X5J5T8_MOUSE Loading...

IgM heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J5T8, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 106 aa.

						>X5J5T8_MOUSE|X5J5T8
ALVKPSQTVSLTCTVTGYSITNGNHWWNWIRQVSGSKLEWIGYISSSGSTDSNPSLKSRISITRDTSKNQLFLQLNSVTTEDIATYYCARDDVWGTGTTVTVSSES
					

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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	A	83	Confident	94	Very high	63 Å²	63	64 Å²	64	52%	0.521	38%	0.375	S	S	.	.				0	121.4	0	0	0	0	0	0	108.5	T99 V100 T101	A1-T99 PolarHBondContact N-O 3.18Å; A1-V100 WeakPolarHBondContact O-CA 3.43Å; A1-T101 PolarHBondContact O-N 3.15Å; A1-T101 PolarHBondContact O-OG1 3.26Å
2	L	91.6	Very high	94.3	Very high	129 Å²	129	64.3 Å²	64.3	68%	0.675	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	124.5	173.2	-179.7	64.1	0	0	0	108.7	T101	L2-T101 WeakPolarHBondContact CA-O 3.31Å; L2-T101 WeakPolarHBondContact CD1-OG1 3.49Å
3	V	93.3	Very high	94.5	Very high	16 Å²	16	60.5 Å²	60.5	10%	0.097	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	155.1	-177.6	-64.4	0	0	0	0	110.5	V9 V78 V100 T101 V102 S103	V3-V9 HydrophobicContact CG1-CB 4.28Å; V3-V9 HydrophobicContact CG1-CG2 4.24Å; V3-V78 HydrophobicContact CB-CG2 4.44Å; V3-V78 HydrophobicContact CG2-CG2 3.73Å; V3-V100 HydrophobicContact CG2-CG1 4.06Å; V3-T101 PolarHBondContact N-O 3.2Å; V3-V102 HydrophobicContact CG2-CG2 3.96Å; V3-V102 CarbonylContact O-C 3.52Å; V3-V102 VanDerWaalsContact O-CA 3.28Å; V3-V102 WeakPolarHBondContact O-CA 3.34Å; V3-S103 PolarHBondContact O-N 3.21Å; V3-S103 PolarHBondContact O-OG 2.79Å
4	K	93.9	Very high	94.7	Very high	122 Å²	122	61.9 Å²	61.9	53%	0.53	37%	0.367	S	S	.	.			trans	-87.1	156.9	173.1	-63.1	-173.2	176.4	-169.9	0	110.7	Q7 V78	K4-Q7 HydrophobicContact CB-CG 4.03Å; K4-Q7 VanDerWaalsContact O-CB 3.28Å; K4-Q7 WeakPolarHBondContact O-CB 3.44Å; K4-Q7 WeakPolarHBondContact O-CG 3.45Å; K4-Q7 PolarHBondContact O-N 3.29Å; K4-V78 VanDerWaalsContact O-CG2 3.3Å; K4-V78 WeakPolarHBondContact O-CG2 3.4Å
5	P	95	Very high	94.7	Very high	33 Å²	33	58.7 Å²	58.7	21%	0.214	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	150.5	172.9	-27.8	38	0	0	0	112.3	Q7 V78 V102 S103 E105	P5-Q7 PolarHBondContact O-N 3.46Å; P5-V78 WeakPolarHBondContact CA-O 3.39Å; P5-V102 HydrophobicContact CB-CG1 4.4Å; P5-V102 HydrophobicContact CG-CG1 3.72Å; P5-S103 WeakPolarHBondContact CD-O 3.46Å; P5-E105 HydrophobicContact CB-CG 4.29Å; P5-E105 HydrophobicContact CG-CG 3.73Å
6	S	94.7	Very high	94.6	Very high	88 Å²	88	62.3 Å²	62.3	62%	0.615	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	-2.9	-177.5	-54	0	0	0	0	115.9	V78	S6-V78 PolarHBondContact N-O 2.9Å
7	Q	95.4	Very high	94.3	Very high	91 Å²	91	63.8 Å²	63.8	43%	0.425	40%	0.403	S	S	.	.			trans	-73.4	165.3	172.9	-67.8	-170.6	-33.4	0	0	111.6	K4 P5 S77 V78	K4-Q7 HydrophobicContact CB-CG 4.03Å; K4-Q7 VanDerWaalsContact O-CB 3.28Å; K4-Q7 WeakPolarHBondContact O-CB 3.44Å; K4-Q7 WeakPolarHBondContact O-CG 3.45Å; K4-Q7 PolarHBondContact O-N 3.29Å; P5-Q7 PolarHBondContact O-N 3.46Å; Q7-S77 PolarHBondContact O-N 3Å; Q7-V78 HydrophobicContact CB-CG2 4.49Å; Q7-V78 WeakPolarHBondContact O-CG2 2.81Å; Q7-V78 PolarHBondContact O-N 3.28Å
8	T	96.1	Very high	93.9	Very high	69 Å²	69	64.6 Å²	64.6	42%	0.423	40%	0.397	S	S	.	.			trans	-100.3	133.3	170.9	-61.5	0	0	0	0	109.3	Q74 L75 N76	T8-Q74 HydrophobicContact CG2-CG 3.52Å; T8-L75 WeakPolarHBondContact CA-O 3.47Å; T8-N76 WeakPolarHBondContact CG2-OD1 3.27Å; T8-N76 PolarHBondContact OG1-OD1 2.87Å
9	V	96	Very high	93.8	Very high	10 Å²	10	63.1 Å²	63.1	6%	0.061	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	138.9	170.4	66.5	0	0	0	0	109.3	V3 L11 Q74 L75 V78 V100	V3-V9 HydrophobicContact CG1-CB 4.28Å; V3-V9 HydrophobicContact CG1-CG2 4.24Å; V9-L11 HydrophobicContact CG2-CD2 4.13Å; V9-Q74 WeakPolarHBondContact O-CA 3.28Å; V9-L75 HydrophobicContact CG1-CB 3.81Å; V9-L75 HydrophobicContact CG1-CD2 4.3Å; V9-L75 HydrophobicContact CG1-CG 4.44Å; V9-L75 PolarHBondContact N-O 3.33Å; V9-L75 PolarHBondContact O-N 3.49Å; V9-V78 HydrophobicContact CB-CG1 4.41Å; V9-V78 HydrophobicContact CG1-CG1 3.79Å; V9-V100 HydrophobicContact CG2-CG2 4.43Å
10	S	96.9	Very high	93.8	Very high	75 Å²	75	60 Å²	60	52%	0.524	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	121.1	171.6	-174.2	0	0	0	0	108.5
11	L	98	Very high	93.9	Very high	8 Å²	8	59.5 Å²	59.5	4%	0.042	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	139.1	177	-60.6	177	0	0	0	109.2	V9 W29 F72 L73 Y86 T98 V100	V9-L11 HydrophobicContact CG2-CD2 4.13Å; L11-W29 HydrophobicContact CB-CH2 3.89Å; L11-W29 HydrophobicContact CB-CZ3 3.99Å; L11-W29 HydrophobicContact CD1-CZ3 4.39Å; L11-F72 VanDerWaalsContact O-CA 3.26Å; L11-F72 WeakPolarHBondContact O-CA 3.37Å; L11-L73 HydrophobicContact CB-CB 4.41Å; L11-L73 HydrophobicContact CD1-CD2 4.24Å; L11-L73 PolarHBondContact N-O 2.88Å; L11-L73 PolarHBondContact O-N 2.89Å; L11-Y86 HydrophobicContact CD1-CD1 3.68Å; L11-Y86 HydrophobicContact CD1-CD2 4.08Å; L11-Y86 HydrophobicContact CD1-CE1 4.46Å; L11-Y86 HydrophobicContact CD1-CG 3.45Å; L11-Y86 VanDerWaalsContact CD1-CG 3.45Å; L11-T98 HydrophobicContact CD2-CG2 3.9Å; L11-V100 HydrophobicContact CD1-CG2 4.27Å; L11-V100 HydrophobicContact CD2-CG2 3.88Å
12	T	97.9	Very high	94.2	Very high	67 Å²	67	61.6 Å²	61.6	41%	0.411	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	129	-179.5	-55.7	0	0	0	0	110.1	Q70 L71 F72	T12-Q70 HydrophobicContact CG2-CB 4.32Å; T12-Q70 HydrophobicContact CG2-CG 4.09Å; T12-L71 WeakPolarHBondContact CA-O 3.42Å; T12-F72 HydrophobicContact CG2-CD1 4.09Å; T12-F72 HydrophobicContact CG2-CE1 3.62Å; T12-F72 HydrophobicContact CG2-CZ 4.26Å; T12-F72 WeakPolarHBondContact OG1-CD1 3.37Å; T12-F72 WeakPolarHBondContact OG1-CE1 3.37Å
13	C	97	Very high	93.9	Very high	16 Å²	16	58 Å²	58	11%	0.108	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	113.3	165.6	-173	0	0	0	0	108.7	W29 Q70 L71 C88	C13-W29 HydrophobicContact CB-CH2 3.99Å; C13-W29 HydrophobicContact CB-CZ2 4.09Å; C13-Q70 WeakPolarHBondContact O-CA 3.37Å; C13-L71 HydrophobicContact CB-CB 4.21Å; C13-L71 HydrophobicContact CB-CD1 4.44Å; C13-L71 PolarHBondContact N-O 3.24Å; C13-L71 PolarHBondContact O-N 2.94Å; C13-C88 HydrophobicContact CB-CB 3.35Å; C13-C88 WeakPolarHBondContact CB-SG 3.39Å; C13-C88 WeakPolarHBondContact SG-CB 3.33Å; C13-C88 CovalentContact SG-SG 2.04Å; C13-C88 PolarHBondContact SG-SG 3.12Å
14	T	96.9	Very high	93.6	Very high	80 Å²	80	62.5 Å²	62.5	49%	0.491	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	124.3	173.7	-56.9	0	0	0	0	108.7	Q70	T14-Q70 HydrophobicContact CG2-CG 4.17Å; T14-Q70 PolarHBondContact OG1-NE2 2.99Å
15	V	94.9	Very high	93.4	Very high	14 Å²	14	58.9 Å²	58.9	9%	0.085	37%	0.372	C	S	.	.			trans	-99.3	134.5	-178.7	177.5	0	0	0	0	108.6	Y18 I20 W27 N69 L71	V15-Y18 HydrophobicContact CG1-CD1 4.06Å; V15-Y18 HydrophobicContact CG1-CD2 4.1Å; V15-Y18 HydrophobicContact CG1-CE1 3.74Å; V15-Y18 HydrophobicContact CG1-CE2 3.78Å; V15-Y18 HydrophobicContact CG1-CG 4.26Å; V15-Y18 WeakPolarHBondContact CG1-O 3.42Å; V15-I20 HydrophobicContact CB-CG2 3.71Å; V15-I20 HydrophobicContact CG1-CG2 4.16Å; V15-I20 HydrophobicContact CG2-CG2 3.56Å; V15-W27 HydrophobicContact CB-CH2 4.03Å; V15-W27 HydrophobicContact CG1-CH2 3.6Å; V15-W27 HydrophobicContact CG1-CZ2 4.14Å; V15-W27 HydrophobicContact CG2-CH2 3.25Å; V15-W27 HydrophobicContact CG2-CZ2 3.96Å; V15-W27 HydrophobicContact CG2-CZ3 3.66Å; V15-N69 WeakPolarHBondContact CB-ND2 3.35Å; V15-N69 PolarHBondContact N-O 3.29Å; V15-N69 PolarHBondContact O-ND2 2.85Å; V15-L71 HydrophobicContact CG2-CD1 4.33Å
