A0A060XGQ4_ONCMY Loading...

GOLD domain-containing protein

AlphaFold DB , UniProt , Accession A0A060XGQ4, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 225 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	58.4	Low	70.3	Confident	194 Å²	194	121.1 Å²	121.1	96%	0.956	64%	0.637	S	S	*	*				0	-29.3	0	-73.1	165.1	66.9	0	0	111.4	V4 R5	M1-V4 PolarHBondContact O-N 2.86Å; M1-R5 PolarHBondContact O-N 3.12Å
2	D	67.7	Low	70.3	Confident	129 Å²	129	116.8 Å²	116.8	69%	0.69	62%	0.624	S	S	*	*	H	α-helix	trans	-70.9	-34.4	-178.4	-49.2	-65.7	0	0	0	114.1	V4 R5 G6	D2-V4 VanDerWaalsContact C-N 3.31Å; D2-V4 PolarHBondContact O-N 3.12Å; D2-R5 PolarHBondContact O-N 3.45Å; D2-G6 PolarHBondContact O-N 2.72Å
3	V	68.2	Low	70.6	Confident	114 Å²	114	113.5 Å²	113.5	69%	0.691	61%	0.61	S	S	*	*	H	α-helix	trans	-64.2	-36.4	176.6	-177.4	0	0	0	0	111.9	G6 L7	V3-G6 PolarHBondContact O-N 3.44Å; V3-L7 HydrophobicContact CG1-CD1 4.38Å; V3-L7 PolarHBondContact O-N 3.26Å
4	V	71.2	Confident	70.3	Confident	96 Å²	96	112.9 Å²	112.9	58%	0.582	61%	0.606	S	S	*	*	H	α-helix	trans	-72.7	-39.1	179.6	179.9	0	0	0	0	111	M1 D2 L7 L8	M1-V4 PolarHBondContact O-N 2.86Å; D2-V4 VanDerWaalsContact C-N 3.31Å; D2-V4 PolarHBondContact O-N 3.12Å; V4-L7 PolarHBondContact O-N 2.61Å; V4-L8 HydrophobicContact CG1-CD1 4.07Å; V4-L8 WeakPolarHBondContact O-CB 3.48Å; V4-L8 WeakPolarHBondContact O-CG 3.43Å; V4-L8 PolarHBondContact O-N 2.91Å
5	R	72.9	Confident	70.3	Confident	186 Å²	186	109.9 Å²	109.9	70%	0.702	59%	0.593	S	S	*	*	H	α-helix	trans	-64.2	-39.5	171.7	-84.6	173.4	82.2	170.2	4.9	112	M1 D2 L8 C9	M1-R5 PolarHBondContact O-N 3.12Å; D2-R5 PolarHBondContact O-N 3.45Å; R5-L8 PolarHBondContact O-N 2.92Å; R5-C9 PolarHBondContact O-N 3.06Å; R5-C9 PolarHBondContact O-SG 3.21Å; R5-C9 VanDerWaalsContact O-SG 3.41Å
6	G	73.2	Confident	69.8	Low	35 Å²	35	107.1 Å²	107.1	36%	0.361	58%	0.584	S	S	.	*	H	α-helix	trans	-62.4	-45.2	175.8	0	0	0	0	0	112.8	D2 V3 C9 L10	D2-G6 PolarHBondContact O-N 2.72Å; V3-G6 PolarHBondContact O-N 3.44Å; G6-C9 PolarHBondContact O-N 2.88Å; G6-L10 WeakPolarHBondContact O-CG 3.27Å; G6-L10 PolarHBondContact O-N 3.02Å
7	L	73.6	Confident	69.1	Low	120 Å²	120	107.5 Å²	107.5	63%	0.628	58%	0.581	S	S	*	*	H	α-helix	trans	-64.5	-41.3	176.2	-113.1	99	0	0	0	112.4	V3 V4 L10 F11	V3-L7 HydrophobicContact CG1-CD1 4.38Å; V3-L7 PolarHBondContact O-N 3.26Å; V4-L7 PolarHBondContact O-N 2.61Å; L7-L10 PolarHBondContact O-N 2.94Å; L7-F11 WeakPolarHBondContact O-CB 3.4Å; L7-F11 PolarHBondContact O-N 3.32Å
8	L	71.6	Confident	68.4	Low	118 Å²	118	109.9 Å²	109.9	62%	0.618	59%	0.591	S	S	*	*	H	α-helix	trans	-63.7	-40.4	177.2	-76.8	164.6	0	0	0	112	V4 R5 F11 S12	V4-L8 HydrophobicContact CG1-CD1 4.07Å; V4-L8 WeakPolarHBondContact O-CB 3.48Å; V4-L8 WeakPolarHBondContact O-CG 3.43Å; V4-L8 PolarHBondContact O-N 2.91Å; R5-L8 PolarHBondContact O-N 2.92Å; L8-F11 PolarHBondContact O-N 2.79Å; L8-S12 PolarHBondContact O-N 2.81Å; L8-S12 PolarHBondContact O-OG 3.39Å
9	C	73.3	Confident	67.7	Low	79 Å²	79	112.7 Å²	112.7	53%	0.534	60%	0.597	S	S	.	*	H	α-helix	trans	-65.2	-43.5	174.9	-74.5	0	0	0	0	112	R5 G6 F11 S12 V13	R5-C9 PolarHBondContact O-N 3.06Å; R5-C9 PolarHBondContact O-SG 3.21Å; R5-C9 VanDerWaalsContact O-SG 3.41Å; G6-C9 PolarHBondContact O-N 2.88Å; C9-F11 VanDerWaalsContact C-N 3.33Å; C9-F11 PolarHBondContact O-N 2.84Å; C9-S12 WeakPolarHBondContact CA-OG 3.48Å; C9-S12 PolarHBondContact O-N 3.28Å; C9-S12 PolarHBondContact O-OG 2.04Å; C9-V13 VanDerWaalsContact O-CG2 3.3Å; C9-V13 WeakPolarHBondContact O-CG2 3.49Å; C9-V13 PolarHBondContact O-N 3.04Å
10	L	69.6	Low	66.8	Low	114 Å²	114	114.8 Å²	114.8	60%	0.597	61%	0.605	S	S	*	*	H	α-helix	trans	-62.4	-42.2	176.6	-77.6	165.2	0	0	0	111.5	G6 L7 V13 L14	G6-L10 WeakPolarHBondContact O-CG 3.27Å; G6-L10 PolarHBondContact O-N 3.02Å; L7-L10 PolarHBondContact O-N 2.94Å; L10-V13 PolarHBondContact O-N 2.91Å; L10-L14 WeakPolarHBondContact O-CB 3.28Å; L10-L14 VanDerWaalsContact O-CG 3.25Å; L10-L14 WeakPolarHBondContact O-CG 3.47Å; L10-L14 PolarHBondContact O-N 3.44Å
11	F	73.2	Confident	65.9	Low	147 Å²	147	115.1 Å²	115.1	65%	0.645	61%	0.611	S	S	*	*	H	α-helix	trans	-64.5	-41.1	176.3	-152	-92.5	0	0	0	111.5	L7 L8 C9 V13 L14 V15	L7-F11 WeakPolarHBondContact O-CB 3.4Å; L7-F11 PolarHBondContact O-N 3.32Å; L8-F11 PolarHBondContact O-N 2.79Å; C9-F11 VanDerWaalsContact C-N 3.33Å; C9-F11 PolarHBondContact O-N 2.84Å; F11-V13 VanDerWaalsContact C-N 3.35Å; F11-V13 PolarHBondContact O-N 2.84Å; F11-L14 PolarHBondContact O-N 2.89Å; F11-V15 HydrophobicContact CD1-CG2 3.84Å; F11-V15 HydrophobicContact CE1-CG2 3.82Å; F11-V15 WeakPolarHBondContact O-CB 3.19Å; F11-V15 WeakPolarHBondContact O-CG2 3.32Å; F11-V15 PolarHBondContact O-N 2.87Å
12	S	70.3	Confident	65.5	Low	69 Å²	69	109.8 Å²	109.8	48%	0.483	60%	0.598	S	S	.	*	H	α-helix	trans	-65	-36.3	175.8	62.8	0	0	0	0	113.3	L8 C9 S16	L8-S12 PolarHBondContact O-N 2.81Å; L8-S12 PolarHBondContact O-OG 3.39Å; C9-S12 WeakPolarHBondContact CA-OG 3.48Å; C9-S12 PolarHBondContact O-N 3.28Å; C9-S12 PolarHBondContact O-OG 2.04Å; S12-S16 WeakPolarHBondContact O-CB 3.19Å; S12-S16 PolarHBondContact O-N 2.79Å; S12-S16 PolarHBondContact O-OG 3.37Å
13	V	74.1	Confident	64.6	Low	74 Å²	74	107.3 Å²	107.3	45%	0.448	60%	0.596	S	S	.	*	H	α-helix	trans	-69	-46.5	177.3	170.4	0	0	0	0	110	C9 L10 F11 V15 S16 E17	C9-V13 VanDerWaalsContact O-CG2 3.3Å; C9-V13 WeakPolarHBondContact O-CG2 3.49Å; C9-V13 PolarHBondContact O-N 3.04Å; L10-V13 PolarHBondContact O-N 2.91Å; F11-V13 VanDerWaalsContact C-N 3.35Å; F11-V13 PolarHBondContact O-N 2.84Å; V13-V15 VanDerWaalsContact C-N 3.35Å; V13-V15 PolarHBondContact O-N 3.22Å; V13-S16 PolarHBondContact O-N 2.88Å; V13-S16 PolarHBondContact O-OG 3.01Å; V13-E17 PolarHBondContact O-N 2.99Å
14	L	67.3	Low	63.2	Low	105 Å²	105	110 Å²	110	55%	0.55	60%	0.598	S	S	.	*	H	α-helix	trans	-63	-39.6	178.3	-70	170.3	0	0	0	112.4	L10 F11 E17 M18	L10-L14 WeakPolarHBondContact O-CB 3.28Å; L10-L14 VanDerWaalsContact O-CG 3.25Å; L10-L14 WeakPolarHBondContact O-CG 3.47Å; L10-L14 PolarHBondContact O-N 3.44Å; F11-L14 PolarHBondContact O-N 2.89Å; L14-E17 PolarHBondContact O-N 2.87Å; L14-M18 WeakPolarHBondContact O-CB 3.32Å; L14-M18 PolarHBondContact O-N 2.91Å
15	V	69.9	Low	62.1	Low	68 Å²	68	108.8 Å²	108.8	41%	0.412	59%	0.594	S	S	.	*	H	α-helix	trans	-66.7	-38.9	175.1	172.2	0	0	0	0	111.1	F11 V13 M18 F19	F11-V15 HydrophobicContact CD1-CG2 3.84Å; F11-V15 HydrophobicContact CE1-CG2 3.82Å; F11-V15 WeakPolarHBondContact O-CB 3.19Å; F11-V15 WeakPolarHBondContact O-CG2 3.32Å; F11-V15 PolarHBondContact O-N 2.87Å; V13-V15 VanDerWaalsContact C-N 3.35Å; V13-V15 PolarHBondContact O-N 3.22Å; V15-M18 PolarHBondContact O-N 2.74Å; V15-F19 PolarHBondContact O-N 3.47Å
16	S	63.1	Low	60.7	Low	65 Å²	65	108.1 Å²	108.1	46%	0.455	60%	0.599	S	S	.	*	H	α-helix	trans	-67.1	-36.2	177.3	73.2	0	0	0	0	113.3	S12 V13 F19 M20	S12-S16 WeakPolarHBondContact O-CB 3.19Å; S12-S16 PolarHBondContact O-N 2.79Å; S12-S16 PolarHBondContact O-OG 3.37Å; V13-S16 PolarHBondContact O-N 2.88Å; V13-S16 PolarHBondContact O-OG 3.01Å; S16-F19 PolarHBondContact O-N 3.4Å; S16-M20 PolarHBondContact O-N 3.37Å
17	E	57.7	Low	59.6	Low	114 Å²	114	109.4 Å²	109.4	53%	0.533	60%	0.602	S	S	.	*	H	α-helix	trans	-69.9	-39.1	174.9	-73.7	-170.7	160.3	0	0	111.4	V13 L14 F19 M20 V21	V13-E17 PolarHBondContact O-N 2.99Å; L14-E17 PolarHBondContact O-N 2.87Å; E17-F19 VanDerWaalsContact C-N 3.31Å; E17-F19 PolarHBondContact O-N 3.08Å; E17-M20 PolarHBondContact O-N 3.44Å; E17-V21 PolarHBondContact O-N 2.91Å
18	M	55.6	Low	59	Low	152 Å²	152	108 Å²	108	75%	0.749	59%	0.594	S	S	*	*	H	α-helix	trans	-64.9	-34.7	176.4	-169.5	168.8	139.1	0	0	112.3	L14 V15 V21	L14-M18 WeakPolarHBondContact O-CB 3.32Å; L14-M18 PolarHBondContact O-N 2.91Å; V15-M18 PolarHBondContact O-N 2.74Å; M18-V21 PolarHBondContact O-N 3.12Å
19	F	54.5	Low	58.9	Low	163 Å²	163	105 Å²	105	72%	0.715	58%	0.578	S	S	*	*	H	α-helix	trans	-68.8	-34.2	175	-123.3	-93.6	0	0	0	113.1	V15 S16 E17 V21 A22	V15-F19 PolarHBondContact O-N 3.47Å; S16-F19 PolarHBondContact O-N 3.4Å; E17-F19 VanDerWaalsContact C-N 3.31Å; E17-F19 PolarHBondContact O-N 3.08Å; F19-V21 VanDerWaalsContact C-N 3.34Å; F19-A22 PolarHBondContact O-N 3.27Å
20	M	49.7	Very low	59.2	Low	154 Å²	154	103 Å²	103	76%	0.759	57%	0.565	S	S	*	*	H	α-helix	trans	-69.8	-29.7	176.7	-84.1	-142.3	-80.7	0	0	113.1	S16 E17 A22	S16-M20 PolarHBondContact O-N 3.37Å; E17-M20 PolarHBondContact O-N 3.44Å; M20-A22 VanDerWaalsContact C-N 3.35Å
21	V	49.1	Very low	60	Low	121 Å²	121	101.8 Å²	101.8	73%	0.733	56%	0.559	S	S	*	*	H	α-helix	trans	-73.1	-29.7	177.6	179.1	0	0	0	0	111.7	E17 M18 F19	E17-V21 PolarHBondContact O-N 2.91Å; M18-V21 PolarHBondContact O-N 3.12Å; F19-V21 VanDerWaalsContact C-N 3.34Å
22	A	50.3	Low	60.7	Low	83 Å²	83	100.1 Å²	100.1	69%	0.686	55%	0.552	S	S	*	*	H	α-helix	trans	-78.8	-16.5	-179.7	0	0	0	0	0	114.2	F19 M20 F24	F19-A22 PolarHBondContact O-N 3.27Å; M20-A22 VanDerWaalsContact C-N 3.35Å; A22-F24 VanDerWaalsContact C-N 3.28Å; A22-F24 PolarHBondContact O-N 2.71Å
23	A	48.4	Very low	61.7	Low	76 Å²	76	100.8 Å²	100.8	63%	0.628	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	2.9	-173.2	0	0	0	0	0	115	S25	A23-S25 VanDerWaalsContact C-N 3.32Å; A23-S25 PolarHBondContact O-N 2.93Å; A23-S25 VanDerWaalsContact O-N 3.14Å
24	F	38.8	Very low	62.6	Low	171 Å²	171	99 Å²	99	75%	0.75	54%	0.54	S	S	*	.			trans	-85.3	76.3	172.2	-125.8	-94.2	0	0	0	109	A22 Q26	A22-F24 VanDerWaalsContact C-N 3.28Å; A22-F24 PolarHBondContact O-N 2.71Å; F24-Q26 PolarHBondContact O-N 2.85Å; F24-Q26 VanDerWaalsContact O-N 3.12Å
25	S	48.5	Very low	63.9	Low	70 Å²	70	97.5 Å²	97.5	49%	0.49	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-60.1	120.6	160.7	-58.6	0	0	0	0	106.9	A23 S27 K160	A23-S25 VanDerWaalsContact C-N 3.32Å; A23-S25 PolarHBondContact O-N 2.93Å; A23-S25 VanDerWaalsContact O-N 3.14Å; S25-S27 PolarHBondContact O-N 3.48Å; S25-K160 PolarHBondContact OG-NZ 3.05Å
26	Q	43.5	Very low	65.1	Low	173 Å²	173	94.2 Å²	94.2	81%	0.808	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-69.1	117.4	171.7	-60.2	-179.6	-51.8	0	0	106.7	F24 M28	F24-Q26 PolarHBondContact O-N 2.85Å; F24-Q26 VanDerWaalsContact O-N 3.12Å; Q26-M28 PolarHBondContact O-N 3.5Å
27	S	50	Low	66.6	Low	61 Å²	61	93 Å²	93	43%	0.427	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-57	136.6	153.3	43.5	0	0	0	0	106.2	S25 D29	S25-S27 PolarHBondContact O-N 3.48Å; S27-D29 WeakPolarHBondContact CB-OD2 3.44Å; S27-D29 PolarHBondContact O-N 2.91Å; S27-D29 PolarHBondContact OG-OD2 2.87Å
28	M	59.4	Low	68.4	Low	91 Å²	91	89.7 Å²	89.7	45%	0.448	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	67.2	173.8	-64.9	-163	75	0	0	108.3	Q26 M122	Q26-M28 PolarHBondContact O-N 3.5Å; M28-M122 HydrophobicContact CB-CE 4.04Å; M28-M122 WeakPolarHBondContact O-CE 3.18Å
29	D	69.9	Low	70.2	Confident	55 Å²	55	84.6 Å²	84.6	29%	0.294	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	129.5	169.6	-66.9	-34	0	0	0	108	S27 I121	S27-D29 WeakPolarHBondContact CB-OD2 3.44Å; S27-D29 PolarHBondContact O-N 2.91Å; S27-D29 PolarHBondContact OG-OD2 2.87Å; D29-I121 WeakPolarHBondContact OD1-CG1 3.49Å; D29-I121 WeakPolarHBondContact OD1-CG2 3.5Å
30	S	79.7	Confident	72.1	Confident	37 Å²	37	84.2 Å²	84.2	26%	0.259	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	108.9	177.8	-65.5	0	0	0	0	109.5	L120	S30-L120 PolarHBondContact N-O 3.46Å; S30-L120 PolarHBondContact O-N 2.71Å
31	D	87	Confident	74.3	Confident	89 Å²	89	81.7 Å²	81.7	48%	0.476	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	140.9	176.1	73.4	-82.3	0	0	0	111.8	F117 F118 E119	D31-F117 HydrophobicContact CB-CE2 3.85Å; D31-F117 HydrophobicContact CB-CZ 3.98Å; D31-F118 WeakPolarHBondContact CA-O 3.23Å; D31-E119 HydrophobicContact CB-CB 4.39Å; D31-E119 HydrophobicContact CB-CG 4.28Å
32	F	88.5	Confident	76.6	Confident	111 Å²	111	80 Å²	80	49%	0.487	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	140.9	179.3	-63.9	-79.3	0	0	0	111.3	F117 F118	F32-F117 WeakPolarHBondContact O-CA 3.46Å; F32-F118 HydrophobicContact CB-CD1 4.42Å; F32-F118 HydrophobicContact CB-CE1 3.84Å; F32-F118 HydrophobicContact CB-CE2 4.21Å; F32-F118 HydrophobicContact CB-CZ 3.73Å; F32-F118 AromaticContact CD2-CE2 3.85Å; F32-F118 HydrophobicContact CD2-CE2 3.85Å; F32-F118 AromaticContact CD2-CZ 3.9Å; F32-F118 HydrophobicContact CD2-CZ 3.9Å; F32-F118 HydrophobicContact CG-CE2 4.48Å; F32-F118 HydrophobicContact CG-CZ 4.15Å; F32-F118 PolarHBondContact N-O 2.8Å; F32-F118 PolarHBondContact O-N 3.44Å
33	T	90.5	Very high	78.8	Confident	84 Å²	84	78 Å²	78	52%	0.515	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.7	166.6	-52.7	0	0	0	0	108.9	L61 I115 I116 F117	T33-L61 HydrophobicContact CG2-CD1 4.05Å; T33-I115 HydrophobicContact CG2-CG2 3.73Å; T33-I116 WeakPolarHBondContact CA-O 3.04Å; T33-F117 WeakPolarHBondContact OG1-CD2 3.41Å
34	F	92.8	Very high	81	Confident	36 Å²	36	77.4 Å²	77.4	16%	0.158	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	158.9	176.8	81.5	-75.4	0	0	0	112.3	L36 E42 F44 F104 I116 F118	F34-L36 HydrophobicContact CE2-CB 3.82Å; F34-L36 HydrophobicContact CE2-CD1 4.16Å; F34-L36 HydrophobicContact CE2-CG 4.47Å; F34-L36 HydrophobicContact CZ-CB 4.32Å; F34-E42 HydrophobicContact CE2-CB 3.88Å; F34-E42 HydrophobicContact CE2-CG 4.11Å; F34-E42 HydrophobicContact CZ-CB 4.36Å; F34-F44 HydrophobicContact CD1-CE2 4.4Å; F34-F44 HydrophobicContact CD1-CZ 4.22Å; F34-F44 HydrophobicContact CD2-CZ 4.29Å; F34-F44 AromaticContact CE1-CE2 3.91Å; F34-F44 HydrophobicContact CE1-CE2 3.91Å; F34-F44 HydrophobicContact CE1-CZ 4.18Å; F34-F44 HydrophobicContact CE2-CE2 4.24Å; F34-F44 HydrophobicContact CE2-CZ 4.25Å; F34-F44 HydrophobicContact CG-CZ 4.27Å; F34-F44 AromaticContact CZ-CE2 3.83Å; F34-F44 HydrophobicContact CZ-CE2 3.83Å; F34-F44 HydrophobicContact CZ-CZ 4.2Å; F34-F104 AromaticContact CE1-CD2 3.85Å; F34-F104 HydrophobicContact CE1-CD2 3.85Å; F34-F104 HydrophobicContact CE1-CE2 4.16Å; F34-F104 HydrophobicContact CE1-CG 4.39Å; F34-F104 HydrophobicContact CZ-CB 4.08Å; F34-F104 AromaticContact CZ-CD2 3.74Å; F34-F104 HydrophobicContact CZ-CD2 3.74Å; F34-F104 HydrophobicContact CZ-CE2 4.5Å; F34-F104 HydrophobicContact CZ-CG 4.09Å; F34-I116 HydrophobicContact CD1-CB 4.28Å; F34-I116 HydrophobicContact CE1-CB 3.8Å; F34-I116 HydrophobicContact CE1-CD1 4.42Å; F34-I116 HydrophobicContact CE1-CG2 4.06Å; F34-I116 HydrophobicContact CZ-CB 4.31Å; F34-I116 HydrophobicContact CZ-CD1 4.11Å; F34-I116 PolarHBondContact N-O 2.85Å; F34-I116 PolarHBondContact O-N 2.76Å; F34-F118 AromaticContact CD1-CD1 3.97Å; F34-F118 HydrophobicContact CD1-CD1 3.97Å; F34-F118 AromaticContact CD1-CE1 3.72Å; F34-F118 HydrophobicContact CD1-CE1 3.72Å; F34-F118 AromaticContact CE1-CD1 3.87Å; F34-F118 HydrophobicContact CE1-CD1 3.87Å; F34-F118 AromaticContact CE1-CE1 3.82Å; F34-F118 HydrophobicContact CE1-CE1 3.82Å
