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Signal peptidase complex subunit 3

Essential component of the signal peptidase complex (SPC) which catalyzes the cleavage of N-terminal signal sequences from nascent proteins as they are translocated into the lumen of the endoplasmic reticulum (By similarity). Essential for the SPC catalytic activity, possibly by stabilizing and positioning the active center of the complex close to the lumenal surface (By similarity).

AlphaFold DB , UniProt , Accession Q6ZWQ7, Species MOUSE (Mus musculus, Mouse), Gene Spcs3, Length 180 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	64.2	Low	88.9	Confident	235 Å²	235	116.1 Å²	116.1	100%	1.158	63%	0.63	S	S	*	*				0	128.8	0	-68.8	164.3	107.3	0	0	107.8	T3	M1-T3 PolarHBondContact O-N 3.44Å; M1-T3 VanDerWaalsContact O-N 3.11Å
2	N	78.7	Confident	89.4	Confident	141 Å²	141	118.3 Å²	118.3	75%	0.754	63%	0.63	S	S	*	*			trans	-61.8	113.7	175.2	-70.5	-45.5	0	0	0	109.1	S6 R7	N2-S6 WeakPolarHBondContact CA-OG 3.02Å; N2-R7 HydrophobicContact CB-CG 4.31Å
3	T	90.4	Very high	89.9	Confident	84 Å²	84	113 Å²	113	52%	0.515	61%	0.613	S	S	.	*			trans	-69.7	157.9	175.9	60.9	0	0	0	0	110.1	M1 L5 S6 R7	M1-T3 PolarHBondContact O-N 3.44Å; M1-T3 VanDerWaalsContact O-N 3.11Å; T3-L5 PolarHBondContact O-N 3.14Å; T3-S6 PolarHBondContact N-OG 3.16Å; T3-S6 PolarHBondContact O-N 3.27Å; T3-S6 PolarHBondContact O-OG 2.91Å; T3-S6 PolarHBondContact OG1-N 3Å; T3-S6 VanDerWaalsContact OG1-N 3.16Å; T3-R7 PolarHBondContact O-N 3.04Å
4	V	92	Very high	90.3	Very high	120 Å²	120	114.6 Å²	114.6	73%	0.727	61%	0.611	S	S	*	*	H	α-helix	trans	-53.7	-39.1	173.4	175.7	0	0	0	0	110.9	S6 R7 A8	V4-S6 PolarHBondContact O-N 3Å; V4-R7 PolarHBondContact O-N 3.07Å; V4-A8 PolarHBondContact O-N 3.17Å
5	L	91.4	Very high	90.8	Very high	141 Å²	141	111.3 Å²	111.3	74%	0.738	60%	0.601	S	S	*	*	H	α-helix	trans	-60.7	-43.7	175.1	-65.4	175.7	0	0	0	112.7	T3 R7 A8 N9	T3-L5 PolarHBondContact O-N 3.14Å; L5-R7 VanDerWaalsContact C-N 3.32Å; L5-R7 PolarHBondContact O-N 3.28Å; L5-A8 PolarHBondContact O-N 2.77Å; L5-N9 WeakPolarHBondContact O-CB 3.45Å; L5-N9 PolarHBondContact O-N 3.13Å
6	S	93	Very high	91.2	Very high	41 Å²	41	110.9 Å²	110.9	29%	0.287	60%	0.598	S	S	.	*	H	α-helix	trans	-63.6	-36.4	178.3	69.7	0	0	0	0	112.9	N2 T3 V4 S10	N2-S6 WeakPolarHBondContact CA-OG 3.02Å; T3-S6 PolarHBondContact N-OG 3.16Å; T3-S6 PolarHBondContact O-N 3.27Å; T3-S6 PolarHBondContact O-OG 2.91Å; T3-S6 PolarHBondContact OG1-N 3Å; T3-S6 VanDerWaalsContact OG1-N 3.16Å; V4-S6 PolarHBondContact O-N 3Å; S6-S10 PolarHBondContact O-N 3.36Å; S6-S10 VanDerWaalsContact O-N 3.07Å
7	R	93	Very high	91.5	Very high	166 Å²	166	108.2 Å²	108.2	63%	0.626	59%	0.589	S	S	*	*	H	α-helix	trans	-72.1	-39.5	177	-64.9	174.7	64.2	-168.4	-0.8	112.1	N2 T3 V4 L5 S10 L11	N2-R7 HydrophobicContact CB-CG 4.31Å; T3-R7 PolarHBondContact O-N 3.04Å; V4-R7 PolarHBondContact O-N 3.07Å; L5-R7 VanDerWaalsContact C-N 3.32Å; L5-R7 PolarHBondContact O-N 3.28Å; R7-S10 PolarHBondContact O-N 3.34Å; R7-S10 PolarHBondContact O-OG 2.9Å; R7-L11 WeakPolarHBondContact O-CG 3.47Å; R7-L11 PolarHBondContact O-N 3.39Å; R7-L11 VanDerWaalsContact O-N 3.17Å
8	A	93.6	Very high	91.8	Very high	56 Å²	56	105.6 Å²	105.6	46%	0.463	58%	0.577	S	S	.	*	H	α-helix	trans	-64.2	-43.1	174.8	0	0	0	0	0	111.1	V4 L5 S10 L11 F12	V4-A8 PolarHBondContact O-N 3.17Å; L5-A8 PolarHBondContact O-N 2.77Å; A8-S10 PolarHBondContact O-N 3.22Å; A8-L11 PolarHBondContact O-N 3.15Å; A8-F12 WeakPolarHBondContact O-CB 3.28Å; A8-F12 PolarHBondContact O-N 2.83Å
9	N	93.6	Very high	92.1	Very high	108 Å²	108	105.9 Å²	105.9	58%	0.578	58%	0.576	S	S	*	*	H	α-helix	trans	-60.5	-43	175.6	-177.9	69.3	0	0	0	112.4	L5 F12 A13	L5-N9 WeakPolarHBondContact O-CB 3.45Å; L5-N9 PolarHBondContact O-N 3.13Å; N9-F12 PolarHBondContact O-N 2.57Å; N9-A13 VanDerWaalsContact O-CB 3.27Å; N9-A13 WeakPolarHBondContact O-CB 3.13Å; N9-A13 PolarHBondContact O-N 2.87Å
10	S	93.5	Very high	92.3	Very high	68 Å²	68	103.2 Å²	103.2	48%	0.476	57%	0.568	S	S	.	*	H	α-helix	trans	-66.1	-39.9	179.2	64.9	0	0	0	0	112.7	S6 R7 A8 F14	S6-S10 PolarHBondContact O-N 3.36Å; S6-S10 VanDerWaalsContact O-N 3.07Å; R7-S10 PolarHBondContact O-N 3.34Å; R7-S10 PolarHBondContact O-OG 2.9Å; A8-S10 PolarHBondContact O-N 3.22Å; S10-F14 VanDerWaalsContact O-CB 3.28Å; S10-F14 WeakPolarHBondContact O-CB 2.8Å; S10-F14 PolarHBondContact O-N 3.42Å
11	L	94.3	Very high	92.5	Very high	117 Å²	117	101.4 Å²	101.4	61%	0.613	57%	0.567	S	S	*	*	H	α-helix	trans	-63.9	-43.1	174.6	-70.1	172.5	0	0	0	111.9	R7 A8 S15	R7-L11 WeakPolarHBondContact O-CG 3.47Å; R7-L11 PolarHBondContact O-N 3.39Å; R7-L11 VanDerWaalsContact O-N 3.17Å; A8-L11 PolarHBondContact O-N 3.15Å; L11-S15 WeakPolarHBondContact O-CB 3.37Å; L11-S15 PolarHBondContact O-N 3.03Å; L11-S15 PolarHBondContact O-OG 3.18Å
12	F	95.7	Very high	94	Very high	143 Å²	143	95.2 Å²	95.2	63%	0.627	54%	0.538	S	S	*	.	H	α-helix	trans	-65.1	-47.9	177.3	-176.5	-99.1	0	0	0	111.8	A8 N9 F14 S15 L16	A8-F12 WeakPolarHBondContact O-CB 3.28Å; A8-F12 PolarHBondContact O-N 2.83Å; N9-F12 PolarHBondContact O-N 2.57Å; F12-F14 VanDerWaalsContact C-N 3.34Å; F12-F14 PolarHBondContact O-N 3.3Å; F12-S15 PolarHBondContact O-N 3.34Å; F12-L16 WeakPolarHBondContact O-CB 3.08Å; F12-L16 PolarHBondContact O-N 2.84Å
13	A	95.5	Very high	94.8	Very high	49 Å²	49	91.7 Å²	91.7	41%	0.405	52%	0.522	S	S	.	.	H	α-helix	trans	-60.8	-41.2	178	0	0	0	0	0	112.3	N9 L16 S17	N9-A13 VanDerWaalsContact O-CB 3.27Å; N9-A13 WeakPolarHBondContact O-CB 3.13Å; N9-A13 PolarHBondContact O-N 2.87Å; A13-L16 PolarHBondContact O-N 2.95Å; A13-S17 PolarHBondContact O-N 3.03Å; A13-S17 PolarHBondContact O-OG 2.79Å
14	F	95.8	Very high	95	Very high	135 Å²	135	93.5 Å²	93.5	59%	0.592	52%	0.523	S	S	*	.	H	α-helix	trans	-65.6	-43.6	174.6	178.5	-104.1	0	0	0	112	S10 F12 L16 S17 V18	S10-F14 VanDerWaalsContact O-CB 3.28Å; S10-F14 WeakPolarHBondContact O-CB 2.8Å; S10-F14 PolarHBondContact O-N 3.42Å; F12-F14 VanDerWaalsContact C-N 3.34Å; F12-F14 PolarHBondContact O-N 3.3Å; F14-L16 VanDerWaalsContact C-N 3.31Å; F14-L16 PolarHBondContact O-N 2.79Å; F14-S17 PolarHBondContact O-N 3.05Å; F14-S17 PolarHBondContact O-OG 2.87Å; F14-V18 HydrophobicContact CD1-CG2 4.4Å; F14-V18 HydrophobicContact CD2-CG2 4.46Å; F14-V18 HydrophobicContact CE1-CG2 3.97Å; F14-V18 HydrophobicContact CE2-CG2 4.03Å; F14-V18 HydrophobicContact CZ-CG2 3.77Å; F14-V18 WeakPolarHBondContact O-CG2 3.28Å; F14-V18 PolarHBondContact O-N 2.79Å
15	S	97.1	Very high	95.1	Very high	66 Å²	66	89.2 Å²	89.2	46%	0.462	50%	0.503	S	S	.	.	H	α-helix	trans	-62	-41.7	177.4	-57.2	0	0	0	0	111.3	L11 F12 V18 M19	L11-S15 WeakPolarHBondContact O-CB 3.37Å; L11-S15 PolarHBondContact O-N 3.03Å; L11-S15 PolarHBondContact O-OG 3.18Å; F12-S15 PolarHBondContact O-N 3.34Å; S15-V18 PolarHBondContact O-N 2.99Å; S15-M19 WeakPolarHBondContact O-CB 3.33Å; S15-M19 VanDerWaalsContact O-CG 3.29Å; S15-M19 WeakPolarHBondContact O-CG 3.41Å; S15-M19 PolarHBondContact O-N 2.9Å
16	L	97	Very high	95.1	Very high	104 Å²	104	84.8 Å²	84.8	55%	0.545	48%	0.483	S	S	.	.	H	α-helix	trans	-65.2	-40.6	177.3	-175.8	63.3	0	0	0	112	F12 A13 F14 M19 A20	F12-L16 WeakPolarHBondContact O-CB 3.08Å; F12-L16 PolarHBondContact O-N 2.84Å; A13-L16 PolarHBondContact O-N 2.95Å; F14-L16 VanDerWaalsContact C-N 3.31Å; F14-L16 PolarHBondContact O-N 2.79Å; L16-M19 PolarHBondContact O-N 2.96Å; L16-A20 WeakPolarHBondContact O-CB 3.4Å; L16-A20 PolarHBondContact O-N 2.78Å
17	S	96.5	Very high	95.1	Very high	65 Å²	65	85.8 Å²	85.8	46%	0.455	48%	0.482	S	S	.	.	H	α-helix	trans	-67.4	-39.6	178.5	69	0	0	0	0	112.2	A13 F14 A20 A21	A13-S17 PolarHBondContact O-N 3.03Å; A13-S17 PolarHBondContact O-OG 2.79Å; F14-S17 PolarHBondContact O-N 3.05Å; F14-S17 PolarHBondContact O-OG 2.87Å; S17-A20 PolarHBondContact O-N 3Å; S17-A21 PolarHBondContact O-N 3.22Å
18	V	97.4	Very high	95.1	Very high	61 Å²	61	81.7 Å²	81.7	37%	0.37	47%	0.472	S	S	.	.	H	α-helix	trans	-62.9	-46.5	173.5	173.9	0	0	0	0	110.7	F14 S15 A20 A21 L22	F14-V18 HydrophobicContact CD1-CG2 4.4Å; F14-V18 HydrophobicContact CD2-CG2 4.46Å; F14-V18 HydrophobicContact CE1-CG2 3.97Å; F14-V18 HydrophobicContact CE2-CG2 4.03Å; F14-V18 HydrophobicContact CZ-CG2 3.77Å; F14-V18 WeakPolarHBondContact O-CG2 3.28Å; F14-V18 PolarHBondContact O-N 2.79Å; S15-V18 PolarHBondContact O-N 2.99Å; V18-A20 VanDerWaalsContact C-N 3.35Å; V18-A20 PolarHBondContact O-N 3.41Å; V18-A21 PolarHBondContact O-N 3.32Å; V18-L22 HydrophobicContact CG1-CD1 4.19Å; V18-L22 WeakPolarHBondContact O-CG 3.04Å; V18-L22 PolarHBondContact O-N 2.88Å
19	M	96.4	Very high	95	Very high	113 Å²	113	82.7 Å²	82.7	56%	0.557	47%	0.472	S	S	*	.	H	α-helix	trans	-61.1	-42.1	176.4	-72.9	-63.3	-65.4	0	0	112	S15 L16 A21 L22 T23	S15-M19 WeakPolarHBondContact O-CB 3.33Å; S15-M19 VanDerWaalsContact O-CG 3.29Å; S15-M19 WeakPolarHBondContact O-CG 3.41Å; S15-M19 PolarHBondContact O-N 2.9Å; L16-M19 PolarHBondContact O-N 2.96Å; M19-A21 PolarHBondContact O-N 2.62Å; M19-L22 PolarHBondContact O-N 2.55Å; M19-T23 WeakPolarHBondContact O-CG2 3.28Å; M19-T23 PolarHBondContact O-N 3.26Å; M19-T23 PolarHBondContact O-OG1 2.59Å
20	A	96.7	Very high	95	Very high	51 Å²	51	77.8 Å²	77.8	42%	0.421	45%	0.446	S	S	.	.	H	α-helix	trans	-63	-40.1	176.3	0	0	0	0	0	112.3	L16 S17 V18 T23 F24	L16-A20 WeakPolarHBondContact O-CB 3.4Å; L16-A20 PolarHBondContact O-N 2.78Å; S17-A20 PolarHBondContact O-N 3Å; V18-A20 VanDerWaalsContact C-N 3.35Å; V18-A20 PolarHBondContact O-N 3.41Å; A20-T23 WeakPolarHBondContact CA-OG1 3.46Å; A20-T23 PolarHBondContact O-OG1 2.87Å; A20-F24 VanDerWaalsContact O-CB 3.25Å; A20-F24 WeakPolarHBondContact O-CB 3.47Å; A20-F24 PolarHBondContact O-N 3.31Å
21	A	96.8	Very high	94.7	Very high	65 Å²	65	75.9 Å²	75.9	54%	0.537	43%	0.434	S	S	.	.	H	α-helix	trans	-65	-40.9	175.2	0	0	0	0	0	111.8	S17 V18 M19 F24 G25	S17-A21 PolarHBondContact O-N 3.22Å; V18-A21 PolarHBondContact O-N 3.32Å; M19-A21 PolarHBondContact O-N 2.62Å; A21-F24 PolarHBondContact O-N 3.08Å; A21-G25 PolarHBondContact O-N 2.8Å
22	L	94.9	Very high	94.4	Very high	105 Å²	105	79.3 Å²	79.3	55%	0.55	45%	0.445	S	S	.	.	H	α-helix	trans	-66.9	-44.3	177	-69.8	174.7	0	0	0	112.3	V18 M19 F24 G25 C26	V18-L22 HydrophobicContact CG1-CD1 4.19Å; V18-L22 WeakPolarHBondContact O-CG 3.04Å; V18-L22 PolarHBondContact O-N 2.88Å; M19-L22 PolarHBondContact O-N 2.55Å; L22-F24 VanDerWaalsContact C-N 3.31Å; L22-F24 PolarHBondContact O-N 2.87Å; L22-G25 PolarHBondContact O-N 3.19Å; L22-C26 PolarHBondContact O-N 2.77Å; L22-C26 PolarHBondContact O-SG 2.79Å
23	T	95.5	Very high	94.1	Very high	67 Å²	67	75.8 Å²	75.8	41%	0.411	43%	0.429	S	S	.	.	H	α-helix	trans	-64.3	-38.7	177	56.4	0	0	0	0	111.4	M19 A20 C26 F27	M19-T23 WeakPolarHBondContact O-CG2 3.28Å; M19-T23 PolarHBondContact O-N 3.26Å; M19-T23 PolarHBondContact O-OG1 2.59Å; A20-T23 WeakPolarHBondContact CA-OG1 3.46Å; A20-T23 PolarHBondContact O-OG1 2.87Å; T23-C26 WeakPolarHBondContact O-CB 3.41Å; T23-C26 PolarHBondContact O-N 3.24Å; T23-F27 PolarHBondContact O-N 2.81Å
24	F	95.4	Very high	93.7	Very high	123 Å²	123	79.7 Å²	79.7	54%	0.539	44%	0.443	S	S	.	.	H	α-helix	trans	-65	-39	173.1	-172.1	-114.6	0	0	0	112.3	A20 A21 L22 F27 I28	A20-F24 VanDerWaalsContact O-CB 3.25Å; A20-F24 WeakPolarHBondContact O-CB 3.47Å; A20-F24 PolarHBondContact O-N 3.31Å; A21-F24 PolarHBondContact O-N 3.08Å; L22-F24 VanDerWaalsContact C-N 3.31Å; L22-F24 PolarHBondContact O-N 2.87Å; F24-F27 HydrophobicContact CD2-CD1 4.19Å; F24-F27 HydrophobicContact CE2-CD1 4.21Å; F24-F27 WeakPolarHBondContact O-CB 3.15Å; F24-F27 PolarHBondContact O-N 2.86Å; F24-I28 HydrophobicContact CD1-CD1 3.72Å; F24-I28 HydrophobicContact CD1-CG1 4.47Å; F24-I28 HydrophobicContact CE1-CD1 3.2Å; F24-I28 HydrophobicContact CE1-CG1 4.17Å; F24-I28 HydrophobicContact CE2-CD1 4.2Å; F24-I28 HydrophobicContact CE2-CG1 4.38Å; F24-I28 HydrophobicContact CG-CD1 4.43Å; F24-I28 HydrophobicContact CZ-CD1 3.48Å; F24-I28 VanDerWaalsContact CZ-CD1 3.48Å; F24-I28 HydrophobicContact CZ-CG1 4.12Å; F24-I28 PolarHBondContact O-N 2.9Å
25	G	93.9	Very high	93.4	Very high	30 Å²	30	74.1 Å²	74.1	31%	0.309	42%	0.418	S	S	.	.	H	α-helix	trans	-61.2	-44.4	172	0	0	0	0	0	112.9	A21 L22 F27 I28 T29	A21-G25 PolarHBondContact O-N 2.8Å; L22-G25 PolarHBondContact O-N 3.19Å; G25-F27 VanDerWaalsContact C-N 3.3Å; G25-F27 PolarHBondContact O-N 2.83Å; G25-I28 PolarHBondContact O-N 2.8Å; G25-T29 WeakPolarHBondContact O-CB 3.25Å; G25-T29 VanDerWaalsContact O-CG2 3.24Å; G25-T29 WeakPolarHBondContact O-CG2 3.42Å; G25-T29 PolarHBondContact O-N 3.22Å; G25-T29 PolarHBondContact O-OG1 3.36Å