16	T	92.8	Very high	93.4	Very high	115 Å²	115	62.6 Å²	62.6	71%	0.706	38%	0.382	S	S	*	.			trans	-124.3	146.2	179.2	56.8	0	0	0	0	110.2	Y18	T16-Y18 VanDerWaalsContact C-N 3.33Å; T16-Y18 PolarHBondContact O-N 3.4Å
17	G	89.2	Confident	93.5	Very high	89 Å²	89	58.9 Å²	58.9	92%	0.918	36%	0.355	S	S	*	.	S	Bend	trans	86.3	-11.7	176.1	0	0	0	0	0	115.8
18	Y	87.6	Confident	93.6	Very high	78 Å²	78	56.4 Å²	56.4	31%	0.306	34%	0.344	S	S	.	.	S	Bend	trans	-158.4	159	171.5	66.6	-86.5	0	0	0	112	V15 T16 W27 N69	V15-Y18 HydrophobicContact CG1-CD1 4.06Å; V15-Y18 HydrophobicContact CG1-CD2 4.1Å; V15-Y18 HydrophobicContact CG1-CE1 3.74Å; V15-Y18 HydrophobicContact CG1-CE2 3.78Å; V15-Y18 HydrophobicContact CG1-CG 4.26Å; V15-Y18 WeakPolarHBondContact CG1-O 3.42Å; T16-Y18 VanDerWaalsContact C-N 3.33Å; T16-Y18 PolarHBondContact O-N 3.4Å; Y18-W27 HydrophobicContact CD2-CZ2 4.31Å; Y18-W27 HydrophobicContact CE1-CH2 4.49Å; Y18-W27 AromaticContact CE2-CH2 3.35Å; Y18-W27 HydrophobicContact CE2-CH2 3.35Å; Y18-W27 AromaticContact CE2-CZ2 3.27Å; Y18-W27 HydrophobicContact CE2-CZ2 3.27Å; Y18-W27 AromaticContact CZ-CH2 3.31Å; Y18-W27 AromaticContact CZ-CZ2 3.78Å; Y18-W27 WeakPolarHBondContact OH-CH2 3.43Å; Y18-W27 WeakPolarHBondContact OH-CZ3 3.3Å; Y18-N69 PolarHBondContact O-ND2 2.97Å
19	S	92.6	Very high	93.7	Very high	35 Å²	35	53.5 Å²	53.5	25%	0.245	33%	0.326	C	S	.	.			trans	-80.7	136.7	179.5	172.3	0	0	0	0	112.9	T21 N22 N69	S19-T21 PolarHBondContact O-N 3.18Å; S19-T21 PolarHBondContact OG-N 2.68Å; S19-T21 PolarHBondContact OG-OG1 2.97Å; S19-N22 PolarHBondContact O-N 3.29Å; S19-N69 WeakPolarHBondContact CA-OD1 3.49Å
20	I	94.2	Very high	93.8	Very high	1 Å²	1	54 Å²	54	1%	0.005	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-15.9	175.8	65	175.4	0	0	0	114.3	V15 W27 R64 T66 N69 Q70 L71	V15-I20 HydrophobicContact CB-CG2 3.71Å; V15-I20 HydrophobicContact CG1-CG2 4.16Å; V15-I20 HydrophobicContact CG2-CG2 3.56Å; I20-W27 HydrophobicContact CB-CZ2 4.01Å; I20-W27 HydrophobicContact CG2-CH2 4.22Å; I20-W27 HydrophobicContact CG2-CZ2 3.6Å; I20-W27 PolarHBondContact O-NE1 2.97Å; I20-W27 VanDerWaalsContact O-NE1 3.13Å; I20-R64 HydrophobicContact CD1-CB 4.05Å; I20-T66 HydrophobicContact CD1-CG2 4.45Å; I20-N69 VanDerWaalsContact CG2-OD1 3.31Å; I20-N69 WeakPolarHBondContact CG2-OD1 2.96Å; I20-N69 PolarHBondContact N-OD1 2.99Å; I20-Q70 WeakPolarHBondContact CD1-O 3.32Å; I20-L71 HydrophobicContact CD1-CD2 4.21Å; I20-L71 HydrophobicContact CD1-CG 4.45Å; I20-L71 HydrophobicContact CG2-CD1 4.48Å; I20-L71 HydrophobicContact CG2-CG 4.44Å
21	T	94.1	Very high	93.8	Very high	51 Å²	51	51.4 Å²	51.4	31%	0.313	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-7.5	178.9	61.2	0	0	0	0	113.4	S19 T66	S19-T21 PolarHBondContact O-N 3.18Å; S19-T21 PolarHBondContact OG-N 2.68Å; S19-T21 PolarHBondContact OG-OG1 2.97Å; T21-T66 HydrophobicContact CG2-CG2 3.35Å
22	N	89.5	Confident	93.7	Very high	106 Å²	106	54.5 Å²	54.5	57%	0.567	32%	0.321	S	S	*	.	S	Bend	trans	-79.1	137.3	-177.6	-77.1	6.3	0	0	0	111	S19 H25	S19-N22 PolarHBondContact O-N 3.29Å; N22-H25 PolarHBondContact O-CD2 2.88Å
23	G	85.8	Confident	93.5	Very high	54 Å²	54	53.7 Å²	53.7	56%	0.557	32%	0.315	S	S	*	.	S	Bend	trans	78.2	-166.7	177	0	0	0	0	0	114	S46	G23-S46 VanDerWaalsContact O-CB 3.28Å; G23-S46 WeakPolarHBondContact O-CB 3.38Å; G23-S46 PolarHBondContact O-OG 3.3Å
24	N	86.9	Confident	93.2	Very high	111 Å²	111	58.5 Å²	58.5	59%	0.594	35%	0.35	S	S	*	.	S	Bend	trans	-114.2	83.3	177.2	-173.6	35.8	0	0	0	108.8
25	H	89.2	Confident	92.6	Very high	46 Å²	46	58.9 Å²	58.9	21%	0.213	37%	0.369	C	S	.	.			trans	-132	157.2	-175.6	-58.2	-71.9	0	0	0	111.1	N22 S45 S46 R90 D91	N22-H25 PolarHBondContact O-CD2 2.88Å; H25-S45 CarbonylContact O-C 3.59Å; H25-S45 WeakPolarHBondContact O-CA 3.42Å; H25-S46 PolarHBondContact O-N 3.02Å; H25-R90 HydrophobicContact CB-CG 4.19Å; H25-R90 VanDerWaalsContact CD2-CZ 3.44Å; H25-R90 PolarHBondContact CD2-NH2 2.8Å; H25-R90 PolarHBondContact CE1-NH2 3.48Å; H25-R90 VanDerWaalsContact CG-CZ 3.45Å; H25-R90 VanDerWaalsContact CG-NE 3.28Å; H25-R90 PolarHBondContact ND1-NE 2.97Å; H25-R90 PolarHBondContact ND1-NH2 3.26Å; H25-R90 PolarHBondContact NE2-NH2 3.38Å; H25-D91 IonicContact CE1-OD2 3.34Å; H25-D91 IonicContact ND1-OD2 3.52Å; H25-D91 PolarHBondContact ND1-OD2 3.26Å
26	W	94.8	Very high	92.3	Very high	111 Å²	111	61.2 Å²	61.2	42%	0.42	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	131.2	175.8	-57.9	-88.7	0	0	0	109.7	N28 Y43	W26-N28 PolarHBondContact O-ND2 2.83Å; W26-Y43 HydrophobicContact CB-CD2 4.34Å; W26-Y43 HydrophobicContact CB-CG 4.3Å; W26-Y43 AromaticContact CD1-CD2 3.51Å; W26-Y43 AromaticContact CD1-CE2 3.47Å; W26-Y43 VanDerWaalsContact CD1-CE2 3.47Å; W26-Y43 HydrophobicContact CG-CD2 4.29Å
27	W	96.8	Very high	92.2	Very high	10 Å²	10	65 Å²	65	4%	0.038	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	110.4	175.2	-67.9	98.6	0	0	0	108.9	V15 Y18 I20 Y43 I44 L71 R90	V15-W27 HydrophobicContact CB-CH2 4.03Å; V15-W27 HydrophobicContact CG1-CH2 3.6Å; V15-W27 HydrophobicContact CG1-CZ2 4.14Å; V15-W27 HydrophobicContact CG2-CH2 3.25Å; V15-W27 HydrophobicContact CG2-CZ2 3.96Å; V15-W27 HydrophobicContact CG2-CZ3 3.66Å; Y18-W27 HydrophobicContact CD2-CZ2 4.31Å; Y18-W27 HydrophobicContact CE1-CH2 4.49Å; Y18-W27 AromaticContact CE2-CH2 3.35Å; Y18-W27 HydrophobicContact CE2-CH2 3.35Å; Y18-W27 AromaticContact CE2-CZ2 3.27Å; Y18-W27 HydrophobicContact CE2-CZ2 3.27Å; Y18-W27 AromaticContact CZ-CH2 3.31Å; Y18-W27 AromaticContact CZ-CZ2 3.78Å; Y18-W27 WeakPolarHBondContact OH-CH2 3.43Å; Y18-W27 WeakPolarHBondContact OH-CZ3 3.3Å; I20-W27 HydrophobicContact CB-CZ2 4.01Å; I20-W27 HydrophobicContact CG2-CH2 4.22Å; I20-W27 HydrophobicContact CG2-CZ2 3.6Å; I20-W27 PolarHBondContact O-NE1 2.97Å; I20-W27 VanDerWaalsContact O-NE1 3.13Å; W27-Y43 CarbonylContact O-C 3.51Å; W27-Y43 WeakPolarHBondContact O-CA 3.3Å; W27-Y43 WeakPolarHBondContact O-CB 3.37Å; W27-I44 HydrophobicContact CB-CG2 4.09Å; W27-I44 WeakPolarHBondContact CB-O 3.17Å; W27-I44 PolarHBondContact N-O 2.99Å; W27-I44 PolarHBondContact O-N 3.27Å; W27-L71 HydrophobicContact CB-CD1 3.65Å; W27-L71 HydrophobicContact CB-CD2 4.02Å; W27-L71 HydrophobicContact CB-CG 4.49Å; W27-L71 HydrophobicContact CD2-CD1 3.45Å; W27-L71 VanDerWaalsContact CD2-CD1 3.45Å; W27-L71 HydrophobicContact CE3-CD1 3.48Å; W27-L71 VanDerWaalsContact CE3-CD1 3.48Å; W27-L71 HydrophobicContact CG-CD1 3.56Å; W27-L71 HydrophobicContact CG-CD2 4.04Å; W27-L71 HydrophobicContact CG-CG 4.45Å; W27-L71 HydrophobicContact CZ3-CD1 4.09Å; W27-R90 HydrophobicContact CD2-CB 4.07Å; W27-R90 HydrophobicContact CE3-CB 3.61Å; W27-R90 HydrophobicContact CE3-CG 4.5Å; W27-R90 HydrophobicContact CH2-CB 4.39Å; W27-R90 HydrophobicContact CZ3-CB 3.78Å
28	N	97.8	Very high	92.5	Very high	39 Å²	39	65.2 Å²	65.2	21%	0.209	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	140.9	-175.5	-66.6	-82.3	0	0	0	110.8	W26 I30 W40 G42 C88 A89	W26-N28 PolarHBondContact O-ND2 2.83Å; N28-I30 HydrophobicContact CB-CD1 4.25Å; N28-I30 HydrophobicContact CB-CG1 4.18Å; N28-W40 PolarHBondContact OD1-NE1 3.49Å; N28-G42 WeakPolarHBondContact CA-O 3.47Å; N28-C88 CarbonylContact O-C 3.57Å; N28-C88 WeakPolarHBondContact O-CA 3.43Å; N28-A89 PolarHBondContact N-O 3.44Å; N28-A89 PolarHBondContact O-N 3.15Å
