X5J4J7_MOUSE Loading...

IgA heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4J7, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 92 aa.

						>X5J4J7_MOUSE|X5J4J7
EVVKPGASVKLSCKASGYTFTSFYMYWVKRRPGQGLEWIGEINPSNGGTNYNEKFKSKATLTVDKSSSTAYMQLSSPTSEDSAVYFCTTNWG
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	E	62	Low	80.1	Confident	179 Å²	179	90.7 Å²	90.7	84%	0.836	52%	0.519	S	S	*	.				0	137.7	0	-167.7	172.7	174.5	0	0	108.4	V3 V9	E1-V3 HydrophobicContact CG-CG1 4.2Å; E1-V9 HydrophobicContact CB-CG2 4.26Å
2	V	73.8	Confident	81.5	Confident	150 Å²	150	90.3 Å²	90.3	91%	0.909	53%	0.525	S	S	*	.			trans	-97.4	117.7	173.8	178.9	0	0	0	0	106.9
3	V	75.5	Confident	82.7	Confident	49 Å²	49	84.4 Å²	84.4	30%	0.297	49%	0.492	S	S	.	.			trans	-111.1	148.4	-176.9	-72.8	0	0	0	0	111.8	E1 V9 P77	E1-V3 HydrophobicContact CG-CG1 4.2Å; V3-V9 HydrophobicContact CG1-CB 3.72Å; V3-V9 HydrophobicContact CG1-CG2 3.65Å; V3-V9 HydrophobicContact CG2-CB 4.21Å; V3-P77 HydrophobicContact CG2-CG 3.85Å
4	K	76.1	Confident	83.7	Confident	172 Å²	172	89.5 Å²	89.5	75%	0.748	51%	0.506	S	S	*	.			trans	-68.9	144.7	173.8	-66.7	-177.8	-178.6	179	0	109.7	G6 A7	K4-G6 PolarHBondContact O-N 3.06Å; K4-A7 WeakPolarHBondContact O-CB 3.5Å; K4-A7 PolarHBondContact O-N 3.28Å; K4-A7 VanDerWaalsContact O-N 3.11Å
5	P	68.3	Low	84.5	Confident	126 Å²	126	84.2 Å²	84.2	82%	0.818	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	133.2	173.2	-24.9	33.9	0	0	0	111.3	A7	P5-A7 VanDerWaalsContact C-N 3.32Å; P5-A7 PolarHBondContact O-N 3.3Å
6	G	69.9	Low	85.1	Confident	54 Å²	54	85.3 Å²	85.3	56%	0.557	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	-5.5	-179.4	0	0	0	0	0	115.9	K4	K4-G6 PolarHBondContact O-N 3.06Å
7	A	83.7	Confident	85.5	Confident	41 Å²	41	85.6 Å²	85.6	34%	0.339	52%	0.518	S	S	.	.			trans	-88.5	144.7	171.6	0	0	0	0	0	111.2	K4 P5 P77	K4-A7 WeakPolarHBondContact O-CB 3.5Å; K4-A7 PolarHBondContact O-N 3.28Å; K4-A7 VanDerWaalsContact O-N 3.11Å; P5-A7 VanDerWaalsContact C-N 3.32Å; P5-A7 PolarHBondContact O-N 3.3Å; A7-P77 WeakPolarHBondContact O-CD 3.3Å
8	S	88.4	Confident	85.8	Confident	62 Å²	62	85.3 Å²	85.3	43%	0.434	51%	0.507	S	S	.	.			trans	-75.4	143.9	173.3	-59	0	0	0	0	111.2	L74	S8-L74 CarbonylContact C-O 3.52Å; S8-L74 VanDerWaalsContact CA-O 3.25Å; S8-L74 WeakPolarHBondContact CA-O 3.32Å
9	V	92.4	Very high	86.3	Confident	13 Å²	13	85.5 Å²	85.5	8%	0.079	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	140.5	171	69.7	0	0	0	0	109.9	E1 V3 L11 Q73 L74	E1-V9 HydrophobicContact CB-CG2 4.26Å; V3-V9 HydrophobicContact CG1-CB 3.72Å; V3-V9 HydrophobicContact CG1-CG2 3.65Å; V3-V9 HydrophobicContact CG2-CB 4.21Å; V9-L11 HydrophobicContact CG2-CD2 4.38Å; V9-Q73 CarbonylContact O-C 3.55Å; V9-Q73 VanDerWaalsContact O-CA 3.3Å; V9-Q73 WeakPolarHBondContact O-CA 3.4Å; V9-L74 HydrophobicContact CG1-CB 3.85Å; V9-L74 HydrophobicContact CG1-CD1 4.17Å; V9-L74 HydrophobicContact CG1-CG 4.46Å; V9-L74 PolarHBondContact N-O 3.33Å; V9-L74 PolarHBondContact O-N 3.16Å
10	K	94.9	Very high	86.7	Confident	114 Å²	114	81.6 Å²	81.6	50%	0.496	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	113.3	177.5	-174	177.3	179.2	-179.9	0	109.9	Y71 M72	K10-Y71 HydrophobicContact CD-CD1 4.37Å; K10-Y71 VanDerWaalsContact CE-CG 3.48Å; K10-Y71 HydrophobicContact CG-CD1 4.34Å; K10-M72 WeakPolarHBondContact CA-O 3.21Å
11	L	95.9	Very high	87.1	Confident	38 Å²	38	80.5 Å²	80.5	20%	0.199	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	144.7	173.6	-55.5	-178.4	0	0	0	109.8	V9 W27 Y71 M72 Y85	V9-L11 HydrophobicContact CG2-CD2 4.38Å; L11-W27 HydrophobicContact CB-CH2 4.07Å; L11-W27 HydrophobicContact CB-CZ3 3.83Å; L11-W27 HydrophobicContact CD1-CZ3 4.33Å; L11-Y71 WeakPolarHBondContact O-CA 2.93Å; L11-M72 HydrophobicContact CD1-CE 3.55Å; L11-M72 HydrophobicContact CG-CE 4.45Å; L11-M72 PolarHBondContact N-O 2.79Å; L11-M72 PolarHBondContact O-N 3.21Å; L11-Y85 HydrophobicContact CD1-CD1 4.11Å; L11-Y85 HydrophobicContact CD1-CD2 4.09Å; L11-Y85 HydrophobicContact CD1-CG 3.64Å
12	S	97.4	Very high	88.7	Confident	85 Å²	85	75.7 Å²	75.7	59%	0.594	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	146.2	174.9	61.8	0	0	0	0	110.8	A70 Y71	S12-A70 CarbonylContact C-O 3.58Å; S12-A70 WeakPolarHBondContact CA-O 3.39Å; S12-Y71 VanDerWaalsContact CB-CE1 3.48Å
13	C	97.1	Very high	89.6	Confident	14 Å²	14	72.7 Å²	72.7	10%	0.095	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	105.4	175.6	179.9	0	0	0	0	108.9	W27 T69 A70 C87	C13-W27 HydrophobicContact CB-CH2 3.8Å; C13-W27 HydrophobicContact CB-CZ2 3.98Å; C13-T69 CarbonylContact O-C 3.58Å; C13-T69 WeakPolarHBondContact O-CA 3.31Å; C13-A70 PolarHBondContact N-O 3.46Å; C13-A70 PolarHBondContact O-N 3.1Å; C13-C87 HydrophobicContact CB-CB 3.5Å; C13-C87 VanDerWaalsContact CB-CB 3.5Å; C13-C87 WeakPolarHBondContact CB-SG 3.49Å; C13-C87 WeakPolarHBondContact SG-CB 3.39Å; C13-C87 CovalentContact SG-SG 2.01Å; C13-C87 PolarHBondContact SG-SG 3.47Å
14	K	96.9	Very high	90.6	Very high	156 Å²	156	75.2 Å²	75.2	68%	0.678	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	120.7	179.8	-172.8	173.9	-176.5	178.8	0	110
15	A	94.6	Very high	91.6	Very high	10 Å²	10	67.2 Å²	67.2	8%	0.083	41%	0.41	C	S	.	.			trans	-78.3	147	175	0	0	0	0	0	111.2	Y18 F20 S68	A15-Y18 HydrophobicContact CB-CE1 4.04Å; A15-Y18 HydrophobicContact CB-CE2 4.08Å; A15-Y18 WeakPolarHBondContact CB-OH 3.28Å; A15-F20 HydrophobicContact CB-CB 4.26Å; A15-F20 HydrophobicContact CB-CD2 3.35Å; A15-F20 HydrophobicContact CB-CE2 3.98Å; A15-F20 HydrophobicContact CB-CG 4.1Å; A15-S68 PolarHBondContact N-O 3.11Å
16	S	93.9	Very high	93	Very high	101 Å²	101	63 Å²	63	71%	0.706	38%	0.379	S	S	*	.			trans	-153	152.8	173	63.6	0	0	0	0	110.4	Y18	S16-Y18 WeakPolarHBondContact O-CD1 3.43Å; S16-Y18 WeakPolarHBondContact O-CE1 3.38Å
17	G	93.1	Very high	94.3	Very high	91 Å²	91	60.7 Å²	60.7	94%	0.938	35%	0.353	S	S	*	.	S	Bend	trans	82.6	4.5	177.5	0	0	0	0	0	115.7