26	C	92.1	Very high	93.1	Very high	47 Å²	47	73.8 Å²	73.8	32%	0.318	42%	0.416	S	S	.	.	H	α-helix	trans	-59.5	-41.4	173.1	-71.9	0	0	0	0	111.9	L22 T23 T29 T30	L22-C26 PolarHBondContact O-N 2.77Å; L22-C26 PolarHBondContact O-SG 2.79Å; T23-C26 WeakPolarHBondContact O-CB 3.41Å; T23-C26 PolarHBondContact O-N 3.24Å; C26-T29 PolarHBondContact O-OG1 3.46Å; C26-T29 VanDerWaalsContact O-OG1 3.11Å; C26-T30 WeakPolarHBondContact O-CG2 3.25Å; C26-T30 PolarHBondContact O-N 2.88Å; C26-T30 PolarHBondContact O-OG1 3.29Å
27	F	93.1	Very high	93	Very high	62 Å²	62	69.2 Å²	69.2	27%	0.272	39%	0.392	S	S	.	.	H	α-helix	trans	-62	-55.6	175.9	170.3	-122	0	0	0	111.8	T23 F24 G25 T29 T30 A31 I156	T23-F27 PolarHBondContact O-N 2.81Å; F24-F27 HydrophobicContact CD2-CD1 4.19Å; F24-F27 HydrophobicContact CE2-CD1 4.21Å; F24-F27 WeakPolarHBondContact O-CB 3.15Å; F24-F27 PolarHBondContact O-N 2.86Å; G25-F27 VanDerWaalsContact C-N 3.3Å; G25-F27 PolarHBondContact O-N 2.83Å; F27-T29 VanDerWaalsContact C-N 3.33Å; F27-T29 PolarHBondContact O-N 3.17Å; F27-T30 PolarHBondContact O-N 2.86Å; F27-T30 VanDerWaalsContact O-N 3.12Å; F27-T30 PolarHBondContact O-OG1 3Å; F27-A31 HydrophobicContact CD2-CB 4.37Å; F27-A31 HydrophobicContact CE2-CB 4.02Å; F27-A31 HydrophobicContact CZ-CB 4.35Å; F27-A31 WeakPolarHBondContact O-CB 3.07Å; F27-A31 PolarHBondContact O-N 3Å; F27-I156 HydrophobicContact CE2-CB 4.44Å; F27-I156 HydrophobicContact CE2-CG1 4.19Å; F27-I156 HydrophobicContact CE2-CG2 3.91Å; F27-I156 HydrophobicContact CZ-CG2 4.21Å
28	I	92.8	Very high	92.9	Very high	81 Å²	81	70.6 Å²	70.6	42%	0.415	40%	0.4	S	S	.	.	H	α-helix	trans	-58.8	-44.5	-177.5	-71.7	177.8	0	0	0	111.7	F24 G25 T30	F24-I28 HydrophobicContact CD1-CD1 3.72Å; F24-I28 HydrophobicContact CD1-CG1 4.47Å; F24-I28 HydrophobicContact CE1-CD1 3.2Å; F24-I28 HydrophobicContact CE1-CG1 4.17Å; F24-I28 HydrophobicContact CE2-CD1 4.2Å; F24-I28 HydrophobicContact CE2-CG1 4.38Å; F24-I28 HydrophobicContact CG-CD1 4.43Å; F24-I28 HydrophobicContact CZ-CD1 3.48Å; F24-I28 VanDerWaalsContact CZ-CD1 3.48Å; F24-I28 HydrophobicContact CZ-CG1 4.12Å; F24-I28 PolarHBondContact O-N 2.9Å; G25-I28 PolarHBondContact O-N 2.8Å; I28-T30 PolarHBondContact O-N 3.02Å; I28-T30 VanDerWaalsContact O-N 3.13Å
29	T	91.9	Very high	92.9	Very high	76 Å²	76	68.1 Å²	68.1	47%	0.466	39%	0.385	S	S	.	.	H	α-helix	trans	-66.9	-14.3	-177.2	53.8	0	0	0	0	113.8	G25 C26 F27	G25-T29 WeakPolarHBondContact O-CB 3.25Å; G25-T29 VanDerWaalsContact O-CG2 3.24Å; G25-T29 WeakPolarHBondContact O-CG2 3.42Å; G25-T29 PolarHBondContact O-N 3.22Å; G25-T29 PolarHBondContact O-OG1 3.36Å; C26-T29 PolarHBondContact O-OG1 3.46Å; C26-T29 VanDerWaalsContact O-OG1 3.11Å; F27-T29 VanDerWaalsContact C-N 3.33Å; F27-T29 PolarHBondContact O-N 3.17Å
30	T	92.3	Very high	92.8	Very high	6 Å²	6	72.3 Å²	72.3	4%	0.037	39%	0.394	C	S	.	.	H	α-helix	trans	-121.2	-10.5	-176.2	62.1	0	0	0	0	114.3	C26 F27 I28 F32 K33 R35 W80 N81	C26-T30 WeakPolarHBondContact O-CG2 3.25Å; C26-T30 PolarHBondContact O-N 2.88Å; C26-T30 PolarHBondContact O-OG1 3.29Å; F27-T30 PolarHBondContact O-N 2.86Å; F27-T30 VanDerWaalsContact O-N 3.12Å; F27-T30 PolarHBondContact O-OG1 3Å; I28-T30 PolarHBondContact O-N 3.02Å; I28-T30 VanDerWaalsContact O-N 3.13Å; T30-F32 VanDerWaalsContact C-N 3.31Å; T30-F32 PolarHBondContact O-N 2.78Å; T30-K33 PolarHBondContact O-N 3.47Å; T30-R35 PolarHBondContact O-NH1 2.95Å; T30-R35 PolarHBondContact O-NH2 3.06Å; T30-W80 HydrophobicContact CG2-CZ2 3.99Å; T30-N81 HydrophobicContact CG2-CB 3.73Å; T30-N81 PolarHBondContact OG1-ND2 3.12Å
31	A	88.4	Confident	92.8	Very high	27 Å²	27	71.1 Å²	71.1	22%	0.223	38%	0.381	C	S	.	.	H	α-helix	trans	-62	-33.6	-177.7	0	0	0	0	0	113.6	F27	F27-A31 HydrophobicContact CD2-CB 4.37Å; F27-A31 HydrophobicContact CE2-CB 4.02Å; F27-A31 HydrophobicContact CZ-CB 4.35Å; F27-A31 WeakPolarHBondContact O-CB 3.07Å; F27-A31 PolarHBondContact O-N 3Å
32	F	87	Confident	92.8	Very high	189 Å²	189	73.4 Å²	73.4	83%	0.829	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	11.7	-174	-55.7	-75.6	0	0	0	114.3	T30	T30-F32 VanDerWaalsContact C-N 3.31Å; T30-F32 PolarHBondContact O-N 2.78Å
33	K	88.9	Confident	92.8	Very high	70 Å²	70	69.4 Å²	69.4	30%	0.304	36%	0.36	S	S	.	.			trans	-77.1	128.3	177.2	-71	-173.8	179	-179.7	0	110.9	T30 R35 D79	T30-K33 PolarHBondContact O-N 3.47Å; K33-R35 PolarHBondContact O-NH1 2.89Å; K33-R35 VanDerWaalsContact O-NH1 3.14Å; K33-D79 IonicContact NZ-OD2 3.51Å
34	D	87.6	Confident	92.7	Very high	130 Å²	130	68.8 Å²	68.8	70%	0.695	36%	0.358	S	S	*	.			trans	-68.1	134.8	166.7	-168.2	-5.2	0	0	0	109.7	S36	D34-S36 WeakPolarHBondContact OD1-CB 3.38Å; D34-S36 PolarHBondContact OD1-N 3.26Å; D34-S36 PolarHBondContact OD1-OG 2.99Å; D34-S36 PolarHBondContact OD2-OG 3.5Å
35	R	90.6	Very high	92.7	Very high	19 Å²	19	68.4 Å²	68.4	7%	0.072	35%	0.353	C	S	.	.			trans	-128.6	19.2	-175.9	-71.1	-178.7	-179.7	88.4	-3.4	111.3	T30 K33 I77 D79 W148 V160	T30-R35 PolarHBondContact O-NH1 2.95Å; T30-R35 PolarHBondContact O-NH2 3.06Å; K33-R35 PolarHBondContact O-NH1 2.89Å; K33-R35 VanDerWaalsContact O-NH1 3.14Å; R35-I77 HydrophobicContact CB-CG2 4.06Å; R35-I77 HydrophobicContact CG-CG2 4.14Å; R35-D79 IonicContact CZ-OD2 3.73Å; R35-D79 IonicContact NE-OD2 3.88Å; R35-D79 IonicContact NH2-OD2 2.82Å; R35-D79 PolarHBondContact NH2-OD2 2.62Å; R35-W148 VanDerWaalsContact O-CZ2 3.3Å; R35-W148 WeakPolarHBondContact O-CZ2 3.43Å; R35-W148 PolarHBondContact O-NE1 2.96Å; R35-V160 HydrophobicContact CB-CG2 4.3Å
36	S	90.2	Very high	92.7	Very high	58 Å²	58	69 Å²	69	41%	0.406	35%	0.349	S	S	.	.			trans	-74.2	139.7	173.7	64.7	0	0	0	0	110.9	D34	D34-S36 WeakPolarHBondContact OD1-CB 3.38Å; D34-S36 PolarHBondContact OD1-N 3.26Å; D34-S36 PolarHBondContact OD1-OG 2.99Å; D34-S36 PolarHBondContact OD2-OG 3.5Å
37	V	93.8	Very high	92.7	Very high	9 Å²	9	68.3 Å²	68.3	6%	0.055	34%	0.342	C	S	.	.			trans	-140.1	142.8	-179.4	168.1	0	0	0	0	108.5	V39 D73 I77 W148 G162 S163	V37-V39 PolarHBondContact O-N 2.97Å; V37-D73 WeakPolarHBondContact CG1-O 3.37Å; V37-I77 HydrophobicContact CB-CD1 4.34Å; V37-I77 HydrophobicContact CG2-CD1 3.67Å; V37-I77 HydrophobicContact CG2-CG1 3.6Å; V37-W148 HydrophobicContact CB-CH2 4.13Å; V37-W148 HydrophobicContact CB-CZ2 4.26Å; V37-G162 WeakPolarHBondContact O-CA 3.09Å; V37-S163 PolarHBondContact O-N 2.86Å; V37-S163 PolarHBondContact O-OG 2.92Å
38	P	95.3	Very high	92.7	Very high	94 Å²	94	65.4 Å²	65.4	61%	0.61	33%	0.329	S	S	*	.	B	Isolated β-bridge	trans	-64.9	130.3	173	27.4	-34.9	0	0	0	111.9	S163	P38-S163 WeakPolarHBondContact CA-O 3.37Å; P38-S163 WeakPolarHBondContact CA-OG 3.35Å
39	V	96.3	Very high	92.7	Very high	8 Å²	8	64.6 Å²	64.6	5%	0.048	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	131.2	178.4	-176.8	0	0	0	0	109	V37 L41 I70 A72 L146 W148 S163	V37-V39 PolarHBondContact O-N 2.97Å; V39-L41 HydrophobicContact CG1-CD2 3.95Å; V39-L41 HydrophobicContact CG1-CG 3.91Å; V39-I70 HydrophobicContact CG1-CG2 4.16Å; V39-A72 HydrophobicContact CG1-CB 4.32Å; V39-A72 HydrophobicContact CG2-CB 4.11Å; V39-L146 HydrophobicContact CG1-CB 3.96Å; V39-L146 HydrophobicContact CG1-CD2 3.7Å; V39-L146 HydrophobicContact CG1-CG 4.5Å; V39-L146 HydrophobicContact CG2-CB 4.44Å; V39-L146 HydrophobicContact CG2-CD2 4Å; V39-W148 HydrophobicContact CG2-CH2 4.14Å; V39-W148 HydrophobicContact CG2-CZ3 3.88Å; V39-S163 PolarHBondContact N-O 3.38Å; V39-S163 VanDerWaalsContact N-O 3.12Å
40	R	96.1	Very high	92.6	Very high	201 Å²	201	62.9 Å²	62.9	76%	0.758	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	117.4	169.9	-64.8	-178.7	-178.7	174.8	0.4	108.8	T71	R40-T71 PolarHBondContact N-O 2.83Å; R40-T71 PolarHBondContact O-N 3.5Å
41	L	96.1	Very high	92.4	Very high	27 Å²	27	64.8 Å²	64.8	14%	0.141	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	135.3	175.4	-64.5	173.6	0	0	0	109.1	V39 I70 L89 L144 L146 V166	V39-L41 HydrophobicContact CG1-CD2 3.95Å; V39-L41 HydrophobicContact CG1-CG 3.91Å; L41-I70 HydrophobicContact CD2-CB 4.11Å; L41-I70 HydrophobicContact CD2-CD1 3.9Å; L41-I70 HydrophobicContact CD2-CG1 3.61Å; L41-I70 HydrophobicContact CD2-CG2 3.89Å; L41-L89 HydrophobicContact CD1-CD1 4.08Å; L41-L89 HydrophobicContact CD2-CD1 4.06Å; L41-L144 HydrophobicContact CD1-CB 4.44Å; L41-L144 WeakPolarHBondContact CD1-O 3.42Å; L41-L146 HydrophobicContact CD2-CB 4.49Å; L41-V166 HydrophobicContact CB-CB 4.29Å; L41-V166 HydrophobicContact CB-CG1 3.63Å; L41-V166 HydrophobicContact CD1-CG1 4.35Å
42	H	95.9	Very high	92.1	Very high	113 Å²	113	68.1 Å²	68.1	52%	0.523	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	140.2	171.2	-178.5	67.6	0	0	0	109.2	F68 D69	H42-F68 CarbonylContact O-C 3.6Å; H42-F68 VanDerWaalsContact O-CA 3.24Å; H42-F68 WeakPolarHBondContact O-CA 3.12Å; H42-F68 WeakPolarHBondContact O-CB 3.32Å; H42-D69 HydrophobicContact CB-CB 4.24Å; H42-D69 IonicContact CD2-OD2 3.91Å; H42-D69 PolarHBondContact N-O 2.99Å; H42-D69 PolarHBondContact O-N 3.01Å
43	V	95.7	Very high	91.3	Very high	21 Å²	21	60.8 Å²	60.8	13%	0.127	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	113.7	178.6	178.1	0	0	0	0	108.1	I46 I66 L144 V166 V168	V43-I46 HydrophobicContact CG1-CD1 3.96Å; V43-I46 HydrophobicContact CG1-CG1 3.65Å; V43-I66 HydrophobicContact CG1-CG2 3.79Å; V43-I66 HydrophobicContact CG2-CG2 4.43Å; V43-L144 HydrophobicContact CG2-CD1 3.43Å; V43-L144 VanDerWaalsContact CG2-CD1 3.43Å; V43-V166 HydrophobicContact CG2-CG1 4Å; V43-V168 HydrophobicContact CB-CG1 3.92Å; V43-V168 HydrophobicContact CG1-CG1 4.37Å; V43-V168 HydrophobicContact CG2-CG1 3.82Å; V43-V168 HydrophobicContact CG2-CG2 4.44Å
44	S	94.1	Very high	90.3	Very high	54 Å²	54	66.2 Å²	66.2	38%	0.378	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	-37.7	-175.6	-46.1	0	0	0	0	111.7	T67	S44-T67 PolarHBondContact N-O 2.97Å
45	R	94.1	Very high	89.4	Confident	114 Å²	114	66.6 Å²	66.6	43%	0.43	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	140.8	-174.8	-169.5	174	61.6	121.7	19.1	112.5	M47 T67	R45-M47 HydrophobicContact CG-CG 4.35Å; R45-M47 PolarHBondContact NH1-SD 2.92Å; R45-T67 PolarHBondContact N-O 2.89Å; R45-T67 PolarHBondContact O-N 3.17Å
46	I	94.3	Very high	88.1	Confident	42 Å²	42	67.7 Å²	67.7	22%	0.215	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	132.6	176.7	-55.9	170.6	0	0	0	108	V43 F65 V168 P169 F170	V43-I46 HydrophobicContact CG1-CD1 3.96Å; V43-I46 HydrophobicContact CG1-CG1 3.65Å; I46-F65 CarbonylContact C-O 3.59Å; I46-F65 WeakPolarHBondContact CA-O 3.5Å; I46-V168 HydrophobicContact CD1-CB 3.76Å; I46-V168 HydrophobicContact CD1-CG2 3.59Å; I46-P169 WeakPolarHBondContact CD1-O 3.27Å; I46-F170 HydrophobicContact CG2-CD1 3.83Å; I46-F170 HydrophobicContact CG2-CD2 4.04Å; I46-F170 HydrophobicContact CG2-CE1 3.73Å; I46-F170 HydrophobicContact CG2-CE2 3.94Å; I46-F170 HydrophobicContact CG2-CG 3.99Å; I46-F170 HydrophobicContact CG2-CZ 3.79Å
47	M	93	Very high	86.9	Confident	34 Å²	34	70.1 Å²	70.1	17%	0.167	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	144.8	175.3	-36.8	-174.6	102.1	0	0	108.8	R45 G64 F65 E175	R45-M47 HydrophobicContact CG-CG 4.35Å; R45-M47 PolarHBondContact NH1-SD 2.92Å; M47-G64 CarbonylContact O-C 3.54Å; M47-G64 WeakPolarHBondContact O-CA 3.46Å; M47-F65 HydrophobicContact CB-CB 4.18Å; M47-F65 HydrophobicContact CG-CB 4.45Å; M47-F65 PolarHBondContact N-O 2.79Å; M47-F65 PolarHBondContact O-N 3.19Å; M47-E175 WeakPolarHBondContact CE-OE1 3.46Å
48	L	93.4	Very high	85.5	Confident	1 Å²	1	81.6 Å²	81.6	1%	0.005	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.2	179.1	-171.4	66.2	0	0	0	108.7	D62 L136 K137 F170 P171 Y174 E175	L48-D62 HydrophobicContact CD1-CB 3.97Å; L48-L136 HydrophobicContact CD1-CB 3.9Å; L48-L136 HydrophobicContact CD1-CD1 4.36Å; L48-K137 VanDerWaalsContact CD2-CA 3.46Å; L48-K137 HydrophobicContact CD2-CB 3.77Å; L48-K137 HydrophobicContact CD2-CG 4.16Å; L48-F170 HydrophobicContact CD1-CD1 4.08Å; L48-F170 HydrophobicContact CD1-CE1 4.27Å; L48-P171 HydrophobicContact CB-CG 3.75Å; L48-Y174 HydrophobicContact CB-CD1 4.38Å; L48-Y174 HydrophobicContact CD2-CD1 3.8Å; L48-Y174 HydrophobicContact CD2-CE1 3.57Å; L48-Y174 HydrophobicContact CG-CD1 3.71Å; L48-Y174 HydrophobicContact CG-CE1 3.74Å; L48-Y174 WeakPolarHBondContact O-CA 3.41Å; L48-E175 PolarHBondContact O-N 3Å
49	K	91.9	Very high	84.5	Confident	64 Å²	64	83 Å²	83	28%	0.278	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	151.9	173.9	-64	-170.3	-178.8	179.3	0	109.1	V51 L63 F65 E175	K49-V51 HydrophobicContact CB-CG2 4.14Å; K49-L63 HydrophobicContact CB-CB 4.48Å; K49-L63 PolarHBondContact N-O 2.73Å; K49-L63 PolarHBondContact O-N 3.38Å; K49-F65 HydrophobicContact CD-CE2 3.98Å; K49-F65 HydrophobicContact CG-CE2 4.27Å; K49-E175 VanDerWaalsContact CE-OE2 3.26Å; K49-E175 WeakPolarHBondContact CE-OE2 3.44Å; K49-E175 HydrophobicContact CG-CB 4.47Å
