X5J4F9_MOUSE Loading...

IgM heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4F9, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 110 aa.

						>X5J4F9_MOUSE|X5J4F9
AELVKPGASVKLSCKASGYTFTSYWMHWVKQRPGRGLEWIGRIDPNSGGTKYSEKFKSKATLTVDKPSSTAYMQLSSLTSEDSAVYYCARYDYLYAMDYWGQGTSVTVSS
					

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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	78.9	Confident	93.3	Very high	114 Å²	114	76.5 Å²	76.5	94%	0.942	46%	0.462	S	S	*	.				0	141.8	0	0	0	0	0	0	108.1	S105	A1-S105 CarbonylContact C-O 3.58Å; A1-S105 WeakPolarHBondContact CA-O 3.2Å
2	E	88.5	Confident	93.6	Very high	63 Å²	63	70.5 Å²	70.5	29%	0.294	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.7	-175.9	-68.1	175	144.7	0	0	109.8	V10 L12 S105 V106 T107	E2-V10 HydrophobicContact CB-CG2 4.34Å; E2-V10 HydrophobicContact CG-CG2 4.43Å; E2-V10 WeakPolarHBondContact OE2-CG2 3.47Å; E2-L12 WeakPolarHBondContact OE2-CD2 3.41Å; E2-S105 PolarHBondContact N-O 2.97Å; E2-V106 HydrophobicContact CB-CG2 4.48Å; E2-V106 CarbonylContact O-C 3.59Å; E2-V106 WeakPolarHBondContact O-CA 3.29Å; E2-T107 PolarHBondContact O-N 3.29Å
3	L	93.5	Very high	93.9	Very high	134 Å²	134	70.7 Å²	70.7	70%	0.702	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	122.5	171.9	-179.4	66.5	0	0	0	108.4	T107	L3-T107 WeakPolarHBondContact CA-O 3.33Å; L3-T107 HydrophobicContact CD1-CG2 3.97Å
4	V	94.7	Very high	94	Very high	20 Å²	20	66.6 Å²	66.6	12%	0.121	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	154.1	-174.2	-61.4	0	0	0	0	111.2	A8 V10 L78 V106 T107 V108 S109	V4-A8 HydrophobicContact CB-CB 4.47Å; V4-V10 HydrophobicContact CG1-CB 4.34Å; V4-V10 HydrophobicContact CG1-CG2 4.09Å; V4-L78 HydrophobicContact CB-CD1 4.45Å; V4-L78 HydrophobicContact CG2-CD1 3.65Å; V4-V106 HydrophobicContact CG2-CG1 4.14Å; V4-T107 PolarHBondContact N-O 2.55Å; V4-V108 HydrophobicContact CG2-CB 4.29Å; V4-V108 HydrophobicContact CG2-CG1 4.43Å; V4-V108 HydrophobicContact CG2-CG2 3.77Å; V4-V108 CarbonylContact O-C 3.48Å; V4-V108 WeakPolarHBondContact O-CA 3.42Å; V4-S109 PolarHBondContact O-N 3.47Å; V4-S109 PolarHBondContact O-OG 2.77Å
5	K	94.3	Very high	94.1	Very high	160 Å²	160	72.9 Å²	72.9	70%	0.696	43%	0.427	S	S	*	.			trans	-81.9	154	175.7	-62.5	-176.2	179.6	-179.3	0	110.8	A8	K5-A8 WeakPolarHBondContact O-CB 3.27Å; K5-A8 PolarHBondContact O-N 3.24Å; K5-A8 VanDerWaalsContact O-N 3.15Å
6	P	95.5	Very high	94	Very high	70 Å²	70	69.1 Å²	69.1	46%	0.455	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	141.7	169.5	-26.1	36.1	0	0	0	111.7	A8 L78 V108 S109	P6-A8 PolarHBondContact O-N 3.07Å; P6-L78 CarbonylContact C-O 3.58Å; P6-L78 WeakPolarHBondContact CA-O 3.39Å; P6-V108 HydrophobicContact CB-CG1 4.47Å; P6-V108 HydrophobicContact CG-CG1 4.16Å; P6-S109 WeakPolarHBondContact CD-O 3.33Å; P6-S109 WeakPolarHBondContact CG-O 2.93Å
7	G	94.3	Very high	93.8	Very high	53 Å²	53	70.9 Å²	70.9	55%	0.546	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	-11.6	-177.4	0	0	0	0	0	114.7	L78	G7-L78 PolarHBondContact N-O 2.03Å
8	A	95.7	Very high	93.5	Very high	35 Å²	35	71.8 Å²	71.8	29%	0.289	45%	0.449	S	S	.	.			trans	-68.5	165.7	176.2	0	0	0	0	0	111.8	V4 K5 P6 S77 L78	V4-A8 HydrophobicContact CB-CB 4.47Å; K5-A8 WeakPolarHBondContact O-CB 3.27Å; K5-A8 PolarHBondContact O-N 3.24Å; K5-A8 VanDerWaalsContact O-N 3.15Å; P6-A8 PolarHBondContact O-N 3.07Å; A8-S77 PolarHBondContact O-N 2.85Å; A8-L78 WeakPolarHBondContact O-CB 3.34Å; A8-L78 WeakPolarHBondContact O-CG 3.43Å; A8-L78 PolarHBondContact O-N 2.81Å
9	S	96.4	Very high	93.2	Very high	65 Å²	65	70.4 Å²	70.4	46%	0.455	44%	0.435	S	S	.	.			trans	-111	151.4	169.8	-58.9	0	0	0	0	110.1	L75 S76	S9-L75 CarbonylContact C-O 3.35Å; S9-L75 WeakPolarHBondContact CA-O 3.43Å; S9-L75 VanDerWaalsContact CB-O 3.3Å; S9-L75 WeakPolarHBondContact CB-O 3.47Å; S9-S76 WeakPolarHBondContact OG-CA 3.17Å
10	V	96.8	Very high	93.1	Very high	12 Å²	12	71.2 Å²	71.2	7%	0.073	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	144.7	176.3	82	0	0	0	0	110.5	E2 V4 Q74 L75 L78 V106	E2-V10 HydrophobicContact CB-CG2 4.34Å; E2-V10 HydrophobicContact CG-CG2 4.43Å; E2-V10 WeakPolarHBondContact OE2-CG2 3.47Å; V4-V10 HydrophobicContact CG1-CB 4.34Å; V4-V10 HydrophobicContact CG1-CG2 4.09Å; V10-Q74 CarbonylContact O-C 3.53Å; V10-Q74 VanDerWaalsContact O-CA 3.28Å; V10-Q74 WeakPolarHBondContact O-CA 3Å; V10-L75 HydrophobicContact CG1-CB 4.22Å; V10-L75 HydrophobicContact CG1-CD1 4.34Å; V10-L75 PolarHBondContact N-O 3.18Å; V10-L75 PolarHBondContact O-N 2.95Å; V10-L78 HydrophobicContact CB-CD1 3.88Å; V10-L78 HydrophobicContact CG1-CD1 3.75Å; V10-V106 HydrophobicContact CG1-CG1 4.39Å; V10-V106 HydrophobicContact CG1-CG2 4.46Å