35	T	93.8	Very high	83.7	Confident	73 Å²	73	75.6 Å²	75.6	45%	0.448	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	120.9	175.9	-50.8	0	0	0	0	109.4	P37 E113 K114	T35-P37 WeakPolarHBondContact O-CD 3.04Å; T35-E113 HydrophobicContact CG2-CB 4.16Å; T35-E113 HydrophobicContact CG2-CG 4.11Å; T35-K114 CarbonylContact C-O 3.54Å; T35-K114 WeakPolarHBondContact CA-O 3.46Å
36	L	95.9	Very high	85.8	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	111.1	176.5	-178.3	60.5	0	0	0	109.9	F34 R40 E42 V68 F104 N106 E113 K114 I116	F34-L36 HydrophobicContact CE2-CB 3.82Å; F34-L36 HydrophobicContact CE2-CD1 4.16Å; F34-L36 HydrophobicContact CE2-CG 4.47Å; F34-L36 HydrophobicContact CZ-CB 4.32Å; L36-R40 HydrophobicContact CD1-CB 4.49Å; L36-E42 HydrophobicContact CD1-CB 3.73Å; L36-V68 HydrophobicContact CD2-CG2 4.27Å; L36-F104 HydrophobicContact CD2-CB 3.85Å; L36-N106 HydrophobicContact CD2-CB 3.5Å; L36-N106 HydrophobicContact CG-CB 3.73Å; L36-E113 WeakPolarHBondContact O-CA 3.38Å; L36-K114 HydrophobicContact CB-CB 4.42Å; L36-K114 PolarHBondContact N-O 3.32Å; L36-K114 PolarHBondContact O-N 2.65Å; L36-I116 HydrophobicContact CB-CD1 4.04Å; L36-I116 HydrophobicContact CD2-CD1 3.67Å
37	P	95.5	Very high	88.1	Confident	38 Å²	38	70.2 Å²	70.2	25%	0.247	37%	0.373	C	S	.	.			trans	-63.4	163.7	-178	-23	34.8	0	0	0	113.3	T35 R40 N106	T35-P37 WeakPolarHBondContact O-CD 3.04Å; P37-R40 HydrophobicContact CB-CB 4.48Å; P37-R40 HydrophobicContact CB-CG 4.22Å; P37-N106 PolarHBondContact O-ND2 2.78Å
38	S	94.4	Very high	90	Very high	45 Å²	45	67.4 Å²	67.4	32%	0.315	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	141.4	172.3	57.3	0	0	0	0	111.6	R40 S109	S38-R40 PolarHBondContact O-N 3.02Å; S38-S109 CarbonylContact C-O 3.58Å; S38-S109 WeakPolarHBondContact CA-O 3.44Å; S38-S109 WeakPolarHBondContact CB-O 3.39Å
39	G	93.7	Very high	91.4	Very high	46 Å²	46	66.3 Å²	66.3	47%	0.474	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	10.7	175.4	0	0	0	0	0	114.7	N106 S109	G39-N106 PolarHBondContact N-O 2.81Å; G39-S109 PolarHBondContact N-O 3.12Å
40	R	94.7	Very high	92.3	Very high	155 Å²	155	70.3 Å²	70.3	59%	0.585	36%	0.361	S	S	*	.			trans	-119.9	156.7	-174.9	-65.5	-164.7	-172.3	174.7	0.4	112.9	L36 P37 S38 N106	L36-R40 HydrophobicContact CD1-CB 4.49Å; P37-R40 HydrophobicContact CB-CB 4.48Å; P37-R40 HydrophobicContact CB-CG 4.22Å; S38-R40 PolarHBondContact O-N 3.02Å; R40-N106 CarbonylContact O-C 3.55Å; R40-N106 WeakPolarHBondContact O-CA 3.29Å; R40-N106 PolarHBondContact O-N 2.77Å
41	K	95.9	Very high	92.6	Very high	101 Å²	101	74.4 Å²	74.4	44%	0.439	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	129	171.5	178.3	176.6	-176.5	168.6	0	108.2	C103 F104 D105	K41-C103 HydrophobicContact CD-CB 4.38Å; K41-C103 VanDerWaalsContact CE-SG 3.58Å; K41-C103 HydrophobicContact CG-CB 4.27Å; K41-F104 CarbonylContact C-O 3.55Å; K41-F104 VanDerWaalsContact CA-O 3.31Å; K41-F104 WeakPolarHBondContact CA-O 3.37Å; K41-D105 HydrophobicContact CB-CB 4.22Å; K41-D105 HydrophobicContact CD-CB 4.11Å; K41-D105 HydrophobicContact CG-CB 3.95Å
42	E	96.6	Very high	92.7	Very high	85 Å²	85	70.3 Å²	70.3	40%	0.397	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	136.2	176.1	-158.3	66.4	-143.1	0	0	108.9	F34 L36 F44 C103 F104	F34-E42 HydrophobicContact CE2-CB 3.88Å; F34-E42 HydrophobicContact CE2-CG 4.11Å; F34-E42 HydrophobicContact CZ-CB 4.36Å; L36-E42 HydrophobicContact CD1-CB 3.73Å; E42-F44 HydrophobicContact CB-CE2 4.37Å; E42-F44 HydrophobicContact CG-CE2 3.96Å; E42-F44 HydrophobicContact CG-CZ 3.9Å; E42-C103 CarbonylContact O-C 3.6Å; E42-C103 VanDerWaalsContact O-CA 3.23Å; E42-C103 WeakPolarHBondContact O-CA 3.47Å; E42-F104 PolarHBondContact N-O 2.63Å; E42-F104 PolarHBondContact O-N 3.29Å
43	C	96.4	Very high	92.7	Very high	42 Å²	42	66.5 Å²	66.5	28%	0.284	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	139.4	-177.9	-66.8	0	0	0	0	109.8	M101 F102 C103	C43-M101 HydrophobicContact CB-CG 4.24Å; C43-M101 HydrophobicContact CB-SD 4.28Å; C43-F102 WeakPolarHBondContact CA-O 3.31Å; C43-C103 HydrophobicContact CB-CB 4.03Å; C43-C103 WeakPolarHBondContact CB-SG 3.46Å; C43-C103 WeakPolarHBondContact SG-CB 3.39Å; C43-C103 CovalentContact SG-SG 2.04Å; C43-C103 PolarHBondContact SG-SG 2.77Å
44	F	95.6	Very high	92.8	Very high	63 Å²	63	62.6 Å²	62.6	28%	0.276	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	152.9	178.3	-59.1	-89.9	0	0	0	109.1	F34 E42 M101 F102 F104 F118	F34-F44 HydrophobicContact CD1-CE2 4.4Å; F34-F44 HydrophobicContact CD1-CZ 4.22Å; F34-F44 HydrophobicContact CD2-CZ 4.29Å; F34-F44 AromaticContact CE1-CE2 3.91Å; F34-F44 HydrophobicContact CE1-CE2 3.91Å; F34-F44 HydrophobicContact CE1-CZ 4.18Å; F34-F44 HydrophobicContact CE2-CE2 4.24Å; F34-F44 HydrophobicContact CE2-CZ 4.25Å; F34-F44 HydrophobicContact CG-CZ 4.27Å; F34-F44 AromaticContact CZ-CE2 3.83Å; F34-F44 HydrophobicContact CZ-CE2 3.83Å; F34-F44 HydrophobicContact CZ-CZ 4.2Å; E42-F44 HydrophobicContact CB-CE2 4.37Å; E42-F44 HydrophobicContact CG-CE2 3.96Å; E42-F44 HydrophobicContact CG-CZ 3.9Å; F44-M101 WeakPolarHBondContact O-CA 3.4Å; F44-F102 HydrophobicContact CB-CD2 3.97Å; F44-F102 HydrophobicContact CB-CE1 4.04Å; F44-F102 HydrophobicContact CB-CE2 3.35Å; F44-F102 HydrophobicContact CB-CZ 3.35Å; F44-F102 HydrophobicContact CD2-CD2 4.29Å; F44-F102 AromaticContact CD2-CE2 3.93Å; F44-F102 HydrophobicContact CD2-CE2 3.93Å; F44-F102 AromaticContact CG-CE2 3.9Å; F44-F102 HydrophobicContact CG-CE2 3.9Å; F44-F102 HydrophobicContact CG-CZ 4.27Å; F44-F102 PolarHBondContact N-O 2.96Å; F44-F102 PolarHBondContact O-N 2.82Å; F44-F104 HydrophobicContact CD2-CD2 4.31Å; F44-F104 HydrophobicContact CD2-CE2 4.38Å; F44-F104 HydrophobicContact CE2-CD2 4.13Å; F44-F104 HydrophobicContact CE2-CE2 4.4Å; F44-F118 HydrophobicContact CD1-CZ 4.44Å; F44-F118 HydrophobicContact CD2-CE1 4.4Å; F44-F118 HydrophobicContact CD2-CZ 4.32Å; F44-F118 HydrophobicContact CE1-CZ 4.44Å; F44-F118 HydrophobicContact CE2-CE1 4.03Å; F44-F118 HydrophobicContact CE2-CZ 4.32Å; F44-F118 HydrophobicContact CG-CZ 4.39Å; F44-F118 HydrophobicContact CZ-CE1 4.15Å; F44-F118 HydrophobicContact CZ-CZ 4.38Å
45	F	94.8	Very high	92.8	Very high	132 Å²	132	63 Å²	63	58%	0.579	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.9	133.7	-177.4	-64	-95.3	0	0	0	109.2	Y100 M101	F45-Y100 CarbonylContact C-O 3.49Å; F45-Y100 VanDerWaalsContact CA-O 3.29Å; F45-Y100 WeakPolarHBondContact CA-O 3.34Å; F45-M101 HydrophobicContact CD1-CB 3.76Å; F45-M101 HydrophobicContact CD1-CG 4.06Å; F45-M101 HydrophobicContact CE1-CB 3.59Å; F45-M101 HydrophobicContact CE1-CG 3.59Å; F45-M101 HydrophobicContact CE1-SD 3.57Å; F45-M101 VanDerWaalsContact CE1-SD 3.57Å; F45-M101 HydrophobicContact CE2-CG 4.4Å; F45-M101 HydrophobicContact CE2-SD 4.38Å; F45-M101 HydrophobicContact CZ-CB 4.31Å; F45-M101 HydrophobicContact CZ-CG 3.78Å; F45-M101 HydrophobicContact CZ-SD 3.44Å; F45-M101 WeakPolarHBondContact CZ-SD 3.41Å
46	Q	92.6	Very high	92.8	Very high	47 Å²	47	59.6 Å²	59.6	22%	0.22	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	119.5	175	-179.4	57.4	54.6	0	0	109	M48 Y100 F102 M122	Q46-M48 HydrophobicContact CG-CG 4.32Å; Q46-M48 HydrophobicContact CG-SD 3.77Å; Q46-Y100 PolarHBondContact N-O 2.88Å; Q46-Y100 PolarHBondContact O-N 2.87Å; Q46-F102 HydrophobicContact CB-CE1 4.03Å; Q46-M122 HydrophobicContact CG-SD 3.96Å
47	T	92.1	Very high	92.8	Very high	84 Å²	84	60.9 Å²	60.9	52%	0.515	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	127.9	173.2	-49.3	0	0	0	0	108.9	D99	T47-D99 WeakPolarHBondContact CA-OD1 3.35Å; T47-D99 VanDerWaalsContact CB-OD1 3.27Å; T47-D99 WeakPolarHBondContact CB-OD1 3.44Å; T47-D99 WeakPolarHBondContact CG2-OD1 3.34Å; T47-D99 PolarHBondContact OG1-OD1 3.13Å
48	M	91	Very high	92.8	Very high	2 Å²	2	59.1 Å²	59.1	1%	0.01	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	148.8	178.5	-63.2	-60	-63.4	0	0	110.1	Q46 A52 L54 T95 G98 Y100 M122 M125	Q46-M48 HydrophobicContact CG-CG 4.32Å; Q46-M48 HydrophobicContact CG-SD 3.77Å; M48-A52 HydrophobicContact CE-CB 4.11Å; M48-L54 HydrophobicContact CE-CB 4.03Å; M48-L54 HydrophobicContact CE-CD1 4.48Å; M48-L54 HydrophobicContact CG-CB 4.49Å; M48-L54 HydrophobicContact CG-CD2 4.37Å; M48-L54 HydrophobicContact SD-CB 4.44Å; M48-L54 HydrophobicContact SD-CD1 4.12Å; M48-T95 HydrophobicContact CB-CG2 3.86Å; M48-T95 HydrophobicContact CE-CG2 3.9Å; M48-T95 HydrophobicContact CG-CG2 3.82Å; M48-G98 PolarHBondContact N-O 2.92Å; M48-G98 PolarHBondContact O-N 3.11Å; M48-Y100 HydrophobicContact CB-CD2 3.9Å; M48-Y100 HydrophobicContact CB-CE2 4.05Å; M48-Y100 HydrophobicContact CG-CD2 3.82Å; M48-Y100 HydrophobicContact CG-CE2 4.35Å; M48-M122 HydrophobicContact CE-CB 4.27Å; M48-M122 HydrophobicContact CE-CG 4.13Å; M48-M122 HydrophobicContact SD-CG 4.05Å; M48-M122 HydrophobicContact SD-SD 4.13Å; M48-M125 HydrophobicContact CE-CE 4.21Å; M48-M125 HydrophobicContact CE-CG 4.18Å; M48-M125 HydrophobicContact CE-SD 4.06Å; M48-M125 HydrophobicContact SD-CE 3.72Å; M48-M125 HydrophobicContact SD-SD 4.18Å
49	K	89.1	Confident	92.8	Very high	68 Å²	68	57.5 Å²	57.5	30%	0.296	29%	0.285	S	S	.	.			trans	-88.6	155.4	171.8	-70.1	-174.7	171.9	-171.7	0	110	A52 T95 E126 E128	K49-A52 WeakPolarHBondContact O-CB 3.41Å; K49-A52 PolarHBondContact O-N 2.91Å; K49-T95 PolarHBondContact O-OG1 2.81Å; K49-E126 PolarHBondContact NZ-O 3.05Å; K49-E128 IonicContact NZ-OE1 2.91Å; K49-E128 PolarHBondContact NZ-OE1 3.42Å
50	K	87.8	Confident	92.8	Very high	138 Å²	138	55.3 Å²	55.3	60%	0.6	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	141.9	174.1	-166.1	-168.5	168.5	-165.5	0	111.9	A52 T95 D97	K50-A52 PolarHBondContact O-N 2.69Å; K50-T95 CarbonylContact C-O 3.51Å; K50-D97 HydrophobicContact CB-CB 4.28Å
51	D	86	Confident	92.6	Very high	123 Å²	123	49.4 Å²	49.4	66%	0.658	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.6	15.2	175.3	-53.5	-47.2	0	0	0	113.7	T95	D51-T95 PolarHBondContact N-O 3.32Å
52	A	88.4	Confident	92.1	Very high	3 Å²	3	48 Å²	48	3%	0.025	24%	0.24	C	C	.	.			trans	-89	167.3	168.4	0	0	0	0	0	111.3	M48 K49 K50 T95 D123 N124	M48-A52 HydrophobicContact CE-CB 4.11Å; K49-A52 WeakPolarHBondContact O-CB 3.41Å; K49-A52 PolarHBondContact O-N 2.91Å; K50-A52 PolarHBondContact O-N 2.69Å; A52-T95 WeakPolarHBondContact CA-OG1 3.48Å; A52-T95 WeakPolarHBondContact CB-OG1 3.48Å; A52-T95 PolarHBondContact N-OG1 3.48Å; A52-T95 PolarHBondContact O-N 2.92Å; A52-T95 PolarHBondContact O-OG1 3.28Å; A52-D123 WeakPolarHBondContact CB-O 3.44Å; A52-N124 HydrophobicContact CB-CB 4.5Å
53	S	88.7	Confident	91.5	Very high	32 Å²	32	44.5 Å²	44.5	22%	0.224	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.6	176.8	179.9	0	0	0	0	110.4	D123	S53-D123 PolarHBondContact N-O 2.66Å; S53-D123 PolarHBondContact O-N 3.07Å
54	L	92.4	Very high	90.9	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	117	171.3	177.1	64.9	0	0	0	108.8	M48 T92 V93 T95 Y100 L120 M122	M48-L54 HydrophobicContact CE-CB 4.03Å; M48-L54 HydrophobicContact CE-CD1 4.48Å; M48-L54 HydrophobicContact CG-CB 4.49Å; M48-L54 HydrophobicContact CG-CD2 4.37Å; M48-L54 HydrophobicContact SD-CB 4.44Å; M48-L54 HydrophobicContact SD-CD1 4.12Å; L54-T92 CarbonylContact O-C 3.57Å; L54-T92 WeakPolarHBondContact O-CA 3.31Å; L54-V93 PolarHBondContact N-O 2.81Å; L54-V93 PolarHBondContact O-N 3.22Å; L54-T95 HydrophobicContact CB-CG2 3.41Å; L54-T95 VanDerWaalsContact CB-CG2 3.41Å; L54-Y100 HydrophobicContact CD2-CD1 4.23Å; L54-Y100 HydrophobicContact CD2-CG 4.05Å; L54-L120 HydrophobicContact CD1-CD2 4.34Å; L54-M122 HydrophobicContact CD1-CG 4.22Å
55	E	93.4	Very high	90.5	Very high	45 Å²	45	49.6 Å²	49.6	21%	0.21	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	130.1	169.6	177.4	168.2	126.4	0	0	109.7	V90 H91 T92 L120 I121	E55-V90 HydrophobicContact CG-CG1 4.18Å; E55-H91 WeakPolarHBondContact CA-O 3.42Å; E55-T92 HydrophobicContact CB-CG2 4.14Å; E55-T92 PolarHBondContact OE2-OG1 2.85Å; E55-L120 WeakPolarHBondContact O-CA 3.15Å; E55-I121 HydrophobicContact CB-CB 4.15Å; E55-I121 PolarHBondContact N-O 2.91Å; E55-I121 PolarHBondContact O-N 3.32Å
56	I	94.5	Very high	90.3	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.4	175.6	-174.6	166.4	0	0	0	109.5	F70 V90 H91 F102 E119 L120	I56-F70 HydrophobicContact CD1-CE2 3.76Å; I56-F70 HydrophobicContact CD1-CZ 3.91Å; I56-F70 HydrophobicContact CG1-CZ 4.49Å; I56-F70 HydrophobicContact CG2-CE1 4.49Å; I56-F70 HydrophobicContact CG2-CZ 3.83Å; I56-V90 WeakPolarHBondContact O-CA 3.49Å; I56-H91 HydrophobicContact CG2-CB 4.02Å; I56-H91 PolarHBondContact N-O 2.95Å; I56-H91 PolarHBondContact O-N 3.14Å; I56-F102 HydrophobicContact CD1-CB 3.92Å; I56-F102 HydrophobicContact CD1-CD1 4.26Å; I56-F102 HydrophobicContact CD1-CD2 3.39Å; I56-F102 HydrophobicContact CD1-CE2 3.92Å; I56-F102 HydrophobicContact CD1-CG 3.6Å; I56-E119 WeakPolarHBondContact CA-O 3.23Å; I56-L120 HydrophobicContact CB-CD2 3.96Å; I56-L120 HydrophobicContact CD1-CD2 3.75Å; I56-L120 HydrophobicContact CG1-CD2 3.78Å
57	E	94.5	Very high	90.4	Very high	28 Å²	28	43.4 Å²	43.4	13%	0.131	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	132.8	172.7	175.2	164.4	-168.3	0	0	108.4	G89 V90 F118 E119 Q168 L172	E57-G89 WeakPolarHBondContact CA-O 3.46Å; E57-V90 HydrophobicContact CB-CG2 4.15Å; E57-V90 HydrophobicContact CG-CG2 3.87Å; E57-F118 CarbonylContact O-C 3.47Å; E57-F118 WeakPolarHBondContact O-CA 3.48Å; E57-F118 WeakPolarHBondContact O-CB 3.43Å; E57-E119 PolarHBondContact N-O 3.28Å; E57-E119 PolarHBondContact O-N 3.1Å; E57-Q168 PolarHBondContact OE2-NE2 3.26Å; E57-L172 WeakPolarHBondContact OE1-CD1 3.01Å