50	N	89.1	Confident	83.9	Confident	40 Å²	40	88.8 Å²	88.8	21%	0.214	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	116.3	171.8	-174.3	-67	0	0	0	107.1	R60 N134 Y174	N50-R60 VanDerWaalsContact OD1-CB 3.25Å; N50-R60 WeakPolarHBondContact OD1-CB 3.26Å; N50-R60 VanDerWaalsContact OD1-CD 3.25Å; N50-R60 WeakPolarHBondContact OD1-CD 3.38Å; N50-R60 WeakPolarHBondContact OD1-CG 3.35Å; N50-N134 PolarHBondContact ND2-OD1 3.22Å; N50-Y174 HydrophobicContact CB-CD1 3.87Å; N50-Y174 HydrophobicContact CB-CD2 3.97Å; N50-Y174 HydrophobicContact CB-CE1 3.85Å; N50-Y174 HydrophobicContact CB-CE2 3.93Å; N50-Y174 HydrophobicContact CB-CG 3.93Å; N50-Y174 PolarHBondContact ND2-OH 3.31Å
51	V	88	Confident	83.5	Confident	45 Å²	45	79.4 Å²	79.4	27%	0.273	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	149.4	-172.3	-177.3	0	0	0	0	108.9	K49 R60 S61 L63	K49-V51 HydrophobicContact CB-CG2 4.14Å; V51-R60 WeakPolarHBondContact O-CA 3.28Å; V51-S61 PolarHBondContact N-O 3.05Å; V51-S61 PolarHBondContact O-N 2.82Å; V51-L63 HydrophobicContact CG2-CB 3.98Å; V51-L63 HydrophobicContact CG2-CD2 3.89Å
52	E	82.5	Confident	83.3	Confident	98 Å²	98	78.1 Å²	78.1	46%	0.458	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	123.5	172.8	-74	169.9	-158	0	0	109.7	F54 R60	E52-F54 WeakPolarHBondContact O-CD2 3.39Å; E52-F54 WeakPolarHBondContact O-CE2 3.5Å; E52-F54 PolarHBondContact O-N 3.21Å; E52-R60 HydrophobicContact CG-CG 3.79Å; E52-R60 IonicContact OE1-CZ 3.67Å; E52-R60 IonicContact OE1-NE 3.41Å; E52-R60 PolarHBondContact OE1-NE 2.87Å; E52-R60 IonicContact OE1-NH2 3Å; E52-R60 PolarHBondContact OE1-NH2 2.98Å
53	D	70	Confident	83.1	Confident	34 Å²	34	73.3 Å²	73.3	18%	0.182	36%	0.363	C	S	.	.			trans	-77.7	115.7	176.8	-84	-1	0	0	0	110	T55 E59 S61 F130	D53-T55 VanDerWaalsContact C-N 3.25Å; D53-T55 PolarHBondContact O-N 2.92Å; D53-E59 PolarHBondContact N-O 3.44Å; D53-S61 WeakPolarHBondContact OD1-CB 3.34Å; D53-S61 WeakPolarHBondContact OD2-CB 3.44Å; D53-S61 PolarHBondContact OD2-OG 2.84Å; D53-F130 WeakPolarHBondContact OD1-CE1 3.48Å
54	F	69.2	Low	83	Confident	184 Å²	184	72.3 Å²	72.3	81%	0.807	36%	0.357	S	S	*	.	S	Bend	trans	-79.7	-8.7	177.9	-61	-76	0	0	0	113.3	E52	E52-F54 WeakPolarHBondContact O-CD2 3.39Å; E52-F54 WeakPolarHBondContact O-CE2 3.5Å; E52-F54 PolarHBondContact O-N 3.21Å
55	T	68.7	Low	82.9	Confident	139 Å²	139	72.5 Å²	72.5	85%	0.853	35%	0.351	S	S	*	.	S	Bend	trans	-97.1	-13.3	-174.9	50.5	0	0	0	0	113.7	D53	D53-T55 VanDerWaalsContact C-N 3.25Å; D53-T55 PolarHBondContact O-N 2.92Å
56	G	63.4	Low	83	Confident	41 Å²	41	67.1 Å²	67.1	42%	0.423	33%	0.331	S	S	.	.	S	Bend	trans	-120.6	-173.7	-175.8	0	0	0	0	0	114.2
57	P	63.4	Low	83.1	Confident	110 Å²	110	65.6 Å²	65.6	71%	0.714	32%	0.323	S	S	*	.	S	Bend	trans	-50.1	144.6	157	24.6	-30.9	0	0	0	107.7	E59	P57-E59 PolarHBondContact O-N 2.91Å
58	R	64.1	Low	83.2	Confident	250 Å²	250	64.1 Å²	64.1	94%	0.943	32%	0.316	S	S	*	.	S	Bend	trans	-61.9	54.2	-172.5	-72.3	176.8	143.9	170.2	-5.6	114.2
59	E	75.7	Confident	83.4	Confident	123 Å²	123	65.8 Å²	65.8	58%	0.575	33%	0.325	S	S	*	.			trans	-97.1	151.1	177.7	-165.2	154.6	-160.2	0	0	108.3	D53 P57	D53-E59 PolarHBondContact N-O 3.44Å; P57-E59 PolarHBondContact O-N 2.91Å
60	R	82.7	Confident	83.6	Confident	129 Å²	129	62.7 Å²	62.7	49%	0.487	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	131.4	-179.7	-88.8	178.7	165.3	-138.7	-3.6	108.6	N50 V51 E52	N50-R60 VanDerWaalsContact OD1-CB 3.25Å; N50-R60 WeakPolarHBondContact OD1-CB 3.26Å; N50-R60 VanDerWaalsContact OD1-CD 3.25Å; N50-R60 WeakPolarHBondContact OD1-CD 3.38Å; N50-R60 WeakPolarHBondContact OD1-CG 3.35Å; V51-R60 WeakPolarHBondContact O-CA 3.28Å; E52-R60 HydrophobicContact CG-CG 3.79Å; E52-R60 IonicContact OE1-CZ 3.67Å; E52-R60 IonicContact OE1-NE 3.41Å; E52-R60 PolarHBondContact OE1-NE 2.87Å; E52-R60 IonicContact OE1-NH2 3Å; E52-R60 PolarHBondContact OE1-NH2 2.98Å
61	S	88.9	Confident	83.9	Confident	5 Å²	5	63.8 Å²	63.8	4%	0.035	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	154.4	-177.2	-63.4	0	0	0	0	111.7	V51 D53 D131 G133	V51-S61 PolarHBondContact N-O 3.05Å; V51-S61 PolarHBondContact O-N 2.82Å; D53-S61 WeakPolarHBondContact OD1-CB 3.34Å; D53-S61 WeakPolarHBondContact OD2-CB 3.44Å; D53-S61 PolarHBondContact OD2-OG 2.84Å; S61-D131 WeakPolarHBondContact CB-O 3.45Å; S61-G133 WeakPolarHBondContact CA-O 3.37Å
62	D	91.2	Very high	84.3	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	128	176.1	-78.4	-4.8	0	0	0	110.5	L48 F130 D131 G133 N134 L136 K137 Y174	L48-D62 HydrophobicContact CD1-CB 3.97Å; D62-F130 WeakPolarHBondContact O-CA 3.33Å; D62-D131 HydrophobicContact CB-CB 4.32Å; D62-D131 PolarHBondContact O-N 2.86Å; D62-G133 PolarHBondContact N-O 2.82Å; D62-N134 PolarHBondContact OD1-OD1 3.44Å; D62-N134 VanDerWaalsContact OD2-CA 3.28Å; D62-N134 WeakPolarHBondContact OD2-CA 3.47Å; D62-L136 HydrophobicContact CB-CB 3.96Å; D62-L136 HydrophobicContact CB-CD1 4.04Å; D62-L136 HydrophobicContact CB-CG 4.3Å; D62-L136 PolarHBondContact OD2-N 3Å; D62-K137 PolarHBondContact OD2-N 3.49Å; D62-Y174 WeakPolarHBondContact OD1-CE1 3.41Å; D62-Y174 PolarHBondContact OD1-OH 3.19Å
63	L	92	Very high	84.9	Confident	12 Å²	12	60.1 Å²	60.1	6%	0.063	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	108	172.2	-179.6	58.7	0	0	0	109.9	K49 V51 F65 F128 F130	K49-L63 HydrophobicContact CB-CB 4.48Å; K49-L63 PolarHBondContact N-O 2.73Å; K49-L63 PolarHBondContact O-N 3.38Å; V51-L63 HydrophobicContact CG2-CB 3.98Å; V51-L63 HydrophobicContact CG2-CD2 3.89Å; L63-F65 HydrophobicContact CD2-CE2 3.79Å; L63-F65 HydrophobicContact CD2-CZ 3.56Å; L63-F65 HydrophobicContact CG-CE2 3.75Å; L63-F65 HydrophobicContact CG-CZ 3.83Å; L63-F128 HydrophobicContact CD1-CB 3.82Å; L63-F128 HydrophobicContact CD1-CD1 4.02Å; L63-F128 HydrophobicContact CD1-CG 4.32Å; L63-F128 HydrophobicContact CD2-CD1 4.47Å; L63-F130 HydrophobicContact CB-CD1 4.44Å; L63-F130 HydrophobicContact CB-CE1 4.16Å; L63-F130 HydrophobicContact CD1-CD1 4.12Å; L63-F130 HydrophobicContact CD1-CD2 4.16Å; L63-F130 HydrophobicContact CD1-CE1 3.92Å; L63-F130 HydrophobicContact CD1-CE2 3.97Å; L63-F130 HydrophobicContact CD1-CG 4.23Å; L63-F130 HydrophobicContact CD1-CZ 3.84Å; L63-F130 HydrophobicContact CD2-CE1 4.43Å; L63-F130 HydrophobicContact CD2-CZ 4.27Å; L63-F130 HydrophobicContact CG-CE1 4.39Å
64	G	92.7	Very high	86.1	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	141.8	176.3	0	0	0	0	0	113.2	M47 F129	M47-G64 CarbonylContact O-C 3.54Å; M47-G64 WeakPolarHBondContact O-CA 3.46Å; G64-F129 PolarHBondContact N-O 3.42Å; G64-F129 WeakPolarHBondContact O-CB 3.48Å
65	F	93.4	Very high	87.3	Confident	57 Å²	57	54.6 Å²	54.6	25%	0.25	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	124.9	165.4	-61.7	-84.1	0	0	0	109.1	I46 M47 K49 L63 F128	I46-F65 CarbonylContact C-O 3.59Å; I46-F65 WeakPolarHBondContact CA-O 3.5Å; M47-F65 HydrophobicContact CB-CB 4.18Å; M47-F65 HydrophobicContact CG-CB 4.45Å; M47-F65 PolarHBondContact N-O 2.79Å; M47-F65 PolarHBondContact O-N 3.19Å; K49-F65 HydrophobicContact CD-CE2 3.98Å; K49-F65 HydrophobicContact CG-CE2 4.27Å; L63-F65 HydrophobicContact CD2-CE2 3.79Å; L63-F65 HydrophobicContact CD2-CZ 3.56Å; L63-F65 HydrophobicContact CG-CE2 3.75Å; L63-F65 HydrophobicContact CG-CZ 3.83Å; F65-F128 HydrophobicContact CE1-CD1 4.49Å
66	I	94.9	Very high	88.4	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	133.8	177.3	-61.6	165.6	0	0	0	108.4	V43 F68 L105 T125 F129 L144 F170	V43-I66 HydrophobicContact CG1-CG2 3.79Å; V43-I66 HydrophobicContact CG2-CG2 4.43Å; I66-F68 HydrophobicContact CG2-CB 4.3Å; I66-F68 HydrophobicContact CG2-CD1 4.18Å; I66-L105 HydrophobicContact CD1-CD1 3.58Å; I66-T125 HydrophobicContact CB-CG2 3.89Å; I66-T125 WeakPolarHBondContact O-CG2 3.48Å; I66-T125 PolarHBondContact O-N 3.39Å; I66-F129 HydrophobicContact CD1-CD1 3.93Å; I66-F129 HydrophobicContact CD1-CE1 3.96Å; I66-L144 HydrophobicContact CD1-CD1 4.48Å; I66-L144 HydrophobicContact CD1-CD2 4.13Å; I66-L144 HydrophobicContact CG2-CD1 4.12Å; I66-F170 HydrophobicContact CD1-CE2 3.97Å; I66-F170 HydrophobicContact CD1-CZ 3.73Å; I66-F170 HydrophobicContact CG1-CE2 4.35Å; I66-F170 HydrophobicContact CG1-CZ 3.89Å
67	T	96.1	Very high	89.8	Confident	10 Å²	10	53 Å²	53	6%	0.061	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	123.9	167.7	-46.5	0	0	0	0	107.8	S44 R45 D122 M123	S44-T67 PolarHBondContact N-O 2.97Å; R45-T67 PolarHBondContact N-O 2.89Å; R45-T67 PolarHBondContact O-N 3.17Å; T67-D122 HydrophobicContact CG2-CB 4.37Å; T67-M123 CarbonylContact C-O 3.51Å; T67-M123 VanDerWaalsContact CA-O 3.24Å; T67-M123 WeakPolarHBondContact CA-O 3.47Å
68	F	96.5	Very high	91.3	Very high	3 Å²	3	49.7 Å²	49.7	1%	0.013	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	157.6	-170.8	61.9	-93.9	0	0	0	112.4	H42 I66 I70 L89 W106 M123 T125	H42-F68 CarbonylContact O-C 3.6Å; H42-F68 VanDerWaalsContact O-CA 3.24Å; H42-F68 WeakPolarHBondContact O-CA 3.12Å; H42-F68 WeakPolarHBondContact O-CB 3.32Å; I66-F68 HydrophobicContact CG2-CB 4.3Å; I66-F68 HydrophobicContact CG2-CD1 4.18Å; F68-I70 HydrophobicContact CD2-CD1 3.83Å; F68-I70 HydrophobicContact CD2-CG1 3.56Å; F68-I70 HydrophobicContact CE2-CD1 3.54Å; F68-I70 HydrophobicContact CE2-CG1 3.71Å; F68-L89 HydrophobicContact CD1-CD2 3.83Å; F68-L89 HydrophobicContact CD2-CD2 3.88Å; F68-L89 HydrophobicContact CE1-CD2 3.69Å; F68-L89 HydrophobicContact CE2-CD2 3.76Å; F68-L89 HydrophobicContact CG-CD2 3.93Å; F68-L89 HydrophobicContact CZ-CD2 3.67Å; F68-W106 HydrophobicContact CE1-CB 4.33Å; F68-W106 HydrophobicContact CZ-CB 3.73Å; F68-W106 HydrophobicContact CZ-CD2 4.32Å; F68-W106 AromaticContact CZ-CG 3.82Å; F68-W106 HydrophobicContact CZ-CG 3.82Å; F68-M123 HydrophobicContact CD2-CB 4.05Å; F68-M123 HydrophobicContact CE1-CB 4.3Å; F68-M123 HydrophobicContact CE2-CB 3.62Å; F68-M123 HydrophobicContact CE2-CG 4.32Å; F68-M123 HydrophobicContact CZ-CB 3.77Å; F68-M123 PolarHBondContact N-O 3.33Å; F68-M123 WeakPolarHBondContact O-CB 3.24Å; F68-M123 PolarHBondContact O-N 2.78Å; F68-T125 HydrophobicContact CE1-CG2 4.38Å
69	D	96.8	Very high	92.7	Very high	36 Å²	36	38.8 Å²	38.8	19%	0.193	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	139.4	172.7	-57.3	-17.7	0	0	0	109	H42 L120 K121 D122	H42-D69 HydrophobicContact CB-CB 4.24Å; H42-D69 IonicContact CD2-OD2 3.91Å; H42-D69 PolarHBondContact N-O 2.99Å; H42-D69 PolarHBondContact O-N 3.01Å; D69-L120 CarbonylContact C-O 3.6Å; D69-L120 VanDerWaalsContact CA-O 3.28Å; D69-L120 WeakPolarHBondContact CA-O 3.47Å; D69-L120 WeakPolarHBondContact CB-O 3.14Å; D69-K121 VanDerWaalsContact OD1-CA 3.31Å; D69-K121 WeakPolarHBondContact OD1-CA 3.48Å; D69-D122 PolarHBondContact OD1-N 3.17Å
70	I	96.4	Very high	93.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	126.7	177.1	-50.3	-166.7	0	0	0	108.7	V39 L41 F68 L89 W106 L118 L120 L146	V39-I70 HydrophobicContact CG1-CG2 4.16Å; L41-I70 HydrophobicContact CD2-CB 4.11Å; L41-I70 HydrophobicContact CD2-CD1 3.9Å; L41-I70 HydrophobicContact CD2-CG1 3.61Å; L41-I70 HydrophobicContact CD2-CG2 3.89Å; F68-I70 HydrophobicContact CD2-CD1 3.83Å; F68-I70 HydrophobicContact CD2-CG1 3.56Å; F68-I70 HydrophobicContact CE2-CD1 3.54Å; F68-I70 HydrophobicContact CE2-CG1 3.71Å; I70-L89 HydrophobicContact CD1-CD1 4.25Å; I70-W106 HydrophobicContact CD1-CE3 4.47Å; I70-W106 HydrophobicContact CD1-CZ3 4.36Å; I70-L118 HydrophobicContact CB-CD2 4.3Å; I70-L118 HydrophobicContact CG2-CD2 3.56Å; I70-L118 HydrophobicContact CG2-CG 4.28Å; I70-L120 HydrophobicContact CB-CB 4.27Å; I70-L120 HydrophobicContact CB-CD1 4.47Å; I70-L120 PolarHBondContact N-O 2.96Å; I70-L120 PolarHBondContact O-N 3.43Å; I70-L146 HydrophobicContact CD1-CD1 4.13Å; I70-L146 HydrophobicContact CG2-CD2 3.81Å
71	T	96.2	Very high	94	Very high	62 Å²	62	34.4 Å²	34.4	38%	0.38	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	117.4	169.5	-61.6	0	0	0	0	109.8	R40 L118 L119	R40-T71 PolarHBondContact N-O 2.83Å; R40-T71 PolarHBondContact O-N 3.5Å; T71-L118 VanDerWaalsContact CA-O 3.25Å; T71-L118 WeakPolarHBondContact CA-O 3.47Å; T71-L119 HydrophobicContact CG2-CD2 3.75Å
72	A	95.6	Very high	94.4	Very high	7 Å²	7	34.2 Å²	34.2	6%	0.058	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	147.8	176	0	0	0	0	0	110.9	V39 L74 L118	V39-A72 HydrophobicContact CG1-CB 4.32Å; V39-A72 HydrophobicContact CG2-CB 4.11Å; A72-L74 HydrophobicContact CB-CD2 4.18Å; A72-L118 HydrophobicContact CB-CB 4.29Å; A72-L118 PolarHBondContact N-O 2.84Å; A72-L118 WeakPolarHBondContact O-CB 3.39Å; A72-L118 PolarHBondContact O-N 2.85Å