11	K	97.4	Very high	93.1	Very high	116 Å²	116	68.1 Å²	68.1	50%	0.504	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	107	-179.3	-174.4	178.9	179.6	-179.9	0	109.9	Y72 M73	K11-Y72 HydrophobicContact CD-CD1 4.4Å; K11-Y72 VanDerWaalsContact CE-CD1 3.46Å; K11-Y72 HydrophobicContact CG-CD1 4.35Å; K11-M73 WeakPolarHBondContact CA-O 3.29Å
12	L	97.5	Very high	93.8	Very high	4 Å²	4	65 Å²	65	2%	0.021	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	145.2	176.4	-61.1	179.1	0	0	0	110.4	E2 W28 Y72 M73 Y86 T104 V106	E2-L12 WeakPolarHBondContact OE2-CD2 3.41Å; L12-W28 HydrophobicContact CB-CH2 3.99Å; L12-W28 HydrophobicContact CB-CZ3 3.85Å; L12-W28 HydrophobicContact CD1-CZ3 4.49Å; L12-Y72 CarbonylContact O-C 3.59Å; L12-Y72 WeakPolarHBondContact O-CA 3.43Å; L12-Y72 WeakPolarHBondContact O-CB 3.47Å; L12-M73 HydrophobicContact CD1-CE 3.62Å; L12-M73 PolarHBondContact N-O 2.99Å; L12-M73 PolarHBondContact O-N 3.03Å; L12-Y86 VanDerWaalsContact CD1-CB 3.45Å; L12-Y86 HydrophobicContact CD1-CD1 4.32Å; L12-Y86 HydrophobicContact CD1-CD2 4.14Å; L12-Y86 HydrophobicContact CD1-CG 3.72Å; L12-T104 HydrophobicContact CD2-CG2 3.61Å; L12-V106 HydrophobicContact CD1-CG2 4.24Å; L12-V106 HydrophobicContact CD2-CG2 4.04Å
13	S	96.9	Very high	93.9	Very high	73 Å²	73	65.3 Å²	65.3	51%	0.51	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	149.5	177.2	66	0	0	0	0	111.4	A71 Y72	S13-A71 CarbonylContact C-O 3.59Å; S13-A71 WeakPolarHBondContact CA-O 3.45Å; S13-Y72 VanDerWaalsContact CB-CD1 3.47Å; S13-Y72 VanDerWaalsContact CB-CE1 3.43Å
14	C	96.2	Very high	93.8	Very high	14 Å²	14	61 Å²	61	10%	0.095	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	106.3	174.1	-179.9	0	0	0	0	108.7	W28 T70 A71 C88	C14-W28 HydrophobicContact CB-CH2 3.83Å; C14-W28 HydrophobicContact CB-CZ2 3.93Å; C14-T70 WeakPolarHBondContact O-CA 3.16Å; C14-A71 PolarHBondContact N-O 2.91Å; C14-A71 PolarHBondContact O-N 3.42Å; C14-C88 HydrophobicContact CB-CB 3.45Å; C14-C88 VanDerWaalsContact CB-CB 3.45Å; C14-C88 WeakPolarHBondContact CB-SG 3.41Å; C14-C88 WeakPolarHBondContact SG-CB 3.37Å; C14-C88 CovalentContact SG-SG 2.03Å; C14-C88 PolarHBondContact SG-SG 2.88Å
15	K	95.6	Very high	93.8	Very high	160 Å²	160	62.5 Å²	62.5	70%	0.696	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	124.1	-179.6	-174.1	173.4	-177.3	179.3	0	110	T70	K15-T70 HydrophobicContact CB-CG2 4.49Å
16	A	92.4	Very high	93.9	Very high	12 Å²	12	55.1 Å²	55.1	10%	0.099	35%	0.345	C	S	.	.			trans	-74.4	146.5	174.1	0	0	0	0	0	111.2	Y19 F21 S69	A16-Y19 HydrophobicContact CB-CE1 3.97Å; A16-Y19 HydrophobicContact CB-CE2 3.89Å; A16-Y19 VanDerWaalsContact CB-CZ 3.44Å; A16-Y19 VanDerWaalsContact CB-OH 3.29Å; A16-Y19 WeakPolarHBondContact CB-OH 3.34Å; A16-F21 HydrophobicContact CB-CB 3.9Å; A16-F21 HydrophobicContact CB-CD2 3.42Å; A16-F21 VanDerWaalsContact CB-CD2 3.42Å; A16-F21 HydrophobicContact CB-CE2 4.2Å; A16-F21 HydrophobicContact CB-CG 3.92Å; A16-S69 PolarHBondContact N-O 3.05Å
17	S	90.1	Very high	93.9	Very high	101 Å²	101	52.4 Å²	52.4	71%	0.706	33%	0.326	S	S	*	.			trans	-148.1	141.1	176.4	-174.8	0	0	0	0	109.7	Y19	S17-Y19 WeakPolarHBondContact O-CD1 3.48Å; S17-Y19 PolarHBondContact O-N 2.81Å
18	G	88.4	Confident	94.1	Very high	86 Å²	86	50.1 Å²	50.1	89%	0.887	30%	0.301	S	S	*	.	S	Bend	trans	77.5	11.4	175.4	0	0	0	0	0	115.9
19	Y	87.2	Confident	94.1	Very high	46 Å²	46	48.7 Å²	48.7	18%	0.18	29%	0.289	C	S	.	.	S	Bend	trans	-156	163.9	174.5	63.2	-88.3	0	0	0	112.1	A16 S17 F21 Y24 R90	A16-Y19 HydrophobicContact CB-CE1 3.97Å; A16-Y19 HydrophobicContact CB-CE2 3.89Å; A16-Y19 VanDerWaalsContact CB-CZ 3.44Å; A16-Y19 VanDerWaalsContact CB-OH 3.29Å; A16-Y19 WeakPolarHBondContact CB-OH 3.34Å; S17-Y19 WeakPolarHBondContact O-CD1 3.48Å; S17-Y19 PolarHBondContact O-N 2.81Å; Y19-F21 PolarHBondContact O-N 2.94Å; Y19-F21 VanDerWaalsContact O-N 3.08Å; Y19-Y24 AromaticContact CD2-CD2 3.39Å; Y19-Y24 HydrophobicContact CD2-CD2 3.39Å; Y19-Y24 AromaticContact CD2-CE2 3.64Å; Y19-Y24 HydrophobicContact CD2-CE2 3.64Å; Y19-Y24 HydrophobicContact CD2-CG 4.28Å; Y19-Y24 AromaticContact CE2-CD2 3.81Å; Y19-Y24 HydrophobicContact CE2-CD2 3.81Å; Y19-Y24 HydrophobicContact CE2-CE2 4.47Å; Y19-Y24 HydrophobicContact CE2-CG 4.32Å; Y19-Y24 HydrophobicContact CG-CD2 4.33Å; Y19-Y24 HydrophobicContact CG-CE2 4.19Å; Y19-R90 VanDerWaalsContact CD1-NH1 3.34Å; Y19-R90 HydrophobicContact CE2-CG 4.17Å; Y19-R90 VanDerWaalsContact CZ-CD 3.49Å
20	T	91.8	Very high	94.2	Very high	85 Å²	85	45.7 Å²	45.7	52%	0.521	27%	0.267	S	S	.	.			trans	-69.1	101.9	173	-54.4	0	0	0	0	109.9	T22 S23 Y24	T20-T22 PolarHBondContact O-N 3.34Å; T20-T22 VanDerWaalsContact O-N 3.14Å; T20-S23 WeakPolarHBondContact CB-OG 3.18Å; T20-S23 WeakPolarHBondContact CG2-OG 3.39Å; T20-S23 WeakPolarHBondContact O-CB 2.99Å; T20-S23 PolarHBondContact O-N 2.81Å; T20-Y24 WeakPolarHBondContact O-CD2 3.06Å