29	W	98.3	Very high	92.9	Very high	8 Å²	8	64.3 Å²	64.3	3%	0.03	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129	161.4	-74.6	100.5	0	0	0	108.9	L11 C13 I41 G42 L71 L73 Y87 C88	L11-W29 HydrophobicContact CB-CH2 3.89Å; L11-W29 HydrophobicContact CB-CZ3 3.99Å; L11-W29 HydrophobicContact CD1-CZ3 4.39Å; C13-W29 HydrophobicContact CB-CH2 3.99Å; C13-W29 HydrophobicContact CB-CZ2 4.09Å; W29-I41 HydrophobicContact CB-CB 4.05Å; W29-I41 HydrophobicContact CB-CD1 4.38Å; W29-I41 HydrophobicContact CB-CG2 4.4Å; W29-I41 WeakPolarHBondContact O-CB 3.4Å; W29-I41 PolarHBondContact O-N 2.81Å; W29-G42 PolarHBondContact N-O 2.73Å; W29-G42 PolarHBondContact O-N 3.48Å; W29-L71 HydrophobicContact CZ2-CB 4.39Å; W29-L73 HydrophobicContact CB-CD2 4.1Å; W29-L73 HydrophobicContact CD2-CB 3.55Å; W29-L73 HydrophobicContact CD2-CD2 3.96Å; W29-L73 HydrophobicContact CD2-CG 4.33Å; W29-L73 VanDerWaalsContact CE2-CB 3.47Å; W29-L73 HydrophobicContact CE3-CB 3.95Å; W29-L73 HydrophobicContact CE3-CD2 3.91Å; W29-L73 HydrophobicContact CG-CB 3.95Å; W29-L73 HydrophobicContact CG-CD2 4.05Å; W29-L73 HydrophobicContact CG-CG 4.43Å; W29-L73 HydrophobicContact CH2-CB 4.17Å; W29-L73 HydrophobicContact CZ2-CB 3.81Å; W29-L73 HydrophobicContact CZ3-CB 4.24Å; W29-Y87 WeakPolarHBondContact CA-O 3.36Å; W29-C88 HydrophobicContact CE3-CB 4.43Å; W29-C88 HydrophobicContact CH2-CB 4.31Å; W29-C88 HydrophobicContact CZ3-CB 4.21Å
30	I	97.8	Very high	93.1	Very high	21 Å²	21	66.8 Å²	66.8	11%	0.108	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	138.7	-175.3	-55	172.5	0	0	0	107	N28 L38 E39 Y86 Y87 A89 W94	N28-I30 HydrophobicContact CB-CD1 4.25Å; N28-I30 HydrophobicContact CB-CG1 4.18Å; I30-L38 HydrophobicContact CG2-CB 3.94Å; I30-L38 HydrophobicContact CG2-CD2 3.88Å; I30-L38 HydrophobicContact CG2-CG 4.44Å; I30-E39 CarbonylContact C-O 3.54Å; I30-E39 WeakPolarHBondContact CA-O 3.48Å; I30-E39 WeakPolarHBondContact CG2-O 3.28Å; I30-Y86 CarbonylContact O-C 3.44Å; I30-Y86 WeakPolarHBondContact O-CA 3.09Å; I30-Y87 PolarHBondContact N-O 3.05Å; I30-Y87 PolarHBondContact O-N 2.94Å; I30-A89 HydrophobicContact CD1-CB 4.02Å; I30-W94 HydrophobicContact CB-CH2 4.41Å; I30-W94 HydrophobicContact CB-CZ3 4.25Å; I30-W94 HydrophobicContact CD1-CH2 3.33Å; I30-W94 HydrophobicContact CD1-CZ2 3.9Å; I30-W94 HydrophobicContact CD1-CZ3 3.81Å; I30-W94 HydrophobicContact CG1-CH2 4.43Å; I30-W94 HydrophobicContact CG2-CH2 4.17Å; I30-W94 HydrophobicContact CG2-CZ3 4.23Å
31	R	97.2	Very high	93.3	Very high	20 Å²	20	66.8 Å²	66.8	8%	0.075	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	151.9	170.4	64.2	178.4	-174.6	-178.1	1.1	112	E39 I41 D82 A84 T85 Y86	R31-E39 HydrophobicContact CG-CB 4.11Å; R31-E39 IonicContact CZ-OE2 3.57Å; R31-E39 PolarHBondContact N-O 2.74Å; R31-E39 IonicContact NE-OE2 2.77Å; R31-E39 PolarHBondContact NE-OE2 3.44Å; R31-E39 IonicContact NH2-OE1 2.74Å; R31-E39 IonicContact NH2-OE2 3.48Å; R31-E39 PolarHBondContact NH2-OE2 2.81Å; R31-E39 PolarHBondContact O-N 3.02Å; R31-I41 HydrophobicContact CB-CD1 3.86Å; R31-I41 HydrophobicContact CB-CG1 4.48Å; R31-I41 HydrophobicContact CG-CD1 3.95Å; R31-I41 HydrophobicContact CG-CG1 4.09Å; R31-D82 IonicContact NH1-OD1 3.18Å; R31-D82 PolarHBondContact NH1-OD1 3.49Å; R31-A84 HydrophobicContact CB-CB 3.88Å; R31-A84 HydrophobicContact CG-CB 4.41Å; R31-T85 CarbonylContact C-O 3.55Å; R31-T85 VanDerWaalsContact CA-O 3.29Å; R31-T85 WeakPolarHBondContact CA-O 3.49Å; R31-Y86 HydrophobicContact CB-CD1 3.91Å; R31-Y86 HydrophobicContact CB-CE1 3.94Å; R31-Y86 HydrophobicContact CB-CE2 4.5Å; R31-Y86 HydrophobicContact CB-CG 4.21Å; R31-Y86 HydrophobicContact CG-CE1 4.5Å
32	Q	96.8	Very high	93.5	Very high	73 Å²	73	64.3 Å²	64.3	34%	0.341	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	106.8	171.9	-167.9	178.5	16.7	0	0	108.7	L38 A84 T85 Y87	Q32-L38 HydrophobicContact CB-CD2 3.84Å; Q32-L38 HydrophobicContact CG-CD2 4.16Å; Q32-A84 WeakPolarHBondContact O-CA 3.49Å; Q32-A84 WeakPolarHBondContact O-CB 3.45Å; Q32-T85 PolarHBondContact N-O 3.24Å; Q32-T85 PolarHBondContact O-N 3.26Å; Q32-Y87 HydrophobicContact CB-CE2 3.83Å; Q32-Y87 PolarHBondContact OE1-OH 3.27Å
33	V	94.1	Very high	93.9	Very high	49 Å²	49	61.8 Å²	61.8	30%	0.297	34%	0.343	S	S	.	.			trans	-68.3	139.6	167.4	179.6	0	0	0	0	107.5	G35 S36 A84	V33-G35 PolarHBondContact O-N 2.85Å; V33-S36 WeakPolarHBondContact O-CA 3.29Å; V33-S36 VanDerWaalsContact O-CB 3.31Å; V33-S36 WeakPolarHBondContact O-CB 3.44Å; V33-S36 PolarHBondContact O-N 2.77Å; V33-A84 HydrophobicContact CG2-CB 4.11Å
34	S	89.1	Confident	94.4	Very high	118 Å²	118	59.5 Å²	59.5	83%	0.825	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	130.8	-177.7	-168.6	0	0	0	0	111.2	S36	S34-S36 PolarHBondContact O-N 2.94Å
35	G	85.5	Confident	94.9	Very high	87 Å²	87	54.4 Å²	54.4	90%	0.897	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	3.7	-176.9	0	0	0	0	0	115.8	V33	V33-G35 PolarHBondContact O-N 2.85Å
36	S	87.9	Confident	95.1	Very high	63 Å²	63	53 Å²	53	44%	0.441	29%	0.286	S	S	.	.	S	Bend	trans	-109.4	170.5	-178.6	-57.3	0	0	0	0	112.7	V33 S34	V33-S36 WeakPolarHBondContact O-CA 3.29Å; V33-S36 VanDerWaalsContact O-CB 3.31Å; V33-S36 WeakPolarHBondContact O-CB 3.44Å; V33-S36 PolarHBondContact O-N 2.77Å; S34-S36 PolarHBondContact O-N 2.94Å
37	K	90.9	Very high	95	Very high	195 Å²	195	52.4 Å²	52.4	85%	0.848	30%	0.299	S	S	*	.			trans	-70.5	162	171.6	-65.3	-174.4	-179.4	-178.9	0	111
38	L	95.6	Very high	94.9	Very high	94 Å²	94	53.3 Å²	53.3	49%	0.492	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	133.1	170.1	-66.6	164	0	0	0	110.1	I30 Q32 Y87 W94	I30-L38 HydrophobicContact CG2-CB 3.94Å; I30-L38 HydrophobicContact CG2-CD2 3.88Å; I30-L38 HydrophobicContact CG2-CG 4.44Å; Q32-L38 HydrophobicContact CB-CD2 3.84Å; Q32-L38 HydrophobicContact CG-CD2 4.16Å; L38-Y87 HydrophobicContact CD2-CD2 4.49Å; L38-Y87 HydrophobicContact CD2-CE2 4.39Å; L38-W94 HydrophobicContact CD1-CH2 3.86Å; L38-W94 HydrophobicContact CD1-CZ3 4.49Å; L38-W94 HydrophobicContact CD2-CH2 4.33Å; L38-W94 HydrophobicContact CD2-CZ3 4.25Å
39	E	96.2	Very high	94.8	Very high	58 Å²	58	54.5 Å²	54.5	27%	0.271	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.8	175.1	-175.6	-176	-171.8	0	0	109.6	I30 R31 N53	I30-E39 CarbonylContact C-O 3.54Å; I30-E39 WeakPolarHBondContact CA-O 3.48Å; I30-E39 WeakPolarHBondContact CG2-O 3.28Å; R31-E39 HydrophobicContact CG-CB 4.11Å; R31-E39 IonicContact CZ-OE2 3.57Å; R31-E39 PolarHBondContact N-O 2.74Å; R31-E39 IonicContact NE-OE2 2.77Å; R31-E39 PolarHBondContact NE-OE2 3.44Å; R31-E39 IonicContact NH2-OE1 2.74Å; R31-E39 IonicContact NH2-OE2 3.48Å; R31-E39 PolarHBondContact NH2-OE2 2.81Å; R31-E39 PolarHBondContact O-N 3.02Å; E39-N53 PolarHBondContact OE1-ND2 2.72Å
40	W	97.1	Very high	94.8	Very high	87 Å²	87	57.8 Å²	57.8	33%	0.33	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	131.9	174.1	177.7	81.1	0	0	0	110.8	N28 G42 Y43 D51 S52 N53	N28-W40 PolarHBondContact OD1-NE1 3.49Å; W40-G42 VanDerWaalsContact CE2-CA 3.46Å; W40-G42 PolarHBondContact NE1-O 2.96Å; W40-Y43 AromaticContact CZ2-CD1 3.65Å; W40-Y43 HydrophobicContact CZ2-CD1 3.65Å; W40-Y43 HydrophobicContact CZ2-CE1 4.29Å; W40-Y43 HydrophobicContact CZ2-CG 4.49Å; W40-D51 HydrophobicContact CH2-CB 4.46Å; W40-S52 VanDerWaalsContact CZ3-C 3.46Å; W40-N53 HydrophobicContact CE3-CB 4.01Å; W40-N53 HydrophobicContact CZ3-CB 4.1Å; W40-N53 WeakPolarHBondContact O-CB 3.42Å; W40-N53 PolarHBondContact O-ND2 2.86Å; W40-N53 VanDerWaalsContact O-ND2 3.13Å