73	D	95.4	Very high	94.6	Very high	59 Å²	59	39.6 Å²	39.6	32%	0.316	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	98	174.9	-167.6	-11.7	0	0	0	110.4	V37 E75 K117	V37-D73 WeakPolarHBondContact CG1-O 3.37Å; D73-E75 VanDerWaalsContact C-N 3.26Å; D73-E75 PolarHBondContact O-N 2.89Å; D73-E75 WeakPolarHBondContact OD1-CB 3.24Å; D73-E75 PolarHBondContact OD1-N 3.14Å; D73-K117 WeakPolarHBondContact OD2-CE 3.37Å
74	L	95	Very high	94.8	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	20%	0.198	C	C	.	.			trans	-86.8	5.2	-174.5	-51.7	175.2	0	0	0	112.5	A72 N76 I77 L85 L87 P116	A72-L74 HydrophobicContact CB-CD2 4.18Å; L74-N76 VanDerWaalsContact C-N 3.3Å; L74-N76 PolarHBondContact O-N 3Å; L74-I77 HydrophobicContact CB-CD1 4.07Å; L74-I77 HydrophobicContact CD2-CD1 3.65Å; L74-I77 HydrophobicContact CG-CD1 4.45Å; L74-I77 WeakPolarHBondContact O-CB 3.26Å; L74-I77 PolarHBondContact O-N 2.92Å; L74-L85 HydrophobicContact CB-CD1 4.13Å; L74-L85 HydrophobicContact CD1-CD1 4.22Å; L74-L87 HydrophobicContact CD1-CD1 3.73Å; L74-L87 HydrophobicContact CD1-CD2 3.74Å; L74-L87 HydrophobicContact CD1-CG 4.24Å; L74-L87 HydrophobicContact CD2-CD2 4.41Å; L74-P116 VanDerWaalsContact CB-O 3.32Å; L74-P116 WeakPolarHBondContact CB-O 3.47Å; L74-P116 PolarHBondContact N-O 3.49Å
75	E	93.6	Very high	95	Very high	102 Å²	102	41.4 Å²	41.4	48%	0.477	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-57.8	-44	-172.4	-172.3	169.9	173.6	0	0	111.5	D73 I77 F78 P116	D73-E75 VanDerWaalsContact C-N 3.26Å; D73-E75 PolarHBondContact O-N 2.89Å; D73-E75 WeakPolarHBondContact OD1-CB 3.24Å; D73-E75 PolarHBondContact OD1-N 3.14Å; E75-I77 PolarHBondContact O-N 2.86Å; E75-I77 VanDerWaalsContact O-N 3.14Å; E75-F78 PolarHBondContact O-N 3.04Å; E75-P116 HydrophobicContact CB-CB 3.8Å; E75-P116 HydrophobicContact CB-CG 3.78Å; E75-P116 HydrophobicContact CG-CB 4.37Å; E75-P116 HydrophobicContact CG-CG 3.95Å
76	N	92.2	Very high	95.2	Very high	145 Å²	145	42.2 Å²	42.2	78%	0.775	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-67.3	-14.8	-179	-66	-28.8	0	0	0	114.1	L74	L74-N76 VanDerWaalsContact C-N 3.3Å; L74-N76 PolarHBondContact O-N 3Å
77	I	94	Very high	95.3	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-80.1	-32.1	179.1	-56.7	171.8	0	0	0	110.6	R35 V37 L74 E75 D79 V82 L85 W148 V150	R35-I77 HydrophobicContact CB-CG2 4.06Å; R35-I77 HydrophobicContact CG-CG2 4.14Å; V37-I77 HydrophobicContact CB-CD1 4.34Å; V37-I77 HydrophobicContact CG2-CD1 3.67Å; V37-I77 HydrophobicContact CG2-CG1 3.6Å; L74-I77 HydrophobicContact CB-CD1 4.07Å; L74-I77 HydrophobicContact CD2-CD1 3.65Å; L74-I77 HydrophobicContact CG-CD1 4.45Å; L74-I77 WeakPolarHBondContact O-CB 3.26Å; L74-I77 PolarHBondContact O-N 2.92Å; E75-I77 PolarHBondContact O-N 2.86Å; E75-I77 VanDerWaalsContact O-N 3.14Å; I77-D79 PolarHBondContact O-N 3.14Å; I77-V82 WeakPolarHBondContact O-CG2 3.43Å; I77-L85 HydrophobicContact CB-CD1 4.14Å; I77-L85 HydrophobicContact CD1-CD1 4.21Å; I77-L85 HydrophobicContact CG2-CD1 3.88Å; I77-L85 HydrophobicContact CG2-CD2 3.68Å; I77-L85 HydrophobicContact CG2-CG 4.4Å; I77-W148 HydrophobicContact CD1-CD2 4.47Å; I77-W148 HydrophobicContact CD1-CH2 4.47Å; I77-W148 HydrophobicContact CD1-CZ2 3.62Å; I77-V150 HydrophobicContact CG2-CG2 4.27Å
78	F	94.6	Very high	95.4	Very high	40 Å²	40	42.8 Å²	42.8	18%	0.175	20%	0.203	C	C	.	.			trans	-78.6	89	-178.4	-75.4	-81.9	0	0	0	111.5	E75 V82 L85 V110 R112	E75-F78 PolarHBondContact O-N 3.04Å; F78-V82 HydrophobicContact CD1-CB 4.22Å; F78-V82 HydrophobicContact CD1-CG1 3.65Å; F78-V82 HydrophobicContact CE1-CG1 3.89Å; F78-V82 HydrophobicContact CG-CG1 4.45Å; F78-L85 HydrophobicContact CD2-CD1 4.17Å; F78-L85 HydrophobicContact CE1-CG 4.12Å; F78-L85 HydrophobicContact CE2-CD1 3.5Å; F78-L85 VanDerWaalsContact CE2-CD1 3.5Å; F78-L85 HydrophobicContact CE2-CG 3.95Å; F78-L85 HydrophobicContact CZ-CB 4.35Å; F78-L85 HydrophobicContact CZ-CD1 3.72Å; F78-L85 HydrophobicContact CZ-CG 3.61Å; F78-V110 HydrophobicContact CE2-CG1 3.97Å; F78-V110 HydrophobicContact CZ-CB 4.26Å; F78-V110 HydrophobicContact CZ-CG1 3.78Å; F78-R112 HydrophobicContact CD1-CB 4.38Å; F78-R112 HydrophobicContact CE1-CB 4.38Å
79	D	92.1	Very high	95.5	Very high	20 Å²	20	42.7 Å²	42.7	11%	0.107	20%	0.203	C	C	.	.			trans	-81.9	-168.1	168.5	64.7	35.7	0	0	0	112.3	K33 R35 I77 N81 V82 R112	K33-D79 IonicContact NZ-OD2 3.51Å; R35-D79 IonicContact CZ-OD2 3.73Å; R35-D79 IonicContact NE-OD2 3.88Å; R35-D79 IonicContact NH2-OD2 2.82Å; R35-D79 PolarHBondContact NH2-OD2 2.62Å; I77-D79 PolarHBondContact O-N 3.14Å; D79-N81 VanDerWaalsContact C-N 3.27Å; D79-N81 PolarHBondContact O-N 3.44Å; D79-N81 WeakPolarHBondContact OD1-CA 3.25Å; D79-N81 WeakPolarHBondContact OD1-CB 3.28Å; D79-N81 PolarHBondContact OD1-N 3.47Å; D79-V82 WeakPolarHBondContact OD1-CG2 3.39Å; D79-V82 PolarHBondContact OD1-N 3.04Å; D79-R112 PolarHBondContact O-NH1 3.24Å; D79-R112 PolarHBondContact O-NH2 2.64Å
80	W	92.4	Very high	95.5	Very high	156 Å²	156	41 Å²	41	59%	0.591	19%	0.194	S	C	*	.	S	Bend	trans	-70.5	-15.2	177.7	57.4	86.8	0	0	0	114.8	T30 R112	T30-W80 HydrophobicContact CG2-CZ2 3.99Å; W80-R112 PolarHBondContact O-NH2 3.23Å
81	N	94.9	Very high	95.5	Very high	5 Å²	5	41 Å²	41	3%	0.027	19%	0.194	C	C	.	.	S	Bend	trans	-103	-27.9	-177.8	-167.7	25.1	0	0	0	112.9	T30 D79 K83 P152 N153 A154	T30-N81 HydrophobicContact CG2-CB 3.73Å; T30-N81 PolarHBondContact OG1-ND2 3.12Å; D79-N81 VanDerWaalsContact C-N 3.27Å; D79-N81 PolarHBondContact O-N 3.44Å; D79-N81 WeakPolarHBondContact OD1-CA 3.25Å; D79-N81 WeakPolarHBondContact OD1-CB 3.28Å; D79-N81 PolarHBondContact OD1-N 3.47Å; N81-K83 PolarHBondContact O-N 2.93Å; N81-P152 CarbonylContact O-C 3.51Å; N81-P152 WeakPolarHBondContact O-CA 3.31Å; N81-N153 PolarHBondContact O-N 3.03Å; N81-N153 PolarHBondContact O-ND2 3.33Å; N81-N153 PolarHBondContact OD1-N 3.14Å; N81-A154 PolarHBondContact ND2-O 3.42Å; N81-A154 PolarHBondContact OD1-N 3.3Å
82	V	95.6	Very high	95.5	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	114.6	-177.3	176.3	0	0	0	0	113.2	I77 F78 D79 L85 R112 V150	I77-V82 WeakPolarHBondContact O-CG2 3.43Å; F78-V82 HydrophobicContact CD1-CB 4.22Å; F78-V82 HydrophobicContact CD1-CG1 3.65Å; F78-V82 HydrophobicContact CE1-CG1 3.89Å; F78-V82 HydrophobicContact CG-CG1 4.45Å; D79-V82 WeakPolarHBondContact OD1-CG2 3.39Å; D79-V82 PolarHBondContact OD1-N 3.04Å; V82-L85 HydrophobicContact CG1-CD2 3.92Å; V82-L85 HydrophobicContact CG1-CG 4.47Å; V82-R112 VanDerWaalsContact C-NH2 3.33Å; V82-R112 VanDerWaalsContact N-NH2 3.17Å; V82-R112 PolarHBondContact O-NE 3.06Å; V82-R112 PolarHBondContact O-NH2 2.61Å; V82-V150 HydrophobicContact CB-CG1 4.34Å; V82-V150 HydrophobicContact CG1-CG1 3.9Å; V82-V150 HydrophobicContact CG2-CG1 3.5Å
83	K	96	Very high	95.5	Very high	114 Å²	114	41.1 Å²	41.1	50%	0.496	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-46.4	178.5	-174.6	179.2	173.7	-178.6	0	112.2	N81 R112 V151 N153	N81-K83 PolarHBondContact O-N 2.93Å; K83-R112 WeakPolarHBondContact O-CB 3.43Å; K83-R112 PolarHBondContact O-N 3.43Å; K83-V151 WeakPolarHBondContact CA-O 3.37Å; K83-V151 WeakPolarHBondContact CB-O 3.44Å; K83-V151 PolarHBondContact N-O 3.49Å; K83-N153 WeakPolarHBondContact CB-OD1 3.08Å
84	Q	96.8	Very high	95.5	Very high	49 Å²	49	41.3 Å²	41.3	23%	0.229	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	161.2	-175.7	63.3	-177.2	12.8	0	0	110.5	I109 V110 L111 V151	Q84-I109 HydrophobicContact CB-CG2 4.26Å; Q84-V110 CarbonylContact C-O 3.59Å; Q84-V110 VanDerWaalsContact CA-O 3.26Å; Q84-V110 WeakPolarHBondContact CA-O 3.37Å; Q84-V110 WeakPolarHBondContact CB-O 3.07Å; Q84-L111 HydrophobicContact CB-CD2 3.8Å; Q84-L111 VanDerWaalsContact OE1-CD2 3.27Å; Q84-V151 HydrophobicContact CG-CB 3.59Å; Q84-V151 HydrophobicContact CG-CG1 4.05Å; Q84-V151 HydrophobicContact CG-CG2 3.9Å; Q84-V151 PolarHBondContact N-O 3Å; Q84-V151 WeakPolarHBondContact O-CB 3.49Å; Q84-V151 PolarHBondContact O-N 2.9Å
85	L	97.1	Very high	95.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.3	170.6	-59.6	179.1	0	0	0	109	L74 I77 F78 V82 I109 V110 V150	L74-L85 HydrophobicContact CB-CD1 4.13Å; L74-L85 HydrophobicContact CD1-CD1 4.22Å; I77-L85 HydrophobicContact CB-CD1 4.14Å; I77-L85 HydrophobicContact CD1-CD1 4.21Å; I77-L85 HydrophobicContact CG2-CD1 3.88Å; I77-L85 HydrophobicContact CG2-CD2 3.68Å; I77-L85 HydrophobicContact CG2-CG 4.4Å; F78-L85 HydrophobicContact CD2-CD1 4.17Å; F78-L85 HydrophobicContact CE1-CG 4.12Å; F78-L85 HydrophobicContact CE2-CD1 3.5Å; F78-L85 VanDerWaalsContact CE2-CD1 3.5Å; F78-L85 HydrophobicContact CE2-CG 3.95Å; F78-L85 HydrophobicContact CZ-CB 4.35Å; F78-L85 HydrophobicContact CZ-CD1 3.72Å; F78-L85 HydrophobicContact CZ-CG 3.61Å; V82-L85 HydrophobicContact CG1-CD2 3.92Å; V82-L85 HydrophobicContact CG1-CG 4.47Å; L85-I109 CarbonylContact O-C 3.51Å; L85-I109 WeakPolarHBondContact O-CA 3.46Å; L85-V110 HydrophobicContact CB-CB 4.47Å; L85-V110 PolarHBondContact N-O 2.89Å; L85-V110 PolarHBondContact O-N 2.73Å; L85-V150 HydrophobicContact CD2-CB 4.08Å; L85-V150 HydrophobicContact CD2-CG1 3.93Å; L85-V150 HydrophobicContact CD2-CG2 3.88Å
86	F	97.5	Very high	95.2	Very high	74 Å²	74	47.8 Å²	47.8	33%	0.325	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	98.7	168.1	177.3	-103.1	0	0	0	108.4	Y88 D107 I109 W148 N149	F86-Y88 AromaticContact CD1-CD1 3.91Å; F86-Y88 HydrophobicContact CD1-CD1 3.91Å; F86-Y88 AromaticContact CE1-CD1 3.85Å; F86-Y88 HydrophobicContact CE1-CD1 3.85Å; F86-Y88 HydrophobicContact CE1-CG 4.34Å; F86-D107 HydrophobicContact CE2-CB 3.96Å; F86-D107 HydrophobicContact CZ-CB 3.88Å; F86-I109 HydrophobicContact CD2-CG1 3.86Å; F86-W148 CarbonylContact O-C 3.57Å; F86-W148 WeakPolarHBondContact O-CA 3.24Å; F86-W148 WeakPolarHBondContact O-CB 3.42Å; F86-N149 HydrophobicContact CB-CB 4.28Å; F86-N149 PolarHBondContact N-O 3.04Å; F86-N149 PolarHBondContact O-N 2.99Å
87	L	97.2	Very high	95	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	142.7	176.6	-61.3	161.5	0	0	0	109.5	L74 W106 D107 K108 V110 L118 L146 W148	L74-L87 HydrophobicContact CD1-CD1 3.73Å; L74-L87 HydrophobicContact CD1-CD2 3.74Å; L74-L87 HydrophobicContact CD1-CG 4.24Å; L74-L87 HydrophobicContact CD2-CD2 4.41Å; L87-W106 HydrophobicContact CB-CZ3 4.29Å; L87-D107 CarbonylContact O-C 3.52Å; L87-D107 WeakPolarHBondContact O-CA 3.21Å; L87-D107 WeakPolarHBondContact O-CB 3.49Å; L87-K108 WeakPolarHBondContact CB-O 3.33Å; L87-K108 PolarHBondContact N-O 3.34Å; L87-K108 PolarHBondContact O-N 2.9Å; L87-V110 HydrophobicContact CD1-CG2 3.52Å; L87-V110 HydrophobicContact CG-CG2 4.45Å; L87-L118 HydrophobicContact CD1-CD1 4.42Å; L87-L118 HydrophobicContact CD1-CD2 4.08Å; L87-L146 HydrophobicContact CB-CD1 4.48Å; L87-W148 HydrophobicContact CD2-CB 3.69Å; L87-W148 HydrophobicContact CD2-CD2 4.2Å; L87-W148 HydrophobicContact CD2-CE3 3.89Å; L87-W148 HydrophobicContact CD2-CG 4.17Å; L87-W148 HydrophobicContact CG-CB 4.44Å
88	Y	97.6	Very high	94.9	Very high	24 Å²	24	49.9 Å²	49.9	9%	0.094	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	139	169.7	61.9	-84	0	0	0	110.8	F86 V104 W106 S147 L159	F86-Y88 AromaticContact CD1-CD1 3.91Å; F86-Y88 HydrophobicContact CD1-CD1 3.91Å; F86-Y88 AromaticContact CE1-CD1 3.85Å; F86-Y88 HydrophobicContact CE1-CD1 3.85Å; F86-Y88 HydrophobicContact CE1-CG 4.34Å; Y88-V104 HydrophobicContact CD2-CG2 4.18Å; Y88-W106 CarbonylContact C-O 3.5Å; Y88-W106 VanDerWaalsContact CA-O 3.23Å; Y88-W106 WeakPolarHBondContact CA-O 3.16Å; Y88-S147 PolarHBondContact N-O 3.4Å; Y88-S147 PolarHBondContact O-N 3.38Å; Y88-S147 VanDerWaalsContact O-O 3.09Å; Y88-S147 VanDerWaalsContact OH-CB 3.24Å; Y88-S147 WeakPolarHBondContact OH-CB 3.47Å; Y88-L159 HydrophobicContact CE1-CD1 3.73Å; Y88-L159 WeakPolarHBondContact OH-CD1 3.23Å; Y88-L159 WeakPolarHBondContact OH-CD2 3.46Å; Y88-L159 WeakPolarHBondContact OH-CG 3.3Å
89	L	97.4	Very high	94.9	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	119.3	174.4	-176	75.3	0	0	0	108	L41 F68 I70 L105 W106 L144 L146	L41-L89 HydrophobicContact CD1-CD1 4.08Å; L41-L89 HydrophobicContact CD2-CD1 4.06Å; F68-L89 HydrophobicContact CD1-CD2 3.83Å; F68-L89 HydrophobicContact CD2-CD2 3.88Å; F68-L89 HydrophobicContact CE1-CD2 3.69Å; F68-L89 HydrophobicContact CE2-CD2 3.76Å; F68-L89 HydrophobicContact CG-CD2 3.93Å; F68-L89 HydrophobicContact CZ-CD2 3.67Å; I70-L89 HydrophobicContact CD1-CD1 4.25Å; L89-L105 PolarHBondContact O-N 3.3Å; L89-W106 HydrophobicContact CB-CB 4.26Å; L89-W106 HydrophobicContact CB-CE3 4.35Å; L89-W106 PolarHBondContact N-O 3.34Å; L89-L144 HydrophobicContact CD1-CB 4.37Å; L89-L146 HydrophobicContact CB-CD1 4.47Å; L89-L146 HydrophobicContact CD1-CB 4.38Å