21	F	92.6	Very high	94.2	Very high	7 Å²	7	48.3 Å²	48.3	3%	0.031	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-53.1	-37.6	-174.1	175.7	-126.9	0	0	0	114	A16 Y19 S23 M26 P45 V64 S69 A71	A16-F21 HydrophobicContact CB-CB 3.9Å; A16-F21 HydrophobicContact CB-CD2 3.42Å; A16-F21 VanDerWaalsContact CB-CD2 3.42Å; A16-F21 HydrophobicContact CB-CE2 4.2Å; A16-F21 HydrophobicContact CB-CG 3.92Å; Y19-F21 PolarHBondContact O-N 2.94Å; Y19-F21 VanDerWaalsContact O-N 3.08Å; F21-S23 VanDerWaalsContact C-N 3.26Å; F21-S23 PolarHBondContact O-N 2.85Å; F21-M26 HydrophobicContact CE2-CE 3.97Å; F21-P45 HydrophobicContact CD1-CB 3.84Å; F21-P45 HydrophobicContact CD1-CG 4.48Å; F21-P45 HydrophobicContact CD2-CB 4.35Å; F21-P45 HydrophobicContact CD2-CG 4.14Å; F21-P45 HydrophobicContact CE1-CB 3.52Å; F21-P45 HydrophobicContact CE1-CG 4.11Å; F21-P45 HydrophobicContact CE2-CB 4.06Å; F21-P45 HydrophobicContact CE2-CG 3.71Å; F21-P45 HydrophobicContact CG-CB 4.27Å; F21-P45 HydrophobicContact CZ-CB 3.64Å; F21-P45 HydrophobicContact CZ-CG 3.7Å; F21-V64 HydrophobicContact CE1-CB 4.4Å; F21-V64 HydrophobicContact CE1-CG1 4.47Å; F21-V64 HydrophobicContact CZ-CG1 4.18Å; F21-S69 VanDerWaalsContact CD1-CA 3.47Å; F21-A71 HydrophobicContact CE2-CB 4.31Å; F21-A71 HydrophobicContact CZ-CB 3.96Å
22	T	93.9	Very high	94	Very high	50 Å²	50	44.7 Å²	44.7	31%	0.307	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-74.6	-9.8	-179.7	52.2	0	0	0	0	114.3	T20 Y24 N46	T20-T22 PolarHBondContact O-N 3.34Å; T20-T22 VanDerWaalsContact O-N 3.14Å; T22-Y24 VanDerWaalsContact C-N 3.33Å; T22-N46 WeakPolarHBondContact O-CB 3.13Å
23	S	91.6	Very high	93.6	Very high	69 Å²	69	50.2 Å²	50.2	48%	0.483	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-84	-7.2	179	-59.6	0	0	0	0	113.8	T20 F21	T20-S23 WeakPolarHBondContact CB-OG 3.18Å; T20-S23 WeakPolarHBondContact CG2-OG 3.39Å; T20-S23 WeakPolarHBondContact O-CB 2.99Å; T20-S23 PolarHBondContact O-N 2.81Å; F21-S23 VanDerWaalsContact C-N 3.26Å; F21-S23 PolarHBondContact O-N 2.85Å
24	Y	91.1	Very high	93.3	Very high	43 Å²	43	51.1 Å²	51.1	17%	0.169	32%	0.319	C	S	.	.	S	Bend	trans	-132.7	145.6	-171.5	-61	-93.9	0	0	0	111.7	Y19 T20 T22 P45 R90 D92	Y19-Y24 AromaticContact CD2-CD2 3.39Å; Y19-Y24 HydrophobicContact CD2-CD2 3.39Å; Y19-Y24 AromaticContact CD2-CE2 3.64Å; Y19-Y24 HydrophobicContact CD2-CE2 3.64Å; Y19-Y24 HydrophobicContact CD2-CG 4.28Å; Y19-Y24 AromaticContact CE2-CD2 3.81Å; Y19-Y24 HydrophobicContact CE2-CD2 3.81Å; Y19-Y24 HydrophobicContact CE2-CE2 4.47Å; Y19-Y24 HydrophobicContact CE2-CG 4.32Å; Y19-Y24 HydrophobicContact CG-CD2 4.33Å; Y19-Y24 HydrophobicContact CG-CE2 4.19Å; T20-Y24 WeakPolarHBondContact O-CD2 3.06Å; T22-Y24 VanDerWaalsContact C-N 3.33Å; Y24-P45 WeakPolarHBondContact O-CD 3.41Å; Y24-P45 VanDerWaalsContact O-CG 3.3Å; Y24-P45 WeakPolarHBondContact O-CG 3.3Å; Y24-R90 VanDerWaalsContact CB-CG 3.43Å; Y24-R90 HydrophobicContact CD1-CG 3.58Å; Y24-R90 HydrophobicContact CD2-CG 4.39Å; Y24-R90 HydrophobicContact CE1-CG 4.45Å; Y24-R90 HydrophobicContact CG-CG 3.55Å; Y24-D92 HydrophobicContact CD1-CB 3.49Å; Y24-D92 VanDerWaalsContact CD1-CB 3.49Å; Y24-D92 HydrophobicContact CE1-CB 3.64Å
25	W	94.1	Very high	93	Very high	52 Å²	52	58.1 Å²	58.1	20%	0.197	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	140.7	168.8	-61.5	-18.5	0	0	0	110.6	Y91 Y93	W25-Y91 HydrophobicContact CD2-CD1 4.44Å; W25-Y91 AromaticContact CE3-CD1 3.62Å; W25-Y91 HydrophobicContact CE3-CD1 3.62Å; W25-Y91 AromaticContact CE3-CE1 3.97Å; W25-Y91 HydrophobicContact CE3-CE1 3.97Å; W25-Y91 HydrophobicContact CZ3-CD1 4.11Å; W25-Y91 AromaticContact CZ3-CE1 3.96Å; W25-Y91 HydrophobicContact CZ3-CE1 3.96Å; W25-Y91 PolarHBondContact N-O 2.87Å; W25-Y91 PolarHBondContact O-N 3.14Å; W25-Y93 HydrophobicContact CH2-CE1 4.33Å; W25-Y93 HydrophobicContact CH2-CE2 4.31Å; W25-Y93 AromaticContact CH2-CZ 3.78Å; W25-Y93 WeakPolarHBondContact CH2-OH 3.42Å; W25-Y93 HydrophobicContact CZ2-CE2 4.24Å
26	M	95.8	Very high	92.8	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.02	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	115.3	172.7	-171.8	61.1	68.8	0	0	109.6	F21 R42 I43 A71 C88	F21-M26 HydrophobicContact CE2-CE 3.97Å; M26-R42 CarbonylContact O-C 3.58Å; M26-R42 WeakPolarHBondContact O-CA 3.48Å; M26-I43 HydrophobicContact CB-CG2 4.02Å; M26-I43 PolarHBondContact N-O 2.7Å; M26-I43 PolarHBondContact O-N 2.9Å; M26-A71 HydrophobicContact CB-CB 4.11Å; M26-A71 HydrophobicContact CG-CB 3.68Å; M26-C88 HydrophobicContact CG-CB 4.41Å; M26-C88 HydrophobicContact SD-CB 3.7Å