41	I	97.9	Very high	94.8	Very high	1 Å²	1	60 Å²	60	1%	0.005	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-45.5	-179.6	-63.7	169.7	0	0	0	110.5	W29 R31 S52 N53 L56 I60 L73 Y86	W29-I41 HydrophobicContact CB-CB 4.05Å; W29-I41 HydrophobicContact CB-CD1 4.38Å; W29-I41 HydrophobicContact CB-CG2 4.4Å; W29-I41 WeakPolarHBondContact O-CB 3.4Å; W29-I41 PolarHBondContact O-N 2.81Å; R31-I41 HydrophobicContact CB-CD1 3.86Å; R31-I41 HydrophobicContact CB-CG1 4.48Å; R31-I41 HydrophobicContact CG-CD1 3.95Å; R31-I41 HydrophobicContact CG-CG1 4.09Å; I41-S52 WeakPolarHBondContact O-CA 3.37Å; I41-N53 PolarHBondContact O-N 2.9Å; I41-L56 HydrophobicContact CB-CD1 4.36Å; I41-L56 HydrophobicContact CG1-CD1 4Å; I41-L56 HydrophobicContact CG2-CD1 4.18Å; I41-I60 HydrophobicContact CG2-CD1 3.5Å; I41-I60 HydrophobicContact CG2-CG2 4.36Å; I41-L73 HydrophobicContact CD1-CD2 3.83Å; I41-L73 HydrophobicContact CG2-CD1 4.02Å; I41-L73 HydrophobicContact CG2-CD2 4.27Å; I41-Y86 HydrophobicContact CD1-CD1 3.52Å; I41-Y86 HydrophobicContact CD1-CE1 3.56Å
42	G	98	Very high	94.8	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.4	174.5	-173.3	0	0	0	0	0	112.2	N28 W29 W40 D51	N28-G42 WeakPolarHBondContact CA-O 3.47Å; W29-G42 PolarHBondContact N-O 2.73Å; W29-G42 PolarHBondContact O-N 3.48Å; W40-G42 VanDerWaalsContact CE2-CA 3.46Å; W40-G42 PolarHBondContact NE1-O 2.96Å; G42-D51 CarbonylContact C-O 3.56Å; G42-D51 WeakPolarHBondContact CA-O 3.4Å
43	Y	97.8	Very high	94.7	Very high	53 Å²	53	58.1 Å²	58.1	21%	0.208	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	164.4	172.2	71.7	-109.3	0	0	0	112.6	W26 W27 W40 T50 D51	W26-Y43 HydrophobicContact CB-CD2 4.34Å; W26-Y43 HydrophobicContact CB-CG 4.3Å; W26-Y43 AromaticContact CD1-CD2 3.51Å; W26-Y43 AromaticContact CD1-CE2 3.47Å; W26-Y43 VanDerWaalsContact CD1-CE2 3.47Å; W26-Y43 HydrophobicContact CG-CD2 4.29Å; W27-Y43 CarbonylContact O-C 3.51Å; W27-Y43 WeakPolarHBondContact O-CA 3.3Å; W27-Y43 WeakPolarHBondContact O-CB 3.37Å; W40-Y43 AromaticContact CZ2-CD1 3.65Å; W40-Y43 HydrophobicContact CZ2-CD1 3.65Å; W40-Y43 HydrophobicContact CZ2-CE1 4.29Å; W40-Y43 HydrophobicContact CZ2-CG 4.49Å; Y43-T50 VanDerWaalsContact O-CA 3.28Å; Y43-T50 WeakPolarHBondContact O-CA 3.39Å; Y43-D51 HydrophobicContact CD1-CB 4.19Å; Y43-D51 HydrophobicContact CE1-CB 3.49Å; Y43-D51 VanDerWaalsContact CE1-CB 3.49Å; Y43-D51 HydrophobicContact CE2-CB 4.25Å; Y43-D51 PolarHBondContact N-O 3.29Å; Y43-D51 PolarHBondContact O-N 2.83Å
44	I	97.8	Very high	94.8	Very high	6 Å²	6	61 Å²	61	3%	0.031	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	130.1	159.6	-171.5	163.6	0	0	0	110	W27 S49 T50 I62 R64 L71	W27-I44 HydrophobicContact CB-CG2 4.09Å; W27-I44 WeakPolarHBondContact CB-O 3.17Å; W27-I44 PolarHBondContact N-O 2.99Å; W27-I44 PolarHBondContact O-N 3.27Å; I44-S49 CarbonylContact C-O 3.52Å; I44-S49 WeakPolarHBondContact CA-O 3.36Å; I44-T50 HydrophobicContact CB-CG2 4Å; I44-T50 HydrophobicContact CD1-CG2 3.85Å; I44-T50 HydrophobicContact CG1-CG2 3.77Å; I44-I62 HydrophobicContact CB-CG2 3.81Å; I44-I62 HydrophobicContact CG2-CG2 3.89Å; I44-R64 HydrophobicContact CD1-CB 4.14Å; I44-R64 HydrophobicContact CD1-CG 3.88Å; I44-L71 HydrophobicContact CG2-CD2 3.47Å; I44-L71 VanDerWaalsContact CG2-CD2 3.47Å
45	S	95.9	Very high	95	Very high	4 Å²	4	58.9 Å²	58.9	3%	0.028	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	167.8	179.1	74.5	0	0	0	0	111.7	H25 S47 G48 S49 R64	H25-S45 CarbonylContact O-C 3.59Å; H25-S45 WeakPolarHBondContact O-CA 3.42Å; S45-S47 PolarHBondContact O-N 3.24Å; S45-S47 PolarHBondContact OG-N 3.04Å; S45-S47 PolarHBondContact OG-OG 2.8Å; S45-G48 PolarHBondContact O-N 2.92Å; S45-G48 PolarHBondContact OG-N 2.81Å; S45-G48 VanDerWaalsContact OG-N 3.15Å; S45-S49 PolarHBondContact N-O 2.88Å; S45-S49 WeakPolarHBondContact OG-CB 3.42Å; S45-S49 PolarHBondContact OG-N 2.94Å; S45-S49 PolarHBondContact OG-O 2.89Å; S45-R64 PolarHBondContact O-NH1 3.08Å
46	S	93.3	Very high	95.4	Very high	16 Å²	16	55 Å²	55	11%	0.112	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.4	169.3	58.4	0	0	0	0	113.7	G23 H25 R64	G23-S46 VanDerWaalsContact O-CB 3.28Å; G23-S46 WeakPolarHBondContact O-CB 3.38Å; G23-S46 PolarHBondContact O-OG 3.3Å; H25-S46 PolarHBondContact O-N 3.02Å; S46-R64 VanDerWaalsContact O-CZ 3.32Å; S46-R64 PolarHBondContact O-NH1 3.01Å; S46-R64 PolarHBondContact O-NH2 2.96Å
47	S	93.5	Very high	95.7	Very high	98 Å²	98	57.8 Å²	57.8	69%	0.685	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-10.8	170.9	59.9	0	0	0	0	114.2	S45 R64	S45-S47 PolarHBondContact O-N 3.24Å; S45-S47 PolarHBondContact OG-N 3.04Å; S45-S47 PolarHBondContact OG-OG 2.8Å; S47-R64 PolarHBondContact O-NH2 2.83Å
48	G	94.9	Very high	95.9	Very high	29 Å²	29	53.9 Å²	53.9	30%	0.299	32%	0.316	S	S	.	.			trans	93.1	6.5	179.7	0	0	0	0	0	114.1	S45 R64	S45-G48 PolarHBondContact O-N 2.92Å; S45-G48 PolarHBondContact OG-N 2.81Å; S45-G48 VanDerWaalsContact OG-N 3.15Å; G48-R64 VanDerWaalsContact CA-CZ 3.45Å
49	S	95.8	Very high	95.9	Very high	65 Å²	65	51.9 Å²	51.9	46%	0.455	30%	0.302	S	S	.	.			trans	-68.3	137.5	170.2	179.6	0	0	0	0	109.8	I44 S45	I44-S49 CarbonylContact C-O 3.52Å; I44-S49 WeakPolarHBondContact CA-O 3.36Å; S45-S49 PolarHBondContact N-O 2.88Å; S45-S49 WeakPolarHBondContact OG-CB 3.42Å; S45-S49 PolarHBondContact OG-N 2.94Å; S45-S49 PolarHBondContact OG-O 2.89Å
50	T	97.3	Very high	96	Very high	77 Å²	77	50.1 Å²	50.1	47%	0.472	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	141.4	-177.8	57.1	0	0	0	0	111	Y43 I44	Y43-T50 VanDerWaalsContact O-CA 3.28Å; Y43-T50 WeakPolarHBondContact O-CA 3.39Å; I44-T50 HydrophobicContact CB-CG2 4Å; I44-T50 HydrophobicContact CD1-CG2 3.85Å; I44-T50 HydrophobicContact CG1-CG2 3.77Å
51	D	97.4	Very high	96	Very high	68 Å²	68	48.2 Å²	48.2	36%	0.364	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	159.3	162.8	-160.6	8.7	0	0	0	110	W40 G42 Y43	W40-D51 HydrophobicContact CH2-CB 4.46Å; G42-D51 CarbonylContact C-O 3.56Å; G42-D51 WeakPolarHBondContact CA-O 3.4Å; Y43-D51 HydrophobicContact CD1-CB 4.19Å; Y43-D51 HydrophobicContact CE1-CB 3.49Å; Y43-D51 VanDerWaalsContact CE1-CB 3.49Å; Y43-D51 HydrophobicContact CE2-CB 4.25Å; Y43-D51 PolarHBondContact N-O 3.29Å; Y43-D51 PolarHBondContact O-N 2.83Å
52	S	97.4	Very high	96	Very high	17 Å²	17	49 Å²	49	12%	0.119	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	153.8	-170.3	40.1	0	0	0	0	112.4	W40 I41 P54 K57	W40-S52 VanDerWaalsContact CZ3-C 3.46Å; I41-S52 WeakPolarHBondContact O-CA 3.37Å; S52-P54 WeakPolarHBondContact O-CD 3.48Å; S52-K57 WeakPolarHBondContact OG-CG 3.3Å
53	N	96.3	Very high	96	Very high	35 Å²	35	52.1 Å²	52.1	19%	0.187	32%	0.317	C	S	.	.			trans	-60.6	120.8	172.1	-172.7	-21.5	0	0	0	109.4	E39 W40 I41 S55 L56 K57	E39-N53 PolarHBondContact OE1-ND2 2.72Å; W40-N53 HydrophobicContact CE3-CB 4.01Å; W40-N53 HydrophobicContact CZ3-CB 4.1Å; W40-N53 WeakPolarHBondContact O-CB 3.42Å; W40-N53 PolarHBondContact O-ND2 2.86Å; W40-N53 VanDerWaalsContact O-ND2 3.13Å; I41-N53 PolarHBondContact O-N 2.9Å; N53-S55 VanDerWaalsContact CG-OG 3.31Å; N53-S55 PolarHBondContact O-N 2.87Å; N53-S55 VanDerWaalsContact O-N 3.08Å; N53-S55 PolarHBondContact OD1-N 2.82Å; N53-S55 PolarHBondContact OD1-OG 3.18Å; N53-L56 PolarHBondContact O-N 3.5Å; N53-K57 PolarHBondContact O-N 2.9Å
