P83 WeakPolarHBondContact O-CD 3.37Å
81	A	97.1	Very high	96.7	Very high	16 Å²	16	39.5 Å²	39.5	13%	0.132	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-75.2	-6.3	176.5	0	0	0	0	0	113.7	T76 D78 R79 P83 T84 A85	T76-A81 HydrophobicContact CG2-CB 3.88Å; D78-A81 VanDerWaalsContact O-CB 3.3Å; D78-A81 WeakPolarHBondContact O-CB 3.34Å; D78-A81 PolarHBondContact O-N 2.04Å; R79-A81 PolarHBondContact O-N 2.97Å; A81-P83 VanDerWaalsContact C-CD 3.43Å; A81-T84 PolarHBondContact O-N 3.48Å; A81-T84 PolarHBondContact O-OG1 3.01Å; A81-A85 WeakPolarHBondContact O-CB 3.42Å; A81-A85 PolarHBondContact O-N 3.2Å
82	Y	98.1	Very high	96.9	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.016	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-43.1	-178.1	176.2	-93.4	0	0	0	114.5	L47 W49 R79 S80 T84 V88 P103 L106 R108 Q112 W114	L47-Y82 HydrophobicContact CD2-CD2 4.35Å; W49-Y82 HydrophobicContact CE3-CD2 4.45Å; W49-Y82 AromaticContact CZ3-CD2 3.95Å; W49-Y82 HydrophobicContact CZ3-CD2 3.95Å; W49-Y82 HydrophobicContact CZ3-CG 4.29Å; R79-Y82 VanDerWaalsContact O-CB 3.24Å; R79-Y82 WeakPolarHBondContact O-CB 3.43Å; R79-Y82 PolarHBondContact O-N 3.08Å; R79-Y82 VanDerWaalsContact O-N 3.07Å; S80-Y82 PolarHBondContact O-N 3.03Å; Y82-T84 PolarHBondContact O-N 2.8Å; Y82-V88 HydrophobicContact CD2-CG2 4.04Å; Y82-V88 HydrophobicContact CE2-CG2 4.19Å; Y82-P103 HydrophobicContact CD2-CG 4.1Å; Y82-P103 HydrophobicContact CE2-CB 4.49Å; Y82-P103 HydrophobicContact CE2-CG 3.63Å; Y82-L106 HydrophobicContact CD1-CB 3.92Å; Y82-L106 HydrophobicContact CD1-CD1 3.56Å; Y82-L106 HydrophobicContact CD1-CG 4.38Å; Y82-L106 HydrophobicContact CE1-CB 3.47Å; Y82-L106 VanDerWaalsContact CE1-CB 3.47Å; Y82-L106 HydrophobicContact CE1-CD1 3.97Å; Y82-L106 HydrophobicContact CE1-CG 4.37Å; Y82-L106 HydrophobicContact CG-CD1 4.09Å; Y82-R108 WeakPolarHBondContact OH-CA 3.3Å; Y82-R108 WeakPolarHBondContact OH-CB 3.45Å; Y82-Q112 VanDerWaalsContact CE2-OE1 3.3Å; Y82-Q112 PolarHBondContact O-NE2 3.35Å; Y82-W114 AromaticContact CE2-CZ2 3.77Å; Y82-W114 HydrophobicContact CE2-CZ2 3.77Å; Y82-W114 AromaticContact CE2-NE1 3.91Å; Y82-W114 AromaticContact CZ-CZ2 3.98Å; Y82-W114 WeakPolarHBondContact OH-CZ2 3.4Å
83	P	96.9	Very high	96.9	Very high	85 Å²	85	37 Å²	37	55%	0.552	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-18.7	-179.2	-20.3	34.4	0	0	0	114.4	S80 A81 P109	S80-P83 WeakPolarHBondContact O-CD 3.37Å; A81-P83 VanDerWaalsContact C-CD 3.43Å; P83-P109 WeakPolarHBondContact O-CG 3.5Å
84	T	95.9	Very high	96.8	Very high	107 Å²	107	37.2 Å²	37.2	66%	0.656	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.5	-12.4	-172.2	57.3	0	0	0	0	114	A81 Y82	A81-T84 PolarHBondContact O-N 3.48Å; A81-T84 PolarHBondContact O-OG1 3.01Å; Y82-T84 PolarHBondContact O-N 2.8Å
85	A	97.3	Very high	96.6	Very high	4 Å²	4	34.8 Å²	34.8	3%	0.033	19%	0.194	C	C	.	.			trans	-63.7	136.4	176.8	0	0	0	0	0	111.3	L47 A81 V88 Q112	L47-A85 HydrophobicContact CB-CB 3.78Å; A81-A85 WeakPolarHBondContact O-CB 3.42Å; A81-A85 PolarHBondContact O-N 3.2Å; A85-V88 HydrophobicContact CB-CG2 4.3Å; A85-Q112 WeakPolarHBondContact O-CG 3.27Å; A85-Q112 PolarHBondContact O-NE2 2.83Å
86	D	97.1	Very high	96.2	Very high	17 Å²	17	36 Å²	36	9%	0.091	20%	0.204	C	C	.	.	S	Bend	trans	-75	-36.2	175.4	-57.8	-77.4	0	0	0	110.9	R42 L44 S45 Q112 G113	R42-D86 IonicContact CZ-OD1 3.43Å; R42-D86 IonicContact NE-OD1 3.31Å; R42-D86 PolarHBondContact NE-OD1 2.67Å; R42-D86 IonicContact NH2-OD1 3.3Å; R42-D86 PolarHBondContact NH2-OD1 3.28Å; L44-D86 HydrophobicContact CD1-CB 3.42Å; L44-D86 VanDerWaalsContact CD1-CB 3.42Å; L44-D86 HydrophobicContact CG-CB 4.24Å; S45-D86 PolarHBondContact N-OD2 3.39Å; S45-D86 PolarHBondContact O-N 3.4Å; D86-Q112 CarbonylContact O-C 3.54Å; D86-Q112 WeakPolarHBondContact O-CA 3.08Å; D86-G113 PolarHBondContact O-N 2.82Å
87	V	98.2	Very high	95.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	136.3	179.3	-172.8	0	0	0	0	110.7	L44 S45 I46 L47 V89 G113 V115 W137 I322 Y326	L44-V87 HydrophobicContact CD1-CG2 4.42Å; L44-V87 HydrophobicContact CD2-CG2 4.32Å; S45-V87 PolarHBondContact O-N 3.38Å; S45-V87 VanDerWaalsContact O-N 3.13Å; I46-V87 WeakPolarHBondContact CA-O 3.49Å; I46-V87 HydrophobicContact CG1-CB 4.26Å; L47-V87 PolarHBondContact N-O 3.05Å; V87-V89 HydrophobicContact CG1-CG2 4.28Å; V87-G113 CarbonylContact C-O 3.59Å; V87-G113 VanDerWaalsContact CA-O 3.32Å; V87-G113 WeakPolarHBondContact CA-O 3.49Å; V87-V115 HydrophobicContact CG1-CG2 3.52Å; V87-W137 HydrophobicContact CG1-CZ3 4.31Å; V87-W137 HydrophobicContact CG2-CZ3 4.09Å; V87-I322 HydrophobicContact CG1-CG2 4.22Å; V87-I322 HydrophobicContact CG2-CG2 4.28Å; V87-Y326 HydrophobicContact CG2-CD2 3.7Å; V87-Y326 HydrophobicContact CG2-CE2 3.51Å
88	V	98.6	Very high	95	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	125.7	171.4	-168.8	0	0	0	0	109.6	L47 W49 Y82 A85 F90 Q112 G113 W114 V115	L47-V88 HydrophobicContact CB-CG1 4.39Å; L47-V88 HydrophobicContact CB-CG2 4.31Å; L47-V88 HydrophobicContact CD2-CG1 4.16Å; L47-V88 HydrophobicContact CD2-CG2 4.3Å; L47-V88 HydrophobicContact CG-CG1 4.18Å; L47-V88 CarbonylContact O-C 3.08Å; L47-V88 WeakPolarHBondContact O-CA 3.31Å; W49-V88 HydrophobicContact CB-CG1 4.15Å; W49-V88 HydrophobicContact CE3-CG1 4.27Å; Y82-V88 HydrophobicContact CD2-CG2 4.04Å; Y82-V88 HydrophobicContact CE2-CG2 4.19Å; A85-V88 HydrophobicContact CB-CG2 4.3Å; V88-F90 HydrophobicContact CB-CE2 3.71Å; V88-F90 HydrophobicContact CB-CZ 4.11Å; V88-F90 HydrophobicContact CG1-CD2 4.18Å; V88-F90 HydrophobicContact CG1-CE1 4.2Å; V88-F90 HydrophobicContact CG1-CE2 3.4Å; V88-F90 HydrophobicContact CG1-CZ 3.41Å; V88-F90 VanDerWaalsContact CG1-CZ 3.41Å; V88-Q112 HydrophobicContact CG2-CG 3.94Å; V88-G113 PolarHBondContact N-O 3.3Å; V88-W114 WeakPolarHBondContact O-CA 3.24Å; V88-V115 PolarHBondContact O-N 2.98Å
89	V	98.7	Very high	94.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	130.2	-175.6	-172	0	0	0	0	110.1	I46 L47 L48 W49 V87 V115 L117 L319 I322	I46-V89 HydrophobicContact CG2-CG2 3.73Å; L47-V89 PolarHBondContact O-N 3.41Å; L48-V89 HydrophobicContact CD1-CB 4.21Å; L48-V89 HydrophobicContact CD1-CG1 4.31Å; W49-V89 WeakPolarHBondContact CB-O 3.48Å; W49-V89 PolarHBondContact N-O 3.07Å; V87-V89 HydrophobicContact CG1-CG2 4.28Å; V89-V115 HydrophobicContact CB-CB 4.5Å; V89-V115 HydrophobicContact CG1-CB 4.34Å; V89-V115 HydrophobicContact CG1-CG1 4.28Å; V89-V115 HydrophobicContact CG2-CB 4.21Å; V89-L117 HydrophobicContact CG1-CB 3.82Å; V89-L117 HydrophobicContact CG1-CD2 3.89Å; V89-L117 HydrophobicContact CG1-CG 4.49Å; V89-L319 HydrophobicContact CB-CD2 4.14Å; V89-L319 HydrophobicContact CG1-CD2 3.89Å; V89-L319 HydrophobicContact CG2-CD2 4.02Å; V89-I322 HydrophobicContact CG2-CD1 3.39Å
90	F	97.8	Very high	93.7	Very high	2 Å²	2	33 Å²	33	1%	0.009	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	116.7	-179.4	-58.4	-98	0	0	0	110.1	W49 V88 L95 L102 P103 W114 V115 L117 F135	W49-F90 HydrophobicContact CB-CD1 3.57Å; W49-F90 HydrophobicContact CB-CE1 3.62Å; W49-F90 HydrophobicContact CB-CG 4.22Å; W49-F90 HydrophobicContact CB-CZ 4.32Å; W49-F90 AromaticContact CD1-CD1 3.44Å; W49-F90 VanDerWaalsContact CD1-CD1 3.44Å; W49-F90 AromaticContact CD1-CE1 3.38Å; W49-F90 AromaticContact CD2-CE1 3.81Å; W49-F90 HydrophobicContact CD2-CE1 3.81Å; W49-F90 HydrophobicContact CD2-CZ 4.49Å; W49-F90 AromaticContact CG-CD1 3.57Å; W49-F90 HydrophobicContact CG-CD1 3.57Å; W49-F90 AromaticContact CG-CE1 3.31Å; W49-F90 HydrophobicContact CG-CE1 3.31Å; W49-F90 HydrophobicContact CG-CZ 4.23Å; W49-F90 AromaticContact NE1-CE1 3.9Å; V88-F90 HydrophobicContact CB-CE2 3.71Å; V88-F90 HydrophobicContact CB-CZ 4.11Å; V88-F90 HydrophobicContact CG1-CD2 4.18Å; V88-F90 HydrophobicContact CG1-CE1 4.2Å; V88-F90 HydrophobicContact CG1-CE2 3.4Å; V88-F90 HydrophobicContact CG1-CZ 3.41Å; V88-F90 VanDerWaalsContact CG1-CZ 3.41Å; F90-L95 HydrophobicContact CB-CD1 4.03Å; F90-L95 HydrophobicContact CD1-CD2 4.34Å; F90-L102 HydrophobicContact CD1-CD2 3.6Å; F90-L102 HydrophobicContact CE1-CD2 3.69Å; F90-L102 HydrophobicContact CG-CD2 4.05Å; F90-L102 HydrophobicContact CZ-CD2 4.18Å; F90-P103 HydrophobicContact CE1-CG 4.36Å; F90-P103 HydrophobicContact CZ-CG 4.29Å; F90-W114 HydrophobicContact CD2-CD2 4.43Å; F90-W114 HydrophobicContact CD2-CE3 4.41Å; F90-W114 HydrophobicContact CE2-CB 4.2Å; F90-W114 AromaticContact CE2-CD2 3.43Å; F90-W114 HydrophobicContact CE2-CD2 3.43Å; F90-W114 VanDerWaalsContact CE2-CD2 3.43Å; F90-W114 AromaticContact CE2-CE2 3.77Å; F90-W114 AromaticContact CE2-CE3 3.67Å; F90-W114 HydrophobicContact CE2-CE3 3.67Å; F90-W114 AromaticContact CE2-CG 3.7Å; F90-W114 HydrophobicContact CE2-CG 3.7Å; F90-W114 HydrophobicContact CE2-CZ2 4.29Å; F90-W114 HydrophobicContact CE2-CZ3 4.21Å; F90-W114 AromaticContact CZ-CD2 3.81Å; F90-W114 HydrophobicContact CZ-CD2 3.81Å; F90-W114 AromaticContact CZ-CE2 3.74Å; F90-W114 AromaticContact CZ-CE3 3.91Å; F90-W114 HydrophobicContact CZ-CE3 3.91Å; F90-W114 HydrophobicContact CZ-CG 4.47Å; F90-W114 AromaticContact CZ-CH2 3.94Å; F90-W114 HydrophobicContact CZ-CH2 3.94Å; F90-W114 AromaticContact CZ-CZ2 3.8Å; F90-W114 HydrophobicContact CZ-CZ2 3.8Å; F90-W114 AromaticContact CZ-CZ3 3.99Å; F90-W114 HydrophobicContact CZ-CZ3 3.99Å; F90-V115 PolarHBondContact N-O 3.11Å; F90-L117 PolarHBondContact O-N 3.38Å; F90-F135 HydrophobicContact CB-CE1 3.81Å; F90-F135 HydrophobicContact CB-CZ 4.07Å; F90-F135 HydrophobicContact CD2-CD1 4.41Å; F90-F135 AromaticContact CD2-CE1 3.56Å; F90-F135 HydrophobicContact CD2-CE1 3.56Å; F90-F135 HydrophobicContact CD2-CZ 4.43Å; F90-F135 HydrophobicContact CE2-CE1 4.32Å; F90-F135 AromaticContact CG-CE1 3.86Å; F90-F135 HydrophobicContact CG-CE1 3.86Å; F90-F135 HydrophobicContact CG-CZ 4.33Å
91	H	96.9	Very high	93.3	Very high	3 Å²	3	32.4 Å²	32.4	1%	0.014	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.1	174.5	-171	-130.2	0	0	0	110.5	P52 F53 Q93 E94 L95 L117	P52-H91 WeakPolarHBondContact CA-ND1 3.37Å; P52-H91 WeakPolarHBondContact CB-ND1 3.44Å; P52-H91 HydrophobicContact CG-CB 4.06Å; F53-H91 AromaticContact CE2-CE1 3.78Å; F53-H91 AromaticContact CZ-CE1 3.69Å; H91-Q93 VanDerWaalsContact C-N 3.35Å; H91-Q93 PolarHBondContact O-N 2.82Å; H91-E94 WeakPolarHBondContact CB-OE2 3.08Å; H91-E94 IonicContact CE1-OE2 3.33Å; H91-E94 PolarHBondContact CE1-OE2 3.24Å; H91-E94 IonicContact CG-OE2 3.15Å; H91-E94 VanDerWaalsContact CG-OE2 3.25Å; H91-E94 VanDerWaalsContact ND1-CD 3.34Å; H91-E94 IonicContact ND1-OE1 2.73Å; H91-E94 IonicContact ND1-OE2 2.74Å; H91-E94 PolarHBondContact ND1-OE2 3.39Å; H91-E94 PolarHBondContact O-N 2.99Å; H91-L95 PolarHBondContact O-N 3.24Å; H91-L117 WeakPolarHBondContact CA-O 3.49Å; H91-L117 HydrophobicContact CB-CD2 4.45Å; H91-L117 PolarHBondContact CD2-O 2.89Å; H91-L117 VanDerWaalsContact CD2-O 3.28Å
92	H	95.6	Very high	93.2	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-61	-38.6	-171	-178.2	61.9	0	0	0	114	E94 L95 S96 W116 L117 N125 A126	H92-E94 PolarHBondContact O-N 3.46Å; H92-L95 PolarHBondContact O-N 3.31Å; H92-S96 PolarHBondContact CE1-OG 2.98Å; H92-S96 PolarHBondContact NE2-OG 2.8Å; H92-S96 WeakPolarHBondContact O-CB 3.2Å; H92-S96 PolarHBondContact O-N 3.4Å; H92-S96 PolarHBondContact O-OG 3.3Å; H92-W116 HydrophobicContact CB-CZ2 3.85Å; H92-W116 AromaticContact CG-CE2 3.85Å; H92-W116 AromaticContact CG-CZ2 3.67Å; H92-W116 AromaticContact CG-NE1 3.52Å; H92-W116 AromaticContact ND1-CE2 3.73Å; H92-W116 AromaticContact ND1-CZ2 3.81Å; H92-W116 AromaticContact ND1-NE1 3.05Å; H92-W116 PolarHBondContact ND1-NE1 2.92Å; H92-L117 PolarHBondContact N-O 3.31Å; H92-N125 PolarHBondContact CD2-OD1 3.47Å; H92-A126 PolarHBondContact CE1-O 3.03Å; H92-A126 PolarHBondContact NE2-O 2.89Å
93	Q	93.1	Very high	93.1	Very high	59 Å²	59	33.2 Å²	33.2	28%	0.276	22%	0.218	S	C	.	.	H	α-helix	trans	-62.8	-34.1	-173.8	-176.1	67.5	45	0	0	112.1	F53 H91 S96 N97	F53-Q93 HydrophobicContact CD1-CG 4.29Å; F53-Q93 HydrophobicContact CE1-CB 4.3Å; F53-Q93 HydrophobicContact CE1-CG 3.95Å; H91-Q93 VanDerWaalsContact C-N 3.35Å; H91-Q93 PolarHBondContact O-N 2.82Å; Q93-S96 PolarHBondContact O-N 3.13Å; Q93-N97 WeakPolarHBondContact O-CB 3.4Å; Q93-N97 PolarHBondContact O-N 2.94Å; Q93-N97 PolarHBondContact O-OD1 3.12Å; Q93-N97 VanDerWaalsContact O-OD1 3.12Å
94	E	93.1	Very high	92.9	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.019	22%	0.224	C	C	.	.	H	α-helix	trans	-80.7	-33.5	-175.3	-75.2	58.5	-157.7	0	0	110.5	H50 P52 F53 H91 H92 N97 A99 S100	H50-E94 HydrophobicContact CB-CB 4.36Å; H50-E94 HydrophobicContact CB-CG 4.26Å; H50-E94 WeakPolarHBondContact ND1-CG 2.97Å; P52-E94 WeakPolarHBondContact CA-OE1 3.47Å; F53-E94 PolarHBondContact N-OE1 3.4Å; H91-E94 WeakPolarHBondContact CB-OE2 3.08Å; H91-E94 IonicContact CE1-OE2 3.33Å; H91-E94 PolarHBondContact CE1-OE2 3.24Å; H91-E94 IonicContact CG-OE2 3.15Å; H91-E94 VanDerWaalsContact CG-OE2 3.25Å; H91-E94 VanDerWaalsContact ND1-CD 3.34Å; H91-E94 IonicContact ND1-OE1 2.73Å; H91-E94 IonicContact ND1-OE2 2.74Å; H91-E94 PolarHBondContact ND1-OE2 3.39Å; H91-E94 PolarHBondContact O-N 2.99Å; H92-E94 PolarHBondContact O-N 3.46Å; E94-N97 VanDerWaalsContact C-OD1 3.3Å; E94-N97 WeakPolarHBondContact CA-OD1 3.26Å; E94-N97 PolarHBondContact O-OD1 3.31Å; E94-A99 PolarHBondContact O-N 3.42Å; E94-A99 VanDerWaalsContact O-N 3.13Å; E94-S100 PolarHBondContact O-N 2.93Å
95	L	92.4	Very high	92.7	Very high	27 Å²	27	37.9 Å²	37.9	14%	0.141	23%	0.226	C	C	.	.	H	α-helix	trans	-66.5	-45.1	167.9	-59	-178.3	0	0	0	110	F90 H91 H92 N97 A98 L102 L131 F135	F90-L95 HydrophobicContact CB-CD1 4.03Å; F90-L95 HydrophobicContact CD1-CD2 4.34Å; H91-L95 PolarHBondContact O-N 3.24Å; H92-L95 PolarHBondContact O-N 3.31Å; L95-N97 PolarHBondContact O-N 3.03Å; L95-A98 PolarHBondContact O-N 2.85Å; L95-L102 HydrophobicContact CD1-CD2 4.19Å; L95-L102 HydrophobicContact CD2-CD2 4.1Å; L95-L102 HydrophobicContact CD2-CG 4.25Å; L95-L131 HydrophobicContact CD1-CD1 4.2Å; L95-L131 HydrophobicContact CD1-CD2 4.43Å; L95-F135 HydrophobicContact CD1-CE2 4.47Å; L95-F135 HydrophobicContact CD1-CZ 3.86Å
96	S	89.6	Confident	92.5	Very high	40 Å²	40	40.7 Å²	40.7	28%	0.28	24%	0.241	S	C	.	.	H	α-helix	trans	-69.3	-34	-174	-62.3	0	0	0	0	113.9	H92 Q93 A98 A126	H92-S96 PolarHBondContact CE1-OG 2.98Å; H92-S96 PolarHBondContact NE2-OG 2.8Å; H92-S96 WeakPolarHBondContact O-CB 3.2Å; H92-S96 PolarHBondContact O-N 3.4Å; H92-S96 PolarHBondContact O-OG 3.3Å; Q93-S96 PolarHBondContact O-N 3.13Å; S96-A98 VanDerWaalsContact C-N 3.32Å; S96-A126 PolarHBondContact OG-O 3.01Å
97	N	86.7	Confident	92.4	Very high	88 Å²	88	45.3 Å²	45.3	47%	0.471	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	8.4	178.4	70.2	1.5	0	0	0	113.1	Q93 E94 L95 A99	Q93-N97 WeakPolarHBondContact O-CB 3.4Å; Q93-N97 PolarHBondContact O-N 2.94Å; Q93-N97 PolarHBondContact O-OD1 3.12Å; Q93-N97 VanDerWaalsContact O-OD1 3.12Å; E94-N97 VanDerWaalsContact C-OD1 3.3Å; E94-N97 WeakPolarHBondContact CA-OD1 3.26Å; E94-N97 PolarHBondContact O-OD1 3.31Å; L95-N97 PolarHBondContact O-N 3.03Å; N97-A99 PolarHBondContact O-N 3.23Å; N97-A99 VanDerWaalsContact O-N 3.08Å; N97-A99 WeakPolarHBondContact OD1-CB 3.49Å; N97-A99 PolarHBondContact OD1-N 2.94Å
98	A	83.3	Confident	92.2	Very high	87 Å²	87	49.6 Å²	49.6	72%	0.719	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	18.9	-175.8	0	0	0	0	0	114.8	L95 S96 S100	L95-A98 PolarHBondContact O-N 2.85Å; S96-A98 VanDerWaalsContact C-N 3.32Å; A98-S100 PolarHBondContact O-N 2.89Å
99	A	80.1	Confident	92	Very high	56 Å²	56	51.6 Å²	51.6	46%	0.463	30%	0.301	S	S	.	.	S	Bend	trans	-67.8	-22.7	168.9	0	0	0	0	0	111.2	E94 N97	E94-A99 PolarHBondContact O-N 3.42Å; E94-A99 VanDerWaalsContact O-N 3.13Å; N97-A99 PolarHBondContact O-N 3.23Å; N97-A99 VanDerWaalsContact O-N 3.08Å; N97-A99 WeakPolarHBondContact OD1-CB 3.49Å; N97-A99 PolarHBondContact OD1-N 2.94Å
100	S	83.8	Confident	91.6	Very high	8 Å²	8	58 Å²	58	6%	0.056	35%	0.346	C	S	.	.	S	Bend	trans	-140.9	145.4	171.8	-161.4	0	0	0	0	110.8	W49 R79 E94 A98	W49-S100 PolarHBondContact NE1-OG 3.38Å; R79-S100 PolarHBondContact NH2-OG 3.32Å; R79-S100 VanDerWaalsContact NH2-OG 3.13Å; E94-S100 PolarHBondContact O-N 2.93Å; A98-S100 PolarHBondContact O-N 2.89Å
101	A	89.9	Confident	91.3	Very high	73 Å²	73	61.8 Å²	61.8	60%	0.603	38%	0.377	S	S	*	.			trans	-112.5	152.6	172	0	0	0	0	0	110.1	W49	W49-A101 PolarHBondContact NE1-O 2.96Å
102	L	94.4	Very high	91.3	Very high	35 Å²	35	61.9 Å²	61.9	18%	0.183	38%	0.377	C	S	.	.			trans	-63.6	138.5	169.6	-67.1	169.6	0	0	0	109.6	F90 L95 M104 W114 L131 V134 F135	F90-L102 HydrophobicContact CD1-CD2 3.6Å; F90-L102 HydrophobicContact CE1-CD2 3.69Å; F90-L102 HydrophobicContact CG-CD2 4.05Å; F90-L102 HydrophobicContact CZ-CD2 4.18Å; L95-L102 HydrophobicContact CD1-CD2 4.19Å; L95-L102 HydrophobicContact CD2-CD2 4.1Å; L95-L102 HydrophobicContact CD2-CG 4.25Å; L102-M104 HydrophobicContact CB-CG 3.85Å; L102-M104 HydrophobicContact CB-SD 3.96Å; L102-M104 HydrophobicContact CD1-SD 4.35Å; L102-M104 PolarHBondContact O-N 3.12Å; L102-W114 HydrophobicContact CB-CH2 4.42Å; L102-W114 HydrophobicContact CB-CZ3 4.26Å; L102-W114 HydrophobicContact CD1-CZ3 4.48Å; L102-W114 HydrophobicContact CD2-CE3 4.23Å; L102-W114 HydrophobicContact CD2-CH2 4.35Å; L102-W114 HydrophobicContact CD2-CZ3 3.63Å; L102-W114 HydrophobicContact CG-CZ3 4.33Å; L102-L131 HydrophobicContact CD1-CD2 4.08Å; L102-V134 HydrophobicContact CD1-CG1 3.79Å; L102-F135 HydrophobicContact CD2-CE1 4.35Å; L102-F135 HydrophobicContact CD2-CZ 3.87Å
103	P	95.3	Very high	91.3	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.006	38%	0.378	C	S	.	.			trans	-77.2	54.5	178.8	31.3	-34.9	0	0	0	112.3	W49 Y82 F90 H105 L106 W114	W49-P103 HydrophobicContact CD2-CG 4.45Å; W49-P103 HydrophobicContact CE3-CG 4.44Å; W49-P103 HydrophobicContact CH2-CB 3.54Å; W49-P103 HydrophobicContact CH2-CG 3.71Å; W49-P103 HydrophobicContact CZ2-CB 3.55Å; W49-P103 HydrophobicContact CZ2-CG 3.7Å; W49-P103 HydrophobicContact CZ3-CB 4.35Å; W49-P103 HydrophobicContact CZ3-CG 4.09Å; Y82-P103 HydrophobicContact CD2-CG 4.1Å; Y82-P103 HydrophobicContact CE2-CB 4.49Å; Y82-P103 HydrophobicContact CE2-CG 3.63Å; F90-P103 HydrophobicContact CE1-CG 4.36Å; F90-P103 HydrophobicContact CZ-CG 4.29Å; P103-H105 PolarHBondContact O-N 2.88Å; P103-L106 HydrophobicContact CB-CB 4.39Å; P103-L106 HydrophobicContact CB-CD1 3.92Å; P103-L106 HydrophobicContact CB-CG 4.18Å; P103-L106 PolarHBondContact O-N 2.73Å; P103-W114 HydrophobicContact CG-CH2 3.92Å; P103-W114 HydrophobicContact CG-CZ2 3.82Å
104	M	92.4	Very high	91.6	Very high	136 Å²	136	59.4 Å²	59.4	67%	0.67	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-15.1	-177.5	-59.5	-56	-68.3	0	0	113.5	L102 W114	L102-M104 HydrophobicContact CB-CG 3.85Å; L102-M104 HydrophobicContact CB-SD 3.96Å; L102-M104 HydrophobicContact CD1-SD 4.35Å; L102-M104 PolarHBondContact O-N 3.12Å; M104-W114 HydrophobicContact SD-CH2 4.18Å; M104-W114 HydrophobicContact SD-CZ3 4.24Å
105	H	92.6	Very high	91.8	Very high	155 Å²	155	59.2 Å²	59.2	72%	0.718	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-14.6	175.2	64.7	-82.8	0	0	0	113.1	P103	P103-H105 PolarHBondContact O-N 2.88Å
106	L	93.9	Very high	92.1	Very high	63 Å²	63	58 Å²	58	33%	0.33	36%	0.359	S	S	.	.	S	Bend	trans	-95.6	143.4	177.9	-59.4	-179.5	0	0	0	110	Y82 P103 R108	Y82-L106 HydrophobicContact CD1-CB 3.92Å; Y82-L106 HydrophobicContact CD1-CD1 3.56Å; Y82-L106 HydrophobicContact CD1-CG 4.38Å; Y82-L106 HydrophobicContact CE1-CB 3.47Å; Y82-L106 VanDerWaalsContact CE1-CB 3.47Å; Y82-L106 HydrophobicContact CE1-CD1 3.97Å; Y82-L106 HydrophobicContact CE1-CG 4.37Å; Y82-L106 HydrophobicContact CG-CD1 4.09Å; P103-L106 HydrophobicContact CB-CB 4.39Å; P103-L106 HydrophobicContact CB-CD1 3.92Å; P103-L106 HydrophobicContact CB-CG 4.18Å; P103-L106 PolarHBondContact O-N 2.73Å; L106-R108 PolarHBondContact O-N 3.22Å
107	P	94.2	Very high	92.5	Very high	113 Å²	113	56.1 Å²	56.1	73%	0.734	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-67.6	124.4	174.2	28.2	-32.9	0	0	0	109.5	P109	P107-P109 WeakPolarHBondContact O-CD 3.35Å
108	R	93.9	Very high	93	Very high	90 Å²	90	52 Å²	52	34%	0.34	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-82.4	120.2	176.1	-177.3	176.9	165	-172.2	-12.7	110.4	Y82 L106 Q112 V134 N136	Y82-R108 WeakPolarHBondContact OH-CA 3.3Å; Y82-R108 WeakPolarHBondContact OH-CB 3.45Å; L106-R108 PolarHBondContact O-N 3.22Å; R108-Q112 PolarHBondContact NE-O 3.18Å; R108-Q112 PolarHBondContact NH2-O 2.65Å; R108-V134 PolarHBondContact NH1-O 2.87Å; R108-N136 PolarHBondContact NH2-OD1 3.09Å
109	P	94.4	Very high	93.6	Very high	43 Å²	43	48.1 Å²	48.1	28%	0.279	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-58.4	139.5	174.7	-22.1	32.5	0	0	0	111.4	P83 P107 A111 Q112	P83-P109 WeakPolarHBondContact O-CG 3.5Å; P107-P109 WeakPolarHBondContact O-CD 3.35Å; P109-A111 VanDerWaalsContact C-N 3.26Å; P109-A111 PolarHBondContact O-N 2.73Å; P109-Q112 HydrophobicContact CB-CB 3.93Å; P109-Q112 HydrophobicContact CG-CB 4.19Å; P109-Q112 WeakPolarHBondContact O-CB 3.45Å; P109-Q112 PolarHBondContact O-N 2.9Å
110	S	90.4	Very high	94.3	Very high	135 Å²	135	47.4 Å²	47.4	94%	0.944	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-30.7	-173.8	56.9	0	0	0	0	113.9
111	A	91.8	Very high	94.7	Very high	81 Å²	81	47 Å²	47	67%	0.669	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-9.3	177.1	0	0	0	0	0	113.6	P109 G113	P109-A111 VanDerWaalsContact C-N 3.26Å; P109-A111 PolarHBondContact O-N 2.73Å; A111-G113 PolarHBondContact O-N 2.93Å
112	Q	95.6	Very high	94.9	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.019	25%	0.254	C	S	.	.			trans	-76.5	124.3	-178.9	177.8	178.9	94.7	0	0	110.5	Y82 A85 D86 V88 R108 P109	Y82-Q112 VanDerWaalsContact CE2-OE1 3.3Å; Y82-Q112 PolarHBondContact O-NE2 3.35Å; A85-Q112 WeakPolarHBondContact O-CG 3.27Å; A85-Q112 PolarHBondContact O-NE2 2.83Å; D86-Q112 CarbonylContact O-C 3.54Å; D86-Q112 WeakPolarHBondContact O-CA 3.08Å; V88-Q112 HydrophobicContact CG2-CG 3.94Å; R108-Q112 PolarHBondContact NE-O 3.18Å; R108-Q112 PolarHBondContact NH2-O 2.65Å; P109-Q112 HydrophobicContact CB-CB 3.93Å; P109-Q112 HydrophobicContact CG-CB 4.19Å; P109-Q112 WeakPolarHBondContact O-CB 3.45Å; P109-Q112 PolarHBondContact O-N 2.9Å
113	G	97.2	Very high	94.6	Very high	2 Å²	2	47.8 Å²	47.8	2%	0.021	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	136.8	175.4	0	0	0	0	0	112.8	D86 V87 V88 A111 W137	D86-G113 PolarHBondContact O-N 2.82Å; V87-G113 CarbonylContact C-O 3.59Å; V87-G113 VanDerWaalsContact CA-O 3.32Å; V87-G113 WeakPolarHBondContact CA-O 3.49Å; V88-G113 PolarHBondContact N-O 3.3Å; A111-G113 PolarHBondContact O-N 2.93Å; G113-W137 VanDerWaalsContact CA-CZ3 3.46Å
114	W	98.1	Very high	94.3	Very high	6 Å²	6	50.6 Å²	50.6	2%	0.023	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	128	174.5	-78.9	20.7	0	0	0	110.3	Y82 V88 F90 L102 P103 M104 V134 F135 N136 W137	Y82-W114 AromaticContact CE2-CZ2 3.77Å; Y82-W114 HydrophobicContact CE2-CZ2 3.77Å; Y82-W114 AromaticContact CE2-NE1 3.91Å; Y82-W114 AromaticContact CZ-CZ2 3.98Å; Y82-W114 WeakPolarHBondContact OH-CZ2 3.4Å; V88-W114 WeakPolarHBondContact O-CA 3.24Å; F90-W114 HydrophobicContact CD2-CD2 4.43Å; F90-W114 HydrophobicContact CD2-CE3 4.41Å; F90-W114 HydrophobicContact CE2-CB 4.2Å; F90-W114 AromaticContact CE2-CD2 3.43Å; F90-W114 HydrophobicContact CE2-CD2 3.43Å; F90-W114 VanDerWaalsContact CE2-CD2 3.43Å; F90-W114 AromaticContact CE2-CE2 3.77Å; F90-W114 AromaticContact CE2-CE3 3.67Å; F90-W114 HydrophobicContact CE2-CE3 3.67Å; F90-W114 AromaticContact CE2-CG 3.7Å; F90-W114 HydrophobicContact CE2-CG 3.7Å; F90-W114 HydrophobicContact CE2-CZ2 4.29Å; F90-W114 HydrophobicContact CE2-CZ3 4.21Å; F90-W114 AromaticContact CZ-CD2 3.81Å; F90-W114 HydrophobicContact CZ-CD2 3.81Å; F90-W114 AromaticContact CZ-CE2 3.74Å; F90-W114 AromaticContact CZ-CE3 3.91Å; F90-W114 HydrophobicContact CZ-CE3 3.91Å; F90-W114 HydrophobicContact CZ-CG 4.47Å; F90-W114 AromaticContact CZ-CH2 3.94Å; F90-W114 HydrophobicContact CZ-CH2 3.94Å; F90-W114 AromaticContact CZ-CZ2 3.8Å; F90-W114 HydrophobicContact CZ-CZ2 3.8Å; F90-W114 AromaticContact CZ-CZ3 3.99Å; F90-W114 HydrophobicContact CZ-CZ3 3.99Å; L102-W114 HydrophobicContact CB-CH2 4.42Å; L102-W114 HydrophobicContact CB-CZ3 4.26Å; L102-W114 HydrophobicContact CD1-CZ3 4.48Å; L102-W114 HydrophobicContact CD2-CE3 4.23Å; L102-W114 HydrophobicContact CD2-CH2 4.35Å; L102-W114 HydrophobicContact CD2-CZ3 3.63Å; L102-W114 HydrophobicContact CG-CZ3 4.33Å; P103-W114 HydrophobicContact CG-CH2 3.92Å; P103-W114 HydrophobicContact CG-CZ2 3.82Å; M104-W114 HydrophobicContact SD-CH2 4.18Å; M104-W114 HydrophobicContact SD-CZ3 4.24Å; W114-V134 HydrophobicContact CE3-CG1 3.8Å; W114-V134 HydrophobicContact CZ3-CG1 3.84Å; W114-F135 HydrophobicContact CB-CD1 3.97Å; W114-F135 HydrophobicContact CE3-CE1 4.32Å; W114-N136 PolarHBondContact N-OD1 3.44Å; W114-N136 PolarHBondContact O-N 3.3Å; W114-W137 PolarHBondContact O-N 3.43Å