18	Y	90.8	Very high	94.9	Very high	80 Å²	80	58.9 Å²	58.9	31%	0.314	34%	0.338	S	S	.	.	S	Bend	trans	-155.8	166.5	176.1	62	-87	0	0	0	111.4	A15 S16 F20 F23 T89	A15-Y18 HydrophobicContact CB-CE1 4.04Å; A15-Y18 HydrophobicContact CB-CE2 4.08Å; A15-Y18 WeakPolarHBondContact CB-OH 3.28Å; S16-Y18 WeakPolarHBondContact O-CD1 3.43Å; S16-Y18 WeakPolarHBondContact O-CE1 3.38Å; Y18-F20 PolarHBondContact O-N 2.73Å; Y18-F20 VanDerWaalsContact O-N 3.13Å; Y18-F23 AromaticContact CD2-CD2 3.43Å; Y18-F23 HydrophobicContact CD2-CD2 3.43Å; Y18-F23 VanDerWaalsContact CD2-CD2 3.43Å; Y18-F23 AromaticContact CD2-CE2 3.84Å; Y18-F23 HydrophobicContact CD2-CE2 3.84Å; Y18-F23 HydrophobicContact CD2-CG 4.37Å; Y18-F23 HydrophobicContact CE2-CB 4.34Å; Y18-F23 AromaticContact CE2-CD2 3.85Å; Y18-F23 HydrophobicContact CE2-CD2 3.85Å; Y18-F23 HydrophobicContact CE2-CG 4.4Å; Y18-F23 HydrophobicContact CG-CD2 4.29Å; Y18-F23 HydrophobicContact CG-CE2 4.3Å; Y18-T89 HydrophobicContact CE1-CG2 4.3Å; Y18-T89 HydrophobicContact CE2-CG2 3.88Å; Y18-T89 WeakPolarHBondContact OH-CG2 3.46Å
19	T	94.6	Very high	95.2	Very high	89 Å²	89	56.2 Å²	56.2	55%	0.546	32%	0.318	S	S	.	.			trans	-69.8	105.4	172.9	-57.8	0	0	0	0	109.9	T21 S22	T19-T21 PolarHBondContact O-N 3.35Å; T19-T21 VanDerWaalsContact O-N 3.1Å; T19-S22 WeakPolarHBondContact CB-OG 3.44Å; T19-S22 WeakPolarHBondContact CG2-OG 2.97Å; T19-S22 WeakPolarHBondContact O-CB 3.22Å; T19-S22 PolarHBondContact O-N 2.73Å
20	F	94.4	Very high	95.3	Very high	8 Å²	8	61.5 Å²	61.5	4%	0.035	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-53.1	-36.3	-174.1	177.4	-125.8	0	0	0	113.8	A15 Y18 S22 M25 P44 V63 A70	A15-F20 HydrophobicContact CB-CB 4.26Å; A15-F20 HydrophobicContact CB-CD2 3.35Å; A15-F20 HydrophobicContact CB-CE2 3.98Å; A15-F20 HydrophobicContact CB-CG 4.1Å; Y18-F20 PolarHBondContact O-N 2.73Å; Y18-F20 VanDerWaalsContact O-N 3.13Å; F20-S22 VanDerWaalsContact C-N 3.26Å; F20-S22 PolarHBondContact O-N 2.76Å; F20-M25 HydrophobicContact CE2-CE 3.9Å; F20-P44 HydrophobicContact CD1-CB 3.86Å; F20-P44 HydrophobicContact CD2-CB 4.44Å; F20-P44 HydrophobicContact CD2-CG 4.28Å; F20-P44 HydrophobicContact CE1-CB 3.57Å; F20-P44 HydrophobicContact CE1-CG 4.18Å; F20-P44 HydrophobicContact CE2-CB 4.19Å; F20-P44 HydrophobicContact CE2-CG 3.88Å; F20-P44 HydrophobicContact CG-CB 4.31Å; F20-P44 HydrophobicContact CZ-CB 3.76Å; F20-P44 HydrophobicContact CZ-CG 3.83Å; F20-V63 HydrophobicContact CE1-CB 4.29Å; F20-V63 HydrophobicContact CE1-CG1 4.35Å; F20-V63 HydrophobicContact CZ-CB 4.41Å; F20-V63 HydrophobicContact CZ-CG1 4.04Å; F20-A70 HydrophobicContact CE2-CB 4.4Å; F20-A70 HydrophobicContact CZ-CB 4.08Å
21	T	95.7	Very high	95.1	Very high	58 Å²	58	58.3 Å²	58.3	36%	0.356	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-76.2	-7.3	-180	54.8	0	0	0	0	114.6	T19 K65	T19-T21 PolarHBondContact O-N 3.35Å; T19-T21 VanDerWaalsContact O-N 3.1Å; T21-K65 HydrophobicContact CG2-CD 4.38Å
22	S	94.4	Very high	94.7	Very high	79 Å²	79	62.3 Å²	62.3	55%	0.552	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-86.3	-10.2	-179	-61.5	0	0	0	0	113.6	T19 F20	T19-S22 WeakPolarHBondContact CB-OG 3.44Å; T19-S22 WeakPolarHBondContact CG2-OG 2.97Å; T19-S22 WeakPolarHBondContact O-CB 3.22Å; T19-S22 PolarHBondContact O-N 2.73Å; F20-S22 VanDerWaalsContact C-N 3.26Å; F20-S22 PolarHBondContact O-N 2.76Å
23	F	93.6	Very high	94.3	Very high	87 Å²	87	62.6 Å²	62.6	38%	0.382	37%	0.366	S	S	.	.	S	Bend	trans	-131.9	144.1	-174.9	-62.8	-89	0	0	0	111.4	Y18 P44 T89	Y18-F23 AromaticContact CD2-CD2 3.43Å; Y18-F23 HydrophobicContact CD2-CD2 3.43Å; Y18-F23 VanDerWaalsContact CD2-CD2 3.43Å; Y18-F23 AromaticContact CD2-CE2 3.84Å; Y18-F23 HydrophobicContact CD2-CE2 3.84Å; Y18-F23 HydrophobicContact CD2-CG 4.37Å; Y18-F23 HydrophobicContact CE2-CB 4.34Å; Y18-F23 AromaticContact CE2-CD2 3.85Å; Y18-F23 HydrophobicContact CE2-CD2 3.85Å; Y18-F23 HydrophobicContact CE2-CG 4.4Å; Y18-F23 HydrophobicContact CG-CD2 4.29Å; Y18-F23 HydrophobicContact CG-CE2 4.3Å; F23-P44 WeakPolarHBondContact O-CD 3.41Å; F23-P44 VanDerWaalsContact O-CG 3.3Å; F23-P44 WeakPolarHBondContact O-CG 3.48Å; F23-T89 HydrophobicContact CB-CG2 3.93Å; F23-T89 HydrophobicContact CG-CG2 4.47Å
24	Y	95.9	Very high	93.9	Very high	102 Å²	102	66.8 Å²	66.8	40%	0.4	38%	0.384	S	S	.	.			trans	-66.4	146.3	166.7	-74.9	-104.5	0	0	0	109.7	E41 N43 T89	Y24-E41 HydrophobicContact CD1-CB 4.49Å; Y24-E41 HydrophobicContact CD1-CG 4.12Å; Y24-N43 HydrophobicContact CD1-CB 3.89Å; Y24-N43 HydrophobicContact CE1-CB 3.53Å; Y24-N43 VanDerWaalsContact CZ-ND2 3.34Å; Y24-N43 PolarHBondContact OH-ND2 2.94Å; Y24-N43 VanDerWaalsContact OH-ND2 3.16Å; Y24-T89 WeakPolarHBondContact O-CA 3.11Å
25	M	97.2	Very high	93.5	Very high	3 Å²	3	62 Å²	62	2%	0.015	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	113.9	169.4	-172.5	64.8	67.3	0	0	109.2	F20 E41 I42 A70 C87 T89	F20-M25 HydrophobicContact CE2-CE 3.9Å; M25-E41 CarbonylContact O-C 3.58Å; M25-E41 VanDerWaalsContact O-CA 3.26Å; M25-E41 WeakPolarHBondContact O-CA 3.35Å; M25-I42 HydrophobicContact CB-CG2 3.96Å; M25-I42 PolarHBondContact N-O 3.42Å; M25-I42 PolarHBondContact O-N 2.83Å; M25-A70 HydrophobicContact CB-CB 4.11Å; M25-A70 HydrophobicContact CG-CB 3.68Å; M25-C87 HydrophobicContact CG-CB 4.39Å; M25-C87 HydrophobicContact SD-CB 3.75Å; M25-T89 HydrophobicContact CE-CG2 4.37Å
26	Y	97.5	Very high	93.4	Very high	39 Å²	39	66 Å²	66	15%	0.153	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	137.9	178.1	-60.8	-89.7	0	0	0	110.5	W38 E41 C87 T88 T89 W91	Y26-W38 AromaticContact CD1-NE1 3.68Å; Y26-E41 HydrophobicContact CD1-CB 3.7Å; Y26-E41 HydrophobicContact CE1-CB 3.88Å; Y26-E41 WeakPolarHBondContact CE1-OE2 3.32Å; Y26-E41 HydrophobicContact CG-CB 4.38Å; Y26-E41 PolarHBondContact OH-OE2 2.96Å; Y26-C87 CarbonylContact O-C 3.56Å; Y26-C87 VanDerWaalsContact O-CA 3.24Å; Y26-C87 WeakPolarHBondContact O-CA 3.38Å; Y26-T88 WeakPolarHBondContact CB-O 3.4Å; Y26-T88 WeakPolarHBondContact CD2-O 3.36Å; Y26-T88 PolarHBondContact N-O 3.46Å; Y26-T88 PolarHBondContact O-N 2.79Å; Y26-T89 WeakPolarHBondContact CE2-O 3.27Å; Y26-W91 HydrophobicContact CD1-CB 3.33Å; Y26-W91 AromaticContact CD1-CG 3.76Å; Y26-W91 HydrophobicContact CD1-CG 3.76Å; Y26-W91 HydrophobicContact CD2-CB 3.61Å; Y26-W91 HydrophobicContact CE1-CB 3.58Å; Y26-W91 HydrophobicContact CE1-CG 4.17Å; Y26-W91 HydrophobicContact CE2-CB 3.87Å; Y26-W91 HydrophobicContact CG-CB 3.36Å; Y26-W91 HydrophobicContact CG-CG 4.11Å