54	P	95.8	Very high	95.9	Very high	109 Å²	109	52.9 Å²	52.9	71%	0.708	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-30.6	-177.8	-28.7	35.8	0	0	0	114.3	S52 L56	S52-P54 WeakPolarHBondContact O-CD 3.48Å; P54-L56 VanDerWaalsContact C-N 3.26Å; P54-L56 PolarHBondContact O-N 2.86Å
55	S	92.7	Very high	95.9	Very high	75 Å²	75	54.5 Å²	54.5	52%	0.524	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-25.9	178.7	64.9	0	0	0	0	113.5	N53	N53-S55 VanDerWaalsContact CG-OG 3.31Å; N53-S55 PolarHBondContact O-N 2.87Å; N53-S55 VanDerWaalsContact O-N 3.08Å; N53-S55 PolarHBondContact OD1-N 2.82Å; N53-S55 PolarHBondContact OD1-OG 3.18Å
56	L	93.9	Very high	95.8	Very high	5 Å²	5	57.9 Å²	57.9	3%	0.026	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-16.1	-176.9	-61.8	176.4	0	0	0	112.6	I41 N53 P54 S58 R59 I60	I41-L56 HydrophobicContact CB-CD1 4.36Å; I41-L56 HydrophobicContact CG1-CD1 4Å; I41-L56 HydrophobicContact CG2-CD1 4.18Å; N53-L56 PolarHBondContact O-N 3.5Å; P54-L56 VanDerWaalsContact C-N 3.26Å; P54-L56 PolarHBondContact O-N 2.86Å; L56-S58 PolarHBondContact O-N 3.05Å; L56-R59 PolarHBondContact O-N 2.99Å; L56-I60 HydrophobicContact CB-CD1 4.21Å; L56-I60 HydrophobicContact CB-CG2 4.17Å; L56-I60 WeakPolarHBondContact O-CG1 3.37Å; L56-I60 PolarHBondContact O-N 3.13Å
57	K	93.6	Very high	95.9	Very high	122 Å²	122	62 Å²	62	53%	0.53	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-33	-169.2	-172.6	165.5	-172.7	169.6	0	114.9	S52 N53 R59	S52-K57 WeakPolarHBondContact OG-CG 3.3Å; N53-K57 PolarHBondContact O-N 2.9Å; K57-R59 VanDerWaalsContact C-N 3.31Å
58	S	95.5	Very high	96.1	Very high	112 Å²	112	63.4 Å²	63.4	78%	0.783	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-19.5	178.3	58.9	0	0	0	0	113.9	L56	L56-S58 PolarHBondContact O-N 3.05Å
59	R	95.9	Very high	96.2	Very high	52 Å²	52	63.4 Å²	63.4	20%	0.196	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-12.2	-174.1	-57.2	-166.4	-60.5	121.8	-3.5	113.5	L56 K57 L75 N76 S77 D82	L56-R59 PolarHBondContact O-N 2.99Å; K57-R59 VanDerWaalsContact C-N 3.31Å; R59-L75 HydrophobicContact CB-CD1 4.19Å; R59-N76 WeakPolarHBondContact O-CB 3.16Å; R59-N76 PolarHBondContact O-N 3.47Å; R59-N76 PolarHBondContact O-ND2 2.78Å; R59-S77 PolarHBondContact NH1-O 3.46Å; R59-D82 IonicContact CZ-OD1 2.86Å; R59-D82 IonicContact CZ-OD2 2.94Å; R59-D82 IonicContact NH1-OD1 3.97Å; R59-D82 IonicContact NH1-OD2 3.68Å; R59-D82 PolarHBondContact NH1-OD2 2.74Å; R59-D82 IonicContact NH2-OD1 3.55Å; R59-D82 PolarHBondContact NH2-OD1 2.8Å; R59-D82 IonicContact NH2-OD2 2.72Å; R59-D82 PolarHBondContact NH2-OD2 2.84Å
60	I	97.5	Very high	96.3	Very high	22 Å²	22	62.2 Å²	62.2	11%	0.113	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	153.2	-175.9	66.2	173.1	0	0	0	113.4	I41 L56 I62 L73 Q74 L75	I41-I60 HydrophobicContact CG2-CD1 3.5Å; I41-I60 HydrophobicContact CG2-CG2 4.36Å; L56-I60 HydrophobicContact CB-CD1 4.21Å; L56-I60 HydrophobicContact CB-CG2 4.17Å; L56-I60 WeakPolarHBondContact O-CG1 3.37Å; L56-I60 PolarHBondContact O-N 3.13Å; I60-I62 HydrophobicContact CD1-CD1 4.4Å; I60-L73 HydrophobicContact CB-CD1 4.05Å; I60-L73 HydrophobicContact CG2-CD1 4.2Å; I60-Q74 CarbonylContact C-O 3.55Å; I60-Q74 WeakPolarHBondContact CA-O 3.26Å; I60-L75 HydrophobicContact CG2-CD1 3.55Å
61	S	97.9	Very high	96.3	Very high	46 Å²	46	58.6 Å²	58.6	32%	0.322	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	128	165.2	-179.4	0	0	0	0	109.3	Q74	S61-Q74 PolarHBondContact N-O 3.34Å; S61-Q74 PolarHBondContact O-N 3.46Å
62	I	98.3	Very high	96.3	Very high	19 Å²	19	57.3 Å²	57.3	10%	0.097	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	121.1	178	-58.8	174.2	0	0	0	107.8	I44 I60 F72 L73	I44-I62 HydrophobicContact CB-CG2 3.81Å; I44-I62 HydrophobicContact CG2-CG2 3.89Å; I60-I62 HydrophobicContact CD1-CD1 4.4Å; I62-F72 WeakPolarHBondContact CA-O 3.45Å; I62-L73 HydrophobicContact CG1-CD1 3.87Å
63	T	97.7	Very high	96.4	Very high	65 Å²	65	56.5 Å²	56.5	40%	0.399	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	176.4	-178	66.9	0	0	0	0	111.2	F72	T63-F72 PolarHBondContact N-O 2.9Å; T63-F72 PolarHBondContact O-N 2.84Å
64	R	96.4	Very high	96.4	Very high	68 Å²	68	58.7 Å²	58.7	26%	0.257	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	150.1	179.2	67.9	-174.8	-177.4	170.2	8.9	111.7	I20 I44 S45 S46 S47 G48 T66 Q70 L71	I20-R64 HydrophobicContact CD1-CB 4.05Å; I44-R64 HydrophobicContact CD1-CB 4.14Å; I44-R64 HydrophobicContact CD1-CG 3.88Å; S45-R64 PolarHBondContact O-NH1 3.08Å; S46-R64 VanDerWaalsContact O-CZ 3.32Å; S46-R64 PolarHBondContact O-NH1 3.01Å; S46-R64 PolarHBondContact O-NH2 2.96Å; S47-R64 PolarHBondContact O-NH2 2.83Å; G48-R64 VanDerWaalsContact CA-CZ 3.45Å; R64-T66 HydrophobicContact CG-CG2 4.28Å; R64-Q70 CarbonylContact C-O 3.57Å; R64-Q70 VanDerWaalsContact CA-O 3.27Å; R64-Q70 WeakPolarHBondContact CA-O 3.05Å; R64-L71 HydrophobicContact CB-CD2 3.95Å
65	D	96.4	Very high	96.5	Very high	40 Å²	40	53.7 Å²	53.7	21%	0.214	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	103.2	167.5	-176.5	-17.2	0	0	0	107.8	S67 K68 N69 Q70 F72	D65-S67 VanDerWaalsContact C-N 3.27Å; D65-S67 PolarHBondContact O-N 3.38Å; D65-S67 WeakPolarHBondContact OD1-CB 3.47Å; D65-S67 PolarHBondContact OD1-N 3.21Å; D65-S67 PolarHBondContact OD1-OG 2.97Å; D65-K68 HydrophobicContact CB-CB 4.38Å; D65-K68 PolarHBondContact O-N 3.43Å; D65-K68 PolarHBondContact OD1-N 3.03Å; D65-K68 WeakPolarHBondContact OD2-CD 3.41Å; D65-K68 WeakPolarHBondContact OD2-CE 3.47Å; D65-K68 WeakPolarHBondContact OD2-CG 3.42Å; D65-K68 IonicContact OD2-NZ 3.6Å; D65-N69 PolarHBondContact O-N 2.91Å; D65-Q70 PolarHBondContact N-O 2.84Å; D65-Q70 PolarHBondContact O-N 3.01Å; D65-F72 HydrophobicContact CB-CE2 3.72Å; D65-F72 HydrophobicContact CB-CZ 4.35Å
66	T	95.4	Very high	96.7	Very high	76 Å²	76	52.5 Å²	52.5	47%	0.466	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-23.8	-177.5	58.4	0	0	0	0	112.2	I20 T21 R64 K68	I20-T66 HydrophobicContact CD1-CG2 4.45Å; T21-T66 HydrophobicContact CG2-CG2 3.35Å; R64-T66 HydrophobicContact CG-CG2 4.28Å; T66-K68 VanDerWaalsContact C-N 3.31Å
67	S	95.4	Very high	96.8	Very high	101 Å²	101	55.5 Å²	55.5	71%	0.706	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-29.8	177.1	75.7	0	0	0	0	112.1	D65	D65-S67 VanDerWaalsContact C-N 3.27Å; D65-S67 PolarHBondContact O-N 3.38Å; D65-S67 WeakPolarHBondContact OD1-CB 3.47Å; D65-S67 PolarHBondContact OD1-N 3.21Å; D65-S67 PolarHBondContact OD1-OG 2.97Å
68	K	96.9	Very high	96.8	Very high	128 Å²	128	49.8 Å²	49.8	56%	0.557	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-2.4	178.7	-62.4	-178.6	-168.2	158.8	0	113.8	D65 T66 Q70	D65-K68 HydrophobicContact CB-CB 4.38Å; D65-K68 PolarHBondContact O-N 3.43Å; D65-K68 PolarHBondContact OD1-N 3.03Å; D65-K68 WeakPolarHBondContact OD2-CD 3.41Å; D65-K68 WeakPolarHBondContact OD2-CE 3.47Å; D65-K68 WeakPolarHBondContact OD2-CG 3.42Å; D65-K68 IonicContact OD2-NZ 3.6Å; T66-K68 VanDerWaalsContact C-N 3.31Å; K68-Q70 VanDerWaalsContact C-N 3.3Å; K68-Q70 HydrophobicContact CB-CB 4.34Å; K68-Q70 HydrophobicContact CB-CG 4.09Å; K68-Q70 PolarHBondContact O-N 2.04Å