115	V	98.7	Very high	94	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	123.5	180	178.4	0	0	0	0	109.7	V87 V88 V89 F90 W137 M139	V87-V115 HydrophobicContact CG1-CG2 3.52Å; V88-V115 PolarHBondContact O-N 2.98Å; V89-V115 HydrophobicContact CB-CB 4.5Å; V89-V115 HydrophobicContact CG1-CB 4.34Å; V89-V115 HydrophobicContact CG1-CG1 4.28Å; V89-V115 HydrophobicContact CG2-CB 4.21Å; F90-V115 PolarHBondContact N-O 3.11Å; V115-W137 WeakPolarHBondContact CA-O 3.49Å; V115-W137 HydrophobicContact CG2-CB 4.24Å; V115-W137 HydrophobicContact CG2-CE3 3.77Å; V115-M139 HydrophobicContact CG1-CB 3.49Å; V115-M139 VanDerWaalsContact CG1-CB 3.49Å
116	W	98.1	Very high	93.5	Very high	2 Å²	2	40 Å²	40	1%	0.008	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	120.1	165	-179.2	82.9	0	0	0	109.3	H92 V128 F135 W137 T138 M139 L338 W341 V342	H92-W116 HydrophobicContact CB-CZ2 3.85Å; H92-W116 AromaticContact CG-CE2 3.85Å; H92-W116 AromaticContact CG-CZ2 3.67Å; H92-W116 AromaticContact CG-NE1 3.52Å; H92-W116 AromaticContact ND1-CE2 3.73Å; H92-W116 AromaticContact ND1-CZ2 3.81Å; H92-W116 AromaticContact ND1-NE1 3.05Å; H92-W116 PolarHBondContact ND1-NE1 2.92Å; W116-V128 HydrophobicContact CZ2-CG2 4.34Å; W116-F135 HydrophobicContact CB-CB 4Å; W116-F135 HydrophobicContact CB-CD1 3.81Å; W116-F135 HydrophobicContact CB-CD2 3.79Å; W116-F135 HydrophobicContact CB-CE1 4.21Å; W116-F135 HydrophobicContact CB-CE2 4.17Å; W116-F135 HydrophobicContact CB-CG 3.59Å; W116-F135 HydrophobicContact CB-CZ 4.38Å; W116-F135 AromaticContact CD1-CE2 3.73Å; W116-F135 HydrophobicContact CG-CD2 4.24Å; W116-F135 HydrophobicContact CG-CE2 4.33Å; W116-W137 PolarHBondContact N-O 3.31Å; W116-T138 HydrophobicContact CE3-CG2 4.2Å; W116-T138 CarbonylContact O-C 3.53Å; W116-T138 WeakPolarHBondContact O-CA 3.15Å; W116-M139 PolarHBondContact O-N 3.31Å; W116-L338 HydrophobicContact CB-CD2 4.25Å; W116-L338 HydrophobicContact CD2-CD1 4.43Å; W116-L338 HydrophobicContact CD2-CD2 4.14Å; W116-L338 HydrophobicContact CE3-CD1 4.36Å; W116-L338 HydrophobicContact CG-CD2 3.86Å; W116-W341 HydrophobicContact CE3-CZ3 4.41Å; W116-W341 AromaticContact CZ3-CZ3 3.87Å; W116-W341 HydrophobicContact CZ3-CZ3 3.87Å; W116-V342 HydrophobicContact CH2-CG2 3.48Å; W116-V342 VanDerWaalsContact CH2-CG2 3.48Å; W116-V342 HydrophobicContact CZ2-CG2 4.07Å; W116-V342 HydrophobicContact CZ3-CG2 3.89Å
117	L	97.9	Very high	92.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	121.8	-179.9	171	61	0	0	0	110.1	V89 F90 H91 H92 M139 W315	V89-L117 HydrophobicContact CG1-CB 3.82Å; V89-L117 HydrophobicContact CG1-CD2 3.89Å; V89-L117 HydrophobicContact CG1-CG 4.49Å; F90-L117 PolarHBondContact O-N 3.38Å; H91-L117 WeakPolarHBondContact CA-O 3.49Å; H91-L117 HydrophobicContact CB-CD2 4.45Å; H91-L117 PolarHBondContact CD2-O 2.89Å; H91-L117 VanDerWaalsContact CD2-O 3.28Å; H92-L117 PolarHBondContact N-O 3.31Å; L117-M139 WeakPolarHBondContact CA-O 3.17Å; L117-M139 HydrophobicContact CB-CB 4.43Å; L117-M139 HydrophobicContact CD1-CB 3.93Å; L117-M139 HydrophobicContact CD1-CE 4.17Å; L117-M139 HydrophobicContact CD1-CG 3.66Å; L117-M139 WeakPolarHBondContact CD1-O 3.49Å; L117-M139 HydrophobicContact CD1-SD 3.81Å; L117-W315 HydrophobicContact CD1-CZ3 4.31Å; L117-W315 HydrophobicContact CD2-CE3 4.42Å; L117-W315 HydrophobicContact CD2-CZ3 3.94Å; L117-W315 HydrophobicContact CG-CZ3 4.46Å
118	S	96.6	Very high	92.8	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.014	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	132.2	164.7	-173	0	0	0	0	111.8	E120 N125 M139 S140	S118-E120 PolarHBondContact OG-N 3.12Å; S118-E120 VanDerWaalsContact OG-N 3.17Å; S118-N125 PolarHBondContact OG-OD1 2.95Å; S118-M139 PolarHBondContact N-O 3.41Å; S118-S140 VanDerWaalsContact O-CA 3.3Å; S118-S140 WeakPolarHBondContact O-CA 3.44Å; S118-S140 VanDerWaalsContact O-CB 3.3Å; S118-S140 WeakPolarHBondContact O-CB 3.39Å; S118-S140 PolarHBondContact O-OG 2.98Å
119	M	96	Very high	92.8	Very high	6 Å²	6	39.5 Å²	39.5	3%	0.03	24%	0.239	C	C	.	.			trans	-100.1	0.7	171.9	-65.5	-57.9	-53	0	0	112.3	Y141 T149 Y151 W315 R318	M119-Y141 WeakPolarHBondContact O-CD1 3.39Å; M119-T149 WeakPolarHBondContact CE-O 3.46Å; M119-Y151 HydrophobicContact CB-CE2 4.36Å; M119-Y151 HydrophobicContact CE-CD2 3.55Å; M119-Y151 HydrophobicContact CE-CE2 3.31Å; M119-Y151 HydrophobicContact CE-CG 4.28Å; M119-Y151 PolarHBondContact O-OH 3.04Å; M119-W315 HydrophobicContact CB-CH2 4.43Å; M119-W315 HydrophobicContact CG-CH2 3.7Å; M119-W315 HydrophobicContact CG-CZ3 4.07Å; M119-R318 PolarHBondContact SD-NH1 3.08Å
120	E	94.4	Very high	92.7	Very high	41 Å²	41	45 Å²	45	19%	0.192	26%	0.26	C	S	.	.	S	Bend	trans	-94.4	148.2	-178.7	-72.1	-69.6	161.7	0	0	111.5	S118 N124 N125	S118-E120 PolarHBondContact OG-N 3.12Å; S118-E120 VanDerWaalsContact OG-N 3.17Å; E120-N124 HydrophobicContact CB-CB 3.98Å; E120-N124 HydrophobicContact CG-CB 4.45Å; E120-N124 PolarHBondContact OE2-ND2 3.13Å; E120-N125 PolarHBondContact O-ND2 3Å
121	P	93.5	Very high	92.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.22	C	C	.	.			trans	-71.5	163.5	176.3	31.6	-32.6	0	0	0	111.7	V123 N124 N125 Y141 N230 S231 A233 Y236	P121-V123 VanDerWaalsContact C-N 3.27Å; P121-V123 HydrophobicContact CG-CG2 4.26Å; P121-V123 PolarHBondContact O-N 3Å; P121-V123 VanDerWaalsContact O-N 3.12Å; P121-N124 PolarHBondContact O-N 3.07Å; P121-N125 PolarHBondContact O-N 3.01Å; P121-N125 PolarHBondContact O-ND2 2.99Å; P121-Y141 WeakPolarHBondContact CA-OH 3.32Å; P121-N230 VanDerWaalsContact CG-OD1 3.31Å; P121-N230 WeakPolarHBondContact CG-OD1 3.3Å; P121-S231 VanDerWaalsContact CB-OG 3.25Å; P121-S231 WeakPolarHBondContact CB-OG 3.31Å; P121-S231 WeakPolarHBondContact CG-OG 3.42Å; P121-A233 HydrophobicContact CB-CB 3.9Å; P121-Y236 HydrophobicContact CB-CD1 4.1Å; P121-Y236 HydrophobicContact CB-CD2 4.28Å; P121-Y236 HydrophobicContact CB-CE1 4.3Å; P121-Y236 HydrophobicContact CB-CE2 4.46Å; P121-Y236 HydrophobicContact CB-CG 4.09Å; P121-Y236 HydrophobicContact CG-CD1 4.14Å; P121-Y236 HydrophobicContact CG-CE1 3.84Å; P121-Y236 HydrophobicContact CG-CE2 4.28Å; P121-Y236 HydrophobicContact CG-CG 4.49Å
122	P	92.7	Very high	93.1	Very high	24 Å²	24	37.8 Å²	37.8	16%	0.156	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-53.4	-41.5	-170.3	-30	38.9	0	0	0	113.8	N124 N125 V342 N343	P122-N124 PolarHBondContact O-N 3.47Å; P122-N125 PolarHBondContact O-N 3.23Å; P122-V342 HydrophobicContact CB-CG1 3.91Å; P122-V342 HydrophobicContact CG-CG1 4.06Å; P122-V342 WeakPolarHBondContact CG-O 3.32Å; P122-N343 WeakPolarHBondContact CB-OD1 3.39Å
123	V	89.8	Confident	93.2	Very high	100 Å²	100	39.2 Å²	39.2	61%	0.606	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-59.9	-17.7	179.2	-59.8	0	0	0	0	114.6	P121 S231	P121-V123 VanDerWaalsContact C-N 3.27Å; P121-V123 HydrophobicContact CG-CG2 4.26Å; P121-V123 PolarHBondContact O-N 3Å; P121-V123 VanDerWaalsContact O-N 3.12Å; V123-S231 WeakPolarHBondContact CG2-OG 3.41Å
124	N	88.8	Confident	93.1	Very high	59 Å²	59	40.4 Å²	40.4	32%	0.316	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-104.9	-9.2	177.6	-68.5	-12.1	0	0	0	112.8	E120 P121 P122 A126 N230	E120-N124 HydrophobicContact CB-CB 3.98Å; E120-N124 HydrophobicContact CG-CB 4.45Å; E120-N124 PolarHBondContact OE2-ND2 3.13Å; P121-N124 PolarHBondContact O-N 3.07Å; P122-N124 PolarHBondContact O-N 3.47Å; N124-A126 PolarHBondContact O-N 3.14Å; N124-N230 PolarHBondContact ND2-ND2 3.14Å
125	N	84.7	Confident	93.1	Very high	16 Å²	16	40.1 Å²	40.1	9%	0.086	22%	0.221	C	C	.	.			trans	-89.2	88.8	175.3	-67.1	-43.2	0	0	0	109.5	H92 S118 E120 P121 P122 V128 V342	H92-N125 PolarHBondContact CD2-OD1 3.47Å; S118-N125 PolarHBondContact OG-OD1 2.95Å; E120-N125 PolarHBondContact O-ND2 3Å; P121-N125 PolarHBondContact O-N 3.01Å; P121-N125 PolarHBondContact O-ND2 2.99Å; P122-N125 PolarHBondContact O-N 3.23Å; N125-V128 HydrophobicContact CB-CG2 3.68Å; N125-V342 HydrophobicContact CB-CG1 4.43Å
126	A	82.2	Confident	93.1	Very high	52 Å²	52	40.7 Å²	40.7	43%	0.43	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	146.4	175.5	0	0	0	0	0	111.7	H92 S96 N124 V128	H92-A126 PolarHBondContact CE1-O 3.03Å; H92-A126 PolarHBondContact NE2-O 2.89Å; S96-A126 PolarHBondContact OG-O 3.01Å; N124-A126 PolarHBondContact O-N 3.14Å; A126-V128 VanDerWaalsContact C-N 3.35Å; A126-V128 PolarHBondContact O-N 2.92Å
127	N	81.6	Confident	93.1	Very high	104 Å²	104	41 Å²	41	56%	0.556	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	30	166.1	-58.9	-28.4	0	0	0	117.1	K129 Q130	N127-K129 VanDerWaalsContact C-N 3.28Å; N127-K129 PolarHBondContact O-N 2.69Å; N127-Q130 PolarHBondContact O-N 2.9Å
128	V	91.9	Very high	93.1	Very high	2 Å²	2	41 Å²	41	1%	0.012	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-61.6	-34.7	179.4	-177.4	0	0	0	0	112.5	W116 N125 A126 Q130 L131 L338 D339 V342	W116-V128 HydrophobicContact CZ2-CG2 4.34Å; N125-V128 HydrophobicContact CB-CG2 3.68Å; A126-V128 VanDerWaalsContact C-N 3.35Å; A126-V128 PolarHBondContact O-N 2.92Å; V128-Q130 PolarHBondContact O-N 3.25Å; V128-Q130 VanDerWaalsContact O-N 3.07Å; V128-L131 WeakPolarHBondContact O-CA 3.39Å; V128-L131 VanDerWaalsContact O-CB 3.25Å; V128-L131 WeakPolarHBondContact O-CB 3.47Å; V128-L131 PolarHBondContact O-N 3.2Å; V128-L338 HydrophobicContact CG1-CB 4.3Å; V128-L338 HydrophobicContact CG1-CD2 3.99Å; V128-L338 HydrophobicContact CG1-CG 3.72Å; V128-D339 HydrophobicContact CB-CB 4.48Å; V128-D339 HydrophobicContact CG1-CB 4.33Å; V128-V342 HydrophobicContact CG1-CB 4.42Å; V128-V342 HydrophobicContact CG1-CG2 3.93Å; V128-V342 HydrophobicContact CG2-CG1 4.47Å
129	K	93.8	Very high	93.2	Very high	150 Å²	150	41 Å²	41	65%	0.652	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-51.8	-32.4	178.8	-170.8	171.8	-177.8	173.9	0	115.3	N127 L131 N132 D339	N127-K129 VanDerWaalsContact C-N 3.28Å; N127-K129 PolarHBondContact O-N 2.69Å; K129-L131 PolarHBondContact O-N 2.94Å; K129-N132 WeakPolarHBondContact O-CB 3.49Å; K129-N132 PolarHBondContact O-N 3.17Å; K129-D339 HydrophobicContact CB-CB 4.04Å; K129-D339 PolarHBondContact N-OD1 3.05Å
130	Q	92.1	Very high	93.3	Very high	158 Å²	158	40.9 Å²	40.9	74%	0.738	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-70.8	-13.5	177.8	-65	-180	-0.2	0	0	113.1	N127 V128	N127-Q130 PolarHBondContact O-N 2.9Å; V128-Q130 PolarHBondContact O-N 3.25Å; V128-Q130 VanDerWaalsContact O-N 3.07Å
131	L	94.8	Very high	93.4	Very high	18 Å²	18	39.3 Å²	39.3	9%	0.094	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-98.2	2.5	-179.5	-55.6	177.9	0	0	0	112.7	L95 L102 V128 K129 G133 V134 F135 L338	L95-L131 HydrophobicContact CD1-CD1 4.2Å; L95-L131 HydrophobicContact CD1-CD2 4.43Å; L102-L131 HydrophobicContact CD1-CD2 4.08Å; V128-L131 WeakPolarHBondContact O-CA 3.39Å; V128-L131 VanDerWaalsContact O-CB 3.25Å; V128-L131 WeakPolarHBondContact O-CB 3.47Å; V128-L131 PolarHBondContact O-N 3.2Å; K129-L131 PolarHBondContact O-N 2.94Å; L131-G133 PolarHBondContact O-N 3.17Å; L131-V134 VanDerWaalsContact O-CB 3.31Å; L131-V134 WeakPolarHBondContact O-CB 3.27Å; L131-V134 WeakPolarHBondContact O-CG2 3.29Å; L131-V134 PolarHBondContact O-N 3.13Å; L131-F135 HydrophobicContact CB-CD2 4.26Å; L131-F135 HydrophobicContact CB-CE2 3.91Å; L131-F135 HydrophobicContact CD1-CE2 4.07Å; L131-F135 HydrophobicContact CD2-CE2 4.17Å; L131-F135 HydrophobicContact CG-CE2 4.27Å; L131-L338 HydrophobicContact CB-CD2 4.04Å
132	N	96.8	Very high	93.5	Very high	48 Å²	48	39.7 Å²	39.7	26%	0.257	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	134.2	173.3	-81.8	7.3	0	0	0	110.6	K129 V134 Q336 D337 L338 D339	K129-N132 WeakPolarHBondContact O-CB 3.49Å; K129-N132 PolarHBondContact O-N 3.17Å; N132-V134 VanDerWaalsContact C-N 3.28Å; N132-V134 PolarHBondContact O-N 3.27Å; N132-Q336 VanDerWaalsContact CB-O 3.23Å; N132-Q336 WeakPolarHBondContact CB-O 3.17Å; N132-Q336 PolarHBondContact ND2-O 3.28Å; N132-D337 PolarHBondContact ND2-OD1 3.24Å; N132-L338 PolarHBondContact OD1-N 3.06Å; N132-D339 PolarHBondContact OD1-N 3.21Å
133	G	96.6	Very high	93.7	Very high	33 Å²	33	43.8 Å²	43.8	34%	0.34	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	1.8	-179.2	0	0	0	0	0	115.3	L131 V334 Y335	L131-G133 PolarHBondContact O-N 3.17Å; G133-V334 WeakPolarHBondContact O-CG1 3.23Å; G133-Y335 PolarHBondContact N-O 3Å
134	V	95.9	Very high	94	Very high	27 Å²	27	42 Å²	42	16%	0.164	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-45.3	-175.3	177.2	0	0	0	0	112.8	L102 R108 W114 L131 N132	L102-V134 HydrophobicContact CD1-CG1 3.79Å; R108-V134 PolarHBondContact NH1-O 2.87Å; W114-V134 HydrophobicContact CE3-CG1 3.8Å; W114-V134 HydrophobicContact CZ3-CG1 3.84Å; L131-V134 VanDerWaalsContact O-CB 3.31Å; L131-V134 WeakPolarHBondContact O-CB 3.27Å; L131-V134 WeakPolarHBondContact O-CG2 3.29Å; L131-V134 PolarHBondContact O-N 3.13Å; N132-V134 VanDerWaalsContact C-N 3.28Å; N132-V134 PolarHBondContact O-N 3.27Å
135	F	97.8	Very high	94.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.208	C	C	.	.			trans	-101.8	145.1	-168.1	-64.1	-80.5	0	0	0	112.7	F90 L95 L102 W114 W116 L131 V334 Y335 L338	F90-F135 HydrophobicContact CB-CE1 3.81Å; F90-F135 HydrophobicContact CB-CZ 4.07Å; F90-F135 HydrophobicContact CD2-CD1 4.41Å; F90-F135 AromaticContact CD2-CE1 3.56Å; F90-F135 HydrophobicContact CD2-CE1 3.56Å; F90-F135 HydrophobicContact CD2-CZ 4.43Å; F90-F135 HydrophobicContact CE2-CE1 4.32Å; F90-F135 AromaticContact CG-CE1 3.86Å; F90-F135 HydrophobicContact CG-CE1 3.86Å; F90-F135 HydrophobicContact CG-CZ 4.33Å; L95-F135 HydrophobicContact CD1-CE2 4.47Å; L95-F135 HydrophobicContact CD1-CZ 3.86Å; L102-F135 HydrophobicContact CD2-CE1 4.35Å; L102-F135 HydrophobicContact CD2-CZ 3.87Å; W114-F135 HydrophobicContact CB-CD1 3.97Å; W114-F135 HydrophobicContact CE3-CE1 4.32Å; W116-F135 HydrophobicContact CB-CB 4Å; W116-F135 HydrophobicContact CB-CD1 3.81Å; W116-F135 HydrophobicContact CB-CD2 3.79Å; W116-F135 HydrophobicContact CB-CE1 4.21Å; W116-F135 HydrophobicContact CB-CE2 4.17Å; W116-F135 HydrophobicContact CB-CG 3.59Å; W116-F135 HydrophobicContact CB-CZ 4.38Å; W116-F135 AromaticContact CD1-CE2 3.73Å; W116-F135 HydrophobicContact CG-CD2 4.24Å; W116-F135 HydrophobicContact CG-CE2 4.33Å; L131-F135 HydrophobicContact CB-CD2 4.26Å; L131-F135 HydrophobicContact CB-CE2 3.91Å; L131-F135 HydrophobicContact CD1-CE2 4.07Å; L131-F135 HydrophobicContact CD2-CE2 4.17Å; L131-F135 HydrophobicContact CG-CE2 4.27Å; F135-V334 WeakPolarHBondContact O-CA 3.22Å; F135-Y335 PolarHBondContact O-N 3.43Å; F135-L338 HydrophobicContact CD2-CD2 3.88Å
136	N	98.3	Very high	95.1	Very high	12 Å²	12	40.3 Å²	40.3	6%	0.064	21%	0.211	C	C	.	.	S	Bend	trans	-84.3	-40.5	175.6	-53.5	84.8	0	0	0	111.7	R108 W114 K333 Y335	R108-N136 PolarHBondContact NH2-OD1 3.09Å; W114-N136 PolarHBondContact N-OD1 3.44Å; W114-N136 PolarHBondContact O-N 3.3Å; N136-K333 VanDerWaalsContact CA-O 3.27Å; N136-K333 WeakPolarHBondContact CA-O 3.38Å; N136-K333 VanDerWaalsContact CB-O 3.24Å; N136-K333 WeakPolarHBondContact CB-O 3.19Å; N136-K333 PolarHBondContact ND2-O 2.82Å; N136-Y335 WeakPolarHBondContact O-CD2 3.39Å; N136-Y335 WeakPolarHBondContact O-CE2 3.29Å
137	W	98.6	Very high	95.8	Very high	10 Å²	10	37.8 Å²	37.8	4%	0.038	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	150.7	-167.7	-52.8	-48.6	0	0	0	111	V87 G113 W114 V115 W116 D146 Y326 L329 P330	V87-W137 HydrophobicContact CG1-CZ3 4.31Å; V87-W137 HydrophobicContact CG2-CZ3 4.09Å; G113-W137 VanDerWaalsContact CA-CZ3 3.46Å; W114-W137 PolarHBondContact O-N 3.43Å; V115-W137 WeakPolarHBondContact CA-O 3.49Å; V115-W137 HydrophobicContact CG2-CB 4.24Å; V115-W137 HydrophobicContact CG2-CE3 3.77Å; W116-W137 PolarHBondContact N-O 3.31Å; W137-D146 WeakPolarHBondContact CA-OD2 3.4Å; W137-D146 HydrophobicContact CB-CB 3.87Å; W137-D146 HydrophobicContact CG-CB 4.36Å; W137-Y326 HydrophobicContact CH2-CD2 4.43Å; W137-Y326 AromaticContact CH2-CE2 3.97Å; W137-Y326 HydrophobicContact CH2-CE2 3.97Å; W137-Y326 HydrophobicContact CZ3-CE2 4.27Å; W137-L329 HydrophobicContact CD2-CB 4.3Å; W137-L329 HydrophobicContact CD2-CD1 3.71Å; W137-L329 HydrophobicContact CD2-CG 4.43Å; W137-L329 HydrophobicContact CE3-CD1 3.73Å; W137-L329 HydrophobicContact CG-CD1 4.18Å; W137-L329 HydrophobicContact CG-CD2 4.35Å; W137-L329 HydrophobicContact CH2-CB 4.46Å; W137-L329 HydrophobicContact CH2-CD1 4.26Å; W137-L329 HydrophobicContact CZ2-CB 3.84Å; W137-L329 HydrophobicContact CZ2-CD1 4.27Å; W137-L329 HydrophobicContact CZ3-CD1 3.99Å; W137-P330 PolarHBondContact NE1-O 3.22Å
138	T	98.4	Very high	96.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	140.8	173.2	55.7	0	0	0	0	110.5	W116 D146 V147 Y335 L338 W341	W116-T138 HydrophobicContact CE3-CG2 4.2Å; W116-T138 CarbonylContact O-C 3.53Å; W116-T138 WeakPolarHBondContact O-CA 3.15Å; T138-D146 PolarHBondContact N-OD2 3.03Å; T138-D146 PolarHBondContact O-N 2.81Å; T138-D146 VanDerWaalsContact O-N 3.15Å; T138-D146 PolarHBondContact OG1-N 3.13Å; T138-D146 PolarHBondContact OG1-OD2 3.47Å; T138-V147 PolarHBondContact O-N 2.89Å; T138-Y335 HydrophobicContact CG2-CD2 4.12Å; T138-Y335 HydrophobicContact CG2-CE1 4.15Å; T138-Y335 HydrophobicContact CG2-CE2 3.7Å; T138-Y335 HydrophobicContact CG2-CG 4.49Å; T138-Y335 PolarHBondContact OG1-OH 3.29Å; T138-L338 HydrophobicContact CG2-CD1 3.62Å; T138-W341 HydrophobicContact CG2-CD2 4.19Å; T138-W341 HydrophobicContact CG2-CE3 3.79Å; T138-W341 HydrophobicContact CG2-CH2 4Å; T138-W341 HydrophobicContact CG2-CZ2 4.36Å; T138-W341 HydrophobicContact CG2-CZ3 3.69Å; T138-W341 WeakPolarHBondContact OG1-CZ2 3.37Å
139	M	98.5	Very high	96.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	116.5	170.5	-175.7	-179.3	170.5	0	0	108.3	V115 W116 L117 S118 V147 T149 R318 I322	V115-M139 HydrophobicContact CG1-CB 3.49Å; V115-M139 VanDerWaalsContact CG1-CB 3.49Å; W116-M139 PolarHBondContact O-N 3.31Å; L117-M139 WeakPolarHBondContact CA-O 3.17Å; L117-M139 HydrophobicContact CB-CB 4.43Å; L117-M139 HydrophobicContact CD1-CB 3.93Å; L117-M139 HydrophobicContact CD1-CE 4.17Å; L117-M139 HydrophobicContact CD1-CG 3.66Å; L117-M139 WeakPolarHBondContact CD1-O 3.49Å; L117-M139 HydrophobicContact CD1-SD 3.81Å; S118-M139 PolarHBondContact N-O 3.41Å; M139-V147 VanDerWaalsContact CA-O 3.32Å; M139-V147 WeakPolarHBondContact CA-O 3.06Å; M139-V147 HydrophobicContact CB-CB 4.02Å; M139-V147 HydrophobicContact CG-CB 3.88Å; M139-V147 HydrophobicContact CG-CG1 3.92Å; M139-V147 WeakPolarHBondContact CG-O 3.21Å; M139-V147 HydrophobicContact SD-CG1 4.23Å; M139-T149 HydrophobicContact CE-CG2 4.21Å; M139-T149 VanDerWaalsContact CE-OG1 3.25Å; M139-T149 WeakPolarHBondContact CE-OG1 3.31Å; M139-R318 HydrophobicContact CE-CB 3.83Å; M139-R318 WeakPolarHBondContact CE-O 3.33Å; M139-I322 HydrophobicContact SD-CD1 3.97Å; M139-I322 HydrophobicContact SD-CG1 3.96Å
140	S	97.8	Very high	96.7	Very high	4 Å²	4	29.4 Å²	29.4	3%	0.028	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	174.7	-171.4	-166.3	0	0	0	0	112.3	S118 V147 T149	S118-S140 VanDerWaalsContact O-CA 3.3Å; S118-S140 WeakPolarHBondContact O-CA 3.44Å; S118-S140 VanDerWaalsContact O-CB 3.3Å; S118-S140 WeakPolarHBondContact O-CB 3.39Å; S118-S140 PolarHBondContact O-OG 2.98Å; S140-V147 PolarHBondContact N-O 2.87Å; S140-T149 PolarHBondContact O-N 3.06Å
141	Y	96.7	Very high	96.9	Very high	9 Å²	9	23.3 Å²	23.3	4%	0.035	13%	0.127	C	C	.	.	S	Bend	trans	-68.7	-24.4	169.7	61.6	-92.2	0	0	0	112.4	M119 P121 K234 D235 Y236	M119-Y141 WeakPolarHBondContact O-CD1 3.39Å; P121-Y141 WeakPolarHBondContact CA-OH 3.32Å; Y141-K234 WeakPolarHBondContact CE2-O 3.39Å; Y141-D235 HydrophobicContact CD2-CB 4.48Å; Y141-D235 WeakPolarHBondContact CD2-O 3.02Å; Y141-Y236 AromaticContact CD1-CD2 3.78Å; Y141-Y236 HydrophobicContact CD1-CD2 3.78Å; Y141-Y236 HydrophobicContact CD1-CE2 4.22Å; Y141-Y236 AromaticContact CD2-CD2 3.92Å; Y141-Y236 HydrophobicContact CD2-CD2 3.92Å; Y141-Y236 AromaticContact CE1-CD2 3.55Å; Y141-Y236 HydrophobicContact CE1-CD2 3.55Å; Y141-Y236 HydrophobicContact CE1-CE2 4.11Å; Y141-Y236 VanDerWaalsContact CE2-CA 3.45Å; Y141-Y236 VanDerWaalsContact CE2-CB 3.49Å; Y141-Y236 AromaticContact CE2-CD2 3.69Å; Y141-Y236 HydrophobicContact CE2-CD2 3.69Å; Y141-Y236 HydrophobicContact CE2-CG 4.06Å; Y141-Y236 AromaticContact CG-CD2 3.97Å; Y141-Y236 HydrophobicContact CG-CD2 3.97Å; Y141-Y236 AromaticContact CZ-CD2 3.51Å
142	R	96.4	Very high	97	Very high	7 Å²	7	22.6 Å²	22.6	3%	0.026	12%	0.123	C	C	.	.	S	Bend	trans	-60	137.7	-179.2	-75.8	-178.3	57.1	156.9	-8.7	111.3	D144 A145 T148 W341 V342 S344	R142-D144 WeakPolarHBondContact CB-OD1 3.29Å; R142-D144 IonicContact CZ-OD1 3.65Å; R142-D144 IonicContact CZ-OD2 3.32Å; R142-D144 IonicContact NE-OD1 2.94Å; R142-D144 PolarHBondContact NE-OD1 3.02Å; R142-D144 IonicContact NE-OD2 2.7Å; R142-D144 VanDerWaalsContact NH2-CG 3.31Å; R142-D144 IonicContact NH2-OD1 2.8Å; R142-D144 PolarHBondContact NH2-OD1 2.88Å; R142-D144 VanDerWaalsContact NH2-OD1 3.13Å; R142-D144 IonicContact NH2-OD2 3.05Å; R142-D144 PolarHBondContact NH2-OD2 2.83Å; R142-D144 PolarHBondContact O-N 3.27Å; R142-A145 WeakPolarHBondContact O-CB 3.28Å; R142-A145 PolarHBondContact O-N 2.84Å; R142-T148 WeakPolarHBondContact O-CG2 3.44Å; R142-T148 PolarHBondContact O-OG1 2.73Å; R142-W341 HydrophobicContact CB-CH2 4.4Å; R142-W341 HydrophobicContact CB-CZ2 4.41Å; R142-W341 PolarHBondContact NH1-O 3.32Å; R142-V342 PolarHBondContact NH1-O 3.47Å; R142-S344 PolarHBondContact NH1-O 3.36Å; R142-S344 PolarHBondContact NH1-OG 3.29Å; R142-S344 PolarHBondContact NH2-OG 2.81Å
143	R	95.6	Very high	97	Very high	111 Å²	111	24.1 Å²	24.1	42%	0.419	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-21.2	-176.5	-66.5	-179.7	-67.1	171	-7.8	113.5	T148 D235 E264	R143-T148 PolarHBondContact O-OG1 3.33Å; R143-T148 VanDerWaalsContact O-OG1 3.12Å; R143-D235 WeakPolarHBondContact CB-OD2 3.22Å; R143-D235 HydrophobicContact CG-CB 4.46Å; R143-D235 IonicContact CZ-OD1 2.54Å; R143-D235 VanDerWaalsContact CZ-OD1 3.3Å; R143-D235 PolarHBondContact N-OD2 2.9Å; R143-D235 VanDerWaalsContact NE-CG 3.28Å; R143-D235 IonicContact NE-OD1 3.13Å; R143-D235 PolarHBondContact NE-OD1 2.93Å; R143-D235 IonicContact NE-OD2 2.63Å; R143-D235 PolarHBondContact NE-OD2 2.8Å; R143-D235 IonicContact NH2-OD1 3.52Å; R143-D235 PolarHBondContact NH2-OD1 2.59Å; R143-E264 IonicContact CZ-OE2 3.25Å; R143-E264 IonicContact NH1-OE2 3.83Å; R143-E264 PolarHBondContact NH1-OE2 3.28Å; R143-E264 IonicContact NH2-OE2 2.69Å; R143-E264 PolarHBondContact NH2-OE2 3Å
144	D	96.4	Very high	97	Very high	63 Å²	63	23.9 Å²	23.9	34%	0.337	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	13.9	175.6	64	-0.9	0	0	0	113.7	R142 K234	R142-D144 WeakPolarHBondContact CB-OD1 3.29Å; R142-D144 IonicContact CZ-OD1 3.65Å; R142-D144 IonicContact CZ-OD2 3.32Å; R142-D144 IonicContact NE-OD1 2.94Å; R142-D144 PolarHBondContact NE-OD1 3.02Å; R142-D144 IonicContact NE-OD2 2.7Å; R142-D144 VanDerWaalsContact NH2-CG 3.31Å; R142-D144 IonicContact NH2-OD1 2.8Å; R142-D144 PolarHBondContact NH2-OD1 2.88Å; R142-D144 VanDerWaalsContact NH2-OD1 3.13Å; R142-D144 IonicContact NH2-OD2 3.05Å; R142-D144 PolarHBondContact NH2-OD2 2.83Å; R142-D144 PolarHBondContact O-N 3.27Å; D144-K234 IonicContact OD2-NZ 3.27Å; D144-K234 PolarHBondContact OD2-NZ 3.25Å
145	A	97.9	Very high	96.9	Very high	11 Å²	11	23.9 Å²	23.9	9%	0.091	12%	0.12	C	C	.	.	S	Bend	trans	-72.3	152.8	167.8	0	0	0	0	0	111.1	R142 V147 T148 W341	R142-A145 WeakPolarHBondContact O-CB 3.28Å; R142-A145 PolarHBondContact O-N 2.84Å; A145-V147 VanDerWaalsContact C-N 3.26Å; A145-V147 PolarHBondContact O-N 2.63Å; A145-T148 PolarHBondContact O-OG1 3.13Å; A145-W341 HydrophobicContact CB-CH2 4.1Å; A145-W341 HydrophobicContact CB-CZ2 4.02Å
146	D	98.3	Very high	96.7	Very high	27 Å²	27	28.9 Å²	28.9	14%	0.144	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-36.7	175.8	-62	-79.1	0	0	0	111.6	W137 T138 L329 K333 Y335	W137-D146 WeakPolarHBondContact CA-OD2 3.4Å; W137-D146 HydrophobicContact CB-CB 3.87Å; W137-D146 HydrophobicContact CG-CB 4.36Å; T138-D146 PolarHBondContact N-OD2 3.03Å; T138-D146 PolarHBondContact O-N 2.81Å; T138-D146 VanDerWaalsContact O-N 3.15Å; T138-D146 PolarHBondContact OG1-N 3.13Å; T138-D146 PolarHBondContact OG1-OD2 3.47Å; D146-L329 HydrophobicContact CB-CD2 3.74Å; D146-K333 IonicContact OD1-NZ 2.81Å; D146-K333 PolarHBondContact OD1-NZ 3.34Å; D146-K333 IonicContact OD2-NZ 3.13Å; D146-K333 PolarHBondContact OD2-NZ 3.3Å; D146-Y335 WeakPolarHBondContact OD2-CE2 3.23Å; D146-Y335 VanDerWaalsContact OD2-CZ 3.28Å; D146-Y335 PolarHBondContact OD2-OH 3.07Å