27	H	96.4	Very high	92.9	Very high	14 Å²	14	57.2 Å²	57.2	7%	0.065	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	146.8	176.7	-69.9	-112.1	0	0	0	110.4	W39 G41 R42 C88 A89 Y91 M97	H27-W39 AromaticContact CG-NE1 3.87Å; H27-W39 AromaticContact ND1-CD1 3.91Å; H27-W39 AromaticContact ND1-CE2 3.85Å; H27-W39 AromaticContact ND1-NE1 3.06Å; H27-W39 PolarHBondContact ND1-NE1 2.93Å; H27-G41 WeakPolarHBondContact CA-O 3.36Å; H27-R42 VanDerWaalsContact CE1-CD 3.49Å; H27-R42 WeakPolarHBondContact CE1-CD 3.45Å; H27-C88 CarbonylContact O-C 3.55Å; H27-C88 WeakPolarHBondContact O-CA 3.33Å; H27-A89 HydrophobicContact CB-CB 4.48Å; H27-A89 PolarHBondContact N-O 2.96Å; H27-A89 PolarHBondContact O-N 3.36Å; H27-Y91 WeakPolarHBondContact NE2-CB 3.35Å; H27-Y91 AromaticContact NE2-CG 3.87Å; H27-M97 HydrophobicContact CB-CE 3.79Å; H27-M97 HydrophobicContact CB-SD 4.48Å; H27-M97 VanDerWaalsContact CG-CE 3.48Å; H27-M97 WeakPolarHBondContact ND1-CE 3.32Å
28	W	97.7	Very high	93.2	Very high	5 Å²	5	53.9 Å²	53.9	2%	0.019	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	135.5	174	-70.3	90.4	0	0	0	110.1	L12 C14 I40 G41 L62 A71 M73 Y87 C88	L12-W28 HydrophobicContact CB-CH2 3.99Å; L12-W28 HydrophobicContact CB-CZ3 3.85Å; L12-W28 HydrophobicContact CD1-CZ3 4.49Å; C14-W28 HydrophobicContact CB-CH2 3.83Å; C14-W28 HydrophobicContact CB-CZ2 3.93Å; W28-I40 HydrophobicContact CB-CB 4.13Å; W28-I40 HydrophobicContact CB-CD1 4.3Å; W28-I40 WeakPolarHBondContact O-CB 3.4Å; W28-I40 PolarHBondContact O-N 2.91Å; W28-G41 PolarHBondContact N-O 2.9Å; W28-L62 HydrophobicContact CG-CD2 4.07Å; W28-A71 HydrophobicContact CZ2-CB 4.37Å; W28-M73 HydrophobicContact CB-SD 3.81Å; W28-M73 HydrophobicContact CD2-CB 3.63Å; W28-M73 HydrophobicContact CD2-CE 4.23Å; W28-M73 HydrophobicContact CD2-CG 4.41Å; W28-M73 HydrophobicContact CD2-SD 4.01Å; W28-M73 HydrophobicContact CE3-CB 3.89Å; W28-M73 HydrophobicContact CE3-CE 3.67Å; W28-M73 HydrophobicContact CE3-SD 4.07Å; W28-M73 HydrophobicContact CG-CB 4.14Å; W28-M73 HydrophobicContact CG-SD 3.92Å; W28-M73 HydrophobicContact CH2-CB 4.07Å; W28-M73 HydrophobicContact CZ2-CB 3.84Å; W28-M73 HydrophobicContact CZ3-CB 4.1Å; W28-M73 HydrophobicContact CZ3-CE 4.2Å; W28-Y87 WeakPolarHBondContact CA-O 3.35Å; W28-C88 HydrophobicContact CD2-CB 4.43Å; W28-C88 HydrophobicContact CE3-CB 4.27Å; W28-C88 HydrophobicContact CH2-CB 4.4Å; W28-C88 HydrophobicContact CZ3-CB 4.26Å
29	V	97.3	Very high	93.6	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.024	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	136.5	-172.4	-176.7	0	0	0	0	109.6	L37 E38 Y86 Y87 W100	V29-L37 HydrophobicContact CG1-CB 3.78Å; V29-L37 HydrophobicContact CG1-CD2 3.93Å; V29-L37 HydrophobicContact CG1-CG 4.3Å; V29-E38 WeakPolarHBondContact CA-O 3.36Å; V29-Y86 CarbonylContact O-C 3.59Å; V29-Y86 WeakPolarHBondContact O-CA 3.24Å; V29-Y87 PolarHBondContact N-O 3.46Å; V29-Y87 PolarHBondContact O-N 3.22Å; V29-W100 HydrophobicContact CB-CH2 4.13Å; V29-W100 HydrophobicContact CB-CZ3 3.84Å; V29-W100 HydrophobicContact CG1-CH2 4.09Å; V29-W100 HydrophobicContact CG1-CZ3 4.01Å; V29-W100 HydrophobicContact CG2-CH2 3.77Å; V29-W100 HydrophobicContact CG2-CZ3 3.88Å
30	K	97.1	Very high	94.1	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.009	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	135.8	174.4	-177.6	-177.6	-176.4	178.8	0	109.5	E38 I40 F56 E81 D82 A84 Y86	K30-E38 HydrophobicContact CB-CB 4.32Å; K30-E38 PolarHBondContact N-O 2.88Å; K30-E38 PolarHBondContact O-N 3.05Å; K30-I40 HydrophobicContact CB-CD1 4.02Å; K30-I40 HydrophobicContact CB-CG1 4.17Å; K30-F56 HydrophobicContact CB-CZ 4.39Å; K30-F56 HydrophobicContact CD-CE1 4.03Å; K30-F56 HydrophobicContact CD-CZ 3.75Å; K30-E81 PolarHBondContact NZ-O 2.87Å; K30-D82 IonicContact NZ-OD1 2.91Å; K30-D82 PolarHBondContact NZ-OD1 2.92Å; K30-A84 HydrophobicContact CD-CB 4.18Å; K30-A84 HydrophobicContact CG-CB 3.53Å; K30-Y86 HydrophobicContact CB-CD1 4.12Å; K30-Y86 HydrophobicContact CB-CE1 3.89Å; K30-Y86 HydrophobicContact CD-CE1 4.01Å; K30-Y86 HydrophobicContact CG-CD1 4.28Å; K30-Y86 HydrophobicContact CG-CE1 3.76Å
31	Q	96.7	Very high	94.3	Very high	68 Å²	68	47.2 Å²	47.2	32%	0.318	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	115.4	171.5	-170	-177.7	36.6	0	0	109.9	L37 A84 V85 Y87	Q31-L37 HydrophobicContact CB-CD2 3.81Å; Q31-L37 HydrophobicContact CG-CD2 3.88Å; Q31-A84 WeakPolarHBondContact O-CA 3.46Å; Q31-A84 VanDerWaalsContact O-CB 3.29Å; Q31-A84 WeakPolarHBondContact O-CB 3.31Å; Q31-V85 PolarHBondContact N-O 2.83Å; Q31-V85 PolarHBondContact O-N 3.14Å; Q31-Y87 HydrophobicContact CB-CD2 4.3Å; Q31-Y87 HydrophobicContact CB-CE2 3.68Å; Q31-Y87 VanDerWaalsContact OE1-CE2 3.28Å; Q31-Y87 PolarHBondContact OE1-OH 2.89Å