58	Y	95.3	Very high	90.6	Very high	1 Å²	1	39.4 Å²	39.4	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	151.1	176.8	72.4	-90.7	0	0	0	112	V68 F70 D83 D88 G89 F104 F117	Y58-V68 HydrophobicContact CD2-CG1 4.18Å; Y58-V68 HydrophobicContact CE2-CG1 3.84Å; Y58-F70 HydrophobicContact CD1-CD1 4.35Å; Y58-F70 HydrophobicContact CD1-CD2 4.12Å; Y58-F70 HydrophobicContact CD1-CE2 4.38Å; Y58-F70 HydrophobicContact CD1-CG 4.09Å; Y58-F70 HydrophobicContact CE1-CB 3.88Å; Y58-F70 AromaticContact CE1-CD1 3.69Å; Y58-F70 HydrophobicContact CE1-CD1 3.69Å; Y58-F70 HydrophobicContact CE1-CD2 4.12Å; Y58-F70 HydrophobicContact CE1-CE1 4.26Å; Y58-F70 AromaticContact CE1-CG 3.61Å; Y58-F70 HydrophobicContact CE1-CG 3.61Å; Y58-F70 HydrophobicContact CE2-CB 4.32Å; Y58-D83 WeakPolarHBondContact OH-CB 3.48Å; Y58-D83 PolarHBondContact OH-OD2 2.88Å; Y58-D88 WeakPolarHBondContact O-CA 3.19Å; Y58-D88 WeakPolarHBondContact O-CB 3.36Å; Y58-G89 WeakPolarHBondContact CD1-O 3.38Å; Y58-G89 PolarHBondContact N-O 3.03Å; Y58-G89 PolarHBondContact O-N 3.45Å; Y58-G89 VanDerWaalsContact O-N 3.1Å; Y58-F104 HydrophobicContact CD1-CE1 4.32Å; Y58-F104 HydrophobicContact CD2-CE1 4.02Å; Y58-F104 AromaticContact CG-CE1 3.74Å; Y58-F104 HydrophobicContact CG-CE1 3.74Å; Y58-F104 HydrophobicContact CG-CZ 4.42Å; Y58-F117 CarbonylContact C-O 3.55Å; Y58-F117 WeakPolarHBondContact CA-O 3.42Å
59	Q	95.3	Very high	90.9	Very high	10 Å²	10	41 Å²	41	5%	0.047	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	132.5	177.3	-178	165.9	69.7	0	0	111.4	L61 S87 D88 F117	Q59-L61 HydrophobicContact CG-CD2 4.25Å; Q59-L61 PolarHBondContact O-N 3Å; Q59-S87 WeakPolarHBondContact CA-O 3.33Å; Q59-D88 HydrophobicContact CB-CB 4.48Å; Q59-D88 HydrophobicContact CG-CB 4.48Å; Q59-F117 PolarHBondContact N-O 3.12Å; Q59-F117 PolarHBondContact O-N 2.81Å
60	V	94	Very high	91.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	112.1	171.1	-172.3	0	0	0	0	108.6	L66 V68 S87 K114	V60-L66 HydrophobicContact CG1-CB 4.33Å; V60-L66 HydrophobicContact CG1-CD2 4.38Å; V60-V68 HydrophobicContact CG2-CB 3.96Å; V60-V68 HydrophobicContact CG2-CG1 3.61Å; V60-S87 PolarHBondContact N-O 3.01Å; V60-K114 HydrophobicContact CG1-CD 4.11Å
61	L	89.3	Confident	91.8	Very high	32 Å²	32	32.3 Å²	32.3	17%	0.168	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-38.8	-178	-60.8	-177.2	0	0	0	112.2	T33 Q59 I115 F117 A175	T33-L61 HydrophobicContact CG2-CD1 4.05Å; Q59-L61 HydrophobicContact CG-CD2 4.25Å; Q59-L61 PolarHBondContact O-N 3Å; L61-I115 HydrophobicContact CB-CB 4.44Å; L61-I115 HydrophobicContact CB-CG2 4.26Å; L61-I115 HydrophobicContact CD1-CG2 4.27Å; L61-I115 PolarHBondContact N-O 3.31Å; L61-F117 HydrophobicContact CD1-CB 3.83Å; L61-F117 HydrophobicContact CD2-CB 4.18Å; L61-F117 HydrophobicContact CG-CB 3.93Å; L61-A175 HydrophobicContact CD2-CB 4.31Å
62	D	86.8	Confident	92.3	Very high	71 Å²	71	26.5 Å²	26.5	38%	0.38	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	157.1	-176	-159.6	12.3	0	0	0	113.2	K114 I115	D62-K114 WeakPolarHBondContact O-CA 3.12Å; D62-I115 HydrophobicContact CB-CB 4.11Å; D62-I115 HydrophobicContact CB-CD1 3.99Å; D62-I115 HydrophobicContact CB-CG1 4.15Å; D62-I115 PolarHBondContact N-O 2.89Å; D62-I115 PolarHBondContact O-N 3.31Å
63	G	83	Confident	92.7	Very high	11 Å²	11	26.7 Å²	26.7	11%	0.113	16%	0.157	C	C	.	.	S	Bend	trans	113.1	121.8	175	0	0	0	0	0	114.8	D65 L66 E113 K114	G63-D65 PolarHBondContact O-N 2.97Å; G63-L66 WeakPolarHBondContact O-CA 3.45Å; G63-L66 PolarHBondContact O-N 3.04Å; G63-E113 WeakPolarHBondContact CA-O 3.43Å; G63-K114 WeakPolarHBondContact O-CD 3.47Å; G63-K114 WeakPolarHBondContact O-CE 3.4Å
64	A	84.9	Confident	93	Very high	72 Å²	72	25.6 Å²	25.6	60%	0.595	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	34.5	-115	176.6	0	0	0	0	0	115.3	L66 S112	A64-L66 PolarHBondContact O-N 2.87Å; A64-S112 VanDerWaalsContact CB-OG 3.25Å; A64-S112 WeakPolarHBondContact CB-OG 3.25Å
65	D	87.7	Confident	93.1	Very high	141 Å²	141	27.8 Å²	27.8	75%	0.754	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.9	7.8	-175.9	-66.8	-28.5	0	0	0	113.4	G63 D67	G63-D65 PolarHBondContact O-N 2.97Å; D65-D67 PolarHBondContact O-N 3.23Å
66	L	90.5	Very high	93.1	Very high	32 Å²	32	29.9 Å²	29.9	17%	0.168	18%	0.18	C	C	.	.			trans	52.9	40	-178.5	-56.5	176.3	0	0	0	112.9	V60 G63 A64 S87	V60-L66 HydrophobicContact CG1-CB 4.33Å; V60-L66 HydrophobicContact CG1-CD2 4.38Å; G63-L66 WeakPolarHBondContact O-CA 3.45Å; G63-L66 PolarHBondContact O-N 3.04Å; A64-L66 PolarHBondContact O-N 2.87Å; L66-S87 WeakPolarHBondContact O-CA 3.38Å; L66-S87 VanDerWaalsContact O-CB 3.23Å; L66-S87 WeakPolarHBondContact O-CB 3.42Å
67	D	94.4	Very high	92.9	Very high	16 Å²	16	32.6 Å²	32.6	9%	0.086	21%	0.207	C	C	.	.			trans	-119.7	150.2	-176.7	61.6	-16.2	0	0	0	112.6	D65 R85 K86 F108 K114	D65-D67 PolarHBondContact O-N 3.23Å; D67-R85 HydrophobicContact CB-CB 4.12Å; D67-K86 WeakPolarHBondContact CA-O 3.36Å; D67-F108 HydrophobicContact CB-CZ 4.45Å; D67-F108 WeakPolarHBondContact O-CZ 3.38Å; D67-F108 WeakPolarHBondContact OD1-CE2 3.34Å; D67-F108 WeakPolarHBondContact OD2-CE2 3.28Å; D67-K114 WeakPolarHBondContact O-CE 3.49Å; D67-K114 WeakPolarHBondContact OD1-CE 3.14Å; D67-K114 IonicContact OD1-NZ 3.73Å
68	V	96.3	Very high	92.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	151.4	171.9	70.4	0	0	0	0	110.3	L36 Y58 V60 R85 K86 F104 D105 I116	L36-V68 HydrophobicContact CD2-CG2 4.27Å; Y58-V68 HydrophobicContact CD2-CG1 4.18Å; Y58-V68 HydrophobicContact CE2-CG1 3.84Å; V60-V68 HydrophobicContact CG2-CB 3.96Å; V60-V68 HydrophobicContact CG2-CG1 3.61Å; V68-R85 PolarHBondContact O-N 3.19Å; V68-K86 PolarHBondContact N-O 3.05Å; V68-K86 PolarHBondContact O-N 3.23Å; V68-F104 HydrophobicContact CG1-CD1 4.39Å; V68-F104 HydrophobicContact CG2-CB 4.1Å; V68-F104 HydrophobicContact CG2-CD1 4.38Å; V68-D105 WeakPolarHBondContact CG2-O 3.37Å; V68-I116 HydrophobicContact CB-CD1 4.33Å; V68-I116 HydrophobicContact CG2-CD1 3.8Å
69	D	97.4	Very high	92.8	Very high	36 Å²	36	41.8 Å²	41.8	19%	0.193	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	124.3	167.4	-81.4	15.9	0	0	0	108.2	D83 H84 R85 D105	D69-D83 WeakPolarHBondContact CA-O 3.42Å; D69-H84 WeakPolarHBondContact OD1-CA 3.47Å; D69-H84 IonicContact OD2-ND1 3.8Å; D69-H84 PolarHBondContact OD2-ND1 2.78Å; D69-R85 PolarHBondContact OD1-N 3.32Å; D69-D105 HydrophobicContact CB-CB 4Å; D69-D105 PolarHBondContact N-O 2.94Å; D69-D105 PolarHBondContact O-N 2.93Å
70	F	97.8	Very high	92.8	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.009	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	138.9	-178	169.3	-98	0	0	0	110.3	I56 Y58 L72 S82 D83 H91 F102 C103 F104	I56-F70 HydrophobicContact CD1-CE2 3.76Å; I56-F70 HydrophobicContact CD1-CZ 3.91Å; I56-F70 HydrophobicContact CG1-CZ 4.49Å; I56-F70 HydrophobicContact CG2-CE1 4.49Å; I56-F70 HydrophobicContact CG2-CZ 3.83Å; Y58-F70 HydrophobicContact CD1-CD1 4.35Å; Y58-F70 HydrophobicContact CD1-CD2 4.12Å; Y58-F70 HydrophobicContact CD1-CE2 4.38Å; Y58-F70 HydrophobicContact CD1-CG 4.09Å; Y58-F70 HydrophobicContact CE1-CB 3.88Å; Y58-F70 AromaticContact CE1-CD1 3.69Å; Y58-F70 HydrophobicContact CE1-CD1 3.69Å; Y58-F70 HydrophobicContact CE1-CD2 4.12Å; Y58-F70 HydrophobicContact CE1-CE1 4.26Å; Y58-F70 AromaticContact CE1-CG 3.61Å; Y58-F70 HydrophobicContact CE1-CG 3.61Å; Y58-F70 HydrophobicContact CE2-CB 4.32Å; F70-L72 HydrophobicContact CE1-CB 3.99Å; F70-L72 HydrophobicContact CZ-CB 3.96Å; F70-S82 CarbonylContact O-C 3.58Å; F70-S82 WeakPolarHBondContact O-CA 3.22Å; F70-D83 HydrophobicContact CB-CB 4.23Å; F70-D83 PolarHBondContact N-O 3.43Å; F70-D83 PolarHBondContact O-N 3.07Å; F70-H91 AromaticContact CD1-CD2 3.94Å; F70-H91 AromaticContact CE1-CD2 3.52Å; F70-F102 HydrophobicContact CE2-CB 3.91Å; F70-F102 HydrophobicContact CZ-CB 4.16Å; F70-C103 WeakPolarHBondContact CA-O 3.43Å; F70-F104 AromaticContact CD2-CD1 3.95Å; F70-F104 HydrophobicContact CD2-CD1 3.95Å; F70-F104 AromaticContact CD2-CE1 3.58Å; F70-F104 HydrophobicContact CD2-CE1 3.58Å; F70-F104 HydrophobicContact CD2-CZ 4.02Å; F70-F104 HydrophobicContact CE2-CE1 4.13Å; F70-F104 HydrophobicContact CE2-CZ 4.11Å
71	S	97.4	Very high	92.9	Very high	21 Å²	21	49.2 Å²	49.2	15%	0.147	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	128.5	175.2	65	0	0	0	0	111.2	Y81 F102 C103	S71-Y81 WeakPolarHBondContact CA-O 3.34Å; S71-F102 CarbonylContact O-C 3.58Å; S71-F102 VanDerWaalsContact O-CA 3.31Å; S71-F102 WeakPolarHBondContact O-CA 3.47Å; S71-C103 PolarHBondContact N-O 2.76Å; S71-C103 PolarHBondContact O-N 3.2Å
72	L	96.9	Very high	93.3	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	130.8	171	179.4	65.3	0	0	0	109.6	F70 V79 L80 Y81 V93 F102	F70-L72 HydrophobicContact CE1-CB 3.99Å; F70-L72 HydrophobicContact CZ-CB 3.96Å; L72-V79 CarbonylContact O-C 3.56Å; L72-L80 PolarHBondContact O-N 2.99Å; L72-Y81 HydrophobicContact CD2-CD2 3.97Å; L72-Y81 PolarHBondContact N-O 2.96Å; L72-Y81 PolarHBondContact O-N 2.82Å; L72-V93 HydrophobicContact CD2-CG2 3.61Å; L72-F102 HydrophobicContact CD1-CB 3.82Å
73	S	96.8	Very high	93.8	Very high	7 Å²	7	48.7 Å²	48.7	5%	0.049	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	143	-180	50	0	0	0	0	112.3	H78 M101	S73-H78 CarbonylContact C-O 3.57Å; S73-H78 WeakPolarHBondContact CA-O 3.49Å; S73-H78 WeakPolarHBondContact CB-O 3.42Å; S73-M101 PolarHBondContact N-O 2.89Å; S73-M101 PolarHBondContact O-N 2.87Å; S73-M101 WeakPolarHBondContact OG-CB 3.47Å; S73-M101 WeakPolarHBondContact OG-CE 3.48Å; S73-M101 PolarHBondContact OG-O 3Å
74	S	95.2	Very high	94.4	Very high	9 Å²	9	54 Å²	54	6%	0.063	31%	0.313	C	S	.	.			trans	-71.6	165	177.1	65.3	0	0	0	0	111.8	T76 G77 H78	S74-T76 PolarHBondContact O-N 3.49Å; S74-T76 VanDerWaalsContact O-N 3.12Å; S74-T76 PolarHBondContact OG-OG1 3.28Å; S74-G77 WeakPolarHBondContact O-CA 3.47Å; S74-G77 PolarHBondContact O-N 3.02Å; S74-H78 PolarHBondContact N-O 2.91Å; S74-H78 PolarHBondContact OG-N 3.31Å; S74-H78 VanDerWaalsContact OG-N 3.12Å; S74-H78 PolarHBondContact OG-O 2.87Å
75	P	94.8	Very high	94.8	Very high	47 Å²	47	58.5 Å²	58.5	31%	0.305	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-24.6	173.7	-23.1	32.7	0	0	0	113.6	G77 D99 Y100	P75-G77 PolarHBondContact O-N 3.01Å; P75-D99 VanDerWaalsContact CA-O 3.28Å; P75-D99 WeakPolarHBondContact CA-O 3.43Å; P75-Y100 HydrophobicContact CG-CD2 3.8Å; P75-Y100 HydrophobicContact CG-CE2 3.61Å; P75-Y100 HydrophobicContact CG-CG 4.45Å
76	T	92.8	Very high	95.2	Very high	90 Å²	90	57 Å²	57	55%	0.552	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-4.6	175	47.8	0	0	0	0	113.5	S74 H78	S74-T76 PolarHBondContact O-N 3.49Å; S74-T76 VanDerWaalsContact O-N 3.12Å; S74-T76 PolarHBondContact OG-OG1 3.28Å; T76-H78 PolarHBondContact OG1-CD2 2.95Å
77	G	89.7	Confident	95.4	Very high	57 Å²	57	57.3 Å²	57.3	59%	0.588	31%	0.307	S	S	*	.	S	Bend	trans	84.3	10.3	179.5	0	0	0	0	0	114.4	S74 P75	S74-G77 WeakPolarHBondContact O-CA 3.47Å; S74-G77 PolarHBondContact O-N 3.02Å; P75-G77 PolarHBondContact O-N 3.01Å
78	H	93.8	Very high	95.4	Very high	129 Å²	129	60.3 Å²	60.3	60%	0.597	32%	0.323	S	S	*	.			trans	-83.6	132.7	175	-67.9	-60.2	0	0	0	110.5	S73 S74 T76 L80	S73-H78 CarbonylContact C-O 3.57Å; S73-H78 WeakPolarHBondContact CA-O 3.49Å; S73-H78 WeakPolarHBondContact CB-O 3.42Å; S74-H78 PolarHBondContact N-O 2.91Å; S74-H78 PolarHBondContact OG-N 3.31Å; S74-H78 VanDerWaalsContact OG-N 3.12Å; S74-H78 PolarHBondContact OG-O 2.87Å; T76-H78 PolarHBondContact OG1-CD2 2.95Å; H78-L80 PolarHBondContact O-N 2.93Å
79	V	95	Very high	95.2	Very high	94 Å²	94	60.9 Å²	60.9	57%	0.57	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	117	174.4	-178.8	0	0	0	0	108.6	L72 Y81	L72-V79 CarbonylContact O-C 3.56Å; V79-Y81 WeakPolarHBondContact CG1-O 3.02Å
80	L	95.1	Very high	95.1	Very high	72 Å²	72	62.9 Å²	62.9	38%	0.377	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	-47	179	-60.3	179.6	0	0	0	110.7	L72 H78 V93 Y100	L72-L80 PolarHBondContact O-N 2.99Å; H78-L80 PolarHBondContact O-N 2.93Å; L80-V93 HydrophobicContact CD1-CG1 3.78Å; L80-V93 HydrophobicContact CD1-CG2 4.15Å; L80-Y100 HydrophobicContact CD1-CD1 4.3Å; L80-Y100 HydrophobicContact CD1-CE1 3.73Å
81	Y	95.9	Very high	95	Very high	93 Å²	93	63.9 Å²	63.9	37%	0.365	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	146.4	177.3	-64.6	-67	0	0	0	111.2	S71 L72 V79 H91 V93	S71-Y81 WeakPolarHBondContact CA-O 3.34Å; L72-Y81 HydrophobicContact CD2-CD2 3.97Å; L72-Y81 PolarHBondContact N-O 2.96Å; L72-Y81 PolarHBondContact O-N 2.82Å; V79-Y81 WeakPolarHBondContact CG1-O 3.02Å; Y81-H91 AromaticContact CD1-ND1 3.64Å; Y81-H91 HydrophobicContact CD2-CB 3.71Å; Y81-H91 AromaticContact CD2-CG 3.88Å; Y81-H91 AromaticContact CD2-ND1 3.79Å; Y81-H91 HydrophobicContact CE2-CB 3.97Å; Y81-H91 HydrophobicContact CG-CB 4.3Å; Y81-H91 AromaticContact CG-CG 3.95Å; Y81-H91 AromaticContact CG-ND1 3.5Å; Y81-V93 HydrophobicContact CD2-CG2 3.99Å; Y81-V93 HydrophobicContact CE2-CG2 3.45Å; Y81-V93 VanDerWaalsContact CE2-CG2 3.45Å
82	S	96.6	Very high	94.8	Very high	62 Å²	62	65.9 Å²	65.9	43%	0.434	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	111.5	177.5	-173	0	0	0	0	108.8	F70 H84	F70-S82 CarbonylContact O-C 3.58Å; F70-S82 WeakPolarHBondContact O-CA 3.22Å; S82-H84 PolarHBondContact OG-NE2 3.43Å
83	D	97.2	Very high	94.6	Very high	31 Å²	31	66.6 Å²	66.6	17%	0.166	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	140.8	173.6	-68.7	-30.9	0	0	0	109.9	Y58 D69 F70 K86 H91	Y58-D83 WeakPolarHBondContact OH-CB 3.48Å; Y58-D83 PolarHBondContact OH-OD2 2.88Å; D69-D83 WeakPolarHBondContact CA-O 3.42Å; F70-D83 HydrophobicContact CB-CB 4.23Å; F70-D83 PolarHBondContact N-O 3.43Å; F70-D83 PolarHBondContact O-N 3.07Å; D83-K86 HydrophobicContact CB-CB 4.32Å; D83-K86 HydrophobicContact CB-CG 3.84Å; D83-H91 IonicContact OD1-CE1 3.48Å; D83-H91 IonicContact OD1-NE2 2.69Å; D83-H91 IonicContact OD2-CD2 3.9Å; D83-H91 IonicContact OD2-CE1 3.72Å; D83-H91 PolarHBondContact OD2-CE1 3.38Å; D83-H91 IonicContact OD2-NE2 3.29Å; D83-H91 PolarHBondContact OD2-NE2 3.22Å
84	H	96.3	Very high	94.4	Very high	121 Å²	121	74.8 Å²	74.8	56%	0.56	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.3	126.1	177.4	-64.8	-69.1	0	0	0	110.2	D69 S82 K86	D69-H84 WeakPolarHBondContact OD1-CA 3.47Å; D69-H84 IonicContact OD2-ND1 3.8Å; D69-H84 PolarHBondContact OD2-ND1 2.78Å; S82-H84 PolarHBondContact OG-NE2 3.43Å; H84-K86 PolarHBondContact O-N 3.25Å
85	R	94.3	Very high	94.2	Very high	168 Å²	168	74.5 Å²	74.5	63%	0.634	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	47.1	56	177.8	-57.8	-170.9	-176.9	-172.5	-3	113.1	D67 V68 D69	D67-R85 HydrophobicContact CB-CB 4.12Å; V68-R85 PolarHBondContact O-N 3.19Å; D69-R85 PolarHBondContact OD1-N 3.32Å