27	W	97.7	Very high	93.4	Very high	5 Å²	5	62.9 Å²	62.9	2%	0.019	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132.3	174.5	-69.3	88.8	0	0	0	110.4	L11 C13 I39 G40 L61 A70 M72 C87	L11-W27 HydrophobicContact CB-CH2 4.07Å; L11-W27 HydrophobicContact CB-CZ3 3.83Å; L11-W27 HydrophobicContact CD1-CZ3 4.33Å; C13-W27 HydrophobicContact CB-CH2 3.8Å; C13-W27 HydrophobicContact CB-CZ2 3.98Å; W27-I39 HydrophobicContact CB-CB 4.16Å; W27-I39 HydrophobicContact CB-CD1 4.39Å; W27-I39 WeakPolarHBondContact O-CB 3.4Å; W27-I39 PolarHBondContact O-N 2.81Å; W27-G40 PolarHBondContact N-O 3.11Å; W27-L61 HydrophobicContact CG-CD2 3.97Å; W27-A70 HydrophobicContact CZ2-CB 4.16Å; W27-M72 HydrophobicContact CB-SD 4.01Å; W27-M72 HydrophobicContact CD2-CB 3.62Å; W27-M72 HydrophobicContact CD2-CG 4.44Å; W27-M72 HydrophobicContact CD2-SD 4.17Å; W27-M72 HydrophobicContact CE3-CB 3.71Å; W27-M72 HydrophobicContact CE3-CE 3.98Å; W27-M72 HydrophobicContact CE3-SD 4.11Å; W27-M72 HydrophobicContact CG-CB 4.23Å; W27-M72 HydrophobicContact CG-SD 4.15Å; W27-M72 HydrophobicContact CH2-CB 3.95Å; W27-M72 HydrophobicContact CZ2-CB 3.88Å; W27-M72 HydrophobicContact CZ3-CB 3.88Å; W27-M72 HydrophobicContact CZ3-CE 4.47Å; W27-C87 HydrophobicContact CE3-CB 4.34Å; W27-C87 HydrophobicContact CH2-CB 4.44Å; W27-C87 HydrophobicContact CZ3-CB 4.31Å
28	V	96.1	Very high	93.5	Very high	3 Å²	3	60.9 Å²	60.9	2%	0.018	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	140.3	-170.9	-169.4	0	0	0	0	108.5	L36 E37 Y85 F86 T88 W91	V28-L36 HydrophobicContact CG1-CB 3.86Å; V28-L36 HydrophobicContact CG1-CD2 3.97Å; V28-L36 HydrophobicContact CG1-CG 4.39Å; V28-E37 WeakPolarHBondContact CA-O 3.46Å; V28-E37 WeakPolarHBondContact CG1-O 3.24Å; V28-Y85 CarbonylContact O-C 3.6Å; V28-Y85 WeakPolarHBondContact O-CA 3.36Å; V28-F86 HydrophobicContact CB-CB 4.47Å; V28-F86 PolarHBondContact N-O 3.2Å; V28-F86 PolarHBondContact O-N 2.89Å; V28-T88 HydrophobicContact CG2-CG2 4.44Å; V28-W91 HydrophobicContact CB-CH2 4.35Å; V28-W91 HydrophobicContact CB-CZ3 4.03Å; V28-W91 HydrophobicContact CG1-CH2 3.54Å; V28-W91 HydrophobicContact CG1-CZ3 3.59Å; V28-W91 HydrophobicContact CG2-CD2 4.33Å; V28-W91 HydrophobicContact CG2-CE3 3.5Å; V28-W91 HydrophobicContact CG2-CH2 3.79Å; V28-W91 HydrophobicContact CG2-CZ3 3.2Å
29	K	94.7	Very high	93.8	Very high	5 Å²	5	57.1 Å²	57.1	2%	0.022	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	149	168.2	72.3	-179	-156.4	-168.4	0	111.5	E37 I39 F55 D81 A83 V84 Y85	K29-E37 WeakPolarHBondContact CE-OE1 2.84Å; K29-E37 HydrophobicContact CG-CB 3.79Å; K29-E37 PolarHBondContact N-O 2.82Å; K29-E37 IonicContact NZ-OE1 3.42Å; K29-E37 PolarHBondContact O-N 2.87Å; K29-I39 HydrophobicContact CB-CD1 4.1Å; K29-I39 HydrophobicContact CG-CG1 4.47Å; K29-F55 HydrophobicContact CD-CE1 3.64Å; K29-F55 HydrophobicContact CD-CZ 3.57Å; K29-F55 HydrophobicContact CG-CZ 4.24Å; K29-F55 VanDerWaalsContact NZ-CE1 3.25Å; K29-F55 VanDerWaalsContact NZ-CZ 3.26Å; K29-D81 IonicContact NZ-OD1 3.5Å; K29-A83 HydrophobicContact CB-CB 4.05Å; K29-V84 CarbonylContact C-O 3.58Å; K29-V84 WeakPolarHBondContact CA-O 3.26Å; K29-Y85 HydrophobicContact CB-CD1 3.84Å; K29-Y85 HydrophobicContact CB-CE1 3.7Å; K29-Y85 HydrophobicContact CD-CE1 4.41Å
30	R	93.9	Very high	94	Very high	124 Å²	124	52.9 Å²	52.9	47%	0.468	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	120	174	-168.3	171.5	63.4	-175.2	2.5	109.7	L36 A83 V84 F86	R30-L36 HydrophobicContact CB-CD2 3.81Å; R30-L36 HydrophobicContact CG-CD2 3.95Å; R30-A83 WeakPolarHBondContact O-CB 2.92Å; R30-V84 PolarHBondContact N-O 2.79Å; R30-V84 PolarHBondContact O-N 2.58Å; R30-F86 HydrophobicContact CB-CD2 4.41Å; R30-F86 HydrophobicContact CB-CE2 3.81Å
31	R	91.6	Very high	94.1	Very high	47 Å²	47	54.1 Å²	54.1	18%	0.177	30%	0.302	C	S	.	.			trans	-91.5	147.1	168.8	-56.5	-163.9	-170.3	96.1	-7.9	110.3	G33 Q34 E37 E80 A83	R31-G33 PolarHBondContact O-N 3.29Å; R31-Q34 HydrophobicContact CB-CB 4.05Å; R31-Q34 HydrophobicContact CB-CG 4.16Å; R31-Q34 VanDerWaalsContact CD-OE1 3.28Å; R31-Q34 PolarHBondContact O-N 2.84Å; R31-E37 IonicContact CZ-OE1 3.91Å; R31-E37 IonicContact NH1-OE1 3.68Å; R31-E37 PolarHBondContact NH1-OE1 2.93Å; R31-E37 IonicContact NH2-OE1 2.73Å; R31-E80 PolarHBondContact NE-O 3.06Å; R31-E80 PolarHBondContact NH2-O 2.95Å; R31-A83 HydrophobicContact CG-CB 4.03Å
32	P	88.1	Confident	94.2	Very high	122 Å²	122	51.5 Å²	51.5	79%	0.792	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	129.2	169.9	-23.9	34	0	0	0	110.7	Q34	P32-Q34 PolarHBondContact O-N 3.12Å
33	G	88.1	Confident	94.4	Very high	91 Å²	91	48.4 Å²	48.4	94%	0.938	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	2.6	-179.2	0	0	0	0	0	115.8	R31	R31-G33 PolarHBondContact O-N 3.29Å
34	Q	88.1	Confident	94.5	Very high	102 Å²	102	44.3 Å²	44.3	48%	0.477	25%	0.245	S	C	.	.	S	Bend	trans	-118.6	161.3	173.6	-58.9	-175.6	-10.7	0	0	111.3	R31 P32	R31-Q34 HydrophobicContact CB-CB 4.05Å; R31-Q34 HydrophobicContact CB-CG 4.16Å; R31-Q34 VanDerWaalsContact CD-OE1 3.28Å; R31-Q34 PolarHBondContact O-N 2.84Å; P32-Q34 PolarHBondContact O-N 3.12Å
35	G	89.4	Confident	94.6	Very high	55 Å²	55	41.9 Å²	41.9	57%	0.567	24%	0.244	S	C	*	.			trans	-67.1	175.2	174.3	0	0	0	0	0	113.4
36	L	92.6	Very high	94.5	Very high	96 Å²	96	47.2 Å²	47.2	50%	0.503	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	129.5	169.2	-65	174.2	0	0	0	109.6	V28 R30 W91	V28-L36 HydrophobicContact CG1-CB 3.86Å; V28-L36 HydrophobicContact CG1-CD2 3.97Å; V28-L36 HydrophobicContact CG1-CG 4.39Å; R30-L36 HydrophobicContact CB-CD2 3.81Å; R30-L36 HydrophobicContact CG-CD2 3.95Å; L36-W91 HydrophobicContact CB-CH2 3.99Å; L36-W91 HydrophobicContact CD1-CH2 4.35Å; L36-W91 HydrophobicContact CD1-CZ3 4.3Å
37	E	94.4	Very high	94.5	Very high	34 Å²	34	47 Å²	47	16%	0.159	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	116.2	172.5	-68.2	-170.5	-89.8	0	0	109.2	V28 K29 R31 K54	V28-E37 WeakPolarHBondContact CA-O 3.46Å; V28-E37 WeakPolarHBondContact CG1-O 3.24Å; K29-E37 WeakPolarHBondContact CE-OE1 2.84Å; K29-E37 HydrophobicContact CG-CB 3.79Å; K29-E37 PolarHBondContact N-O 2.82Å; K29-E37 IonicContact NZ-OE1 3.42Å; K29-E37 PolarHBondContact O-N 2.87Å; R31-E37 IonicContact CZ-OE1 3.91Å; R31-E37 IonicContact NH1-OE1 3.68Å; R31-E37 PolarHBondContact NH1-OE1 2.93Å; R31-E37 IonicContact NH2-OE1 2.73Å; E37-K54 IonicContact OE2-NZ 3.79Å; E37-K54 PolarHBondContact OE2-NZ 2.01Å