69	N	96.5	Very high	96.8	Very high	29 Å²	29	47 Å²	47	16%	0.155	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	44.4	-175.7	-151.7	43.2	0	0	0	112.5	V15 Y18 S19 I20 D65	V15-N69 WeakPolarHBondContact CB-ND2 3.35Å; V15-N69 PolarHBondContact N-O 3.29Å; V15-N69 PolarHBondContact O-ND2 2.85Å; Y18-N69 PolarHBondContact O-ND2 2.97Å; S19-N69 WeakPolarHBondContact CA-OD1 3.49Å; I20-N69 VanDerWaalsContact CG2-OD1 3.31Å; I20-N69 WeakPolarHBondContact CG2-OD1 2.96Å; I20-N69 PolarHBondContact N-OD1 2.99Å; D65-N69 PolarHBondContact O-N 2.91Å
70	Q	97.6	Very high	96.7	Very high	41 Å²	41	49 Å²	49	19%	0.192	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	146.2	-173.6	-77.2	175.8	-22.6	0	0	112.6	T12 C13 T14 I20 R64 D65 K68 F72	T12-Q70 HydrophobicContact CG2-CB 4.32Å; T12-Q70 HydrophobicContact CG2-CG 4.09Å; C13-Q70 WeakPolarHBondContact O-CA 3.37Å; T14-Q70 HydrophobicContact CG2-CG 4.17Å; T14-Q70 PolarHBondContact OG1-NE2 2.99Å; I20-Q70 WeakPolarHBondContact CD1-O 3.32Å; R64-Q70 CarbonylContact C-O 3.57Å; R64-Q70 VanDerWaalsContact CA-O 3.27Å; R64-Q70 WeakPolarHBondContact CA-O 3.05Å; D65-Q70 PolarHBondContact N-O 2.84Å; D65-Q70 PolarHBondContact O-N 3.01Å; K68-Q70 VanDerWaalsContact C-N 3.3Å; K68-Q70 HydrophobicContact CB-CB 4.34Å; K68-Q70 HydrophobicContact CB-CG 4.09Å; K68-Q70 PolarHBondContact O-N 2.04Å; Q70-F72 HydrophobicContact CB-CE1 4.5Å; Q70-F72 HydrophobicContact CB-CE2 3.79Å; Q70-F72 HydrophobicContact CB-CZ 3.66Å
71	L	97.4	Very high	96.4	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	145.6	172.5	-56.6	152.9	0	0	0	108.5	T12 C13 V15 I20 W27 W29 I44 R64	T12-L71 WeakPolarHBondContact CA-O 3.42Å; C13-L71 HydrophobicContact CB-CB 4.21Å; C13-L71 HydrophobicContact CB-CD1 4.44Å; C13-L71 PolarHBondContact N-O 3.24Å; C13-L71 PolarHBondContact O-N 2.94Å; V15-L71 HydrophobicContact CG2-CD1 4.33Å; I20-L71 HydrophobicContact CD1-CD2 4.21Å; I20-L71 HydrophobicContact CD1-CG 4.45Å; I20-L71 HydrophobicContact CG2-CD1 4.48Å; I20-L71 HydrophobicContact CG2-CG 4.44Å; W27-L71 HydrophobicContact CB-CD1 3.65Å; W27-L71 HydrophobicContact CB-CD2 4.02Å; W27-L71 HydrophobicContact CB-CG 4.49Å; W27-L71 HydrophobicContact CD2-CD1 3.45Å; W27-L71 VanDerWaalsContact CD2-CD1 3.45Å; W27-L71 HydrophobicContact CE3-CD1 3.48Å; W27-L71 VanDerWaalsContact CE3-CD1 3.48Å; W27-L71 HydrophobicContact CG-CD1 3.56Å; W27-L71 HydrophobicContact CG-CD2 4.04Å; W27-L71 HydrophobicContact CG-CG 4.45Å; W27-L71 HydrophobicContact CZ3-CD1 4.09Å; W29-L71 HydrophobicContact CZ2-CB 4.39Å; I44-L71 HydrophobicContact CG2-CD2 3.47Å; I44-L71 VanDerWaalsContact CG2-CD2 3.47Å; R64-L71 HydrophobicContact CB-CD2 3.95Å
72	F	98.1	Very high	96.2	Very high	40 Å²	40	52.7 Å²	52.7	18%	0.175	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	139.9	-178.2	-55	-88.2	0	0	0	111	L11 T12 I62 T63 D65 Q70	L11-F72 VanDerWaalsContact O-CA 3.26Å; L11-F72 WeakPolarHBondContact O-CA 3.37Å; T12-F72 HydrophobicContact CG2-CD1 4.09Å; T12-F72 HydrophobicContact CG2-CE1 3.62Å; T12-F72 HydrophobicContact CG2-CZ 4.26Å; T12-F72 WeakPolarHBondContact OG1-CD1 3.37Å; T12-F72 WeakPolarHBondContact OG1-CE1 3.37Å; I62-F72 WeakPolarHBondContact CA-O 3.45Å; T63-F72 PolarHBondContact N-O 2.9Å; T63-F72 PolarHBondContact O-N 2.84Å; D65-F72 HydrophobicContact CB-CE2 3.72Å; D65-F72 HydrophobicContact CB-CZ 4.35Å; Q70-F72 HydrophobicContact CB-CE1 4.5Å; Q70-F72 HydrophobicContact CB-CE2 3.79Å; Q70-F72 HydrophobicContact CB-CZ 3.66Å
73	L	98.4	Very high	96.1	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	113	164.7	171.3	67.5	0	0	0	107.8	L11 W29 I41 I60 I62 Y86	L11-L73 HydrophobicContact CB-CB 4.41Å; L11-L73 HydrophobicContact CD1-CD2 4.24Å; L11-L73 PolarHBondContact N-O 2.88Å; L11-L73 PolarHBondContact O-N 2.89Å; W29-L73 HydrophobicContact CB-CD2 4.1Å; W29-L73 HydrophobicContact CD2-CB 3.55Å; W29-L73 HydrophobicContact CD2-CD2 3.96Å; W29-L73 HydrophobicContact CD2-CG 4.33Å; W29-L73 VanDerWaalsContact CE2-CB 3.47Å; W29-L73 HydrophobicContact CE3-CB 3.95Å; W29-L73 HydrophobicContact CE3-CD2 3.91Å; W29-L73 HydrophobicContact CG-CB 3.95Å; W29-L73 HydrophobicContact CG-CD2 4.05Å; W29-L73 HydrophobicContact CG-CG 4.43Å; W29-L73 HydrophobicContact CH2-CB 4.17Å; W29-L73 HydrophobicContact CZ2-CB 3.81Å; W29-L73 HydrophobicContact CZ3-CB 4.24Å; I41-L73 HydrophobicContact CD1-CD2 3.83Å; I41-L73 HydrophobicContact CG2-CD1 4.02Å; I41-L73 HydrophobicContact CG2-CD2 4.27Å; I60-L73 HydrophobicContact CB-CD1 4.05Å; I60-L73 HydrophobicContact CG2-CD1 4.2Å; I62-L73 HydrophobicContact CG1-CD1 3.87Å; L73-Y86 HydrophobicContact CD2-CD1 3.85Å; L73-Y86 HydrophobicContact CD2-CE1 4.22Å
74	Q	97.9	Very high	96.1	Very high	80 Å²	80	51.8 Å²	51.8	37%	0.374	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	131.5	168.8	-171.3	177.2	17	0	0	108.5	T8 V9 I60 S61	T8-Q74 HydrophobicContact CG2-CG 3.52Å; V9-Q74 WeakPolarHBondContact O-CA 3.28Å; I60-Q74 CarbonylContact C-O 3.55Å; I60-Q74 WeakPolarHBondContact CA-O 3.26Å; S61-Q74 PolarHBondContact N-O 3.34Å; S61-Q74 PolarHBondContact O-N 3.46Å
75	L	97	Very high	96.2	Very high	5 Å²	5	50 Å²	50	3%	0.026	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	116.8	174.8	175.1	68	0	0	0	108.5	T8 V9 R59 I60 V78 D82 Y86	T8-L75 WeakPolarHBondContact CA-O 3.47Å; V9-L75 HydrophobicContact CG1-CB 3.81Å; V9-L75 HydrophobicContact CG1-CD2 4.3Å; V9-L75 HydrophobicContact CG1-CG 4.44Å; V9-L75 PolarHBondContact N-O 3.33Å; V9-L75 PolarHBondContact O-N 3.49Å; R59-L75 HydrophobicContact CB-CD1 4.19Å; I60-L75 HydrophobicContact CG2-CD1 3.55Å; L75-V78 HydrophobicContact CD2-CG1 3.97Å; L75-V78 HydrophobicContact CG-CG1 3.98Å; L75-D82 HydrophobicContact CD2-CB 3.86Å; L75-Y86 HydrophobicContact CD2-CE1 4.44Å; L75-Y86 WeakPolarHBondContact CD2-OH 3.42Å
76	N	97	Very high	96.2	Very high	50 Å²	50	48.3 Å²	48.3	27%	0.267	26%	0.264	S	S	.	.			trans	-93	151.6	-176.7	-58.2	-39.7	0	0	0	110.8	T8 R59 V78	T8-N76 WeakPolarHBondContact CG2-OD1 3.27Å; T8-N76 PolarHBondContact OG1-OD1 2.87Å; R59-N76 WeakPolarHBondContact O-CB 3.16Å; R59-N76 PolarHBondContact O-N 3.47Å; R59-N76 PolarHBondContact O-ND2 2.78Å; N76-V78 PolarHBondContact O-N 2.95Å
77	S	94.9	Very high	96.4	Very high	68 Å²	68	46.7 Å²	46.7	48%	0.476	25%	0.25	S	C	.	.	S	Bend	trans	51.1	56.2	175.2	-54.6	0	0	0	0	112.5	Q7 R59	Q7-S77 PolarHBondContact O-N 3Å; R59-S77 PolarHBondContact NH1-O 3.46Å
78	V	95.4	Very high	96.4	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.006	22%	0.219	C	C	.	.			trans	-62.1	141.4	-176.6	-62.8	0	0	0	0	112	V3 K4 P5 S6 Q7 V9 L75 N76 D82 V102	V3-V78 HydrophobicContact CB-CG2 4.44Å; V3-V78 HydrophobicContact CG2-CG2 3.73Å; K4-V78 VanDerWaalsContact O-CG2 3.3Å; K4-V78 WeakPolarHBondContact O-CG2 3.4Å; P5-V78 WeakPolarHBondContact CA-O 3.39Å; S6-V78 PolarHBondContact N-O 2.9Å; Q7-V78 HydrophobicContact CB-CG2 4.49Å; Q7-V78 WeakPolarHBondContact O-CG2 2.81Å; Q7-V78 PolarHBondContact O-N 3.28Å; V9-V78 HydrophobicContact CB-CG1 4.41Å; V9-V78 HydrophobicContact CG1-CG1 3.79Å; L75-V78 HydrophobicContact CD2-CG1 3.97Å; L75-V78 HydrophobicContact CG-CG1 3.98Å; N76-V78 PolarHBondContact O-N 2.95Å; V78-D82 WeakPolarHBondContact CA-OD2 3.46Å; V78-V102 HydrophobicContact CB-CG2 4.37Å; V78-V102 HydrophobicContact CG2-CG2 4.26Å