32	R	93.9	Very high	94.5	Very high	40 Å²	40	49.4 Å²	49.4	15%	0.151	28%	0.277	C	S	.	.			trans	-87.2	147.2	170.9	-70.6	173.1	174.9	145.9	-20.1	109.8	G34 R35 E38 E81 A84	R32-G34 PolarHBondContact O-N 2.83Å; R32-R35 HydrophobicContact CB-CB 4.03Å; R32-R35 HydrophobicContact CB-CG 4.29Å; R32-R35 PolarHBondContact O-N 2.81Å; R32-E38 IonicContact CZ-OE2 3.88Å; R32-E38 IonicContact NE-OE2 3.71Å; R32-E38 IonicContact NH1-OE1 2.81Å; R32-E38 IonicContact NH1-OE2 3.34Å; R32-E38 PolarHBondContact NH1-OE2 3.03Å; R32-E81 PolarHBondContact NE-O 3.45Å; R32-E81 PolarHBondContact NH2-O 2.95Å; R32-E81 IonicContact NH2-OE2 3.72Å; R32-A84 HydrophobicContact CG-CB 4.13Å
33	P	88.7	Confident	94.7	Very high	119 Å²	119	47.2 Å²	47.2	77%	0.773	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	129.5	172.6	-25.1	34.3	0	0	0	111.2	R35	P33-R35 PolarHBondContact O-N 2.8Å
34	G	89.8	Confident	94.9	Very high	93 Å²	93	45.3 Å²	45.3	96%	0.959	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.4	10	179.6	0	0	0	0	0	115.8	R32	R32-G34 PolarHBondContact O-N 2.83Å
35	R	91.4	Very high	95.1	Very high	161 Å²	161	43.2 Å²	43.2	61%	0.608	24%	0.24	S	C	*	.	S	Bend	trans	-122.4	161.1	176	-65.5	-171.2	167	-158.9	-2.2	111.7	R32 P33	R32-R35 HydrophobicContact CB-CB 4.03Å; R32-R35 HydrophobicContact CB-CG 4.29Å; R32-R35 PolarHBondContact O-N 2.81Å; P33-R35 PolarHBondContact O-N 2.8Å
36	G	91.2	Very high	95.1	Very high	56 Å²	56	45.4 Å²	45.4	58%	0.577	26%	0.255	S	S	*	.			trans	-66.3	171.4	173.7	0	0	0	0	0	113.4
37	L	94.5	Very high	95.1	Very high	97 Å²	97	49.1 Å²	49.1	51%	0.508	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	129.8	175.7	-63.6	174.9	0	0	0	110.8	V29 Q31 W100	V29-L37 HydrophobicContact CG1-CB 3.78Å; V29-L37 HydrophobicContact CG1-CD2 3.93Å; V29-L37 HydrophobicContact CG1-CG 4.3Å; Q31-L37 HydrophobicContact CB-CD2 3.81Å; Q31-L37 HydrophobicContact CG-CD2 3.88Å; L37-W100 HydrophobicContact CD1-CH2 3.87Å; L37-W100 HydrophobicContact CD1-CZ3 4.4Å
38	E	96.2	Very high	95.1	Very high	30 Å²	30	50.1 Å²	50.1	14%	0.14	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	114	174.5	-63.9	-171.7	102.1	0	0	109.4	V29 K30 R32 I40 K55 F56	V29-E38 WeakPolarHBondContact CA-O 3.36Å; K30-E38 HydrophobicContact CB-CB 4.32Å; K30-E38 PolarHBondContact N-O 2.88Å; K30-E38 PolarHBondContact O-N 3.05Å; R32-E38 IonicContact CZ-OE2 3.88Å; R32-E38 IonicContact NE-OE2 3.71Å; R32-E38 IonicContact NH1-OE1 2.81Å; R32-E38 IonicContact NH1-OE2 3.34Å; R32-E38 PolarHBondContact NH1-OE2 3.03Å; E38-I40 PolarHBondContact O-N 3.42Å; E38-K55 IonicContact OE1-NZ 3.53Å; E38-K55 PolarHBondContact OE1-NZ 3.02Å; E38-F56 HydrophobicContact CB-CE2 4.49Å
39	W	96.1	Very high	95	Very high	78 Å²	78	51.5 Å²	51.5	30%	0.295	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	124.8	176	-178.1	70.1	0	0	0	110.7	H27 G41 R42 K51 S53	H27-W39 AromaticContact CG-NE1 3.87Å; H27-W39 AromaticContact ND1-CD1 3.91Å; H27-W39 AromaticContact ND1-CE2 3.85Å; H27-W39 AromaticContact ND1-NE1 3.06Å; H27-W39 PolarHBondContact ND1-NE1 2.93Å; W39-G41 VanDerWaalsContact CE2-C 3.47Å; W39-G41 PolarHBondContact NE1-O 3.43Å; W39-R42 HydrophobicContact CZ2-CB 4.02Å; W39-R42 HydrophobicContact CZ2-CG 4.07Å; W39-K51 HydrophobicContact CH2-CB 4.26Å; W39-K51 HydrophobicContact CH2-CD 4.25Å; W39-K51 HydrophobicContact CH2-CG 4.03Å; W39-S53 VanDerWaalsContact O-CB 3.3Å; W39-S53 WeakPolarHBondContact O-CB 3.41Å; W39-S53 PolarHBondContact O-OG 3.11Å
40	I	97.7	Very high	95.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-49.9	-178.1	-58.9	175.9	0	0	0	110	W28 K30 E38 Y52 S53 F56 A60 M73 Y86	W28-I40 HydrophobicContact CB-CB 4.13Å; W28-I40 HydrophobicContact CB-CD1 4.3Å; W28-I40 WeakPolarHBondContact O-CB 3.4Å; W28-I40 PolarHBondContact O-N 2.91Å; K30-I40 HydrophobicContact CB-CD1 4.02Å; K30-I40 HydrophobicContact CB-CG1 4.17Å; E38-I40 PolarHBondContact O-N 3.42Å; I40-Y52 WeakPolarHBondContact O-CA 3.05Å; I40-S53 PolarHBondContact O-N 3.49Å; I40-S53 PolarHBondContact O-OG 2.59Å; I40-F56 HydrophobicContact CB-CB 4.49Å; I40-F56 HydrophobicContact CB-CD1 4.48Å; I40-F56 HydrophobicContact CB-CD2 4.38Å; I40-F56 HydrophobicContact CB-CG 4.21Å; I40-F56 HydrophobicContact CD1-CE1 4.46Å; I40-F56 HydrophobicContact CG1-CD1 4.14Å; I40-F56 HydrophobicContact CG1-CD2 4.28Å; I40-F56 HydrophobicContact CG1-CE1 4.08Å; I40-F56 HydrophobicContact CG1-CE2 4.2Å; I40-F56 HydrophobicContact CG1-CG 4.23Å; I40-F56 HydrophobicContact CG1-CZ 4.1Å; I40-F56 HydrophobicContact CG2-CB 3.66Å; I40-F56 HydrophobicContact CG2-CD1 3.91Å; I40-F56 HydrophobicContact CG2-CD2 4.38Å; I40-F56 HydrophobicContact CG2-CG 3.74Å; I40-A60 HydrophobicContact CG2-CB 3.73Å; I40-M73 HydrophobicContact CB-SD 4.48Å; I40-M73 HydrophobicContact CD1-CE 3.82Å; I40-M73 HydrophobicContact CD1-SD 3.6Å; I40-M73 HydrophobicContact CG2-SD 3.84Å; I40-Y86 HydrophobicContact CD1-CD1 3.68Å; I40-Y86 HydrophobicContact CD1-CE1 3.76Å
41	G	97.1	Very high	95.1	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.1	179.3	-173.2	0	0	0	0	0	112.7	H27 W28 W39 K51	H27-G41 WeakPolarHBondContact CA-O 3.36Å; W28-G41 PolarHBondContact N-O 2.9Å; W39-G41 VanDerWaalsContact CE2-C 3.47Å; W39-G41 PolarHBondContact NE1-O 3.43Å; G41-K51 CarbonylContact C-O 3.53Å; G41-K51 WeakPolarHBondContact CA-O 3.4Å