86	K	95.9	Very high	94	Very high	108 Å²	108	77.4 Å²	77.4	47%	0.47	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	145.7	176.9	-69.5	-62.7	-169.9	166.9	0	111	D67 V68 D83 H84	D67-K86 WeakPolarHBondContact CA-O 3.36Å; V68-K86 PolarHBondContact N-O 3.05Å; V68-K86 PolarHBondContact O-N 3.23Å; D83-K86 HydrophobicContact CB-CB 4.32Å; D83-K86 HydrophobicContact CB-CG 3.84Å; H84-K86 PolarHBondContact O-N 3.25Å
87	S	93	Very high	94	Very high	40 Å²	40	79 Å²	79	28%	0.28	41%	0.413	S	S	.	.	S	Bend	trans	-84	-24.7	173.9	49.5	0	0	0	0	113	Q59 V60 L66	Q59-S87 WeakPolarHBondContact CA-O 3.33Å; V60-S87 PolarHBondContact N-O 3.01Å; L66-S87 WeakPolarHBondContact O-CA 3.38Å; L66-S87 VanDerWaalsContact O-CB 3.23Å; L66-S87 WeakPolarHBondContact O-CB 3.42Å
88	D	94.3	Very high	94.1	Very high	79 Å²	79	77.2 Å²	77.2	42%	0.422	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	157	-175.7	55.4	-72.3	0	0	0	109.7	Y58 Q59	Y58-D88 WeakPolarHBondContact O-CA 3.19Å; Y58-D88 WeakPolarHBondContact O-CB 3.36Å; Q59-D88 HydrophobicContact CB-CB 4.48Å; Q59-D88 HydrophobicContact CG-CB 4.48Å
89	G	93.4	Very high	94.2	Very high	12 Å²	12	75 Å²	75	12%	0.124	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.9	152.3	177.2	0	0	0	0	0	112.1	E57 Y58	E57-G89 WeakPolarHBondContact CA-O 3.46Å; Y58-G89 WeakPolarHBondContact CD1-O 3.38Å; Y58-G89 PolarHBondContact N-O 3.03Å; Y58-G89 PolarHBondContact O-N 3.45Å; Y58-G89 VanDerWaalsContact O-N 3.1Å
90	V	94.9	Very high	94.2	Very high	77 Å²	77	70.7 Å²	70.7	47%	0.467	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	127.4	175.5	-176.6	0	0	0	0	108	E55 I56 E57	E55-V90 HydrophobicContact CG-CG1 4.18Å; I56-V90 WeakPolarHBondContact O-CA 3.49Å; E57-V90 HydrophobicContact CB-CG2 4.15Å; E57-V90 HydrophobicContact CG-CG2 3.87Å
91	H	95.4	Very high	94.3	Very high	24 Å²	24	70 Å²	70	11%	0.111	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	128.1	179.2	-62	-73.5	0	0	0	110.7	E55 I56 F70 Y81 D83	E55-H91 WeakPolarHBondContact CA-O 3.42Å; I56-H91 HydrophobicContact CG2-CB 4.02Å; I56-H91 PolarHBondContact N-O 2.95Å; I56-H91 PolarHBondContact O-N 3.14Å; F70-H91 AromaticContact CD1-CD2 3.94Å; F70-H91 AromaticContact CE1-CD2 3.52Å; Y81-H91 AromaticContact CD1-ND1 3.64Å; Y81-H91 HydrophobicContact CD2-CB 3.71Å; Y81-H91 AromaticContact CD2-CG 3.88Å; Y81-H91 AromaticContact CD2-ND1 3.79Å; Y81-H91 HydrophobicContact CE2-CB 3.97Å; Y81-H91 HydrophobicContact CG-CB 4.3Å; Y81-H91 AromaticContact CG-CG 3.95Å; Y81-H91 AromaticContact CG-ND1 3.5Å; D83-H91 IonicContact OD1-CE1 3.48Å; D83-H91 IonicContact OD1-NE2 2.69Å; D83-H91 IonicContact OD2-CD2 3.9Å; D83-H91 IonicContact OD2-CE1 3.72Å; D83-H91 PolarHBondContact OD2-CE1 3.38Å; D83-H91 IonicContact OD2-NE2 3.29Å; D83-H91 PolarHBondContact OD2-NE2 3.22Å
92	T	93.6	Very high	94.3	Very high	63 Å²	63	65.8 Å²	65.8	39%	0.387	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.6	178.5	-44.6	0	0	0	0	109.2	L54 E55	L54-T92 CarbonylContact O-C 3.57Å; L54-T92 WeakPolarHBondContact O-CA 3.31Å; E55-T92 HydrophobicContact CB-CG2 4.14Å; E55-T92 PolarHBondContact OE2-OG1 2.85Å
93	V	93.2	Very high	94.3	Very high	15 Å²	15	62.9 Å²	62.9	9%	0.091	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	133.8	-177.2	174.7	0	0	0	0	110.2	L54 L72 L80 Y81 Y100	L54-V93 PolarHBondContact N-O 2.81Å; L54-V93 PolarHBondContact O-N 3.22Å; L72-V93 HydrophobicContact CD2-CG2 3.61Å; L80-V93 HydrophobicContact CD1-CG1 3.78Å; L80-V93 HydrophobicContact CD1-CG2 4.15Å; Y81-V93 HydrophobicContact CD2-CG2 3.99Å; Y81-V93 HydrophobicContact CE2-CG2 3.45Å; Y81-V93 VanDerWaalsContact CE2-CG2 3.45Å; V93-Y100 HydrophobicContact CG1-CE1 4.01Å
94	E	92.3	Very high	94.3	Very high	179 Å²	179	61.4 Å²	61.4	84%	0.836	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	124.3	163.4	-66.6	-177	171.4	0	0	109.4
95	T	90.5	Very high	94.4	Very high	4 Å²	4	57.1 Å²	57.1	3%	0.025	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-94	143.7	-166.4	57.5	0	0	0	0	113.5	M48 K49 K50 D51 A52 L54 Y100	M48-T95 HydrophobicContact CB-CG2 3.86Å; M48-T95 HydrophobicContact CE-CG2 3.9Å; M48-T95 HydrophobicContact CG-CG2 3.82Å; K49-T95 PolarHBondContact O-OG1 2.81Å; K50-T95 CarbonylContact C-O 3.51Å; D51-T95 PolarHBondContact N-O 3.32Å; A52-T95 WeakPolarHBondContact CA-OG1 3.48Å; A52-T95 WeakPolarHBondContact CB-OG1 3.48Å; A52-T95 PolarHBondContact N-OG1 3.48Å; A52-T95 PolarHBondContact O-N 2.92Å; A52-T95 PolarHBondContact O-OG1 3.28Å; L54-T95 HydrophobicContact CB-CG2 3.41Å; L54-T95 VanDerWaalsContact CB-CG2 3.41Å; T95-Y100 WeakPolarHBondContact CA-OH 3.46Å; T95-Y100 HydrophobicContact CG2-CD2 4.47Å; T95-Y100 HydrophobicContact CG2-CE2 3.97Å
96	E	91.3	Very high	94.4	Very high	107 Å²	107	49.1 Å²	49.1	50%	0.5	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-96.5	164.5	166.2	-61.2	-175.7	156.6	0	0	109.3	G98 Y100	E96-G98 PolarHBondContact O-N 3.48Å; E96-Y100 PolarHBondContact N-OH 2.73Å
97	D	91.9	Very high	94.3	Very high	125 Å²	125	47.3 Å²	47.3	67%	0.668	26%	0.263	S	S	*	.	S	Bend	trans	-66.1	117.8	175.6	-165.6	66.9	0	0	0	110.5	K50	K50-D97 HydrophobicContact CB-CB 4.28Å
98	G	92.8	Very high	94.3	Very high	18 Å²	18	48.4 Å²	48.4	19%	0.186	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	145.3	-169.6	174	0	0	0	0	0	115.2	M48 E96	M48-G98 PolarHBondContact N-O 2.92Å; M48-G98 PolarHBondContact O-N 3.11Å; E96-G98 PolarHBondContact O-N 3.48Å
99	D	94.6	Very high	94.1	Very high	82 Å²	82	45.2 Å²	45.2	44%	0.439	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	111.7	-174.9	-65.1	-21.5	0	0	0	111.6	T47 P75	T47-D99 WeakPolarHBondContact CA-OD1 3.35Å; T47-D99 VanDerWaalsContact CB-OD1 3.27Å; T47-D99 WeakPolarHBondContact CB-OD1 3.44Å; T47-D99 WeakPolarHBondContact CG2-OD1 3.34Å; T47-D99 PolarHBondContact OG1-OD1 3.13Å; P75-D99 VanDerWaalsContact CA-O 3.28Å; P75-D99 WeakPolarHBondContact CA-O 3.43Å
100	Y	95.5	Very high	93.7	Very high	4 Å²	4	49 Å²	49	2%	0.016	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	135.7	171	-78.5	-101.6	0	0	0	109.8	F45 Q46 M48 L54 P75 L80 V93 T95 E96	F45-Y100 CarbonylContact C-O 3.49Å; F45-Y100 VanDerWaalsContact CA-O 3.29Å; F45-Y100 WeakPolarHBondContact CA-O 3.34Å; Q46-Y100 PolarHBondContact N-O 2.88Å; Q46-Y100 PolarHBondContact O-N 2.87Å; M48-Y100 HydrophobicContact CB-CD2 3.9Å; M48-Y100 HydrophobicContact CB-CE2 4.05Å; M48-Y100 HydrophobicContact CG-CD2 3.82Å; M48-Y100 HydrophobicContact CG-CE2 4.35Å; L54-Y100 HydrophobicContact CD2-CD1 4.23Å; L54-Y100 HydrophobicContact CD2-CG 4.05Å; P75-Y100 HydrophobicContact CG-CD2 3.8Å; P75-Y100 HydrophobicContact CG-CE2 3.61Å; P75-Y100 HydrophobicContact CG-CG 4.45Å; L80-Y100 HydrophobicContact CD1-CD1 4.3Å; L80-Y100 HydrophobicContact CD1-CE1 3.73Å; V93-Y100 HydrophobicContact CG1-CE1 4.01Å; T95-Y100 WeakPolarHBondContact CA-OH 3.46Å; T95-Y100 HydrophobicContact CG2-CD2 4.47Å; T95-Y100 HydrophobicContact CG2-CE2 3.97Å; E96-Y100 PolarHBondContact N-OH 2.73Å
101	M	96.3	Very high	93.3	Very high	58 Å²	58	51.7 Å²	51.7	29%	0.286	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	123.4	178.1	178.4	-177	61.8	0	0	109.9	C43 F44 F45 S73	C43-M101 HydrophobicContact CB-CG 4.24Å; C43-M101 HydrophobicContact CB-SD 4.28Å; F44-M101 WeakPolarHBondContact O-CA 3.4Å; F45-M101 HydrophobicContact CD1-CB 3.76Å; F45-M101 HydrophobicContact CD1-CG 4.06Å; F45-M101 HydrophobicContact CE1-CB 3.59Å; F45-M101 HydrophobicContact CE1-CG 3.59Å; F45-M101 HydrophobicContact CE1-SD 3.57Å; F45-M101 VanDerWaalsContact CE1-SD 3.57Å; F45-M101 HydrophobicContact CE2-CG 4.4Å; F45-M101 HydrophobicContact CE2-SD 4.38Å; F45-M101 HydrophobicContact CZ-CB 4.31Å; F45-M101 HydrophobicContact CZ-CG 3.78Å; F45-M101 HydrophobicContact CZ-SD 3.44Å; F45-M101 WeakPolarHBondContact CZ-SD 3.41Å; S73-M101 PolarHBondContact N-O 2.89Å; S73-M101 PolarHBondContact O-N 2.87Å; S73-M101 WeakPolarHBondContact OG-CB 3.47Å; S73-M101 WeakPolarHBondContact OG-CE 3.48Å; S73-M101 PolarHBondContact OG-O 3Å
102	F	96	Very high	93.1	Very high	4 Å²	4	52.1 Å²	52.1	2%	0.018	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	137.5	172.4	52.1	-82.6	0	0	0	109.9	C43 F44 Q46 I56 F70 S71 L72 F104 F118 L120	C43-F102 WeakPolarHBondContact CA-O 3.31Å; F44-F102 HydrophobicContact CB-CD2 3.97Å; F44-F102 HydrophobicContact CB-CE1 4.04Å; F44-F102 HydrophobicContact CB-CE2 3.35Å; F44-F102 HydrophobicContact CB-CZ 3.35Å; F44-F102 HydrophobicContact CD2-CD2 4.29Å; F44-F102 AromaticContact CD2-CE2 3.93Å; F44-F102 HydrophobicContact CD2-CE2 3.93Å; F44-F102 AromaticContact CG-CE2 3.9Å; F44-F102 HydrophobicContact CG-CE2 3.9Å; F44-F102 HydrophobicContact CG-CZ 4.27Å; F44-F102 PolarHBondContact N-O 2.96Å; F44-F102 PolarHBondContact O-N 2.82Å; Q46-F102 HydrophobicContact CB-CE1 4.03Å; I56-F102 HydrophobicContact CD1-CB 3.92Å; I56-F102 HydrophobicContact CD1-CD1 4.26Å; I56-F102 HydrophobicContact CD1-CD2 3.39Å; I56-F102 HydrophobicContact CD1-CE2 3.92Å; I56-F102 HydrophobicContact CD1-CG 3.6Å; F70-F102 HydrophobicContact CE2-CB 3.91Å; F70-F102 HydrophobicContact CZ-CB 4.16Å; S71-F102 CarbonylContact O-C 3.58Å; S71-F102 VanDerWaalsContact O-CA 3.31Å; S71-F102 WeakPolarHBondContact O-CA 3.47Å; L72-F102 HydrophobicContact CD1-CB 3.82Å; F102-F104 HydrophobicContact CD2-CE2 4.12Å; F102-F118 HydrophobicContact CE2-CD2 4.17Å; F102-F118 AromaticContact CE2-CE2 3.74Å; F102-F118 HydrophobicContact CE2-CE2 3.74Å; F102-F118 HydrophobicContact CE2-CZ 4.14Å; F102-F118 HydrophobicContact CZ-CE2 4.22Å; F102-L120 HydrophobicContact CE1-CD1 4.17Å; F102-L120 HydrophobicContact CE1-CD2 4.05Å; F102-L120 HydrophobicContact CE2-CD1 4.47Å; F102-L120 HydrophobicContact CE2-CD2 4.27Å; F102-L120 HydrophobicContact CZ-CD1 3.65Å; F102-L120 HydrophobicContact CZ-CD2 3.88Å; F102-L120 HydrophobicContact CZ-CG 4.3Å
103	C	97.3	Very high	93	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.007	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	146.3	-174.6	-53.9	0	0	0	0	112.1	K41 E42 C43 F70 S71	K41-C103 HydrophobicContact CD-CB 4.38Å; K41-C103 VanDerWaalsContact CE-SG 3.58Å; K41-C103 HydrophobicContact CG-CB 4.27Å; E42-C103 CarbonylContact O-C 3.6Å; E42-C103 VanDerWaalsContact O-CA 3.23Å; E42-C103 WeakPolarHBondContact O-CA 3.47Å; C43-C103 HydrophobicContact CB-CB 4.03Å; C43-C103 WeakPolarHBondContact CB-SG 3.46Å; C43-C103 WeakPolarHBondContact SG-CB 3.39Å; C43-C103 CovalentContact SG-SG 2.04Å; C43-C103 PolarHBondContact SG-SG 2.77Å; F70-C103 WeakPolarHBondContact CA-O 3.43Å; S71-C103 PolarHBondContact N-O 2.76Å; S71-C103 PolarHBondContact O-N 3.2Å
104	F	97.8	Very high	93.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124	171.9	-60.6	-81.5	0	0	0	109	F34 L36 K41 E42 F44 Y58 V68 F70 F102 I116 F118	F34-F104 AromaticContact CE1-CD2 3.85Å; F34-F104 HydrophobicContact CE1-CD2 3.85Å; F34-F104 HydrophobicContact CE1-CE2 4.16Å; F34-F104 HydrophobicContact CE1-CG 4.39Å; F34-F104 HydrophobicContact CZ-CB 4.08Å; F34-F104 AromaticContact CZ-CD2 3.74Å; F34-F104 HydrophobicContact CZ-CD2 3.74Å; F34-F104 HydrophobicContact CZ-CE2 4.5Å; F34-F104 HydrophobicContact CZ-CG 4.09Å; L36-F104 HydrophobicContact CD2-CB 3.85Å; K41-F104 CarbonylContact C-O 3.55Å; K41-F104 VanDerWaalsContact CA-O 3.31Å; K41-F104 WeakPolarHBondContact CA-O 3.37Å; E42-F104 PolarHBondContact N-O 2.63Å; E42-F104 PolarHBondContact O-N 3.29Å; F44-F104 HydrophobicContact CD2-CD2 4.31Å; F44-F104 HydrophobicContact CD2-CE2 4.38Å; F44-F104 HydrophobicContact CE2-CD2 4.13Å; F44-F104 HydrophobicContact CE2-CE2 4.4Å; Y58-F104 HydrophobicContact CD1-CE1 4.32Å; Y58-F104 HydrophobicContact CD2-CE1 4.02Å; Y58-F104 AromaticContact CG-CE1 3.74Å; Y58-F104 HydrophobicContact CG-CE1 3.74Å; Y58-F104 HydrophobicContact CG-CZ 4.42Å; V68-F104 HydrophobicContact CG1-CD1 4.39Å; V68-F104 HydrophobicContact CG2-CB 4.1Å; V68-F104 HydrophobicContact CG2-CD1 4.38Å; F70-F104 AromaticContact CD2-CD1 3.95Å; F70-F104 HydrophobicContact CD2-CD1 3.95Å; F70-F104 AromaticContact CD2-CE1 3.58Å; F70-F104 HydrophobicContact CD2-CE1 3.58Å; F70-F104 HydrophobicContact CD2-CZ 4.02Å; F70-F104 HydrophobicContact CE2-CE1 4.13Å; F70-F104 HydrophobicContact CE2-CZ 4.11Å; F102-F104 HydrophobicContact CD2-CE2 4.12Å; F104-I116 HydrophobicContact CB-CD1 3.84Å; F104-I116 HydrophobicContact CD1-CD1 4.06Å; F104-I116 HydrophobicContact CD1-CG2 4.02Å; F104-I116 HydrophobicContact CE1-CG2 3.92Å; F104-I116 HydrophobicContact CG-CD1 4.06Å; F104-I116 HydrophobicContact CG-CG2 4.5Å; F104-I116 HydrophobicContact CZ-CG2 4.3Å; F104-F118 HydrophobicContact CE2-CB 4.43Å; F104-F118 AromaticContact CE2-CD1 3.84Å; F104-F118 HydrophobicContact CE2-CD1 3.84Å; F104-F118 HydrophobicContact CE2-CE1 4.28Å; F104-F118 HydrophobicContact CE2-CG 4.13Å; F104-F118 HydrophobicContact CZ-CB 3.87Å; F104-F118 HydrophobicContact CZ-CD1 4.11Å; F104-F118 HydrophobicContact CZ-CG 4.06Å
105	D	97.3	Very high	93.1	Very high	32 Å²	32	47.7 Å²	47.7	17%	0.171	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	118.9	-174.4	-168.3	-16.3	0	0	0	110.8	K41 V68 D69 S107 F108	K41-D105 HydrophobicContact CB-CB 4.22Å; K41-D105 HydrophobicContact CD-CB 4.11Å; K41-D105 HydrophobicContact CG-CB 3.95Å; V68-D105 WeakPolarHBondContact CG2-O 3.37Å; D69-D105 HydrophobicContact CB-CB 4Å; D69-D105 PolarHBondContact N-O 2.94Å; D69-D105 PolarHBondContact O-N 2.93Å; D105-S107 WeakPolarHBondContact OD1-CA 3.31Å; D105-S107 WeakPolarHBondContact OD1-CB 3.46Å; D105-S107 PolarHBondContact OD1-N 2.93Å; D105-S107 PolarHBondContact OD1-OG 2.88Å; D105-F108 WeakPolarHBondContact O-CE1 3.37Å
106	N	95.7	Very high	93.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.272	C	S	.	.			trans	-118.1	26.1	174.3	-171.8	40.7	0	0	0	110.9	L36 P37 G39 R40 F108 S109 S112 K114	L36-N106 HydrophobicContact CD2-CB 3.5Å; L36-N106 HydrophobicContact CG-CB 3.73Å; P37-N106 PolarHBondContact O-ND2 2.78Å; G39-N106 PolarHBondContact N-O 2.81Å; R40-N106 CarbonylContact O-C 3.55Å; R40-N106 WeakPolarHBondContact O-CA 3.29Å; R40-N106 PolarHBondContact O-N 2.77Å; N106-F108 PolarHBondContact O-N 2.85Å; N106-S109 PolarHBondContact O-N 2.89Å; N106-S109 WeakPolarHBondContact OD1-CB 3.39Å; N106-S109 PolarHBondContact OD1-OG 3.46Å; N106-S112 PolarHBondContact ND2-O 2.88Å; N106-S112 VanDerWaalsContact ND2-O 3.07Å; N106-K114 HydrophobicContact CB-CG 4.43Å; N106-K114 WeakPolarHBondContact OD1-CG 3.31Å; N106-K114 PolarHBondContact OD1-NZ 2.81Å