38	W	95.7	Very high	94.4	Very high	50 Å²	50	48.5 Å²	48.5	19%	0.189	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	131.3	172.4	-178.8	70	0	0	0	110.7	Y26 G40 E41 N50 Y51 N52 W91	Y26-W38 AromaticContact CD1-NE1 3.68Å; W38-G40 VanDerWaalsContact CE2-CA 3.47Å; W38-G40 VanDerWaalsContact CZ2-C 3.49Å; W38-G40 PolarHBondContact NE1-O 3.36Å; W38-E41 HydrophobicContact CZ2-CB 4.23Å; W38-E41 HydrophobicContact CZ2-CG 4.17Å; W38-N50 HydrophobicContact CH2-CB 4.43Å; W38-Y51 VanDerWaalsContact CZ3-C 3.43Å; W38-N52 HydrophobicContact CE3-CB 3.63Å; W38-N52 HydrophobicContact CZ3-CB 3.82Å; W38-N52 WeakPolarHBondContact O-CB 3.36Å; W38-N52 PolarHBondContact O-ND2 3Å; W38-W91 HydrophobicContact CB-CH2 4.42Å; W38-W91 HydrophobicContact CB-CZ2 3.61Å; W38-W91 AromaticContact CD1-CE2 3.73Å; W38-W91 AromaticContact CD1-NE1 3.66Å; W38-W91 HydrophobicContact CG-CZ2 4.23Å; W38-W91 AromaticContact CG-NE1 3.87Å
39	I	96.8	Very high	94.5	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-47.9	-179.6	-60.1	173	0	0	0	110.2	W27 K29 N52 F55 A59 M72 Y85	W27-I39 HydrophobicContact CB-CB 4.16Å; W27-I39 HydrophobicContact CB-CD1 4.39Å; W27-I39 WeakPolarHBondContact O-CB 3.4Å; W27-I39 PolarHBondContact O-N 2.81Å; K29-I39 HydrophobicContact CB-CD1 4.1Å; K29-I39 HydrophobicContact CG-CG1 4.47Å; I39-N52 PolarHBondContact O-N 3.2Å; I39-F55 HydrophobicContact CB-CD2 4.35Å; I39-F55 HydrophobicContact CB-CG 4.3Å; I39-F55 HydrophobicContact CG1-CD1 4.3Å; I39-F55 HydrophobicContact CG1-CD2 4.36Å; I39-F55 HydrophobicContact CG1-CE1 4.24Å; I39-F55 HydrophobicContact CG1-CE2 4.28Å; I39-F55 HydrophobicContact CG1-CG 4.35Å; I39-F55 HydrophobicContact CG1-CZ 4.22Å; I39-F55 HydrophobicContact CG2-CB 3.74Å; I39-F55 HydrophobicContact CG2-CD1 4.15Å; I39-F55 HydrophobicContact CG2-CD2 4.32Å; I39-F55 HydrophobicContact CG2-CG 3.82Å; I39-A59 HydrophobicContact CG2-CB 3.89Å; I39-M72 HydrophobicContact CD1-CE 3.88Å; I39-M72 HydrophobicContact CD1-SD 3.69Å; I39-M72 HydrophobicContact CG2-SD 3.85Å; I39-Y85 HydrophobicContact CD1-CD1 3.64Å; I39-Y85 HydrophobicContact CD1-CE1 3.59Å
40	G	97.3	Very high	94.7	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.5	176	-172.3	0	0	0	0	0	111.8	W27 W38 N50	W27-G40 PolarHBondContact N-O 3.11Å; W38-G40 VanDerWaalsContact CE2-CA 3.47Å; W38-G40 VanDerWaalsContact CZ2-C 3.49Å; W38-G40 PolarHBondContact NE1-O 3.36Å; G40-N50 CarbonylContact C-O 3.43Å; G40-N50 WeakPolarHBondContact CA-O 3.03Å
41	E	97.6	Very high	94.8	Very high	34 Å²	34	51.1 Å²	51.1	16%	0.159	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	153.6	175	71	-169.8	165.3	0	0	110.2	Y24 M25 Y26 W38 T49 N50 L61	Y24-E41 HydrophobicContact CD1-CB 4.49Å; Y24-E41 HydrophobicContact CD1-CG 4.12Å; M25-E41 CarbonylContact O-C 3.58Å; M25-E41 VanDerWaalsContact O-CA 3.26Å; M25-E41 WeakPolarHBondContact O-CA 3.35Å; Y26-E41 HydrophobicContact CD1-CB 3.7Å; Y26-E41 HydrophobicContact CE1-CB 3.88Å; Y26-E41 WeakPolarHBondContact CE1-OE2 3.32Å; Y26-E41 HydrophobicContact CG-CB 4.38Å; Y26-E41 PolarHBondContact OH-OE2 2.96Å; W38-E41 HydrophobicContact CZ2-CB 4.23Å; W38-E41 HydrophobicContact CZ2-CG 4.17Å; E41-T49 VanDerWaalsContact O-CA 3.31Å; E41-T49 WeakPolarHBondContact O-CA 3.45Å; E41-N50 HydrophobicContact CG-CB 3.91Å; E41-N50 PolarHBondContact N-O 2.99Å; E41-N50 PolarHBondContact O-N 3.06Å; E41-L61 WeakPolarHBondContact O-CD1 3.19Å
42	I	98.2	Very high	95	Very high	3 Å²	3	51 Å²	51	2%	0.015	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	133.2	170.4	-175.2	158.1	0	0	0	109.4	M25 P44 G48 T49 L61 V63	M25-I42 HydrophobicContact CB-CG2 3.96Å; M25-I42 PolarHBondContact N-O 3.42Å; M25-I42 PolarHBondContact O-N 2.83Å; I42-P44 VanDerWaalsContact O-CD 3.26Å; I42-P44 WeakPolarHBondContact O-CD 3.19Å; I42-G48 CarbonylContact C-O 3.58Å; I42-G48 WeakPolarHBondContact CA-O 3.16Å; I42-T49 HydrophobicContact CB-CG2 3.94Å; I42-T49 HydrophobicContact CD1-CG2 3.65Å; I42-T49 HydrophobicContact CG1-CG2 3.74Å; I42-L61 HydrophobicContact CB-CB 4.04Å; I42-L61 HydrophobicContact CB-CD1 4.33Å; I42-L61 HydrophobicContact CD1-CB 4.07Å; I42-L61 HydrophobicContact CG2-CB 4.36Å; I42-V63 HydrophobicContact CD1-CB 4.49Å; I42-V63 HydrophobicContact CD1-CG1 3.76Å; I42-V63 HydrophobicContact CD1-CG2 4.3Å; I42-V63 HydrophobicContact CG1-CG1 3.92Å; I42-V63 HydrophobicContact CG2-CG1 3.88Å
43	N	97.4	Very high	95.4	Very high	15 Å²	15	51.4 Å²	51.4	8%	0.08	32%	0.316	C	S	.	.			trans	-84.1	110.8	170.7	-174.3	-27.4	0	0	0	108.9	Y24 S45 N46 G47 G48	Y24-N43 HydrophobicContact CD1-CB 3.89Å; Y24-N43 HydrophobicContact CE1-CB 3.53Å; Y24-N43 VanDerWaalsContact CZ-ND2 3.34Å; Y24-N43 PolarHBondContact OH-ND2 2.94Å; Y24-N43 VanDerWaalsContact OH-ND2 3.16Å; N43-S45 VanDerWaalsContact CG-OG 3.27Å; N43-S45 PolarHBondContact ND2-OG 2.88Å; N43-S45 PolarHBondContact O-N 3.45Å; N43-S45 VanDerWaalsContact OD1-CB 3.27Å; N43-S45 WeakPolarHBondContact OD1-CB 3.5Å; N43-S45 PolarHBondContact OD1-N 3.18Å; N43-S45 PolarHBondContact OD1-OG 3.17Å; N43-N46 WeakPolarHBondContact CB-OD1 3.07Å; N43-N46 PolarHBondContact O-N 2.86Å; N43-G47 VanDerWaalsContact O-CA 3.26Å; N43-G47 WeakPolarHBondContact O-CA 3.47Å; N43-G47 PolarHBondContact O-N 2.9Å; N43-G48 PolarHBondContact N-O 3.03Å
44	P	97	Very high	95.6	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-16.8	-178.2	-17.7	33.3	0	0	0	113.7	F20 F23 I42 V63 K65	F20-P44 HydrophobicContact CD1-CB 3.86Å; F20-P44 HydrophobicContact CD2-CB 4.44Å; F20-P44 HydrophobicContact CD2-CG 4.28Å; F20-P44 HydrophobicContact CE1-CB 3.57Å; F20-P44 HydrophobicContact CE1-CG 4.18Å; F20-P44 HydrophobicContact CE2-CB 4.19Å; F20-P44 HydrophobicContact CE2-CG 3.88Å; F20-P44 HydrophobicContact CG-CB 4.31Å; F20-P44 HydrophobicContact CZ-CB 3.76Å; F20-P44 HydrophobicContact CZ-CG 3.83Å; F23-P44 WeakPolarHBondContact O-CD 3.41Å; F23-P44 VanDerWaalsContact O-CG 3.3Å; F23-P44 WeakPolarHBondContact O-CG 3.48Å; I42-P44 VanDerWaalsContact O-CD 3.26Å; I42-P44 WeakPolarHBondContact O-CD 3.19Å; P44-V63 HydrophobicContact CB-CG1 4.07Å; P44-V63 HydrophobicContact CG-CG1 4.3Å; P44-K65 WeakPolarHBondContact O-CE 2.97Å
45	S	96.6	Very high	95.8	Very high	52 Å²	52	49.1 Å²	49.1	36%	0.364	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-43.6	177.8	72.2	0	0	0	0	112.6	N43 K65	N43-S45 VanDerWaalsContact CG-OG 3.27Å; N43-S45 PolarHBondContact ND2-OG 2.88Å; N43-S45 PolarHBondContact O-N 3.45Å; N43-S45 VanDerWaalsContact OD1-CB 3.27Å; N43-S45 WeakPolarHBondContact OD1-CB 3.5Å; N43-S45 PolarHBondContact OD1-N 3.18Å; N43-S45 PolarHBondContact OD1-OG 3.17Å; S45-K65 PolarHBondContact O-NZ 2.85Å