42	R	96.4	Very high	95.1	Very high	53 Å²	53	59.6 Å²	59.6	20%	0.2	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.7	170.6	72.2	178.7	-178.1	86.2	-5.9	110.9	M26 H27 W39 T50 K51	M26-R42 CarbonylContact O-C 3.58Å; M26-R42 WeakPolarHBondContact O-CA 3.48Å; H27-R42 VanDerWaalsContact CE1-CD 3.49Å; H27-R42 WeakPolarHBondContact CE1-CD 3.45Å; W39-R42 HydrophobicContact CZ2-CB 4.02Å; W39-R42 HydrophobicContact CZ2-CG 4.07Å; R42-T50 WeakPolarHBondContact O-CA 3.2Å; R42-K51 HydrophobicContact CG-CB 4.15Å; R42-K51 PolarHBondContact N-O 2.8Å; R42-K51 PolarHBondContact O-N 3.13Å
43	I	97.3	Very high	95.3	Very high	4 Å²	4	59 Å²	59	2%	0.021	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	135.8	168.7	-173.6	157	0	0	0	109.2	M26 P45 G49 T50 L62 V64 A71	M26-I43 HydrophobicContact CB-CG2 4.02Å; M26-I43 PolarHBondContact N-O 2.7Å; M26-I43 PolarHBondContact O-N 2.9Å; I43-P45 WeakPolarHBondContact O-CD 3.26Å; I43-G49 CarbonylContact C-O 3.51Å; I43-G49 WeakPolarHBondContact CA-O 3.27Å; I43-T50 HydrophobicContact CB-CG2 4.06Å; I43-T50 HydrophobicContact CD1-CG2 3.68Å; I43-T50 HydrophobicContact CG1-CG2 3.81Å; I43-L62 HydrophobicContact CB-CB 4.04Å; I43-L62 HydrophobicContact CB-CD1 4.26Å; I43-L62 HydrophobicContact CD1-CB 4.03Å; I43-L62 HydrophobicContact CG2-CB 4.39Å; I43-V64 HydrophobicContact CD1-CG1 3.71Å; I43-V64 HydrophobicContact CD1-CG2 4.45Å; I43-V64 HydrophobicContact CG1-CG1 3.87Å; I43-V64 HydrophobicContact CG2-CG1 3.88Å; I43-A71 HydrophobicContact CG2-CB 4.49Å
44	D	95.9	Very high	95.6	Very high	28 Å²	28	62.3 Å²	62.3	15%	0.15	36%	0.356	C	S	.	.			trans	-84.3	112	167.8	176.1	-3.3	0	0	0	108.6	N46 S47 G48 G49	D44-N46 PolarHBondContact O-N 3.46Å; D44-N46 VanDerWaalsContact OD1-CB 3.32Å; D44-N46 WeakPolarHBondContact OD1-CB 3.03Å; D44-N46 PolarHBondContact OD1-N 2.79Å; D44-S47 WeakPolarHBondContact CB-OG 3.36Å; D44-S47 PolarHBondContact OD1-N 2.54Å; D44-S47 WeakPolarHBondContact OD2-CB 3.42Å; D44-S47 PolarHBondContact OD2-OG 2.79Å; D44-G48 WeakPolarHBondContact O-CA 3.47Å; D44-G48 PolarHBondContact O-N 2.92Å; D44-G49 PolarHBondContact N-O 3.09Å
45	P	95.6	Very high	95.7	Very high	0 Å²	0	65 Å²	65	0%	0	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-18.2	-179.5	-17.3	32.4	0	0	0	114.1	F21 Y24 I43 V64 K66	F21-P45 HydrophobicContact CD1-CB 3.84Å; F21-P45 HydrophobicContact CD1-CG 4.48Å; F21-P45 HydrophobicContact CD2-CB 4.35Å; F21-P45 HydrophobicContact CD2-CG 4.14Å; F21-P45 HydrophobicContact CE1-CB 3.52Å; F21-P45 HydrophobicContact CE1-CG 4.11Å; F21-P45 HydrophobicContact CE2-CB 4.06Å; F21-P45 HydrophobicContact CE2-CG 3.71Å; F21-P45 HydrophobicContact CG-CB 4.27Å; F21-P45 HydrophobicContact CZ-CB 3.64Å; F21-P45 HydrophobicContact CZ-CG 3.7Å; Y24-P45 WeakPolarHBondContact O-CD 3.41Å; Y24-P45 VanDerWaalsContact O-CG 3.3Å; Y24-P45 WeakPolarHBondContact O-CG 3.3Å; I43-P45 WeakPolarHBondContact O-CD 3.26Å; P45-V64 HydrophobicContact CB-CG1 4.09Å; P45-V64 HydrophobicContact CG-CG1 4.4Å; P45-K66 WeakPolarHBondContact O-CE 3.35Å
46	N	95	Very high	95.9	Very high	98 Å²	98	57.8 Å²	57.8	52%	0.524	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-56.2	175.4	-171.9	33.1	0	0	0	111.5	T22 D44 K66	T22-N46 WeakPolarHBondContact O-CB 3.13Å; D44-N46 PolarHBondContact O-N 3.46Å; D44-N46 VanDerWaalsContact OD1-CB 3.32Å; D44-N46 WeakPolarHBondContact OD1-CB 3.03Å; D44-N46 PolarHBondContact OD1-N 2.79Å; N46-K66 WeakPolarHBondContact O-CE 3.42Å; N46-K66 PolarHBondContact O-NZ 2.89Å
47	S	95.6	Very high	96.1	Very high	81 Å²	81	62.7 Å²	62.7	57%	0.566	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-20.3	-174.6	65.5	0	0	0	0	114.3	D44 G49	D44-S47 WeakPolarHBondContact CB-OG 3.36Å; D44-S47 PolarHBondContact OD1-N 2.54Å; D44-S47 WeakPolarHBondContact OD2-CB 3.42Å; D44-S47 PolarHBondContact OD2-OG 2.79Å; S47-G49 PolarHBondContact O-N 3.24Å; S47-G49 PolarHBondContact OG-N 3.26Å; S47-G49 VanDerWaalsContact OG-N 3.17Å
48	G	95.3	Very high	96.1	Very high	35 Å²	35	63.4 Å²	63.4	36%	0.361	33%	0.333	S	S	.	.			trans	77.2	2.6	-168.2	0	0	0	0	0	113.7	D44 T50	D44-G48 WeakPolarHBondContact O-CA 3.47Å; D44-G48 PolarHBondContact O-N 2.92Å; G48-T50 PolarHBondContact O-N 3.23Å
49	G	96.8	Very high	96	Very high	34 Å²	34	63.8 Å²	63.8	35%	0.351	33%	0.334	S	S	.	.			trans	-62.1	130.4	-179.8	0	0	0	0	0	112	I43 D44 S47	I43-G49 CarbonylContact C-O 3.51Å; I43-G49 WeakPolarHBondContact CA-O 3.27Å; D44-G49 PolarHBondContact N-O 3.09Å; S47-G49 PolarHBondContact O-N 3.24Å; S47-G49 PolarHBondContact OG-N 3.26Å; S47-G49 VanDerWaalsContact OG-N 3.17Å