147	V	98.1	Very high	96.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	83.2	171.9	-172.5	0	0	0	0	109.6	T138 M139 S140 A145 T149 Q321 I322 K325 L329	T138-V147 PolarHBondContact O-N 2.89Å; M139-V147 VanDerWaalsContact CA-O 3.32Å; M139-V147 WeakPolarHBondContact CA-O 3.06Å; M139-V147 HydrophobicContact CB-CB 4.02Å; M139-V147 HydrophobicContact CG-CB 3.88Å; M139-V147 HydrophobicContact CG-CG1 3.92Å; M139-V147 WeakPolarHBondContact CG-O 3.21Å; M139-V147 HydrophobicContact SD-CG1 4.23Å; S140-V147 PolarHBondContact N-O 2.87Å; A145-V147 VanDerWaalsContact C-N 3.26Å; A145-V147 PolarHBondContact O-N 2.63Å; V147-T149 PolarHBondContact O-N 2.79Å; V147-T149 PolarHBondContact O-OG1 3Å; V147-Q321 HydrophobicContact CG1-CB 4.16Å; V147-I322 HydrophobicContact CG1-CG1 4.01Å; V147-I322 HydrophobicContact CG2-CG1 4.32Å; V147-K325 HydrophobicContact CG1-CG 4.34Å; V147-K325 HydrophobicContact CG2-CB 4.13Å; V147-L329 HydrophobicContact CG2-CD1 4.27Å; V147-L329 HydrophobicContact CG2-CD2 4.31Å
148	T	96.6	Very high	95	Very high	39 Å²	39	32.8 Å²	32.8	24%	0.239	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	125.1	175.5	-55.5	0	0	0	0	111.3	R142 R143 A145	R142-T148 WeakPolarHBondContact O-CG2 3.44Å; R142-T148 PolarHBondContact O-OG1 2.73Å; R143-T148 PolarHBondContact O-OG1 3.33Å; R143-T148 VanDerWaalsContact O-OG1 3.12Å; A145-T148 PolarHBondContact O-OG1 3.13Å
149	T	94.1	Very high	93.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.199	C	C	.	.			trans	-137.7	87.2	179.4	-48.9	0	0	0	0	110.1	M119 M139 S140 V147 R318 Q321	M119-T149 WeakPolarHBondContact CE-O 3.46Å; M139-T149 HydrophobicContact CE-CG2 4.21Å; M139-T149 VanDerWaalsContact CE-OG1 3.25Å; M139-T149 WeakPolarHBondContact CE-OG1 3.31Å; S140-T149 PolarHBondContact O-N 3.06Å; V147-T149 PolarHBondContact O-N 2.79Å; V147-T149 PolarHBondContact O-OG1 3Å; T149-R318 HydrophobicContact CG2-CB 3.76Å; T149-R318 HydrophobicContact CG2-CG 3.55Å; T149-R318 VanDerWaalsContact CG2-NH1 3.29Å; T149-R318 PolarHBondContact O-NH1 3.43Å; T149-Q321 HydrophobicContact CG2-CG 4.45Å
150	P	95.1	Very high	91.4	Very high	41 Å²	41	41 Å²	41	27%	0.266	24%	0.236	S	C	.	.			trans	-68	172.1	-175.6	31.5	-36.3	0	0	0	111.8	G152 Y312 R318	P150-G152 WeakPolarHBondContact CB-O 3.22Å; P150-Y312 HydrophobicContact CG-CD2 4.31Å; P150-Y312 HydrophobicContact CG-CE2 4.2Å; P150-Y312 WeakPolarHBondContact O-CB 3.4Å; P150-R318 PolarHBondContact O-NH1 2.82Å; P150-R318 PolarHBondContact O-NH2 3.13Å
151	Y	97.4	Very high	89.2	Confident	30 Å²	30	50.2 Å²	50.2	12%	0.118	28%	0.279	C	S	.	.	S	Bend	trans	-75.4	-27.6	171.8	-79.7	-97.5	0	0	0	112.9	M119 Y236 E239 Y312	M119-Y151 HydrophobicContact CB-CE2 4.36Å; M119-Y151 HydrophobicContact CE-CD2 3.55Å; M119-Y151 HydrophobicContact CE-CE2 3.31Å; M119-Y151 HydrophobicContact CE-CG 4.28Å; M119-Y151 PolarHBondContact O-OH 3.04Å; Y151-Y236 HydrophobicContact CE2-CE2 4.08Å; Y151-E239 HydrophobicContact CD1-CB 4.11Å; Y151-E239 VanDerWaalsContact CD1-N 3.28Å; Y151-E239 HydrophobicContact CE1-CB 4.48Å; Y151-E239 WeakPolarHBondContact CE1-OE2 3.48Å; Y151-Y312 PolarHBondContact O-N 2.82Å
152	G	96.6	Very high	87.3	Confident	2 Å²	2	53 Å²	53	2%	0.021	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	173.3	172.3	0	0	0	0	0	111.5	P150 W242 K310	P150-G152 WeakPolarHBondContact CB-O 3.22Å; G152-W242 VanDerWaalsContact CA-CD2 3.49Å; G152-W242 WeakPolarHBondContact O-CZ2 3.49Å; G152-K310 CarbonylContact C-O 3.39Å; G152-K310 WeakPolarHBondContact CA-O 3.23Å
153	E	95.4	Very high	85.9	Confident	80 Å²	80	55.6 Å²	55.6	37%	0.374	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	143.9	-176.9	-177.7	179.5	-159.4	0	0	109.6	L155 K310 Y312	E153-L155 VanDerWaalsContact CD-CD2 3.49Å; E153-L155 HydrophobicContact CG-CD2 3.89Å; E153-L155 HydrophobicContact CG-CG 4.36Å; E153-K310 PolarHBondContact N-O 3.37Å; E153-K310 PolarHBondContact O-N 3.03Å; E153-Y312 HydrophobicContact CB-CE2 4.19Å; E153-Y312 PolarHBondContact OE2-OH 2.8Å
154	T	96.6	Very high	84.6	Confident	29 Å²	29	58.4 Å²	58.4	18%	0.178	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	119	169.8	-58	0	0	0	0	109	V265 P267 H307	T154-V265 VanDerWaalsContact CB-O 3.31Å; T154-V265 WeakPolarHBondContact CB-O 3.49Å; T154-V265 PolarHBondContact OG1-O 3.26Å; T154-P267 HydrophobicContact CG2-CB 4.12Å; T154-P267 HydrophobicContact CG2-CG 3.78Å; T154-P267 WeakPolarHBondContact OG1-CD 3.01Å; T154-H307 HydrophobicContact CG2-CB 3.75Å
155	L	95.1	Very high	83.4	Confident	27 Å²	27	56.8 Å²	56.8	14%	0.141	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	145.3	179.2	-62.5	175.9	0	0	0	110.3	E153 H307 R308 K310	E153-L155 VanDerWaalsContact CD-CD2 3.49Å; E153-L155 HydrophobicContact CG-CD2 3.89Å; E153-L155 HydrophobicContact CG-CG 4.36Å; L155-H307 CarbonylContact O-C 3.53Å; L155-H307 VanDerWaalsContact O-CA 3.27Å; L155-H307 WeakPolarHBondContact O-CA 3.49Å; L155-R308 HydrophobicContact CB-CG 3.84Å; L155-R308 VanDerWaalsContact CD1-CZ 3.48Å; L155-R308 PolarHBondContact N-O 3.26Å; L155-R308 PolarHBondContact O-N 2.99Å; L155-K310 HydrophobicContact CD1-CB 3.7Å; L155-K310 HydrophobicContact CD1-CD 4.04Å; L155-K310 HydrophobicContact CD1-CG 4.46Å; L155-K310 HydrophobicContact CG-CB 4.33Å
156	P	93.1	Very high	82.1	Confident	105 Å²	105	58.7 Å²	58.7	68%	0.682	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.5	155.5	173.1	30	-35	0	0	0	111.1
157	G	86.1	Confident	80.8	Confident	38 Å²	38	59.3 Å²	59.3	39%	0.392	35%	0.352	S	S	.	.	S	Bend	trans	109.4	141.6	-179.5	0	0	0	0	0	111.2	G159 T306 H307 R308	G157-G159 PolarHBondContact O-N 3.05Å; G157-T306 CarbonylContact C-O 3.58Å; G157-T306 PolarHBondContact N-O 2.82Å; G157-T306 CarbonylContact O-C 3.6Å; G157-H307 CarbonylContact O-C 3.58Å; G157-H307 WeakPolarHBondContact O-CA 3.49Å; G157-H307 PolarHBondContact O-N 3.01Å; G157-R308 PolarHBondContact O-N 3.42Å
158	A	74.7	Confident	79.7	Confident	66 Å²	66	67.3 Å²	67.3	55%	0.545	40%	0.395	S	S	.	.			trans	-51.7	131.4	175.4	0	0	0	0	0	109.7	K305	A158-K305 WeakPolarHBondContact CB-O 3.32Å
159	G	64.3	Low	79.1	Confident	13 Å²	13	67.4 Å²	67.4	13%	0.134	39%	0.391	C	S	.	.			trans	-64.6	-164.4	171.9	0	0	0	0	0	111.9	G157 Q161 H304 H307	G157-G159 PolarHBondContact O-N 3.05Å; G159-Q161 PolarHBondContact O-N 2.84Å; G159-H304 PolarHBondContact N-O 3.17Å; G159-H307 PolarHBondContact N-O 3.36Å
160	M	57.7	Low	78.9	Confident	159 Å²	159	72.3 Å²	72.3	78%	0.783	43%	0.425	S	S	*	.	S	Bend	trans	-44.5	117	175.6	-77.8	-175.8	-79.3	0	0	110.5	G162 F163	M160-G162 PolarHBondContact O-N 2.94Å; M160-G162 VanDerWaalsContact O-N 3.13Å; M160-F163 PolarHBondContact O-N 3.18Å
161	Q	50.8	Low	78.9	Confident	198 Å²	198	70.7 Å²	70.7	93%	0.925	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	122.1	173.1	-77.4	-173.2	-10.2	0	0	108	G159	G159-Q161 PolarHBondContact O-N 2.84Å
162	G	56.2	Low	79	Confident	68 Å²	68	70.8 Å²	70.8	70%	0.701	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.8	25.3	178.4	0	0	0	0	0	116.3	M160 Q164	M160-G162 PolarHBondContact O-N 2.94Å; M160-G162 VanDerWaalsContact O-N 3.13Å; G162-Q164 PolarHBondContact O-N 2.6Å
163	F	68.2	Low	79.1	Confident	61 Å²	61	70.7 Å²	70.7	27%	0.268	42%	0.415	S	S	.	.			trans	-55.1	115.5	163.3	-179.3	-90.8	0	0	0	109.6	M160 F301 H304	M160-F163 PolarHBondContact O-N 3.18Å; F163-F301 HydrophobicContact CD1-CB 4.27Å; F163-F301 HydrophobicContact CD1-CD1 4.4Å; F163-F301 HydrophobicContact CE1-CB 3.75Å; F163-F301 AromaticContact CE1-CD1 3.29Å; F163-F301 HydrophobicContact CE1-CD1 3.29Å; F163-F301 HydrophobicContact CE1-CE1 4Å; F163-F301 AromaticContact CE1-CG 3.6Å; F163-F301 HydrophobicContact CE1-CG 3.6Å; F163-F301 AromaticContact CZ-CD1 3.46Å; F163-F301 HydrophobicContact CZ-CD1 3.46Å; F163-F301 VanDerWaalsContact CZ-CD1 3.46Å; F163-F301 AromaticContact CZ-CE1 3.73Å; F163-F301 HydrophobicContact CZ-CE1 3.73Å; F163-F301 HydrophobicContact CZ-CG 4.21Å; F163-H304 HydrophobicContact CB-CB 4.49Å; F163-H304 AromaticContact CD1-CD2 3.65Å; F163-H304 AromaticContact CD1-NE2 3.96Å; F163-H304 AromaticContact CD2-NE2 3.91Å; F163-H304 AromaticContact CE1-CD2 3.89Å; F163-H304 AromaticContact CE1-NE2 3.93Å; F163-H304 AromaticContact CE2-NE2 3.86Å; F163-H304 AromaticContact CG-CD2 3.9Å; F163-H304 AromaticContact CG-NE2 3.96Å; F163-H304 AromaticContact CZ-NE2 3.87Å
164	Q	67.1	Low	79.2	Confident	169 Å²	169	66.9 Å²	66.9	79%	0.79	40%	0.397	S	S	*	.			trans	-106.8	115.5	176	-69.9	-173.3	-6.2	0	0	109.3	G162 A166	G162-Q164 PolarHBondContact O-N 2.6Å; Q164-A166 PolarHBondContact O-N 3.45Å; Q164-A166 VanDerWaalsContact O-N 3.09Å
165	S	71.9	Confident	79.3	Confident	30 Å²	30	65.6 Å²	65.6	21%	0.21	39%	0.389	C	S	.	.			trans	-64.3	105.8	168.5	42.6	0	0	0	0	109.6	E298	S165-E298 WeakPolarHBondContact OG-CG 3.47Å
166	A	71.4	Confident	79.4	Confident	51 Å²	51	65.5 Å²	65.5	42%	0.421	39%	0.389	S	S	.	.			trans	-82.6	116.7	169.5	0	0	0	0	0	109.7	Q164 R169	Q164-A166 PolarHBondContact O-N 3.45Å; Q164-A166 VanDerWaalsContact O-N 3.09Å; A166-R169 VanDerWaalsContact O-CG 3.25Å; A166-R169 WeakPolarHBondContact O-CG 3.39Å; A166-R169 PolarHBondContact O-NE 3.43Å
167	L	69.6	Low	79.4	Confident	39 Å²	39	60.7 Å²	60.7	20%	0.204	36%	0.358	C	S	.	.			trans	-83.3	-24.4	169.5	-89.5	149.5	0	0	0	113	R169 K294 Y297	L167-R169 PolarHBondContact O-N 3.45Å; L167-K294 HydrophobicContact CD1-CB 3.52Å; L167-K294 HydrophobicContact CD1-CD 3.75Å; L167-K294 HydrophobicContact CD1-CG 3.32Å; L167-Y297 HydrophobicContact CD1-CD1 4.15Å; L167-Y297 HydrophobicContact CD2-CD1 3.52Å; L167-Y297 HydrophobicContact CD2-CD2 4.23Å; L167-Y297 HydrophobicContact CD2-CE1 4.15Å; L167-Y297 HydrophobicContact CD2-CG 3.55Å; L167-Y297 HydrophobicContact CG-CD1 3.49Å; L167-Y297 VanDerWaalsContact CG-CD1 3.49Å; L167-Y297 HydrophobicContact CG-CE1 3.94Å; L167-Y297 HydrophobicContact CG-CG 4.08Å
168	N	74.5	Confident	79.5	Confident	168 Å²	168	62 Å²	62	90%	0.898	36%	0.362	S	S	*	.			trans	-78.3	54.3	179.4	-68.5	-5.5	0	0	0	111.5
169	R	84.4	Confident	79.9	Confident	41 Å²	41	67.6 Å²	67.6	16%	0.155	37%	0.373	C	S	.	.			trans	-87.6	138.7	178.8	-67.9	-160.3	-173.4	-148.1	-4.2	109.8	A166 L167 C171 S220 K221 C222 L223 G249 Y297	A166-R169 VanDerWaalsContact O-CG 3.25Å; A166-R169 WeakPolarHBondContact O-CG 3.39Å; A166-R169 PolarHBondContact O-NE 3.43Å; L167-R169 PolarHBondContact O-N 3.45Å; R169-C171 PolarHBondContact O-N 3.36Å; R169-S220 PolarHBondContact NH1-O 2.93Å; R169-K221 VanDerWaalsContact CB-O 3.3Å; R169-K221 WeakPolarHBondContact CB-O 3.45Å; R169-C222 WeakPolarHBondContact CD-O 3.44Å; R169-C222 PolarHBondContact NH1-O 3.19Å; R169-L223 HydrophobicContact CB-CD2 3.9Å; R169-L223 HydrophobicContact CB-CG 4.12Å; R169-L223 HydrophobicContact CG-CD2 4.06Å; R169-G249 PolarHBondContact NH1-O 3.28Å; R169-G249 PolarHBondContact NH2-O 3.48Å; R169-Y297 PolarHBondContact NE-OH 3.33Å
170	S	90.3	Very high	80.7	Confident	103 Å²	103	68 Å²	68	72%	0.72	37%	0.374	S	S	*	.	S	Bend	trans	-82.5	-2.5	-176.5	56.3	0	0	0	0	113.7	K221	S170-K221 PolarHBondContact N-O 3.34Å
171	C	96	Very high	82	Confident	7 Å²	7	67 Å²	67	5%	0.047	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	142.2	-179.3	163.5	0	0	0	0	110.2	R169 A173 K221 C222 L223	R169-C171 PolarHBondContact O-N 3.36Å; C171-A173 PolarHBondContact SG-O 3.27Å; C171-A173 VanDerWaalsContact SG-O 3.33Å; C171-K221 WeakPolarHBondContact CB-O 3.31Å; C171-K221 PolarHBondContact N-O 3.06Å; C171-C222 HydrophobicContact CB-CB 3.75Å; C171-C222 WeakPolarHBondContact CB-SG 3.47Å; C171-C222 CarbonylContact O-C 3.45Å; C171-C222 WeakPolarHBondContact O-CA 3.23Å; C171-C222 WeakPolarHBondContact SG-CB 3.25Å; C171-C222 CovalentContact SG-SG 2.04Å; C171-C222 PolarHBondContact SG-SG 2.82Å; C171-L223 PolarHBondContact O-N 3.17Å
172	F	97.9	Very high	83.3	Confident	33 Å²	33	62.6 Å²	62.6	15%	0.145	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	-67	176.4	-171	-82.3	0	0	0	110.5	I197 P198 L223 F224 L287 N288 A291	F172-I197 HydrophobicContact CD1-CB 4.01Å; F172-I197 HydrophobicContact CD1-CD1 4.06Å; F172-I197 HydrophobicContact CD1-CG2 4.46Å; F172-I197 HydrophobicContact CE1-CB 3.67Å; F172-I197 HydrophobicContact CE1-CD1 3.6Å; F172-I197 HydrophobicContact CE1-CG1 4.25Å; F172-I197 HydrophobicContact CE1-CG2 3.68Å; F172-I197 HydrophobicContact CZ-CB 4.24Å; F172-I197 HydrophobicContact CZ-CG2 3.79Å; F172-P198 HydrophobicContact CB-CB 4.46Å; F172-P198 HydrophobicContact CB-CG 3.66Å; F172-P198 HydrophobicContact CD2-CG 4.5Å; F172-P198 HydrophobicContact CG-CG 4.04Å; F172-L223 WeakPolarHBondContact O-CB 3.34Å; F172-L223 PolarHBondContact O-N 3.05Å; F172-L223 VanDerWaalsContact O-N 3.08Å; F172-F224 HydrophobicContact CD1-CD2 4.07Å; F172-F224 HydrophobicContact CD1-CE2 4.44Å; F172-F224 AromaticContact CE1-CD2 3.82Å; F172-F224 HydrophobicContact CE1-CD2 3.82Å; F172-F224 AromaticContact CE1-CE2 3.88Å; F172-F224 HydrophobicContact CE1-CE2 3.88Å; F172-F224 HydrophobicContact CE2-CE2 4.48Å; F172-F224 HydrophobicContact CZ-CD2 4.32Å; F172-F224 AromaticContact CZ-CE2 3.92Å; F172-F224 HydrophobicContact CZ-CE2 3.92Å; F172-F224 WeakPolarHBondContact O-CD2 3.39Å; F172-F224 PolarHBondContact O-N 3.15Å; F172-L287 HydrophobicContact CE1-CB 4.18Å; F172-L287 HydrophobicContact CZ-CB 4.15Å; F172-N288 WeakPolarHBondContact CE2-OD1 2.93Å; F172-N288 WeakPolarHBondContact CZ-OD1 3.24Å; F172-A291 HydrophobicContact CD2-CB 4.32Å; F172-A291 HydrophobicContact CE2-CB 3.58Å; F172-A291 HydrophobicContact CZ-CB 4.12Å
173	A	98.6	Very high	84.6	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	149.2	175.6	0	0	0	0	0	111.5	C171 P198 I199 Q200 F224	C171-A173 PolarHBondContact SG-O 3.27Å; C171-A173 VanDerWaalsContact SG-O 3.33Å; A173-P198 PolarHBondContact N-O 3.15Å; A173-I199 HydrophobicContact CB-CG1 4.17Å; A173-I199 WeakPolarHBondContact O-CA 3.48Å; A173-Q200 PolarHBondContact O-N 3.09Å; A173-F224 VanDerWaalsContact CA-O 3.3Å; A173-F224 WeakPolarHBondContact CA-O 3.22Å; A173-F224 HydrophobicContact CB-CB 4.03Å
174	S	98.4	Very high	85.6	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	155.3	167.6	56.7	0	0	0	0	113.2	Q200 C222 F224 L226	S174-Q200 CarbonylContact C-O 3.53Å; S174-Q200 WeakPolarHBondContact CA-O 3.07Å; S174-C222 WeakPolarHBondContact CB-SG 2.96Å; S174-C222 PolarHBondContact OG-SG 3.31Å; S174-C222 VanDerWaalsContact OG-SG 3.39Å; S174-F224 PolarHBondContact N-O 2.81Å; S174-L226 PolarHBondContact O-N 3.13Å
175	W	98.3	Very high	86.9	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.008	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	122.1	173	-172.9	35.2	0	0	0	110.4	V177 R186 V187 Y190 I199 Q200 V201 Y202 W205 L226	W175-V177 HydrophobicContact CD2-CB 4.23Å; W175-V177 HydrophobicContact CD2-CG1 3.81Å; W175-V177 HydrophobicContact CE3-CG1 3.89Å; W175-V177 HydrophobicContact CG-CG1 4.44Å; W175-V177 HydrophobicContact CH2-CB 4.47Å; W175-V177 HydrophobicContact CH2-CG1 4.11Å; W175-V177 HydrophobicContact CH2-CG2 4.37Å; W175-V177 HydrophobicContact CZ2-CB 3.96Å; W175-V177 HydrophobicContact CZ2-CG1 4.03Å; W175-V177 HydrophobicContact CZ2-CG2 3.96Å; W175-V177 HydrophobicContact CZ3-CG1 4.04Å; W175-R186 HydrophobicContact CH2-CG 4.38Å; W175-R186 HydrophobicContact CZ2-CB 4.4Å; W175-R186 HydrophobicContact CZ2-CG 4.05Å; W175-V187 HydrophobicContact CH2-CG2 4.41Å; W175-Y190 HydrophobicContact CE3-CD1 4.04Å; W175-Y190 AromaticContact CE3-CD2 3.63Å; W175-Y190 HydrophobicContact CE3-CD2 3.63Å; W175-Y190 HydrophobicContact CE3-CE1 4.47Å; W175-Y190 HydrophobicContact CE3-CE2 4.14Å; W175-Y190 AromaticContact CE3-CG 3.57Å; W175-Y190 HydrophobicContact CE3-CG 3.57Å; W175-Y190 HydrophobicContact CH2-CD1 4.44Å; W175-Y190 HydrophobicContact CH2-CG 4.31Å; W175-Y190 AromaticContact CZ3-CD1 3.46Å; W175-Y190 HydrophobicContact CZ3-CD1 3.46Å; W175-Y190 VanDerWaalsContact CZ3-CD1 3.46Å; W175-Y190 AromaticContact CZ3-CD2 3.91Å; W175-Y190 HydrophobicContact CZ3-CD2 3.91Å; W175-Y190 HydrophobicContact CZ3-CE1 4.09Å; W175-Y190 AromaticContact CZ3-CG 3.33Å; W175-Y190 HydrophobicContact CZ3-CG 3.33Å; W175-I199 HydrophobicContact CB-CG2 4.27Å; W175-Q200 PolarHBondContact N-O 3.15Å; W175-V201 HydrophobicContact CB-CG2 4.43Å; W175-V201 HydrophobicContact CE3-CG1 4.04Å; W175-V201 HydrophobicContact CE3-CG2 4.27Å; W175-V201 VanDerWaalsContact O-CA 3.31Å; W175-V201 WeakPolarHBondContact O-CA 3.11Å; W175-Y202 PolarHBondContact O-N 2.74Å; W175-W205 HydrophobicContact CE3-CZ3 4.12Å; W175-W205 HydrophobicContact CH2-CH2 4.45Å; W175-W205 HydrophobicContact CH2-CZ3 4.08Å; W175-W205 HydrophobicContact CZ3-CE3 4.1Å; W175-W205 AromaticContact CZ3-CH2 3.95Å; W175-W205 HydrophobicContact CZ3-CH2 3.95Å; W175-W205 AromaticContact CZ3-CZ3 3.4Å; W175-W205 HydrophobicContact CZ3-CZ3 3.4Å; W175-L226 HydrophobicContact CB-CB 3.99Å; W175-L226 HydrophobicContact CB-CD1 4.05Å; W175-L226 HydrophobicContact CB-CG 4.24Å; W175-L226 HydrophobicContact CG-CB 3.98Å; W175-L226 HydrophobicContact CG-CD1 4.32Å
176	V	97.4	Very high	88	Confident	24 Å²	24	58.7 Å²	58.7	15%	0.145	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	113.6	178.3	-175.5	0	0	0	0	108.8	Y202 L210 L215 I219 Y225	V176-Y202 HydrophobicContact CG2-CD2 4.49Å; V176-L210 HydrophobicContact CG1-CD1 4.34Å; V176-L210 HydrophobicContact CG2-CD1 3.93Å; V176-L215 HydrophobicContact CB-CD1 4.19Å; V176-L215 HydrophobicContact CG1-CD1 3.76Å; V176-L215 HydrophobicContact CG2-CD1 3.91Å; V176-I219 HydrophobicContact CG2-CD1 4.16Å; V176-I219 HydrophobicContact CG2-CG1 4.15Å; V176-Y225 HydrophobicContact CB-CE2 4.27Å; V176-Y225 HydrophobicContact CG2-CE2 3.95Å
177	V	94.3	Very high	89.1	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.03	30%	0.304	C	S	.	.			trans	-139.5	126	-172.3	53.1	0	0	0	0	111.7	W175 V201 Y202 G203 K204 W205	W175-V177 HydrophobicContact CD2-CB 4.23Å; W175-V177 HydrophobicContact CD2-CG1 3.81Å; W175-V177 HydrophobicContact CE3-CG1 3.89Å; W175-V177 HydrophobicContact CG-CG1 4.44Å; W175-V177 HydrophobicContact CH2-CB 4.47Å; W175-V177 HydrophobicContact CH2-CG1 4.11Å; W175-V177 HydrophobicContact CH2-CG2 4.37Å; W175-V177 HydrophobicContact CZ2-CB 3.96Å; W175-V177 HydrophobicContact CZ2-CG1 4.03Å; W175-V177 HydrophobicContact CZ2-CG2 3.96Å; W175-V177 HydrophobicContact CZ3-CG1 4.04Å; V177-V201 HydrophobicContact CG1-CG1 3.88Å; V177-Y202 PolarHBondContact N-O 3.32Å; V177-G203 CarbonylContact O-C 3.39Å; V177-G203 WeakPolarHBondContact O-CA 3.25Å; V177-K204 PolarHBondContact O-N 2.87Å; V177-W205 HydrophobicContact CG1-CB 4.17Å; V177-W205 HydrophobicContact CG1-CD2 4.22Å; V177-W205 HydrophobicContact CG1-CE3 3.49Å; V177-W205 VanDerWaalsContact CG1-CE3 3.49Å; V177-W205 HydrophobicContact CG1-CZ3 4.23Å; V177-W205 HydrophobicContact CG2-CB 4.34Å; V177-W205 WeakPolarHBondContact O-CB 3.25Å; V177-W205 PolarHBondContact O-N 3.44Å
178	S	86.4	Confident	90.4	Very high	66 Å²	66	58.2 Å²	58.2	46%	0.462	31%	0.314	S	S	.	.	S	Bend	trans	-101.2	-44.8	-176.3	-73.6	0	0	0	0	113.9	K204 W205	S178-K204 WeakPolarHBondContact O-CB 2.83Å; S178-W205 PolarHBondContact O-N 3.17Å
179	K	83.4	Confident	91.4	Very high	182 Å²	182	51 Å²	51	79%	0.791	28%	0.276	S	S	*	.	S	Bend	trans	-119	128.9	175.7	-65.4	178.5	-179.8	175.8	0	106.6	R186	K179-R186 PolarHBondContact O-NH2 3.13Å
180	S	82.1	Confident	92.1	Very high	22 Å²	22	49.5 Å²	49.5	15%	0.154	27%	0.27	C	S	.	.			trans	-151.1	142.2	170.1	-153.1	0	0	0	0	110.6	Q184 R186 V187	S180-Q184 PolarHBondContact OG-OE1 3.04Å; S180-R186 PolarHBondContact OG-NE 2.92Å; S180-R186 PolarHBondContact OG-NH2 3.49Å; S180-V187 WeakPolarHBondContact OG-CG2 3.25Å
181	K	84.3	Confident	92.4	Very high	137 Å²	137	48.8 Å²	48.8	60%	0.596	26%	0.256	S	S	*	.			trans	-104.8	146.5	174.1	-60.1	177.1	-178.7	174.7	0	109.1	N183 Q184 V187	K181-N183 WeakPolarHBondContact CB-OD1 3.42Å; K181-N183 PolarHBondContact O-N 2.89Å; K181-N183 VanDerWaalsContact O-N 3.14Å; K181-Q184 HydrophobicContact CB-CG 4.09Å; K181-Q184 PolarHBondContact O-N 3.42Å; K181-V187 WeakPolarHBondContact O-CG2 3.44Å
182	P	79	Confident	92.5	Very high	107 Å²	107	50.4 Å²	50.4	70%	0.695	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-29.2	-176.6	-27.9	35.8	0	0	0	114.9
183	N	82.1	Confident	92.5	Very high	132 Å²	132	48.9 Å²	48.9	71%	0.706	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	22	-174.6	66	-26.9	0	0	0	114.4	K181	K181-N183 WeakPolarHBondContact CB-OD1 3.42Å; K181-N183 PolarHBondContact O-N 2.89Å; K181-N183 VanDerWaalsContact O-N 3.14Å
184	Q	90.8	Very high	92.5	Very high	35 Å²	35	53 Å²	53	16%	0.164	28%	0.28	C	S	.	.	S	Bend	trans	-95	138	176.5	-67.8	-176.8	-56.5	0	0	110.5	S180 K181 R186 V187 D188 N230	S180-Q184 PolarHBondContact OG-OE1 3.04Å; K181-Q184 HydrophobicContact CB-CG 4.09Å; K181-Q184 PolarHBondContact O-N 3.42Å; Q184-R186 HydrophobicContact CB-CG 4.18Å; Q184-R186 PolarHBondContact O-N 2.95Å; Q184-V187 HydrophobicContact CB-CG2 4.41Å; Q184-V187 WeakPolarHBondContact O-CA 3.36Å; Q184-V187 WeakPolarHBondContact O-CB 3.38Å; Q184-V187 PolarHBondContact O-N 3.31Å; Q184-D188 PolarHBondContact O-N 3.35Å; Q184-N230 PolarHBondContact NE2-O 3.12Å
185	T	93.5	Very high	92.5	Very high	66 Å²	66	60.5 Å²	60.5	41%	0.405	31%	0.312	S	S	.	.	H	α-helix	trans	-45	-45.2	178.4	-44	0	0	0	0	112.8	V187 D188 V189 E232 L255	T185-V187 VanDerWaalsContact C-N 3.26Å; T185-V187 PolarHBondContact O-N 3.42Å; T185-D188 PolarHBondContact O-N 2.64Å; T185-D188 VanDerWaalsContact O-N 3.13Å; T185-V189 HydrophobicContact CG2-CG2 4.26Å; T185-V189 WeakPolarHBondContact O-CG2 3.1Å; T185-V189 PolarHBondContact O-N 2.59Å; T185-E232 WeakPolarHBondContact CB-OE1 3.22Å; T185-E232 WeakPolarHBondContact CG2-OE1 3.48Å; T185-E232 PolarHBondContact OG1-OE1 3.4Å; T185-L255 HydrophobicContact CG2-CD1 4.45Å; T185-L255 HydrophobicContact CG2-CD2 4.21Å
186	R	95	Very high	92.5	Very high	13 Å²	13	66.1 Å²	66.1	5%	0.049	33%	0.334	C	S	.	.	H	α-helix	trans	-60.5	-31.1	179.4	72.5	-172.5	-179.2	172.7	-16.3	114.5	W175 K179 S180 Q184 Y190 F228 E229 L255	W175-R186 HydrophobicContact CH2-CG 4.38Å; W175-R186 HydrophobicContact CZ2-CB 4.4Å; W175-R186 HydrophobicContact CZ2-CG 4.05Å; K179-R186 PolarHBondContact O-NH2 3.13Å; S180-R186 PolarHBondContact OG-NE 2.92Å; S180-R186 PolarHBondContact OG-NH2 3.49Å; Q184-R186 HydrophobicContact CB-CG 4.18Å; Q184-R186 PolarHBondContact O-N 2.95Å; R186-Y190 VanDerWaalsContact O-CB 3.25Å; R186-Y190 WeakPolarHBondContact O-CB 3.23Å; R186-Y190 PolarHBondContact O-N 2.82Å; R186-F228 HydrophobicContact CB-CB 3.8Å; R186-F228 HydrophobicContact CB-CD2 4.04Å; R186-F228 HydrophobicContact CB-CG 4.31Å; R186-E229 WeakPolarHBondContact CD-O 3.41Å; R186-L255 HydrophobicContact CB-CD2 3.84Å
187	V	95.3	Very high	92.5	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-72.8	-43.4	177	176.4	0	0	0	0	109	W175 S180 K181 Q184 T185 Y190 Q191 W205	W175-V187 HydrophobicContact CH2-CG2 4.41Å; S180-V187 WeakPolarHBondContact OG-CG2 3.25Å; K181-V187 WeakPolarHBondContact O-CG2 3.44Å; Q184-V187 HydrophobicContact CB-CG2 4.41Å; Q184-V187 WeakPolarHBondContact O-CA 3.36Å; Q184-V187 WeakPolarHBondContact O-CB 3.38Å; Q184-V187 PolarHBondContact O-N 3.31Å; T185-V187 VanDerWaalsContact C-N 3.26Å; T185-V187 PolarHBondContact O-N 3.42Å; V187-Y190 PolarHBondContact O-N 3.48Å; V187-Q191 HydrophobicContact CG1-CG 4.14Å; V187-Q191 VanDerWaalsContact O-CB 3.29Å; V187-Q191 WeakPolarHBondContact O-CB 3.46Å; V187-Q191 VanDerWaalsContact O-CG 3.23Å; V187-Q191 WeakPolarHBondContact O-CG 3.39Å; V187-Q191 PolarHBondContact O-N 2.54Å; V187-W205 HydrophobicContact CG1-CZ2 4.35Å; V187-W205 HydrophobicContact CG2-CZ2 4.5Å
188	D	95.5	Very high	92.7	Very high	80 Å²	80	69.1 Å²	69.1	43%	0.428	35%	0.354	S	S	.	.	H	α-helix	trans	-63.9	-44.7	178.3	-60	-31.4	0	0	0	111.7	Q184 T185 Q191 S192	Q184-D188 PolarHBondContact O-N 3.35Å; T185-D188 PolarHBondContact O-N 2.64Å; T185-D188 VanDerWaalsContact O-N 3.13Å; D188-Q191 PolarHBondContact O-N 3.43Å; D188-S192 WeakPolarHBondContact O-CB 3.38Å; D188-S192 PolarHBondContact O-N 2.91Å; D188-S192 PolarHBondContact O-OG 3.12Å
189	V	97.3	Very high	93.3	Very high	16 Å²	16	67.1 Å²	67.1	10%	0.097	34%	0.338	C	S	.	.	H	α-helix	trans	-60.2	-50.4	174.7	172.1	0	0	0	0	110.3	T185 Q191 S192 L193 F228 L255 V274 I280	T185-V189 HydrophobicContact CG2-CG2 4.26Å; T185-V189 WeakPolarHBondContact O-CG2 3.1Å; T185-V189 PolarHBondContact O-N 2.59Å; V189-Q191 PolarHBondContact O-N 3.34Å; V189-S192 PolarHBondContact O-N 3.1Å; V189-L193 WeakPolarHBondContact O-CB 3.33Å; V189-L193 PolarHBondContact O-N 3.27Å; V189-F228 HydrophobicContact CB-CE2 4.3Å; V189-F228 HydrophobicContact CG1-CE2 3.71Å; V189-F228 HydrophobicContact CG1-CZ 3.68Å; V189-L255 HydrophobicContact CB-CD2 4.37Å; V189-L255 HydrophobicContact CG2-CD2 4.06Å; V189-V274 HydrophobicContact CG1-CG1 4.21Å; V189-V274 HydrophobicContact CG1-CG2 4.32Å; V189-V274 HydrophobicContact CG2-CG1 4.4Å; V189-I280 HydrophobicContact CB-CD1 4.47Å; V189-I280 HydrophobicContact CG1-CD1 3.93Å; V189-I280 HydrophobicContact CG2-CD1 4.48Å