107	S	94.1	Very high	93.4	Very high	70 Å²	70	43.2 Å²	43.2	49%	0.49	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-26	177.3	60.3	0	0	0	0	112.9	D105	D105-S107 WeakPolarHBondContact OD1-CA 3.31Å; D105-S107 WeakPolarHBondContact OD1-CB 3.46Å; D105-S107 PolarHBondContact OD1-N 2.93Å; D105-S107 PolarHBondContact OD1-OG 2.88Å
108	F	92.4	Very high	93.6	Very high	63 Å²	63	37.4 Å²	37.4	28%	0.276	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-22.4	178.8	65.6	-93.7	0	0	0	113.6	D67 D105 N106	D67-F108 HydrophobicContact CB-CZ 4.45Å; D67-F108 WeakPolarHBondContact O-CZ 3.38Å; D67-F108 WeakPolarHBondContact OD1-CE2 3.34Å; D67-F108 WeakPolarHBondContact OD2-CE2 3.28Å; D105-F108 WeakPolarHBondContact O-CE1 3.37Å; N106-F108 PolarHBondContact O-N 2.85Å
109	S	89.3	Confident	93.5	Very high	12 Å²	12	37 Å²	37	8%	0.084	21%	0.214	C	C	.	.			trans	-90	111.6	177	-61.2	0	0	0	0	110.1	S38 G39 N106 K114	S38-S109 CarbonylContact C-O 3.58Å; S38-S109 WeakPolarHBondContact CA-O 3.44Å; S38-S109 WeakPolarHBondContact CB-O 3.39Å; G39-S109 PolarHBondContact N-O 3.12Å; N106-S109 PolarHBondContact O-N 2.89Å; N106-S109 WeakPolarHBondContact OD1-CB 3.39Å; N106-S109 PolarHBondContact OD1-OG 3.46Å; S109-K114 PolarHBondContact OG-NZ 3.14Å
110	A	84.8	Confident	93.3	Very high	90 Å²	90	33.3 Å²	33.3	74%	0.744	19%	0.194	S	C	*	.	S	Bend	trans	-78	-20.1	-178.8	0	0	0	0	0	114
111	V	87.3	Confident	92.9	Very high	135 Å²	135	33.8 Å²	33.8	82%	0.818	20%	0.197	S	C	*	.	S	Bend	trans	-128.4	-41.6	-168	-176.7	0	0	0	0	112.6
112	S	90.2	Very high	92.5	Very high	33 Å²	33	31.7 Å²	31.7	23%	0.231	19%	0.187	C	C	.	.			trans	-91.2	131.5	-175.1	47	0	0	0	0	112.6	A64 N106	A64-S112 VanDerWaalsContact CB-OG 3.25Å; A64-S112 WeakPolarHBondContact CB-OG 3.25Å; N106-S112 PolarHBondContact ND2-O 2.88Å; N106-S112 VanDerWaalsContact ND2-O 3.07Å
113	E	93.3	Very high	91.7	Very high	114 Å²	114	35.8 Å²	35.8	53%	0.533	21%	0.209	S	C	.	.			trans	-74.9	161.1	161.2	65.4	-172	-178.9	0	0	110.6	T35 L36 G63	T35-E113 HydrophobicContact CG2-CB 4.16Å; T35-E113 HydrophobicContact CG2-CG 4.11Å; L36-E113 WeakPolarHBondContact O-CA 3.38Å; G63-E113 WeakPolarHBondContact CA-O 3.43Å
114	K	93.8	Very high	90.4	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	141.2	177.9	-64.1	-69.7	-171.1	-60	0	109.1	T35 L36 V60 D62 G63 D67 N106 S109 I116	T35-K114 CarbonylContact C-O 3.54Å; T35-K114 WeakPolarHBondContact CA-O 3.46Å; L36-K114 HydrophobicContact CB-CB 4.42Å; L36-K114 PolarHBondContact N-O 3.32Å; L36-K114 PolarHBondContact O-N 2.65Å; V60-K114 HydrophobicContact CG1-CD 4.11Å; D62-K114 WeakPolarHBondContact O-CA 3.12Å; G63-K114 WeakPolarHBondContact O-CD 3.47Å; G63-K114 WeakPolarHBondContact O-CE 3.4Å; D67-K114 WeakPolarHBondContact O-CE 3.49Å; D67-K114 WeakPolarHBondContact OD1-CE 3.14Å; D67-K114 IonicContact OD1-NZ 3.73Å; N106-K114 HydrophobicContact CB-CG 4.43Å; N106-K114 WeakPolarHBondContact OD1-CG 3.31Å; N106-K114 PolarHBondContact OD1-NZ 2.81Å; S109-K114 PolarHBondContact OG-NZ 3.14Å; K114-I116 HydrophobicContact CB-CD1 4.48Å; K114-I116 HydrophobicContact CB-CG1 4.28Å
115	I	92.4	Very high	88.8	Confident	50 Å²	50	44.2 Å²	44.2	26%	0.256	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	118.8	169.8	-56.9	-178.9	0	0	0	107.2	T33 L61 D62	T33-I115 HydrophobicContact CG2-CG2 3.73Å; L61-I115 HydrophobicContact CB-CB 4.44Å; L61-I115 HydrophobicContact CB-CG2 4.26Å; L61-I115 HydrophobicContact CD1-CG2 4.27Å; L61-I115 PolarHBondContact N-O 3.31Å; D62-I115 HydrophobicContact CB-CB 4.11Å; D62-I115 HydrophobicContact CB-CD1 3.99Å; D62-I115 HydrophobicContact CB-CG1 4.15Å; D62-I115 PolarHBondContact N-O 2.89Å; D62-I115 PolarHBondContact O-N 3.31Å
116	I	95	Very high	86.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	127.1	-174	-56.8	172.4	0	0	0	108.1	T33 F34 L36 V68 F104 K114	T33-I116 WeakPolarHBondContact CA-O 3.04Å; F34-I116 HydrophobicContact CD1-CB 4.28Å; F34-I116 HydrophobicContact CE1-CB 3.8Å; F34-I116 HydrophobicContact CE1-CD1 4.42Å; F34-I116 HydrophobicContact CE1-CG2 4.06Å; F34-I116 HydrophobicContact CZ-CB 4.31Å; F34-I116 HydrophobicContact CZ-CD1 4.11Å; F34-I116 PolarHBondContact N-O 2.85Å; F34-I116 PolarHBondContact O-N 2.76Å; L36-I116 HydrophobicContact CB-CD1 4.04Å; L36-I116 HydrophobicContact CD2-CD1 3.67Å; V68-I116 HydrophobicContact CB-CD1 4.33Å; V68-I116 HydrophobicContact CG2-CD1 3.8Å; F104-I116 HydrophobicContact CB-CD1 3.84Å; F104-I116 HydrophobicContact CD1-CD1 4.06Å; F104-I116 HydrophobicContact CD1-CG2 4.02Å; F104-I116 HydrophobicContact CE1-CG2 3.92Å; F104-I116 HydrophobicContact CG-CD1 4.06Å; F104-I116 HydrophobicContact CG-CG2 4.5Å; F104-I116 HydrophobicContact CZ-CG2 4.3Å; K114-I116 HydrophobicContact CB-CD1 4.48Å; K114-I116 HydrophobicContact CB-CG1 4.28Å
117	F	94.6	Very high	84.4	Confident	17 Å²	17	55.9 Å²	55.9	8%	0.075	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	134.8	165.5	172.3	-100.2	0	0	0	108.3	D31 F32 T33 Y58 Q59 L61 E119 T171	D31-F117 HydrophobicContact CB-CE2 3.85Å; D31-F117 HydrophobicContact CB-CZ 3.98Å; F32-F117 WeakPolarHBondContact O-CA 3.46Å; T33-F117 WeakPolarHBondContact OG1-CD2 3.41Å; Y58-F117 CarbonylContact C-O 3.55Å; Y58-F117 WeakPolarHBondContact CA-O 3.42Å; Q59-F117 PolarHBondContact N-O 3.12Å; Q59-F117 PolarHBondContact O-N 2.81Å; L61-F117 HydrophobicContact CD1-CB 3.83Å; L61-F117 HydrophobicContact CD2-CB 4.18Å; L61-F117 HydrophobicContact CG-CB 3.93Å; F117-E119 HydrophobicContact CE1-CB 4.38Å; F117-E119 HydrophobicContact CZ-CB 4.34Å; F117-T171 HydrophobicContact CZ-CG2 4Å
118	F	94.4	Very high	82	Confident	3 Å²	3	61.2 Å²	61.2	1%	0.013	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	150.4	168.9	71.3	-91.6	0	0	0	110.8	D31 F32 F34 F44 E57 F102 F104 L120	D31-F118 WeakPolarHBondContact CA-O 3.23Å; F32-F118 HydrophobicContact CB-CD1 4.42Å; F32-F118 HydrophobicContact CB-CE1 3.84Å; F32-F118 HydrophobicContact CB-CE2 4.21Å; F32-F118 HydrophobicContact CB-CZ 3.73Å; F32-F118 AromaticContact CD2-CE2 3.85Å; F32-F118 HydrophobicContact CD2-CE2 3.85Å; F32-F118 AromaticContact CD2-CZ 3.9Å; F32-F118 HydrophobicContact CD2-CZ 3.9Å; F32-F118 HydrophobicContact CG-CE2 4.48Å; F32-F118 HydrophobicContact CG-CZ 4.15Å; F32-F118 PolarHBondContact N-O 2.8Å; F32-F118 PolarHBondContact O-N 3.44Å; F34-F118 AromaticContact CD1-CD1 3.97Å; F34-F118 HydrophobicContact CD1-CD1 3.97Å; F34-F118 AromaticContact CD1-CE1 3.72Å; F34-F118 HydrophobicContact CD1-CE1 3.72Å; F34-F118 AromaticContact CE1-CD1 3.87Å; F34-F118 HydrophobicContact CE1-CD1 3.87Å; F34-F118 AromaticContact CE1-CE1 3.82Å; F34-F118 HydrophobicContact CE1-CE1 3.82Å; F44-F118 HydrophobicContact CD1-CZ 4.44Å; F44-F118 HydrophobicContact CD2-CE1 4.4Å; F44-F118 HydrophobicContact CD2-CZ 4.32Å; F44-F118 HydrophobicContact CE1-CZ 4.44Å; F44-F118 HydrophobicContact CE2-CE1 4.03Å; F44-F118 HydrophobicContact CE2-CZ 4.32Å; F44-F118 HydrophobicContact CG-CZ 4.39Å; F44-F118 HydrophobicContact CZ-CE1 4.15Å; F44-F118 HydrophobicContact CZ-CZ 4.38Å; E57-F118 CarbonylContact O-C 3.47Å; E57-F118 WeakPolarHBondContact O-CA 3.48Å; E57-F118 WeakPolarHBondContact O-CB 3.43Å; F102-F118 HydrophobicContact CE2-CD2 4.17Å; F102-F118 AromaticContact CE2-CE2 3.74Å; F102-F118 HydrophobicContact CE2-CE2 3.74Å; F102-F118 HydrophobicContact CE2-CZ 4.14Å; F102-F118 HydrophobicContact CZ-CE2 4.22Å; F104-F118 HydrophobicContact CE2-CB 4.43Å; F104-F118 AromaticContact CE2-CD1 3.84Å; F104-F118 HydrophobicContact CE2-CD1 3.84Å; F104-F118 HydrophobicContact CE2-CE1 4.28Å; F104-F118 HydrophobicContact CE2-CG 4.13Å; F104-F118 HydrophobicContact CZ-CB 3.87Å; F104-F118 HydrophobicContact CZ-CD1 4.11Å; F104-F118 HydrophobicContact CZ-CG 4.06Å; F118-L120 HydrophobicContact CD2-CG 4.18Å; F118-L120 HydrophobicContact CE2-CD1 4.13Å; F118-L120 HydrophobicContact CE2-CG 4.16Å
119	E	91.3	Very high	79.7	Confident	8 Å²	8	61.5 Å²	61.5	4%	0.037	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	135.7	178.7	-175.1	171.3	-167.9	0	0	108.7	D31 I56 E57 F117 I121	D31-E119 HydrophobicContact CB-CB 4.39Å; D31-E119 HydrophobicContact CB-CG 4.28Å; I56-E119 WeakPolarHBondContact CA-O 3.23Å; E57-E119 PolarHBondContact N-O 3.28Å; E57-E119 PolarHBondContact O-N 3.1Å; F117-E119 HydrophobicContact CE1-CB 4.38Å; F117-E119 HydrophobicContact CZ-CB 4.34Å; E119-I121 HydrophobicContact CG-CG1 4.22Å
120	L	91.3	Very high	77.4	Confident	5 Å²	5	67.9 Å²	67.9	3%	0.026	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	122.3	174	-61.7	170.1	0	0	0	108.3	S30 L54 E55 I56 F102 F118	S30-L120 PolarHBondContact N-O 3.46Å; S30-L120 PolarHBondContact O-N 2.71Å; L54-L120 HydrophobicContact CD1-CD2 4.34Å; E55-L120 WeakPolarHBondContact O-CA 3.15Å; I56-L120 HydrophobicContact CB-CD2 3.96Å; I56-L120 HydrophobicContact CD1-CD2 3.75Å; I56-L120 HydrophobicContact CG1-CD2 3.78Å; F102-L120 HydrophobicContact CE1-CD1 4.17Å; F102-L120 HydrophobicContact CE1-CD2 4.05Å; F102-L120 HydrophobicContact CE2-CD1 4.47Å; F102-L120 HydrophobicContact CE2-CD2 4.27Å; F102-L120 HydrophobicContact CZ-CD1 3.65Å; F102-L120 HydrophobicContact CZ-CD2 3.88Å; F102-L120 HydrophobicContact CZ-CG 4.3Å; F118-L120 HydrophobicContact CD2-CG 4.18Å; F118-L120 HydrophobicContact CE2-CD1 4.13Å; F118-L120 HydrophobicContact CE2-CG 4.16Å
121	I	87.4	Confident	75.2	Confident	15 Å²	15	71.9 Å²	71.9	8%	0.077	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	118.5	176.5	-57.3	171.6	0	0	0	106.6	D29 E55 E119 Q168	D29-I121 WeakPolarHBondContact OD1-CG1 3.49Å; D29-I121 WeakPolarHBondContact OD1-CG2 3.5Å; E55-I121 HydrophobicContact CB-CB 4.15Å; E55-I121 PolarHBondContact N-O 2.91Å; E55-I121 PolarHBondContact O-N 3.32Å; E119-I121 HydrophobicContact CG-CG1 4.22Å; I121-Q168 VanDerWaalsContact CD1-CD 3.47Å; I121-Q168 HydrophobicContact CD1-CG 4.23Å
122	M	87	Confident	73.2	Confident	14 Å²	14	71.1 Å²	71.1	7%	0.069	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	109.3	-177.5	-61.3	169.9	-71.8	0	0	109.1	M28 Q46 M48 L54 M125	M28-M122 HydrophobicContact CB-CE 4.04Å; M28-M122 WeakPolarHBondContact O-CE 3.18Å; Q46-M122 HydrophobicContact CG-SD 3.96Å; M48-M122 HydrophobicContact CE-CB 4.27Å; M48-M122 HydrophobicContact CE-CG 4.13Å; M48-M122 HydrophobicContact SD-CG 4.05Å; M48-M122 HydrophobicContact SD-SD 4.13Å; L54-M122 HydrophobicContact CD1-CG 4.22Å; M122-M125 HydrophobicContact CB-CE 4.38Å; M122-M125 HydrophobicContact CB-CG 4.08Å; M122-M125 HydrophobicContact CG-CE 4.36Å; M122-M125 HydrophobicContact SD-CE 3.52Å; M122-M125 VanDerWaalsContact SD-CE 3.52Å
123	D	79.4	Confident	71.1	Confident	89 Å²	89	76.1 Å²	76.1	48%	0.476	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	147.8	177.5	-84.6	-21	0	0	0	110.7	A52 S53 M125	A52-D123 WeakPolarHBondContact CB-O 3.44Å; S53-D123 PolarHBondContact N-O 2.66Å; S53-D123 PolarHBondContact O-N 3.07Å; D123-M125 VanDerWaalsContact C-N 3.29Å; D123-M125 PolarHBondContact O-N 3.22Å
124	N	68.8	Low	68.9	Low	129 Å²	129	75.3 Å²	75.3	69%	0.69	39%	0.393	S	S	*	.	S	Bend	trans	62.7	23.2	-179.2	-61.9	-16.8	0	0	0	115.9	A52 E126	A52-N124 HydrophobicContact CB-CB 4.5Å; N124-E126 VanDerWaalsContact C-N 3.31Å; N124-E126 PolarHBondContact O-N 3.48Å
125	M	64.5	Low	66.8	Low	50 Å²	50	82.3 Å²	82.3	25%	0.246	42%	0.42	C	S	.	.			trans	-75.3	85.7	165.8	-71.7	-98.9	-106.1	0	0	109.1	M48 M122 D123 Q127	M48-M125 HydrophobicContact CE-CE 4.21Å; M48-M125 HydrophobicContact CE-CG 4.18Å; M48-M125 HydrophobicContact CE-SD 4.06Å; M48-M125 HydrophobicContact SD-CE 3.72Å; M48-M125 HydrophobicContact SD-SD 4.18Å; M122-M125 HydrophobicContact CB-CE 4.38Å; M122-M125 HydrophobicContact CB-CG 4.08Å; M122-M125 HydrophobicContact CG-CE 4.36Å; M122-M125 HydrophobicContact SD-CE 3.52Å; M122-M125 VanDerWaalsContact SD-CE 3.52Å; D123-M125 VanDerWaalsContact C-N 3.29Å; D123-M125 PolarHBondContact O-N 3.22Å; M125-Q127 PolarHBondContact O-N 3.25Å
126	E	54.6	Low	64.7	Low	167 Å²	167	88.5 Å²	88.5	78%	0.78	45%	0.445	S	S	*	.			trans	-59.5	110.2	170.5	-72.1	-178.2	164.9	0	0	108.8	K49 N124 E128	K49-E126 PolarHBondContact NZ-O 3.05Å; N124-E126 VanDerWaalsContact C-N 3.31Å; N124-E126 PolarHBondContact O-N 3.48Å; E126-E128 PolarHBondContact O-N 2.98Å
127	Q	46.3	Very low	62.6	Low	110 Å²	110	95.5 Å²	95.5	51%	0.514	48%	0.478	S	S	.	.			trans	-61.3	119.2	174.5	-84.3	-175.7	5.8	0	0	109.1	M125 G129	M125-Q127 PolarHBondContact O-N 3.25Å; Q127-G129 PolarHBondContact O-N 3.02Å
128	E	44.2	Very low	60.5	Low	181 Å²	181	105 Å²	105	85%	0.846	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	80	156.5	-81.7	166.7	-138	0	0	107.7	K49 E126	K49-E128 IonicContact NZ-OE1 2.91Å; K49-E128 PolarHBondContact NZ-OE1 3.42Å; E126-E128 PolarHBondContact O-N 2.98Å
129	G	43.3	Very low	58.4	Low	70 Å²	70	108.6 Å²	108.6	72%	0.722	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	168.7	-25.4	-178.9	0	0	0	0	0	115.4	Q127 E131	Q127-G129 PolarHBondContact O-N 3.02Å; G129-E131 PolarHBondContact O-N 2.91Å
130	E	41.4	Very low	56.3	Low	146 Å²	146	117.2 Å²	117.2	68%	0.682	57%	0.573	S	S	*	*	S	Bend	trans	-87	106.2	159.8	-103.6	176.4	163.7	0	0	106.1	P132	E130-P132 WeakPolarHBondContact O-CD 3.44Å; E130-P132 VanDerWaalsContact O-N 3.08Å
131	E	39.3	Very low	54.3	Low	174 Å²	174	120.2 Å²	120.2	81%	0.813	60%	0.604	S	S	*	*			trans	-45.6	123	159	-74.8	-170.8	151	0	0	106.2	G129 E133	G129-E131 PolarHBondContact O-N 2.91Å; E131-E133 VanDerWaalsContact C-N 3.28Å; E131-E133 WeakPolarHBondContact O-CA 3.43Å; E131-E133 PolarHBondContact O-N 3.24Å
132	P	44	Very low	52.5	Low	119 Å²	119	123.1 Å²	123.1	77%	0.773	62%	0.623	S	S	*	*			trans	-57.6	108.1	172.6	23.6	-30	0	0	0	104.1	E130 D134	E130-P132 WeakPolarHBondContact O-CD 3.44Å; E130-P132 VanDerWaalsContact O-N 3.08Å; P132-D134 VanDerWaalsContact C-N 3.32Å; P132-D134 WeakPolarHBondContact O-CA 3.23Å; P132-D134 PolarHBondContact O-N 2.87Å
133	E	47.5	Very low	51	Low	138 Å²	138	129.8 Å²	129.8	65%	0.645	66%	0.659	S	S	*	*			trans	-62.9	102.7	-164.5	-137	-158.3	-176.3	0	0	105.6	E131 W135	E131-E133 VanDerWaalsContact C-N 3.28Å; E131-E133 WeakPolarHBondContact O-CA 3.43Å; E131-E133 PolarHBondContact O-N 3.24Å; E133-W135 HydrophobicContact CB-CZ2 3.78Å; E133-W135 VanDerWaalsContact CD-NE1 3.25Å; E133-W135 PolarHBondContact O-N 3.08Å; E133-W135 PolarHBondContact OE2-NE1 3.48Å