50	T	97.8	Very high	96.1	Very high	64 Å²	64	60.3 Å²	60.3	39%	0.393	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	147.9	-178.5	54.7	0	0	0	0	112.1	R42 I43 G48 Y52 L62	R42-T50 WeakPolarHBondContact O-CA 3.2Å; I43-T50 HydrophobicContact CB-CG2 4.06Å; I43-T50 HydrophobicContact CD1-CG2 3.68Å; I43-T50 HydrophobicContact CG1-CG2 3.81Å; G48-T50 PolarHBondContact O-N 3.23Å; T50-Y52 WeakPolarHBondContact OG1-CE2 3.49Å; T50-L62 HydrophobicContact CG2-CB 4Å
51	K	97.3	Very high	96.1	Very high	127 Å²	127	63.7 Å²	63.7	55%	0.552	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.9	139.5	168	-169.7	-178.7	179.2	177.9	0	108.5	W39 G41 R42	W39-K51 HydrophobicContact CH2-CB 4.26Å; W39-K51 HydrophobicContact CH2-CD 4.25Å; W39-K51 HydrophobicContact CH2-CG 4.03Å; G41-K51 CarbonylContact C-O 3.53Å; G41-K51 WeakPolarHBondContact CA-O 3.4Å; R42-K51 HydrophobicContact CG-CB 4.15Å; R42-K51 PolarHBondContact N-O 2.8Å; R42-K51 PolarHBondContact O-N 3.13Å
52	Y	97.9	Very high	96.2	Very high	54 Å²	54	64.1 Å²	64.1	21%	0.212	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	155.7	-178	-60.1	-91.2	0	0	0	110.3	I40 T50 A60 L62	I40-Y52 WeakPolarHBondContact O-CA 3.05Å; T50-Y52 WeakPolarHBondContact OG1-CE2 3.49Å; Y52-A60 HydrophobicContact CD1-CB 4.42Å; Y52-A60 HydrophobicContact CE1-CB 4.25Å; Y52-A60 WeakPolarHBondContact CE1-O 2.9Å; Y52-L62 HydrophobicContact CE1-CD1 4.06Å; Y52-L62 HydrophobicContact CE1-CG 3.71Å; Y52-L62 PolarHBondContact OH-N 2.82Å; Y52-L62 VanDerWaalsContact OH-N 3.14Å
53	S	96.8	Very high	96.3	Very high	26 Å²	26	64.4 Å²	64.4	18%	0.182	35%	0.353	C	S	.	.			trans	-77.7	154.8	158	59.9	0	0	0	0	110.1	W39 I40 K55 F56 K57	W39-S53 VanDerWaalsContact O-CB 3.3Å; W39-S53 WeakPolarHBondContact O-CB 3.41Å; W39-S53 PolarHBondContact O-OG 3.11Å; I40-S53 PolarHBondContact O-N 3.49Å; I40-S53 PolarHBondContact O-OG 2.59Å; S53-K55 VanDerWaalsContact C-N 3.25Å; S53-K55 PolarHBondContact O-N 2.84Å; S53-F56 PolarHBondContact O-N 2.98Å; S53-F56 VanDerWaalsContact O-N 3.09Å; S53-F56 VanDerWaalsContact OG-CD2 3.31Å; S53-F56 WeakPolarHBondContact OG-CD2 3.18Å; S53-K57 PolarHBondContact O-N 3.47Å; S53-K57 VanDerWaalsContact O-N 3.13Å
54	E	95.4	Very high	96.3	Very high	189 Å²	189	66.2 Å²	66.2	88%	0.883	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-56.4	-40.4	-174.7	-64.5	-179.3	164.4	0	0	112.5	F56	E54-F56 VanDerWaalsContact C-N 3.25Å; E54-F56 PolarHBondContact O-N 3.05Å
55	K	93	Very high	96.3	Very high	149 Å²	149	67.7 Å²	67.7	65%	0.648	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-59.9	-30.1	179.2	-70.8	177.8	173.4	175	0	114.2	E38 S53	E38-K55 IonicContact OE1-NZ 3.53Å; E38-K55 PolarHBondContact OE1-NZ 3.02Å; S53-K55 VanDerWaalsContact C-N 3.25Å; S53-K55 PolarHBondContact O-N 2.84Å
56	F	95.4	Very high	96.3	Very high	11 Å²	11	72.7 Å²	72.7	5%	0.048	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-112.6	-4.7	-170.8	-66.2	-89.6	0	0	0	113.5	K30 E38 I40 S53 E54 S58 K59 A60	K30-F56 HydrophobicContact CB-CZ 4.39Å; K30-F56 HydrophobicContact CD-CE1 4.03Å; K30-F56 HydrophobicContact CD-CZ 3.75Å; E38-F56 HydrophobicContact CB-CE2 4.49Å; I40-F56 HydrophobicContact CB-CB 4.49Å; I40-F56 HydrophobicContact CB-CD1 4.48Å; I40-F56 HydrophobicContact CB-CD2 4.38Å; I40-F56 HydrophobicContact CB-CG 4.21Å; I40-F56 HydrophobicContact CD1-CE1 4.46Å; I40-F56 HydrophobicContact CG1-CD1 4.14Å; I40-F56 HydrophobicContact CG1-CD2 4.28Å; I40-F56 HydrophobicContact CG1-CE1 4.08Å; I40-F56 HydrophobicContact CG1-CE2 4.2Å; I40-F56 HydrophobicContact CG1-CG 4.23Å; I40-F56 HydrophobicContact CG1-CZ 4.1Å; I40-F56 HydrophobicContact CG2-CB 3.66Å; I40-F56 HydrophobicContact CG2-CD1 3.91Å; I40-F56 HydrophobicContact CG2-CD2 4.38Å; I40-F56 HydrophobicContact CG2-CG 3.74Å; S53-F56 PolarHBondContact O-N 2.98Å; S53-F56 VanDerWaalsContact O-N 3.09Å; S53-F56 VanDerWaalsContact OG-CD2 3.31Å; S53-F56 WeakPolarHBondContact OG-CD2 3.18Å; E54-F56 VanDerWaalsContact C-N 3.25Å; E54-F56 PolarHBondContact O-N 3.05Å; F56-S58 PolarHBondContact O-N 2.88Å; F56-K59 PolarHBondContact O-N 2.83Å; F56-A60 HydrophobicContact CB-CB 4.29Å; F56-A60 PolarHBondContact O-N 2.79Å
57	K	94.3	Very high	96.2	Very high	159 Å²	159	74 Å²	74	69%	0.691	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-33.4	-176.5	-170.6	177.8	-179.8	-176.6	0	113.9	S53	S53-K57 PolarHBondContact O-N 3.47Å; S53-K57 VanDerWaalsContact O-N 3.13Å
58	S	94.6	Very high	96.2	Very high	111 Å²	111	72 Å²	72	78%	0.776	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-7.1	177.1	55.7	0	0	0	0	113.9	F56	F56-S58 PolarHBondContact O-N 2.88Å
59	K	95.6	Very high	96.2	Very high	39 Å²	39	72.3 Å²	72.3	17%	0.17	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-30.4	-168.2	-163.4	168.4	-165.9	168.2	0	113.8	F56 L75 S76 D82	F56-K59 PolarHBondContact O-N 2.83Å; K59-L75 WeakPolarHBondContact O-CA 2.99Å; K59-S76 WeakPolarHBondContact CE-O 3.3Å; K59-S76 WeakPolarHBondContact CG-O 3.42Å; K59-S76 PolarHBondContact O-N 3.3Å; K59-S76 PolarHBondContact O-OG 2.98Å; K59-D82 WeakPolarHBondContact CE-OD1 3.5Å; K59-D82 WeakPolarHBondContact CE-OD2 3.46Å; K59-D82 IonicContact NZ-OD1 2.89Å; K59-D82 PolarHBondContact NZ-OD1 2.88Å; K59-D82 IonicContact NZ-OD2 2.54Å; K59-D82 PolarHBondContact NZ-OD2 2.88Å