46	N	96.2	Very high	96.1	Very high	114 Å²	114	52 Å²	52	61%	0.61	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.1	-5.1	-172.6	64.2	16.8	0	0	0	114.1	N43 G48	N43-N46 WeakPolarHBondContact CB-OD1 3.07Å; N43-N46 PolarHBondContact O-N 2.86Å; N46-G48 VanDerWaalsContact C-N 3.26Å; N46-G48 PolarHBondContact O-N 3.04Å; N46-G48 PolarHBondContact OD1-N 2.89Å
47	G	96.1	Very high	96.1	Very high	34 Å²	34	52.7 Å²	52.7	35%	0.351	29%	0.288	S	S	.	.			trans	77.2	6.7	-179	0	0	0	0	0	114.4	N43 T49	N43-G47 VanDerWaalsContact O-CA 3.26Å; N43-G47 WeakPolarHBondContact O-CA 3.47Å; N43-G47 PolarHBondContact O-N 2.9Å; G47-T49 PolarHBondContact O-N 3.11Å
48	G	97.6	Very high	96	Very high	37 Å²	37	53.8 Å²	53.8	38%	0.381	29%	0.293	S	S	.	.			trans	-60.4	134.3	175.9	0	0	0	0	0	111	I42 N43 N46	I42-G48 CarbonylContact C-O 3.58Å; I42-G48 WeakPolarHBondContact CA-O 3.16Å; N43-G48 PolarHBondContact N-O 3.03Å; N46-G48 VanDerWaalsContact C-N 3.26Å; N46-G48 PolarHBondContact O-N 3.04Å; N46-G48 PolarHBondContact OD1-N 2.89Å
49	T	98	Very high	96	Very high	63 Å²	63	51.6 Å²	51.6	39%	0.387	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	146.8	-177.8	51.3	0	0	0	0	111.2	E41 I42 G47 Y51 L61	E41-T49 VanDerWaalsContact O-CA 3.31Å; E41-T49 WeakPolarHBondContact O-CA 3.45Å; I42-T49 HydrophobicContact CB-CG2 3.94Å; I42-T49 HydrophobicContact CD1-CG2 3.65Å; I42-T49 HydrophobicContact CG1-CG2 3.74Å; G47-T49 PolarHBondContact O-N 3.11Å; T49-Y51 HydrophobicContact CG2-CE2 4.46Å; T49-Y51 WeakPolarHBondContact OG1-CE2 3.41Å; T49-L61 HydrophobicContact CG2-CB 3.95Å
50	N	97.3	Very high	96.1	Very high	84 Å²	84	54.8 Å²	54.8	45%	0.449	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	147.9	169.4	-172.6	16.7	0	0	0	108.7	W38 G40 E41	W38-N50 HydrophobicContact CH2-CB 4.43Å; G40-N50 CarbonylContact C-O 3.43Å; G40-N50 WeakPolarHBondContact CA-O 3.03Å; E41-N50 HydrophobicContact CG-CB 3.91Å; E41-N50 PolarHBondContact N-O 2.99Å; E41-N50 PolarHBondContact O-N 3.06Å
51	Y	97.8	Very high	96.1	Very high	40 Å²	40	55.1 Å²	55.1	16%	0.157	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	149.8	-171.3	-64.8	-92.1	0	0	0	110.7	W38 T49 K56 A59 L61	W38-Y51 VanDerWaalsContact CZ3-C 3.43Å; T49-Y51 HydrophobicContact CG2-CE2 4.46Å; T49-Y51 WeakPolarHBondContact OG1-CE2 3.41Å; Y51-K56 HydrophobicContact CG-CG 4.46Å; Y51-A59 HydrophobicContact CD1-CB 4.49Å; Y51-A59 HydrophobicContact CE1-CB 4.25Å; Y51-A59 WeakPolarHBondContact CE1-O 3.32Å; Y51-L61 HydrophobicContact CE1-CD1 3.99Å; Y51-L61 HydrophobicContact CE1-CG 3.68Å; Y51-L61 PolarHBondContact OH-N 2.95Å; Y51-L61 VanDerWaalsContact OH-N 3.09Å
52	N	95.9	Very high	96.1	Very high	44 Å²	44	56.4 Å²	56.4	24%	0.235	32%	0.316	C	S	.	.			trans	-71.3	133.2	157.4	-179.8	-26.8	0	0	0	108.4	W38 I39 K54 F55 K56	W38-N52 HydrophobicContact CE3-CB 3.63Å; W38-N52 HydrophobicContact CZ3-CB 3.82Å; W38-N52 WeakPolarHBondContact O-CB 3.36Å; W38-N52 PolarHBondContact O-ND2 3Å; I39-N52 PolarHBondContact O-N 3.2Å; N52-K54 PolarHBondContact O-N 2.85Å; N52-K54 PolarHBondContact OD1-N 2.8Å; N52-K54 VanDerWaalsContact OD1-N 3.12Å; N52-F55 HydrophobicContact CB-CD2 3.92Å; N52-F55 PolarHBondContact O-N 3.49Å; N52-K56 PolarHBondContact O-N 2.79Å
53	E	95	Very high	96.1	Very high	132 Å²	132	58 Å²	58	62%	0.617	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-31.1	-177	-70.4	-61	149	0	0	112.9	F55 K56	E53-F55 PolarHBondContact O-N 2.86Å; E53-K56 IonicContact OE1-NZ 2.85Å; E53-K56 PolarHBondContact OE1-NZ 2.86Å; E53-K56 WeakPolarHBondContact OE2-CD 3.46Å; E53-K56 IonicContact OE2-NZ 3.49Å; E53-K56 PolarHBondContact OE2-NZ 2.83Å
54	K	92.2	Very high	96.1	Very high	141 Å²	141	59.9 Å²	59.9	61%	0.613	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-26.2	175.2	-66.8	-174.4	-176.2	-179.7	0	114.3	E37 N52	E37-K54 IonicContact OE2-NZ 3.79Å; E37-K54 PolarHBondContact OE2-NZ 2.01Å; N52-K54 PolarHBondContact O-N 2.85Å; N52-K54 PolarHBondContact OD1-N 2.8Å; N52-K54 VanDerWaalsContact OD1-N 3.12Å
55	F	93.7	Very high	96	Very high	4 Å²	4	65.2 Å²	65.2	2%	0.018	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115	-10.1	-172.3	-59.9	-84.4	0	0	0	113.8	K29 I39 N52 E53 S57 K58 A59	K29-F55 HydrophobicContact CD-CE1 3.64Å; K29-F55 HydrophobicContact CD-CZ 3.57Å; K29-F55 HydrophobicContact CG-CZ 4.24Å; K29-F55 VanDerWaalsContact NZ-CE1 3.25Å; K29-F55 VanDerWaalsContact NZ-CZ 3.26Å; I39-F55 HydrophobicContact CB-CD2 4.35Å; I39-F55 HydrophobicContact CB-CG 4.3Å; I39-F55 HydrophobicContact CG1-CD1 4.3Å; I39-F55 HydrophobicContact CG1-CD2 4.36Å; I39-F55 HydrophobicContact CG1-CE1 4.24Å; I39-F55 HydrophobicContact CG1-CE2 4.28Å; I39-F55 HydrophobicContact CG1-CG 4.35Å; I39-F55 HydrophobicContact CG1-CZ 4.22Å; I39-F55 HydrophobicContact CG2-CB 3.74Å; I39-F55 HydrophobicContact CG2-CD1 4.15Å; I39-F55 HydrophobicContact CG2-CD2 4.32Å; I39-F55 HydrophobicContact CG2-CG 3.82Å; N52-F55 HydrophobicContact CB-CD2 3.92Å; N52-F55 PolarHBondContact O-N 3.49Å; E53-F55 PolarHBondContact O-N 2.86Å; F55-S57 PolarHBondContact O-N 2.96Å; F55-S57 VanDerWaalsContact O-N 3.11Å; F55-K58 PolarHBondContact O-N 3.26Å; F55-A59 HydrophobicContact CB-CB 4.26Å; F55-A59 PolarHBondContact O-N 2.89Å
56	K	93.9	Very high	95.9	Very high	114 Å²	114	68 Å²	68	50%	0.496	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-32.8	-174.8	-167.2	176.6	-169.2	172.7	0	114.1	Y51 N52 E53	Y51-K56 HydrophobicContact CG-CG 4.46Å; N52-K56 PolarHBondContact O-N 2.79Å; E53-K56 IonicContact OE1-NZ 2.85Å; E53-K56 PolarHBondContact OE1-NZ 2.86Å; E53-K56 WeakPolarHBondContact OE2-CD 3.46Å; E53-K56 IonicContact OE2-NZ 3.49Å; E53-K56 PolarHBondContact OE2-NZ 2.83Å
57	S	93	Very high	95.9	Very high	111 Å²	111	64.2 Å²	64.2	78%	0.776	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-13.5	176.9	58.9	0	0	0	0	114.4	F55	F55-S57 PolarHBondContact O-N 2.96Å; F55-S57 VanDerWaalsContact O-N 3.11Å
58	K	92.8	Very high	96	Very high	58 Å²	58	64.5 Å²	64.5	25%	0.252	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-34.8	-173.9	-71	-173.1	169.3	-168.2	0	113.4	F55 L74 S75 D81	F55-K58 PolarHBondContact O-N 3.26Å; K58-L74 WeakPolarHBondContact O-CA 3.38Å; K58-S75 PolarHBondContact O-N 3.34Å; K58-D81 IonicContact NZ-OD1 3.69Å; K58-D81 IonicContact NZ-OD2 2.84Å; K58-D81 PolarHBondContact NZ-OD2 3.4Å