134	D	46.8	Very low	49.7	Very low	96 Å²	96	134 Å²	134	51%	0.513	68%	0.678	S	S	.	*			trans	-79.3	55.2	-162.8	-168.2	8.3	0	0	0	110.1	P132 K136 E137	P132-D134 VanDerWaalsContact C-N 3.32Å; P132-D134 WeakPolarHBondContact O-CA 3.23Å; P132-D134 PolarHBondContact O-N 2.87Å; D134-K136 PolarHBondContact O-N 3.39Å; D134-E137 WeakPolarHBondContact OD1-CB 3.32Å; D134-E137 PolarHBondContact OD1-N 2.87Å; D134-E137 VanDerWaalsContact OD1-N 3.12Å
135	W	49	Very low	48.9	Very low	148 Å²	148	132.6 Å²	132.6	56%	0.561	67%	0.67	S	S	*	*			trans	-69.2	-18.4	168	-15	-64	0	0	0	110.6	E133 E137 Y138	E133-W135 HydrophobicContact CB-CZ2 3.78Å; E133-W135 VanDerWaalsContact CD-NE1 3.25Å; E133-W135 PolarHBondContact O-N 3.08Å; E133-W135 PolarHBondContact OE2-NE1 3.48Å; W135-E137 VanDerWaalsContact C-N 3.3Å; W135-E137 PolarHBondContact O-N 3.15Å; W135-Y138 PolarHBondContact O-N 3.42Å; W135-Y138 VanDerWaalsContact O-N 3.08Å
136	K	49.4	Very low	48.5	Very low	179 Å²	179	134.1 Å²	134.1	78%	0.778	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-68	-32.7	-176.5	-149.7	173.3	-174	174.3	0	111.1	D134 Y138 I139	D134-K136 PolarHBondContact O-N 3.39Å; K136-Y138 PolarHBondContact O-N 3.2Å; K136-I139 PolarHBondContact O-N 3.16Å
137	E	50.3	Low	48.6	Very low	148 Å²	148	133.1 Å²	133.1	69%	0.692	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-68.4	-21.1	172.3	-166.8	163.5	-153.3	0	0	113.1	D134 W135	D134-E137 WeakPolarHBondContact OD1-CB 3.32Å; D134-E137 PolarHBondContact OD1-N 2.87Å; D134-E137 VanDerWaalsContact OD1-N 3.12Å; W135-E137 VanDerWaalsContact C-N 3.3Å; W135-E137 PolarHBondContact O-N 3.15Å
138	Y	50.1	Low	49.2	Very low	216 Å²	216	135.1 Å²	135.1	85%	0.847	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-87.8	-8.4	179	-102.9	-87.9	0	0	0	115.5	W135 K136	W135-Y138 PolarHBondContact O-N 3.42Å; W135-Y138 VanDerWaalsContact O-N 3.08Å; K136-Y138 PolarHBondContact O-N 3.2Å
139	I	50.1	Low	49.9	Very low	79 Å²	79	129.4 Å²	129.4	41%	0.405	66%	0.658	S	S	.	*			trans	-111.1	19.2	-172.4	-57.1	-174.2	0	0	0	112.8	K136 G141	K136-I139 PolarHBondContact O-N 3.16Å; I139-G141 VanDerWaalsContact C-N 3.3Å; I139-G141 PolarHBondContact O-N 3Å
140	H	47.5	Very low	50.9	Low	189 Å²	189	132 Å²	132	88%	0.875	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	82.9	166.3	-98.8	-74.5	0	0	0	111
141	G	49.4	Very low	52.3	Low	67 Å²	67	130.4 Å²	130.4	69%	0.691	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-167.2	-19.9	177.1	0	0	0	0	0	119.2	I139	I139-G141 VanDerWaalsContact C-N 3.3Å; I139-G141 PolarHBondContact O-N 3Å
142	T	50.4	Low	53.8	Low	77 Å²	77	126.9 Å²	126.9	47%	0.472	63%	0.634	S	S	.	*			trans	-145.1	90.7	-173.2	57	0	0	0	0	113.6	M144 L145	T142-M144 PolarHBondContact O-N 2.77Å; T142-L145 PolarHBondContact O-N 3.47Å; T142-L145 WeakPolarHBondContact OG1-CB 3.38Å
143	D	55.2	Low	55	Low	154 Å²	154	125.7 Å²	125.7	82%	0.824	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-15.9	-177.7	-152.5	32.9	0	0	0	114.9
144	M	51.3	Low	56.3	Low	178 Å²	178	123.9 Å²	123.9	88%	0.877	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-9.5	178.1	-74.8	-84.3	-175.5	0	0	114.2	T142	T142-M144 PolarHBondContact O-N 2.77Å
145	L	53.1	Low	57.6	Low	98 Å²	98	123.3 Å²	123.3	51%	0.513	61%	0.613	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.2	-29.8	-179.6	-153.2	74	0	0	0	111.8	T142 M147 K148 L149	T142-L145 PolarHBondContact O-N 3.47Å; T142-L145 WeakPolarHBondContact OG1-CB 3.38Å; L145-M147 PolarHBondContact O-N 3.27Å; L145-K148 PolarHBondContact O-N 3.26Å; L145-L149 HydrophobicContact CD2-CD1 4.22Å; L145-L149 HydrophobicContact CG-CD1 3.86Å; L145-L149 VanDerWaalsContact O-CD1 3.31Å; L145-L149 WeakPolarHBondContact O-CD1 3.38Å; L145-L149 PolarHBondContact O-N 3.43Å; L145-L149 VanDerWaalsContact O-N 3.12Å
146	D	54.5	Low	58.7	Low	83 Å²	83	121 Å²	121	44%	0.444	61%	0.611	S	S	.	*	H	α-helix	trans	-57.4	-46.7	177.4	-97.1	-12.1	0	0	0	112.3	K148 L149 E150	D146-K148 PolarHBondContact O-N 3.44Å; D146-K148 VanDerWaalsContact O-N 3.14Å; D146-L149 PolarHBondContact O-N 3.35Å; D146-E150 PolarHBondContact O-N 3.49Å
147	M	57	Low	59.7	Low	146 Å²	146	117 Å²	117	72%	0.719	60%	0.598	S	S	*	*	H	α-helix	trans	-64.1	-25.1	-176.5	-146.4	-176.2	84.7	0	0	113.4	L145	L145-M147 PolarHBondContact O-N 3.27Å
148	K	58.8	Low	60.8	Low	151 Å²	151	112.3 Å²	112.3	66%	0.657	58%	0.582	S	S	*	*	H	α-helix	trans	-89.7	-25	174.8	-72.5	-161.1	174.4	-159.3	0	113	L145 D146 I152	L145-K148 PolarHBondContact O-N 3.26Å; D146-K148 PolarHBondContact O-N 3.44Å; D146-K148 VanDerWaalsContact O-N 3.14Å; K148-I152 WeakPolarHBondContact O-CD1 3.3Å; K148-I152 VanDerWaalsContact O-CG1 3.28Å; K148-I152 WeakPolarHBondContact O-CG1 3.43Å
149	L	58.6	Low	61.9	Low	61 Å²	61	105.5 Å²	105.5	32%	0.319	56%	0.562	S	S	.	*	H	α-helix	trans	-74.2	-37.2	173.8	-101	88	0	0	0	111.3	L145 D146 I152 M153	L145-L149 HydrophobicContact CD2-CD1 4.22Å; L145-L149 HydrophobicContact CG-CD1 3.86Å; L145-L149 VanDerWaalsContact O-CD1 3.31Å; L145-L149 WeakPolarHBondContact O-CD1 3.38Å; L145-L149 PolarHBondContact O-N 3.43Å; L145-L149 VanDerWaalsContact O-N 3.12Å; D146-L149 PolarHBondContact O-N 3.35Å; L149-I152 PolarHBondContact O-N 2.96Å; L149-I152 VanDerWaalsContact O-N 3.13Å; L149-M153 WeakPolarHBondContact O-CG 3.32Å; L149-M153 PolarHBondContact O-N 3.43Å
150	E	66.1	Low	62.8	Low	126 Å²	126	106.4 Å²	106.4	59%	0.589	56%	0.563	S	S	*	*	H	α-helix	trans	-63.4	-43.6	180	-151.6	156.5	-155.7	0	0	111.4	D146 I152 M153 D154	D146-E150 PolarHBondContact O-N 3.49Å; E150-I152 VanDerWaalsContact C-N 3.29Å; E150-I152 PolarHBondContact O-N 3.04Å; E150-M153 PolarHBondContact O-N 3.09Å; E150-D154 PolarHBondContact O-N 3.39Å
151	D	69.7	Low	63.8	Low	112 Å²	112	100 Å²	100	60%	0.599	54%	0.544	S	S	*	.	H	α-helix	trans	-59.4	-36.5	172.2	-101.5	-11.7	0	0	0	112.8	T155	D151-T155 WeakPolarHBondContact O-CB 3.18Å; D151-T155 PolarHBondContact O-N 2.99Å; D151-T155 VanDerWaalsContact O-N 3.11Å; D151-T155 PolarHBondContact O-OG1 3.24Å
152	I	71.8	Confident	64.8	Low	100 Å²	100	105.6 Å²	105.6	51%	0.513	54%	0.544	S	S	.	.	H	α-helix	trans	-73.5	-41.2	178.4	-68.3	168.5	0	0	0	110.3	K148 L149 E150 T155 I156	K148-I152 WeakPolarHBondContact O-CD1 3.3Å; K148-I152 VanDerWaalsContact O-CG1 3.28Å; K148-I152 WeakPolarHBondContact O-CG1 3.43Å; L149-I152 PolarHBondContact O-N 2.96Å; L149-I152 VanDerWaalsContact O-N 3.13Å; E150-I152 VanDerWaalsContact C-N 3.29Å; E150-I152 PolarHBondContact O-N 3.04Å; I152-T155 PolarHBondContact O-N 3.4Å; I152-I156 HydrophobicContact CG2-CD1 3.79Å; I152-I156 HydrophobicContact CG2-CG1 4.42Å; I152-I156 VanDerWaalsContact O-CG1 3.3Å; I152-I156 WeakPolarHBondContact O-CG1 3.43Å; I152-I156 PolarHBondContact O-N 3.18Å
153	M	68.1	Low	65.7	Low	94 Å²	94	107.4 Å²	107.4	46%	0.463	55%	0.55	S	S	.	*	H	α-helix	trans	-60.7	-46.2	175.2	-75.2	-178.2	172.7	0	0	111.2	L149 E150 T155 I156 N157	L149-M153 WeakPolarHBondContact O-CG 3.32Å; L149-M153 PolarHBondContact O-N 3.43Å; E150-M153 PolarHBondContact O-N 3.09Å; M153-T155 VanDerWaalsContact C-N 3.29Å; M153-T155 PolarHBondContact O-N 3.11Å; M153-I156 PolarHBondContact O-N 2.99Å; M153-N157 WeakPolarHBondContact O-CB 3.2Å; M153-N157 VanDerWaalsContact O-CG 3.26Å; M153-N157 PolarHBondContact O-N 3.34Å; M153-N157 PolarHBondContact O-ND2 3.43Å
154	D	74.7	Confident	66.6	Low	100 Å²	100	101.5 Å²	101.5	54%	0.535	53%	0.525	S	S	.	.	H	α-helix	trans	-60.6	-40.9	176.4	-83	-5.6	0	0	0	111.8	E150 S158	E150-D154 PolarHBondContact O-N 3.39Å; D154-S158 VanDerWaalsContact O-CB 3.31Å; D154-S158 WeakPolarHBondContact O-CB 3.43Å; D154-S158 PolarHBondContact O-N 2.93Å; D154-S158 PolarHBondContact O-OG 3.27Å
155	T	73.8	Confident	67.4	Low	83 Å²	83	99.6 Å²	99.6	51%	0.509	51%	0.512	S	S	.	.	H	α-helix	trans	-65.3	-45.1	177.5	-55	0	0	0	0	111.3	D151 I152 M153 S158 V159	D151-T155 WeakPolarHBondContact O-CB 3.18Å; D151-T155 PolarHBondContact O-N 2.99Å; D151-T155 VanDerWaalsContact O-N 3.11Å; D151-T155 PolarHBondContact O-OG1 3.24Å; I152-T155 PolarHBondContact O-N 3.4Å; M153-T155 VanDerWaalsContact C-N 3.29Å; M153-T155 PolarHBondContact O-N 3.11Å; T155-S158 PolarHBondContact O-N 3.47Å; T155-S158 PolarHBondContact O-OG 3.06Å; T155-V159 VanDerWaalsContact O-CG2 3.32Å; T155-V159 WeakPolarHBondContact O-CG2 3.38Å; T155-V159 PolarHBondContact O-N 3.46Å
156	I	72.8	Confident	68.2	Low	99 Å²	99	97.7 Å²	97.7	51%	0.508	51%	0.507	S	S	.	.	H	α-helix	trans	-63.2	-45.6	178.4	-71.1	169.6	0	0	0	111	I152 M153 S158 V159 K160	I152-I156 HydrophobicContact CG2-CD1 3.79Å; I152-I156 HydrophobicContact CG2-CG1 4.42Å; I152-I156 VanDerWaalsContact O-CG1 3.3Å; I152-I156 WeakPolarHBondContact O-CG1 3.43Å; I152-I156 PolarHBondContact O-N 3.18Å; M153-I156 PolarHBondContact O-N 2.99Å; I156-S158 VanDerWaalsContact C-N 3.31Å; I156-S158 PolarHBondContact O-N 2.92Å; I156-V159 PolarHBondContact O-N 3.25Å; I156-K160 WeakPolarHBondContact O-CB 3.47Å; I156-K160 PolarHBondContact O-N 3.47Å
157	N	71.1	Confident	69.3	Low	95 Å²	95	98.4 Å²	98.4	51%	0.508	51%	0.51	S	S	.	.	H	α-helix	trans	-61.2	-41.9	177.1	-73.2	-27.5	0	0	0	111.2	M153 V159 K160 A161	M153-N157 WeakPolarHBondContact O-CB 3.2Å; M153-N157 VanDerWaalsContact O-CG 3.26Å; M153-N157 PolarHBondContact O-N 3.34Å; M153-N157 PolarHBondContact O-ND2 3.43Å; N157-V159 VanDerWaalsContact C-N 3.34Å; N157-V159 PolarHBondContact O-N 2.95Å; N157-K160 PolarHBondContact O-N 3.18Å; N157-A161 WeakPolarHBondContact O-CB 3.46Å; N157-A161 PolarHBondContact O-N 3.11Å
158	S	72.3	Confident	69.9	Low	51 Å²	51	93.6 Å²	93.6	36%	0.357	49%	0.486	S	S	.	.	H	α-helix	trans	-65.6	-35.1	177.1	82.1	0	0	0	0	113	D154 T155 I156 R162	D154-S158 VanDerWaalsContact O-CB 3.31Å; D154-S158 WeakPolarHBondContact O-CB 3.43Å; D154-S158 PolarHBondContact O-N 2.93Å; D154-S158 PolarHBondContact O-OG 3.27Å; T155-S158 PolarHBondContact O-N 3.47Å; T155-S158 PolarHBondContact O-OG 3.06Å; I156-S158 VanDerWaalsContact C-N 3.31Å; I156-S158 PolarHBondContact O-N 2.92Å; S158-R162 WeakPolarHBondContact O-CD 3.4Å; S158-R162 WeakPolarHBondContact O-CG 3.21Å; S158-R162 PolarHBondContact O-N 3.33Å; S158-R162 VanDerWaalsContact O-N 3.16Å
159	V	74.6	Confident	70.6	Confident	72 Å²	72	91 Å²	91	44%	0.436	48%	0.479	S	S	.	.	H	α-helix	trans	-74.4	-42.4	177.8	171.3	0	0	0	0	110.6	T155 I156 N157 A161 R162 L163	T155-V159 VanDerWaalsContact O-CG2 3.32Å; T155-V159 WeakPolarHBondContact O-CG2 3.38Å; T155-V159 PolarHBondContact O-N 3.46Å; I156-V159 PolarHBondContact O-N 3.25Å; N157-V159 VanDerWaalsContact C-N 3.34Å; N157-V159 PolarHBondContact O-N 2.95Å; V159-A161 VanDerWaalsContact C-N 3.35Å; V159-A161 PolarHBondContact O-N 3.44Å; V159-R162 PolarHBondContact O-N 3.43Å; V159-R162 VanDerWaalsContact O-N 3.15Å; V159-L163 HydrophobicContact CG1-CD1 3.86Å; V159-L163 HydrophobicContact CG1-CG 4.36Å; V159-L163 WeakPolarHBondContact O-CG 3.47Å; V159-L163 PolarHBondContact O-N 2.97Å
160	K	68.6	Low	71.4	Confident	98 Å²	98	92.8 Å²	92.8	43%	0.426	49%	0.485	S	S	.	.	H	α-helix	trans	-59.5	-45.7	175.5	-173.9	177.1	169.8	-172.3	0	111	S25 I156 N157 R162 L163 G164	S25-K160 PolarHBondContact OG-NZ 3.05Å; I156-K160 WeakPolarHBondContact O-CB 3.47Å; I156-K160 PolarHBondContact O-N 3.47Å; N157-K160 PolarHBondContact O-N 3.18Å; K160-R162 VanDerWaalsContact C-N 3.32Å; K160-R162 PolarHBondContact O-N 2.92Å; K160-L163 PolarHBondContact O-N 2.71Å; K160-G164 PolarHBondContact O-N 3.39Å
161	A	67.9	Low	71.8	Confident	56 Å²	56	88.8 Å²	88.8	46%	0.463	47%	0.469	S	S	.	.	H	α-helix	trans	-61.6	-38	174.9	0	0	0	0	0	112.7	N157 V159 K165	N157-A161 WeakPolarHBondContact O-CB 3.46Å; N157-A161 PolarHBondContact O-N 3.11Å; V159-A161 VanDerWaalsContact C-N 3.35Å; V159-A161 PolarHBondContact O-N 3.44Å; A161-K165 VanDerWaalsContact O-CG 3.32Å; A161-K165 WeakPolarHBondContact O-CG 3.48Å; A161-K165 PolarHBondContact O-N 2.73Å
162	R	69.7	Low	72.1	Confident	184 Å²	184	85.5 Å²	85.5	69%	0.694	45%	0.451	S	S	*	.	H	α-helix	trans	-70	-37.5	176.1	-72.6	167	-172.4	-100.1	2.3	112.5	S158 V159 K160 S166	S158-R162 WeakPolarHBondContact O-CD 3.4Å; S158-R162 WeakPolarHBondContact O-CG 3.21Å; S158-R162 PolarHBondContact O-N 3.33Å; S158-R162 VanDerWaalsContact O-N 3.16Å; V159-R162 PolarHBondContact O-N 3.43Å; V159-R162 VanDerWaalsContact O-N 3.15Å; K160-R162 VanDerWaalsContact C-N 3.32Å; K160-R162 PolarHBondContact O-N 2.92Å; R162-S166 PolarHBondContact O-N 2.95Å; R162-S166 VanDerWaalsContact O-N 3.08Å
163	L	70.8	Confident	72.3	Confident	115 Å²	115	85.7 Å²	85.7	60%	0.602	45%	0.453	S	S	*	.	H	α-helix	trans	-70.5	-42.5	178.1	-75.6	169.2	0	0	0	111.8	V159 K160 K165 S166 L167	V159-L163 HydrophobicContact CG1-CD1 3.86Å; V159-L163 HydrophobicContact CG1-CG 4.36Å; V159-L163 WeakPolarHBondContact O-CG 3.47Å; V159-L163 PolarHBondContact O-N 2.97Å; K160-L163 PolarHBondContact O-N 2.71Å; L163-K165 PolarHBondContact O-N 3.32Å; L163-S166 PolarHBondContact O-N 2.93Å; L163-S166 VanDerWaalsContact O-N 3.11Å; L163-L167 PolarHBondContact O-N 3.17Å
164	G	72.5	Confident	73.2	Confident	29 Å²	29	87.8 Å²	87.8	30%	0.299	46%	0.46	S	S	.	.	H	α-helix	trans	-55.5	-50.9	173.2	0	0	0	0	0	111.4	K160 S166 L167 Q168	K160-G164 PolarHBondContact O-N 3.39Å; G164-S166 VanDerWaalsContact C-N 3.28Å; G164-S166 PolarHBondContact O-N 3.17Å; G164-L167 WeakPolarHBondContact O-CB 3.42Å; G164-L167 PolarHBondContact O-N 3.01Å; G164-Q168 PolarHBondContact O-N 2.94Å
165	K	68.6	Low	73.3	Confident	138 Å²	138	83.7 Å²	83.7	60%	0.6	44%	0.439	S	S	*	.	H	α-helix	trans	-56.8	-39.1	174.2	-72.7	179.7	179.1	-176.1	0	113.3	A161 L163 L167 I169	A161-K165 VanDerWaalsContact O-CG 3.32Å; A161-K165 WeakPolarHBondContact O-CG 3.48Å; A161-K165 PolarHBondContact O-N 2.73Å; L163-K165 PolarHBondContact O-N 3.32Å; K165-L167 VanDerWaalsContact C-N 3.33Å; K165-I169 WeakPolarHBondContact O-CD1 3.25Å; K165-I169 VanDerWaalsContact O-CG1 3.23Å; K165-I169 WeakPolarHBondContact O-CG1 3.44Å; K165-I169 PolarHBondContact O-N 3.27Å
166	S	71.4	Confident	73.7	Confident	59 Å²	59	83.4 Å²	83.4	41%	0.413	43%	0.431	S	S	.	.	H	α-helix	trans	-71.8	-26.8	178.3	-170.4	0	0	0	0	113.3	R162 L163 G164 Q170	R162-S166 PolarHBondContact O-N 2.95Å; R162-S166 VanDerWaalsContact O-N 3.08Å; L163-S166 PolarHBondContact O-N 2.93Å; L163-S166 VanDerWaalsContact O-N 3.11Å; G164-S166 VanDerWaalsContact C-N 3.28Å; G164-S166 PolarHBondContact O-N 3.17Å; S166-Q170 WeakPolarHBondContact O-CG 3.45Å; S166-Q170 PolarHBondContact O-N 3Å; S166-Q170 PolarHBondContact O-NE2 2.98Å