90	S	96.8	Very high	95	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	145.6	174.4	53.5	0	0	0	0	111.7	V103 L144 T145	S90-V103 CarbonylContact C-O 3.51Å; S90-V103 VanDerWaalsContact CA-O 3.26Å; S90-V103 WeakPolarHBondContact CA-O 3.32Å; S90-L144 WeakPolarHBondContact O-CA 3.34Å; S90-T145 PolarHBondContact N-O 3.45Å; S90-T145 PolarHBondContact O-N 2.96Å; S90-T145 PolarHBondContact OG-O 2.87Å
91	A	96.7	Very high	95.1	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	126.3	165.4	0	0	0	0	0	109.4	Q102 V103 L105 F129 V142 T143 L144	A91-Q102 CarbonylContact O-C 3.55Å; A91-Q102 WeakPolarHBondContact O-CA 3.15Å; A91-V103 PolarHBondContact N-O 3.21Å; A91-V103 PolarHBondContact O-N 3.04Å; A91-L105 HydrophobicContact CB-CD1 3.88Å; A91-L105 HydrophobicContact CB-CD2 4.31Å; A91-L105 HydrophobicContact CB-CG 4.06Å; A91-F129 HydrophobicContact CB-CE1 3.92Å; A91-F129 HydrophobicContact CB-CE2 4.4Å; A91-F129 HydrophobicContact CB-CZ 3.73Å; A91-V142 HydrophobicContact CB-CG1 3.95Å; A91-T143 CarbonylContact C-O 3.57Å; A91-T143 WeakPolarHBondContact CA-O 3.31Å; A91-L144 HydrophobicContact CB-CD2 3.6Å
92	E	96.2	Very high	95.2	Very high	61 Å²	61	55.2 Å²	55.2	29%	0.285	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	130	176.3	-72.1	174.7	-158.5	0	0	109.8	L100 N101 Q102 T143	E92-L100 HydrophobicContact CB-CD1 4.26Å; E92-L100 HydrophobicContact CG-CD1 4.28Å; E92-N101 VanDerWaalsContact CA-O 3.28Å; E92-N101 WeakPolarHBondContact CA-O 3.49Å; E92-Q102 HydrophobicContact CG-CB 4.12Å; E92-Q102 HydrophobicContact CG-CG 3.82Å; E92-T143 PolarHBondContact N-O 3.49Å; E92-T143 PolarHBondContact O-N 2.98Å
93	Y	95.8	Very high	95.1	Very high	10 Å²	10	56.9 Å²	56.9	4%	0.039	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	161.1	-178.5	63.7	-74.4	0	0	0	110.3	T95 N101 V103 F129 D131 L136 V142	Y93-T95 HydrophobicContact CD2-CG2 3.86Å; Y93-T95 HydrophobicContact CE2-CG2 3.61Å; Y93-N101 HydrophobicContact CD1-CB 3.93Å; Y93-N101 HydrophobicContact CD2-CB 4.15Å; Y93-N101 HydrophobicContact CE1-CB 3.49Å; Y93-N101 VanDerWaalsContact CE1-CB 3.49Å; Y93-N101 HydrophobicContact CE2-CB 3.78Å; Y93-N101 WeakPolarHBondContact CE2-ND2 3.43Å; Y93-N101 HydrophobicContact CG-CB 4.23Å; Y93-N101 VanDerWaalsContact CZ-CB 3.42Å; Y93-N101 PolarHBondContact N-O 2.83Å; Y93-N101 WeakPolarHBondContact O-CB 3.24Å; Y93-N101 PolarHBondContact O-N 2.87Å; Y93-V103 HydrophobicContact CE1-CG2 4.15Å; Y93-F129 HydrophobicContact CD1-CE2 4.17Å; Y93-F129 AromaticContact CD1-CZ 3.88Å; Y93-F129 HydrophobicContact CD1-CZ 3.88Å; Y93-F129 AromaticContact CE1-CE2 3.44Å; Y93-F129 HydrophobicContact CE1-CE2 3.44Å; Y93-F129 VanDerWaalsContact CE1-CE2 3.44Å; Y93-F129 AromaticContact CE1-CZ 3.62Å; Y93-F129 HydrophobicContact CE1-CZ 3.62Å; Y93-F129 AromaticContact CZ-CE2 3.9Å; Y93-D131 WeakPolarHBondContact CE2-OD1 3.1Å; Y93-D131 VanDerWaalsContact CZ-OD1 3.3Å; Y93-D131 PolarHBondContact OH-OD1 3.35Å; Y93-L136 HydrophobicContact CD1-CD2 4.41Å; Y93-L136 HydrophobicContact CD2-CD2 3.85Å; Y93-L136 HydrophobicContact CE1-CD2 4.23Å; Y93-L136 HydrophobicContact CE2-CD2 3.6Å; Y93-L136 HydrophobicContact CE2-CG 4.32Å; Y93-L136 HydrophobicContact CG-CD2 4.25Å; Y93-V142 HydrophobicContact CG-CG2 4.49Å
94	S	94.9	Very high	95.2	Very high	63 Å²	63	54.2 Å²	54.2	44%	0.441	29%	0.289	S	S	.	.			trans	-110.6	143.6	176.5	59.8	0	0	0	0	110.4	A99 N139	S94-A99 WeakPolarHBondContact CB-O 3.37Å; S94-N139 PolarHBondContact O-ND2 2.98Å
95	T	92.3	Very high	95.2	Very high	29 Å²	29	51.9 Å²	51.9	18%	0.178	28%	0.278	C	S	.	.			trans	-120.4	177.3	171.5	67.7	0	0	0	0	110.2	Y93 N97 N98 N101	Y93-T95 HydrophobicContact CD2-CG2 3.86Å; Y93-T95 HydrophobicContact CE2-CG2 3.61Å; T95-N97 PolarHBondContact O-N 3.45Å; T95-N98 PolarHBondContact N-O 3.12Å; T95-N98 VanDerWaalsContact O-O 3.08Å; T95-N98 PolarHBondContact OG1-N 2.96Å; T95-N98 VanDerWaalsContact OG1-N 3.15Å; T95-N101 VanDerWaalsContact CG2-ND2 3.33Å; T95-N101 WeakPolarHBondContact CG2-ND2 3.22Å
96	K	90.1	Very high	95.2	Very high	211 Å²	211	52.6 Å²	52.6	92%	0.917	28%	0.281	S	S	*	.	S	Bend	trans	-64.5	-30.9	177.2	-66.2	-179.1	-177.9	176.5	0	112.6
97	N	89.3	Confident	95.2	Very high	134 Å²	134	50.3 Å²	50.3	72%	0.717	27%	0.272	S	S	*	.	S	Bend	trans	-92.2	-35	-176.1	-62.1	-19	0	0	0	111.6	T95	T95-N97 PolarHBondContact O-N 3.45Å
98	N	92.2	Very high	95.1	Very high	57 Å²	57	54.2 Å²	54.2	31%	0.305	29%	0.289	S	S	.	.			trans	-122.5	124.6	-173.8	-61.5	-38.2	0	0	0	111	T95 L100 N101 D132	T95-N98 PolarHBondContact N-O 3.12Å; T95-N98 VanDerWaalsContact O-O 3.08Å; T95-N98 PolarHBondContact OG1-N 2.96Å; T95-N98 VanDerWaalsContact OG1-N 3.15Å; N98-L100 VanDerWaalsContact C-N 3.28Å; N98-L100 PolarHBondContact O-N 3.13Å; N98-N101 WeakPolarHBondContact CB-OD1 3.32Å; N98-N101 PolarHBondContact ND2-OD1 2.78Å; N98-D132 PolarHBondContact ND2-OD2 2.82Å
99	A	93.5	Very high	95.1	Very high	96 Å²	96	57.2 Å²	57.2	79%	0.793	31%	0.306	S	S	*	.	S	Bend	trans	-66.6	-31	178.5	0	0	0	0	0	112.8	S94	S94-A99 WeakPolarHBondContact CB-O 3.37Å
100	L	94.8	Very high	95.1	Very high	111 Å²	111	57.4 Å²	57.4	58%	0.581	31%	0.307	S	S	*	.			trans	-143	114.4	178.6	175.8	67.7	0	0	0	109.5	E92 N98	E92-L100 HydrophobicContact CB-CD1 4.26Å; E92-L100 HydrophobicContact CG-CD1 4.28Å; N98-L100 VanDerWaalsContact C-N 3.28Å; N98-L100 PolarHBondContact O-N 3.13Å
101	N	95.1	Very high	95	Very high	21 Å²	21	61.1 Å²	61.1	11%	0.112	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.6	165.7	-75.8	-14.7	0	0	0	108.2	E92 Y93 T95 N98 D131	E92-N101 VanDerWaalsContact CA-O 3.28Å; E92-N101 WeakPolarHBondContact CA-O 3.49Å; Y93-N101 HydrophobicContact CD1-CB 3.93Å; Y93-N101 HydrophobicContact CD2-CB 4.15Å; Y93-N101 HydrophobicContact CE1-CB 3.49Å; Y93-N101 VanDerWaalsContact CE1-CB 3.49Å; Y93-N101 HydrophobicContact CE2-CB 3.78Å; Y93-N101 WeakPolarHBondContact CE2-ND2 3.43Å; Y93-N101 HydrophobicContact CG-CB 4.23Å; Y93-N101 VanDerWaalsContact CZ-CB 3.42Å; Y93-N101 PolarHBondContact N-O 2.83Å; Y93-N101 WeakPolarHBondContact O-CB 3.24Å; Y93-N101 PolarHBondContact O-N 2.87Å; T95-N101 VanDerWaalsContact CG2-ND2 3.33Å; T95-N101 WeakPolarHBondContact CG2-ND2 3.22Å; N98-N101 WeakPolarHBondContact CB-OD1 3.32Å; N98-N101 PolarHBondContact ND2-OD1 2.78Å; N101-D131 PolarHBondContact ND2-OD1 3.23Å
102	Q	95.6	Very high	94.9	Very high	105 Å²	105	66.4 Å²	66.4	49%	0.491	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	118.9	178.2	-175.1	178	-8.8	0	0	110.2	A91 E92	A91-Q102 CarbonylContact O-C 3.55Å; A91-Q102 WeakPolarHBondContact O-CA 3.15Å; E92-Q102 HydrophobicContact CG-CB 4.12Å; E92-Q102 HydrophobicContact CG-CG 3.82Å
103	V	95.3	Very high	94.8	Very high	34 Å²	34	67.3 Å²	67.3	21%	0.206	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	131.8	-176.7	-177.9	0	0	0	0	110.2	S90 A91 Y93 L105 F129	S90-V103 CarbonylContact C-O 3.51Å; S90-V103 VanDerWaalsContact CA-O 3.26Å; S90-V103 WeakPolarHBondContact CA-O 3.32Å; A91-V103 PolarHBondContact N-O 3.21Å; A91-V103 PolarHBondContact O-N 3.04Å; Y93-V103 HydrophobicContact CE1-CG2 4.15Å; V103-L105 HydrophobicContact CG1-CD2 4.29Å; V103-F129 HydrophobicContact CB-CD2 4.01Å; V103-F129 HydrophobicContact CB-CE2 3.95Å; V103-F129 HydrophobicContact CG1-CD2 3.92Å; V103-F129 HydrophobicContact CG1-CE2 4.37Å; V103-F129 HydrophobicContact CG2-CD2 4.15Å; V103-F129 HydrophobicContact CG2-CE2 3.91Å
104	V	96.8	Very high	94.7	Very high	58 Å²	58	70.5 Å²	70.5	35%	0.352	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	120.8	174.5	178.4	0	0	0	0	109.5	Y88 Y127	Y88-V104 HydrophobicContact CD2-CG2 4.18Å; V104-Y127 HydrophobicContact CG1-CD2 4.24Å; V104-Y127 HydrophobicContact CG1-CE2 4.45Å; V104-Y127 WeakPolarHBondContact O-CB 3.35Å
105	L	96.5	Very high	94.6	Very high	0 Å²	0	73 Å²	73	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-30.8	-177.2	-59.7	-173.7	0	0	0	113	I66 L89 A91 V103 T125 K126 Y127 F129 L144	I66-L105 HydrophobicContact CD1-CD1 3.58Å; L89-L105 PolarHBondContact O-N 3.3Å; A91-L105 HydrophobicContact CB-CD1 3.88Å; A91-L105 HydrophobicContact CB-CD2 4.31Å; A91-L105 HydrophobicContact CB-CG 4.06Å; V103-L105 HydrophobicContact CG1-CD2 4.29Å; L105-T125 HydrophobicContact CB-CG2 3.86Å; L105-T125 HydrophobicContact CD1-CG2 4.05Å; L105-T125 HydrophobicContact CD2-CG2 4.31Å; L105-T125 HydrophobicContact CG-CG2 4.32Å; L105-T125 CarbonylContact O-C 3.53Å; L105-K126 PolarHBondContact O-N 2.93Å; L105-Y127 PolarHBondContact O-N 3.03Å; L105-F129 HydrophobicContact CD2-CB 3.64Å; L105-F129 HydrophobicContact CD2-CD1 3.71Å; L105-F129 HydrophobicContact CD2-CD2 4.09Å; L105-F129 HydrophobicContact CD2-CE1 4.36Å; L105-F129 HydrophobicContact CD2-CG 3.54Å; L105-L144 HydrophobicContact CD1-CD2 3.65Å
106	W	97.5	Very high	94.6	Very high	16 Å²	16	73.1 Å²	73.1	6%	0.061	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	150.7	-172.8	177	89	0	0	0	110.4	F68 I70 L87 Y88 L89 K108 L120 L146	F68-W106 HydrophobicContact CE1-CB 4.33Å; F68-W106 HydrophobicContact CZ-CB 3.73Å; F68-W106 HydrophobicContact CZ-CD2 4.32Å; F68-W106 AromaticContact CZ-CG 3.82Å; F68-W106 HydrophobicContact CZ-CG 3.82Å; I70-W106 HydrophobicContact CD1-CE3 4.47Å; I70-W106 HydrophobicContact CD1-CZ3 4.36Å; L87-W106 HydrophobicContact CB-CZ3 4.29Å; Y88-W106 CarbonylContact C-O 3.5Å; Y88-W106 VanDerWaalsContact CA-O 3.23Å; Y88-W106 WeakPolarHBondContact CA-O 3.16Å; L89-W106 HydrophobicContact CB-CB 4.26Å; L89-W106 HydrophobicContact CB-CE3 4.35Å; L89-W106 PolarHBondContact N-O 3.34Å; W106-K108 HydrophobicContact CH2-CB 3.19Å; W106-K108 HydrophobicContact CH2-CD 3.84Å; W106-K108 HydrophobicContact CH2-CG 4.13Å; W106-K108 HydrophobicContact CZ2-CB 3.38Å; W106-K108 HydrophobicContact CZ2-CD 3.87Å; W106-K108 HydrophobicContact CZ2-CG 4.21Å; W106-K108 HydrophobicContact CZ3-CB 3.91Å; W106-L120 HydrophobicContact CH2-CD1 3.45Å; W106-L120 VanDerWaalsContact CH2-CD1 3.45Å; W106-L120 HydrophobicContact CZ2-CD1 3.45Å; W106-L120 VanDerWaalsContact CZ2-CD1 3.45Å; W106-L120 HydrophobicContact CZ3-CD1 4.35Å; W106-L146 HydrophobicContact CZ3-CD1 4.4Å
107	D	97.3	Very high	94.7	Very high	25 Å²	25	67.9 Å²	67.9	13%	0.134	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	158	174.6	69.2	-18	0	0	0	111.6	F86 L87 K126 Y127	F86-D107 HydrophobicContact CE2-CB 3.96Å; F86-D107 HydrophobicContact CZ-CB 3.88Å; L87-D107 CarbonylContact O-C 3.52Å; L87-D107 WeakPolarHBondContact O-CA 3.21Å; L87-D107 WeakPolarHBondContact O-CB 3.49Å; D107-K126 WeakPolarHBondContact OD1-CD 3.26Å; D107-K126 WeakPolarHBondContact OD1-CE 3.4Å; D107-K126 IonicContact OD1-NZ 2.62Å; D107-K126 PolarHBondContact OD1-NZ 3.43Å; D107-K126 IonicContact OD2-NZ 3.63Å; D107-Y127 HydrophobicContact CB-CE2 4.36Å; D107-Y127 PolarHBondContact OD1-OH 3.25Å; D107-Y127 PolarHBondContact OD2-OH 2.97Å
108	K	96.1	Very high	95	Very high	83 Å²	83	61.8 Å²	61.8	36%	0.361	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	136	171	179.1	175.9	-179.7	-176.6	0	110.8	L87 W106 V110 L118	L87-K108 WeakPolarHBondContact CB-O 3.33Å; L87-K108 PolarHBondContact N-O 3.34Å; L87-K108 PolarHBondContact O-N 2.9Å; W106-K108 HydrophobicContact CH2-CB 3.19Å; W106-K108 HydrophobicContact CH2-CD 3.84Å; W106-K108 HydrophobicContact CH2-CG 4.13Å; W106-K108 HydrophobicContact CZ2-CB 3.38Å; W106-K108 HydrophobicContact CZ2-CD 3.87Å; W106-K108 HydrophobicContact CZ2-CG 4.21Å; W106-K108 HydrophobicContact CZ3-CB 3.91Å; K108-V110 HydrophobicContact CD-CG2 4.45Å; K108-V110 HydrophobicContact CG-CG2 4.38Å; K108-L118 HydrophobicContact CD-CD1 4.32Å
109	I	97	Very high	95.1	Very high	86 Å²	86	64.9 Å²	64.9	44%	0.441	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	128	168.3	-58.8	172.6	0	0	0	108	Q84 L85 F86 L111	Q84-I109 HydrophobicContact CB-CG2 4.26Å; L85-I109 CarbonylContact O-C 3.51Å; L85-I109 WeakPolarHBondContact O-CA 3.46Å; F86-I109 HydrophobicContact CD2-CG1 3.86Å; I109-L111 HydrophobicContact CG2-CD2 3.76Å; I109-L111 HydrophobicContact CG2-CG 4.38Å
110	V	96.5	Very high	95.2	Very high	5 Å²	5	61.5 Å²	61.5	3%	0.03	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	115.9	169.8	-177.7	0	0	0	0	107.3	F78 Q84 L85 L87 K108 D114	F78-V110 HydrophobicContact CE2-CG1 3.97Å; F78-V110 HydrophobicContact CZ-CB 4.26Å; F78-V110 HydrophobicContact CZ-CG1 3.78Å; Q84-V110 CarbonylContact C-O 3.59Å; Q84-V110 VanDerWaalsContact CA-O 3.26Å; Q84-V110 WeakPolarHBondContact CA-O 3.37Å; Q84-V110 WeakPolarHBondContact CB-O 3.07Å; L85-V110 HydrophobicContact CB-CB 4.47Å; L85-V110 PolarHBondContact N-O 2.89Å; L85-V110 PolarHBondContact O-N 2.73Å; L87-V110 HydrophobicContact CD1-CG2 3.52Å; L87-V110 HydrophobicContact CG-CG2 4.45Å; K108-V110 HydrophobicContact CD-CG2 4.45Å; K108-V110 HydrophobicContact CG-CG2 4.38Å; V110-D114 HydrophobicContact CG1-CB 4.01Å