59	A	96.1	Very high	96	Very high	3 Å²	3	63.1 Å²	63.1	3%	0.025	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	139.1	-173.3	0	0	0	0	0	111.1	I39 Y51 F55 M72 Q73 L74	I39-A59 HydrophobicContact CG2-CB 3.89Å; Y51-A59 HydrophobicContact CD1-CB 4.49Å; Y51-A59 HydrophobicContact CE1-CB 4.25Å; Y51-A59 WeakPolarHBondContact CE1-O 3.32Å; F55-A59 HydrophobicContact CB-CB 4.26Å; F55-A59 PolarHBondContact O-N 2.89Å; A59-M72 HydrophobicContact CB-CG 4.47Å; A59-M72 HydrophobicContact CB-SD 4.47Å; A59-Q73 CarbonylContact C-O 3.53Å; A59-Q73 VanDerWaalsContact CA-O 3.32Å; A59-Q73 WeakPolarHBondContact CA-O 3.4Å; A59-L74 HydrophobicContact CB-CD2 3.9Å
60	T	97.8	Very high	96	Very high	67 Å²	67	60.1 Å²	60.1	41%	0.411	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	119.8	170.4	-57.3	0	0	0	0	108.8	T62 M72 Q73	T60-T62 HydrophobicContact CG2-CG2 4.35Å; T60-M72 WeakPolarHBondContact O-CA 3.41Å; T60-Q73 PolarHBondContact N-O 3.09Å; T60-Q73 PolarHBondContact O-N 2.83Å
61	L	98.3	Very high	96	Very high	8 Å²	8	58.6 Å²	58.6	4%	0.042	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	132.9	178.8	-51.9	-177.2	0	0	0	110.2	W27 E41 I42 T49 Y51 Y71 M72	W27-L61 HydrophobicContact CG-CD2 3.97Å; E41-L61 WeakPolarHBondContact O-CD1 3.19Å; I42-L61 HydrophobicContact CB-CB 4.04Å; I42-L61 HydrophobicContact CB-CD1 4.33Å; I42-L61 HydrophobicContact CD1-CB 4.07Å; I42-L61 HydrophobicContact CG2-CB 4.36Å; T49-L61 HydrophobicContact CG2-CB 3.95Å; Y51-L61 HydrophobicContact CE1-CD1 3.99Å; Y51-L61 HydrophobicContact CE1-CG 3.68Å; Y51-L61 PolarHBondContact OH-N 2.95Å; Y51-L61 VanDerWaalsContact OH-N 3.09Å; L61-Y71 WeakPolarHBondContact CA-O 3.26Å; L61-M72 HydrophobicContact CD2-CB 3.71Å; L61-M72 HydrophobicContact CD2-CG 3.6Å; L61-M72 HydrophobicContact CD2-SD 4.16Å
62	T	98.2	Very high	96	Very high	60 Å²	60	56.7 Å²	56.7	37%	0.368	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	162.7	176.3	57	0	0	0	0	110.8	T60 Y71	T60-T62 HydrophobicContact CG2-CG2 4.35Å; T62-Y71 PolarHBondContact N-O 2.8Å; T62-Y71 PolarHBondContact O-N 2.93Å
63	V	97.7	Very high	96.1	Very high	38 Å²	38	58.3 Å²	58.3	23%	0.23	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	144	176.7	-69.7	0	0	0	0	110.8	F20 I42 P44 A70	F20-V63 HydrophobicContact CE1-CB 4.29Å; F20-V63 HydrophobicContact CE1-CG1 4.35Å; F20-V63 HydrophobicContact CZ-CB 4.41Å; F20-V63 HydrophobicContact CZ-CG1 4.04Å; I42-V63 HydrophobicContact CD1-CB 4.49Å; I42-V63 HydrophobicContact CD1-CG1 3.76Å; I42-V63 HydrophobicContact CD1-CG2 4.3Å; I42-V63 HydrophobicContact CG1-CG1 3.92Å; I42-V63 HydrophobicContact CG2-CG1 3.88Å; P44-V63 HydrophobicContact CB-CG1 4.07Å; P44-V63 HydrophobicContact CG-CG1 4.3Å; V63-A70 HydrophobicContact CG1-CB 4.18Å
64	D	96.9	Very high	96.1	Very high	54 Å²	54	52.2 Å²	52.2	29%	0.289	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	106.7	164.4	174.5	7.9	0	0	0	108.2	S66 S67 S68 T69 Y71	D64-S66 VanDerWaalsContact C-N 3.3Å; D64-S66 PolarHBondContact O-N 3.03Å; D64-S66 WeakPolarHBondContact OD1-CB 3.3Å; D64-S66 PolarHBondContact OD1-N 2.84Å; D64-S66 PolarHBondContact OD1-OG 2.82Å; D64-S66 PolarHBondContact OD2-OG 2.94Å; D64-S67 WeakPolarHBondContact CB-OG 3.44Å; D64-S67 PolarHBondContact OD1-N 3.13Å; D64-S67 WeakPolarHBondContact OD2-CB 3.25Å; D64-S67 PolarHBondContact OD2-OG 2.86Å; D64-S68 PolarHBondContact O-N 2.85Å; D64-S68 VanDerWaalsContact O-N 3.11Å; D64-T69 PolarHBondContact N-O 2.98Å; D64-T69 PolarHBondContact O-N 2.8Å; D64-Y71 HydrophobicContact CB-CE2 3.91Å
65	K	95.2	Very high	96.1	Very high	112 Å²	112	47.5 Å²	47.5	49%	0.487	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-30.6	-178.5	-55.4	-174.4	-161.8	-176.8	0	111.8	T21 P44 S45 S68	T21-K65 HydrophobicContact CG2-CD 4.38Å; P44-K65 WeakPolarHBondContact O-CE 2.97Å; S45-K65 PolarHBondContact O-NZ 2.85Å; K65-S68 PolarHBondContact O-N 3.08Å
66	S	94.8	Very high	95.8	Very high	109 Å²	109	50.6 Å²	50.6	76%	0.762	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-38.6	-177.1	72.9	0	0	0	0	111.7	D64	D64-S66 VanDerWaalsContact C-N 3.3Å; D64-S66 PolarHBondContact O-N 3.03Å; D64-S66 WeakPolarHBondContact OD1-CB 3.3Å; D64-S66 PolarHBondContact OD1-N 2.84Å; D64-S66 PolarHBondContact OD1-OG 2.82Å; D64-S66 PolarHBondContact OD2-OG 2.94Å
67	S	96.6	Very high	95.5	Very high	35 Å²	35	46.1 Å²	46.1	25%	0.245	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	1.3	178	66.5	0	0	0	0	113.7	D64 T69	D64-S67 WeakPolarHBondContact CB-OG 3.44Å; D64-S67 PolarHBondContact OD1-N 3.13Å; D64-S67 WeakPolarHBondContact OD2-CB 3.25Å; D64-S67 PolarHBondContact OD2-OG 2.86Å; S67-T69 PolarHBondContact O-N 3.13Å; S67-T69 PolarHBondContact O-OG1 2.92Å; S67-T69 VanDerWaalsContact O-OG1 3.08Å; S67-T69 WeakPolarHBondContact OG-CB 3.44Å; S67-T69 PolarHBondContact OG-OG1 3.35Å; S67-T69 VanDerWaalsContact OG-OG1 3.13Å
68	S	96.9	Very high	95.3	Very high	40 Å²	40	44.1 Å²	44.1	28%	0.28	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	42.7	-172.8	-62.2	0	0	0	0	112.7	A15 D64 K65	A15-S68 PolarHBondContact N-O 3.11Å; D64-S68 PolarHBondContact O-N 2.85Å; D64-S68 VanDerWaalsContact O-N 3.11Å; K65-S68 PolarHBondContact O-N 3.08Å
69	T	98	Very high	95	Very high	9 Å²	9	46.5 Å²	46.5	6%	0.055	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.3	-174.4	-53.8	0	0	0	0	110.9	C13 D64 S67 Y71	C13-T69 CarbonylContact O-C 3.58Å; C13-T69 WeakPolarHBondContact O-CA 3.31Å; D64-T69 PolarHBondContact N-O 2.98Å; D64-T69 PolarHBondContact O-N 2.8Å; S67-T69 PolarHBondContact O-N 3.13Å; S67-T69 PolarHBondContact O-OG1 2.92Å; S67-T69 VanDerWaalsContact O-OG1 3.08Å; S67-T69 WeakPolarHBondContact OG-CB 3.44Å; S67-T69 PolarHBondContact OG-OG1 3.35Å; S67-T69 VanDerWaalsContact OG-OG1 3.13Å; T69-Y71 HydrophobicContact CG2-CD1 4.27Å; T69-Y71 HydrophobicContact CG2-CD2 4.39Å; T69-Y71 HydrophobicContact CG2-CE1 3.67Å; T69-Y71 HydrophobicContact CG2-CE2 3.78Å
70	A	98	Very high	94.6	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	150	166.9	0	0	0	0	0	110	S12 C13 F20 M25 W27 V63	S12-A70 CarbonylContact C-O 3.58Å; S12-A70 WeakPolarHBondContact CA-O 3.39Å; C13-A70 PolarHBondContact N-O 3.46Å; C13-A70 PolarHBondContact O-N 3.1Å; F20-A70 HydrophobicContact CE2-CB 4.4Å; F20-A70 HydrophobicContact CZ-CB 4.08Å; M25-A70 HydrophobicContact CB-CB 4.11Å; M25-A70 HydrophobicContact CG-CB 3.68Å; W27-A70 HydrophobicContact CZ2-CB 4.16Å; V63-A70 HydrophobicContact CG1-CB 4.18Å