167	L	76.6	Confident	74.4	Confident	97 Å²	97	84.7 Å²	84.7	51%	0.508	44%	0.435	S	S	.	.	H	α-helix	trans	-75.5	-45.6	175.6	-156.1	76.7	0	0	0	110	L163 G164 K165 I169 Q170 T171	L163-L167 PolarHBondContact O-N 3.17Å; G164-L167 WeakPolarHBondContact O-CB 3.42Å; G164-L167 PolarHBondContact O-N 3.01Å; K165-L167 VanDerWaalsContact C-N 3.33Å; L167-I169 VanDerWaalsContact C-N 3.34Å; L167-I169 PolarHBondContact O-N 3.36Å; L167-Q170 WeakPolarHBondContact O-CA 3.43Å; L167-Q170 WeakPolarHBondContact O-CB 3.38Å; L167-Q170 PolarHBondContact O-N 3.49Å; L167-T171 PolarHBondContact O-N 3.06Å; L167-T171 PolarHBondContact O-OG1 2.97Å
168	Q	70.4	Confident	75.1	Confident	45 Å²	45	82.9 Å²	82.9	21%	0.21	43%	0.434	C	S	.	.	H	α-helix	trans	-54.1	-49.2	173.7	-172.1	-174.3	-3.3	0	0	111.2	E57 I121 G164 Q170 T171 L172	E57-Q168 PolarHBondContact OE2-NE2 3.26Å; I121-Q168 VanDerWaalsContact CD1-CD 3.47Å; I121-Q168 HydrophobicContact CD1-CG 4.23Å; G164-Q168 PolarHBondContact O-N 2.94Å; Q168-Q170 VanDerWaalsContact C-N 3.26Å; Q168-Q170 PolarHBondContact O-N 2.83Å; Q168-T171 PolarHBondContact O-N 3.34Å; Q168-T171 VanDerWaalsContact O-N 3.11Å; Q168-L172 WeakPolarHBondContact O-CB 3.39Å; Q168-L172 PolarHBondContact O-N 3.12Å
169	I	73.1	Confident	75.5	Confident	98 Å²	98	83 Å²	83	50%	0.503	43%	0.426	S	S	.	.	H	α-helix	trans	-58.7	-37.9	176.1	-68.8	164.8	0	0	0	111.8	K165 L167 L173	K165-I169 WeakPolarHBondContact O-CD1 3.25Å; K165-I169 VanDerWaalsContact O-CG1 3.23Å; K165-I169 WeakPolarHBondContact O-CG1 3.44Å; K165-I169 PolarHBondContact O-N 3.27Å; L167-I169 VanDerWaalsContact C-N 3.34Å; L167-I169 PolarHBondContact O-N 3.36Å; I169-L173 HydrophobicContact CG2-CD1 3.91Å; I169-L173 HydrophobicContact CG2-CG 4.29Å; I169-L173 WeakPolarHBondContact O-CB 3.37Å; I169-L173 WeakPolarHBondContact O-CG 3.39Å; I169-L173 PolarHBondContact O-N 3.38Å
170	Q	75.9	Confident	76.1	Confident	98 Å²	98	83.7 Å²	83.7	46%	0.458	43%	0.427	S	S	.	.	H	α-helix	trans	-68.6	-37.7	177.6	-81.4	177.3	89	0	0	112.6	S166 L167 Q168 L173 K174	S166-Q170 WeakPolarHBondContact O-CG 3.45Å; S166-Q170 PolarHBondContact O-N 3Å; S166-Q170 PolarHBondContact O-NE2 2.98Å; L167-Q170 WeakPolarHBondContact O-CA 3.43Å; L167-Q170 WeakPolarHBondContact O-CB 3.38Å; L167-Q170 PolarHBondContact O-N 3.49Å; Q168-Q170 VanDerWaalsContact C-N 3.26Å; Q168-Q170 PolarHBondContact O-N 2.83Å; Q170-L173 PolarHBondContact O-N 3.46Å; Q170-K174 WeakPolarHBondContact O-CG 3.42Å; Q170-K174 PolarHBondContact O-N 3.1Å; Q170-K174 VanDerWaalsContact O-N 3.1Å
171	T	73.9	Confident	77.1	Confident	41 Å²	41	87 Å²	87	25%	0.252	44%	0.437	S	S	.	.	H	α-helix	trans	-63.7	-46.7	175.1	-55.4	0	0	0	0	110.4	F117 L167 Q168 L173 K174 A175	F117-T171 HydrophobicContact CZ-CG2 4Å; L167-T171 PolarHBondContact O-N 3.06Å; L167-T171 PolarHBondContact O-OG1 2.97Å; Q168-T171 PolarHBondContact O-N 3.34Å; Q168-T171 VanDerWaalsContact O-N 3.11Å; T171-L173 PolarHBondContact O-N 2.98Å; T171-K174 WeakPolarHBondContact O-CB 3.47Å; T171-K174 PolarHBondContact O-N 3.43Å; T171-A175 PolarHBondContact O-N 3.47Å; T171-A175 VanDerWaalsContact O-N 3.09Å
172	L	75.2	Confident	77.7	Confident	43 Å²	43	87.5 Å²	87.5	23%	0.225	43%	0.432	C	S	.	.	H	α-helix	trans	-57.6	-47.7	175.3	-153.6	-171.8	0	0	0	111.5	E57 Q168 K174 A175 F176	E57-L172 WeakPolarHBondContact OE1-CD1 3.01Å; Q168-L172 WeakPolarHBondContact O-CB 3.39Å; Q168-L172 PolarHBondContact O-N 3.12Å; L172-K174 VanDerWaalsContact C-N 3.3Å; L172-K174 PolarHBondContact O-N 3.32Å; L172-A175 WeakPolarHBondContact O-CB 3.39Å; L172-A175 PolarHBondContact O-N 2.87Å; L172-A175 VanDerWaalsContact O-N 3.12Å; L172-F176 HydrophobicContact CD2-CD2 3.16Å; L172-F176 HydrophobicContact CD2-CE2 2.97Å; L172-F176 HydrophobicContact CD2-CG 4.13Å; L172-F176 HydrophobicContact CD2-CZ 3.81Å; L172-F176 HydrophobicContact CG-CE2 4.39Å; L172-F176 PolarHBondContact O-N 3.43Å
173	L	75.8	Confident	78.3	Confident	104 Å²	104	81.8 Å²	81.8	55%	0.545	42%	0.415	S	S	.	.	H	α-helix	trans	-61.4	-35.9	178.3	-75.5	171.5	0	0	0	112.9	I169 Q170 T171 F176 E177	I169-L173 HydrophobicContact CG2-CD1 3.91Å; I169-L173 HydrophobicContact CG2-CG 4.29Å; I169-L173 WeakPolarHBondContact O-CB 3.37Å; I169-L173 WeakPolarHBondContact O-CG 3.39Å; I169-L173 PolarHBondContact O-N 3.38Å; Q170-L173 PolarHBondContact O-N 3.46Å; T171-L173 PolarHBondContact O-N 2.98Å; L173-F176 PolarHBondContact O-N 3.02Å; L173-E177 WeakPolarHBondContact O-CB 3.33Å; L173-E177 PolarHBondContact O-N 3.36Å
174	K	87.2	Confident	79.1	Confident	139 Å²	139	82.7 Å²	82.7	60%	0.604	42%	0.416	S	S	*	.	H	α-helix	trans	-66.7	-39	174.6	-74.3	172.9	-177.3	168.6	0	112	Q170 T171 L172 E177 A178	Q170-K174 WeakPolarHBondContact O-CG 3.42Å; Q170-K174 PolarHBondContact O-N 3.1Å; Q170-K174 VanDerWaalsContact O-N 3.1Å; T171-K174 WeakPolarHBondContact O-CB 3.47Å; T171-K174 PolarHBondContact O-N 3.43Å; L172-K174 VanDerWaalsContact C-N 3.3Å; L172-K174 PolarHBondContact O-N 3.32Å; K174-E177 PolarHBondContact O-N 3.47Å; K174-A178 WeakPolarHBondContact O-CB 3.46Å; K174-A178 PolarHBondContact O-N 3.46Å
175	A	77.2	Confident	79.8	Confident	13 Å²	13	87.5 Å²	87.5	11%	0.107	43%	0.431	C	S	.	.	H	α-helix	trans	-63.2	-45.7	175.3	0	0	0	0	0	111.1	L61 T171 L172 A178 R179	L61-A175 HydrophobicContact CD2-CB 4.31Å; T171-A175 PolarHBondContact O-N 3.47Å; T171-A175 VanDerWaalsContact O-N 3.09Å; L172-A175 WeakPolarHBondContact O-CB 3.39Å; L172-A175 PolarHBondContact O-N 2.87Å; L172-A175 VanDerWaalsContact O-N 3.12Å; A175-A178 PolarHBondContact O-N 3.02Å; A175-R179 PolarHBondContact O-N 3.03Å
176	F	82.6	Confident	80.1	Confident	78 Å²	78	84.2 Å²	84.2	34%	0.342	43%	0.425	S	S	.	.	H	α-helix	trans	-61.3	-43.4	173.2	-81.4	-49	0	0	0	112.9	L172 L173 A178 R179 D180	L172-F176 HydrophobicContact CD2-CD2 3.16Å; L172-F176 HydrophobicContact CD2-CE2 2.97Å; L172-F176 HydrophobicContact CD2-CG 4.13Å; L172-F176 HydrophobicContact CD2-CZ 3.81Å; L172-F176 HydrophobicContact CG-CE2 4.39Å; L172-F176 PolarHBondContact O-N 3.43Å; L173-F176 PolarHBondContact O-N 3.02Å; F176-A178 VanDerWaalsContact C-N 3.32Å; F176-A178 PolarHBondContact O-N 3.41Å; F176-R179 PolarHBondContact O-N 3.41Å; F176-D180 WeakPolarHBondContact O-CB 3.48Å; F176-D180 PolarHBondContact O-N 3.37Å
177	E	87.8	Confident	80.7	Confident	125 Å²	125	85.5 Å²	85.5	58%	0.584	43%	0.427	S	S	*	.	H	α-helix	trans	-60.8	-42.8	177.9	-174.8	-176.1	161.6	0	0	111.3	L173 K174 D180 R181	L173-E177 WeakPolarHBondContact O-CB 3.33Å; L173-E177 PolarHBondContact O-N 3.36Å; K174-E177 PolarHBondContact O-N 3.47Å; E177-D180 PolarHBondContact O-N 3.35Å; E177-R181 WeakPolarHBondContact O-CB 3.37Å; E177-R181 PolarHBondContact O-N 3.47Å
178	A	85.2	Confident	81.2	Confident	58 Å²	58	88.6 Å²	88.6	48%	0.479	43%	0.433	S	S	.	.	H	α-helix	trans	-62.7	-44.4	176.6	0	0	0	0	0	111.7	K174 A175 F176 R181 N182	K174-A178 WeakPolarHBondContact O-CB 3.46Å; K174-A178 PolarHBondContact O-N 3.46Å; A175-A178 PolarHBondContact O-N 3.02Å; F176-A178 VanDerWaalsContact C-N 3.32Å; F176-A178 PolarHBondContact O-N 3.41Å; A178-R181 PolarHBondContact O-N 3.45Å; A178-N182 PolarHBondContact O-N 3.42Å
179	R	80.9	Confident	81.7	Confident	52 Å²	52	91.4 Å²	91.4	20%	0.196	45%	0.45	C	S	.	.	H	α-helix	trans	-60.5	-52.1	175.5	179.9	-174.3	175.6	-175.1	2	111.6	A175 F176 R181 N182 I183	A175-R179 PolarHBondContact O-N 3.03Å; F176-R179 PolarHBondContact O-N 3.41Å; R179-R181 VanDerWaalsContact C-N 3.27Å; R179-R181 PolarHBondContact O-N 3.41Å; R179-N182 PolarHBondContact O-N 2.99Å; R179-N182 VanDerWaalsContact O-N 3.17Å; R179-I183 HydrophobicContact CG-CD1 3.95Å; R179-I183 WeakPolarHBondContact O-CG1 3.3Å; R179-I183 PolarHBondContact O-N 2.95Å
180	D	87.3	Confident	82.3	Confident	87 Å²	87	94.6 Å²	94.6	47%	0.465	46%	0.456	S	S	.	.	H	α-helix	trans	-61.1	-39.2	-178.8	-83	-4.6	0	0	0	111.2	F176 E177 I183 Q184	F176-D180 WeakPolarHBondContact O-CB 3.48Å; F176-D180 PolarHBondContact O-N 3.37Å; E177-D180 PolarHBondContact O-N 3.35Å; D180-I183 PolarHBondContact O-N 3.1Å; D180-Q184 WeakPolarHBondContact O-CB 3.23Å; D180-Q184 VanDerWaalsContact O-CG 3.23Å; D180-Q184 WeakPolarHBondContact O-CG 3.38Å; D180-Q184 PolarHBondContact O-N 3.04Å
181	R	90.2	Very high	83.1	Confident	168 Å²	168	94.3 Å²	94.3	63%	0.634	46%	0.46	S	S	*	.	H	α-helix	trans	-63.3	-43.3	175.9	-172.1	172.6	-178.4	154.1	-0.4	112.2	E177 A178 R179 Q184 E185	E177-R181 WeakPolarHBondContact O-CB 3.37Å; E177-R181 PolarHBondContact O-N 3.47Å; A178-R181 PolarHBondContact O-N 3.45Å; R179-R181 VanDerWaalsContact C-N 3.27Å; R179-R181 PolarHBondContact O-N 3.41Å; R181-Q184 PolarHBondContact O-N 3.2Å; R181-E185 WeakPolarHBondContact O-CB 3.5Å; R181-E185 PolarHBondContact O-N 3.43Å
182	N	79.8	Confident	83.7	Confident	67 Å²	67	95.5 Å²	95.5	36%	0.358	47%	0.465	S	S	.	.	H	α-helix	trans	-63.4	-42.4	176.7	-170	39.1	0	0	0	111.8	A178 R179 Q184 E185 S186	A178-N182 PolarHBondContact O-N 3.42Å; R179-N182 PolarHBondContact O-N 2.99Å; R179-N182 VanDerWaalsContact O-N 3.17Å; N182-Q184 PolarHBondContact O-N 3.1Å; N182-E185 PolarHBondContact O-N 2.96Å; N182-S186 PolarHBondContact O-N 3.5Å; N182-S186 VanDerWaalsContact O-N 3.1Å; N182-S186 PolarHBondContact O-OG 2.86Å
183	I	82.8	Confident	84.1	Confident	64 Å²	64	98.4 Å²	98.4	33%	0.328	48%	0.479	S	S	.	.	H	α-helix	trans	-64	-41.9	175.7	-67.2	171.8	0	0	0	110.7	R179 D180 S186 N187	R179-I183 HydrophobicContact CG-CD1 3.95Å; R179-I183 WeakPolarHBondContact O-CG1 3.3Å; R179-I183 PolarHBondContact O-N 2.95Å; D180-I183 PolarHBondContact O-N 3.1Å; I183-S186 PolarHBondContact O-OG 2.81Å; I183-N187 WeakPolarHBondContact CG2-ND2 3.4Å; I183-N187 WeakPolarHBondContact O-CB 3.21Å; I183-N187 PolarHBondContact O-N 3.37Å; I183-N187 VanDerWaalsContact O-N 3.1Å; I183-N187 PolarHBondContact O-ND2 3.03Å
184	Q	87.9	Confident	84.9	Confident	134 Å²	134	100.4 Å²	100.4	63%	0.626	48%	0.479	S	S	*	.	H	α-helix	trans	-64.8	-43.1	178.1	-76.6	177.5	13	0	0	112.1	D180 R181 N182 N187 Y188	D180-Q184 WeakPolarHBondContact O-CB 3.23Å; D180-Q184 VanDerWaalsContact O-CG 3.23Å; D180-Q184 WeakPolarHBondContact O-CG 3.38Å; D180-Q184 PolarHBondContact O-N 3.04Å; R181-Q184 PolarHBondContact O-N 3.2Å; N182-Q184 PolarHBondContact O-N 3.1Å; Q184-N187 PolarHBondContact O-N 2.92Å; Q184-Y188 WeakPolarHBondContact O-CB 3.32Å; Q184-Y188 PolarHBondContact O-N 2.93Å
185	E	85.4	Confident	84.9	Confident	130 Å²	130	96.9 Å²	96.9	61%	0.607	47%	0.472	S	S	*	.	H	α-helix	trans	-67.2	-44.1	-178.2	-172	166.1	-174.6	0	0	112	R181 N182 Y188 N189	R181-E185 WeakPolarHBondContact O-CB 3.5Å; R181-E185 PolarHBondContact O-N 3.43Å; N182-E185 PolarHBondContact O-N 2.96Å; E185-Y188 PolarHBondContact O-N 3.37Å; E185-N189 PolarHBondContact O-N 3.15Å
186	S	76.3	Confident	85.7	Confident	69 Å²	69	102 Å²	102	48%	0.483	50%	0.495	S	S	.	.	H	α-helix	trans	-63.6	-41.7	176.2	59.6	0	0	0	0	112.4	N182 I183 R190	N182-S186 PolarHBondContact O-N 3.5Å; N182-S186 VanDerWaalsContact O-N 3.1Å; N182-S186 PolarHBondContact O-OG 2.86Å; I183-S186 PolarHBondContact O-OG 2.81Å; S186-R190 PolarHBondContact O-N 3.3Å
187	N	82.8	Confident	86.1	Confident	85 Å²	85	101.8 Å²	101.8	46%	0.455	50%	0.5	S	S	.	.	H	α-helix	trans	-65.9	-44.9	174.4	-82.7	-64.4	0	0	0	112.3	I183 Q184 N189 R190 V191	I183-N187 WeakPolarHBondContact CG2-ND2 3.4Å; I183-N187 WeakPolarHBondContact O-CB 3.21Å; I183-N187 PolarHBondContact O-N 3.37Å; I183-N187 VanDerWaalsContact O-N 3.1Å; I183-N187 PolarHBondContact O-ND2 3.03Å; Q184-N187 PolarHBondContact O-N 2.92Å; N187-N189 VanDerWaalsContact C-N 3.34Å; N187-N189 PolarHBondContact O-N 3.3Å; N187-R190 PolarHBondContact O-N 3.43Å; N187-V191 WeakPolarHBondContact O-CG2 3.35Å; N187-V191 PolarHBondContact O-N 3.36Å
188	Y	87.9	Confident	86.2	Confident	162 Å²	162	100.6 Å²	100.6	64%	0.635	50%	0.498	S	S	*	.	H	α-helix	trans	-56.4	-49.1	178	173.1	-99	0	0	0	111.1	Q184 E185 R190 V191 N192	Q184-Y188 WeakPolarHBondContact O-CB 3.32Å; Q184-Y188 PolarHBondContact O-N 2.93Å; E185-Y188 PolarHBondContact O-N 3.37Å; Y188-R190 PolarHBondContact O-N 2.98Å; Y188-V191 PolarHBondContact O-N 2.83Å; Y188-N192 WeakPolarHBondContact O-CB 3.18Å; Y188-N192 PolarHBondContact O-N 3.47Å
189	N	80.9	Confident	86.7	Confident	104 Å²	104	104.2 Å²	104.2	56%	0.556	51%	0.507	S	S	*	.	H	α-helix	trans	-62.2	-44.2	-179.3	-171.6	35.7	0	0	0	111.8	E185 N187 N192 M193	E185-N189 PolarHBondContact O-N 3.15Å; N187-N189 VanDerWaalsContact C-N 3.34Å; N187-N189 PolarHBondContact O-N 3.3Å; N189-N192 PolarHBondContact O-N 3.43Å; N189-M193 WeakPolarHBondContact O-CB 3.19Å; N189-M193 PolarHBondContact O-N 2.92Å
190	R	86.1	Confident	87.2	Confident	166 Å²	166	106.8 Å²	106.8	63%	0.626	52%	0.524	S	S	*	.	H	α-helix	trans	-61.6	-48	177.9	-174.2	176.7	175.2	-176.1	0.1	111.6	S186 N187 Y188 M193 W194	S186-R190 PolarHBondContact O-N 3.3Å; N187-R190 PolarHBondContact O-N 3.43Å; Y188-R190 PolarHBondContact O-N 2.98Å; R190-M193 PolarHBondContact O-N 3.43Å; R190-W194 PolarHBondContact O-N 2.86Å; R190-W194 VanDerWaalsContact O-N 3.15Å
191	V	92.9	Very high	87.5	Confident	92 Å²	92	106.1 Å²	106.1	56%	0.558	52%	0.522	S	S	*	.	H	α-helix	trans	-65	-42.7	179.6	172.6	0	0	0	0	111.2	N187 Y188 W194 S195	N187-V191 WeakPolarHBondContact O-CG2 3.35Å; N187-V191 PolarHBondContact O-N 3.36Å; Y188-V191 PolarHBondContact O-N 2.83Å; V191-W194 PolarHBondContact O-N 2.88Å; V191-S195 VanDerWaalsContact O-CB 3.3Å; V191-S195 WeakPolarHBondContact O-CB 3.3Å; V191-S195 PolarHBondContact O-N 2.81Å; V191-S195 PolarHBondContact O-OG 2.89Å
192	N	86.7	Confident	87.7	Confident	66 Å²	66	104.2 Å²	104.2	35%	0.353	52%	0.522	S	S	.	.	H	α-helix	trans	-64.3	-42.3	179.4	-173.5	56.1	0	0	0	111.6	Y188 N189 S195 M196	Y188-N192 WeakPolarHBondContact O-CB 3.18Å; Y188-N192 PolarHBondContact O-N 3.47Å; N189-N192 PolarHBondContact O-N 3.43Å; N192-S195 PolarHBondContact O-N 2.86Å; N192-M196 WeakPolarHBondContact O-CB 3.37Å; N192-M196 PolarHBondContact O-N 3.41Å
193	M	82.7	Confident	88.4	Confident	103 Å²	103	105.5 Å²	105.5	51%	0.507	53%	0.532	S	S	.	.	H	α-helix	trans	-60.9	-46.4	176.2	-174.9	-175.3	71.4	0	0	112.1	N189 R190 T197	N189-M193 WeakPolarHBondContact O-CB 3.19Å; N189-M193 PolarHBondContact O-N 2.92Å; R190-M193 PolarHBondContact O-N 3.43Å; M193-T197 PolarHBondContact O-N 3.09Å; M193-T197 VanDerWaalsContact O-N 3.09Å; M193-T197 PolarHBondContact O-OG1 3.3Å
194	W	92.6	Very high	88.8	Confident	147 Å²	147	107.6 Å²	107.6	56%	0.557	54%	0.544	S	S	*	.	H	α-helix	trans	-67.5	-37.5	177.1	-79.3	108.7	0	0	0	112.3	R190 V191 T197 N198	R190-W194 PolarHBondContact O-N 2.86Å; R190-W194 VanDerWaalsContact O-N 3.15Å; V191-W194 PolarHBondContact O-N 2.88Å; W194-T197 PolarHBondContact O-N 2.78Å; W194-N198 PolarHBondContact O-N 3.32Å; W194-N198 PolarHBondContact O-ND2 3.45Å