190	Y	97.4	Very high	94	Very high	10 Å²	10	62.3 Å²	62.3	4%	0.039	32%	0.318	C	S	.	.	H	α-helix	trans	-58.8	-47.5	176.4	159.6	-104.4	0	0	0	112.2	W175 R186 V187 S192 L193 Q194 I199 V201 W205	W175-Y190 HydrophobicContact CE3-CD1 4.04Å; W175-Y190 AromaticContact CE3-CD2 3.63Å; W175-Y190 HydrophobicContact CE3-CD2 3.63Å; W175-Y190 HydrophobicContact CE3-CE1 4.47Å; W175-Y190 HydrophobicContact CE3-CE2 4.14Å; W175-Y190 AromaticContact CE3-CG 3.57Å; W175-Y190 HydrophobicContact CE3-CG 3.57Å; W175-Y190 HydrophobicContact CH2-CD1 4.44Å; W175-Y190 HydrophobicContact CH2-CG 4.31Å; W175-Y190 AromaticContact CZ3-CD1 3.46Å; W175-Y190 HydrophobicContact CZ3-CD1 3.46Å; W175-Y190 VanDerWaalsContact CZ3-CD1 3.46Å; W175-Y190 AromaticContact CZ3-CD2 3.91Å; W175-Y190 HydrophobicContact CZ3-CD2 3.91Å; W175-Y190 HydrophobicContact CZ3-CE1 4.09Å; W175-Y190 AromaticContact CZ3-CG 3.33Å; W175-Y190 HydrophobicContact CZ3-CG 3.33Å; R186-Y190 VanDerWaalsContact O-CB 3.25Å; R186-Y190 WeakPolarHBondContact O-CB 3.23Å; R186-Y190 PolarHBondContact O-N 2.82Å; V187-Y190 PolarHBondContact O-N 3.48Å; Y190-S192 PolarHBondContact O-N 3.12Å; Y190-L193 PolarHBondContact O-N 3.45Å; Y190-Q194 HydrophobicContact CE2-CB 4.11Å; Y190-Q194 VanDerWaalsContact CZ-OE1 3.3Å; Y190-Q194 WeakPolarHBondContact O-CB 3.25Å; Y190-Q194 WeakPolarHBondContact O-CG 3.22Å; Y190-Q194 PolarHBondContact O-N 3.13Å; Y190-Q194 PolarHBondContact OH-OE1 3.43Å; Y190-I199 HydrophobicContact CD2-CD1 4.05Å; Y190-I199 HydrophobicContact CD2-CG2 4.17Å; Y190-I199 HydrophobicContact CE2-CB 4.2Å; Y190-I199 HydrophobicContact CE2-CD1 4.3Å; Y190-I199 HydrophobicContact CE2-CG2 3.93Å; Y190-V201 HydrophobicContact CD2-CG2 4.32Å; Y190-V201 HydrophobicContact CE2-CG2 3.38Å; Y190-V201 WeakPolarHBondContact OH-CG2 3.33Å; Y190-W205 AromaticContact CD1-CH2 4Å; Y190-W205 HydrophobicContact CD1-CH2 4Å; Y190-W205 HydrophobicContact CD1-CZ3 4.24Å; Y190-W205 AromaticContact CE1-CH2 3.8Å; Y190-W205 HydrophobicContact CE1-CH2 3.8Å; Y190-W205 AromaticContact CE1-CZ3 3.92Å; Y190-W205 HydrophobicContact CE1-CZ3 3.92Å
191	Q	96.9	Very high	94.7	Very high	87 Å²	87	62 Å²	62	41%	0.407	32%	0.315	S	S	.	.	H	α-helix	trans	-62.7	-33.3	-176.7	-79.5	-178.1	7	0	0	112.6	V187 D188 V189 Q194 K195	V187-Q191 HydrophobicContact CG1-CG 4.14Å; V187-Q191 VanDerWaalsContact O-CB 3.29Å; V187-Q191 WeakPolarHBondContact O-CB 3.46Å; V187-Q191 VanDerWaalsContact O-CG 3.23Å; V187-Q191 WeakPolarHBondContact O-CG 3.39Å; V187-Q191 PolarHBondContact O-N 2.54Å; D188-Q191 PolarHBondContact O-N 3.43Å; V189-Q191 PolarHBondContact O-N 3.34Å; Q191-Q194 WeakPolarHBondContact O-CG 3.43Å; Q191-K195 WeakPolarHBondContact O-CE 3.48Å
192	S	97.9	Very high	95.4	Very high	42 Å²	42	58 Å²	58	29%	0.294	30%	0.297	S	S	.	.	H	α-helix	trans	-78.1	-44.8	176.1	-58.9	0	0	0	0	111.4	D188 V189 Y190 K195 Y196	D188-S192 WeakPolarHBondContact O-CB 3.38Å; D188-S192 PolarHBondContact O-N 2.91Å; D188-S192 PolarHBondContact O-OG 3.12Å; V189-S192 PolarHBondContact O-N 3.1Å; Y190-S192 PolarHBondContact O-N 3.12Å; S192-K195 WeakPolarHBondContact O-CB 3.47Å; S192-K195 PolarHBondContact O-N 2.68Å; S192-Y196 WeakPolarHBondContact O-CD2 3.23Å
193	L	98.6	Very high	96.1	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-68.9	-36.9	-174.5	-173.7	62.1	0	0	0	112.7	V189 Y190 K195 Y196 I197 I199 L226 I280 L283 A284 L287	V189-L193 WeakPolarHBondContact O-CB 3.33Å; V189-L193 PolarHBondContact O-N 3.27Å; Y190-L193 PolarHBondContact O-N 3.45Å; L193-K195 PolarHBondContact O-N 3.41Å; L193-Y196 PolarHBondContact O-N 3.37Å; L193-I197 HydrophobicContact CD1-CD1 3.9Å; L193-I197 HydrophobicContact CD1-CG1 3.95Å; L193-I197 HydrophobicContact CD2-CD1 3.97Å; L193-I197 HydrophobicContact CG-CD1 3.73Å; L193-I197 HydrophobicContact CG-CG1 3.81Å; L193-I197 WeakPolarHBondContact O-CG1 3.48Å; L193-I197 PolarHBondContact O-N 3.47Å; L193-I199 HydrophobicContact CB-CD1 4.22Å; L193-I199 HydrophobicContact CD2-CD1 4.2Å; L193-I199 HydrophobicContact CG-CD1 4.03Å; L193-L226 HydrophobicContact CD2-CD2 4.37Å; L193-I280 HydrophobicContact CB-CG2 4.01Å; L193-I280 HydrophobicContact CD1-CG2 4.02Å; L193-L283 HydrophobicContact CD1-CD2 4.18Å; L193-L283 HydrophobicContact CD1-CG 4.19Å; L193-L283 HydrophobicContact CD2-CD2 4.18Å; L193-A284 HydrophobicContact CD1-CB 3.89Å; L193-L287 HydrophobicContact CD1-CD1 4.49Å; L193-L287 HydrophobicContact CD2-CD1 4.41Å
194	Q	98.1	Very high	96.7	Very high	86 Å²	86	54 Å²	54	40%	0.402	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-14.2	178.5	70	176.8	-27.3	0	0	114.1	Y190 Q191 Y196 I199	Y190-Q194 HydrophobicContact CE2-CB 4.11Å; Y190-Q194 VanDerWaalsContact CZ-OE1 3.3Å; Y190-Q194 WeakPolarHBondContact O-CB 3.25Å; Y190-Q194 WeakPolarHBondContact O-CG 3.22Å; Y190-Q194 PolarHBondContact O-N 3.13Å; Y190-Q194 PolarHBondContact OH-OE1 3.43Å; Q191-Q194 WeakPolarHBondContact O-CG 3.43Å; Q194-Y196 VanDerWaalsContact C-N 3.29Å; Q194-I199 HydrophobicContact CB-CD1 3.93Å
195	K	98.4	Very high	96.7	Very high	158 Å²	158	55.9 Å²	55.9	69%	0.687	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-21	176	-59.3	176.5	-175.6	175.2	0	112.3	Q191 S192 L193	Q191-K195 WeakPolarHBondContact O-CE 3.48Å; S192-K195 WeakPolarHBondContact O-CB 3.47Å; S192-K195 PolarHBondContact O-N 2.68Å; L193-K195 PolarHBondContact O-N 3.41Å
196	Y	98.5	Very high	96.6	Very high	121 Å²	121	57.1 Å²	57.1	48%	0.475	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115	-22.9	-172.7	-57.4	-74.8	0	0	0	113.3	S192 L193 Q194 I280 V281 A284	S192-Y196 WeakPolarHBondContact O-CD2 3.23Å; L193-Y196 PolarHBondContact O-N 3.37Å; Q194-Y196 VanDerWaalsContact C-N 3.29Å; Y196-I280 HydrophobicContact CD2-CG2 4.1Å; Y196-I280 HydrophobicContact CE2-CG2 4.21Å; Y196-V281 HydrophobicContact CE1-CG2 4.06Å; Y196-V281 HydrophobicContact CE2-CG2 4.01Å; Y196-A284 VanDerWaalsContact CB-CB 3.44Å; Y196-A284 HydrophobicContact CD2-CB 4.46Å; Y196-A284 HydrophobicContact CG-CB 4.13Å
197	I	98.4	Very high	96.6	Very high	5 Å²	5	65.7 Å²	65.7	3%	0.026	31%	0.306	C	S	.	.	S	Bend	trans	-139.2	150.5	178.4	55.9	162	0	0	0	111.7	F172 L193 I199 A284 L287	F172-I197 HydrophobicContact CD1-CB 4.01Å; F172-I197 HydrophobicContact CD1-CD1 4.06Å; F172-I197 HydrophobicContact CD1-CG2 4.46Å; F172-I197 HydrophobicContact CE1-CB 3.67Å; F172-I197 HydrophobicContact CE1-CD1 3.6Å; F172-I197 HydrophobicContact CE1-CG1 4.25Å; F172-I197 HydrophobicContact CE1-CG2 3.68Å; F172-I197 HydrophobicContact CZ-CB 4.24Å; F172-I197 HydrophobicContact CZ-CG2 3.79Å; L193-I197 HydrophobicContact CD1-CD1 3.9Å; L193-I197 HydrophobicContact CD1-CG1 3.95Å; L193-I197 HydrophobicContact CD2-CD1 3.97Å; L193-I197 HydrophobicContact CG-CD1 3.73Å; L193-I197 HydrophobicContact CG-CG1 3.81Å; L193-I197 WeakPolarHBondContact O-CG1 3.48Å; L193-I197 PolarHBondContact O-N 3.47Å; I197-I199 HydrophobicContact CD1-CD1 4.38Å; I197-I199 HydrophobicContact CD1-CG1 4.25Å; I197-I199 HydrophobicContact CG1-CD1 4.26Å; I197-I199 HydrophobicContact CG1-CG1 4.17Å; I197-I199 PolarHBondContact O-N 3.06Å; I197-A284 HydrophobicContact CG2-CB 4.25Å; I197-L287 HydrophobicContact CD1-CD1 3.66Å
198	P	98.3	Very high	96.6	Very high	86 Å²	86	71.8 Å²	71.8	56%	0.558	33%	0.333	S	S	*	.			trans	-73.9	126.5	176.8	21	-20.2	0	0	0	111.6	F172 A173	F172-P198 HydrophobicContact CB-CB 4.46Å; F172-P198 HydrophobicContact CB-CG 3.66Å; F172-P198 HydrophobicContact CD2-CG 4.5Å; F172-P198 HydrophobicContact CG-CG 4.04Å; A173-P198 PolarHBondContact N-O 3.15Å
199	I	98.5	Very high	96.6	Very high	24 Å²	24	72.2 Å²	72.2	12%	0.123	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	118.4	179.8	-56.5	167.1	0	0	0	110	A173 W175 Y190 L193 Q194 I197 V201 L226	A173-I199 HydrophobicContact CB-CG1 4.17Å; A173-I199 WeakPolarHBondContact O-CA 3.48Å; W175-I199 HydrophobicContact CB-CG2 4.27Å; Y190-I199 HydrophobicContact CD2-CD1 4.05Å; Y190-I199 HydrophobicContact CD2-CG2 4.17Å; Y190-I199 HydrophobicContact CE2-CB 4.2Å; Y190-I199 HydrophobicContact CE2-CD1 4.3Å; Y190-I199 HydrophobicContact CE2-CG2 3.93Å; L193-I199 HydrophobicContact CB-CD1 4.22Å; L193-I199 HydrophobicContact CD2-CD1 4.2Å; L193-I199 HydrophobicContact CG-CD1 4.03Å; Q194-I199 HydrophobicContact CB-CD1 3.93Å; I197-I199 HydrophobicContact CD1-CD1 4.38Å; I197-I199 HydrophobicContact CD1-CG1 4.25Å; I197-I199 HydrophobicContact CG1-CD1 4.26Å; I197-I199 HydrophobicContact CG1-CG1 4.17Å; I197-I199 PolarHBondContact O-N 3.06Å; I199-V201 HydrophobicContact CG2-CG2 4.07Å; I199-L226 HydrophobicContact CD1-CD1 4.02Å; I199-L226 HydrophobicContact CG2-CD1 3.9Å
200	Q	98.1	Very high	96.4	Very high	82 Å²	82	73.7 Å²	73.7	38%	0.383	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	117.2	174.4	-60.4	-173.7	18.6	0	0	110.5	A173 S174 W175 Y202	A173-Q200 PolarHBondContact O-N 3.09Å; S174-Q200 CarbonylContact C-O 3.53Å; S174-Q200 WeakPolarHBondContact CA-O 3.07Å; W175-Q200 PolarHBondContact N-O 3.15Å; Q200-Y202 HydrophobicContact CB-CE2 3.81Å; Q200-Y202 PolarHBondContact OE1-OH 3.04Å
201	V	97.7	Very high	96.2	Very high	15 Å²	15	76.8 Å²	76.8	9%	0.091	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	131.5	-177.4	-169	0	0	0	0	112	W175 V177 Y190 I199 W205 K206	W175-V201 HydrophobicContact CB-CG2 4.43Å; W175-V201 HydrophobicContact CE3-CG1 4.04Å; W175-V201 HydrophobicContact CE3-CG2 4.27Å; W175-V201 VanDerWaalsContact O-CA 3.31Å; W175-V201 WeakPolarHBondContact O-CA 3.11Å; V177-V201 HydrophobicContact CG1-CG1 3.88Å; Y190-V201 HydrophobicContact CD2-CG2 4.32Å; Y190-V201 HydrophobicContact CE2-CG2 3.38Å; Y190-V201 WeakPolarHBondContact OH-CG2 3.33Å; I199-V201 HydrophobicContact CG2-CG2 4.07Å; V201-W205 HydrophobicContact CG1-CE3 4.18Å; V201-W205 HydrophobicContact CG1-CZ3 4.22Å; V201-K206 HydrophobicContact CB-CG 3.95Å; V201-K206 HydrophobicContact CG1-CB 4.29Å; V201-K206 HydrophobicContact CG1-CG 3.48Å; V201-K206 VanDerWaalsContact CG1-CG 3.48Å
202	Y	97.4	Very high	95.9	Very high	52 Å²	52	77.6 Å²	77.6	20%	0.204	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	173.8	178.6	-58	-88	0	0	0	111.4	W175 V176 V177 Q200 K208 L210 T218	W175-Y202 PolarHBondContact O-N 2.74Å; V176-Y202 HydrophobicContact CG2-CD2 4.49Å; V177-Y202 PolarHBondContact N-O 3.32Å; Q200-Y202 HydrophobicContact CB-CE2 3.81Å; Q200-Y202 PolarHBondContact OE1-OH 3.04Å; Y202-K208 HydrophobicContact CD1-CB 4.45Å; Y202-L210 HydrophobicContact CD1-CD1 4.02Å; Y202-L210 HydrophobicContact CD1-CD2 3.99Å; Y202-L210 HydrophobicContact CD1-CG 4.06Å; Y202-L210 HydrophobicContact CD2-CD1 4.21Å; Y202-L210 HydrophobicContact CE1-CD2 4.47Å; Y202-L210 HydrophobicContact CG-CD1 3.68Å; Y202-L210 HydrophobicContact CG-CD2 4.5Å; Y202-L210 HydrophobicContact CG-CG 4.13Å; Y202-T218 HydrophobicContact CD2-CG2 4.2Å; Y202-T218 HydrophobicContact CE1-CG2 4.12Å; Y202-T218 HydrophobicContact CE2-CG2 3.67Å
203	G	95.3	Very high	95.8	Very high	2 Å²	2	81.4 Å²	81.4	2%	0.021	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	100.2	177.6	179.7	0	0	0	0	0	113.4	V177 W205 K206 K207 K208	V177-G203 CarbonylContact O-C 3.39Å; V177-G203 WeakPolarHBondContact O-CA 3.25Å; G203-W205 PolarHBondContact O-N 2.75Å; G203-K206 PolarHBondContact O-N 2.84Å; G203-K207 PolarHBondContact O-N 3.45Å; G203-K208 WeakPolarHBondContact CA-O 3.45Å; G203-K208 PolarHBondContact N-O 3.36Å; G203-K208 CarbonylContact O-C 3.55Å; G203-K208 PolarHBondContact O-N 3.29Å
204	K	93.5	Very high	95.7	Very high	153 Å²	153	87.4 Å²	87.4	67%	0.665	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-60.8	-32.2	-175	-66.5	-178.2	178.2	-178.2	0	112.6	V177 S178 K206 K207	V177-K204 PolarHBondContact O-N 2.87Å; S178-K204 WeakPolarHBondContact O-CB 2.83Å; K204-K206 VanDerWaalsContact C-N 3.26Å; K204-K206 PolarHBondContact O-N 3.41Å; K204-K207 PolarHBondContact O-N 3.25Å; K204-K207 VanDerWaalsContact O-N 3.07Å
205	W	92	Very high	95.6	Very high	75 Å²	75	84 Å²	84	28%	0.284	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-62	-32.5	-179.4	-178.6	63	0	0	0	113.1	W175 V177 S178 V187 Y190 V201 G203	W175-W205 HydrophobicContact CE3-CZ3 4.12Å; W175-W205 HydrophobicContact CH2-CH2 4.45Å; W175-W205 HydrophobicContact CH2-CZ3 4.08Å; W175-W205 HydrophobicContact CZ3-CE3 4.1Å; W175-W205 AromaticContact CZ3-CH2 3.95Å; W175-W205 HydrophobicContact CZ3-CH2 3.95Å; W175-W205 AromaticContact CZ3-CZ3 3.4Å; W175-W205 HydrophobicContact CZ3-CZ3 3.4Å; V177-W205 HydrophobicContact CG1-CB 4.17Å; V177-W205 HydrophobicContact CG1-CD2 4.22Å; V177-W205 HydrophobicContact CG1-CE3 3.49Å; V177-W205 VanDerWaalsContact CG1-CE3 3.49Å; V177-W205 HydrophobicContact CG1-CZ3 4.23Å; V177-W205 HydrophobicContact CG2-CB 4.34Å; V177-W205 WeakPolarHBondContact O-CB 3.25Å; V177-W205 PolarHBondContact O-N 3.44Å; S178-W205 PolarHBondContact O-N 3.17Å; V187-W205 HydrophobicContact CG1-CZ2 4.35Å; V187-W205 HydrophobicContact CG2-CZ2 4.5Å; Y190-W205 AromaticContact CD1-CH2 4Å; Y190-W205 HydrophobicContact CD1-CH2 4Å; Y190-W205 HydrophobicContact CD1-CZ3 4.24Å; Y190-W205 AromaticContact CE1-CH2 3.8Å; Y190-W205 HydrophobicContact CE1-CH2 3.8Å; Y190-W205 AromaticContact CE1-CZ3 3.92Å; Y190-W205 HydrophobicContact CE1-CZ3 3.92Å; V201-W205 HydrophobicContact CG1-CE3 4.18Å; V201-W205 HydrophobicContact CG1-CZ3 4.22Å; G203-W205 PolarHBondContact O-N 2.75Å
206	K	91.5	Very high	95.5	Very high	92 Å²	92	78.5 Å²	78.5	40%	0.4	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-102.7	15.3	175.5	-74.8	-64.4	-170.8	176.8	0	113.9	V201 G203 K204 K208	V201-K206 HydrophobicContact CB-CG 3.95Å; V201-K206 HydrophobicContact CG1-CB 4.29Å; V201-K206 HydrophobicContact CG1-CG 3.48Å; V201-K206 VanDerWaalsContact CG1-CG 3.48Å; G203-K206 PolarHBondContact O-N 2.84Å; K204-K206 VanDerWaalsContact C-N 3.26Å; K204-K206 PolarHBondContact O-N 3.41Å; K206-K208 PolarHBondContact O-N 3.21Å; K206-K208 VanDerWaalsContact O-N 3.15Å
207	K	93.9	Very high	95.3	Very high	193 Å²	193	75.5 Å²	75.5	84%	0.839	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	31.9	-175.3	-56.5	-179.3	179.2	-179.8	0	113	G203 K204 P209	G203-K207 PolarHBondContact O-N 3.45Å; K204-K207 PolarHBondContact O-N 3.25Å; K204-K207 VanDerWaalsContact O-N 3.07Å; K207-P209 VanDerWaalsContact C-CD 3.45Å
208	K	95.6	Very high	95.3	Very high	129 Å²	129	75.8 Å²	75.8	56%	0.561	37%	0.374	S	S	*	.	B	Isolated β-bridge	trans	-126.2	60.2	177.9	-70.9	-178	-179.9	-175.9	0	109.9	Y202 G203 K206	Y202-K208 HydrophobicContact CD1-CB 4.45Å; G203-K208 WeakPolarHBondContact CA-O 3.45Å; G203-K208 PolarHBondContact N-O 3.36Å; G203-K208 CarbonylContact O-C 3.55Å; G203-K208 PolarHBondContact O-N 3.29Å; K206-K208 PolarHBondContact O-N 3.21Å; K206-K208 VanDerWaalsContact O-N 3.15Å
209	P	94.5	Very high	95.2	Very high	89 Å²	89	71.7 Å²	71.7	58%	0.578	35%	0.348	S	S	*	.			trans	-58.3	142.3	-176.8	27.8	-35.1	0	0	0	110.9	K207	K207-P209 VanDerWaalsContact C-CD 3.45Å
210	L	93.6	Very high	95.1	Very high	47 Å²	47	72.8 Å²	72.8	25%	0.246	36%	0.358	C	S	.	.			trans	-109.1	126.2	173	-73.5	174.9	0	0	0	109.3	V176 Y202 L215 T218	V176-L210 HydrophobicContact CG1-CD1 4.34Å; V176-L210 HydrophobicContact CG2-CD1 3.93Å; Y202-L210 HydrophobicContact CD1-CD1 4.02Å; Y202-L210 HydrophobicContact CD1-CD2 3.99Å; Y202-L210 HydrophobicContact CD1-CG 4.06Å; Y202-L210 HydrophobicContact CD2-CD1 4.21Å; Y202-L210 HydrophobicContact CE1-CD2 4.47Å; Y202-L210 HydrophobicContact CG-CD1 3.68Å; Y202-L210 HydrophobicContact CG-CD2 4.5Å; Y202-L210 HydrophobicContact CG-CG 4.13Å; L210-L215 HydrophobicContact CD1-CD1 4.18Å; L210-T218 HydrophobicContact CD1-CG2 4.04Å; L210-T218 HydrophobicContact CD2-CG2 4.42Å
211	P	93.4	Very high	95	Very high	75 Å²	75	73.7 Å²	73.7	49%	0.487	36%	0.361	S	S	.	.			trans	-57.5	153.7	164.4	-26.1	36.9	0	0	0	111.8	D213 R214 L215	P211-D213 WeakPolarHBondContact CB-OD1 3.23Å; P211-D213 PolarHBondContact O-N 3.23Å; P211-R214 HydrophobicContact CB-CB 4.3Å; P211-R214 HydrophobicContact CB-CG 4.14Å; P211-R214 HydrophobicContact CG-CG 4.3Å; P211-R214 PolarHBondContact O-N 2.7Å; P211-R214 VanDerWaalsContact O-N 3.09Å; P211-L215 PolarHBondContact O-N 2.63Å; P211-L215 VanDerWaalsContact O-N 3.17Å
212	D	90.8	Very high	95	Very high	104 Å²	104	73 Å²	73	56%	0.556	36%	0.357	S	S	*	.	H	α-helix	trans	-64.5	-39.8	-173.8	-167.4	52.2	0	0	0	112.9	R214 L215 R243	D212-R214 PolarHBondContact O-N 3.05Å; D212-L215 WeakPolarHBondContact O-CB 3.33Å; D212-L215 PolarHBondContact O-N 3.33Å; D212-R243 IonicContact OD1-CZ 2.75Å; D212-R243 IonicContact OD1-NH1 3.37Å; D212-R243 PolarHBondContact OD1-NH1 2.88Å; D212-R243 VanDerWaalsContact OD1-NH1 3.13Å; D212-R243 IonicContact OD1-NH2 3.84Å; D212-R243 PolarHBondContact OD1-NH2 3.32Å; D212-R243 IonicContact OD2-NH2 3.69Å; D212-R243 PolarHBondContact OD2-NH2 3.35Å; D212-R243 VanDerWaalsContact OD2-NH2 3.15Å
213	D	94.9	Very high	95	Very high	122 Å²	122	71.2 Å²	71.2	65%	0.652	35%	0.35	S	S	*	.	H	α-helix	trans	-66.5	-21.3	175.1	67.1	-44.4	0	0	0	113.2	P211 P217	P211-D213 WeakPolarHBondContact CB-OD1 3.23Å; P211-D213 PolarHBondContact O-N 3.23Å; D213-P217 WeakPolarHBondContact O-CD 3.44Å; D213-P217 WeakPolarHBondContact O-CG 3.41Å
214	R	96.6	Very high	95.2	Very high	125 Å²	125	71.1 Å²	71.1	47%	0.472	35%	0.349	S	S	.	.	H	α-helix	trans	-95.1	-9.4	177.8	-62.7	-62.6	-64.1	-174.1	-7.8	113.5	P211 D212 T218	P211-R214 HydrophobicContact CB-CB 4.3Å; P211-R214 HydrophobicContact CB-CG 4.14Å; P211-R214 HydrophobicContact CG-CG 4.3Å; P211-R214 PolarHBondContact O-N 2.7Å; P211-R214 VanDerWaalsContact O-N 3.09Å; D212-R214 PolarHBondContact O-N 3.05Å; R214-T218 VanDerWaalsContact O-CB 3.26Å; R214-T218 WeakPolarHBondContact O-CB 3.43Å; R214-T218 PolarHBondContact O-N 2.81Å; R214-T218 VanDerWaalsContact O-N 3.13Å; R214-T218 PolarHBondContact O-OG1 2.68Å
215	L	96.2	Very high	95.5	Very high	16 Å²	16	63.9 Å²	63.9	8%	0.084	32%	0.318	C	S	.	.	H	α-helix	trans	-63.2	-63.1	-174.3	-174	71.8	0	0	0	112	V176 L210 P211 D212 T218 I219 N244	V176-L215 HydrophobicContact CB-CD1 4.19Å; V176-L215 HydrophobicContact CG1-CD1 3.76Å; V176-L215 HydrophobicContact CG2-CD1 3.91Å; L210-L215 HydrophobicContact CD1-CD1 4.18Å; P211-L215 PolarHBondContact O-N 2.63Å; P211-L215 VanDerWaalsContact O-N 3.17Å; D212-L215 WeakPolarHBondContact O-CB 3.33Å; D212-L215 PolarHBondContact O-N 3.33Å; L215-T218 PolarHBondContact O-N 2.77Å; L215-T218 VanDerWaalsContact O-N 3.17Å; L215-I219 HydrophobicContact CD1-CD1 3.99Å; L215-I219 HydrophobicContact CG-CD1 3.9Å; L215-I219 WeakPolarHBondContact O-CG1 3.5Å; L215-I219 PolarHBondContact O-N 3.28Å; L215-N244 VanDerWaalsContact CD2-OD1 3.23Å; L215-N244 WeakPolarHBondContact CD2-OD1 3.42Å
216	L	96.3	Very high	95.8	Very high	41 Å²	41	60.3 Å²	60.3	22%	0.215	30%	0.304	C	S	.	.	H	α-helix	trans	-63.5	-43	-177.4	-54.4	-178.4	0	0	0	112.4	T218 I219 S220 R243 Q247 A248	L216-T218 PolarHBondContact O-N 2.8Å; L216-I219 PolarHBondContact O-N 2.82Å; L216-S220 WeakPolarHBondContact O-CB 3.45Å; L216-S220 PolarHBondContact O-N 3.37Å; L216-S220 PolarHBondContact O-OG 3.05Å; L216-R243 HydrophobicContact CD2-CG 4.22Å; L216-R243 VanDerWaalsContact CD2-O 3.24Å; L216-R243 WeakPolarHBondContact CD2-O 3.27Å; L216-Q247 HydrophobicContact CD1-CB 4.05Å; L216-A248 HydrophobicContact CB-CB 4.45Å; L216-A248 HydrophobicContact CD2-CB 4.25Å
217	P	95.9	Very high	96.1	Very high	58 Å²	58	56 Å²	56	38%	0.377	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-21.9	175.4	-25.2	35.9	0	0	0	114.9	D213 S220 K221	D213-P217 WeakPolarHBondContact O-CD 3.44Å; D213-P217 WeakPolarHBondContact O-CG 3.41Å; P217-S220 PolarHBondContact O-OG 3.29Å; P217-K221 WeakPolarHBondContact O-CE 3.24Å
218	T	96.9	Very high	96.3	Very high	11 Å²	11	46.8 Å²	46.8	7%	0.067	25%	0.245	C	C	.	.	H	α-helix	trans	-80.8	-46.3	174.4	-60	0	0	0	0	110.3	Y202 L210 R214 L215 L216 S220 K221	Y202-T218 HydrophobicContact CD2-CG2 4.2Å; Y202-T218 HydrophobicContact CE1-CG2 4.12Å; Y202-T218 HydrophobicContact CE2-CG2 3.67Å; L210-T218 HydrophobicContact CD1-CG2 4.04Å; L210-T218 HydrophobicContact CD2-CG2 4.42Å; R214-T218 VanDerWaalsContact O-CB 3.26Å; R214-T218 WeakPolarHBondContact O-CB 3.43Å; R214-T218 PolarHBondContact O-N 2.81Å; R214-T218 VanDerWaalsContact O-N 3.13Å; R214-T218 PolarHBondContact O-OG1 2.68Å; L215-T218 PolarHBondContact O-N 2.77Å; L215-T218 VanDerWaalsContact O-N 3.17Å; L216-T218 PolarHBondContact O-N 2.8Å; T218-S220 VanDerWaalsContact C-N 3.35Å; T218-S220 PolarHBondContact O-N 3.36Å; T218-K221 WeakPolarHBondContact O-CB 3.46Å; T218-K221 PolarHBondContact O-N 3.24Å
219	I	97.4	Very high	96.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.4	-38.9	-179.6	-64.3	168.6	0	0	0	111	V176 L215 L216 K221 C222 Y225 N244 A248 T250	V176-I219 HydrophobicContact CG2-CD1 4.16Å; V176-I219 HydrophobicContact CG2-CG1 4.15Å; L215-I219 HydrophobicContact CD1-CD1 3.99Å; L215-I219 HydrophobicContact CG-CD1 3.9Å; L215-I219 WeakPolarHBondContact O-CG1 3.5Å; L215-I219 PolarHBondContact O-N 3.28Å; L216-I219 PolarHBondContact O-N 2.82Å; I219-K221 PolarHBondContact O-N 2.87Å; I219-C222 WeakPolarHBondContact O-CB 3.42Å; I219-C222 PolarHBondContact O-N 3.28Å; I219-Y225 HydrophobicContact CB-CD2 4.32Å; I219-Y225 HydrophobicContact CD1-CD2 3.85Å; I219-Y225 HydrophobicContact CD1-CE2 3.45Å; I219-Y225 VanDerWaalsContact CD1-CE2 3.45Å; I219-Y225 HydrophobicContact CG1-CD2 3.84Å; I219-Y225 HydrophobicContact CG1-CE2 3.8Å; I219-Y225 HydrophobicContact CG2-CD2 3.53Å; I219-Y225 HydrophobicContact CG2-CE2 4.29Å; I219-Y225 HydrophobicContact CG2-CG 3.87Å; I219-N244 HydrophobicContact CD1-CB 3.78Å; I219-N244 WeakPolarHBondContact CG2-O 3.39Å; I219-A248 HydrophobicContact CB-CB 3.83Å; I219-A248 HydrophobicContact CG2-CB 3.58Å; I219-T250 HydrophobicContact CG2-CG2 3.63Å; I219-T250 WeakPolarHBondContact O-CG2 3Å
220	S	95.9	Very high	96.3	Very high	47 Å²	47	37.8 Å²	37.8	33%	0.329	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-12.7	-178.8	67.8	0	0	0	0	114.3	R169 L216 P217 T218 C222 A248	R169-S220 PolarHBondContact NH1-O 2.93Å; L216-S220 WeakPolarHBondContact O-CB 3.45Å; L216-S220 PolarHBondContact O-N 3.37Å; L216-S220 PolarHBondContact O-OG 3.05Å; P217-S220 PolarHBondContact O-OG 3.29Å; T218-S220 VanDerWaalsContact C-N 3.35Å; T218-S220 PolarHBondContact O-N 3.36Å; S220-C222 VanDerWaalsContact C-N 3.27Å; S220-A248 WeakPolarHBondContact CA-O 3.35Å; S220-A248 VanDerWaalsContact CB-O 3.25Å; S220-A248 WeakPolarHBondContact CB-O 3.33Å
221	K	96.2	Very high	96.2	Very high	102 Å²	102	36.6 Å²	36.6	44%	0.443	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-10.7	172.9	-63.6	176.8	-177	-177.9	0	113.3	R169 S170 C171 P217 T218 I219	R169-K221 VanDerWaalsContact CB-O 3.3Å; R169-K221 WeakPolarHBondContact CB-O 3.45Å; S170-K221 PolarHBondContact N-O 3.34Å; C171-K221 WeakPolarHBondContact CB-O 3.31Å; C171-K221 PolarHBondContact N-O 3.06Å; P217-K221 WeakPolarHBondContact O-CE 3.24Å; T218-K221 WeakPolarHBondContact O-CB 3.46Å; T218-K221 PolarHBondContact O-N 3.24Å; I219-K221 PolarHBondContact O-N 2.87Å
222	C	97.7	Very high	96.2	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.007	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	149.8	-176.7	-56.1	0	0	0	0	112.1	R169 C171 S174 I219 S220 F224 T250	R169-C222 WeakPolarHBondContact CD-O 3.44Å; R169-C222 PolarHBondContact NH1-O 3.19Å; C171-C222 HydrophobicContact CB-CB 3.75Å; C171-C222 WeakPolarHBondContact CB-SG 3.47Å; C171-C222 CarbonylContact O-C 3.45Å; C171-C222 WeakPolarHBondContact O-CA 3.23Å; C171-C222 WeakPolarHBondContact SG-CB 3.25Å; C171-C222 CovalentContact SG-SG 2.04Å; C171-C222 PolarHBondContact SG-SG 2.82Å; S174-C222 WeakPolarHBondContact CB-SG 2.96Å; S174-C222 PolarHBondContact OG-SG 3.31Å; S174-C222 VanDerWaalsContact OG-SG 3.39Å; I219-C222 WeakPolarHBondContact O-CB 3.42Å; I219-C222 PolarHBondContact O-N 3.28Å; S220-C222 VanDerWaalsContact C-N 3.27Å; C222-F224 WeakPolarHBondContact CB-O 3.31Å; C222-T250 VanDerWaalsContact O-CG2 3.31Å; C222-T250 WeakPolarHBondContact O-CG2 3.23Å
223	L	97.9	Very high	96.4	Very high	14 Å²	14	34.1 Å²	34.1	7%	0.073	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	-46.6	171.2	-63.1	169.4	0	0	0	110.6	R169 C171 F172 I251 A291 Y297	R169-L223 HydrophobicContact CB-CD2 3.9Å; R169-L223 HydrophobicContact CB-CG 4.12Å; R169-L223 HydrophobicContact CG-CD2 4.06Å; C171-L223 PolarHBondContact O-N 3.17Å; F172-L223 WeakPolarHBondContact O-CB 3.34Å; F172-L223 PolarHBondContact O-N 3.05Å; F172-L223 VanDerWaalsContact O-N 3.08Å; L223-I251 PolarHBondContact O-N 2.9Å; L223-A291 HydrophobicContact CD1-CB 3.71Å; L223-Y297 HydrophobicContact CB-CE2 4Å; L223-Y297 HydrophobicContact CD2-CD2 4.23Å; L223-Y297 HydrophobicContact CD2-CE2 3.58Å; L223-Y297 HydrophobicContact CG-CE2 4.39Å