79	T	94.4	Very high	96.4	Very high	54 Å²	54	36.4 Å²	36.4	33%	0.331	19%	0.194	S	C	.	.			trans	-123.8	174.5	175.1	72.6	0	0	0	0	110.9	E81 D82 V102	T79-E81 PolarHBondContact O-N 2.9Å; T79-E81 PolarHBondContact OG1-N 3.45Å; T79-D82 PolarHBondContact N-OD2 2.97Å; T79-D82 WeakPolarHBondContact O-CB 3.39Å; T79-D82 PolarHBondContact O-N 2.83Å; T79-V102 VanDerWaalsContact O-CG2 3.27Å; T79-V102 WeakPolarHBondContact O-CG2 3.28Å
80	T	93.4	Very high	96.2	Very high	94 Å²	94	37.1 Å²	37.1	58%	0.577	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-60.5	-22.2	174.4	49.2	0	0	0	0	113.2	D82 I83	T80-D82 PolarHBondContact O-N 3.45Å; T80-I83 WeakPolarHBondContact O-CB 3.45Å; T80-I83 VanDerWaalsContact O-CG1 3.3Å; T80-I83 WeakPolarHBondContact O-CG1 3.36Å; T80-I83 PolarHBondContact O-N 3Å
81	E	91.9	Very high	95.7	Very high	146 Å²	146	39.7 Å²	39.7	68%	0.682	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-70.9	-18.8	174.2	-58.6	178.5	172.6	0	0	112.6	T79 I83	T79-E81 PolarHBondContact O-N 2.9Å; T79-E81 PolarHBondContact OG1-N 3.45Å; E81-I83 VanDerWaalsContact C-N 3.28Å
82	D	94.4	Very high	95.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-88.2	6.3	176.6	-60.2	-48.4	0	0	0	112.6	R31 R59 L75 V78 T79 T80 A84 Y86	R31-D82 IonicContact NH1-OD1 3.18Å; R31-D82 PolarHBondContact NH1-OD1 3.49Å; R59-D82 IonicContact CZ-OD1 2.86Å; R59-D82 IonicContact CZ-OD2 2.94Å; R59-D82 IonicContact NH1-OD1 3.97Å; R59-D82 IonicContact NH1-OD2 3.68Å; R59-D82 PolarHBondContact NH1-OD2 2.74Å; R59-D82 IonicContact NH2-OD1 3.55Å; R59-D82 PolarHBondContact NH2-OD1 2.8Å; R59-D82 IonicContact NH2-OD2 2.72Å; R59-D82 PolarHBondContact NH2-OD2 2.84Å; L75-D82 HydrophobicContact CD2-CB 3.86Å; V78-D82 WeakPolarHBondContact CA-OD2 3.46Å; T79-D82 PolarHBondContact N-OD2 2.97Å; T79-D82 WeakPolarHBondContact O-CB 3.39Å; T79-D82 PolarHBondContact O-N 2.83Å; T80-D82 PolarHBondContact O-N 3.45Å; D82-A84 PolarHBondContact O-N 3.13Å; D82-A84 VanDerWaalsContact O-N 3.12Å; D82-Y86 WeakPolarHBondContact O-CE2 3.21Å; D82-Y86 PolarHBondContact O-OH 2.75Å
83	I	95.9	Very high	95	Very high	62 Å²	62	49.7 Å²	49.7	32%	0.318	27%	0.268	S	S	.	.			trans	-71.5	107.1	173.1	-63.2	176	0	0	0	109.2	T80 E81 V100 V102	T80-I83 WeakPolarHBondContact O-CB 3.45Å; T80-I83 VanDerWaalsContact O-CG1 3.3Å; T80-I83 WeakPolarHBondContact O-CG1 3.36Å; T80-I83 PolarHBondContact O-N 3Å; E81-I83 VanDerWaalsContact C-N 3.28Å; I83-V100 WeakPolarHBondContact CA-O 3.38Å; I83-V102 HydrophobicContact CD1-CB 4.2Å; I83-V102 HydrophobicContact CG1-CB 4.09Å; I83-V102 HydrophobicContact CG1-CG2 3.98Å
84	A	97.1	Very high	94.9	Very high	3 Å²	3	55 Å²	55	3%	0.025	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	166.5	-177.7	0	0	0	0	0	111.4	R31 Q32 V33 D82 Y86 V100	R31-A84 HydrophobicContact CB-CB 3.88Å; R31-A84 HydrophobicContact CG-CB 4.41Å; Q32-A84 WeakPolarHBondContact O-CA 3.49Å; Q32-A84 WeakPolarHBondContact O-CB 3.45Å; V33-A84 HydrophobicContact CG2-CB 4.11Å; D82-A84 PolarHBondContact O-N 3.13Å; D82-A84 VanDerWaalsContact O-N 3.12Å; A84-Y86 HydrophobicContact CB-CD2 4.23Å; A84-Y86 HydrophobicContact CB-CE2 3.76Å; A84-Y86 WeakPolarHBondContact O-CD2 3.11Å; A84-V100 PolarHBondContact N-O 2.95Å; A84-V100 PolarHBondContact O-N 2.71Å
85	T	97.7	Very high	94.7	Very high	29 Å²	29	52.7 Å²	52.7	18%	0.178	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	123.5	161.3	-56.7	0	0	0	0	109.2	R31 Q32 Y87 T99	R31-T85 CarbonylContact C-O 3.55Å; R31-T85 VanDerWaalsContact CA-O 3.29Å; R31-T85 WeakPolarHBondContact CA-O 3.49Å; Q32-T85 PolarHBondContact N-O 3.24Å; Q32-T85 PolarHBondContact O-N 3.26Å; T85-Y87 HydrophobicContact CG2-CD1 4.4Å; T85-Y87 HydrophobicContact CG2-CD2 4.45Å; T85-Y87 HydrophobicContact CG2-CE1 3.66Å; T85-Y87 HydrophobicContact CG2-CE2 3.75Å; T85-Y87 WeakPolarHBondContact CG2-OH 3.31Å; T85-Y87 WeakPolarHBondContact O-CD2 3.22Å; T85-Y87 WeakPolarHBondContact O-CE2 3.36Å; T85-T99 PolarHBondContact OG1-OG1 3.02Å
86	Y	98	Very high	94.6	Very high	5 Å²	5	59.5 Å²	59.5	2%	0.02	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.4	-178.5	-70.5	-105.6	0	0	0	109.8	L11 I30 R31 I41 L73 L75 D82 A84 G97 T98 V100	L11-Y86 HydrophobicContact CD1-CD1 3.68Å; L11-Y86 HydrophobicContact CD1-CD2 4.08Å; L11-Y86 HydrophobicContact CD1-CE1 4.46Å; L11-Y86 HydrophobicContact CD1-CG 3.45Å; L11-Y86 VanDerWaalsContact CD1-CG 3.45Å; I30-Y86 CarbonylContact O-C 3.44Å; I30-Y86 WeakPolarHBondContact O-CA 3.09Å; R31-Y86 HydrophobicContact CB-CD1 3.91Å; R31-Y86 HydrophobicContact CB-CE1 3.94Å; R31-Y86 HydrophobicContact CB-CE2 4.5Å; R31-Y86 HydrophobicContact CB-CG 4.21Å; R31-Y86 HydrophobicContact CG-CE1 4.5Å; I41-Y86 HydrophobicContact CD1-CD1 3.52Å; I41-Y86 HydrophobicContact CD1-CE1 3.56Å; L73-Y86 HydrophobicContact CD2-CD1 3.85Å; L73-Y86 HydrophobicContact CD2-CE1 4.22Å; L75-Y86 HydrophobicContact CD2-CE1 4.44Å; L75-Y86 WeakPolarHBondContact CD2-OH 3.42Å; D82-Y86 WeakPolarHBondContact O-CE2 3.21Å; D82-Y86 PolarHBondContact O-OH 2.75Å; A84-Y86 HydrophobicContact CB-CD2 4.23Å; A84-Y86 HydrophobicContact CB-CE2 3.76Å; A84-Y86 WeakPolarHBondContact O-CD2 3.11Å; Y86-G97 CarbonylContact O-C 3.51Å; Y86-G97 WeakPolarHBondContact O-CA 3.28Å; Y86-T98 PolarHBondContact N-O 3.32Å; Y86-T98 PolarHBondContact O-N 2.7Å; Y86-V100 HydrophobicContact CD2-CB 4.06Å; Y86-V100 HydrophobicContact CD2-CG2 3.69Å; Y86-V100 HydrophobicContact CE2-CB 3.82Å; Y86-V100 HydrophobicContact CE2-CG2 3.84Å
87	Y	97.9	Very high	94.5	Very high	42 Å²	42	58 Å²	58	17%	0.165	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	144.3	-177.8	-54.2	-85.5	0	0	0	110.3	W29 I30 Q32 L38 T85 W94 G97	W29-Y87 WeakPolarHBondContact CA-O 3.36Å; I30-Y87 PolarHBondContact N-O 3.05Å; I30-Y87 PolarHBondContact O-N 2.94Å; Q32-Y87 HydrophobicContact CB-CE2 3.83Å; Q32-Y87 PolarHBondContact OE1-OH 3.27Å; L38-Y87 HydrophobicContact CD2-CD2 4.49Å; L38-Y87 HydrophobicContact CD2-CE2 4.39Å; T85-Y87 HydrophobicContact CG2-CD1 4.4Å; T85-Y87 HydrophobicContact CG2-CD2 4.45Å; T85-Y87 HydrophobicContact CG2-CE1 3.66Å; T85-Y87 HydrophobicContact CG2-CE2 3.75Å; T85-Y87 WeakPolarHBondContact CG2-OH 3.31Å; T85-Y87 WeakPolarHBondContact O-CD2 3.22Å; T85-Y87 WeakPolarHBondContact O-CE2 3.36Å; Y87-W94 HydrophobicContact CD1-CE3 4.33Å; Y87-W94 HydrophobicContact CD2-CZ3 4.22Å; Y87-W94 AromaticContact CG-CE3 3.98Å; Y87-W94 HydrophobicContact CG-CE3 3.98Å; Y87-W94 HydrophobicContact CG-CZ3 4.07Å; Y87-G97 VanDerWaalsContact CD1-CA 3.44Å
88	C	97.1	Very high	94.6	Very high	10 Å²	10	57.6 Å²	57.6	7%	0.068	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	128.5	165.7	150.3	0	0	0	0	106.5	C13 N28 W29 G95	C13-C88 HydrophobicContact CB-CB 3.35Å; C13-C88 WeakPolarHBondContact CB-SG 3.39Å; C13-C88 WeakPolarHBondContact SG-CB 3.33Å; C13-C88 CovalentContact SG-SG 2.04Å; C13-C88 PolarHBondContact SG-SG 3.12Å; N28-C88 CarbonylContact O-C 3.57Å; N28-C88 WeakPolarHBondContact O-CA 3.43Å; W29-C88 HydrophobicContact CE3-CB 4.43Å; W29-C88 HydrophobicContact CH2-CB 4.31Å; W29-C88 HydrophobicContact CZ3-CB 4.21Å; C88-G95 PolarHBondContact O-N 3Å
89	A	96.3	Very high	94.7	Very high	3 Å²	3	61.1 Å²	61.1	3%	0.025	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	146.2	-176.3	0	0	0	0	0	111.9	N28 I30 V93 W94	N28-A89 PolarHBondContact N-O 3.44Å; N28-A89 PolarHBondContact O-N 3.15Å; I30-A89 HydrophobicContact CD1-CB 4.02Å; A89-V93 CarbonylContact C-O 3.45Å; A89-V93 VanDerWaalsContact CA-O 3.3Å; A89-V93 WeakPolarHBondContact CA-O 3.34Å; A89-W94 HydrophobicContact CB-CD2 3.86Å; A89-W94 HydrophobicContact CB-CE3 4.12Å; A89-W94 HydrophobicContact CB-CG 4.19Å; A89-W94 HydrophobicContact CB-CZ2 4.43Å