71	Y	98.2	Very high	94.2	Very high	52 Å²	52	49.8 Å²	49.8	20%	0.204	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	145.4	177.1	-56.2	-87.4	0	0	0	111.2	K10 L11 S12 L61 T62 D64 T69	K10-Y71 HydrophobicContact CD-CD1 4.37Å; K10-Y71 VanDerWaalsContact CE-CG 3.48Å; K10-Y71 HydrophobicContact CG-CD1 4.34Å; L11-Y71 WeakPolarHBondContact O-CA 2.93Å; S12-Y71 VanDerWaalsContact CB-CE1 3.48Å; L61-Y71 WeakPolarHBondContact CA-O 3.26Å; T62-Y71 PolarHBondContact N-O 2.8Å; T62-Y71 PolarHBondContact O-N 2.93Å; D64-Y71 HydrophobicContact CB-CE2 3.91Å; T69-Y71 HydrophobicContact CG2-CD1 4.27Å; T69-Y71 HydrophobicContact CG2-CD2 4.39Å; T69-Y71 HydrophobicContact CG2-CE1 3.67Å; T69-Y71 HydrophobicContact CG2-CE2 3.78Å
72	M	97.8	Very high	93.8	Very high	0 Å²	0	54 Å²	54	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	122.4	166.3	178.6	178.1	73	0	0	108.7	K10 L11 W27 I39 A59 T60 L61 L74 Y85	K10-M72 WeakPolarHBondContact CA-O 3.21Å; L11-M72 HydrophobicContact CD1-CE 3.55Å; L11-M72 HydrophobicContact CG-CE 4.45Å; L11-M72 PolarHBondContact N-O 2.79Å; L11-M72 PolarHBondContact O-N 3.21Å; W27-M72 HydrophobicContact CB-SD 4.01Å; W27-M72 HydrophobicContact CD2-CB 3.62Å; W27-M72 HydrophobicContact CD2-CG 4.44Å; W27-M72 HydrophobicContact CD2-SD 4.17Å; W27-M72 HydrophobicContact CE3-CB 3.71Å; W27-M72 HydrophobicContact CE3-CE 3.98Å; W27-M72 HydrophobicContact CE3-SD 4.11Å; W27-M72 HydrophobicContact CG-CB 4.23Å; W27-M72 HydrophobicContact CG-SD 4.15Å; W27-M72 HydrophobicContact CH2-CB 3.95Å; W27-M72 HydrophobicContact CZ2-CB 3.88Å; W27-M72 HydrophobicContact CZ3-CB 3.88Å; W27-M72 HydrophobicContact CZ3-CE 4.47Å; I39-M72 HydrophobicContact CD1-CE 3.88Å; I39-M72 HydrophobicContact CD1-SD 3.69Å; I39-M72 HydrophobicContact CG2-SD 3.85Å; A59-M72 HydrophobicContact CB-CG 4.47Å; A59-M72 HydrophobicContact CB-SD 4.47Å; T60-M72 WeakPolarHBondContact O-CA 3.41Å; L61-M72 HydrophobicContact CD2-CB 3.71Å; L61-M72 HydrophobicContact CD2-CG 3.6Å; L61-M72 HydrophobicContact CD2-SD 4.16Å; M72-L74 HydrophobicContact CE-CD1 3.87Å; M72-L74 HydrophobicContact CE-CD2 4.3Å; M72-L74 HydrophobicContact CE-CG 3.99Å; M72-L74 HydrophobicContact CG-CG 4.47Å; M72-L74 HydrophobicContact SD-CD2 4.27Å; M72-L74 HydrophobicContact SD-CG 4.45Å; M72-Y85 HydrophobicContact CE-CD1 3.39Å; M72-Y85 HydrophobicContact CE-CE1 3.68Å; M72-Y85 HydrophobicContact CE-CG 4.21Å
73	Q	96.8	Very high	93.6	Very high	77 Å²	77	52.3 Å²	52.3	36%	0.36	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	128.1	169.5	-177.9	173.3	-17.3	0	0	109.3	V9 A59 T60	V9-Q73 CarbonylContact O-C 3.55Å; V9-Q73 VanDerWaalsContact O-CA 3.3Å; V9-Q73 WeakPolarHBondContact O-CA 3.4Å; A59-Q73 CarbonylContact C-O 3.53Å; A59-Q73 VanDerWaalsContact CA-O 3.32Å; A59-Q73 WeakPolarHBondContact CA-O 3.4Å; T60-Q73 PolarHBondContact N-O 3.09Å; T60-Q73 PolarHBondContact O-N 2.83Å
74	L	94.5	Very high	93.4	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.021	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	124.4	170.3	-66.3	167.8	0	0	0	108.8	S8 V9 K58 A59 M72 Y85	S8-L74 CarbonylContact C-O 3.52Å; S8-L74 VanDerWaalsContact CA-O 3.25Å; S8-L74 WeakPolarHBondContact CA-O 3.32Å; V9-L74 HydrophobicContact CG1-CB 3.85Å; V9-L74 HydrophobicContact CG1-CD1 4.17Å; V9-L74 HydrophobicContact CG1-CG 4.46Å; V9-L74 PolarHBondContact N-O 3.33Å; V9-L74 PolarHBondContact O-N 3.16Å; K58-L74 WeakPolarHBondContact O-CA 3.38Å; A59-L74 HydrophobicContact CB-CD2 3.9Å; M72-L74 HydrophobicContact CE-CD1 3.87Å; M72-L74 HydrophobicContact CE-CD2 4.3Å; M72-L74 HydrophobicContact CE-CG 3.99Å; M72-L74 HydrophobicContact CG-CG 4.47Å; M72-L74 HydrophobicContact SD-CD2 4.27Å; M72-L74 HydrophobicContact SD-CG 4.45Å; L74-Y85 HydrophobicContact CD1-CE1 3.67Å; L74-Y85 HydrophobicContact CD1-CE2 4.29Å; L74-Y85 VanDerWaalsContact CD1-OH 3.28Å; L74-Y85 WeakPolarHBondContact CD1-OH 3.32Å
75	S	92.2	Very high	93.4	Very high	43 Å²	43	54 Å²	54	30%	0.301	32%	0.319	S	S	.	.	S	Bend	trans	-93	133	179.7	-61.5	0	0	0	0	110.6	K58	K58-S75 PolarHBondContact O-N 3.34Å
76	S	88.7	Confident	93.4	Very high	69 Å²	69	52.2 Å²	52.2	48%	0.483	31%	0.311	S	S	.	.	S	Bend	trans	46.6	54	177.4	-56.8	0	0	0	0	114.1
77	P	87.8	Confident	93.4	Very high	19 Å²	19	49.3 Å²	49.3	12%	0.123	29%	0.291	C	S	.	.			trans	-61.5	138.9	-178.8	29	-31.9	0	0	0	110.4	V3 A7 D81	V3-P77 HydrophobicContact CG2-CG 3.85Å; A7-P77 WeakPolarHBondContact O-CD 3.3Å; P77-D81 HydrophobicContact CB-CB 4.1Å
78	T	89	Confident	93.4	Very high	69 Å²	69	49.8 Å²	49.8	42%	0.423	29%	0.292	S	S	.	.			trans	-102	177.3	176.4	67.8	0	0	0	0	110.7	E80 D81	T78-E80 PolarHBondContact O-N 2.62Å; T78-E80 PolarHBondContact OG1-N 2.95Å; T78-D81 PolarHBondContact N-OD2 3.11Å; T78-D81 PolarHBondContact O-N 3.48Å
79	S	86.8	Confident	93.2	Very high	109 Å²	109	49.5 Å²	49.5	76%	0.762	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-56.6	-31.1	173.6	51.1	0	0	0	0	112.7	D81 S82	S79-D81 PolarHBondContact O-N 2.6Å; S79-S82 WeakPolarHBondContact O-CB 2.91Å; S79-S82 PolarHBondContact O-N 3.46Å; S79-S82 VanDerWaalsContact O-N 3.11Å
80	E	86.1	Confident	92.5	Very high	128 Å²	128	54.6 Å²	54.6	60%	0.598	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-67.7	-22.9	175.7	-61.9	-177.8	172.2	0	0	112.9	R31 T78 S82	R31-E80 PolarHBondContact NE-O 3.06Å; R31-E80 PolarHBondContact NH2-O 2.95Å; T78-E80 PolarHBondContact O-N 2.62Å; T78-E80 PolarHBondContact OG1-N 2.95Å; E80-S82 VanDerWaalsContact C-N 3.26Å
81	D	89.1	Confident	91	Very high	11 Å²	11	59.6 Å²	59.6	6%	0.059	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-86.6	-0.6	176.4	-62.8	-48	0	0	0	111.4	K29 K58 P77 T78 S79 A83 Y85	K29-D81 IonicContact NZ-OD1 3.5Å; K58-D81 IonicContact NZ-OD1 3.69Å; K58-D81 IonicContact NZ-OD2 2.84Å; K58-D81 PolarHBondContact NZ-OD2 3.4Å; P77-D81 HydrophobicContact CB-CB 4.1Å; T78-D81 PolarHBondContact N-OD2 3.11Å; T78-D81 PolarHBondContact O-N 3.48Å; S79-D81 PolarHBondContact O-N 2.6Å; D81-A83 PolarHBondContact O-N 3.46Å; D81-Y85 WeakPolarHBondContact O-CE2 3.39Å; D81-Y85 PolarHBondContact O-OH 3.4Å
82	S	90.5	Very high	89	Confident	95 Å²	95	64.1 Å²	64.1	66%	0.664	40%	0.398	S	S	*	.			trans	-69.1	106.3	171.5	-163	0	0	0	0	110.6	S79 E80	S79-S82 WeakPolarHBondContact O-CB 2.91Å; S79-S82 PolarHBondContact O-N 3.46Å; S79-S82 VanDerWaalsContact O-N 3.11Å; E80-S82 VanDerWaalsContact C-N 3.26Å