111	L	96.5	Very high	95.3	Very high	79 Å²	79	64.2 Å²	64.2	41%	0.414	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	155	179.4	-58.6	177.4	0	0	0	110.3	Q84 I109 G113 D114	Q84-L111 HydrophobicContact CB-CD2 3.8Å; Q84-L111 VanDerWaalsContact OE1-CD2 3.27Å; I109-L111 HydrophobicContact CG2-CD2 3.76Å; I109-L111 HydrophobicContact CG2-CG 4.38Å; L111-G113 PolarHBondContact O-N 2.8Å; L111-D114 WeakPolarHBondContact CB-OD2 3.45Å; L111-D114 PolarHBondContact N-OD2 2.92Å; L111-D114 VanDerWaalsContact O-CB 3.31Å; L111-D114 WeakPolarHBondContact O-CB 3.33Å; L111-D114 PolarHBondContact O-N 3.37Å
112	R	94.2	Very high	95.3	Very high	111 Å²	111	68.4 Å²	68.4	42%	0.419	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	126.5	167.1	178.8	-172.7	-66.3	-93.4	7.2	109.6	F78 D79 W80 V82 K83	F78-R112 HydrophobicContact CD1-CB 4.38Å; F78-R112 HydrophobicContact CE1-CB 4.38Å; D79-R112 PolarHBondContact O-NH1 3.24Å; D79-R112 PolarHBondContact O-NH2 2.64Å; W80-R112 PolarHBondContact O-NH2 3.23Å; V82-R112 VanDerWaalsContact C-NH2 3.33Å; V82-R112 VanDerWaalsContact N-NH2 3.17Å; V82-R112 PolarHBondContact O-NE 3.06Å; V82-R112 PolarHBondContact O-NH2 2.61Å; K83-R112 WeakPolarHBondContact O-CB 3.43Å; K83-R112 PolarHBondContact O-N 3.43Å
113	G	93	Very high	95.4	Very high	79 Å²	79	66 Å²	66	81%	0.814	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.7	-13.3	-177.8	0	0	0	0	0	113.7	L111	L111-G113 PolarHBondContact O-N 2.8Å
114	D	94.3	Very high	95.4	Very high	78 Å²	78	71.4 Å²	71.4	42%	0.417	37%	0.368	S	S	.	.	S	Bend	trans	-68.7	166	165.8	-67.7	-16.2	0	0	0	110.5	V110 L111 P116	V110-D114 HydrophobicContact CG1-CB 4.01Å; L111-D114 WeakPolarHBondContact CB-OD2 3.45Å; L111-D114 PolarHBondContact N-OD2 2.92Å; L111-D114 VanDerWaalsContact O-CB 3.31Å; L111-D114 WeakPolarHBondContact O-CB 3.33Å; L111-D114 PolarHBondContact O-N 3.37Å; D114-P116 VanDerWaalsContact O-CD 3.23Å; D114-P116 WeakPolarHBondContact O-CD 3.23Å
115	N	93.6	Very high	95.2	Very high	116 Å²	116	69.7 Å²	69.7	62%	0.62	36%	0.357	S	S	*	.			trans	-63.5	116.6	172.3	-174.2	-5.1	0	0	0	110	K117	N115-K117 PolarHBondContact O-N 2.99Å; N115-K117 WeakPolarHBondContact OD1-CB 3.5Å; N115-K117 PolarHBondContact OD1-N 3Å
116	P	90.6	Very high	95.2	Very high	30 Å²	30	75.5 Å²	75.5	20%	0.195	38%	0.383	C	S	.	.			trans	-73.2	-15.5	-178.3	30.1	-35.4	0	0	0	113.1	L74 E75 D114 L118	L74-P116 VanDerWaalsContact CB-O 3.32Å; L74-P116 WeakPolarHBondContact CB-O 3.47Å; L74-P116 PolarHBondContact N-O 3.49Å; E75-P116 HydrophobicContact CB-CB 3.8Å; E75-P116 HydrophobicContact CB-CG 3.78Å; E75-P116 HydrophobicContact CG-CB 4.37Å; E75-P116 HydrophobicContact CG-CG 3.95Å; D114-P116 VanDerWaalsContact O-CD 3.23Å; D114-P116 WeakPolarHBondContact O-CD 3.23Å; P116-L118 PolarHBondContact O-N 3.11Å
117	K	94.2	Very high	95.1	Very high	102 Å²	102	79.3 Å²	79.3	44%	0.443	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	109.8	179.4	-65.5	-179.9	-179.8	178	0	109.8	D73 N115 L119	D73-K117 WeakPolarHBondContact OD2-CE 3.37Å; N115-K117 PolarHBondContact O-N 2.99Å; N115-K117 WeakPolarHBondContact OD1-CB 3.5Å; N115-K117 PolarHBondContact OD1-N 3Å; K117-L119 PolarHBondContact O-N 2.82Å
118	L	94.3	Very high	94.8	Very high	6 Å²	6	84.5 Å²	84.5	3%	0.031	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	103.8	176.9	-167.8	66.7	0	0	0	108.8	I70 T71 A72 L87 K108 P116 L120 L146	I70-L118 HydrophobicContact CB-CD2 4.3Å; I70-L118 HydrophobicContact CG2-CD2 3.56Å; I70-L118 HydrophobicContact CG2-CG 4.28Å; T71-L118 VanDerWaalsContact CA-O 3.25Å; T71-L118 WeakPolarHBondContact CA-O 3.47Å; A72-L118 HydrophobicContact CB-CB 4.29Å; A72-L118 PolarHBondContact N-O 2.84Å; A72-L118 WeakPolarHBondContact O-CB 3.39Å; A72-L118 PolarHBondContact O-N 2.85Å; L87-L118 HydrophobicContact CD1-CD1 4.42Å; L87-L118 HydrophobicContact CD1-CD2 4.08Å; K108-L118 HydrophobicContact CD-CD1 4.32Å; P116-L118 PolarHBondContact O-N 3.11Å; L118-L120 HydrophobicContact CD1-CD1 3.69Å; L118-L120 HydrophobicContact CD1-CD2 4.24Å; L118-L120 HydrophobicContact CD1-CG 3.74Å; L118-L120 HydrophobicContact CD2-CD1 4.4Å; L118-L120 HydrophobicContact CG-CD1 4.05Å; L118-L120 HydrophobicContact CG-CG 4Å; L118-L146 HydrophobicContact CD2-CD2 4.13Å
119	L	95.6	Very high	94.6	Very high	122 Å²	122	80.6 Å²	80.6	64%	0.639	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	89	174.4	-65.6	173.4	0	0	0	108.6	T71 K117	T71-L119 HydrophobicContact CG2-CD2 3.75Å; K117-L119 PolarHBondContact O-N 2.82Å
120	L	95.5	Very high	94.3	Very high	24 Å²	24	80.2 Å²	80.2	13%	0.126	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	132.2	-178.8	-62	-177.5	0	0	0	109.9	D69 I70 W106 L118 M123	D69-L120 CarbonylContact C-O 3.6Å; D69-L120 VanDerWaalsContact CA-O 3.28Å; D69-L120 WeakPolarHBondContact CA-O 3.47Å; D69-L120 WeakPolarHBondContact CB-O 3.14Å; I70-L120 HydrophobicContact CB-CB 4.27Å; I70-L120 HydrophobicContact CB-CD1 4.47Å; I70-L120 PolarHBondContact N-O 2.96Å; I70-L120 PolarHBondContact O-N 3.43Å; W106-L120 HydrophobicContact CH2-CD1 3.45Å; W106-L120 VanDerWaalsContact CH2-CD1 3.45Å; W106-L120 HydrophobicContact CZ2-CD1 3.45Å; W106-L120 VanDerWaalsContact CZ2-CD1 3.45Å; W106-L120 HydrophobicContact CZ3-CD1 4.35Å; L118-L120 HydrophobicContact CD1-CD1 3.69Å; L118-L120 HydrophobicContact CD1-CD2 4.24Å; L118-L120 HydrophobicContact CD1-CG 3.74Å; L118-L120 HydrophobicContact CD2-CD1 4.4Å; L118-L120 HydrophobicContact CG-CD1 4.05Å; L118-L120 HydrophobicContact CG-CG 4Å; L120-M123 HydrophobicContact CB-CG 3.64Å; L120-M123 HydrophobicContact CB-SD 4.32Å; L120-M123 HydrophobicContact CD1-CG 4.25Å; L120-M123 HydrophobicContact CD2-SD 4.3Å; L120-M123 HydrophobicContact CG-CG 4.38Å
121	K	96.1	Very high	94	Very high	168 Å²	168	80.2 Å²	80.2	73%	0.73	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.2	142.9	179.6	-65.4	-171.7	176.6	-172.9	0	110.7	D69 M123	D69-K121 VanDerWaalsContact OD1-CA 3.31Å; D69-K121 WeakPolarHBondContact OD1-CA 3.48Å; K121-M123 PolarHBondContact O-N 3.24Å
122	D	95.6	Very high	93.3	Very high	110 Å²	110	81.2 Å²	81.2	59%	0.588	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	50.7	36.7	178.5	-65.7	-53.5	0	0	0	113.3	T67 D69	T67-D122 HydrophobicContact CG2-CB 4.37Å; D69-D122 PolarHBondContact OD1-N 3.17Å
123	M	96.5	Very high	92.9	Very high	55 Å²	55	76.6 Å²	76.6	27%	0.271	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	133.1	179.7	-64.2	-57.3	-60.7	0	0	110	T67 F68 L120 K121	T67-M123 CarbonylContact C-O 3.51Å; T67-M123 VanDerWaalsContact CA-O 3.24Å; T67-M123 WeakPolarHBondContact CA-O 3.47Å; F68-M123 HydrophobicContact CD2-CB 4.05Å; F68-M123 HydrophobicContact CE1-CB 4.3Å; F68-M123 HydrophobicContact CE2-CB 3.62Å; F68-M123 HydrophobicContact CE2-CG 4.32Å; F68-M123 HydrophobicContact CZ-CB 3.77Å; F68-M123 PolarHBondContact N-O 3.33Å; F68-M123 WeakPolarHBondContact O-CB 3.24Å; F68-M123 PolarHBondContact O-N 2.78Å; L120-M123 HydrophobicContact CB-CG 3.64Å; L120-M123 HydrophobicContact CB-SD 4.32Å; L120-M123 HydrophobicContact CD1-CG 4.25Å; L120-M123 HydrophobicContact CD2-SD 4.3Å; L120-M123 HydrophobicContact CG-CG 4.38Å; K121-M123 PolarHBondContact O-N 3.24Å
124	K	95	Very high	92.6	Very high	147 Å²	147	76.9 Å²	76.9	64%	0.639	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	152.9	171.6	-62.1	178.2	-176.1	174.7	0	109.9	K126	K124-K126 PolarHBondContact O-N 2.75Å
125	T	94.2	Very high	92.4	Very high	21 Å²	21	74.3 Å²	74.3	13%	0.129	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-55.9	132.3	169.2	55.7	0	0	0	0	110.3	I66 F68 L105	I66-T125 HydrophobicContact CB-CG2 3.89Å; I66-T125 WeakPolarHBondContact O-CG2 3.48Å; I66-T125 PolarHBondContact O-N 3.39Å; F68-T125 HydrophobicContact CE1-CG2 4.38Å; L105-T125 HydrophobicContact CB-CG2 3.86Å; L105-T125 HydrophobicContact CD1-CG2 4.05Å; L105-T125 HydrophobicContact CD2-CG2 4.31Å; L105-T125 HydrophobicContact CG-CG2 4.32Å; L105-T125 CarbonylContact O-C 3.53Å
126	K	95.1	Very high	92.3	Very high	122 Å²	122	68.8 Å²	68.8	53%	0.53	34%	0.335	S	S	.	.	S	Bend	trans	-83	-41.2	176.8	179.6	-174.9	172.5	-170.3	0	110.4	L105 D107 K124	L105-K126 PolarHBondContact O-N 2.93Å; D107-K126 WeakPolarHBondContact OD1-CD 3.26Å; D107-K126 WeakPolarHBondContact OD1-CE 3.4Å; D107-K126 IonicContact OD1-NZ 2.62Å; D107-K126 PolarHBondContact OD1-NZ 3.43Å; D107-K126 IonicContact OD2-NZ 3.63Å; K124-K126 PolarHBondContact O-N 2.75Å
127	Y	95.9	Very high	92.3	Very high	97 Å²	97	71.9 Å²	71.9	38%	0.38	35%	0.346	S	S	.	.	S	Bend	trans	-96.8	149	176.3	-58.4	-68.5	0	0	0	110	V104 L105 D107 F129	V104-Y127 HydrophobicContact CG1-CD2 4.24Å; V104-Y127 HydrophobicContact CG1-CE2 4.45Å; V104-Y127 WeakPolarHBondContact O-CB 3.35Å; L105-Y127 PolarHBondContact O-N 3.03Å; D107-Y127 HydrophobicContact CB-CE2 4.36Å; D107-Y127 PolarHBondContact OD1-OH 3.25Å; D107-Y127 PolarHBondContact OD2-OH 2.97Å; Y127-F129 PolarHBondContact O-N 2.91Å
128	F	90.7	Very high	92.2	Very high	134 Å²	134	68 Å²	68	59%	0.588	34%	0.335	S	S	*	.			trans	-70.2	130.2	176.3	-65.7	-63.1	0	0	0	110.2	L63 F65 F130	L63-F128 HydrophobicContact CD1-CB 3.82Å; L63-F128 HydrophobicContact CD1-CD1 4.02Å; L63-F128 HydrophobicContact CD1-CG 4.32Å; L63-F128 HydrophobicContact CD2-CD1 4.47Å; F65-F128 HydrophobicContact CE1-CD1 4.49Å; F128-F130 HydrophobicContact CB-CD2 3.45Å; F128-F130 VanDerWaalsContact CB-CD2 3.45Å; F128-F130 HydrophobicContact CB-CE2 3.3Å; F128-F130 HydrophobicContact CB-CZ 4.34Å; F128-F130 HydrophobicContact CD2-CE2 4.11Å; F128-F130 HydrophobicContact CG-CD2 4.41Å; F128-F130 AromaticContact CG-CE2 3.78Å; F128-F130 HydrophobicContact CG-CE2 3.78Å; F128-F130 PolarHBondContact O-N 3.35Å
129	F	92.5	Very high	92.2	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	80.4	176.3	-170	-175.6	0	0	0	109.5	G64 I66 A91 Y93 V103 L105 Y127 L136 V142 F170	G64-F129 PolarHBondContact N-O 3.42Å; G64-F129 WeakPolarHBondContact O-CB 3.48Å; I66-F129 HydrophobicContact CD1-CD1 3.93Å; I66-F129 HydrophobicContact CD1-CE1 3.96Å; A91-F129 HydrophobicContact CB-CE1 3.92Å; A91-F129 HydrophobicContact CB-CE2 4.4Å; A91-F129 HydrophobicContact CB-CZ 3.73Å; Y93-F129 HydrophobicContact CD1-CE2 4.17Å; Y93-F129 AromaticContact CD1-CZ 3.88Å; Y93-F129 HydrophobicContact CD1-CZ 3.88Å; Y93-F129 AromaticContact CE1-CE2 3.44Å; Y93-F129 HydrophobicContact CE1-CE2 3.44Å; Y93-F129 VanDerWaalsContact CE1-CE2 3.44Å; Y93-F129 AromaticContact CE1-CZ 3.62Å; Y93-F129 HydrophobicContact CE1-CZ 3.62Å; Y93-F129 AromaticContact CZ-CE2 3.9Å; V103-F129 HydrophobicContact CB-CD2 4.01Å; V103-F129 HydrophobicContact CB-CE2 3.95Å; V103-F129 HydrophobicContact CG1-CD2 3.92Å; V103-F129 HydrophobicContact CG1-CE2 4.37Å; V103-F129 HydrophobicContact CG2-CD2 4.15Å; V103-F129 HydrophobicContact CG2-CE2 3.91Å; L105-F129 HydrophobicContact CD2-CB 3.64Å; L105-F129 HydrophobicContact CD2-CD1 3.71Å; L105-F129 HydrophobicContact CD2-CD2 4.09Å; L105-F129 HydrophobicContact CD2-CE1 4.36Å; L105-F129 HydrophobicContact CD2-CG 3.54Å; Y127-F129 PolarHBondContact O-N 2.91Å; F129-L136 HydrophobicContact CD1-CD1 4.46Å; F129-L136 HydrophobicContact CD2-CD1 4.17Å; F129-L136 HydrophobicContact CE1-CD1 4.38Å; F129-L136 HydrophobicContact CE1-CD2 4.07Å; F129-L136 HydrophobicContact CE2-CD1 4.07Å; F129-L136 HydrophobicContact CE2-CD2 3.96Å; F129-L136 HydrophobicContact CG-CD1 4.37Å; F129-L136 HydrophobicContact CZ-CD1 4.19Å; F129-L136 HydrophobicContact CZ-CD2 3.53Å; F129-V142 HydrophobicContact CE1-CG1 4.13Å; F129-V142 HydrophobicContact CZ-CG1 4.18Å; F129-F170 HydrophobicContact CD1-CE1 4.47Å; F129-F170 AromaticContact CD1-CZ 3.88Å; F129-F170 HydrophobicContact CD1-CZ 3.88Å; F129-F170 HydrophobicContact CE1-CE1 4.31Å; F129-F170 HydrophobicContact CE1-CE2 4.11Å; F129-F170 AromaticContact CE1-CZ 3.54Å; F129-F170 HydrophobicContact CE1-CZ 3.54Å
130	F	90.5	Very high	92	Very high	78 Å²	78	73.3 Å²	73.3	34%	0.342	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	140.1	173.7	-75.9	-76.2	0	0	0	110.9	D53 D62 L63 F128	D53-F130 WeakPolarHBondContact OD1-CE1 3.48Å; D62-F130 WeakPolarHBondContact O-CA 3.33Å; L63-F130 HydrophobicContact CB-CD1 4.44Å; L63-F130 HydrophobicContact CB-CE1 4.16Å; L63-F130 HydrophobicContact CD1-CD1 4.12Å; L63-F130 HydrophobicContact CD1-CD2 4.16Å; L63-F130 HydrophobicContact CD1-CE1 3.92Å; L63-F130 HydrophobicContact CD1-CE2 3.97Å; L63-F130 HydrophobicContact CD1-CG 4.23Å; L63-F130 HydrophobicContact CD1-CZ 3.84Å; L63-F130 HydrophobicContact CD2-CE1 4.43Å; L63-F130 HydrophobicContact CD2-CZ 4.27Å; L63-F130 HydrophobicContact CG-CE1 4.39Å; F128-F130 HydrophobicContact CB-CD2 3.45Å; F128-F130 VanDerWaalsContact CB-CD2 3.45Å; F128-F130 HydrophobicContact CB-CE2 3.3Å; F128-F130 HydrophobicContact CB-CZ 4.34Å; F128-F130 HydrophobicContact CD2-CE2 4.11Å; F128-F130 HydrophobicContact CG-CD2 4.41Å; F128-F130 AromaticContact CG-CE2 3.78Å; F128-F130 HydrophobicContact CG-CE2 3.78Å; F128-F130 PolarHBondContact O-N 3.35Å