90	R	93.1	Very high	94.8	Very high	44 Å²	44	58.5 Å²	58.5	17%	0.166	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	123.8	170.6	175.7	-164.3	151.4	-171.3	-1.4	107.6	H25 W27 D92 V93	H25-R90 HydrophobicContact CB-CG 4.19Å; H25-R90 VanDerWaalsContact CD2-CZ 3.44Å; H25-R90 PolarHBondContact CD2-NH2 2.8Å; H25-R90 PolarHBondContact CE1-NH2 3.48Å; H25-R90 VanDerWaalsContact CG-CZ 3.45Å; H25-R90 VanDerWaalsContact CG-NE 3.28Å; H25-R90 PolarHBondContact ND1-NE 2.97Å; H25-R90 PolarHBondContact ND1-NH2 3.26Å; H25-R90 PolarHBondContact NE2-NH2 3.38Å; W27-R90 HydrophobicContact CD2-CB 4.07Å; W27-R90 HydrophobicContact CE3-CB 3.61Å; W27-R90 HydrophobicContact CE3-CG 4.5Å; W27-R90 HydrophobicContact CH2-CB 4.39Å; W27-R90 HydrophobicContact CZ3-CB 3.78Å; R90-D92 PolarHBondContact O-N 2.59Å; R90-V93 PolarHBondContact N-O 2.97Å; R90-V93 WeakPolarHBondContact O-CA 3.27Å; R90-V93 WeakPolarHBondContact O-CB 3.42Å; R90-V93 PolarHBondContact O-N 3.45Å
91	D	87.2	Confident	94.9	Very high	96 Å²	96	56.7 Å²	56.7	51%	0.513	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	-127.6	-177	-50	-44.5	0	0	0	109.3	H25 V93	H25-D91 IonicContact CE1-OD2 3.34Å; H25-D91 IonicContact ND1-OD2 3.52Å; H25-D91 PolarHBondContact ND1-OD2 3.26Å; D91-V93 VanDerWaalsContact C-N 3.32Å
92	D	89	Confident	94.9	Very high	159 Å²	159	50.4 Å²	50.4	85%	0.85	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	6.1	176.7	-61.4	-40.8	0	0	0	114.1	R90	R90-D92 PolarHBondContact O-N 2.59Å
93	V	91.3	Very high	94.7	Very high	91 Å²	91	51.9 Å²	51.9	55%	0.552	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	122.3	-177.8	-175.9	0	0	0	0	110.4	A89 R90 D91	A89-V93 CarbonylContact C-O 3.45Å; A89-V93 VanDerWaalsContact CA-O 3.3Å; A89-V93 WeakPolarHBondContact CA-O 3.34Å; R90-V93 PolarHBondContact N-O 2.97Å; R90-V93 WeakPolarHBondContact O-CA 3.27Å; R90-V93 WeakPolarHBondContact O-CB 3.42Å; R90-V93 PolarHBondContact O-N 3.45Å; D91-V93 VanDerWaalsContact C-N 3.32Å
94	W	95.2	Very high	93.8	Very high	114 Å²	114	53.6 Å²	53.6	43%	0.432	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	139.3	-178	-69.2	67.1	0	0	0	111.1	I30 L38 Y87 A89	I30-W94 HydrophobicContact CB-CH2 4.41Å; I30-W94 HydrophobicContact CB-CZ3 4.25Å; I30-W94 HydrophobicContact CD1-CH2 3.33Å; I30-W94 HydrophobicContact CD1-CZ2 3.9Å; I30-W94 HydrophobicContact CD1-CZ3 3.81Å; I30-W94 HydrophobicContact CG1-CH2 4.43Å; I30-W94 HydrophobicContact CG2-CH2 4.17Å; I30-W94 HydrophobicContact CG2-CZ3 4.23Å; L38-W94 HydrophobicContact CD1-CH2 3.86Å; L38-W94 HydrophobicContact CD1-CZ3 4.49Å; L38-W94 HydrophobicContact CD2-CH2 4.33Å; L38-W94 HydrophobicContact CD2-CZ3 4.25Å; Y87-W94 HydrophobicContact CD1-CE3 4.33Å; Y87-W94 HydrophobicContact CD2-CZ3 4.22Å; Y87-W94 AromaticContact CG-CE3 3.98Å; Y87-W94 HydrophobicContact CG-CE3 3.98Å; Y87-W94 HydrophobicContact CG-CZ3 4.07Å; A89-W94 HydrophobicContact CB-CD2 3.86Å; A89-W94 HydrophobicContact CB-CE3 4.12Å; A89-W94 HydrophobicContact CB-CG 4.19Å; A89-W94 HydrophobicContact CB-CZ2 4.43Å
95	G	95	Very high	92.1	Very high	31 Å²	31	61.1 Å²	61.1	32%	0.32	35%	0.347	S	S	.	.			trans	-69.3	161.4	165.1	0	0	0	0	0	111.3	C88 G97	C88-G95 PolarHBondContact O-N 3Å; G95-G97 PolarHBondContact O-N 3.24Å
96	T	94.6	Very high	90	Very high	147 Å²	147	68 Å²	68	90%	0.902	40%	0.396	S	S	*	.			trans	-62.1	-15.4	-179.4	58.3	0	0	0	0	114
97	G	95.3	Very high	89.6	Confident	19 Å²	19	71.2 Å²	71.2	20%	0.196	42%	0.415	C	S	.	.			trans	83	159.5	-177	0	0	0	0	0	113	Y86 Y87 G95	Y86-G97 CarbonylContact O-C 3.51Å; Y86-G97 WeakPolarHBondContact O-CA 3.28Å; Y87-G97 VanDerWaalsContact CD1-CA 3.44Å; G95-G97 PolarHBondContact O-N 3.24Å
98	T	96.9	Very high	89.2	Confident	60 Å²	60	72.7 Å²	72.7	37%	0.368	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	119.5	172	-64.4	0	0	0	0	108.8	L11 Y86 V100	L11-T98 HydrophobicContact CD2-CG2 3.9Å; Y86-T98 PolarHBondContact N-O 3.32Å; Y86-T98 PolarHBondContact O-N 2.7Å; T98-V100 PolarHBondContact O-N 2.8Å
99	T	96.9	Very high	88.7	Confident	74 Å²	74	76.2 Å²	76.2	45%	0.454	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	123.1	175.4	-52.5	0	0	0	0	110	A1 T85 T101	A1-T99 PolarHBondContact N-O 3.18Å; T85-T99 PolarHBondContact OG1-OG1 3.02Å; T99-T101 HydrophobicContact CG2-CG2 4.2Å
100	V	96.1	Very high	88.3	Confident	0 Å²	0	80.5 Å²	80.5	0%	0	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	128.5	171.2	179.1	0	0	0	0	108.1	A1 V3 V9 L11 I83 A84 Y86 T98	A1-V100 WeakPolarHBondContact O-CA 3.43Å; V3-V100 HydrophobicContact CG2-CG1 4.06Å; V9-V100 HydrophobicContact CG2-CG2 4.43Å; L11-V100 HydrophobicContact CD1-CG2 4.27Å; L11-V100 HydrophobicContact CD2-CG2 3.88Å; I83-V100 WeakPolarHBondContact CA-O 3.38Å; A84-V100 PolarHBondContact N-O 2.95Å; A84-V100 PolarHBondContact O-N 2.71Å; Y86-V100 HydrophobicContact CD2-CB 4.06Å; Y86-V100 HydrophobicContact CD2-CG2 3.69Å; Y86-V100 HydrophobicContact CE2-CB 3.82Å; Y86-V100 HydrophobicContact CE2-CG2 3.84Å; T98-V100 PolarHBondContact O-N 2.8Å
101	T	95.4	Very high	88	Confident	56 Å²	56	82.8 Å²	82.8	34%	0.344	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	136.7	176	52.9	0	0	0	0	108.7	A1 L2 V3 T99	A1-T101 PolarHBondContact O-N 3.15Å; A1-T101 PolarHBondContact O-OG1 3.26Å; L2-T101 WeakPolarHBondContact CA-O 3.31Å; L2-T101 WeakPolarHBondContact CD1-OG1 3.49Å; V3-T101 PolarHBondContact N-O 3.2Å; T99-T101 HydrophobicContact CG2-CG2 4.2Å
102	V	93.5	Very high	88	Confident	13 Å²	13	81.9 Å²	81.9	8%	0.079	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.7	176.1	-173.8	0	0	0	0	108.4	V3 P5 V78 T79 I83	V3-V102 HydrophobicContact CG2-CG2 3.96Å; V3-V102 CarbonylContact O-C 3.52Å; V3-V102 VanDerWaalsContact O-CA 3.28Å; V3-V102 WeakPolarHBondContact O-CA 3.34Å; P5-V102 HydrophobicContact CB-CG1 4.4Å; P5-V102 HydrophobicContact CG-CG1 3.72Å; V78-V102 HydrophobicContact CB-CG2 4.37Å; V78-V102 HydrophobicContact CG2-CG2 4.26Å; T79-V102 VanDerWaalsContact O-CG2 3.27Å; T79-V102 WeakPolarHBondContact O-CG2 3.28Å; I83-V102 HydrophobicContact CD1-CB 4.2Å; I83-V102 HydrophobicContact CG1-CB 4.09Å; I83-V102 HydrophobicContact CG1-CG2 3.98Å
103	S	89.6	Confident	87.9	Confident	32 Å²	32	76.4 Å²	76.4	22%	0.224	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-67.3	146.6	174.7	61.3	0	0	0	0	110	V3 P5	V3-S103 PolarHBondContact O-N 3.21Å; V3-S103 PolarHBondContact O-OG 2.79Å; P5-S103 WeakPolarHBondContact CD-O 3.46Å
104	S	76.3	Confident	87.7	Confident	97 Å²	97	75.2 Å²	75.2	68%	0.678	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-56.9	140.8	162.4	48.3	0	0	0	0	109.4	S106	S104-S106 PolarHBondContact O-N 3Å
105	E	61.8	Low	87.1	Confident	161 Å²	161	72 Å²	72	75%	0.752	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-56.2	123.8	167.1	-62	-169.9	157.8	0	0	107.8	P5	P5-E105 HydrophobicContact CB-CG 4.29Å; P5-E105 HydrophobicContact CG-CG 3.73Å
106	S	53.3	Low	86.3	Confident	174 Å²	174	75.7 Å²	75.7	100%	1.217	47%	0.474	S	S	*	.			trans	-116.3	0	169.9	62	0	0	0	0	108	S104	S104-S106 PolarHBondContact O-N 3Å

Retrieved 106 of 106 residues in 33 ms (Link to these results)

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