195	S	87.9	Confident	89.1	Confident	65 Å²	65	104.4 Å²	104.4	46%	0.455	53%	0.533	S	S	.	.	H	α-helix	trans	-65.4	-44.9	177	-61.5	0	0	0	0	111.9	V191 N192 T197 N198 M199	V191-S195 VanDerWaalsContact O-CB 3.3Å; V191-S195 WeakPolarHBondContact O-CB 3.3Å; V191-S195 PolarHBondContact O-N 2.81Å; V191-S195 PolarHBondContact O-OG 2.89Å; N192-S195 PolarHBondContact O-N 2.86Å; S195-T197 VanDerWaalsContact C-N 3.33Å; S195-T197 PolarHBondContact O-N 3.08Å; S195-N198 PolarHBondContact O-N 3.03Å; S195-M199 WeakPolarHBondContact O-CB 3.4Å; S195-M199 PolarHBondContact O-N 3.44Å
196	M	94.3	Very high	89.4	Confident	121 Å²	121	101.7 Å²	101.7	60%	0.596	53%	0.525	S	S	*	.	H	α-helix	trans	-61.9	-41.4	176.5	-173.5	-177.7	-67.1	0	0	111.6	N192 M199 L200	N192-M196 WeakPolarHBondContact O-CB 3.37Å; N192-M196 PolarHBondContact O-N 3.41Å; M196-M199 PolarHBondContact O-N 3.04Å; M196-L200 PolarHBondContact O-N 3.4Å
197	T	89.9	Confident	90.2	Very high	72 Å²	72	100.4 Å²	100.4	44%	0.442	52%	0.523	S	S	.	.	H	α-helix	trans	-61.8	-47	176.5	-57.5	0	0	0	0	111.3	M193 W194 S195 L200 V201	M193-T197 PolarHBondContact O-N 3.09Å; M193-T197 VanDerWaalsContact O-N 3.09Å; M193-T197 PolarHBondContact O-OG1 3.3Å; W194-T197 PolarHBondContact O-N 2.78Å; S195-T197 VanDerWaalsContact C-N 3.33Å; S195-T197 PolarHBondContact O-N 3.08Å; T197-L200 PolarHBondContact O-N 3.29Å; T197-V201 WeakPolarHBondContact O-CG2 3.46Å; T197-V201 PolarHBondContact O-N 2.92Å; T197-V201 VanDerWaalsContact O-N 3.08Å
198	N	89.8	Confident	90.6	Very high	100 Å²	100	100.4 Å²	100.4	54%	0.535	53%	0.526	S	S	.	.	H	α-helix	trans	-63.7	-41.8	177.9	-82.5	-79.7	0	0	0	112.3	W194 S195 L200 V201 M202	W194-N198 PolarHBondContact O-N 3.32Å; W194-N198 PolarHBondContact O-ND2 3.45Å; S195-N198 PolarHBondContact O-N 3.03Å; N198-L200 VanDerWaalsContact C-N 3.31Å; N198-L200 PolarHBondContact O-N 3Å; N198-V201 PolarHBondContact O-N 3.18Å; N198-M202 WeakPolarHBondContact O-CG 3.4Å; N198-M202 PolarHBondContact O-N 3.42Å
199	M	94.8	Very high	90.6	Very high	135 Å²	135	97.7 Å²	97.7	67%	0.665	52%	0.519	S	S	*	.	H	α-helix	trans	-58	-44.8	175.6	-177.5	-175.4	175.9	0	0	111.4	S195 M196 M202 V203	S195-M199 WeakPolarHBondContact O-CB 3.4Å; S195-M199 PolarHBondContact O-N 3.44Å; M196-M199 PolarHBondContact O-N 3.04Å; M199-M202 PolarHBondContact O-N 3.47Å; M199-V203 WeakPolarHBondContact O-CG2 3.39Å; M199-V203 PolarHBondContact O-N 3.25Å; M199-V203 VanDerWaalsContact O-N 3.12Å
200	L	93.1	Very high	91.3	Very high	106 Å²	106	96.3 Å²	96.3	56%	0.555	52%	0.515	S	S	*	.	H	α-helix	trans	-63.5	-43	178.8	-170.5	149.5	0	0	0	111.7	M196 T197 N198 M202 V203 L204	M196-L200 PolarHBondContact O-N 3.4Å; T197-L200 PolarHBondContact O-N 3.29Å; N198-L200 VanDerWaalsContact C-N 3.31Å; N198-L200 PolarHBondContact O-N 3Å; L200-M202 PolarHBondContact O-N 2.93Å; L200-V203 PolarHBondContact O-N 3.31Å; L200-L204 HydrophobicContact CD2-CD1 3.57Å; L200-L204 HydrophobicContact CD2-CG 4.07Å; L200-L204 WeakPolarHBondContact O-CG 3.41Å; L200-L204 PolarHBondContact O-N 2.93Å
201	V	93.6	Very high	91.5	Very high	72 Å²	72	96.1 Å²	96.1	44%	0.436	52%	0.515	S	S	.	.	H	α-helix	trans	-60.6	-44.5	176.4	172.1	0	0	0	0	111.3	T197 N198 V203 L204 V205	T197-V201 WeakPolarHBondContact O-CG2 3.46Å; T197-V201 PolarHBondContact O-N 2.92Å; T197-V201 VanDerWaalsContact O-N 3.08Å; N198-V201 PolarHBondContact O-N 3.18Å; V201-V203 VanDerWaalsContact C-N 3.34Å; V201-V203 PolarHBondContact O-N 3.31Å; V201-L204 PolarHBondContact O-N 3.43Å; V201-V205 HydrophobicContact CG1-CG2 4.33Å; V201-V205 WeakPolarHBondContact O-CG2 3.34Å; V201-V205 PolarHBondContact O-N 3.32Å
202	M	94.1	Very high	91.2	Very high	129 Å²	129	96.8 Å²	96.8	64%	0.635	52%	0.515	S	S	*	.	H	α-helix	trans	-59.7	-44.3	177.7	-72.2	-67.2	-72.8	0	0	111.8	N198 M199 L200 L204 V205 T206	N198-M202 WeakPolarHBondContact O-CG 3.4Å; N198-M202 PolarHBondContact O-N 3.42Å; M199-M202 PolarHBondContact O-N 3.47Å; L200-M202 PolarHBondContact O-N 2.93Å; M202-L204 PolarHBondContact O-N 3.12Å; M202-V205 PolarHBondContact O-N 3.39Å; M202-T206 PolarHBondContact O-N 3.01Å; M202-T206 PolarHBondContact O-OG1 3.49Å
203	V	93.9	Very high	91.4	Very high	94 Å²	94	98.5 Å²	98.5	57%	0.57	52%	0.523	S	S	*	.	H	α-helix	trans	-62	-43.6	176.9	172.6	0	0	0	0	111.5	M199 L200 V201 T206 G207	M199-V203 WeakPolarHBondContact O-CG2 3.39Å; M199-V203 PolarHBondContact O-N 3.25Å; M199-V203 VanDerWaalsContact O-N 3.12Å; L200-V203 PolarHBondContact O-N 3.31Å; V201-V203 VanDerWaalsContact C-N 3.34Å; V201-V203 PolarHBondContact O-N 3.31Å; V203-T206 PolarHBondContact O-N 3.48Å; V203-G207 PolarHBondContact O-N 3.35Å
204	L	91.3	Very high	91.6	Very high	108 Å²	108	102.6 Å²	102.6	57%	0.565	53%	0.533	S	S	*	.	H	α-helix	trans	-61.9	-46.5	176.8	-71.5	178.4	0	0	0	111.7	L200 V201 M202 T206 G207 V208	L200-L204 HydrophobicContact CD2-CD1 3.57Å; L200-L204 HydrophobicContact CD2-CG 4.07Å; L200-L204 WeakPolarHBondContact O-CG 3.41Å; L200-L204 PolarHBondContact O-N 2.93Å; V201-L204 PolarHBondContact O-N 3.43Å; M202-L204 PolarHBondContact O-N 3.12Å; L204-T206 VanDerWaalsContact C-N 3.35Å; L204-T206 PolarHBondContact O-N 3.03Å; L204-G207 PolarHBondContact O-N 2.95Å; L204-V208 WeakPolarHBondContact O-CG2 3.5Å; L204-V208 PolarHBondContact O-N 3.34Å
205	V	93.6	Very high	91.2	Very high	67 Å²	67	98.9 Å²	98.9	41%	0.406	53%	0.529	S	S	.	.	H	α-helix	trans	-60.5	-45.4	178.3	171.1	0	0	0	0	110.6	V201 M202 G207 V208 Q209	V201-V205 HydrophobicContact CG1-CG2 4.33Å; V201-V205 WeakPolarHBondContact O-CG2 3.34Å; V201-V205 PolarHBondContact O-N 3.32Å; M202-V205 PolarHBondContact O-N 3.39Å; V205-G207 VanDerWaalsContact C-N 3.33Å; V205-G207 PolarHBondContact O-N 2.93Å; V205-V208 PolarHBondContact O-N 2.88Å; V205-Q209 HydrophobicContact CG1-CG 4.32Å; V205-Q209 WeakPolarHBondContact O-CB 3.41Å; V205-Q209 VanDerWaalsContact O-CG 3.22Å; V205-Q209 WeakPolarHBondContact O-CG 3.42Å; V205-Q209 PolarHBondContact O-N 3.44Å
206	T	93.3	Very high	91	Very high	72 Å²	72	102.1 Å²	102.1	44%	0.442	54%	0.541	S	S	.	.	H	α-helix	trans	-61.1	-41.4	175.5	-57.4	0	0	0	0	111.8	M202 V203 L204 Q209 V210	M202-T206 PolarHBondContact O-N 3.01Å; M202-T206 PolarHBondContact O-OG1 3.49Å; V203-T206 PolarHBondContact O-N 3.48Å; L204-T206 VanDerWaalsContact C-N 3.35Å; L204-T206 PolarHBondContact O-N 3.03Å; T206-Q209 PolarHBondContact O-N 2.99Å; T206-V210 WeakPolarHBondContact O-CG2 3.46Å; T206-V210 PolarHBondContact O-N 2.97Å
207	G	91.5	Very high	90.3	Very high	43 Å²	43	104.2 Å²	104.2	44%	0.443	55%	0.547	S	S	.	.	H	α-helix	trans	-60.7	-46.8	175.7	0	0	0	0	0	112.8	V203 L204 V205 V210 Y211	V203-G207 PolarHBondContact O-N 3.35Å; L204-G207 PolarHBondContact O-N 2.95Å; V205-G207 VanDerWaalsContact C-N 3.33Å; V205-G207 PolarHBondContact O-N 2.93Å; G207-V210 PolarHBondContact O-N 3.41Å; G207-Y211 WeakPolarHBondContact O-CB 3.35Å; G207-Y211 PolarHBondContact O-N 3.37Å
208	V	90.9	Very high	89.3	Confident	84 Å²	84	106.4 Å²	106.4	51%	0.509	56%	0.556	S	S	.	*	H	α-helix	trans	-62.7	-44	176.5	172.9	0	0	0	0	110.9	L204 V205 V210 Y211 L212	L204-V208 WeakPolarHBondContact O-CG2 3.5Å; L204-V208 PolarHBondContact O-N 3.34Å; V205-V208 PolarHBondContact O-N 2.88Å; V208-V210 PolarHBondContact O-N 2.88Å; V208-Y211 PolarHBondContact O-N 3.26Å; V208-L212 HydrophobicContact CG1-CD1 3.96Å; V208-L212 HydrophobicContact CG1-CG 4.22Å; V208-L212 WeakPolarHBondContact O-CB 3.22Å; V208-L212 WeakPolarHBondContact O-CG 3.47Å; V208-L212 PolarHBondContact O-N 3.46Å
209	Q	89.8	Confident	88	Confident	105 Å²	105	106.3 Å²	106.3	49%	0.491	56%	0.555	S	S	.	*	H	α-helix	trans	-58.1	-47.5	177	-75.8	171.9	-18.7	0	0	111.8	V205 T206 Y211 L212 I213	V205-Q209 HydrophobicContact CG1-CG 4.32Å; V205-Q209 WeakPolarHBondContact O-CB 3.41Å; V205-Q209 VanDerWaalsContact O-CG 3.22Å; V205-Q209 WeakPolarHBondContact O-CG 3.42Å; V205-Q209 PolarHBondContact O-N 3.44Å; T206-Q209 PolarHBondContact O-N 2.99Å; Q209-Y211 VanDerWaalsContact C-N 3.35Å; Q209-Y211 PolarHBondContact O-N 2.94Å; Q209-L212 PolarHBondContact O-N 3.4Å; Q209-I213 VanDerWaalsContact O-CG1 3.31Å; Q209-I213 WeakPolarHBondContact O-CG1 3.34Å; Q209-I213 PolarHBondContact O-N 3.26Å
210	V	93.8	Very high	86.5	Confident	76 Å²	76	108.3 Å²	108.3	46%	0.461	56%	0.56	S	S	.	*	H	α-helix	trans	-64.5	-40.3	178	173.1	0	0	0	0	111.4	T206 G207 V208 R214	T206-V210 WeakPolarHBondContact O-CG2 3.46Å; T206-V210 PolarHBondContact O-N 2.97Å; G207-V210 PolarHBondContact O-N 3.41Å; V208-V210 PolarHBondContact O-N 2.88Å; V210-R214 PolarHBondContact O-N 3.43Å
211	Y	90.5	Very high	85	Confident	162 Å²	162	112.5 Å²	112.5	64%	0.635	57%	0.568	S	S	*	*	H	α-helix	trans	-62.7	-47.7	176.8	177	-96.7	0	0	0	112.1	G207 V208 Q209 I213 R214 S215	G207-Y211 WeakPolarHBondContact O-CB 3.35Å; G207-Y211 PolarHBondContact O-N 3.37Å; V208-Y211 PolarHBondContact O-N 3.26Å; Q209-Y211 VanDerWaalsContact C-N 3.35Å; Q209-Y211 PolarHBondContact O-N 2.94Å; Y211-I213 PolarHBondContact O-N 3.32Å; Y211-R214 PolarHBondContact O-N 2.82Å; Y211-S215 WeakPolarHBondContact O-CB 3.34Å; Y211-S215 PolarHBondContact O-N 3.28Å
212	L	87.8	Confident	83.3	Confident	105 Å²	105	116.8 Å²	116.8	55%	0.55	58%	0.583	S	S	.	*	H	α-helix	trans	-62.3	-42.7	179.1	-72.1	177.7	0	0	0	111.7	V208 Q209 S215 L216	V208-L212 HydrophobicContact CG1-CD1 3.96Å; V208-L212 HydrophobicContact CG1-CG 4.22Å; V208-L212 WeakPolarHBondContact O-CB 3.22Å; V208-L212 WeakPolarHBondContact O-CG 3.47Å; V208-L212 PolarHBondContact O-N 3.46Å; Q209-L212 PolarHBondContact O-N 3.4Å; L212-S215 PolarHBondContact O-N 3Å; L212-L216 WeakPolarHBondContact O-CB 3.39Å; L212-L216 PolarHBondContact O-N 3.04Å
213	I	91	Very high	81.5	Confident	102 Å²	102	116 Å²	116	52%	0.523	59%	0.586	S	S	.	*	H	α-helix	trans	-61	-48.6	175.8	-70.1	171.8	0	0	0	110.1	Q209 Y211 S215 L216 F217	Q209-I213 VanDerWaalsContact O-CG1 3.31Å; Q209-I213 WeakPolarHBondContact O-CG1 3.34Å; Q209-I213 PolarHBondContact O-N 3.26Å; Y211-I213 PolarHBondContact O-N 3.32Å; I213-S215 VanDerWaalsContact C-N 3.35Å; I213-S215 PolarHBondContact O-N 3.47Å; I213-L216 PolarHBondContact O-N 3.43Å; I213-F217 HydrophobicContact CG2-CD2 3.85Å; I213-F217 HydrophobicContact CG2-CE2 3.86Å; I213-F217 WeakPolarHBondContact O-CD2 3.31Å; I213-F217 PolarHBondContact O-N 3.04Å
214	R	86.9	Confident	79.5	Confident	190 Å²	190	122.1 Å²	122.1	72%	0.717	60%	0.599	S	S	*	*	H	α-helix	trans	-60	-43.4	176.1	-87.6	-175.8	172.4	173.2	-1.3	112.4	V210 Y211 L216 F217 D218	V210-R214 PolarHBondContact O-N 3.43Å; Y211-R214 PolarHBondContact O-N 2.82Å; R214-L216 VanDerWaalsContact C-N 3.29Å; R214-L216 PolarHBondContact O-N 3.49Å; R214-F217 PolarHBondContact O-N 3.46Å; R214-D218 WeakPolarHBondContact O-CB 3.45Å; R214-D218 PolarHBondContact O-N 2.9Å
215	S	83.9	Confident	77.4	Confident	69 Å²	69	126.6 Å²	126.6	48%	0.483	63%	0.631	S	S	.	*	H	α-helix	trans	-64.5	-32.1	179	-177.4	0	0	0	0	113	Y211 L212 I213	Y211-S215 WeakPolarHBondContact O-CB 3.34Å; Y211-S215 PolarHBondContact O-N 3.28Å; L212-S215 PolarHBondContact O-N 3Å; I213-S215 VanDerWaalsContact C-N 3.35Å; I213-S215 PolarHBondContact O-N 3.47Å
216	L	83.7	Confident	76.6	Confident	133 Å²	133	129.6 Å²	129.6	70%	0.696	64%	0.642	S	S	*	*	H	α-helix	trans	-71.3	-34.2	176.6	-166.5	85.2	0	0	0	111.7	L212 I213 R214	L212-L216 WeakPolarHBondContact O-CB 3.39Å; L212-L216 PolarHBondContact O-N 3.04Å; I213-L216 PolarHBondContact O-N 3.43Å; R214-L216 VanDerWaalsContact C-N 3.29Å; R214-L216 PolarHBondContact O-N 3.49Å
217	F	80.1	Confident	75.7	Confident	164 Å²	164	132.6 Å²	132.6	72%	0.719	65%	0.653	S	S	*	*	H	α-helix	trans	-90.3	-16.9	-179.7	-71.5	-66.3	0	0	0	114	I213 R214 D219	I213-F217 HydrophobicContact CG2-CD2 3.85Å; I213-F217 HydrophobicContact CG2-CE2 3.86Å; I213-F217 WeakPolarHBondContact O-CD2 3.31Å; I213-F217 PolarHBondContact O-N 3.04Å; R214-F217 PolarHBondContact O-N 3.46Å; F217-D219 PolarHBondContact O-N 2.87Å
218	D	67.6	Low	74.8	Confident	119 Å²	119	137.6 Å²	137.6	64%	0.636	66%	0.664	S	S	*	*			trans	-83.1	45.2	173	-155.6	22.4	0	0	0	111.4	R214 K220	R214-D218 WeakPolarHBondContact O-CB 3.45Å; R214-D218 PolarHBondContact O-N 2.9Å; D218-K220 PolarHBondContact O-N 3.07Å
219	D	62.9	Low	73.9	Confident	97 Å²	97	140.7 Å²	140.7	52%	0.519	67%	0.673	S	S	.	*			trans	-74.1	92.4	170.6	-170.3	17.3	0	0	0	107.9	F217 R221	F217-D219 PolarHBondContact O-N 2.87Å; D219-R221 PolarHBondContact O-N 2.82Å; D219-R221 WeakPolarHBondContact OD2-CG 3.15Å; D219-R221 IonicContact OD2-CZ 3.62Å; D219-R221 IonicContact OD2-NE 2.9Å; D219-R221 PolarHBondContact OD2-NE 3.23Å; D219-R221 IonicContact OD2-NH2 3.46Å; D219-R221 PolarHBondContact OD2-NH2 3.22Å
220	K	62.4	Low	72.9	Confident	177 Å²	177	142.9 Å²	142.9	77%	0.77	69%	0.685	S	S	*	*			trans	-65.5	75.9	167.5	-75.4	-177.1	-178	177.4	0	109.2	D218 H222	D218-K220 PolarHBondContact O-N 3.07Å; K220-H222 PolarHBondContact O-N 2.76Å
221	R	61.8	Low	71.5	Confident	194 Å²	194	147.4 Å²	147.4	73%	0.732	70%	0.7	S	S	*	*			trans	-67.6	88.4	160.7	-67	-168.3	-170.7	-147.1	2.6	107.7	D219 T223	D219-R221 PolarHBondContact O-N 2.82Å; D219-R221 WeakPolarHBondContact OD2-CG 3.15Å; D219-R221 IonicContact OD2-CZ 3.62Å; D219-R221 IonicContact OD2-NE 2.9Å; D219-R221 PolarHBondContact OD2-NE 3.23Å; D219-R221 IonicContact OD2-NH2 3.46Å; D219-R221 PolarHBondContact OD2-NH2 3.22Å; R221-T223 HydrophobicContact CB-CG2 4.44Å; R221-T223 PolarHBondContact O-N 2.84Å
222	H	58.4	Low	70.1	Confident	162 Å²	162	146.4 Å²	146.4	75%	0.75	70%	0.704	S	S	*	*			trans	-66.9	76.9	157.3	-169.3	-59.7	0	0	0	106.9	K220 R224	K220-H222 PolarHBondContact O-N 2.76Å; H222-R224 PolarHBondContact O-N 2.83Å
223	T	55.4	Low	68.8	Low	112 Å²	112	149.5 Å²	149.5	69%	0.687	72%	0.716	S	S	*	*			trans	-63.7	94.2	166	42.6	0	0	0	0	106.9	R221 T225	R221-T223 HydrophobicContact CB-CG2 4.44Å; R221-T223 PolarHBondContact O-N 2.84Å; T223-T225 PolarHBondContact O-N 3.24Å
224	R	53.2	Low	66.9	Low	224 Å²	224	153.5 Å²	153.5	85%	0.845	73%	0.732	S	S	*	*			trans	-77.3	97.8	166.6	-159.6	-179.2	-166.6	167.9	3.5	106	H222	H222-R224 PolarHBondContact O-N 2.83Å
225	T	46.6	Very low	65.1	Low	201 Å²	201	150.2 Å²	150.2	100%	1.233	73%	0.734	S	S	*	*			trans	-125.5	0	160.1	40.6	0	0	0	0	107.5	T223	T223-T225 PolarHBondContact O-N 3.24Å

Retrieved 225 of 225 residues in 139.9 ms (Link to these results)

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