131	D	89.7	Confident	91.9	Very high	5 Å²	5	76.1 Å²	76.1	3%	0.027	36%	0.363	C	S	.	.			trans	-112.4	147.5	166.6	-176.7	59.6	0	0	0	109.9	S61 D62 Y93 N101 G133 G135 L136	S61-D131 WeakPolarHBondContact CB-O 3.45Å; D62-D131 HydrophobicContact CB-CB 4.32Å; D62-D131 PolarHBondContact O-N 2.86Å; Y93-D131 WeakPolarHBondContact CE2-OD1 3.1Å; Y93-D131 VanDerWaalsContact CZ-OD1 3.3Å; Y93-D131 PolarHBondContact OH-OD1 3.35Å; N101-D131 PolarHBondContact ND2-OD1 3.23Å; D131-G133 PolarHBondContact O-N 2.81Å; D131-G135 WeakPolarHBondContact OD2-CA 3.46Å; D131-G135 PolarHBondContact OD2-N 2.9Å; D131-L136 HydrophobicContact CB-CD1 3.74Å; D131-L136 HydrophobicContact CB-CG 3.67Å
132	D	83	Confident	91.9	Very high	100 Å²	100	68.1 Å²	68.1	54%	0.535	33%	0.328	S	S	.	.	S	Bend	trans	-74.4	79.6	174.5	59.9	-32.1	0	0	0	110.1	N98	N98-D132 PolarHBondContact ND2-OD2 2.82Å
133	G	84.5	Confident	91.9	Very high	14 Å²	14	64 Å²	64	14%	0.144	31%	0.306	C	S	.	.	S	Bend	trans	111	-139.8	-177.9	0	0	0	0	0	113	S61 D62 D131	S61-G133 WeakPolarHBondContact CA-O 3.37Å; D62-G133 PolarHBondContact N-O 2.82Å; D131-G133 PolarHBondContact O-N 2.81Å
134	N	87.6	Confident	92	Very high	85 Å²	85	61.4 Å²	61.4	46%	0.455	29%	0.294	S	S	.	.	S	Bend	trans	-116.1	36	-172	-55	-67	0	0	0	112.9	N50 D62 Y174	N50-N134 PolarHBondContact ND2-OD1 3.22Å; D62-N134 PolarHBondContact OD1-OD1 3.44Å; D62-N134 VanDerWaalsContact OD2-CA 3.28Å; D62-N134 WeakPolarHBondContact OD2-CA 3.47Å; N134-Y174 PolarHBondContact OD1-OH 2.67Å; N134-Y174 VanDerWaalsContact OD1-OH 3.13Å
135	G	89.4	Confident	92.1	Very high	24 Å²	24	55 Å²	55	25%	0.247	27%	0.267	C	S	.	.			trans	-84.4	-9.3	-173.9	0	0	0	0	0	114.9	D131 N139	D131-G135 WeakPolarHBondContact OD2-CA 3.46Å; D131-G135 PolarHBondContact OD2-N 2.9Å; G135-N139 WeakPolarHBondContact O-CB 3.26Å; G135-N139 PolarHBondContact O-ND2 3.22Å
136	L	91.2	Very high	92.2	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.261	C	S	.	.	S	Bend	trans	-85.7	-34	174.6	-67.4	174.8	0	0	0	111.7	L48 D62 Y93 F129 D131 G138 N139 V142 F170	L48-L136 HydrophobicContact CD1-CB 3.9Å; L48-L136 HydrophobicContact CD1-CD1 4.36Å; D62-L136 HydrophobicContact CB-CB 3.96Å; D62-L136 HydrophobicContact CB-CD1 4.04Å; D62-L136 HydrophobicContact CB-CG 4.3Å; D62-L136 PolarHBondContact OD2-N 3Å; Y93-L136 HydrophobicContact CD1-CD2 4.41Å; Y93-L136 HydrophobicContact CD2-CD2 3.85Å; Y93-L136 HydrophobicContact CE1-CD2 4.23Å; Y93-L136 HydrophobicContact CE2-CD2 3.6Å; Y93-L136 HydrophobicContact CE2-CG 4.32Å; Y93-L136 HydrophobicContact CG-CD2 4.25Å; F129-L136 HydrophobicContact CD1-CD1 4.46Å; F129-L136 HydrophobicContact CD2-CD1 4.17Å; F129-L136 HydrophobicContact CE1-CD1 4.38Å; F129-L136 HydrophobicContact CE1-CD2 4.07Å; F129-L136 HydrophobicContact CE2-CD1 4.07Å; F129-L136 HydrophobicContact CE2-CD2 3.96Å; F129-L136 HydrophobicContact CG-CD1 4.37Å; F129-L136 HydrophobicContact CZ-CD1 4.19Å; F129-L136 HydrophobicContact CZ-CD2 3.53Å; D131-L136 HydrophobicContact CB-CD1 3.74Å; D131-L136 HydrophobicContact CB-CG 3.67Å; L136-G138 PolarHBondContact O-N 3.46Å; L136-G138 VanDerWaalsContact O-N 3.16Å; L136-N139 VanDerWaalsContact O-CB 3.28Å; L136-N139 WeakPolarHBondContact O-CB 3.32Å; L136-N139 PolarHBondContact O-N 3.46Å; L136-V142 HydrophobicContact CD2-CG2 4.48Å; L136-F170 HydrophobicContact CB-CD1 4.12Å; L136-F170 HydrophobicContact CB-CE1 4.48Å; L136-F170 WeakPolarHBondContact O-CB 3.21Å
137	K	91.8	Very high	92.3	Very high	95 Å²	95	48.4 Å²	48.4	41%	0.413	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	119	177	-170.7	-170.4	-176.9	174.8	0	111.6	L48 D62 N139 D172 Y174	L48-K137 VanDerWaalsContact CD2-CA 3.46Å; L48-K137 HydrophobicContact CD2-CB 3.77Å; L48-K137 HydrophobicContact CD2-CG 4.16Å; D62-K137 PolarHBondContact OD2-N 3.49Å; K137-N139 PolarHBondContact O-N 3.19Å; K137-D172 WeakPolarHBondContact CE-O 3.45Å; K137-Y174 HydrophobicContact CB-CE1 4.29Å; K137-Y174 HydrophobicContact CD-CE1 4.35Å; K137-Y174 HydrophobicContact CD-CE2 3.78Å; K137-Y174 HydrophobicContact CG-CE1 4.4Å
138	G	91.9	Very high	92.4	Very high	21 Å²	21	43.8 Å²	43.8	22%	0.216	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	15.1	-178.5	0	0	0	0	0	114.8	L136 R140 P171 D172	L136-G138 PolarHBondContact O-N 3.46Å; L136-G138 VanDerWaalsContact O-N 3.16Å; G138-R140 PolarHBondContact O-N 2.89Å; G138-P171 PolarHBondContact N-O 2.99Å; G138-D172 WeakPolarHBondContact CA-OD1 3.4Å
139	N	93.3	Very high	92.7	Very high	20 Å²	20	38.9 Å²	38.9	11%	0.107	20%	0.199	C	C	.	.			trans	-69.6	119.4	174.9	-161.8	-37.7	0	0	0	109.8	S94 G135 L136 K137 N141 V142 P169 F170	S94-N139 PolarHBondContact O-ND2 2.98Å; G135-N139 WeakPolarHBondContact O-CB 3.26Å; G135-N139 PolarHBondContact O-ND2 3.22Å; L136-N139 VanDerWaalsContact O-CB 3.28Å; L136-N139 WeakPolarHBondContact O-CB 3.32Å; L136-N139 PolarHBondContact O-N 3.46Å; K137-N139 PolarHBondContact O-N 3.19Å; N139-N141 PolarHBondContact OD1-N 3.28Å; N139-N141 VanDerWaalsContact OD1-N 3.14Å; N139-V142 HydrophobicContact CB-CG2 4.25Å; N139-P169 CarbonylContact O-C 3.59Å; N139-P169 WeakPolarHBondContact O-CA 3.37Å; N139-F170 PolarHBondContact O-N 3.4Å
140	R	92.1	Very high	92.8	Very high	220 Å²	220	39 Å²	39	83%	0.83	20%	0.199	S	C	*	.	S	Bend	trans	-81.2	-17	-173.9	-63.5	-173.6	177.8	-172	-1.2	113.7	G138	G138-R140 PolarHBondContact O-N 2.89Å
141	N	93.6	Very high	93.1	Very high	83 Å²	83	36.6 Å²	36.6	44%	0.444	19%	0.191	S	C	.	.			trans	-137.1	82.5	-171.3	-169.5	9.2	0	0	0	111.2	N139 T143 S167	N139-N141 PolarHBondContact OD1-N 3.28Å; N139-N141 VanDerWaalsContact OD1-N 3.14Å; N141-T143 PolarHBondContact OD1-OG1 3.25Å; N141-T143 VanDerWaalsContact OD1-OG1 3.05Å; N141-S167 VanDerWaalsContact OD1-CB 3.28Å; N141-S167 WeakPolarHBondContact OD1-CB 3.28Å; N141-S167 PolarHBondContact OD1-OG 3.47Å
142	V	95.7	Very high	93.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	110.5	165.4	-176.2	0	0	0	0	107.9	A91 Y93 F129 L136 N139 S167 V168 F170	A91-V142 HydrophobicContact CB-CG1 3.95Å; Y93-V142 HydrophobicContact CG-CG2 4.49Å; F129-V142 HydrophobicContact CE1-CG1 4.13Å; F129-V142 HydrophobicContact CZ-CG1 4.18Å; L136-V142 HydrophobicContact CD2-CG2 4.48Å; N139-V142 HydrophobicContact CB-CG2 4.25Å; V142-S167 WeakPolarHBondContact O-CA 3.44Å; V142-V168 PolarHBondContact N-O 2.95Å; V142-V168 PolarHBondContact O-N 3.07Å; V142-F170 HydrophobicContact CB-CD2 3.86Å; V142-F170 HydrophobicContact CB-CE2 3.81Å; V142-F170 HydrophobicContact CG1-CD2 4.41Å; V142-F170 HydrophobicContact CG1-CE2 3.86Å; V142-F170 HydrophobicContact CG2-CD2 3.4Å; V142-F170 VanDerWaalsContact CG2-CD2 3.4Å; V142-F170 HydrophobicContact CG2-CE2 3.7Å; V142-F170 HydrophobicContact CG2-CG 4.25Å
143	T	96.7	Very high	94	Very high	22 Å²	22	37.3 Å²	37.3	14%	0.135	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	121.3	-176.2	-60	0	0	0	0	110.3	A91 E92 N141 H165 V166 S167	A91-T143 CarbonylContact C-O 3.57Å; A91-T143 WeakPolarHBondContact CA-O 3.31Å; E92-T143 PolarHBondContact N-O 3.49Å; E92-T143 PolarHBondContact O-N 2.98Å; N141-T143 PolarHBondContact OD1-OG1 3.25Å; N141-T143 VanDerWaalsContact OD1-OG1 3.05Å; T143-H165 HydrophobicContact CG2-CB 3.85Å; T143-V166 WeakPolarHBondContact CA-O 3.48Å; T143-S167 PolarHBondContact OG1-OG 3.44Å
144	L	97	Very high	94.4	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	130.4	174.1	-59.4	-178.3	0	0	0	110.4	L41 V43 I66 L89 S90 A91 L105 H165 V166	L41-L144 HydrophobicContact CD1-CB 4.44Å; L41-L144 WeakPolarHBondContact CD1-O 3.42Å; V43-L144 HydrophobicContact CG2-CD1 3.43Å; V43-L144 VanDerWaalsContact CG2-CD1 3.43Å; I66-L144 HydrophobicContact CD1-CD1 4.48Å; I66-L144 HydrophobicContact CD1-CD2 4.13Å; I66-L144 HydrophobicContact CG2-CD1 4.12Å; L89-L144 HydrophobicContact CD1-CB 4.37Å; S90-L144 WeakPolarHBondContact O-CA 3.34Å; A91-L144 HydrophobicContact CB-CD2 3.6Å; L105-L144 HydrophobicContact CD1-CD2 3.65Å; L144-H165 VanDerWaalsContact O-CA 3.32Å; L144-H165 WeakPolarHBondContact O-CA 3.29Å; L144-V166 HydrophobicContact CB-CG1 3.87Å; L144-V166 HydrophobicContact CD1-CG1 4.32Å; L144-V166 HydrophobicContact CG-CG1 4.45Å; L144-V166 PolarHBondContact N-O 3.17Å; L144-V166 PolarHBondContact O-N 3.39Å; L144-V166 VanDerWaalsContact O-N 3.08Å
145	T	96.9	Very high	94.6	Very high	14 Å²	14	36 Å²	36	9%	0.086	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	130.3	-178.4	-60.6	0	0	0	0	109.6	S90 T161	S90-T145 PolarHBondContact N-O 3.45Å; S90-T145 PolarHBondContact O-N 2.96Å; S90-T145 PolarHBondContact OG-O 2.87Å; T145-T161 HydrophobicContact CG2-CG2 3.3Å
146	L	97.3	Very high	94.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	123.8	171	-175	70.6	0	0	0	109	V39 L41 I70 L87 L89 W106 L118 W148 G162	V39-L146 HydrophobicContact CG1-CB 3.96Å; V39-L146 HydrophobicContact CG1-CD2 3.7Å; V39-L146 HydrophobicContact CG1-CG 4.5Å; V39-L146 HydrophobicContact CG2-CB 4.44Å; V39-L146 HydrophobicContact CG2-CD2 4Å; L41-L146 HydrophobicContact CD2-CB 4.49Å; I70-L146 HydrophobicContact CD1-CD1 4.13Å; I70-L146 HydrophobicContact CG2-CD2 3.81Å; L87-L146 HydrophobicContact CB-CD1 4.48Å; L89-L146 HydrophobicContact CB-CD1 4.47Å; L89-L146 HydrophobicContact CD1-CB 4.38Å; W106-L146 HydrophobicContact CZ3-CD1 4.4Å; L118-L146 HydrophobicContact CD2-CD2 4.13Å; L146-W148 HydrophobicContact CD2-CZ3 4.35Å; L146-W148 HydrophobicContact CG-CE3 4.37Å; L146-W148 HydrophobicContact CG-CZ3 4.4Å; L146-G162 PolarHBondContact O-N 2.95Å
147	S	97.3	Very high	94.9	Very high	4 Å²	4	44 Å²	44	3%	0.028	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	163.2	174	-62.4	0	0	0	0	110	Y88 V160 T161	Y88-S147 PolarHBondContact N-O 3.4Å; Y88-S147 PolarHBondContact O-N 3.38Å; Y88-S147 VanDerWaalsContact O-O 3.09Å; Y88-S147 VanDerWaalsContact OH-CB 3.24Å; Y88-S147 WeakPolarHBondContact OH-CB 3.47Å; S147-V160 CarbonylContact C-O 3.51Å; S147-V160 VanDerWaalsContact CA-O 3.32Å; S147-V160 WeakPolarHBondContact CA-O 3.34Å; S147-V160 WeakPolarHBondContact CB-O 3.34Å; S147-T161 PolarHBondContact OG-OG1 3.42Å
148	W	97	Very high	95	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	148	176	49.3	91.2	0	0	0	112.5	R35 V37 V39 I77 F86 L87 L146 V160	R35-W148 VanDerWaalsContact O-CZ2 3.3Å; R35-W148 WeakPolarHBondContact O-CZ2 3.43Å; R35-W148 PolarHBondContact O-NE1 2.96Å; V37-W148 HydrophobicContact CB-CH2 4.13Å; V37-W148 HydrophobicContact CB-CZ2 4.26Å; V39-W148 HydrophobicContact CG2-CH2 4.14Å; V39-W148 HydrophobicContact CG2-CZ3 3.88Å; I77-W148 HydrophobicContact CD1-CD2 4.47Å; I77-W148 HydrophobicContact CD1-CH2 4.47Å; I77-W148 HydrophobicContact CD1-CZ2 3.62Å; F86-W148 CarbonylContact O-C 3.57Å; F86-W148 WeakPolarHBondContact O-CA 3.24Å; F86-W148 WeakPolarHBondContact O-CB 3.42Å; L87-W148 HydrophobicContact CD2-CB 3.69Å; L87-W148 HydrophobicContact CD2-CD2 4.2Å; L87-W148 HydrophobicContact CD2-CE3 3.89Å; L87-W148 HydrophobicContact CD2-CG 4.17Å; L87-W148 HydrophobicContact CG-CB 4.44Å; L146-W148 HydrophobicContact CD2-CZ3 4.35Å; L146-W148 HydrophobicContact CG-CE3 4.37Å; L146-W148 HydrophobicContact CG-CZ3 4.4Å; W148-V160 HydrophobicContact CZ2-CG1 4.04Å; W148-V160 PolarHBondContact N-O 2.93Å; W148-V160 PolarHBondContact O-N 3.22Å
149	N	96.9	Very high	95.2	Very high	31 Å²	31	45.4 Å²	45.4	17%	0.166	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	127.7	163.4	-169.9	-99.3	0	0	0	109.4	F86 L157 P158 L159	F86-N149 HydrophobicContact CB-CB 4.28Å; F86-N149 PolarHBondContact N-O 3.04Å; F86-N149 PolarHBondContact O-N 2.99Å; N149-L157 PolarHBondContact ND2-O 2.89Å; N149-P158 PolarHBondContact ND2-O 3.48Å; N149-L159 HydrophobicContact CB-CD1 4.09Å
150	V	96.3	Very high	95.2	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	121	176.6	-175.5	0	0	0	0	108.3	I77 V82 L85 P152 L157 P158 V160	I77-V150 HydrophobicContact CG2-CG2 4.27Å; V82-V150 HydrophobicContact CB-CG1 4.34Å; V82-V150 HydrophobicContact CG1-CG1 3.9Å; V82-V150 HydrophobicContact CG2-CG1 3.5Å; L85-V150 HydrophobicContact CD2-CB 4.08Å; L85-V150 HydrophobicContact CD2-CG1 3.93Å; L85-V150 HydrophobicContact CD2-CG2 3.88Å; V150-P152 WeakPolarHBondContact O-CD 3.37Å; V150-L157 WeakPolarHBondContact O-CA 3.43Å; V150-P158 HydrophobicContact CB-CG 3.84Å; V150-P158 HydrophobicContact CG2-CG 4.16Å; V150-P158 PolarHBondContact N-O 3.48Å; V150-P158 WeakPolarHBondContact O-CD 3.25Å; V150-V160 HydrophobicContact CG2-CG2 4.41Å