83	A	93.3	Very high	88.6	Confident	26 Å²	26	67.4 Å²	67.4	22%	0.215	42%	0.417	C	S	.	.	S	Bend	trans	-157.5	170	-174.7	0	0	0	0	0	110.8	K29 R30 R31 D81 Y85	K29-A83 HydrophobicContact CB-CB 4.05Å; R30-A83 WeakPolarHBondContact O-CB 2.92Å; R31-A83 HydrophobicContact CG-CB 4.03Å; D81-A83 PolarHBondContact O-N 3.46Å; A83-Y85 HydrophobicContact CB-CE2 4.09Å; A83-Y85 WeakPolarHBondContact O-CD2 3.4Å
84	V	94.6	Very high	88.2	Confident	76 Å²	76	66.8 Å²	66.8	46%	0.461	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	130.5	163.5	-173.8	0	0	0	0	108.3	K29 R30 F86	K29-V84 CarbonylContact C-O 3.58Å; K29-V84 WeakPolarHBondContact CA-O 3.26Å; R30-V84 PolarHBondContact N-O 2.79Å; R30-V84 PolarHBondContact O-N 2.58Å; V84-F86 HydrophobicContact CB-CE2 3.94Å; V84-F86 HydrophobicContact CB-CZ 4.1Å; V84-F86 HydrophobicContact CG1-CD2 4.35Å; V84-F86 HydrophobicContact CG1-CE1 3.96Å; V84-F86 HydrophobicContact CG1-CE2 3.56Å; V84-F86 HydrophobicContact CG1-CZ 3.33Å
85	Y	95.8	Very high	87.8	Confident	51 Å²	51	70.3 Å²	70.3	20%	0.2	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	136.6	179.7	-70.2	-93	0	0	0	110.3	L11 V28 K29 I39 M72 L74 D81 A83	L11-Y85 HydrophobicContact CD1-CD1 4.11Å; L11-Y85 HydrophobicContact CD1-CD2 4.09Å; L11-Y85 HydrophobicContact CD1-CG 3.64Å; V28-Y85 CarbonylContact O-C 3.6Å; V28-Y85 WeakPolarHBondContact O-CA 3.36Å; K29-Y85 HydrophobicContact CB-CD1 3.84Å; K29-Y85 HydrophobicContact CB-CE1 3.7Å; K29-Y85 HydrophobicContact CD-CE1 4.41Å; I39-Y85 HydrophobicContact CD1-CD1 3.64Å; I39-Y85 HydrophobicContact CD1-CE1 3.59Å; M72-Y85 HydrophobicContact CE-CD1 3.39Å; M72-Y85 HydrophobicContact CE-CE1 3.68Å; M72-Y85 HydrophobicContact CE-CG 4.21Å; L74-Y85 HydrophobicContact CD1-CE1 3.67Å; L74-Y85 HydrophobicContact CD1-CE2 4.29Å; L74-Y85 VanDerWaalsContact CD1-OH 3.28Å; L74-Y85 WeakPolarHBondContact CD1-OH 3.32Å; D81-Y85 WeakPolarHBondContact O-CE2 3.39Å; D81-Y85 PolarHBondContact O-OH 3.4Å; A83-Y85 HydrophobicContact CB-CE2 4.09Å; A83-Y85 WeakPolarHBondContact O-CD2 3.4Å
86	F	95.6	Very high	87.5	Confident	74 Å²	74	71.9 Å²	71.9	33%	0.325	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	145.2	179.6	-59.7	-82.9	0	0	0	109.9	V28 R30 V84	V28-F86 HydrophobicContact CB-CB 4.47Å; V28-F86 PolarHBondContact N-O 3.2Å; V28-F86 PolarHBondContact O-N 2.89Å; R30-F86 HydrophobicContact CB-CD2 4.41Å; R30-F86 HydrophobicContact CB-CE2 3.81Å; V84-F86 HydrophobicContact CB-CE2 3.94Å; V84-F86 HydrophobicContact CB-CZ 4.1Å; V84-F86 HydrophobicContact CG1-CD2 4.35Å; V84-F86 HydrophobicContact CG1-CE1 3.96Å; V84-F86 HydrophobicContact CG1-CE2 3.56Å; V84-F86 HydrophobicContact CG1-CZ 3.33Å
87	C	95.8	Very high	87.5	Confident	49 Å²	49	72.1 Å²	72.1	33%	0.331	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	143.1	161.8	62.4	0	0	0	0	109.2	C13 M25 Y26 W27	C13-C87 HydrophobicContact CB-CB 3.5Å; C13-C87 VanDerWaalsContact CB-CB 3.5Å; C13-C87 WeakPolarHBondContact CB-SG 3.49Å; C13-C87 WeakPolarHBondContact SG-CB 3.39Å; C13-C87 CovalentContact SG-SG 2.01Å; C13-C87 PolarHBondContact SG-SG 3.47Å; M25-C87 HydrophobicContact CG-CB 4.39Å; M25-C87 HydrophobicContact SD-CB 3.75Å; Y26-C87 CarbonylContact O-C 3.56Å; Y26-C87 VanDerWaalsContact O-CA 3.24Å; Y26-C87 WeakPolarHBondContact O-CA 3.38Å; W27-C87 HydrophobicContact CE3-CB 4.34Å; W27-C87 HydrophobicContact CH2-CB 4.44Å; W27-C87 HydrophobicContact CZ3-CB 4.31Å
88	T	95.1	Very high	87.5	Confident	45 Å²	45	75.7 Å²	75.7	28%	0.276	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	152.5	178.3	-179.5	0	0	0	0	109.9	Y26 V28 N90 W91	Y26-T88 WeakPolarHBondContact CB-O 3.4Å; Y26-T88 WeakPolarHBondContact CD2-O 3.36Å; Y26-T88 PolarHBondContact N-O 3.46Å; Y26-T88 PolarHBondContact O-N 2.79Å; V28-T88 HydrophobicContact CG2-CG2 4.44Å; T88-N90 VanDerWaalsContact CG2-O 3.32Å; T88-N90 WeakPolarHBondContact CG2-O 3.26Å; T88-N90 PolarHBondContact OG1-N 2.89Å; T88-N90 PolarHBondContact OG1-O 2.71Å; T88-W91 HydrophobicContact CG2-CE3 4.2Å
89	T	93.2	Very high	87.3	Confident	33 Å²	33	76.1 Å²	76.1	20%	0.202	47%	0.474	C	S	.	.	S	Bend	trans	-90.2	-14.2	168.6	55.8	0	0	0	0	113	Y18 F23 Y24 M25 Y26	Y18-T89 HydrophobicContact CE1-CG2 4.3Å; Y18-T89 HydrophobicContact CE2-CG2 3.88Å; Y18-T89 WeakPolarHBondContact OH-CG2 3.46Å; F23-T89 HydrophobicContact CB-CG2 3.93Å; F23-T89 HydrophobicContact CG-CG2 4.47Å; Y24-T89 WeakPolarHBondContact O-CA 3.11Å; M25-T89 HydrophobicContact CE-CG2 4.37Å; Y26-T89 WeakPolarHBondContact CE2-O 3.27Å
90	N	83.6	Confident	87.4	Confident	116 Å²	116	73.6 Å²	73.6	62%	0.62	45%	0.452	S	S	*	.			trans	-116.5	106.2	-176.6	-60.8	-18.3	0	0	0	108	T88	T88-N90 VanDerWaalsContact CG2-O 3.32Å; T88-N90 WeakPolarHBondContact CG2-O 3.26Å; T88-N90 PolarHBondContact OG1-N 2.89Å; T88-N90 PolarHBondContact OG1-O 2.71Å
91	W	67.6	Low	87.5	Confident	105 Å²	105	69.1 Å²	69.1	40%	0.398	44%	0.44	S	S	.	.			trans	-119.3	85.2	169.5	-169.1	-104.6	0	0	0	107.6	Y26 V28 L36 W38 T88	Y26-W91 HydrophobicContact CD1-CB 3.33Å; Y26-W91 AromaticContact CD1-CG 3.76Å; Y26-W91 HydrophobicContact CD1-CG 3.76Å; Y26-W91 HydrophobicContact CD2-CB 3.61Å; Y26-W91 HydrophobicContact CE1-CB 3.58Å; Y26-W91 HydrophobicContact CE1-CG 4.17Å; Y26-W91 HydrophobicContact CE2-CB 3.87Å; Y26-W91 HydrophobicContact CG-CB 3.36Å; Y26-W91 HydrophobicContact CG-CG 4.11Å; V28-W91 HydrophobicContact CB-CH2 4.35Å; V28-W91 HydrophobicContact CB-CZ3 4.03Å; V28-W91 HydrophobicContact CG1-CH2 3.54Å; V28-W91 HydrophobicContact CG1-CZ3 3.59Å; V28-W91 HydrophobicContact CG2-CD2 4.33Å; V28-W91 HydrophobicContact CG2-CE3 3.5Å; V28-W91 HydrophobicContact CG2-CH2 3.79Å; V28-W91 HydrophobicContact CG2-CZ3 3.2Å; L36-W91 HydrophobicContact CB-CH2 3.99Å; L36-W91 HydrophobicContact CD1-CH2 4.35Å; L36-W91 HydrophobicContact CD1-CZ3 4.3Å; W38-W91 HydrophobicContact CB-CH2 4.42Å; W38-W91 HydrophobicContact CB-CZ2 3.61Å; W38-W91 AromaticContact CD1-CE2 3.73Å; W38-W91 AromaticContact CD1-NE1 3.66Å; W38-W91 HydrophobicContact CG-CZ2 4.23Å; W38-W91 AromaticContact CG-NE1 3.87Å; T88-W91 HydrophobicContact CG2-CE3 4.2Å
92	G	55.8	Low	87.3	Confident	148 Å²	148	74.4 Å²	74.4	100%	1.526	47%	0.474	S	S	*	.			trans	-176.5	0	-174.7	0	0	0	0	0	109.2

Retrieved 92 of 92 residues in 18.9 ms (Link to these results)

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