224	F	98.7	Very high	96.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	149.2	-177.1	-53	-77.9	0	0	0	112.1	F172 A173 S174 C222 I251 V253 I272 L287 V290 A291	F172-F224 HydrophobicContact CD1-CD2 4.07Å; F172-F224 HydrophobicContact CD1-CE2 4.44Å; F172-F224 AromaticContact CE1-CD2 3.82Å; F172-F224 HydrophobicContact CE1-CD2 3.82Å; F172-F224 AromaticContact CE1-CE2 3.88Å; F172-F224 HydrophobicContact CE1-CE2 3.88Å; F172-F224 HydrophobicContact CE2-CE2 4.48Å; F172-F224 HydrophobicContact CZ-CD2 4.32Å; F172-F224 AromaticContact CZ-CE2 3.92Å; F172-F224 HydrophobicContact CZ-CE2 3.92Å; F172-F224 WeakPolarHBondContact O-CD2 3.39Å; F172-F224 PolarHBondContact O-N 3.15Å; A173-F224 VanDerWaalsContact CA-O 3.3Å; A173-F224 WeakPolarHBondContact CA-O 3.22Å; A173-F224 HydrophobicContact CB-CB 4.03Å; S174-F224 PolarHBondContact N-O 2.81Å; C222-F224 WeakPolarHBondContact CB-O 3.31Å; F224-I251 VanDerWaalsContact CA-O 3.31Å; F224-I251 WeakPolarHBondContact CA-O 3.45Å; F224-I251 HydrophobicContact CD1-CB 3.78Å; F224-I251 HydrophobicContact CD1-CG2 4.08Å; F224-I251 HydrophobicContact CE1-CB 4.09Å; F224-I251 HydrophobicContact CE1-CD1 4.01Å; F224-I251 HydrophobicContact CE1-CG2 4.23Å; F224-V253 HydrophobicContact CB-CG2 4.1Å; F224-V253 HydrophobicContact CD1-CG2 4.11Å; F224-V253 HydrophobicContact CG-CG2 4.36Å; F224-I272 HydrophobicContact CD1-CD1 4.33Å; F224-I272 HydrophobicContact CE1-CD1 3.93Å; F224-L287 HydrophobicContact CD1-CD2 3.76Å; F224-L287 HydrophobicContact CD2-CD2 4.45Å; F224-L287 HydrophobicContact CE1-CD2 3.64Å; F224-L287 HydrophobicContact CE2-CB 4.26Å; F224-L287 HydrophobicContact CE2-CD2 4.34Å; F224-L287 HydrophobicContact CG-CD2 4.19Å; F224-L287 HydrophobicContact CZ-CB 4.33Å; F224-L287 HydrophobicContact CZ-CD2 3.95Å; F224-L287 WeakPolarHBondContact CZ-O 3.47Å; F224-V290 HydrophobicContact CE1-CB 4.44Å; F224-V290 HydrophobicContact CE1-CG1 3.99Å; F224-V290 HydrophobicContact CZ-CB 4.04Å; F224-V290 HydrophobicContact CZ-CG1 3.88Å; F224-A291 HydrophobicContact CE2-CB 4.13Å; F224-A291 HydrophobicContact CZ-CB 4.49Å
225	Y	98.8	Very high	96.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	128.8	166.5	179.7	-102.8	0	0	0	109.7	V176 I219 S227 K240 N244 A245 T250 I251 P252 V253	V176-Y225 HydrophobicContact CB-CE2 4.27Å; V176-Y225 HydrophobicContact CG2-CE2 3.95Å; I219-Y225 HydrophobicContact CB-CD2 4.32Å; I219-Y225 HydrophobicContact CD1-CD2 3.85Å; I219-Y225 HydrophobicContact CD1-CE2 3.45Å; I219-Y225 VanDerWaalsContact CD1-CE2 3.45Å; I219-Y225 HydrophobicContact CG1-CD2 3.84Å; I219-Y225 HydrophobicContact CG1-CE2 3.8Å; I219-Y225 HydrophobicContact CG2-CD2 3.53Å; I219-Y225 HydrophobicContact CG2-CE2 4.29Å; I219-Y225 HydrophobicContact CG2-CG 3.87Å; Y225-S227 VanDerWaalsContact CD1-OG 3.29Å; Y225-S227 WeakPolarHBondContact CD1-OG 3.43Å; Y225-S227 PolarHBondContact O-N 3.45Å; Y225-K240 HydrophobicContact CE1-CB 4.28Å; Y225-K240 WeakPolarHBondContact CE1-O 3.45Å; Y225-N244 HydrophobicContact CD1-CB 4.25Å; Y225-N244 HydrophobicContact CE1-CB 3.53Å; Y225-N244 HydrophobicContact CE2-CB 4.37Å; Y225-N244 PolarHBondContact OH-ND2 3.42Å; Y225-A245 HydrophobicContact CD1-CB 3.86Å; Y225-A245 HydrophobicContact CG-CB 4.45Å; Y225-T250 VanDerWaalsContact CB-OG1 3.28Å; Y225-T250 WeakPolarHBondContact CB-OG1 3.44Å; Y225-I251 PolarHBondContact N-O 3.26Å; Y225-P252 WeakPolarHBondContact O-CA 3.4Å; Y225-V253 PolarHBondContact O-N 2.81Å
226	L	98.8	Very high	96.6	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	92.9	176	-55.8	-169	0	0	0	109.3	S174 W175 L193 I199 F228 V253	S174-L226 PolarHBondContact O-N 3.13Å; W175-L226 HydrophobicContact CB-CB 3.99Å; W175-L226 HydrophobicContact CB-CD1 4.05Å; W175-L226 HydrophobicContact CB-CG 4.24Å; W175-L226 HydrophobicContact CG-CB 3.98Å; W175-L226 HydrophobicContact CG-CD1 4.32Å; L193-L226 HydrophobicContact CD2-CD2 4.37Å; I199-L226 HydrophobicContact CD1-CD1 4.02Å; I199-L226 HydrophobicContact CG2-CD1 3.9Å; L226-F228 HydrophobicContact CB-CD1 4.15Å; L226-F228 HydrophobicContact CB-CD2 4.19Å; L226-F228 HydrophobicContact CB-CE1 4.04Å; L226-F228 HydrophobicContact CB-CE2 4.09Å; L226-F228 HydrophobicContact CB-CG 4.22Å; L226-F228 HydrophobicContact CB-CZ 4.02Å; L226-F228 HydrophobicContact CD1-CD2 4.46Å; L226-F228 HydrophobicContact CD1-CE2 3.78Å; L226-F228 HydrophobicContact CD1-CZ 3.96Å; L226-F228 HydrophobicContact CD2-CE1 4.23Å; L226-F228 HydrophobicContact CD2-CZ 3.93Å; L226-F228 HydrophobicContact CG-CE2 4.36Å; L226-F228 HydrophobicContact CG-CZ 4.18Å; L226-F228 PolarHBondContact O-N 2.95Å; L226-V253 HydrophobicContact CD2-CB 3.84Å; L226-V253 HydrophobicContact CD2-CG1 4.27Å; L226-V253 HydrophobicContact CD2-CG2 4.21Å
227	S	98.5	Very high	96.7	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.007	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	53.6	177.4	-65.8	0	0	0	0	111.4	Y225 E229 K240 V253	Y225-S227 VanDerWaalsContact CD1-OG 3.29Å; Y225-S227 WeakPolarHBondContact CD1-OG 3.43Å; Y225-S227 PolarHBondContact O-N 3.45Å; S227-E229 PolarHBondContact O-N 2.68Å; S227-K240 PolarHBondContact OG-O 3.12Å; S227-K240 VanDerWaalsContact OG-O 3.13Å; S227-V253 PolarHBondContact N-O 3.34Å
228	F	98.1	Very high	96.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	115.3	-174.7	-62.9	-9.2	0	0	0	111.6	R186 V189 L226 K240 V253 L255 V274	R186-F228 HydrophobicContact CB-CB 3.8Å; R186-F228 HydrophobicContact CB-CD2 4.04Å; R186-F228 HydrophobicContact CB-CG 4.31Å; V189-F228 HydrophobicContact CB-CE2 4.3Å; V189-F228 HydrophobicContact CG1-CE2 3.71Å; V189-F228 HydrophobicContact CG1-CZ 3.68Å; L226-F228 HydrophobicContact CB-CD1 4.15Å; L226-F228 HydrophobicContact CB-CD2 4.19Å; L226-F228 HydrophobicContact CB-CE1 4.04Å; L226-F228 HydrophobicContact CB-CE2 4.09Å; L226-F228 HydrophobicContact CB-CG 4.22Å; L226-F228 HydrophobicContact CB-CZ 4.02Å; L226-F228 HydrophobicContact CD1-CD2 4.46Å; L226-F228 HydrophobicContact CD1-CE2 3.78Å; L226-F228 HydrophobicContact CD1-CZ 3.96Å; L226-F228 HydrophobicContact CD2-CE1 4.23Å; L226-F228 HydrophobicContact CD2-CZ 3.93Å; L226-F228 HydrophobicContact CG-CE2 4.36Å; L226-F228 HydrophobicContact CG-CZ 4.18Å; L226-F228 PolarHBondContact O-N 2.95Å; F228-K240 WeakPolarHBondContact O-CD 3.44Å; F228-K240 WeakPolarHBondContact O-CE 3.36Å; F228-V253 WeakPolarHBondContact CD1-O 3.27Å; F228-V253 HydrophobicContact CE1-CG1 4.16Å; F228-V253 WeakPolarHBondContact CE1-O 3.22Å; F228-L255 HydrophobicContact CB-CB 4.25Å; F228-L255 HydrophobicContact CB-CD2 4.5Å; F228-L255 HydrophobicContact CD1-CB 3.5Å; F228-L255 VanDerWaalsContact CD1-CB 3.5Å; F228-L255 HydrophobicContact CD2-CD2 4.48Å; F228-L255 HydrophobicContact CE1-CB 4.01Å; F228-L255 HydrophobicContact CG-CB 3.97Å; F228-L255 HydrophobicContact CG-CD2 4.27Å; F228-V274 HydrophobicContact CE1-CG2 3.87Å; F228-V274 HydrophobicContact CZ-CG2 4.2Å
229	E	96.9	Very high	96.8	Very high	5 Å²	5	25.2 Å²	25.2	2%	0.023	13%	0.127	C	C	.	.			trans	-65.9	153.7	175.7	-62	-57.2	166.7	0	0	112.2	R186 S227 S231 Y236 S238 K240 L255	R186-E229 WeakPolarHBondContact CD-O 3.41Å; S227-E229 PolarHBondContact O-N 2.68Å; E229-S231 PolarHBondContact O-N 3.12Å; E229-Y236 HydrophobicContact CB-CD1 3.95Å; E229-Y236 HydrophobicContact CB-CE1 3.97Å; E229-Y236 HydrophobicContact CG-CD1 4.02Å; E229-Y236 HydrophobicContact CG-CE1 4.16Å; E229-Y236 VanDerWaalsContact OE2-CE1 3.27Å; E229-Y236 WeakPolarHBondContact OE2-CE1 3.4Å; E229-S238 VanDerWaalsContact OE1-CB 3.23Å; E229-S238 WeakPolarHBondContact OE1-CB 3.48Å; E229-S238 PolarHBondContact OE1-N 2.97Å; E229-S238 PolarHBondContact OE1-OG 2.96Å; E229-S238 VanDerWaalsContact OE2-CB 3.29Å; E229-S238 WeakPolarHBondContact OE2-CB 3.34Å; E229-S238 PolarHBondContact OE2-OG 2.63Å; E229-K240 WeakPolarHBondContact OE2-CE 3.3Å; E229-K240 IonicContact OE2-NZ 3.48Å; E229-K240 PolarHBondContact OE2-NZ 3.37Å; E229-L255 WeakPolarHBondContact CB-O 3.4Å; E229-L255 PolarHBondContact N-O 3.47Å
230	N	92.5	Very high	96.8	Very high	24 Å²	24	26.1 Å²	26.1	13%	0.128	13%	0.131	C	C	.	.	S	Bend	trans	-71.8	-17.6	179.4	57.3	5.3	0	0	0	113	P121 N124 Q184 Y236	P121-N230 VanDerWaalsContact CG-OD1 3.31Å; P121-N230 WeakPolarHBondContact CG-OD1 3.3Å; N124-N230 PolarHBondContact ND2-ND2 3.14Å; Q184-N230 PolarHBondContact NE2-O 3.12Å; N230-Y236 WeakPolarHBondContact OD1-CE1 3.44Å
231	S	92	Very high	96.9	Very high	22 Å²	22	23.9 Å²	23.9	15%	0.154	12%	0.115	C	C	.	.	S	Bend	trans	-157.4	154.8	170.1	55.3	0	0	0	0	110.5	P121 V123 E229 A233	P121-S231 VanDerWaalsContact CB-OG 3.25Å; P121-S231 WeakPolarHBondContact CB-OG 3.31Å; P121-S231 WeakPolarHBondContact CG-OG 3.42Å; V123-S231 WeakPolarHBondContact CG2-OG 3.41Å; E229-S231 PolarHBondContact O-N 3.12Å; S231-A233 PolarHBondContact O-N 2.97Å
232	E	93.8	Very high	97	Very high	113 Å²	113	19.2 Å²	19.2	53%	0.528	10%	0.095	S	C	.	.			trans	-85	98.6	173	-59.5	165.7	-116	0	0	107.7	T185 G256	T185-E232 WeakPolarHBondContact CB-OE1 3.22Å; T185-E232 WeakPolarHBondContact CG2-OE1 3.48Å; T185-E232 PolarHBondContact OG1-OE1 3.4Å; E232-G256 WeakPolarHBondContact CG-O 3.36Å
233	A	94.6	Very high	97	Very high	14 Å²	14	21.3 Å²	21.3	12%	0.116	10%	0.102	C	C	.	.			trans	-129.7	149.7	-176.9	0	0	0	0	0	110.4	P121 S231 D235 Y236	P121-A233 HydrophobicContact CB-CB 3.9Å; S231-A233 PolarHBondContact O-N 2.97Å; A233-D235 PolarHBondContact O-N 3.24Å; A233-Y236 WeakPolarHBondContact O-CB 3.41Å; A233-Y236 PolarHBondContact O-N 3.04Å
234	K	95.8	Very high	96.9	Very high	96 Å²	96	21.1 Å²	21.1	42%	0.417	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	123.9	-179.2	-178.4	-176.6	-178	-176.9	0	110.9	Y141 D144 Y236	Y141-K234 WeakPolarHBondContact CE2-O 3.39Å; D144-K234 IonicContact OD2-NZ 3.27Å; D144-K234 PolarHBondContact OD2-NZ 3.25Å; K234-Y236 PolarHBondContact O-N 2.81Å
235	D	97.2	Very high	96.9	Very high	16 Å²	16	21.1 Å²	21.1	9%	0.086	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	6.6	-180	-55.3	-29	0	0	0	116.1	Y141 R143 A233 I237	Y141-D235 HydrophobicContact CD2-CB 4.48Å; Y141-D235 WeakPolarHBondContact CD2-O 3.02Å; R143-D235 WeakPolarHBondContact CB-OD2 3.22Å; R143-D235 HydrophobicContact CG-CB 4.46Å; R143-D235 IonicContact CZ-OD1 2.54Å; R143-D235 VanDerWaalsContact CZ-OD1 3.3Å; R143-D235 PolarHBondContact N-OD2 2.9Å; R143-D235 VanDerWaalsContact NE-CG 3.28Å; R143-D235 IonicContact NE-OD1 3.13Å; R143-D235 PolarHBondContact NE-OD1 2.93Å; R143-D235 IonicContact NE-OD2 2.63Å; R143-D235 PolarHBondContact NE-OD2 2.8Å; R143-D235 IonicContact NH2-OD1 3.52Å; R143-D235 PolarHBondContact NH2-OD1 2.59Å; A233-D235 PolarHBondContact O-N 3.24Å; D235-I237 PolarHBondContact O-N 2.69Å
236	Y	97.8	Very high	96.8	Very high	3 Å²	3	21.6 Å²	21.6	1%	0.012	10%	0.103	C	C	.	.			trans	-78.1	90.8	-174.8	-174	-116	0	0	0	111.9	P121 Y141 Y151 E229 N230 A233 K234 P257	P121-Y236 HydrophobicContact CB-CD1 4.1Å; P121-Y236 HydrophobicContact CB-CD2 4.28Å; P121-Y236 HydrophobicContact CB-CE1 4.3Å; P121-Y236 HydrophobicContact CB-CE2 4.46Å; P121-Y236 HydrophobicContact CB-CG 4.09Å; P121-Y236 HydrophobicContact CG-CD1 4.14Å; P121-Y236 HydrophobicContact CG-CE1 3.84Å; P121-Y236 HydrophobicContact CG-CE2 4.28Å; P121-Y236 HydrophobicContact CG-CG 4.49Å; Y141-Y236 AromaticContact CD1-CD2 3.78Å; Y141-Y236 HydrophobicContact CD1-CD2 3.78Å; Y141-Y236 HydrophobicContact CD1-CE2 4.22Å; Y141-Y236 AromaticContact CD2-CD2 3.92Å; Y141-Y236 HydrophobicContact CD2-CD2 3.92Å; Y141-Y236 AromaticContact CE1-CD2 3.55Å; Y141-Y236 HydrophobicContact CE1-CD2 3.55Å; Y141-Y236 HydrophobicContact CE1-CE2 4.11Å; Y141-Y236 VanDerWaalsContact CE2-CA 3.45Å; Y141-Y236 VanDerWaalsContact CE2-CB 3.49Å; Y141-Y236 AromaticContact CE2-CD2 3.69Å; Y141-Y236 HydrophobicContact CE2-CD2 3.69Å; Y141-Y236 HydrophobicContact CE2-CG 4.06Å; Y141-Y236 AromaticContact CG-CD2 3.97Å; Y141-Y236 HydrophobicContact CG-CD2 3.97Å; Y141-Y236 AromaticContact CZ-CD2 3.51Å; Y151-Y236 HydrophobicContact CE2-CE2 4.08Å; E229-Y236 HydrophobicContact CB-CD1 3.95Å; E229-Y236 HydrophobicContact CB-CE1 3.97Å; E229-Y236 HydrophobicContact CG-CD1 4.02Å; E229-Y236 HydrophobicContact CG-CE1 4.16Å; E229-Y236 VanDerWaalsContact OE2-CE1 3.27Å; E229-Y236 WeakPolarHBondContact OE2-CE1 3.4Å; N230-Y236 WeakPolarHBondContact OD1-CE1 3.44Å; A233-Y236 WeakPolarHBondContact O-CB 3.41Å; A233-Y236 PolarHBondContact O-N 3.04Å; K234-Y236 PolarHBondContact O-N 2.81Å; Y236-P257 WeakPolarHBondContact O-CD 3.42Å
237	I	98.3	Very high	96.6	Very high	9 Å²	9	25.6 Å²	25.6	5%	0.046	12%	0.122	C	C	.	.			trans	-124.4	110	175.9	-58.3	173.3	0	0	0	108.1	D235 L241 W242 P257 T261 Y262 V265	D235-I237 PolarHBondContact O-N 2.69Å; I237-L241 HydrophobicContact CG2-CB 3.79Å; I237-L241 HydrophobicContact CG2-CD2 3.35Å; I237-L241 HydrophobicContact CG2-CG 4.2Å; I237-W242 PolarHBondContact O-NE1 2.91Å; I237-P257 HydrophobicContact CD1-CG 4.15Å; I237-P257 HydrophobicContact CG1-CG 3.65Å; I237-T261 HydrophobicContact CD1-CG2 4.45Å; I237-Y262 HydrophobicContact CB-CE1 4.39Å; I237-Y262 HydrophobicContact CD1-CD1 3.57Å; I237-Y262 HydrophobicContact CD1-CD2 4.36Å; I237-Y262 HydrophobicContact CD1-CE1 3.83Å; I237-Y262 HydrophobicContact CD1-CG 3.85Å; I237-Y262 HydrophobicContact CG1-CD1 4.04Å; I237-Y262 HydrophobicContact CG1-CE1 3.74Å; I237-Y262 HydrophobicContact CG2-CD1 4.25Å; I237-Y262 HydrophobicContact CG2-CE1 3.84Å; I237-V265 HydrophobicContact CD1-CG2 3.7Å
238	S	97.8	Very high	96.5	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.125	C	C	.	.			trans	-101	-168.9	-162.3	77.3	0	0	0	0	114.4	E229 K240 L241 W242	E229-S238 VanDerWaalsContact OE1-CB 3.23Å; E229-S238 WeakPolarHBondContact OE1-CB 3.48Å; E229-S238 PolarHBondContact OE1-N 2.97Å; E229-S238 PolarHBondContact OE1-OG 2.96Å; E229-S238 VanDerWaalsContact OE2-CB 3.29Å; E229-S238 WeakPolarHBondContact OE2-CB 3.34Å; E229-S238 PolarHBondContact OE2-OG 2.63Å; S238-K240 PolarHBondContact O-N 3.29Å; S238-K240 WeakPolarHBondContact OG-CG 3.34Å; S238-K240 PolarHBondContact OG-N 2.94Å; S238-K240 PolarHBondContact OG-NZ 3.15Å; S238-L241 PolarHBondContact O-N 3.28Å; S238-W242 PolarHBondContact O-N 3.27Å
239	E	97.3	Very high	96.3	Very high	63 Å²	63	26.2 Å²	26.2	29%	0.294	13%	0.128	S	C	.	.	H	α-helix	trans	-52.4	-22.7	170.8	77.4	-66.5	153.6	0	0	113.4	Y151 R243 N244	Y151-E239 HydrophobicContact CD1-CB 4.11Å; Y151-E239 VanDerWaalsContact CD1-N 3.28Å; Y151-E239 HydrophobicContact CE1-CB 4.48Å; Y151-E239 WeakPolarHBondContact CE1-OE2 3.48Å; E239-R243 HydrophobicContact CB-CB 4.23Å; E239-R243 CarbonylContact O-C 3.47Å; E239-R243 WeakPolarHBondContact O-CA 3.46Å; E239-R243 WeakPolarHBondContact O-CB 3.43Å; E239-R243 PolarHBondContact O-N 2.88Å; E239-N244 PolarHBondContact O-N 3.4Å
240	K	98.1	Very high	96.2	Very high	18 Å²	18	26.1 Å²	26.1	8%	0.078	13%	0.127	C	C	.	.	I	π-helix	trans	-60.8	-46	179.8	-66.5	173.6	-153.6	63.4	0	112	Y225 S227 F228 E229 S238 N244 A245	Y225-K240 HydrophobicContact CE1-CB 4.28Å; Y225-K240 WeakPolarHBondContact CE1-O 3.45Å; S227-K240 PolarHBondContact OG-O 3.12Å; S227-K240 VanDerWaalsContact OG-O 3.13Å; F228-K240 WeakPolarHBondContact O-CD 3.44Å; F228-K240 WeakPolarHBondContact O-CE 3.36Å; E229-K240 WeakPolarHBondContact OE2-CE 3.3Å; E229-K240 IonicContact OE2-NZ 3.48Å; E229-K240 PolarHBondContact OE2-NZ 3.37Å; S238-K240 PolarHBondContact O-N 3.29Å; S238-K240 WeakPolarHBondContact OG-CG 3.34Å; S238-K240 PolarHBondContact OG-N 2.94Å; S238-K240 PolarHBondContact OG-NZ 3.15Å; K240-N244 WeakPolarHBondContact O-CB 3.24Å; K240-A245 PolarHBondContact O-N 3.38Å; K240-A245 VanDerWaalsContact O-N 3.07Å
241	L	98.6	Very high	96.5	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.122	C	C	.	.	I	π-helix	trans	-73.2	-56.9	173.4	-178	67.8	0	0	0	110.2	I237 S238 A245 F246 P252 V254 Y262 A266	I237-L241 HydrophobicContact CG2-CB 3.79Å; I237-L241 HydrophobicContact CG2-CD2 3.35Å; I237-L241 HydrophobicContact CG2-CG 4.2Å; S238-L241 PolarHBondContact O-N 3.28Å; L241-A245 WeakPolarHBondContact O-CB 3.32Å; L241-A245 PolarHBondContact O-N 2.97Å; L241-F246 HydrophobicContact CD1-CD2 4.48Å; L241-F246 HydrophobicContact CD1-CE1 4.18Å; L241-F246 HydrophobicContact CD1-CE2 3.84Å; L241-F246 HydrophobicContact CD1-CZ 3.67Å; L241-F246 HydrophobicContact CD2-CE2 3.94Å; L241-F246 HydrophobicContact CD2-CZ 4.3Å; L241-F246 HydrophobicContact CG-CD2 4.14Å; L241-F246 HydrophobicContact CG-CE2 3.6Å; L241-F246 HydrophobicContact CG-CZ 3.97Å; L241-F246 PolarHBondContact O-N 3.07Å; L241-F246 VanDerWaalsContact O-N 3.1Å; L241-P252 HydrophobicContact CD1-CB 3.57Å; L241-P252 HydrophobicContact CD1-CG 3.57Å; L241-V254 HydrophobicContact CD1-CG1 3.88Å; L241-Y262 HydrophobicContact CD2-CD1 4.01Å; L241-Y262 HydrophobicContact CD2-CE1 4.14Å; L241-A266 HydrophobicContact CD2-CB 4.36Å
242	W	98.1	Very high	96.9	Very high	5 Å²	5	24 Å²	24	2%	0.019	12%	0.115	C	C	.	.	I	π-helix	trans	-73.9	-50.5	-163	-62.6	110.7	0	0	0	113.8	G152 I237 S238 F246 V265 I309 T311	G152-W242 VanDerWaalsContact CA-CD2 3.49Å; G152-W242 WeakPolarHBondContact O-CZ2 3.49Å; I237-W242 PolarHBondContact O-NE1 2.91Å; S238-W242 PolarHBondContact O-N 3.27Å; W242-F246 AromaticContact CE3-CD2 3.97Å; W242-F246 HydrophobicContact CE3-CD2 3.97Å; W242-F246 HydrophobicContact CE3-CE2 4.06Å; W242-F246 HydrophobicContact CZ3-CD2 4.43Å; W242-F246 HydrophobicContact CZ3-CE2 4.17Å; W242-V265 HydrophobicContact CH2-CB 4.36Å; W242-V265 HydrophobicContact CH2-CG2 4.36Å; W242-V265 WeakPolarHBondContact CH2-O 3.5Å; W242-V265 HydrophobicContact CZ2-CB 4.22Å; W242-V265 HydrophobicContact CZ2-CG2 3.9Å; W242-I309 HydrophobicContact CE3-CD1 4.15Å; W242-I309 HydrophobicContact CE3-CG2 3.88Å; W242-I309 HydrophobicContact CZ3-CD1 3.85Å; W242-I309 HydrophobicContact CZ3-CG2 4.46Å; W242-T311 HydrophobicContact CB-CG2 4.1Å
243	R	96.7	Very high	97.1	Very high	45 Å²	45	18.7 Å²	18.7	17%	0.17	9%	0.09	C	C	.	.	I	π-helix	trans	-87.7	-54.3	-178.8	172.3	166.4	-172.7	-96.4	4.2	110.7	D212 L216 E239 Q247 T311	D212-R243 IonicContact OD1-CZ 2.75Å; D212-R243 IonicContact OD1-NH1 3.37Å; D212-R243 PolarHBondContact OD1-NH1 2.88Å; D212-R243 VanDerWaalsContact OD1-NH1 3.13Å; D212-R243 IonicContact OD1-NH2 3.84Å; D212-R243 PolarHBondContact OD1-NH2 3.32Å; D212-R243 IonicContact OD2-NH2 3.69Å; D212-R243 PolarHBondContact OD2-NH2 3.35Å; D212-R243 VanDerWaalsContact OD2-NH2 3.15Å; L216-R243 HydrophobicContact CD2-CG 4.22Å; L216-R243 VanDerWaalsContact CD2-O 3.24Å; L216-R243 WeakPolarHBondContact CD2-O 3.27Å; E239-R243 HydrophobicContact CB-CB 4.23Å; E239-R243 CarbonylContact O-C 3.47Å; E239-R243 WeakPolarHBondContact O-CA 3.46Å; E239-R243 WeakPolarHBondContact O-CB 3.43Å; E239-R243 PolarHBondContact O-N 2.88Å; R243-Q247 VanDerWaalsContact O-CB 3.23Å; R243-Q247 WeakPolarHBondContact O-CB 3.33Å; R243-Q247 PolarHBondContact O-N 2.93Å; R243-T311 HydrophobicContact CB-CG2 4.45Å
244	N	97.6	Very high	97.3	Very high	9 Å²	9	18 Å²	18	5%	0.048	8%	0.084	C	C	.	.	I	π-helix	trans	-72.7	-45.9	-167.8	-61.5	-4.6	0	0	0	111.9	L215 I219 Y225 E239 K240 A248	L215-N244 VanDerWaalsContact CD2-OD1 3.23Å; L215-N244 WeakPolarHBondContact CD2-OD1 3.42Å; I219-N244 HydrophobicContact CD1-CB 3.78Å; I219-N244 WeakPolarHBondContact CG2-O 3.39Å; Y225-N244 HydrophobicContact CD1-CB 4.25Å; Y225-N244 HydrophobicContact CE1-CB 3.53Å; Y225-N244 HydrophobicContact CE2-CB 4.37Å; Y225-N244 PolarHBondContact OH-ND2 3.42Å; E239-N244 PolarHBondContact O-N 3.4Å; K240-N244 WeakPolarHBondContact O-CB 3.24Å; N244-A248 WeakPolarHBondContact O-CB 3.09Å
245	A	97.9	Very high	97.4	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.068	C	C	.	.	I	π-helix	trans	-83.1	-58.4	-178.4	0	0	0	0	0	113.1	Y225 K240 L241 A248 G249 T250 P252	Y225-A245 HydrophobicContact CD1-CB 3.86Å; Y225-A245 HydrophobicContact CG-CB 4.45Å; K240-A245 PolarHBondContact O-N 3.38Å; K240-A245 VanDerWaalsContact O-N 3.07Å; L241-A245 WeakPolarHBondContact O-CB 3.32Å; L241-A245 PolarHBondContact O-N 2.97Å; A245-A248 PolarHBondContact O-N 2.83Å; A245-G249 PolarHBondContact O-N 3.4Å; A245-G249 VanDerWaalsContact O-N 3.15Å; A245-T250 WeakPolarHBondContact CA-OG1 3.38Å; A245-T250 PolarHBondContact O-N 2.85Å; A245-T250 PolarHBondContact O-OG1 2.89Å; A245-P252 HydrophobicContact CB-CB 3.62Å; A245-P252 HydrophobicContact CB-CG 4.19Å
246	F	96.8	Very high	97.4	Very high	10 Å²	10	13.5 Å²	13.5	4%	0.044	7%	0.065	C	C	.	.	I	π-helix	trans	-67.8	-44.8	-173.6	-68.8	-34.3	0	0	0	112.9	L241 W242 A248 G249 P252 A266 P267 W303 I309	L241-F246 HydrophobicContact CD1-CD2 4.48Å; L241-F246 HydrophobicContact CD1-CE1 4.18Å; L241-F246 HydrophobicContact CD1-CE2 3.84Å; L241-F246 HydrophobicContact CD1-CZ 3.67Å; L241-F246 HydrophobicContact CD2-CE2 3.94Å; L241-F246 HydrophobicContact CD2-CZ 4.3Å; L241-F246 HydrophobicContact CG-CD2 4.14Å; L241-F246 HydrophobicContact CG-CE2 3.6Å; L241-F246 HydrophobicContact CG-CZ 3.97Å; L241-F246 PolarHBondContact O-N 3.07Å; L241-F246 VanDerWaalsContact O-N 3.1Å; W242-F246 AromaticContact CE3-CD2 3.97Å; W242-F246 HydrophobicContact CE3-CD2 3.97Å; W242-F246 HydrophobicContact CE3-CE2 4.06Å; W242-F246 HydrophobicContact CZ3-CD2 4.43Å; W242-F246 HydrophobicContact CZ3-CE2 4.17Å; F246-A248 VanDerWaalsContact C-N 3.31Å; F246-A248 PolarHBondContact O-N 3.07Å; F246-G249 PolarHBondContact O-N 3.32Å; F246-P252 HydrophobicContact CD1-CG 4.27Å; F246-P252 HydrophobicContact CE1-CG 3.7Å; F246-P252 HydrophobicContact CZ-CG 4.32Å; F246-A266 HydrophobicContact CZ-CB 4.38Å; F246-P267 HydrophobicContact CZ-CG 4.46Å; F246-W303 AromaticContact CD1-CZ2 3.94Å; F246-W303 HydrophobicContact CD1-CZ2 3.94Å; F246-W303 HydrophobicContact CE1-CZ2 4.33Å; F246-W303 HydrophobicContact CG-CZ2 4.41Å; F246-I309 HydrophobicContact CB-CG1 4.03Å; F246-I309 HydrophobicContact CD2-CD1 3.69Å; F246-I309 HydrophobicContact CD2-CG1 3.93Å; F246-I309 HydrophobicContact CD2-CG2 4.48Å; F246-I309 HydrophobicContact CE2-CD1 4.01Å; F246-I309 HydrophobicContact CG-CD1 4.34Å; F246-I309 HydrophobicContact CG-CG1 4.17Å
247	Q	94.6	Very high	97.4	Very high	85 Å²	85	13.8 Å²	13.8	40%	0.397	7%	0.068	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-25	178.6	-56.7	-178.2	-32	0	0	113	L216 R243 G249 T311	L216-Q247 HydrophobicContact CD1-CB 4.05Å; R243-Q247 VanDerWaalsContact O-CB 3.23Å; R243-Q247 WeakPolarHBondContact O-CB 3.33Å; R243-Q247 PolarHBondContact O-N 2.93Å; Q247-G249 PolarHBondContact O-N 3.15Å; Q247-T311 HydrophobicContact CG-CG2 4.27Å; Q247-T311 PolarHBondContact NE2-OG1 3.29Å
248	A	95.1	Very high	97.3	Very high	9 Å²	9	16.4 Å²	16.4	7%	0.074	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-5	170.7	0	0	0	0	0	113.2	L216 I219 S220 N244 A245 F246 T250	L216-A248 HydrophobicContact CB-CB 4.45Å; L216-A248 HydrophobicContact CD2-CB 4.25Å; I219-A248 HydrophobicContact CB-CB 3.83Å; I219-A248 HydrophobicContact CG2-CB 3.58Å; S220-A248 WeakPolarHBondContact CA-O 3.35Å; S220-A248 VanDerWaalsContact CB-O 3.25Å; S220-A248 WeakPolarHBondContact CB-O 3.33Å; N244-A248 WeakPolarHBondContact O-CB 3.09Å; A245-A248 PolarHBondContact O-N 2.83Å; F246-A248 VanDerWaalsContact C-N 3.31Å; F246-A248 PolarHBondContact O-N 3.07Å; A248-T250 HydrophobicContact CB-CG2 4.29Å
249	G	94.4	Very high	97.3	Very high	5 Å²	5	19.8 Å²	19.8	5%	0.052	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	38.7	-179.4	0	0	0	0	0	113	R169 A245 F246 Q247 F301	R169-G249 PolarHBondContact NH1-O 3.28Å; R169-G249 PolarHBondContact NH2-O 3.48Å; A245-G249 PolarHBondContact O-N 3.4Å; A245-G249 VanDerWaalsContact O-N 3.15Å; F246-G249 PolarHBondContact O-N 3.32Å; Q247-G249 PolarHBondContact O-N 3.15Å; G249-F301 WeakPolarHBondContact O-CE1 2.99Å
250	T	96.3	Very high	97.4	Very high	2 Å²	2	20.1 Å²	20.1	1%	0.012	11%	0.107	C	C	.	.			trans	-107	159.6	175.5	60	0	0	0	0	110.7	I219 C222 Y225 A245 A248 P252	I219-T250 HydrophobicContact CG2-CG2 3.63Å; I219-T250 WeakPolarHBondContact O-CG2 3Å; C222-T250 VanDerWaalsContact O-CG2 3.31Å; C222-T250 WeakPolarHBondContact O-CG2 3.23Å; Y225-T250 VanDerWaalsContact CB-OG1 3.28Å; Y225-T250 WeakPolarHBondContact CB-OG1 3.44Å; A245-T250 WeakPolarHBondContact CA-OG1 3.38Å; A245-T250 PolarHBondContact O-N 2.85Å; A245-T250 PolarHBondContact O-OG1 2.89Å; A248-T250 HydrophobicContact CB-CG2 4.29Å; T250-P252 WeakPolarHBondContact O-CD 3.25Å
251	I	98.4	Very high	97.4	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.005	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	115.9	170.3	-56.7	176.9	0	0	0	108.4	L223 F224 Y225 V253 I272 V290 Y297 Y300 F301	L223-I251 PolarHBondContact O-N 2.9Å; F224-I251 VanDerWaalsContact CA-O 3.31Å; F224-I251 WeakPolarHBondContact CA-O 3.45Å; F224-I251 HydrophobicContact CD1-CB 3.78Å; F224-I251 HydrophobicContact CD1-CG2 4.08Å; F224-I251 HydrophobicContact CE1-CB 4.09Å; F224-I251 HydrophobicContact CE1-CD1 4.01Å; F224-I251 HydrophobicContact CE1-CG2 4.23Å; Y225-I251 PolarHBondContact N-O 3.26Å; I251-V253 PolarHBondContact O-N 3.27Å; I251-I272 HydrophobicContact CG2-CD1 3.87Å; I251-I272 HydrophobicContact CG2-CG1 4.09Å; I251-V290 HydrophobicContact CD1-CG1 3.98Å; I251-Y297 HydrophobicContact CD1-CD2 3.33Å; I251-Y297 HydrophobicContact CD1-CE2 3.46Å; I251-Y297 VanDerWaalsContact CD1-CE2 3.46Å; I251-Y297 HydrophobicContact CD1-CG 4.18Å; I251-Y297 HydrophobicContact CG1-CD2 4.3Å; I251-Y297 HydrophobicContact CG1-CE2 3.94Å; I251-Y300 HydrophobicContact CD1-CD2 3.73Å; I251-Y300 HydrophobicContact CD1-CG 3.8Å; I251-Y300 HydrophobicContact CG1-CG 4.18Å; I251-Y300 HydrophobicContact CG2-CD1 3.87Å; I251-Y300 HydrophobicContact CG2-CD2 4.46Å; I251-Y300 HydrophobicContact CG2-CE1 4.28Å; I251-Y300 HydrophobicContact CG2-CG 3.98Å; I251-F301 HydrophobicContact CD1-CE2 4.04Å; I251-F301 HydrophobicContact CD1-CZ 4.45Å; I251-F301 HydrophobicContact CG1-CE2 3.66Å; I251-F301 HydrophobicContact CG1-CZ 3.59Å