151	V	96.2	Very high	95.4	Very high	28 Å²	28	38.7 Å²	38.7	17%	0.17	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	102.2	179.1	-173.8	0	0	0	0	108.8	K83 Q84 L157	K83-V151 WeakPolarHBondContact CA-O 3.37Å; K83-V151 WeakPolarHBondContact CB-O 3.44Å; K83-V151 PolarHBondContact N-O 3.49Å; Q84-V151 HydrophobicContact CG-CB 3.59Å; Q84-V151 HydrophobicContact CG-CG1 4.05Å; Q84-V151 HydrophobicContact CG-CG2 3.9Å; Q84-V151 PolarHBondContact N-O 3Å; Q84-V151 WeakPolarHBondContact O-CB 3.49Å; Q84-V151 PolarHBondContact O-N 2.9Å; V151-L157 HydrophobicContact CB-CD2 4.07Å; V151-L157 HydrophobicContact CG1-CD2 3.89Å; V151-L157 HydrophobicContact CG2-CD2 4.1Å
152	P	95.9	Very high	95.3	Very high	19 Å²	19	35.1 Å²	35.1	12%	0.123	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	166.1	175.5	34.8	-32.8	0	0	0	111.7	N81 V150 A154 I156	N81-P152 CarbonylContact O-C 3.51Å; N81-P152 WeakPolarHBondContact O-CA 3.31Å; V150-P152 WeakPolarHBondContact O-CD 3.37Å; P152-A154 VanDerWaalsContact C-N 3.31Å; P152-I156 VanDerWaalsContact CD-O 3.26Å; P152-I156 WeakPolarHBondContact CD-O 3.49Å; P152-I156 WeakPolarHBondContact CG-O 3.44Å
153	N	94.9	Very high	95	Very high	102 Å²	102	38.6 Å²	38.6	55%	0.545	24%	0.235	S	C	.	.	S	Bend	trans	-66.4	-37	167.8	-68.3	-47.8	0	0	0	111	N81 K83	N81-N153 PolarHBondContact O-N 3.03Å; N81-N153 PolarHBondContact O-ND2 3.33Å; N81-N153 PolarHBondContact OD1-N 3.14Å; K83-N153 WeakPolarHBondContact CB-OD1 3.08Å
154	A	92.9	Very high	94.7	Very high	25 Å²	25	38.7 Å²	38.7	21%	0.207	24%	0.24	C	C	.	.	S	Bend	trans	-143.8	125.5	173.4	0	0	0	0	0	111	N81 P152	N81-A154 PolarHBondContact ND2-O 3.42Å; N81-A154 PolarHBondContact OD1-N 3.3Å; P152-A154 VanDerWaalsContact C-N 3.31Å
155	G	92.6	Very high	94.5	Very high	45 Å²	45	45.1 Å²	45.1	46%	0.464	27%	0.27	S	S	.	.	S	Bend	trans	139.7	-161.2	174.8	0	0	0	0	0	114.5
156	I	92.5	Very high	94.5	Very high	95 Å²	95	46 Å²	46	49%	0.487	28%	0.276	S	S	.	.			trans	-78.4	162.2	176.1	59.8	171.9	0	0	0	111.9	F27 P152 P158	F27-I156 HydrophobicContact CE2-CB 4.44Å; F27-I156 HydrophobicContact CE2-CG1 4.19Å; F27-I156 HydrophobicContact CE2-CG2 3.91Å; F27-I156 HydrophobicContact CZ-CG2 4.21Å; P152-I156 VanDerWaalsContact CD-O 3.26Å; P152-I156 WeakPolarHBondContact CD-O 3.49Å; P152-I156 WeakPolarHBondContact CG-O 3.44Å; I156-P158 VanDerWaalsContact C-CD 3.47Å; I156-P158 WeakPolarHBondContact O-CD 3.46Å
157	L	94	Very high	94.4	Very high	99 Å²	99	48.9 Å²	48.9	52%	0.518	30%	0.296	S	S	.	.			trans	-104.7	75.6	177.2	-62.7	176.8	0	0	0	110.3	N149 V150 V151 L159	N149-L157 PolarHBondContact ND2-O 2.89Å; V150-L157 WeakPolarHBondContact O-CA 3.43Å; V151-L157 HydrophobicContact CB-CD2 4.07Å; V151-L157 HydrophobicContact CG1-CD2 3.89Å; V151-L157 HydrophobicContact CG2-CD2 4.1Å; L157-L159 PolarHBondContact O-N 2.74Å
158	P	93.8	Very high	94.2	Very high	34 Å²	34	49.5 Å²	49.5	22%	0.221	30%	0.299	C	S	.	.			trans	-68.5	135.5	-174.5	30.3	-34.3	0	0	0	110.1	N149 V150 I156 V160	N149-P158 PolarHBondContact ND2-O 3.48Å; V150-P158 HydrophobicContact CB-CG 3.84Å; V150-P158 HydrophobicContact CG2-CG 4.16Å; V150-P158 PolarHBondContact N-O 3.48Å; V150-P158 WeakPolarHBondContact O-CD 3.25Å; I156-P158 VanDerWaalsContact C-CD 3.47Å; I156-P158 WeakPolarHBondContact O-CD 3.46Å; P158-V160 HydrophobicContact CB-CG2 4.45Å
159	L	95.4	Very high	94.2	Very high	111 Å²	111	53.6 Å²	53.6	58%	0.581	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	125.2	169.4	-160.3	67.6	0	0	0	108.2	Y88 N149 L157	Y88-L159 HydrophobicContact CE1-CD1 3.73Å; Y88-L159 WeakPolarHBondContact OH-CD1 3.23Å; Y88-L159 WeakPolarHBondContact OH-CD2 3.46Å; Y88-L159 WeakPolarHBondContact OH-CG 3.3Å; N149-L159 HydrophobicContact CB-CD1 4.09Å; L157-L159 PolarHBondContact O-N 2.74Å
160	V	95.2	Very high	94	Very high	23 Å²	23	52.5 Å²	52.5	14%	0.139	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	136.2	-176.8	-176.7	0	0	0	0	108.7	R35 S147 W148 V150 P158	R35-V160 HydrophobicContact CB-CG2 4.3Å; S147-V160 CarbonylContact C-O 3.51Å; S147-V160 VanDerWaalsContact CA-O 3.32Å; S147-V160 WeakPolarHBondContact CA-O 3.34Å; S147-V160 WeakPolarHBondContact CB-O 3.34Å; W148-V160 HydrophobicContact CZ2-CG1 4.04Å; W148-V160 PolarHBondContact N-O 2.93Å; W148-V160 PolarHBondContact O-N 3.22Å; V150-V160 HydrophobicContact CG2-CG2 4.41Å; P158-V160 HydrophobicContact CB-CG2 4.45Å
161	T	94.9	Very high	93.9	Very high	76 Å²	76	54.3 Å²	54.3	47%	0.466	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	135	176.1	-62.5	0	0	0	0	109.5	T145 S147	T145-T161 HydrophobicContact CG2-CG2 3.3Å; S147-T161 PolarHBondContact OG-OG1 3.42Å
162	G	91.5	Very high	93.7	Very high	8 Å²	8	58.6 Å²	58.6	8%	0.082	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	152.5	178.1	0	0	0	0	0	112.8	V37 L146 G164	V37-G162 WeakPolarHBondContact O-CA 3.09Å; L146-G162 PolarHBondContact O-N 2.95Å; G162-G164 VanDerWaalsContact C-N 3.31Å; G162-G164 PolarHBondContact O-N 2.98Å
163	S	89	Confident	93.6	Very high	73 Å²	73	62.7 Å²	62.7	51%	0.51	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	83.7	173.3	46.7	0	0	0	0	109.7	V37 P38 V39	V37-S163 PolarHBondContact O-N 2.86Å; V37-S163 PolarHBondContact O-OG 2.92Å; P38-S163 WeakPolarHBondContact CA-O 3.37Å; P38-S163 WeakPolarHBondContact CA-OG 3.35Å; V39-S163 PolarHBondContact N-O 3.38Å; V39-S163 VanDerWaalsContact N-O 3.12Å
164	G	90.4	Very high	93.5	Very high	23 Å²	23	60.4 Å²	60.4	24%	0.237	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163	126.9	177.2	0	0	0	0	0	111.6	G162	G162-G164 VanDerWaalsContact C-N 3.31Å; G162-G164 PolarHBondContact O-N 2.98Å
165	H	94.3	Very high	93.2	Very high	136 Å²	136	63.1 Å²	63.1	63%	0.63	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.4	156.6	173.1	57.4	-90.1	0	0	0	108.8	T143 L144	T143-H165 HydrophobicContact CG2-CB 3.85Å; L144-H165 VanDerWaalsContact O-CA 3.32Å; L144-H165 WeakPolarHBondContact O-CA 3.29Å
166	V	95.6	Very high	92.6	Very high	34 Å²	34	68.2 Å²	68.2	21%	0.206	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	122.3	174.1	62.4	0	0	0	0	109.1	L41 V43 T143 L144 V168	L41-V166 HydrophobicContact CB-CB 4.29Å; L41-V166 HydrophobicContact CB-CG1 3.63Å; L41-V166 HydrophobicContact CD1-CG1 4.35Å; V43-V166 HydrophobicContact CG2-CG1 4Å; T143-V166 WeakPolarHBondContact CA-O 3.48Å; L144-V166 HydrophobicContact CB-CG1 3.87Å; L144-V166 HydrophobicContact CD1-CG1 4.32Å; L144-V166 HydrophobicContact CG-CG1 4.45Å; L144-V166 PolarHBondContact N-O 3.17Å; L144-V166 PolarHBondContact O-N 3.39Å; L144-V166 VanDerWaalsContact O-N 3.08Å; V166-V168 HydrophobicContact CG2-CG1 4.01Å
167	S	95.3	Very high	91.3	Very high	60 Å²	60	68.7 Å²	68.7	42%	0.42	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	123.8	175.4	-56.7	0	0	0	0	108.9	N141 V142 T143	N141-S167 VanDerWaalsContact OD1-CB 3.28Å; N141-S167 WeakPolarHBondContact OD1-CB 3.28Å; N141-S167 PolarHBondContact OD1-OG 3.47Å; V142-S167 WeakPolarHBondContact O-CA 3.44Å; T143-S167 PolarHBondContact OG1-OG 3.44Å
168	V	94.7	Very high	89.7	Confident	17 Å²	17	72.5 Å²	72.5	10%	0.103	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	141.4	-178.6	-65.2	0	0	0	0	111.2	V43 I46 V142 V166	V43-V168 HydrophobicContact CB-CG1 3.92Å; V43-V168 HydrophobicContact CG1-CG1 4.37Å; V43-V168 HydrophobicContact CG2-CG1 3.82Å; V43-V168 HydrophobicContact CG2-CG2 4.44Å; I46-V168 HydrophobicContact CD1-CB 3.76Å; I46-V168 HydrophobicContact CD1-CG2 3.59Å; V142-V168 PolarHBondContact N-O 2.95Å; V142-V168 PolarHBondContact O-N 3.07Å; V166-V168 HydrophobicContact CG2-CG1 4.01Å
169	P	95.2	Very high	87.8	Confident	86 Å²	86	76.4 Å²	76.4	56%	0.558	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-78.9	140.6	171.2	32.4	-33.3	0	0	0	110.4	I46 N139	I46-P169 WeakPolarHBondContact CD1-O 3.27Å; N139-P169 CarbonylContact O-C 3.59Å; N139-P169 WeakPolarHBondContact O-CA 3.37Å
170	F	94.1	Very high	85.7	Confident	8 Å²	8	85 Å²	85	4%	0.035	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-86.5	153.2	169.2	-95.5	-116.4	0	0	0	111.3	I46 L48 I66 F129 L136 N139 V142	I46-F170 HydrophobicContact CG2-CD1 3.83Å; I46-F170 HydrophobicContact CG2-CD2 4.04Å; I46-F170 HydrophobicContact CG2-CE1 3.73Å; I46-F170 HydrophobicContact CG2-CE2 3.94Å; I46-F170 HydrophobicContact CG2-CG 3.99Å; I46-F170 HydrophobicContact CG2-CZ 3.79Å; L48-F170 HydrophobicContact CD1-CD1 4.08Å; L48-F170 HydrophobicContact CD1-CE1 4.27Å; I66-F170 HydrophobicContact CD1-CE2 3.97Å; I66-F170 HydrophobicContact CD1-CZ 3.73Å; I66-F170 HydrophobicContact CG1-CE2 4.35Å; I66-F170 HydrophobicContact CG1-CZ 3.89Å; F129-F170 HydrophobicContact CD1-CE1 4.47Å; F129-F170 AromaticContact CD1-CZ 3.88Å; F129-F170 HydrophobicContact CD1-CZ 3.88Å; F129-F170 HydrophobicContact CE1-CE1 4.31Å; F129-F170 HydrophobicContact CE1-CE2 4.11Å; F129-F170 AromaticContact CE1-CZ 3.54Å; F129-F170 HydrophobicContact CE1-CZ 3.54Å; L136-F170 HydrophobicContact CB-CD1 4.12Å; L136-F170 HydrophobicContact CB-CE1 4.48Å; L136-F170 WeakPolarHBondContact O-CB 3.21Å; N139-F170 PolarHBondContact O-N 3.4Å; V142-F170 HydrophobicContact CB-CD2 3.86Å; V142-F170 HydrophobicContact CB-CE2 3.81Å; V142-F170 HydrophobicContact CG1-CD2 4.41Å; V142-F170 HydrophobicContact CG1-CE2 3.86Å; V142-F170 HydrophobicContact CG2-CD2 3.4Å; V142-F170 VanDerWaalsContact CG2-CD2 3.4Å; V142-F170 HydrophobicContact CG2-CE2 3.7Å; V142-F170 HydrophobicContact CG2-CG 4.25Å
171	P	94	Very high	85.2	Confident	39 Å²	39	88.1 Å²	88.1	25%	0.253	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-67.2	147.5	-178.1	28.2	-35.1	0	0	0	112.2	L48 G138 T173	L48-P171 HydrophobicContact CB-CG 3.75Å; G138-P171 PolarHBondContact N-O 2.99Å; P171-T173 PolarHBondContact O-N 3.35Å
172	D	92.6	Very high	84.7	Confident	118 Å²	118	88.7 Å²	88.7	63%	0.631	48%	0.477	S	S	*	.	S	Bend	trans	-76.3	-11.2	174.5	-65.7	-46.7	0	0	0	113	K137 G138	K137-D172 WeakPolarHBondContact CE-O 3.45Å; G138-D172 WeakPolarHBondContact CA-OD1 3.4Å
173	T	92.6	Very high	84.3	Confident	104 Å²	104	93.2 Å²	93.2	64%	0.638	50%	0.498	S	S	*	.	S	Bend	trans	-126.1	141.2	-175.4	55.8	0	0	0	0	111.3	P171	P171-T173 PolarHBondContact O-N 3.35Å
174	Y	92.6	Very high	84.1	Confident	55 Å²	55	94.4 Å²	94.4	22%	0.216	50%	0.498	C	S	.	.			trans	-73.2	144.8	171.5	-60.7	-61	0	0	0	111.3	L48 N50 D62 N134 K137 I176	L48-Y174 HydrophobicContact CB-CD1 4.38Å; L48-Y174 HydrophobicContact CD2-CD1 3.8Å; L48-Y174 HydrophobicContact CD2-CE1 3.57Å; L48-Y174 HydrophobicContact CG-CD1 3.71Å; L48-Y174 HydrophobicContact CG-CE1 3.74Å; L48-Y174 WeakPolarHBondContact O-CA 3.41Å; N50-Y174 HydrophobicContact CB-CD1 3.87Å; N50-Y174 HydrophobicContact CB-CD2 3.97Å; N50-Y174 HydrophobicContact CB-CE1 3.85Å; N50-Y174 HydrophobicContact CB-CE2 3.93Å; N50-Y174 HydrophobicContact CB-CG 3.93Å; N50-Y174 PolarHBondContact ND2-OH 3.31Å; D62-Y174 WeakPolarHBondContact OD1-CE1 3.41Å; D62-Y174 PolarHBondContact OD1-OH 3.19Å; N134-Y174 PolarHBondContact OD1-OH 2.67Å; N134-Y174 VanDerWaalsContact OD1-OH 3.13Å; K137-Y174 HydrophobicContact CB-CE1 4.29Å; K137-Y174 HydrophobicContact CD-CE1 4.35Å; K137-Y174 HydrophobicContact CD-CE2 3.78Å; K137-Y174 HydrophobicContact CG-CE1 4.4Å; Y174-I176 PolarHBondContact O-N 3.02Å
175	E	87.8	Confident	83.7	Confident	82 Å²	82	98.8 Å²	98.8	38%	0.383	51%	0.514	S	S	.	.			trans	-68	122.4	168.4	-166.5	178.1	-156	0	0	109	M47 L48 K49 T177	M47-E175 WeakPolarHBondContact CE-OE1 3.46Å; L48-E175 PolarHBondContact O-N 3Å; K49-E175 VanDerWaalsContact CE-OE2 3.26Å; K49-E175 WeakPolarHBondContact CE-OE2 3.44Å; K49-E175 HydrophobicContact CG-CB 4.47Å; E175-T177 PolarHBondContact O-N 3.5Å
176	I	79.3	Confident	83	Confident	151 Å²	151	96.3 Å²	96.3	77%	0.774	51%	0.506	S	S	*	.			trans	-70.5	113.3	177.3	-55.5	170.6	0	0	0	107.3	Y174 K178	Y174-I176 PolarHBondContact O-N 3.02Å; I176-K178 PolarHBondContact O-N 3.16Å
177	T	66.2	Low	82.1	Confident	106 Å²	106	100.8 Å²	100.8	65%	0.65	53%	0.528	S	S	*	.			trans	-58.6	111.3	163.3	33.6	0	0	0	0	107.8	E175 S179	E175-T177 PolarHBondContact O-N 3.5Å; T177-S179 PolarHBondContact O-N 3.22Å
178	K	59.3	Low	81.1	Confident	179 Å²	179	103.9 Å²	103.9	78%	0.778	54%	0.536	S	S	*	.			trans	-55.5	110.4	165.6	-73.9	-176.2	177.5	-178.6	0	106.9	I176 Y180	I176-K178 PolarHBondContact O-N 3.16Å; K178-Y180 PolarHBondContact O-N 3.11Å
179	S	53.8	Low	79.9	Confident	116 Å²	116	111.2 Å²	111.2	81%	0.811	57%	0.572	S	S	*	*			trans	-62.4	115.8	161.6	50.8	0	0	0	0	106.4	T177	T177-S179 PolarHBondContact O-N 3.22Å
180	Y	51.6	Low	78.5	Confident	290 Å²	290	113.5 Å²	113.5	100%	1.137	57%	0.573	S	S	*	*			trans	-74.2	0	163.9	-78.6	-82.9	0	0	0	109.5	K178	K178-Y180 PolarHBondContact O-N 3.11Å

Retrieved 180 of 180 residues in 75.6 ms (Link to these results)

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