252	P	98.8	Very high	97.3	Very high	2 Å²	2	20.3 Å²	20.3	1%	0.013	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	128.4	174.7	25.3	-30.7	0	0	0	111.6	Y225 L241 A245 F246 T250 V254 S270 F271 I272	Y225-P252 WeakPolarHBondContact O-CA 3.4Å; L241-P252 HydrophobicContact CD1-CB 3.57Å; L241-P252 HydrophobicContact CD1-CG 3.57Å; A245-P252 HydrophobicContact CB-CB 3.62Å; A245-P252 HydrophobicContact CB-CG 4.19Å; F246-P252 HydrophobicContact CD1-CG 4.27Å; F246-P252 HydrophobicContact CE1-CG 3.7Å; F246-P252 HydrophobicContact CZ-CG 4.32Å; T250-P252 WeakPolarHBondContact O-CD 3.25Å; P252-V254 HydrophobicContact CB-CG1 3.97Å; P252-S270 VanDerWaalsContact CD-O 3.23Å; P252-S270 WeakPolarHBondContact CD-O 3.4Å; P252-S270 VanDerWaalsContact CG-O 3.29Å; P252-S270 WeakPolarHBondContact CG-O 3.41Å; P252-F271 HydrophobicContact CB-CB 4.42Å; P252-F271 HydrophobicContact CG-CB 3.7Å; P252-I272 PolarHBondContact O-N 3.13Å
253	V	98.9	Very high	97.3	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	110.1	162.3	-173.5	0	0	0	0	107.1	F224 Y225 L226 S227 F228 I251 I272 V274 L283 L287	F224-V253 HydrophobicContact CB-CG2 4.1Å; F224-V253 HydrophobicContact CD1-CG2 4.11Å; F224-V253 HydrophobicContact CG-CG2 4.36Å; Y225-V253 PolarHBondContact O-N 2.81Å; L226-V253 HydrophobicContact CD2-CB 3.84Å; L226-V253 HydrophobicContact CD2-CG1 4.27Å; L226-V253 HydrophobicContact CD2-CG2 4.21Å; S227-V253 PolarHBondContact N-O 3.34Å; F228-V253 WeakPolarHBondContact CD1-O 3.27Å; F228-V253 HydrophobicContact CE1-CG1 4.16Å; F228-V253 WeakPolarHBondContact CE1-O 3.22Å; I251-V253 PolarHBondContact O-N 3.27Å; V253-I272 CarbonylContact C-O 3.58Å; V253-I272 WeakPolarHBondContact CA-O 3.4Å; V253-I272 HydrophobicContact CG2-CB 4.45Å; V253-V274 HydrophobicContact CG1-CG2 4.08Å; V253-L283 HydrophobicContact CG1-CD1 4.35Å; V253-L287 HydrophobicContact CG2-CD1 4.32Å; V253-L287 HydrophobicContact CG2-CD2 3.71Å
254	V	98.9	Very high	97.4	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	144.3	-167	-56.6	0	0	0	0	112.4	L241 P252 Y262 F271 I272 H273 V274	L241-V254 HydrophobicContact CD1-CG1 3.88Å; P252-V254 HydrophobicContact CB-CG1 3.97Å; V254-Y262 HydrophobicContact CB-CD1 4.4Å; V254-Y262 HydrophobicContact CB-CE1 3.77Å; V254-Y262 HydrophobicContact CB-CE2 4.3Å; V254-Y262 HydrophobicContact CG1-CD1 4.3Å; V254-Y262 HydrophobicContact CG1-CE1 3.82Å; V254-Y262 HydrophobicContact CG2-CD1 4.21Å; V254-Y262 HydrophobicContact CG2-CD2 4.24Å; V254-Y262 HydrophobicContact CG2-CE1 4.02Å; V254-Y262 HydrophobicContact CG2-CE2 4.03Å; V254-Y262 HydrophobicContact CG2-CG 4.33Å; V254-F271 HydrophobicContact CG1-CB 4.11Å; V254-F271 HydrophobicContact CG1-CD2 4.5Å; V254-F271 HydrophobicContact CG2-CD2 3.57Å; V254-F271 HydrophobicContact CG2-CE2 4.12Å; V254-F271 HydrophobicContact CG2-CG 4.36Å; V254-I272 PolarHBondContact N-O 2.88Å; V254-H273 HydrophobicContact CG2-CB 4.05Å; V254-H273 VanDerWaalsContact CG2-CD2 3.46Å; V254-H273 WeakPolarHBondContact CG2-CD2 3.41Å; V254-V274 WeakPolarHBondContact O-CG2 3.32Å; V254-V274 PolarHBondContact O-N 2.99Å
255	L	98.4	Very high	97.3	Very high	14 Å²	14	30.2 Å²	30.2	7%	0.073	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	119.6	169.9	176.3	69.6	0	0	0	107.2	T185 R186 V189 F228 E229 V274	T185-L255 HydrophobicContact CG2-CD1 4.45Å; T185-L255 HydrophobicContact CG2-CD2 4.21Å; R186-L255 HydrophobicContact CB-CD2 3.84Å; V189-L255 HydrophobicContact CB-CD2 4.37Å; V189-L255 HydrophobicContact CG2-CD2 4.06Å; F228-L255 HydrophobicContact CB-CB 4.25Å; F228-L255 HydrophobicContact CB-CD2 4.5Å; F228-L255 HydrophobicContact CD1-CB 3.5Å; F228-L255 VanDerWaalsContact CD1-CB 3.5Å; F228-L255 HydrophobicContact CD2-CD2 4.48Å; F228-L255 HydrophobicContact CE1-CB 4.01Å; F228-L255 HydrophobicContact CG-CB 3.97Å; F228-L255 HydrophobicContact CG-CD2 4.27Å; E229-L255 WeakPolarHBondContact CB-O 3.4Å; E229-L255 PolarHBondContact N-O 3.47Å; L255-V274 HydrophobicContact CB-CG2 4.27Å; L255-V274 HydrophobicContact CD1-CB 4.32Å; L255-V274 HydrophobicContact CD1-CG1 4.47Å
256	G	97	Very high	97.3	Very high	3 Å²	3	30.6 Å²	30.6	3%	0.031	16%	0.164	C	C	.	.	S	Bend	trans	175.5	-132.6	-173.1	0	0	0	0	0	110.5	E232	E232-G256 WeakPolarHBondContact CG-O 3.36Å
257	P	96.9	Very high	97.3	Very high	10 Å²	10	30.2 Å²	30.2	7%	0.065	16%	0.162	C	C	.	.	S	Bend	trans	-61.5	175.5	173.9	24.2	-32.1	0	0	0	112.8	Y236 I237 T261 Y262 H273	Y236-P257 WeakPolarHBondContact O-CD 3.42Å; I237-P257 HydrophobicContact CD1-CG 4.15Å; I237-P257 HydrophobicContact CG1-CG 3.65Å; P257-T261 HydrophobicContact CB-CG2 3.85Å; P257-T261 HydrophobicContact CG-CG2 4.03Å; P257-Y262 HydrophobicContact CG-CD2 4.33Å; P257-Y262 HydrophobicContact CG-CE2 3.84Å; P257-Y262 VanDerWaalsContact O-CE2 3.27Å; P257-Y262 WeakPolarHBondContact O-CE2 3.26Å; P257-H273 PolarHBondContact O-NE2 3.08Å; P257-H273 VanDerWaalsContact O-NE2 3.13Å
258	S	97.6	Very high	97.4	Very high	64 Å²	64	30 Å²	30	45%	0.448	17%	0.168	S	C	.	.			trans	-57	153.1	-178.5	78.5	0	0	0	0	112.9	T261 Y262	S258-T261 WeakPolarHBondContact O-CA 3.48Å; S258-T261 VanDerWaalsContact O-CB 3.24Å; S258-T261 WeakPolarHBondContact O-CB 3.26Å; S258-T261 PolarHBondContact O-N 3.11Å; S258-T261 PolarHBondContact OG-N 2.92Å; S258-T261 PolarHBondContact OG-OG1 2.95Å; S258-Y262 PolarHBondContact O-N 2.89Å
259	R	97.7	Very high	97.5	Very high	70 Å²	70	34.4 Å²	34.4	26%	0.264	19%	0.187	S	C	.	.	H	α-helix	trans	-51.7	-47	175	169.6	163	-177.1	101	16.9	113.4	T261 Y262 E263 H273 D276	R259-T261 PolarHBondContact O-N 3.24Å; R259-Y262 WeakPolarHBondContact O-CB 3.31Å; R259-Y262 PolarHBondContact O-N 3.42Å; R259-E263 HydrophobicContact CG-CG 4.31Å; R259-E263 IonicContact CZ-OE1 3.79Å; R259-E263 VanDerWaalsContact CZ-OE1 3.27Å; R259-E263 IonicContact NE-OE1 2.65Å; R259-E263 PolarHBondContact NE-OE1 3.23Å; R259-E263 IonicContact NH2-OE1 3.39Å; R259-E263 PolarHBondContact NH2-OE1 3.37Å; R259-E263 PolarHBondContact O-N 3.28Å; R259-H273 HydrophobicContact CB-CB 4.35Å; R259-H273 HydrophobicContact CG-CB 4.5Å; R259-D276 WeakPolarHBondContact CD-OD1 3.28Å; R259-D276 IonicContact CZ-OD1 2.79Å; R259-D276 IonicContact CZ-OD2 3.51Å; R259-D276 IonicContact NE-OD1 3Å; R259-D276 IonicContact NH1-OD1 2.64Å; R259-D276 PolarHBondContact NH1-OD1 3.47Å; R259-D276 IonicContact NH1-OD2 2.59Å; R259-D276 PolarHBondContact NH1-OD2 2.91Å
260	P	98.1	Very high	97.6	Very high	71 Å²	71	34.2 Å²	34.2	46%	0.461	19%	0.185	S	C	.	.	H	α-helix	trans	-55.6	-37.4	174.8	-28.9	36.2	0	0	0	113.7	Y262 E263 E264	P260-Y262 VanDerWaalsContact C-N 3.3Å; P260-Y262 PolarHBondContact O-N 3.4Å; P260-E263 PolarHBondContact O-N 3.31Å; P260-E263 VanDerWaalsContact O-N 3.13Å; P260-E264 WeakPolarHBondContact O-CG 3.48Å; P260-E264 PolarHBondContact O-N 3.37Å
261	T	97.8	Very high	97.8	Very high	20 Å²	20	34.5 Å²	34.5	12%	0.123	19%	0.186	C	C	.	.	H	α-helix	trans	-62.1	-36.8	176.5	-51.3	0	0	0	0	112.3	I237 P257 S258 R259	I237-T261 HydrophobicContact CD1-CG2 4.45Å; P257-T261 HydrophobicContact CB-CG2 3.85Å; P257-T261 HydrophobicContact CG-CG2 4.03Å; S258-T261 WeakPolarHBondContact O-CA 3.48Å; S258-T261 VanDerWaalsContact O-CB 3.24Å; S258-T261 WeakPolarHBondContact O-CB 3.26Å; S258-T261 PolarHBondContact O-N 3.11Å; S258-T261 PolarHBondContact OG-N 2.92Å; S258-T261 PolarHBondContact OG-OG1 2.95Å; R259-T261 PolarHBondContact O-N 3.24Å
262	Y	98.3	Very high	97.8	Very high	1 Å²	1	34.5 Å²	34.5	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-69.3	-41.8	172.2	-77.7	-88.9	0	0	0	111.8	I237 L241 V254 P257 S258 R259 P260 E264 V265 A266 F271 H273	I237-Y262 HydrophobicContact CB-CE1 4.39Å; I237-Y262 HydrophobicContact CD1-CD1 3.57Å; I237-Y262 HydrophobicContact CD1-CD2 4.36Å; I237-Y262 HydrophobicContact CD1-CE1 3.83Å; I237-Y262 HydrophobicContact CD1-CG 3.85Å; I237-Y262 HydrophobicContact CG1-CD1 4.04Å; I237-Y262 HydrophobicContact CG1-CE1 3.74Å; I237-Y262 HydrophobicContact CG2-CD1 4.25Å; I237-Y262 HydrophobicContact CG2-CE1 3.84Å; L241-Y262 HydrophobicContact CD2-CD1 4.01Å; L241-Y262 HydrophobicContact CD2-CE1 4.14Å; V254-Y262 HydrophobicContact CB-CD1 4.4Å; V254-Y262 HydrophobicContact CB-CE1 3.77Å; V254-Y262 HydrophobicContact CB-CE2 4.3Å; V254-Y262 HydrophobicContact CG1-CD1 4.3Å; V254-Y262 HydrophobicContact CG1-CE1 3.82Å; V254-Y262 HydrophobicContact CG2-CD1 4.21Å; V254-Y262 HydrophobicContact CG2-CD2 4.24Å; V254-Y262 HydrophobicContact CG2-CE1 4.02Å; V254-Y262 HydrophobicContact CG2-CE2 4.03Å; V254-Y262 HydrophobicContact CG2-CG 4.33Å; P257-Y262 HydrophobicContact CG-CD2 4.33Å; P257-Y262 HydrophobicContact CG-CE2 3.84Å; P257-Y262 VanDerWaalsContact O-CE2 3.27Å; P257-Y262 WeakPolarHBondContact O-CE2 3.26Å; S258-Y262 PolarHBondContact O-N 2.89Å; R259-Y262 WeakPolarHBondContact O-CB 3.31Å; R259-Y262 PolarHBondContact O-N 3.42Å; P260-Y262 VanDerWaalsContact C-N 3.3Å; P260-Y262 PolarHBondContact O-N 3.4Å; Y262-E264 PolarHBondContact O-N 2.88Å; Y262-V265 PolarHBondContact O-N 3.4Å; Y262-A266 VanDerWaalsContact O-CB 3.25Å; Y262-A266 WeakPolarHBondContact O-CB 3.45Å; Y262-A266 PolarHBondContact O-N 2.87Å; Y262-F271 HydrophobicContact CG-CE2 4.3Å; Y262-F271 HydrophobicContact CG-CZ 4.29Å; Y262-H273 AromaticContact CD2-CD2 3.71Å; Y262-H273 AromaticContact CD2-NE2 3.88Å; Y262-H273 AromaticContact CE2-CD2 3.93Å; Y262-H273 AromaticContact CE2-NE2 3.82Å
263	E	98	Very high	97.8	Very high	104 Å²	104	34.9 Å²	34.9	49%	0.486	19%	0.188	S	C	.	.	H	α-helix	trans	-64.3	-27.8	-179.5	-67.2	178.3	156.3	0	0	113.1	R259 P260 V265 F271	R259-E263 HydrophobicContact CG-CG 4.31Å; R259-E263 IonicContact CZ-OE1 3.79Å; R259-E263 VanDerWaalsContact CZ-OE1 3.27Å; R259-E263 IonicContact NE-OE1 2.65Å; R259-E263 PolarHBondContact NE-OE1 3.23Å; R259-E263 IonicContact NH2-OE1 3.39Å; R259-E263 PolarHBondContact NH2-OE1 3.37Å; R259-E263 PolarHBondContact O-N 3.28Å; P260-E263 PolarHBondContact O-N 3.31Å; P260-E263 VanDerWaalsContact O-N 3.13Å; E263-V265 VanDerWaalsContact C-N 3.25Å; E263-V265 PolarHBondContact O-N 2.74Å; E263-F271 HydrophobicContact CG-CE1 4.3Å; E263-F271 HydrophobicContact CG-CZ 3.83Å
264	E	97	Very high	97.8	Very high	118 Å²	118	35.8 Å²	35.8	55%	0.551	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-20	176.4	-75.1	169.2	167.4	0	0	113.8	R143 P260 Y262	R143-E264 IonicContact CZ-OE2 3.25Å; R143-E264 IonicContact NH1-OE2 3.83Å; R143-E264 PolarHBondContact NH1-OE2 3.28Å; R143-E264 IonicContact NH2-OE2 2.69Å; R143-E264 PolarHBondContact NH2-OE2 3Å; P260-E264 WeakPolarHBondContact O-CG 3.48Å; P260-E264 PolarHBondContact O-N 3.37Å; Y262-E264 PolarHBondContact O-N 2.88Å
265	V	96.8	Very high	97.7	Very high	46 Å²	46	39.4 Å²	39.4	28%	0.279	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128.6	-34.7	-172.4	-58.4	0	0	0	0	114.4	T154 I237 W242 Y262 E263	T154-V265 VanDerWaalsContact CB-O 3.31Å; T154-V265 WeakPolarHBondContact CB-O 3.49Å; T154-V265 PolarHBondContact OG1-O 3.26Å; I237-V265 HydrophobicContact CD1-CG2 3.7Å; W242-V265 HydrophobicContact CH2-CB 4.36Å; W242-V265 HydrophobicContact CH2-CG2 4.36Å; W242-V265 WeakPolarHBondContact CH2-O 3.5Å; W242-V265 HydrophobicContact CZ2-CB 4.22Å; W242-V265 HydrophobicContact CZ2-CG2 3.9Å; Y262-V265 PolarHBondContact O-N 3.4Å; E263-V265 VanDerWaalsContact C-N 3.25Å; E263-V265 PolarHBondContact O-N 2.74Å
266	A	97.8	Very high	97.7	Very high	8 Å²	8	42.1 Å²	42.1	7%	0.066	24%	0.238	C	C	.	.	S	Bend	trans	-76.8	156.2	-179.2	0	0	0	0	0	110.7	L241 F246 Y262 F271	L241-A266 HydrophobicContact CD2-CB 4.36Å; F246-A266 HydrophobicContact CZ-CB 4.38Å; Y262-A266 VanDerWaalsContact O-CB 3.25Å; Y262-A266 WeakPolarHBondContact O-CB 3.45Å; Y262-A266 PolarHBondContact O-N 2.87Å; A266-F271 HydrophobicContact CB-CD1 3.92Å; A266-F271 HydrophobicContact CB-CE1 3.96Å
267	P	97.1	Very high	97.8	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.006	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-57.8	149.5	172.2	-16.2	27.3	0	0	0	110.8	T154 F246 H269 S270 W303 H307 I309	T154-P267 HydrophobicContact CG2-CB 4.12Å; T154-P267 HydrophobicContact CG2-CG 3.78Å; T154-P267 WeakPolarHBondContact OG1-CD 3.01Å; F246-P267 HydrophobicContact CZ-CG 4.46Å; P267-H269 PolarHBondContact O-N 2.83Å; P267-S270 WeakPolarHBondContact CD-OG 3.32Å; P267-S270 VanDerWaalsContact O-CB 3.22Å; P267-S270 WeakPolarHBondContact O-CB 3.39Å; P267-S270 PolarHBondContact O-N 3.22Å; P267-S270 PolarHBondContact O-OG 2.7Å; P267-W303 HydrophobicContact CB-CB 3.65Å; P267-W303 HydrophobicContact CB-CD2 3.61Å; P267-W303 HydrophobicContact CB-CE3 3.76Å; P267-W303 HydrophobicContact CB-CG 3.58Å; P267-W303 HydrophobicContact CG-CD2 3.75Å; P267-W303 HydrophobicContact CG-CE3 3.64Å; P267-W303 HydrophobicContact CG-CG 4.26Å; P267-W303 HydrophobicContact CG-CH2 4.39Å; P267-W303 HydrophobicContact CG-CZ3 3.97Å; P267-H307 HydrophobicContact CB-CB 4.44Å; P267-I309 HydrophobicContact CG-CD1 3.63Å
268	P	95.8	Very high	97.8	Very high	80 Å²	80	52.5 Å²	52.5	52%	0.519	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	139.5	-179.7	25.7	-34.6	0	0	0	110.7	S270	P268-S270 VanDerWaalsContact C-N 3.29Å; P268-S270 PolarHBondContact O-N 2.98Å
269	H	96.9	Very high	97.9	Very high	102 Å²	102	51.9 Å²	51.9	47%	0.472	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	42.6	177.9	-164.1	69.2	0	0	0	113.7	P267 Y300	P267-H269 PolarHBondContact O-N 2.83Å; H269-Y300 WeakPolarHBondContact O-CA 3.31Å; H269-Y300 WeakPolarHBondContact O-CD1 3.2Å
270	S	98	Very high	97.9	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.014	27%	0.273	C	S	.	.			trans	-110.7	-3.8	-175	65.7	0	0	0	0	115	P252 P267 P268	P252-S270 VanDerWaalsContact CD-O 3.23Å; P252-S270 WeakPolarHBondContact CD-O 3.4Å; P252-S270 VanDerWaalsContact CG-O 3.29Å; P252-S270 WeakPolarHBondContact CG-O 3.41Å; P267-S270 WeakPolarHBondContact CD-OG 3.32Å; P267-S270 VanDerWaalsContact O-CB 3.22Å; P267-S270 WeakPolarHBondContact O-CB 3.39Å; P267-S270 PolarHBondContact O-N 3.22Å; P267-S270 PolarHBondContact O-OG 2.7Å; P268-S270 VanDerWaalsContact C-N 3.29Å; P268-S270 PolarHBondContact O-N 2.98Å
271	F	98.8	Very high	97.9	Very high	8 Å²	8	50.4 Å²	50.4	4%	0.035	27%	0.272	C	S	.	.			trans	-147	159.8	-175.8	67.8	-91.2	0	0	0	112.9	P252 V254 Y262 E263 A266 H273	P252-F271 HydrophobicContact CB-CB 4.42Å; P252-F271 HydrophobicContact CG-CB 3.7Å; V254-F271 HydrophobicContact CG1-CB 4.11Å; V254-F271 HydrophobicContact CG1-CD2 4.5Å; V254-F271 HydrophobicContact CG2-CD2 3.57Å; V254-F271 HydrophobicContact CG2-CE2 4.12Å; V254-F271 HydrophobicContact CG2-CG 4.36Å; Y262-F271 HydrophobicContact CG-CE2 4.3Å; Y262-F271 HydrophobicContact CG-CZ 4.29Å; E263-F271 HydrophobicContact CG-CE1 4.3Å; E263-F271 HydrophobicContact CG-CZ 3.83Å; A266-F271 HydrophobicContact CB-CD1 3.92Å; A266-F271 HydrophobicContact CB-CE1 3.96Å; F271-H273 HydrophobicContact CD2-CB 4.27Å; F271-H273 HydrophobicContact CE2-CB 4.01Å
272	I	98.9	Very high	98	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	120.8	173.3	-61.8	171.9	0	0	0	107.7	F224 I251 P252 V253 V254 F277 L283 Y286 L287 Y300	F224-I272 HydrophobicContact CD1-CD1 4.33Å; F224-I272 HydrophobicContact CE1-CD1 3.93Å; I251-I272 HydrophobicContact CG2-CD1 3.87Å; I251-I272 HydrophobicContact CG2-CG1 4.09Å; P252-I272 PolarHBondContact O-N 3.13Å; V253-I272 CarbonylContact C-O 3.58Å; V253-I272 WeakPolarHBondContact CA-O 3.4Å; V253-I272 HydrophobicContact CG2-CB 4.45Å; V254-I272 PolarHBondContact N-O 2.88Å; I272-F277 HydrophobicContact CG2-CE2 3.66Å; I272-F277 HydrophobicContact CG2-CZ 4.05Å; I272-L283 HydrophobicContact CG2-CD1 4.04Å; I272-Y286 HydrophobicContact CD1-CD1 4.2Å; I272-Y286 HydrophobicContact CD1-CE1 3.83Å; I272-Y286 HydrophobicContact CG1-CE1 4.07Å; I272-Y286 HydrophobicContact CG2-CD1 4.3Å; I272-Y286 HydrophobicContact CG2-CE1 4.32Å; I272-L287 HydrophobicContact CD1-CD2 3.54Å; I272-L287 HydrophobicContact CG2-CD2 4.47Å; I272-Y300 HydrophobicContact CD1-CE1 4.46Å; I272-Y300 HydrophobicContact CD1-CE2 4.38Å; I272-Y300 HydrophobicContact CG1-CE1 3.73Å; I272-Y300 HydrophobicContact CG1-CE2 4.42Å; I272-Y300 WeakPolarHBondContact CG1-OH 3.43Å
273	H	98.8	Very high	98	Very high	9 Å²	9	53.5 Å²	53.5	4%	0.042	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	132.4	180	-162.9	-81.6	0	0	0	110.2	V254 P257 R259 Y262 F271 A275 D276	V254-H273 HydrophobicContact CG2-CB 4.05Å; V254-H273 VanDerWaalsContact CG2-CD2 3.46Å; V254-H273 WeakPolarHBondContact CG2-CD2 3.41Å; P257-H273 PolarHBondContact O-NE2 3.08Å; P257-H273 VanDerWaalsContact O-NE2 3.13Å; R259-H273 HydrophobicContact CB-CB 4.35Å; R259-H273 HydrophobicContact CG-CB 4.5Å; Y262-H273 AromaticContact CD2-CD2 3.71Å; Y262-H273 AromaticContact CD2-NE2 3.88Å; Y262-H273 AromaticContact CE2-CD2 3.93Å; Y262-H273 AromaticContact CE2-NE2 3.82Å; F271-H273 HydrophobicContact CD2-CB 4.27Å; F271-H273 HydrophobicContact CE2-CB 4.01Å; H273-A275 VanDerWaalsContact ND1-CB 3.27Å; H273-A275 WeakPolarHBondContact ND1-CB 3.44Å; H273-A275 PolarHBondContact ND1-N 3.41Å; H273-A275 PolarHBondContact O-N 3.34Å; H273-D276 WeakPolarHBondContact CB-OD2 3.37Å; H273-D276 PolarHBondContact N-OD2 2.73Å; H273-D276 VanDerWaalsContact N-OD2 3.13Å; H273-D276 WeakPolarHBondContact O-CB 3.33Å; H273-D276 VanDerWaalsContact O-CG 3.32Å; H273-D276 PolarHBondContact O-N 2.96Å
274	V	98.5	Very high	98	Very high	19 Å²	19	48.6 Å²	48.6	12%	0.115	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-57.8	-35.9	-179.3	169.7	0	0	0	0	111.8	V189 F228 V253 V254 L255 D276 F277 L283	V189-V274 HydrophobicContact CG1-CG1 4.21Å; V189-V274 HydrophobicContact CG1-CG2 4.32Å; V189-V274 HydrophobicContact CG2-CG1 4.4Å; F228-V274 HydrophobicContact CE1-CG2 3.87Å; F228-V274 HydrophobicContact CZ-CG2 4.2Å; V253-V274 HydrophobicContact CG1-CG2 4.08Å; V254-V274 WeakPolarHBondContact O-CG2 3.32Å; V254-V274 PolarHBondContact O-N 2.99Å; L255-V274 HydrophobicContact CB-CG2 4.27Å; L255-V274 HydrophobicContact CD1-CB 4.32Å; L255-V274 HydrophobicContact CD1-CG1 4.47Å; V274-D276 PolarHBondContact O-N 3.3Å; V274-F277 PolarHBondContact O-N 3.24Å; V274-L283 HydrophobicContact CB-CD2 4.48Å; V274-L283 HydrophobicContact CG1-CD2 4.26Å; V274-L283 HydrophobicContact CG2-CD2 3.99Å
275	A	97.6	Very high	98.1	Very high	77 Å²	77	45.9 Å²	45.9	64%	0.636	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-72.7	-1.5	178.9	0	0	0	0	0	115.4	H273 F277	H273-A275 VanDerWaalsContact ND1-CB 3.27Å; H273-A275 WeakPolarHBondContact ND1-CB 3.44Å; H273-A275 PolarHBondContact ND1-N 3.41Å; H273-A275 PolarHBondContact O-N 3.34Å; A275-F277 PolarHBondContact O-N 2.9Å
276	D	98.3	Very high	98.2	Very high	70 Å²	70	47.3 Å²	47.3	37%	0.374	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-72.5	-14.5	173.7	-63	-27.6	0	0	0	112.5	R259 H273 V274	R259-D276 WeakPolarHBondContact CD-OD1 3.28Å; R259-D276 IonicContact CZ-OD1 2.79Å; R259-D276 IonicContact CZ-OD2 3.51Å; R259-D276 IonicContact NE-OD1 3Å; R259-D276 IonicContact NH1-OD1 2.64Å; R259-D276 PolarHBondContact NH1-OD1 3.47Å; R259-D276 IonicContact NH1-OD2 2.59Å; R259-D276 PolarHBondContact NH1-OD2 2.91Å; H273-D276 WeakPolarHBondContact CB-OD2 3.37Å; H273-D276 PolarHBondContact N-OD2 2.73Å; H273-D276 VanDerWaalsContact N-OD2 3.13Å; H273-D276 WeakPolarHBondContact O-CB 3.33Å; H273-D276 VanDerWaalsContact O-CG 3.32Å; H273-D276 PolarHBondContact O-N 2.96Å; V274-D276 PolarHBondContact O-N 3.3Å
277	F	98.6	Very high	98.3	Very high	39 Å²	39	46.9 Å²	46.9	17%	0.171	26%	0.258	C	S	.	.	S	Bend	trans	-115	141.3	-171.1	-55.3	-82	0	0	0	110.6	I272 V274 A275 S279 E282 L283 Y286	I272-F277 HydrophobicContact CG2-CE2 3.66Å; I272-F277 HydrophobicContact CG2-CZ 4.05Å; V274-F277 PolarHBondContact O-N 3.24Å; A275-F277 PolarHBondContact O-N 2.9Å; F277-S279 PolarHBondContact O-N 3.23Å; F277-E282 HydrophobicContact CB-CB 4.09Å; F277-E282 HydrophobicContact CD1-CB 4.17Å; F277-L283 HydrophobicContact CB-CB 4.04Å; F277-L283 HydrophobicContact CD1-CB 4.48Å; F277-L283 HydrophobicContact CD2-CB 3.78Å; F277-L283 HydrophobicContact CD2-CD1 3.55Å; F277-L283 HydrophobicContact CD2-CG 4.2Å; F277-L283 HydrophobicContact CE2-CB 4.44Å; F277-L283 HydrophobicContact CE2-CD1 3.44Å; F277-L283 VanDerWaalsContact CE2-CD1 3.44Å; F277-L283 HydrophobicContact CG-CB 3.81Å; F277-L283 HydrophobicContact CG-CD1 4.36Å; F277-L283 HydrophobicContact CZ-CD1 4.18Å; F277-Y286 AromaticContact CE1-CD1 3.88Å; F277-Y286 HydrophobicContact CE1-CD1 3.88Å; F277-Y286 AromaticContact CE1-CD2 3.95Å; F277-Y286 HydrophobicContact CE1-CD2 3.95Å; F277-Y286 AromaticContact CE1-CG 3.43Å; F277-Y286 HydrophobicContact CE1-CG 3.43Å; F277-Y286 VanDerWaalsContact CE1-CG 3.43Å; F277-Y286 HydrophobicContact CE2-CD1 4.41Å; F277-Y286 AromaticContact CZ-CD1 3.37Å; F277-Y286 HydrophobicContact CZ-CD1 3.37Å; F277-Y286 HydrophobicContact CZ-CD2 4.21Å; F277-Y286 HydrophobicContact CZ-CE1 4.02Å; F277-Y286 AromaticContact CZ-CG 3.47Å; F277-Y286 HydrophobicContact CZ-CG 3.47Å; F277-Y286 VanDerWaalsContact CZ-CG 3.47Å
278	K	97.9	Very high	98.3	Very high	193 Å²	193	50 Å²	50	84%	0.839	28%	0.275	S	S	*	.	S	Bend	trans	-73.3	-19.4	179.2	-60.2	175.8	-180	174.2	0	112.2	E282	K278-E282 WeakPolarHBondContact CB-OE2 3.48Å; K278-E282 PolarHBondContact N-OE2 3.07Å
279	S	98.3	Very high	98.4	Very high	50 Å²	50	51 Å²	51	35%	0.35	27%	0.273	S	S	.	.	S	Bend	trans	-151.6	161.8	179.1	72.7	0	0	0	0	112.3	F277 V281 E282 L283	F277-S279 PolarHBondContact O-N 3.23Å; S279-V281 PolarHBondContact O-N 3.25Å; S279-V281 PolarHBondContact OG-N 2.83Å; S279-E282 PolarHBondContact O-N 2.72Å; S279-E282 PolarHBondContact OG-N 3.05Å; S279-L283 PolarHBondContact O-N 2.85Å
280	I	98.4	Very high	98.5	Very high	37 Å²	37	46.2 Å²	46.2	19%	0.19	25%	0.25	C	S	.	.	H	α-helix	trans	-61.8	-28.8	172.4	-66.1	-65.1	0	0	0	112	V189 L193 Y196 L283 A284	V189-I280 HydrophobicContact CB-CD1 4.47Å; V189-I280 HydrophobicContact CG1-CD1 3.93Å; V189-I280 HydrophobicContact CG2-CD1 4.48Å; L193-I280 HydrophobicContact CB-CG2 4.01Å; L193-I280 HydrophobicContact CD1-CG2 4.02Å; Y196-I280 HydrophobicContact CD2-CG2 4.1Å; Y196-I280 HydrophobicContact CE2-CG2 4.21Å; I280-L283 HydrophobicContact CD1-CD2 4.41Å; I280-A284 WeakPolarHBondContact O-CB 3.48Å; I280-A284 PolarHBondContact O-N 3.16Å
281	V	98.6	Very high	98.4	Very high	73 Å²	73	47.3 Å²	47.3	44%	0.442	26%	0.26	S	S	.	.	H	α-helix	trans	-67.3	-43.7	176.4	-176.7	0	0	0	0	110.4	Y196 S279 A284 A285	Y196-V281 HydrophobicContact CE1-CG2 4.06Å; Y196-V281 HydrophobicContact CE2-CG2 4.01Å; S279-V281 PolarHBondContact O-N 3.25Å; S279-V281 PolarHBondContact OG-N 2.83Å; V281-A284 PolarHBondContact O-N 3.18Å; V281-A285 WeakPolarHBondContact O-CB 3.24Å; V281-A285 PolarHBondContact O-N 3.35Å
282	E	98.8	Very high	98.3	Very high	86 Å²	86	51.3 Å²	51.3	40%	0.402	29%	0.294	S	S	.	.	H	α-helix	trans	-64.3	-43.1	175.5	-73.6	179.9	-170.6	0	0	111.7	F277 K278 S279 A284 A285 Y286	F277-E282 HydrophobicContact CB-CB 4.09Å; F277-E282 HydrophobicContact CD1-CB 4.17Å; K278-E282 WeakPolarHBondContact CB-OE2 3.48Å; K278-E282 PolarHBondContact N-OE2 3.07Å; S279-E282 PolarHBondContact O-N 2.72Å; S279-E282 PolarHBondContact OG-N 3.05Å; E282-A284 VanDerWaalsContact C-N 3.35Å; E282-A284 PolarHBondContact O-N 3.31Å; E282-A285 PolarHBondContact O-N 3.15Å; E282-Y286 WeakPolarHBondContact O-CB 3.32Å; E282-Y286 PolarHBondContact O-N 3.23Å
283	L	98.8	Very high	98.1	Very high	0 Å²	0	54 Å²	54	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-58	-47.5	173.2	171.7	60.9	0	0	0	111.1	L193 V253 I272 V274 F277 S279 I280 A285 Y286 L287	L193-L283 HydrophobicContact CD1-CD2 4.18Å; L193-L283 HydrophobicContact CD1-CG 4.19Å; L193-L283 HydrophobicContact CD2-CD2 4.18Å; V253-L283 HydrophobicContact CG1-CD1 4.35Å; I272-L283 HydrophobicContact CG2-CD1 4.04Å; V274-L283 HydrophobicContact CB-CD2 4.48Å; V274-L283 HydrophobicContact CG1-CD2 4.26Å; V274-L283 HydrophobicContact CG2-CD2 3.99Å; F277-L283 HydrophobicContact CB-CB 4.04Å; F277-L283 HydrophobicContact CD1-CB 4.48Å; F277-L283 HydrophobicContact CD2-CB 3.78Å; F277-L283 HydrophobicContact CD2-CD1 3.55Å; F277-L283 HydrophobicContact CD2-CG 4.2Å; F277-L283 HydrophobicContact CE2-CB 4.44Å; F277-L283 HydrophobicContact CE2-CD1 3.44Å; F277-L283 VanDerWaalsContact CE2-CD1 3.44Å; F277-L283 HydrophobicContact CG-CB 3.81Å; F277-L283 HydrophobicContact CG-CD1 4.36Å; F277-L283 HydrophobicContact CZ-CD1 4.18Å; S279-L283 PolarHBondContact O-N 2.85Å; I280-L283 HydrophobicContact CD1-CD2 4.41Å; L283-A285 PolarHBondContact O-N 3.22Å; L283-Y286 PolarHBondContact O-N 2.83Å; L283-L287 HydrophobicContact CD1-CD1 4Å; L283-L287 HydrophobicContact CD1-CD2 4.48Å; L283-L287 HydrophobicContact CD1-CG 4.04Å; L283-L287 HydrophobicContact CG-CD1 4.14Å; L283-L287 VanDerWaalsContact O-CG 3.31Å; L283-L287 WeakPolarHBondContact O-CG 3.31Å; L283-L287 PolarHBondContact O-N 2.04Å
284	A	98.8	Very high	97.9	Very high	2 Å²	2	59.8 Å²	59.8	2%	0.017	33%	0.333	C	S	.	.	H	α-helix	trans	-62.8	-42	178.9	0	0	0	0	0	112.3	L193 Y196 I197 I280 V281 E282 Y286 L287 N288	L193-A284 HydrophobicContact CD1-CB 3.89Å; Y196-A284 VanDerWaalsContact CB-CB 3.44Å; Y196-A284 HydrophobicContact CD2-CB 4.46Å; Y196-A284 HydrophobicContact CG-CB 4.13Å; I197-A284 HydrophobicContact CG2-CB 4.25Å; I280-A284 WeakPolarHBondContact O-CB 3.48Å; I280-A284 PolarHBondContact O-N 3.16Å; V281-A284 PolarHBondContact O-N 3.18Å; E282-A284 VanDerWaalsContact C-N 3.35Å; E282-A284 PolarHBondContact O-N 3.31Å; A284-Y286 VanDerWaalsContact C-N 3.33Å; A284-L287 PolarHBondContact O-N 3.32Å; A284-N288 PolarHBondContact O-N 2.68Å; A284-N288 PolarHBondContact O-ND2 3.33Å
285	A	98.8	Very high	97.7	Very high	60 Å²	60	65.2 Å²	65.2	50%	0.496	36%	0.357	S	S	.	.	H	α-helix	trans	-61.6	-42.8	176	0	0	0	0	0	111.3	V281 E282 L283 N288 H289	V281-A285 WeakPolarHBondContact O-CB 3.24Å; V281-A285 PolarHBondContact O-N 3.35Å; E282-A285 PolarHBondContact O-N 3.15Å; L283-A285 PolarHBondContact O-N 3.22Å; A285-N288 PolarHBondContact O-N 3Å; A285-H289 PolarHBondContact O-N 3.08Å
286	Y	98.8	Very high	97.6	Very high	76 Å²	76	62.6 Å²	62.6	30%	0.298	34%	0.335	S	S	.	.	H	α-helix	trans	-63.5	-45.5	176.3	-174.3	-100	0	0	0	112.5	I272 F277 E282 L283 A284 N288 H289 V290 Y300	I272-Y286 HydrophobicContact CD1-CD1 4.2Å; I272-Y286 HydrophobicContact CD1-CE1 3.83Å; I272-Y286 HydrophobicContact CG1-CE1 4.07Å; I272-Y286 HydrophobicContact CG2-CD1 4.3Å; I272-Y286 HydrophobicContact CG2-CE1 4.32Å; F277-Y286 AromaticContact CE1-CD1 3.88Å; F277-Y286 HydrophobicContact CE1-CD1 3.88Å; F277-Y286 AromaticContact CE1-CD2 3.95Å; F277-Y286 HydrophobicContact CE1-CD2 3.95Å; F277-Y286 AromaticContact CE1-CG 3.43Å; F277-Y286 HydrophobicContact CE1-CG 3.43Å; F277-Y286 VanDerWaalsContact CE1-CG 3.43Å; F277-Y286 HydrophobicContact CE2-CD1 4.41Å; F277-Y286 AromaticContact CZ-CD1 3.37Å; F277-Y286 HydrophobicContact CZ-CD1 3.37Å; F277-Y286 HydrophobicContact CZ-CD2 4.21Å; F277-Y286 HydrophobicContact CZ-CE1 4.02Å; F277-Y286 AromaticContact CZ-CG 3.47Å; F277-Y286 HydrophobicContact CZ-CG 3.47Å; F277-Y286 VanDerWaalsContact CZ-CG 3.47Å; E282-Y286 WeakPolarHBondContact O-CB 3.32Å; E282-Y286 PolarHBondContact O-N 3.23Å; L283-Y286 PolarHBondContact O-N 2.83Å; A284-Y286 VanDerWaalsContact C-N 3.33Å; Y286-N288 VanDerWaalsContact C-N 3.3Å; Y286-N288 PolarHBondContact O-N 2.88Å; Y286-H289 WeakPolarHBondContact O-CB 3.34Å; Y286-H289 PolarHBondContact O-N 3.08Å; Y286-H289 VanDerWaalsContact O-N 3.16Å; Y286-V290 HydrophobicContact CD1-CG2 4.07Å; Y286-V290 HydrophobicContact CE1-CG2 3.65Å; Y286-V290 HydrophobicContact CE2-CG2 4.36Å; Y286-V290 WeakPolarHBondContact O-CG2 3.33Å; Y286-V290 PolarHBondContact O-N 2.91Å; Y286-Y300 PolarHBondContact OH-OH 3.09Å
287	L	98.8	Very high	97.5	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.9	-38.5	176.8	-66.3	174.9	0	0	0	112.1	F172 L193 I197 F224 V253 I272 L283 A284 A291	F172-L287 HydrophobicContact CE1-CB 4.18Å; F172-L287 HydrophobicContact CZ-CB 4.15Å; L193-L287 HydrophobicContact CD1-CD1 4.49Å; L193-L287 HydrophobicContact CD2-CD1 4.41Å; I197-L287 HydrophobicContact CD1-CD1 3.66Å; F224-L287 HydrophobicContact CD1-CD2 3.76Å; F224-L287 HydrophobicContact CD2-CD2 4.45Å; F224-L287 HydrophobicContact CE1-CD2 3.64Å; F224-L287 HydrophobicContact CE2-CB 4.26Å; F224-L287 HydrophobicContact CE2-CD2 4.34Å; F224-L287 HydrophobicContact CG-CD2 4.19Å; F224-L287 HydrophobicContact CZ-CB 4.33Å; F224-L287 HydrophobicContact CZ-CD2 3.95Å; F224-L287 WeakPolarHBondContact CZ-O 3.47Å; V253-L287 HydrophobicContact CG2-CD1 4.32Å; V253-L287 HydrophobicContact CG2-CD2 3.71Å; I272-L287 HydrophobicContact CD1-CD2 3.54Å; I272-L287 HydrophobicContact CG2-CD2 4.47Å; L283-L287 HydrophobicContact CD1-CD1 4Å; L283-L287 HydrophobicContact CD1-CD2 4.48Å; L283-L287 HydrophobicContact CD1-CG 4.04Å; L283-L287 HydrophobicContact CG-CD1 4.14Å; L283-L287 VanDerWaalsContact O-CG 3.31Å; L283-L287 WeakPolarHBondContact O-CG 3.31Å; L283-L287 PolarHBondContact O-N 2.04Å; A284-L287 PolarHBondContact O-N 3.32Å; L287-A291 VanDerWaalsContact O-CB 3.31Å; L287-A291 WeakPolarHBondContact O-CB 3.06Å; L287-A291 PolarHBondContact O-N 2.93Å
288	N	98.6	Very high	97.3	Very high	66 Å²	66	60.4 Å²	60.4	35%	0.353	32%	0.324	S	S	.	.	H	α-helix	trans	-65.7	-40.6	173.8	-78.5	-49.1	0	0	0	112.2	F172 A284 A285 Y286 A291 A292	F172-N288 WeakPolarHBondContact CE2-OD1 2.93Å; F172-N288 WeakPolarHBondContact CZ-OD1 3.24Å; A284-N288 PolarHBondContact O-N 2.68Å; A284-N288 PolarHBondContact O-ND2 3.33Å; A285-N288 PolarHBondContact O-N 3Å; Y286-N288 VanDerWaalsContact C-N 3.3Å; Y286-N288 PolarHBondContact O-N 2.88Å; N288-A291 PolarHBondContact O-N 3.09Å; N288-A292 WeakPolarHBondContact O-CB 3.09Å; N288-A292 PolarHBondContact O-N 3.06Å
289	H	98.2	Very high	97.2	Very high	102 Å²	102	53.7 Å²	53.7	47%	0.472	30%	0.295	S	S	.	.	H	α-helix	trans	-60.6	-49.9	174.8	171.2	60.5	0	0	0	111.3	A285 Y286 A291 A292 D293	A285-H289 PolarHBondContact O-N 3.08Å; Y286-H289 WeakPolarHBondContact O-CB 3.34Å; Y286-H289 PolarHBondContact O-N 3.08Å; Y286-H289 VanDerWaalsContact O-N 3.16Å; H289-A291 VanDerWaalsContact C-N 3.29Å; H289-A291 PolarHBondContact O-N 3.42Å; H289-A292 PolarHBondContact O-N 3Å; H289-A292 VanDerWaalsContact O-N 3.14Å; H289-D293 IonicContact CE1-OD2 3.25Å; H289-D293 WeakPolarHBondContact O-CB 3.32Å; H289-D293 PolarHBondContact O-N 3.33Å
290	V	97.9	Very high	97.2	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-61.4	-37	177.1	175.3	0	0	0	0	111.6	F224 I251 Y286 A292 Y297 Y300	F224-V290 HydrophobicContact CE1-CB 4.44Å; F224-V290 HydrophobicContact CE1-CG1 3.99Å; F224-V290 HydrophobicContact CZ-CB 4.04Å; F224-V290 HydrophobicContact CZ-CG1 3.88Å; I251-V290 HydrophobicContact CD1-CG1 3.98Å; Y286-V290 HydrophobicContact CD1-CG2 4.07Å; Y286-V290 HydrophobicContact CE1-CG2 3.65Å; Y286-V290 HydrophobicContact CE2-CG2 4.36Å; Y286-V290 WeakPolarHBondContact O-CG2 3.33Å; Y286-V290 PolarHBondContact O-N 2.91Å; V290-A292 VanDerWaalsContact C-N 3.34Å; V290-Y297 HydrophobicContact CG1-CD2 4.31Å; V290-Y300 HydrophobicContact CG1-CD2 4.3Å; V290-Y300 HydrophobicContact CG1-CE2 4.22Å; V290-Y300 HydrophobicContact CG2-CE2 4.26Å
291	A	96.6	Very high	97	Very high	25 Å²	25	50.8 Å²	50.8	21%	0.207	28%	0.275	C	S	.	.	H	α-helix	trans	-69.2	-29.8	176.8	0	0	0	0	0	113.8	F172 L223 F224 L287 N288 H289	F172-A291 HydrophobicContact CD2-CB 4.32Å; F172-A291 HydrophobicContact CE2-CB 3.58Å; F172-A291 HydrophobicContact CZ-CB 4.12Å; L223-A291 HydrophobicContact CD1-CB 3.71Å; F224-A291 HydrophobicContact CE2-CB 4.13Å; F224-A291 HydrophobicContact CZ-CB 4.49Å; L287-A291 VanDerWaalsContact O-CB 3.31Å; L287-A291 WeakPolarHBondContact O-CB 3.06Å; L287-A291 PolarHBondContact O-N 2.93Å; N288-A291 PolarHBondContact O-N 3.09Å; H289-A291 VanDerWaalsContact C-N 3.29Å; H289-A291 PolarHBondContact O-N 3.42Å
292	A	95.9	Very high	96.8	Very high	91 Å²	91	51.8 Å²	51.8	75%	0.752	27%	0.273	S	S	*	.	H	α-helix	trans	-88.5	-24.3	-178.5	0	0	0	0	0	113	N288 H289 V290	N288-A292 WeakPolarHBondContact O-CB 3.09Å; N288-A292 PolarHBondContact O-N 3.06Å; H289-A292 PolarHBondContact O-N 3Å; H289-A292 VanDerWaalsContact O-N 3.14Å; V290-A292 VanDerWaalsContact C-N 3.34Å
293	D	95.9	Very high	96.6	Very high	59 Å²	59	48.2 Å²	48.2	32%	0.316	26%	0.256	S	S	.	.			trans	-103.5	109.3	-178.2	-173.1	-34.1	0	0	0	111	H289 Q295 A296 Y297	H289-D293 IonicContact CE1-OD2 3.25Å; H289-D293 WeakPolarHBondContact O-CB 3.32Å; H289-D293 PolarHBondContact O-N 3.33Å; D293-Q295 VanDerWaalsContact C-N 3.29Å; D293-Q295 PolarHBondContact O-N 3.29Å; D293-Q295 WeakPolarHBondContact OD1-CA 3.49Å; D293-Q295 WeakPolarHBondContact OD1-CB 3.39Å; D293-Q295 PolarHBondContact OD1-N 2.92Å; D293-A296 HydrophobicContact CB-CB 3.77Å; D293-A296 PolarHBondContact O-N 3.09Å; D293-A296 PolarHBondContact OD1-N 3.14Å; D293-Y297 PolarHBondContact O-N 3.03Å
294	K	92.9	Very high	96.3	Very high	129 Å²	129	49.6 Å²	49.6	56%	0.561	26%	0.262	S	S	*	.	H	α-helix	trans	-55.8	-44	178.2	167.1	160.3	-169.3	-168.7	0	112.3	L167 Y297 E298	L167-K294 HydrophobicContact CD1-CB 3.52Å; L167-K294 HydrophobicContact CD1-CD 3.75Å; L167-K294 HydrophobicContact CD1-CG 3.32Å; K294-Y297 PolarHBondContact O-N 3.23Å; K294-E298 VanDerWaalsContact CE-CD 3.46Å; K294-E298 WeakPolarHBondContact CE-OE1 3.16Å; K294-E298 HydrophobicContact CG-CG 4.37Å; K294-E298 IonicContact NZ-OE1 3.89Å; K294-E298 WeakPolarHBondContact O-CB 2.95Å; K294-E298 WeakPolarHBondContact O-CG 3.02Å; K294-E298 PolarHBondContact O-N 3.01Å
295	Q	94.7	Very high	95.9	Very high	134 Å²	134	57 Å²	57	63%	0.626	29%	0.294	S	S	*	.	H	α-helix	trans	-66.2	-48.9	-178.1	-175.8	177.4	-6.7	0	0	109.5	D293 Y297 E298 E299	D293-Q295 VanDerWaalsContact C-N 3.29Å; D293-Q295 PolarHBondContact O-N 3.29Å; D293-Q295 WeakPolarHBondContact OD1-CA 3.49Å; D293-Q295 WeakPolarHBondContact OD1-CB 3.39Å; D293-Q295 PolarHBondContact OD1-N 2.92Å; Q295-Y297 VanDerWaalsContact C-N 3.29Å; Q295-Y297 PolarHBondContact O-N 3.03Å; Q295-E298 PolarHBondContact O-N 3.24Å; Q295-E298 VanDerWaalsContact O-N 3.11Å; Q295-E299 WeakPolarHBondContact O-CG 3.42Å; Q295-E299 PolarHBondContact O-N 2.74Å
296	A	96.4	Very high	95.6	Very high	21 Å²	21	57.8 Å²	57.8	17%	0.174	29%	0.293	C	S	.	.	H	α-helix	trans	-57.4	-41.1	178.3	0	0	0	0	0	112.4	D293 Y300	D293-A296 HydrophobicContact CB-CB 3.77Å; D293-A296 PolarHBondContact O-N 3.09Å; D293-A296 PolarHBondContact OD1-N 3.14Å; A296-Y300 WeakPolarHBondContact O-CD2 3.28Å
297	Y	96.4	Very high	95.4	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.3	-45.1	174.9	-176.7	-99.9	0	0	0	112.6	L167 R169 L223 I251 V290 D293 K294 Q295 E299 Y300 F301	L167-Y297 HydrophobicContact CD1-CD1 4.15Å; L167-Y297 HydrophobicContact CD2-CD1 3.52Å; L167-Y297 HydrophobicContact CD2-CD2 4.23Å; L167-Y297 HydrophobicContact CD2-CE1 4.15Å; L167-Y297 HydrophobicContact CD2-CG 3.55Å; L167-Y297 HydrophobicContact CG-CD1 3.49Å; L167-Y297 VanDerWaalsContact CG-CD1 3.49Å; L167-Y297 HydrophobicContact CG-CE1 3.94Å; L167-Y297 HydrophobicContact CG-CG 4.08Å; R169-Y297 PolarHBondContact NE-OH 3.33Å; L223-Y297 HydrophobicContact CB-CE2 4Å; L223-Y297 HydrophobicContact CD2-CD2 4.23Å; L223-Y297 HydrophobicContact CD2-CE2 3.58Å; L223-Y297 HydrophobicContact CG-CE2 4.39Å; I251-Y297 HydrophobicContact CD1-CD2 3.33Å; I251-Y297 HydrophobicContact CD1-CE2 3.46Å; I251-Y297 VanDerWaalsContact CD1-CE2 3.46Å; I251-Y297 HydrophobicContact CD1-CG 4.18Å; I251-Y297 HydrophobicContact CG1-CD2 4.3Å; I251-Y297 HydrophobicContact CG1-CE2 3.94Å; V290-Y297 HydrophobicContact CG1-CD2 4.31Å; D293-Y297 PolarHBondContact O-N 3.03Å; K294-Y297 PolarHBondContact O-N 3.23Å; Q295-Y297 VanDerWaalsContact C-N 3.29Å; Q295-Y297 PolarHBondContact O-N 3.03Å; Y297-E299 VanDerWaalsContact C-N 3.3Å; Y297-E299 PolarHBondContact O-N 2.85Å; Y297-Y300 PolarHBondContact O-N 2Å; Y297-F301 HydrophobicContact CD1-CD2 4.42Å; Y297-F301 AromaticContact CD1-CE2 3.96Å; Y297-F301 HydrophobicContact CD1-CE2 3.96Å; Y297-F301 HydrophobicContact CD2-CE2 4.44Å; Y297-F301 HydrophobicContact CE1-CD2 4.23Å; Y297-F301 AromaticContact CE1-CE2 3.5Å; Y297-F301 HydrophobicContact CE1-CE2 3.5Å; Y297-F301 VanDerWaalsContact CE1-CE2 3.5Å; Y297-F301 HydrophobicContact CE1-CZ 4.28Å; Y297-F301 AromaticContact CE2-CE2 3.99Å; Y297-F301 HydrophobicContact CE2-CE2 3.99Å; Y297-F301 HydrophobicContact CE2-CZ 4.45Å; Y297-F301 HydrophobicContact CG-CE2 4.42Å; Y297-F301 AromaticContact CZ-CE2 3.5Å; Y297-F301 VanDerWaalsContact CZ-CE2 3.5Å; Y297-F301 AromaticContact CZ-CZ 3.93Å; Y297-F301 VanDerWaalsContact O-CD2 3.31Å; Y297-F301 WeakPolarHBondContact O-CD2 3.3Å
298	E	94.5	Very high	95.2	Very high	64 Å²	64	62.1 Å²	62.1	30%	0.299	31%	0.311	S	S	.	.	H	α-helix	trans	-68.9	-26.3	-178.2	-71	-177.3	163.4	0	0	113.1	S165 K294 Q295 Y300 F301	S165-E298 WeakPolarHBondContact OG-CG 3.47Å; K294-E298 VanDerWaalsContact CE-CD 3.46Å; K294-E298 WeakPolarHBondContact CE-OE1 3.16Å; K294-E298 HydrophobicContact CG-CG 4.37Å; K294-E298 IonicContact NZ-OE1 3.89Å; K294-E298 WeakPolarHBondContact O-CB 2.95Å; K294-E298 WeakPolarHBondContact O-CG 3.02Å; K294-E298 PolarHBondContact O-N 3.01Å; Q295-E298 PolarHBondContact O-N 3.24Å; Q295-E298 VanDerWaalsContact O-N 3.11Å; E298-Y300 VanDerWaalsContact C-N 3.25Å; E298-Y300 PolarHBondContact O-N 3.04Å; E298-F301 PolarHBondContact O-N 3.24Å; E298-F301 VanDerWaalsContact O-N 3.12Å
299	E	95.8	Very high	95	Very high	52 Å²	52	60.7 Å²	60.7	24%	0.243	30%	0.303	C	S	.	.	H	α-helix	trans	-54.4	-41.6	173.4	-69.5	-54.4	134.7	0	0	111.9	Q295 Y297 F301 K302	Q295-E299 WeakPolarHBondContact O-CG 3.42Å; Q295-E299 PolarHBondContact O-N 2.74Å; Y297-E299 VanDerWaalsContact C-N 3.3Å; Y297-E299 PolarHBondContact O-N 2.85Å; E299-F301 PolarHBondContact O-N 3.13Å; E299-K302 WeakPolarHBondContact O-CB 3.37Å; E299-K302 PolarHBondContact O-N 2.84Å; E299-K302 VanDerWaalsContact O-N 3.12Å; E299-K302 WeakPolarHBondContact OE1-CE 3.34Å; E299-K302 IonicContact OE1-NZ 3.76Å; E299-K302 PolarHBondContact OE1-NZ 3.31Å; E299-K302 VanDerWaalsContact OE2-CD 3.25Å; E299-K302 WeakPolarHBondContact OE2-CD 3.45Å; E299-K302 WeakPolarHBondContact OE2-CE 3.48Å; E299-K302 IonicContact OE2-NZ 2.83Å; E299-K302 PolarHBondContact OE2-NZ 3.01Å
300	Y	97.2	Very high	94.8	Very high	11 Å²	11	58.6 Å²	58.6	4%	0.043	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-10	-179.4	-80	-81	0	0	0	115	I251 H269 I272 Y286 V290 A296 Y297 E298 W303	I251-Y300 HydrophobicContact CD1-CD2 3.73Å; I251-Y300 HydrophobicContact CD1-CG 3.8Å; I251-Y300 HydrophobicContact CG1-CG 4.18Å; I251-Y300 HydrophobicContact CG2-CD1 3.87Å; I251-Y300 HydrophobicContact CG2-CD2 4.46Å; I251-Y300 HydrophobicContact CG2-CE1 4.28Å; I251-Y300 HydrophobicContact CG2-CG 3.98Å; H269-Y300 WeakPolarHBondContact O-CA 3.31Å; H269-Y300 WeakPolarHBondContact O-CD1 3.2Å; I272-Y300 HydrophobicContact CD1-CE1 4.46Å; I272-Y300 HydrophobicContact CD1-CE2 4.38Å; I272-Y300 HydrophobicContact CG1-CE1 3.73Å; I272-Y300 HydrophobicContact CG1-CE2 4.42Å; I272-Y300 WeakPolarHBondContact CG1-OH 3.43Å; Y286-Y300 PolarHBondContact OH-OH 3.09Å; V290-Y300 HydrophobicContact CG1-CD2 4.3Å; V290-Y300 HydrophobicContact CG1-CE2 4.22Å; V290-Y300 HydrophobicContact CG2-CE2 4.26Å; A296-Y300 WeakPolarHBondContact O-CD2 3.28Å; Y297-Y300 PolarHBondContact O-N 2Å; E298-Y300 VanDerWaalsContact C-N 3.25Å; E298-Y300 PolarHBondContact O-N 3.04Å; Y300-W303 PolarHBondContact O-NE1 2.7Å
301	F	94.8	Very high	94.7	Very high	15 Å²	15	59.6 Å²	59.6	7%	0.066	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-1.5	179.5	-61.4	-77.7	0	0	0	113	F163 G249 I251 Y297 E298 E299 W303 H304	F163-F301 HydrophobicContact CD1-CB 4.27Å; F163-F301 HydrophobicContact CD1-CD1 4.4Å; F163-F301 HydrophobicContact CE1-CB 3.75Å; F163-F301 AromaticContact CE1-CD1 3.29Å; F163-F301 HydrophobicContact CE1-CD1 3.29Å; F163-F301 HydrophobicContact CE1-CE1 4Å; F163-F301 AromaticContact CE1-CG 3.6Å; F163-F301 HydrophobicContact CE1-CG 3.6Å; F163-F301 AromaticContact CZ-CD1 3.46Å; F163-F301 HydrophobicContact CZ-CD1 3.46Å; F163-F301 VanDerWaalsContact CZ-CD1 3.46Å; F163-F301 AromaticContact CZ-CE1 3.73Å; F163-F301 HydrophobicContact CZ-CE1 3.73Å; F163-F301 HydrophobicContact CZ-CG 4.21Å; G249-F301 WeakPolarHBondContact O-CE1 2.99Å; I251-F301 HydrophobicContact CD1-CE2 4.04Å; I251-F301 HydrophobicContact CD1-CZ 4.45Å; I251-F301 HydrophobicContact CG1-CE2 3.66Å; I251-F301 HydrophobicContact CG1-CZ 3.59Å; Y297-F301 HydrophobicContact CD1-CD2 4.42Å; Y297-F301 AromaticContact CD1-CE2 3.96Å; Y297-F301 HydrophobicContact CD1-CE2 3.96Å; Y297-F301 HydrophobicContact CD2-CE2 4.44Å; Y297-F301 HydrophobicContact CE1-CD2 4.23Å; Y297-F301 AromaticContact CE1-CE2 3.5Å; Y297-F301 HydrophobicContact CE1-CE2 3.5Å; Y297-F301 VanDerWaalsContact CE1-CE2 3.5Å; Y297-F301 HydrophobicContact CE1-CZ 4.28Å; Y297-F301 AromaticContact CE2-CE2 3.99Å; Y297-F301 HydrophobicContact CE2-CE2 3.99Å; Y297-F301 HydrophobicContact CE2-CZ 4.45Å; Y297-F301 HydrophobicContact CG-CE2 4.42Å; Y297-F301 AromaticContact CZ-CE2 3.5Å; Y297-F301 VanDerWaalsContact CZ-CE2 3.5Å; Y297-F301 AromaticContact CZ-CZ 3.93Å; Y297-F301 VanDerWaalsContact O-CD2 3.31Å; Y297-F301 WeakPolarHBondContact O-CD2 3.3Å; E298-F301 PolarHBondContact O-N 3.24Å; E298-F301 VanDerWaalsContact O-N 3.12Å; E299-F301 PolarHBondContact O-N 3.13Å; F301-W303 PolarHBondContact O-N 3.3Å; F301-H304 WeakPolarHBondContact O-CB 3.48Å; F301-H304 PolarHBondContact O-CD2 2.98Å; F301-H304 PolarHBondContact O-N 3.32Å; F301-H304 VanDerWaalsContact O-N 3.14Å
302	K	94.3	Very high	94.6	Very high	94 Å²	94	59.2 Å²	59.2	41%	0.409	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-60.7	-27.7	179.5	-76.1	-172.8	179.4	173.1	0	113.3	E299 H304 K305	E299-K302 WeakPolarHBondContact O-CB 3.37Å; E299-K302 PolarHBondContact O-N 2.84Å; E299-K302 VanDerWaalsContact O-N 3.12Å; E299-K302 WeakPolarHBondContact OE1-CE 3.34Å; E299-K302 IonicContact OE1-NZ 3.76Å; E299-K302 PolarHBondContact OE1-NZ 3.31Å; E299-K302 VanDerWaalsContact OE2-CD 3.25Å; E299-K302 WeakPolarHBondContact OE2-CD 3.45Å; E299-K302 WeakPolarHBondContact OE2-CE 3.48Å; E299-K302 IonicContact OE2-NZ 2.83Å; E299-K302 PolarHBondContact OE2-NZ 3.01Å; K302-H304 PolarHBondContact O-N 2.83Å; K302-H304 VanDerWaalsContact O-N 3.15Å; K302-K305 WeakPolarHBondContact O-CB 3.44Å; K302-K305 WeakPolarHBondContact O-CG 3.35Å; K302-K305 PolarHBondContact O-N 2.83Å
303	W	94.6	Very high	94.4	Very high	11 Å²	11	59 Å²	59	4%	0.042	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-59.2	-24.4	177.8	65.5	-97.3	0	0	0	113.2	F246 P267 Y300 F301 K305 T306 H307 I309	F246-W303 AromaticContact CD1-CZ2 3.94Å; F246-W303 HydrophobicContact CD1-CZ2 3.94Å; F246-W303 HydrophobicContact CE1-CZ2 4.33Å; F246-W303 HydrophobicContact CG-CZ2 4.41Å; P267-W303 HydrophobicContact CB-CB 3.65Å; P267-W303 HydrophobicContact CB-CD2 3.61Å; P267-W303 HydrophobicContact CB-CE3 3.76Å; P267-W303 HydrophobicContact CB-CG 3.58Å; P267-W303 HydrophobicContact CG-CD2 3.75Å; P267-W303 HydrophobicContact CG-CE3 3.64Å; P267-W303 HydrophobicContact CG-CG 4.26Å; P267-W303 HydrophobicContact CG-CH2 4.39Å; P267-W303 HydrophobicContact CG-CZ3 3.97Å; Y300-W303 PolarHBondContact O-NE1 2.7Å; F301-W303 PolarHBondContact O-N 3.3Å; W303-K305 PolarHBondContact O-N 2.9Å; W303-K305 VanDerWaalsContact O-N 3.08Å; W303-T306 PolarHBondContact O-N 3.26Å; W303-T306 PolarHBondContact O-OG1 3.1Å; W303-H307 HydrophobicContact CE3-CB 4.07Å; W303-H307 PolarHBondContact O-N 3.16Å; W303-I309 HydrophobicContact CH2-CD1 4.04Å; W303-I309 HydrophobicContact CH2-CG1 3.49Å; W303-I309 VanDerWaalsContact CH2-CG1 3.49Å; W303-I309 HydrophobicContact CZ3-CD1 4.05Å; W303-I309 HydrophobicContact CZ3-CG1 3.75Å
304	H	92.5	Very high	94.3	Very high	29 Å²	29	57.4 Å²	57.4	13%	0.134	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-59.3	-21	174.7	-78.8	-76.3	0	0	0	113.4	G159 F163 F301 K302 T306	G159-H304 PolarHBondContact N-O 3.17Å; F163-H304 HydrophobicContact CB-CB 4.49Å; F163-H304 AromaticContact CD1-CD2 3.65Å; F163-H304 AromaticContact CD1-NE2 3.96Å; F163-H304 AromaticContact CD2-NE2 3.91Å; F163-H304 AromaticContact CE1-CD2 3.89Å; F163-H304 AromaticContact CE1-NE2 3.93Å; F163-H304 AromaticContact CE2-NE2 3.86Å; F163-H304 AromaticContact CG-CD2 3.9Å; F163-H304 AromaticContact CG-NE2 3.96Å; F163-H304 AromaticContact CZ-NE2 3.87Å; F301-H304 WeakPolarHBondContact O-CB 3.48Å; F301-H304 PolarHBondContact O-CD2 2.98Å; F301-H304 PolarHBondContact O-N 3.32Å; F301-H304 VanDerWaalsContact O-N 3.14Å; K302-H304 PolarHBondContact O-N 2.83Å; K302-H304 VanDerWaalsContact O-N 3.15Å; H304-T306 VanDerWaalsContact C-N 3.27Å; H304-T306 PolarHBondContact O-N 3.02Å
305	K	91.4	Very high	94.5	Very high	156 Å²	156	52.6 Å²	52.6	68%	0.678	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-69.6	-25.6	175.7	-63.3	-179.8	-179.1	-178.2	0	112.8	A158 K302 W303	A158-K305 WeakPolarHBondContact CB-O 3.32Å; K302-K305 WeakPolarHBondContact O-CB 3.44Å; K302-K305 WeakPolarHBondContact O-CG 3.35Å; K302-K305 PolarHBondContact O-N 2.83Å; W303-K305 PolarHBondContact O-N 2.9Å; W303-K305 VanDerWaalsContact O-N 3.08Å
306	T	92.1	Very high	94.6	Very high	78 Å²	78	48.1 Å²	48.1	48%	0.479	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.9	-17.5	-169.7	48.7	0	0	0	0	113.6	G157 W303 H304	G157-T306 CarbonylContact C-O 3.58Å; G157-T306 PolarHBondContact N-O 2.82Å; G157-T306 CarbonylContact O-C 3.6Å; W303-T306 PolarHBondContact O-N 3.26Å; W303-T306 PolarHBondContact O-OG1 3.1Å; H304-T306 VanDerWaalsContact C-N 3.27Å; H304-T306 PolarHBondContact O-N 3.02Å
307	H	94.3	Very high	94.6	Very high	48 Å²	48	48.1 Å²	48.1	22%	0.222	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	157.3	-177.3	-51.8	80	0	0	0	112.2	T154 L155 G157 G159 P267 W303	T154-H307 HydrophobicContact CG2-CB 3.75Å; L155-H307 CarbonylContact O-C 3.53Å; L155-H307 VanDerWaalsContact O-CA 3.27Å; L155-H307 WeakPolarHBondContact O-CA 3.49Å; G157-H307 CarbonylContact O-C 3.58Å; G157-H307 WeakPolarHBondContact O-CA 3.49Å; G157-H307 PolarHBondContact O-N 3.01Å; G159-H307 PolarHBondContact N-O 3.36Å; P267-H307 HydrophobicContact CB-CB 4.44Å; W303-H307 HydrophobicContact CE3-CB 4.07Å; W303-H307 PolarHBondContact O-N 3.16Å
308	R	93.5	Very high	94.6	Very high	119 Å²	119	48.6 Å²	48.6	45%	0.449	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	155.7	171.7	67	-172.8	176.6	92.7	-2	110.2	L155 G157	L155-R308 HydrophobicContact CB-CG 3.84Å; L155-R308 VanDerWaalsContact CD1-CZ 3.48Å; L155-R308 PolarHBondContact N-O 3.26Å; L155-R308 PolarHBondContact O-N 2.99Å; G157-R308 PolarHBondContact O-N 3.42Å
309	I	94.6	Very high	94.8	Very high	35 Å²	35	45.7 Å²	45.7	18%	0.179	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	131.1	179.7	-58.3	-62.1	0	0	0	109.8	W242 F246 P267 W303 T311	W242-I309 HydrophobicContact CE3-CD1 4.15Å; W242-I309 HydrophobicContact CE3-CG2 3.88Å; W242-I309 HydrophobicContact CZ3-CD1 3.85Å; W242-I309 HydrophobicContact CZ3-CG2 4.46Å; F246-I309 HydrophobicContact CB-CG1 4.03Å; F246-I309 HydrophobicContact CD2-CD1 3.69Å; F246-I309 HydrophobicContact CD2-CG1 3.93Å; F246-I309 HydrophobicContact CD2-CG2 4.48Å; F246-I309 HydrophobicContact CE2-CD1 4.01Å; F246-I309 HydrophobicContact CG-CD1 4.34Å; F246-I309 HydrophobicContact CG-CG1 4.17Å; P267-I309 HydrophobicContact CG-CD1 3.63Å; W303-I309 HydrophobicContact CH2-CD1 4.04Å; W303-I309 HydrophobicContact CH2-CG1 3.49Å; W303-I309 VanDerWaalsContact CH2-CG1 3.49Å; W303-I309 HydrophobicContact CZ3-CD1 4.05Å; W303-I309 HydrophobicContact CZ3-CG1 3.75Å; I309-T311 HydrophobicContact CG2-CG2 4.13Å
310	K	94.8	Very high	94.8	Very high	59 Å²	59	43.2 Å²	43.2	26%	0.257	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	135.9	164.4	-178.7	-178.3	177.6	-168.5	0	108.7	G152 E153 L155 Y312 E317	G152-K310 CarbonylContact C-O 3.39Å; G152-K310 WeakPolarHBondContact CA-O 3.23Å; E153-K310 PolarHBondContact N-O 3.37Å; E153-K310 PolarHBondContact O-N 3.03Å; L155-K310 HydrophobicContact CD1-CB 3.7Å; L155-K310 HydrophobicContact CD1-CD 4.04Å; L155-K310 HydrophobicContact CD1-CG 4.46Å; L155-K310 HydrophobicContact CG-CB 4.33Å; K310-Y312 HydrophobicContact CD-CE2 4.28Å; K310-Y312 HydrophobicContact CG-CE2 4.48Å; K310-Y312 PolarHBondContact NZ-OH 2.72Å; K310-Y312 VanDerWaalsContact NZ-OH 3.15Å; K310-E317 WeakPolarHBondContact CE-OE1 3.14Å; K310-E317 IonicContact NZ-OE1 2.82Å; K310-E317 PolarHBondContact NZ-OE1 3.37Å
311	T	95.6	Very high	94.8	Very high	21 Å²	21	44.1 Å²	44.1	13%	0.129	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.8	175.5	55.5	0	0	0	0	110.5	W242 R243 Q247 I309 T313	W242-T311 HydrophobicContact CB-CG2 4.1Å; R243-T311 HydrophobicContact CB-CG2 4.45Å; Q247-T311 HydrophobicContact CG-CG2 4.27Å; Q247-T311 PolarHBondContact NE2-OG1 3.29Å; I309-T311 HydrophobicContact CG2-CG2 4.13Å; T311-T313 PolarHBondContact O-N 3.12Å
312	Y	94.4	Very high	94.9	Very high	18 Å²	18	43.4 Å²	43.4	7%	0.071	20%	0.203	C	C	.	.			trans	-97.3	80.5	177.3	-68.9	-89.8	0	0	0	109.9	P150 Y151 E153 K310 E317 R318	P150-Y312 HydrophobicContact CG-CD2 4.31Å; P150-Y312 HydrophobicContact CG-CE2 4.2Å; P150-Y312 WeakPolarHBondContact O-CB 3.4Å; Y151-Y312 PolarHBondContact O-N 2.82Å; E153-Y312 HydrophobicContact CB-CE2 4.19Å; E153-Y312 PolarHBondContact OE2-OH 2.8Å; K310-Y312 HydrophobicContact CD-CE2 4.28Å; K310-Y312 HydrophobicContact CG-CE2 4.48Å; K310-Y312 PolarHBondContact NZ-OH 2.72Å; K310-Y312 VanDerWaalsContact NZ-OH 3.15Å; Y312-E317 HydrophobicContact CD1-CG 4.08Å; Y312-E317 HydrophobicContact CE1-CG 4.2Å; Y312-R318 PolarHBondContact O-NE 3.08Å; Y312-R318 PolarHBondContact O-NH2 3.04Å
313	T	92	Very high	95	Very high	86 Å²	86	39.7 Å²	39.7	53%	0.528	19%	0.189	S	C	.	.			trans	-97.7	-17.2	-179.6	53.4	0	0	0	0	113.5	T311	T311-T313 PolarHBondContact O-N 3.12Å
314	D	94.6	Very high	95	Very high	26 Å²	26	44 Å²	44	14%	0.139	21%	0.212	C	C	.	.			trans	-93.4	121.6	-179.9	-164	-30.7	0	0	0	110.7	Y68 R316 E317 R318	Y68-D314 WeakPolarHBondContact OH-CB 3.35Å; Y68-D314 PolarHBondContact OH-OD2 3.2Å; D314-R316 PolarHBondContact O-N 3.07Å; D314-R316 VanDerWaalsContact OD1-CB 3.31Å; D314-R316 WeakPolarHBondContact OD1-CB 3.29Å; D314-R316 IonicContact OD1-CZ 3Å; D314-R316 PolarHBondContact OD1-N 2.88Å; D314-R316 IonicContact OD1-NE 3.76Å; D314-R316 PolarHBondContact OD1-NE 2.85Å; D314-R316 IonicContact OD1-NH2 3.36Å; D314-R316 IonicContact OD2-CZ 3.22Å; D314-R316 IonicContact OD2-NE 2.7Å; D314-R316 PolarHBondContact OD2-NE 3.07Å; D314-R316 IonicContact OD2-NH2 2.68Å; D314-R316 PolarHBondContact OD2-NH2 3.49Å; D314-E317 HydrophobicContact CB-CB 4.3Å; D314-E317 PolarHBondContact O-N 3.31Å; D314-R318 WeakPolarHBondContact O-CG 3.47Å; D314-R318 PolarHBondContact O-N 3.05Å
315	W	95.7	Very high	95.2	Very high	28 Å²	28	47 Å²	47	11%	0.106	22%	0.224	C	C	.	.	H	α-helix	trans	-61.8	-28.6	176.7	-77.3	113.4	0	0	0	113.1	W51 P52 F53 Y57 L117 M119 R318 L319	W51-W315 HydrophobicContact CE3-CB 4.5Å; W51-W315 HydrophobicContact CZ3-CB 3.85Å; P52-W315 HydrophobicContact CB-CD2 4.1Å; P52-W315 VanDerWaalsContact CB-CE2 3.49Å; P52-W315 HydrophobicContact CB-CH2 4.09Å; P52-W315 HydrophobicContact CB-CZ2 3.49Å; P52-W315 VanDerWaalsContact CB-CZ2 3.49Å; P52-W315 HydrophobicContact CG-CD2 3.75Å; P52-W315 HydrophobicContact CG-CE3 3.96Å; P52-W315 HydrophobicContact CG-CG 4.31Å; P52-W315 HydrophobicContact CG-CH2 4.05Å; P52-W315 HydrophobicContact CG-CZ2 3.84Å; P52-W315 HydrophobicContact CG-CZ3 4.12Å; F53-W315 HydrophobicContact CD2-CZ2 4.38Å; F53-W315 HydrophobicContact CE2-CZ2 4.08Å; Y57-W315 HydrophobicContact CE2-CB 4.43Å; Y57-W315 AromaticContact CE2-CD1 3.86Å; L117-W315 HydrophobicContact CD1-CZ3 4.31Å; L117-W315 HydrophobicContact CD2-CE3 4.42Å; L117-W315 HydrophobicContact CD2-CZ3 3.94Å; L117-W315 HydrophobicContact CG-CZ3 4.46Å; M119-W315 HydrophobicContact CB-CH2 4.43Å; M119-W315 HydrophobicContact CG-CH2 3.7Å; M119-W315 HydrophobicContact CG-CZ3 4.07Å; W315-R318 HydrophobicContact CE3-CB 4.27Å; W315-R318 VanDerWaalsContact CE3-CD 3.48Å; W315-R318 HydrophobicContact CE3-CG 4.45Å; W315-R318 WeakPolarHBondContact O-CB 3.43Å; W315-R318 PolarHBondContact O-N 3.4Å; W315-L319 VanDerWaalsContact O-CG 3.26Å; W315-L319 WeakPolarHBondContact O-CG 3.47Å; W315-L319 PolarHBondContact O-N 3.3Å
316	R	96.8	Very high	95.3	Very high	39 Å²	39	42.8 Å²	42.8	15%	0.147	21%	0.205	C	C	.	.	H	α-helix	trans	-65.2	-46.4	176.7	-62.9	170.1	-68.9	-175.4	3.3	110.6	W51 L59 Y68 L75 D314 R318 L319 C320	W51-R316 HydrophobicContact CH2-CG 4.27Å; L59-R316 HydrophobicContact CD2-CG 3.72Å; Y68-R316 HydrophobicContact CE2-CB 4.07Å; L75-R316 HydrophobicContact CD1-CB 4.2Å; D314-R316 PolarHBondContact O-N 3.07Å; D314-R316 VanDerWaalsContact OD1-CB 3.31Å; D314-R316 WeakPolarHBondContact OD1-CB 3.29Å; D314-R316 IonicContact OD1-CZ 3Å; D314-R316 PolarHBondContact OD1-N 2.88Å; D314-R316 IonicContact OD1-NE 3.76Å; D314-R316 PolarHBondContact OD1-NE 2.85Å; D314-R316 IonicContact OD1-NH2 3.36Å; D314-R316 IonicContact OD2-CZ 3.22Å; D314-R316 IonicContact OD2-NE 2.7Å; D314-R316 PolarHBondContact OD2-NE 3.07Å; D314-R316 IonicContact OD2-NH2 2.68Å; D314-R316 PolarHBondContact OD2-NH2 3.49Å; R316-R318 VanDerWaalsContact C-N 3.28Å; R316-R318 PolarHBondContact O-N 3.29Å; R316-L319 PolarHBondContact O-N 2.96Å; R316-C320 PolarHBondContact O-N 3.31Å; R316-C320 PolarHBondContact O-SG 3.47Å
317	E	96.7	Very high	95.4	Very high	21 Å²	21	43.9 Å²	43.9	10%	0.098	21%	0.213	C	C	.	.	H	α-helix	trans	-58.2	-44	175.8	-168.3	176	-172.3	0	0	111.6	Y68 K310 Y312 D314 C320 Q321	Y68-E317 HydrophobicContact CD1-CB 4Å; Y68-E317 HydrophobicContact CD1-CG 3.68Å; Y68-E317 HydrophobicContact CD2-CB 4.31Å; Y68-E317 HydrophobicContact CD2-CG 4.44Å; Y68-E317 HydrophobicContact CE1-CB 3.51Å; Y68-E317 HydrophobicContact CE1-CG 3.69Å; Y68-E317 VanDerWaalsContact CE2-CA 3.48Å; Y68-E317 HydrophobicContact CE2-CB 3.87Å; Y68-E317 HydrophobicContact CE2-CG 4.45Å; Y68-E317 HydrophobicContact CG-CB 4.38Å; Y68-E317 HydrophobicContact CG-CG 4.08Å; Y68-E317 VanDerWaalsContact CZ-CB 3.44Å; Y68-E317 PolarHBondContact OH-N 3.41Å; K310-E317 WeakPolarHBondContact CE-OE1 3.14Å; K310-E317 IonicContact NZ-OE1 2.82Å; K310-E317 PolarHBondContact NZ-OE1 3.37Å; Y312-E317 HydrophobicContact CD1-CG 4.08Å; Y312-E317 HydrophobicContact CE1-CG 4.2Å; D314-E317 HydrophobicContact CB-CB 4.3Å; D314-E317 PolarHBondContact O-N 3.31Å; E317-C320 PolarHBondContact O-N 3.41Å; E317-Q321 WeakPolarHBondContact O-CG 3.22Å; E317-Q321 PolarHBondContact O-N 2.87Å; E317-Q321 PolarHBondContact O-NE2 3.18Å
318	R	96.8	Very high	95.4	Very high	10 Å²	10	46.1 Å²	46.1	4%	0.038	23%	0.234	C	C	.	.	H	α-helix	trans	-57.6	-51.9	177.1	-65.3	-178.4	167.9	-86.9	-2	110.2	M119 M139 T149 P150 Y312 D314 W315 R316 C320 Q321	M119-R318 PolarHBondContact SD-NH1 3.08Å; M139-R318 HydrophobicContact CE-CB 3.83Å; M139-R318 WeakPolarHBondContact CE-O 3.33Å; T149-R318 HydrophobicContact CG2-CB 3.76Å; T149-R318 HydrophobicContact CG2-CG 3.55Å; T149-R318 VanDerWaalsContact CG2-NH1 3.29Å; T149-R318 PolarHBondContact O-NH1 3.43Å; P150-R318 PolarHBondContact O-NH1 2.82Å; P150-R318 PolarHBondContact O-NH2 3.13Å; Y312-R318 PolarHBondContact O-NE 3.08Å; Y312-R318 PolarHBondContact O-NH2 3.04Å; D314-R318 WeakPolarHBondContact O-CG 3.47Å; D314-R318 PolarHBondContact O-N 3.05Å; W315-R318 HydrophobicContact CE3-CB 4.27Å; W315-R318 VanDerWaalsContact CE3-CD 3.48Å; W315-R318 HydrophobicContact CE3-CG 4.45Å; W315-R318 WeakPolarHBondContact O-CB 3.43Å; W315-R318 PolarHBondContact O-N 3.4Å; R316-R318 VanDerWaalsContact C-N 3.28Å; R316-R318 PolarHBondContact O-N 3.29Å; R318-C320 VanDerWaalsContact C-N 3.33Å; R318-C320 PolarHBondContact O-N 3.39Å; R318-Q321 VanDerWaalsContact O-CB 3.23Å; R318-Q321 WeakPolarHBondContact O-CB 3.43Å; R318-Q321 WeakPolarHBondContact O-CG 3.33Å; R318-Q321 PolarHBondContact O-N 3.48Å
319	L	97.6	Very high	95.4	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.016	22%	0.217	C	C	.	.	H	α-helix	trans	-62.5	-38.1	179.7	-67.6	165	0	0	0	112.3	L48 L75 V89 W315 R316 Q321 I322	L48-L319 HydrophobicContact CB-CD1 4.33Å; L48-L319 HydrophobicContact CD1-CD1 4.31Å; L48-L319 HydrophobicContact CD1-CD2 4.17Å; L48-L319 HydrophobicContact CD2-CD1 3.95Å; L48-L319 HydrophobicContact CG-CD1 4.43Å; L75-L319 HydrophobicContact CD1-CB 4.04Å; L75-L319 HydrophobicContact CD2-CB 3.89Å; V89-L319 HydrophobicContact CB-CD2 4.14Å; V89-L319 HydrophobicContact CG1-CD2 3.89Å; V89-L319 HydrophobicContact CG2-CD2 4.02Å; W315-L319 VanDerWaalsContact O-CG 3.26Å; W315-L319 WeakPolarHBondContact O-CG 3.47Å; W315-L319 PolarHBondContact O-N 3.3Å; R316-L319 PolarHBondContact O-N 2.96Å; L319-Q321 PolarHBondContact O-N 3.41Å; L319-Q321 VanDerWaalsContact O-N 3.16Å; L319-I322 HydrophobicContact CD2-CD1 4.3Å; L319-I322 VanDerWaalsContact O-CB 3.28Å; L319-I322 WeakPolarHBondContact O-CB 3.46Å; L319-I322 WeakPolarHBondContact O-CG1 3.43Å; L319-I322 PolarHBondContact O-N 3Å
320	C	97.3	Very high	95.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-21.4	175.7	-60	0	0	0	0	113.2	C64 Y68 I70 R316 E317 R318 I322 C323	C64-C320 WeakPolarHBondContact CA-SG 3.44Å; C64-C320 HydrophobicContact CB-CB 3.86Å; C64-C320 WeakPolarHBondContact CB-SG 3.23Å; C64-C320 WeakPolarHBondContact SG-CB 3.33Å; C64-C320 CovalentContact SG-SG 2.04Å; C64-C320 PolarHBondContact SG-SG 3Å; Y68-C320 HydrophobicContact CD2-CB 4.48Å; I70-C320 HydrophobicContact CD1-CB 3.72Å; R316-C320 PolarHBondContact O-N 3.31Å; R316-C320 PolarHBondContact O-SG 3.47Å; E317-C320 PolarHBondContact O-N 3.41Å; R318-C320 VanDerWaalsContact C-N 3.33Å; R318-C320 PolarHBondContact O-N 3.39Å; C320-I322 PolarHBondContact O-N 3.28Å; C320-C323 WeakPolarHBondContact O-CB 3.45Å; C320-C323 PolarHBondContact O-N 2.81Å; C320-C323 VanDerWaalsContact O-N 3.15Å
321	Q	96.6	Very high	95.1	Very high	31 Å²	31	45.2 Å²	45.2	15%	0.145	25%	0.249	C	C	.	.	H	α-helix	trans	-62.5	-25.4	174.3	-59	-51.3	-62.7	0	0	112.7	V147 T149 E317 R318 L319 C323 L324 K325	V147-Q321 HydrophobicContact CG1-CB 4.16Å; T149-Q321 HydrophobicContact CG2-CG 4.45Å; E317-Q321 WeakPolarHBondContact O-CG 3.22Å; E317-Q321 PolarHBondContact O-N 2.87Å; E317-Q321 PolarHBondContact O-NE2 3.18Å; R318-Q321 VanDerWaalsContact O-CB 3.23Å; R318-Q321 WeakPolarHBondContact O-CB 3.43Å; R318-Q321 WeakPolarHBondContact O-CG 3.33Å; R318-Q321 PolarHBondContact O-N 3.48Å; L319-Q321 PolarHBondContact O-N 3.41Å; L319-Q321 VanDerWaalsContact O-N 3.16Å; Q321-C323 PolarHBondContact O-N 3.34Å; Q321-L324 PolarHBondContact O-N 3.02Å; Q321-K325 PolarHBondContact O-N 2.81Å
322	I	97.6	Very high	94.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-57.3	-43	175.1	-63.8	168.6	0	0	0	109.7	I46 V87 V89 M139 V147 L319 C320 L324 K325 Y326	I46-I322 HydrophobicContact CD1-CB 3.74Å; I46-I322 HydrophobicContact CD1-CD1 4.35Å; I46-I322 HydrophobicContact CD1-CG2 3.87Å; I46-I322 HydrophobicContact CG1-CG2 4.38Å; I46-I322 HydrophobicContact CG2-CD1 4.09Å; V87-I322 HydrophobicContact CG1-CG2 4.22Å; V87-I322 HydrophobicContact CG2-CG2 4.28Å; V89-I322 HydrophobicContact CG2-CD1 3.39Å; M139-I322 HydrophobicContact SD-CD1 3.97Å; M139-I322 HydrophobicContact SD-CG1 3.96Å; V147-I322 HydrophobicContact CG1-CG1 4.01Å; V147-I322 HydrophobicContact CG2-CG1 4.32Å; L319-I322 HydrophobicContact CD2-CD1 4.3Å; L319-I322 VanDerWaalsContact O-CB 3.28Å; L319-I322 WeakPolarHBondContact O-CB 3.46Å; L319-I322 WeakPolarHBondContact O-CG1 3.43Å; L319-I322 PolarHBondContact O-N 3Å; C320-I322 PolarHBondContact O-N 3.28Å; I322-L324 VanDerWaalsContact C-N 3.29Å; I322-L324 PolarHBondContact O-N 2.89Å; I322-K325 CarbonylContact O-C 3.36Å; I322-K325 PolarHBondContact O-N 3.4Å; I322-K325 VanDerWaalsContact O-N 3.09Å; I322-Y326 WeakPolarHBondContact O-CA 3.39Å; I322-Y326 WeakPolarHBondContact O-CB 3.37Å; I322-Y326 PolarHBondContact O-N 3.36Å
323	C	95.8	Very high	94.8	Very high	16 Å²	16	57.9 Å²	57.9	11%	0.108	30%	0.296	C	S	.	.	H	α-helix	trans	-63.4	-34	-179.4	-67.6	0	0	0	0	113.2	L44 I46 I70 C73 C320 Q321 K325	L44-C323 HydrophobicContact CD2-CB 4.39Å; I46-C323 WeakPolarHBondContact CD1-SG 3.21Å; I70-C323 HydrophobicContact CG2-CB 4.06Å; C73-C323 VanDerWaalsContact CA-SG 3.59Å; C73-C323 HydrophobicContact CB-CB 3.6Å; C73-C323 WeakPolarHBondContact CB-SG 3.46Å; C73-C323 WeakPolarHBondContact SG-CB 3.45Å; C73-C323 CovalentContact SG-SG 2Å; C73-C323 PolarHBondContact SG-SG 3.46Å; C320-C323 WeakPolarHBondContact O-CB 3.45Å; C320-C323 PolarHBondContact O-N 2.81Å; C320-C323 VanDerWaalsContact O-N 3.15Å; Q321-C323 PolarHBondContact O-N 3.34Å; C323-K325 VanDerWaalsContact C-N 3.31Å
324	L	94.7	Very high	95	Very high	101 Å²	101	56.2 Å²	56.2	53%	0.529	29%	0.286	S	S	.	.	H	α-helix	trans	-70.7	-29.4	176.5	-60.2	-179.3	0	0	0	112.2	I70 Q321 I322	I70-L324 HydrophobicContact CD1-CD1 3.92Å; I70-L324 HydrophobicContact CD1-CD2 4.43Å; I70-L324 HydrophobicContact CD1-CG 4.13Å; I70-L324 HydrophobicContact CG1-CD1 4.45Å; I70-L324 HydrophobicContact CG1-CD2 4.23Å; I70-L324 HydrophobicContact CG1-CG 4.47Å; I70-L324 HydrophobicContact CG2-CD2 4.07Å; I70-L324 HydrophobicContact CG2-CG 4.45Å; Q321-L324 PolarHBondContact O-N 3.02Å; I322-L324 VanDerWaalsContact C-N 3.29Å; I322-L324 PolarHBondContact O-N 2.89Å
325	K	95.7	Very high	95.1	Very high	91 Å²	91	56.1 Å²	56.1	40%	0.396	28%	0.284	S	S	.	.	H	α-helix	trans	-93.5	-25.2	179.9	-64.6	-62.8	-178	-179.4	0	113.5	V147 Q321 I322 C323 P327 S328 L329	V147-K325 HydrophobicContact CG1-CG 4.34Å; V147-K325 HydrophobicContact CG2-CB 4.13Å; Q321-K325 PolarHBondContact O-N 2.81Å; I322-K325 CarbonylContact O-C 3.36Å; I322-K325 PolarHBondContact O-N 3.4Å; I322-K325 VanDerWaalsContact O-N 3.09Å; C323-K325 VanDerWaalsContact C-N 3.31Å; K325-P327 VanDerWaalsContact C-CD 3.41Å; K325-P327 VanDerWaalsContact C-N 3.34Å; K325-P327 VanDerWaalsContact O-N 3.16Å; K325-S328 PolarHBondContact O-N 2.84Å; K325-S328 PolarHBondContact O-OG 2.86Å; K325-L329 HydrophobicContact CB-CD2 4.48Å; K325-L329 WeakPolarHBondContact O-CG 3.28Å; K325-L329 PolarHBondContact O-N 3.33Å
326	Y	95.2	Very high	95.2	Very high	69 Å²	69	61.2 Å²	61.2	27%	0.271	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-49.2	-44.6	-172	-173.5	-94.3	0	0	0	114.2	L44 V87 W137 I322 S328 L329	L44-Y326 HydrophobicContact CD1-CD1 3.73Å; L44-Y326 HydrophobicContact CD1-CD2 3.86Å; L44-Y326 HydrophobicContact CD1-CE1 3.54Å; L44-Y326 HydrophobicContact CD1-CE2 3.67Å; L44-Y326 HydrophobicContact CD1-CG 3.88Å; L44-Y326 VanDerWaalsContact CD1-CZ 3.5Å; L44-Y326 HydrophobicContact CD2-CD1 4.22Å; L44-Y326 HydrophobicContact CD2-CD2 3.8Å; L44-Y326 HydrophobicContact CD2-CE2 4.41Å; L44-Y326 HydrophobicContact CD2-CG 3.68Å; L44-Y326 HydrophobicContact CG-CG 4.47Å; V87-Y326 HydrophobicContact CG2-CD2 3.7Å; V87-Y326 HydrophobicContact CG2-CE2 3.51Å; W137-Y326 HydrophobicContact CH2-CD2 4.43Å; W137-Y326 AromaticContact CH2-CE2 3.97Å; W137-Y326 HydrophobicContact CH2-CE2 3.97Å; W137-Y326 HydrophobicContact CZ3-CE2 4.27Å; I322-Y326 WeakPolarHBondContact O-CA 3.39Å; I322-Y326 WeakPolarHBondContact O-CB 3.37Å; I322-Y326 PolarHBondContact O-N 3.36Å; Y326-S328 PolarHBondContact O-N 3.37Å; Y326-S328 VanDerWaalsContact O-N 3.14Å; Y326-L329 HydrophobicContact CD2-CD1 4.3Å; Y326-L329 WeakPolarHBondContact O-CB 3.43Å; Y326-L329 PolarHBondContact O-N 2.82Å
327	P	93.2	Very high	95.3	Very high	101 Å²	101	63.7 Å²	63.7	66%	0.656	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-61.3	-24	179.4	-24.1	35.7	0	0	0	114.6	K325	K325-P327 VanDerWaalsContact C-CD 3.41Å; K325-P327 VanDerWaalsContact C-N 3.34Å; K325-P327 VanDerWaalsContact O-N 3.16Å
328	S	93.6	Very high	95.3	Very high	95 Å²	95	62.7 Å²	62.7	66%	0.664	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-101.5	1.3	177.8	67.3	0	0	0	0	113.6	K325 Y326	K325-S328 PolarHBondContact O-N 2.84Å; K325-S328 PolarHBondContact O-OG 2.86Å; Y326-S328 PolarHBondContact O-N 3.37Å; Y326-S328 VanDerWaalsContact O-N 3.14Å
329	L	95.4	Very high	95.3	Very high	15 Å²	15	64.5 Å²	64.5	8%	0.079	33%	0.331	C	S	.	.	S	Bend	trans	-74.1	134.1	179.4	-69	-177.9	0	0	0	111.3	W137 D146 V147 K325 Y326 T331	W137-L329 HydrophobicContact CD2-CB 4.3Å; W137-L329 HydrophobicContact CD2-CD1 3.71Å; W137-L329 HydrophobicContact CD2-CG 4.43Å; W137-L329 HydrophobicContact CE3-CD1 3.73Å; W137-L329 HydrophobicContact CG-CD1 4.18Å; W137-L329 HydrophobicContact CG-CD2 4.35Å; W137-L329 HydrophobicContact CH2-CB 4.46Å; W137-L329 HydrophobicContact CH2-CD1 4.26Å; W137-L329 HydrophobicContact CZ2-CB 3.84Å; W137-L329 HydrophobicContact CZ2-CD1 4.27Å; W137-L329 HydrophobicContact CZ3-CD1 3.99Å; D146-L329 HydrophobicContact CB-CD2 3.74Å; V147-L329 HydrophobicContact CG2-CD1 4.27Å; V147-L329 HydrophobicContact CG2-CD2 4.31Å; K325-L329 HydrophobicContact CB-CD2 4.48Å; K325-L329 WeakPolarHBondContact O-CG 3.28Å; K325-L329 PolarHBondContact O-N 3.33Å; Y326-L329 HydrophobicContact CD2-CD1 4.3Å; Y326-L329 WeakPolarHBondContact O-CB 3.43Å; Y326-L329 PolarHBondContact O-N 2.82Å; L329-T331 PolarHBondContact O-N 2.92Å
330	P	93.9	Very high	95.2	Very high	56 Å²	56	65.5 Å²	65.5	36%	0.364	34%	0.342	S	S	.	.			trans	-70.9	123.5	-179.6	27	-33.3	0	0	0	110.9	W137 R332 K333	W137-P330 PolarHBondContact NE1-O 3.22Å; P330-R332 PolarHBondContact O-N 3Å; P330-K333 HydrophobicContact CB-CB 3.89Å; P330-K333 HydrophobicContact CB-CD 4.48Å; P330-K333 HydrophobicContact CG-CB 3.59Å; P330-K333 HydrophobicContact CG-CD 3.46Å; P330-K333 VanDerWaalsContact CG-CD 3.46Å; P330-K333 HydrophobicContact CG-CG 4.17Å
331	T	87.7	Confident	95.1	Very high	123 Å²	123	67.1 Å²	67.1	76%	0.755	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-24	-171.3	53.1	0	0	0	0	114.9	L329	L329-T331 PolarHBondContact O-N 2.92Å
332	R	88.1	Confident	95.1	Very high	237 Å²	237	65.9 Å²	65.9	89%	0.894	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	6.1	-177.9	-62.1	-175.5	-177.1	176.6	1.3	114	P330	P330-R332 PolarHBondContact O-N 3Å
333	K	95.3	Very high	94.8	Very high	67 Å²	67	70.4 Å²	70.4	29%	0.291	37%	0.367	S	S	.	.			trans	-71.8	140.4	-178.4	-176.6	176.9	175.9	-175.4	0	110.3	N136 D146 P330 Y335	N136-K333 VanDerWaalsContact CA-O 3.27Å; N136-K333 WeakPolarHBondContact CA-O 3.38Å; N136-K333 VanDerWaalsContact CB-O 3.24Å; N136-K333 WeakPolarHBondContact CB-O 3.19Å; N136-K333 PolarHBondContact ND2-O 2.82Å; D146-K333 IonicContact OD1-NZ 2.81Å; D146-K333 PolarHBondContact OD1-NZ 3.34Å; D146-K333 IonicContact OD2-NZ 3.13Å; D146-K333 PolarHBondContact OD2-NZ 3.3Å; P330-K333 HydrophobicContact CB-CB 3.89Å; P330-K333 HydrophobicContact CB-CD 4.48Å; P330-K333 HydrophobicContact CG-CB 3.59Å; P330-K333 HydrophobicContact CG-CD 3.46Å; P330-K333 VanDerWaalsContact CG-CD 3.46Å; P330-K333 HydrophobicContact CG-CG 4.17Å; K333-Y335 HydrophobicContact CD-CE2 4.28Å; K333-Y335 VanDerWaalsContact CE-CZ 3.4Å; K333-Y335 VanDerWaalsContact NZ-CZ 3.25Å; K333-Y335 PolarHBondContact NZ-OH 2.89Å
334	V	96.9	Very high	94.6	Very high	52 Å²	52	74.4 Å²	74.4	32%	0.315	40%	0.395	S	S	.	.			trans	-139.8	132.8	166.6	178.5	0	0	0	0	107.2	G133 F135 Q336	G133-V334 WeakPolarHBondContact O-CG1 3.23Å; F135-V334 WeakPolarHBondContact O-CA 3.22Å; V334-Q336 PolarHBondContact O-N 3.37Å
335	Y	97.6	Very high	94.6	Very high	23 Å²	23	73.1 Å²	73.1	9%	0.09	39%	0.388	C	S	.	.			trans	-75.8	92.5	172.3	-78.7	-95.3	0	0	0	109.7	G133 F135 N136 T138 D146 K333 D337 L338 W341	G133-Y335 PolarHBondContact N-O 3Å; F135-Y335 PolarHBondContact O-N 3.43Å; N136-Y335 WeakPolarHBondContact O-CD2 3.39Å; N136-Y335 WeakPolarHBondContact O-CE2 3.29Å; T138-Y335 HydrophobicContact CG2-CD2 4.12Å; T138-Y335 HydrophobicContact CG2-CE1 4.15Å; T138-Y335 HydrophobicContact CG2-CE2 3.7Å; T138-Y335 HydrophobicContact CG2-CG 4.49Å; T138-Y335 PolarHBondContact OG1-OH 3.29Å; D146-Y335 WeakPolarHBondContact OD2-CE2 3.23Å; D146-Y335 VanDerWaalsContact OD2-CZ 3.28Å; D146-Y335 PolarHBondContact OD2-OH 3.07Å; K333-Y335 HydrophobicContact CD-CE2 4.28Å; K333-Y335 VanDerWaalsContact CE-CZ 3.4Å; K333-Y335 VanDerWaalsContact NZ-CZ 3.25Å; K333-Y335 PolarHBondContact NZ-OH 2.89Å; Y335-D337 PolarHBondContact O-N 3.1Å; Y335-L338 HydrophobicContact CD1-CD1 4.39Å; Y335-L338 HydrophobicContact CG-CD1 4.26Å; Y335-W341 HydrophobicContact CD1-CB 4.07Å; Y335-W341 HydrophobicContact CD1-CG 4.18Å; Y335-W341 HydrophobicContact CE1-CB 4.05Å; Y335-W341 AromaticContact CE1-CD1 3.7Å; Y335-W341 HydrophobicContact CE1-CD2 4.13Å; Y335-W341 AromaticContact CE1-CG 3.67Å; Y335-W341 HydrophobicContact CE1-CG 3.67Å
336	Q	97.9	Very high	94.6	Very high	135 Å²	135	72.1 Å²	72.1	63%	0.631	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-30.8	173.2	-62.2	-57.8	-28.9	0	0	111.7	N132 V334	N132-Q336 VanDerWaalsContact CB-O 3.23Å; N132-Q336 WeakPolarHBondContact CB-O 3.17Å; N132-Q336 PolarHBondContact ND2-O 3.28Å; V334-Q336 PolarHBondContact O-N 3.37Å
337	D	97.1	Very high	94.5	Very high	92 Å²	92	72.3 Å²	72.3	49%	0.492	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.9	74.1	173.6	-169.2	18.3	0	0	0	110.8	N132 Y335 D339 G340 W341	N132-D337 PolarHBondContact ND2-OD1 3.24Å; Y335-D337 PolarHBondContact O-N 3.1Å; D337-D339 VanDerWaalsContact C-N 3.33Å; D337-G340 PolarHBondContact OD1-N 2.95Å; D337-G340 WeakPolarHBondContact OD2-CA 3.33Å; D337-W341 PolarHBondContact O-N 3.19Å; D337-W341 VanDerWaalsContact O-N 3.13Å
338	L	97.3	Very high	94.6	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-67.4	-37.7	175.3	-178.9	61.5	0	0	0	110.8	W116 V128 L131 N132 F135 T138 Y335 W341 V342	W116-L338 HydrophobicContact CB-CD2 4.25Å; W116-L338 HydrophobicContact CD2-CD1 4.43Å; W116-L338 HydrophobicContact CD2-CD2 4.14Å; W116-L338 HydrophobicContact CE3-CD1 4.36Å; W116-L338 HydrophobicContact CG-CD2 3.86Å; V128-L338 HydrophobicContact CG1-CB 4.3Å; V128-L338 HydrophobicContact CG1-CD2 3.99Å; V128-L338 HydrophobicContact CG1-CG 3.72Å; L131-L338 HydrophobicContact CB-CD2 4.04Å; N132-L338 PolarHBondContact OD1-N 3.06Å; F135-L338 HydrophobicContact CD2-CD2 3.88Å; T138-L338 HydrophobicContact CG2-CD1 3.62Å; Y335-L338 HydrophobicContact CD1-CD1 4.39Å; Y335-L338 HydrophobicContact CG-CD1 4.26Å; L338-W341 HydrophobicContact CD1-CE3 4.18Å; L338-W341 PolarHBondContact O-N 2.86Å; L338-V342 HydrophobicContact CD1-CG2 4.42Å; L338-V342 HydrophobicContact CG-CG2 4.49Å; L338-V342 WeakPolarHBondContact O-CG2 3.32Å; L338-V342 PolarHBondContact O-N 2.98Å
339	D	96.1	Very high	94.7	Very high	47 Å²	47	69.1 Å²	69.1	25%	0.251	36%	0.361	S	S	.	.	H	α-helix	trans	-61.4	-47.6	176.6	-171.6	68.2	0	0	0	112	V128 K129 N132 D337 W341 V342 N343	V128-D339 HydrophobicContact CB-CB 4.48Å; V128-D339 HydrophobicContact CG1-CB 4.33Å; K129-D339 HydrophobicContact CB-CB 4.04Å; K129-D339 PolarHBondContact N-OD1 3.05Å; N132-D339 PolarHBondContact OD1-N 3.21Å; D337-D339 VanDerWaalsContact C-N 3.33Å; D339-W341 VanDerWaalsContact C-N 3.34Å; D339-W341 PolarHBondContact O-N 2.82Å; D339-V342 PolarHBondContact O-N 3.48Å; D339-N343 PolarHBondContact O-N 3.48Å; D339-N343 PolarHBondContact O-ND2 3.19Å; D339-N343 PolarHBondContact OD1-ND2 3.48Å
340	G	96.1	Very high	94.6	Very high	25 Å²	25	72.7 Å²	72.7	26%	0.258	38%	0.38	S	S	.	.	H	α-helix	trans	-60.3	-42.4	173.5	0	0	0	0	0	112.3	D337 N343 S344	D337-G340 PolarHBondContact OD1-N 2.95Å; D337-G340 WeakPolarHBondContact OD2-CA 3.33Å; G340-N343 PolarHBondContact O-N 2.88Å; G340-S344 WeakPolarHBondContact O-CB 3.43Å; G340-S344 PolarHBondContact O-N 2.87Å
341	W	96.3	Very high	94.7	Very high	34 Å²	34	73.9 Å²	73.9	13%	0.129	38%	0.381	C	S	.	.	H	α-helix	trans	-61.3	-45.9	173.9	-179.6	85.5	0	0	0	111.8	W116 T138 R142 A145 Y335 D337 L338 D339 N343 S344	W116-W341 HydrophobicContact CE3-CZ3 4.41Å; W116-W341 AromaticContact CZ3-CZ3 3.87Å; W116-W341 HydrophobicContact CZ3-CZ3 3.87Å; T138-W341 HydrophobicContact CG2-CD2 4.19Å; T138-W341 HydrophobicContact CG2-CE3 3.79Å; T138-W341 HydrophobicContact CG2-CH2 4Å; T138-W341 HydrophobicContact CG2-CZ2 4.36Å; T138-W341 HydrophobicContact CG2-CZ3 3.69Å; T138-W341 WeakPolarHBondContact OG1-CZ2 3.37Å; R142-W341 HydrophobicContact CB-CH2 4.4Å; R142-W341 HydrophobicContact CB-CZ2 4.41Å; R142-W341 PolarHBondContact NH1-O 3.32Å; A145-W341 HydrophobicContact CB-CH2 4.1Å; A145-W341 HydrophobicContact CB-CZ2 4.02Å; Y335-W341 HydrophobicContact CD1-CB 4.07Å; Y335-W341 HydrophobicContact CD1-CG 4.18Å; Y335-W341 HydrophobicContact CE1-CB 4.05Å; Y335-W341 AromaticContact CE1-CD1 3.7Å; Y335-W341 HydrophobicContact CE1-CD2 4.13Å; Y335-W341 AromaticContact CE1-CG 3.67Å; Y335-W341 HydrophobicContact CE1-CG 3.67Å; D337-W341 PolarHBondContact O-N 3.19Å; D337-W341 VanDerWaalsContact O-N 3.13Å; L338-W341 HydrophobicContact CD1-CE3 4.18Å; L338-W341 PolarHBondContact O-N 2.86Å; D339-W341 VanDerWaalsContact C-N 3.34Å; D339-W341 PolarHBondContact O-N 2.82Å; W341-N343 VanDerWaalsContact C-N 3.32Å; W341-N343 PolarHBondContact O-N 3.39Å; W341-S344 PolarHBondContact O-N 3.22Å; W341-S344 PolarHBondContact O-OG 3.16Å
342	V	95.1	Very high	95.2	Very high	5 Å²	5	70.1 Å²	70.1	3%	0.03	35%	0.352	C	S	.	.	H	α-helix	trans	-61.2	-41.9	179.8	168.2	0	0	0	0	111.2	W116 P122 N125 V128 R142 L338 D339	W116-V342 HydrophobicContact CH2-CG2 3.48Å; W116-V342 VanDerWaalsContact CH2-CG2 3.48Å; W116-V342 HydrophobicContact CZ2-CG2 4.07Å; W116-V342 HydrophobicContact CZ3-CG2 3.89Å; P122-V342 HydrophobicContact CB-CG1 3.91Å; P122-V342 HydrophobicContact CG-CG1 4.06Å; P122-V342 WeakPolarHBondContact CG-O 3.32Å; N125-V342 HydrophobicContact CB-CG1 4.43Å; V128-V342 HydrophobicContact CG1-CB 4.42Å; V128-V342 HydrophobicContact CG1-CG2 3.93Å; V128-V342 HydrophobicContact CG2-CG1 4.47Å; R142-V342 PolarHBondContact NH1-O 3.47Å; L338-V342 HydrophobicContact CD1-CG2 4.42Å; L338-V342 HydrophobicContact CG-CG2 4.49Å; L338-V342 WeakPolarHBondContact O-CG2 3.32Å; L338-V342 PolarHBondContact O-N 2.98Å; D339-V342 PolarHBondContact O-N 3.48Å
343	N	92.9	Very high	95.8	Very high	95 Å²	95	56.2 Å²	56.2	51%	0.508	31%	0.307	S	S	.	.	H	α-helix	trans	-88.9	1.4	-174.9	-65.6	-69.9	0	0	0	114.9	P122 D339 G340 W341	P122-N343 WeakPolarHBondContact CB-OD1 3.39Å; D339-N343 PolarHBondContact O-N 3.48Å; D339-N343 PolarHBondContact O-ND2 3.19Å; D339-N343 PolarHBondContact OD1-ND2 3.48Å; G340-N343 PolarHBondContact O-N 2.88Å; W341-N343 VanDerWaalsContact C-N 3.32Å; W341-N343 PolarHBondContact O-N 3.39Å
344	S	91.3	Very high	95.9	Very high	99 Å²	99	55.2 Å²	55.2	69%	0.692	31%	0.309	S	S	*	.			trans	-72.7	0	-177.6	74.7	0	0	0	0	115	R142 G340 W341	R142-S344 PolarHBondContact NH1-O 3.36Å; R142-S344 PolarHBondContact NH1-OG 3.29Å; R142-S344 PolarHBondContact NH2-OG 2.81Å; G340-S344 WeakPolarHBondContact O-CB 3.43Å; G340-S344 PolarHBondContact O-N 2.87Å; W341-S344 PolarHBondContact O-N 3.22Å; W341-S344 PolarHBondContact O-OG 3.16Å

Retrieved 344 of 344 residues in 71.7 ms (Link to these results)

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