60	A	97.6	Very high	96.3	Very high	4 Å²	4	71 Å²	71	3%	0.033	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	135.9	-178.3	0	0	0	0	0	110.7	I40 Y52 F56 M73 Q74 L75	I40-A60 HydrophobicContact CG2-CB 3.73Å; Y52-A60 HydrophobicContact CD1-CB 4.42Å; Y52-A60 HydrophobicContact CE1-CB 4.25Å; Y52-A60 WeakPolarHBondContact CE1-O 2.9Å; F56-A60 HydrophobicContact CB-CB 4.29Å; F56-A60 PolarHBondContact O-N 2.79Å; A60-M73 HydrophobicContact CB-CG 4.4Å; A60-M73 HydrophobicContact CB-SD 4.44Å; A60-Q74 CarbonylContact C-O 3.54Å; A60-Q74 WeakPolarHBondContact CA-O 3.11Å; A60-L75 HydrophobicContact CB-CD2 3.93Å
61	T	98.3	Very high	96.3	Very high	72 Å²	72	68 Å²	68	44%	0.442	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	119.4	169	-59.2	0	0	0	0	108.6	T63 M73 Q74	T61-T63 HydrophobicContact CG2-CG2 4.35Å; T61-M73 WeakPolarHBondContact O-CA 3.48Å; T61-Q74 PolarHBondContact N-O 2.87Å; T61-Q74 PolarHBondContact O-N 2.8Å
62	L	98.4	Very high	96.3	Very high	9 Å²	9	64.5 Å²	64.5	5%	0.047	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	134.2	178	-53.9	-176.3	0	0	0	110.7	W28 I43 T50 Y52 Y72 M73	W28-L62 HydrophobicContact CG-CD2 4.07Å; I43-L62 HydrophobicContact CB-CB 4.04Å; I43-L62 HydrophobicContact CB-CD1 4.26Å; I43-L62 HydrophobicContact CD1-CB 4.03Å; I43-L62 HydrophobicContact CG2-CB 4.39Å; T50-L62 HydrophobicContact CG2-CB 4Å; Y52-L62 HydrophobicContact CE1-CD1 4.06Å; Y52-L62 HydrophobicContact CE1-CG 3.71Å; Y52-L62 PolarHBondContact OH-N 2.82Å; Y52-L62 VanDerWaalsContact OH-N 3.14Å; L62-Y72 WeakPolarHBondContact CA-O 3.35Å; L62-M73 HydrophobicContact CD2-CB 3.65Å; L62-M73 HydrophobicContact CD2-CG 3.61Å; L62-M73 HydrophobicContact CD2-SD 4.16Å
63	T	98.1	Very high	96.3	Very high	59 Å²	59	61.9 Å²	61.9	36%	0.362	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	163	177.2	55.4	0	0	0	0	110.7	T61 Y72	T61-T63 HydrophobicContact CG2-CG2 4.35Å; T63-Y72 PolarHBondContact N-O 3.15Å; T63-Y72 PolarHBondContact O-N 3.23Å
64	V	97.6	Very high	96.4	Very high	41 Å²	41	64.9 Å²	64.9	25%	0.248	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	145.7	175.9	-66.4	0	0	0	0	110.9	F21 I43 P45 A71	F21-V64 HydrophobicContact CE1-CB 4.4Å; F21-V64 HydrophobicContact CE1-CG1 4.47Å; F21-V64 HydrophobicContact CZ-CG1 4.18Å; I43-V64 HydrophobicContact CD1-CG1 3.71Å; I43-V64 HydrophobicContact CD1-CG2 4.45Å; I43-V64 HydrophobicContact CG1-CG1 3.87Å; I43-V64 HydrophobicContact CG2-CG1 3.88Å; P45-V64 HydrophobicContact CB-CG1 4.09Å; P45-V64 HydrophobicContact CG-CG1 4.4Å; V64-A71 HydrophobicContact CG1-CB 4.27Å
65	D	96.6	Very high	96.5	Very high	60 Å²	60	55.9 Å²	55.9	32%	0.321	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	103.8	168.5	177	12.4	0	0	0	108	P67 S68 S69 T70 Y72	D65-P67 VanDerWaalsContact OD1-CD 3.23Å; D65-P67 WeakPolarHBondContact OD1-CD 3.37Å; D65-S68 WeakPolarHBondContact CB-OG 3Å; D65-S68 PolarHBondContact O-OG 3.15Å; D65-S68 VanDerWaalsContact OD2-CB 3.22Å; D65-S68 WeakPolarHBondContact OD2-CB 3.15Å; D65-S68 PolarHBondContact OD2-OG 2.78Å; D65-S69 PolarHBondContact O-N 2.86Å; D65-S69 VanDerWaalsContact O-N 3.11Å; D65-T70 PolarHBondContact N-O 3.06Å; D65-T70 PolarHBondContact O-N 2.87Å; D65-Y72 HydrophobicContact CB-CE2 3.77Å
66	K	94.6	Very high	96.6	Very high	104 Å²	104	50.5 Å²	50.5	45%	0.452	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-49.9	-174.9	-68.1	173.2	174.9	178.3	0	112	P45 N46 S68 S69	P45-K66 WeakPolarHBondContact O-CE 3.35Å; N46-K66 WeakPolarHBondContact O-CE 3.42Å; N46-K66 PolarHBondContact O-NZ 2.89Å; K66-S68 VanDerWaalsContact C-N 3.27Å; K66-S68 PolarHBondContact O-N 3.15Å; K66-S69 PolarHBondContact O-N 2.88Å
67	P	93.8	Very high	96.6	Very high	127 Å²	127	53.7 Å²	53.7	83%	0.825	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-41.5	176	-30.1	32.2	0	0	0	114.6	D65 S69	D65-P67 VanDerWaalsContact OD1-CD 3.23Å; D65-P67 WeakPolarHBondContact OD1-CD 3.37Å; P67-S69 VanDerWaalsContact C-N 3.35Å
68	S	95.5	Very high	96.7	Very high	37 Å²	37	46.2 Å²	46.2	26%	0.259	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-0.6	179.4	72.2	0	0	0	0	114.1	D65 K66 T70	D65-S68 WeakPolarHBondContact CB-OG 3Å; D65-S68 PolarHBondContact O-OG 3.15Å; D65-S68 VanDerWaalsContact OD2-CB 3.22Å; D65-S68 WeakPolarHBondContact OD2-CB 3.15Å; D65-S68 PolarHBondContact OD2-OG 2.78Å; K66-S68 VanDerWaalsContact C-N 3.27Å; K66-S68 PolarHBondContact O-N 3.15Å; S68-T70 PolarHBondContact O-N 3.03Å; S68-T70 PolarHBondContact O-OG1 2.91Å; S68-T70 WeakPolarHBondContact OG-CB 3.48Å; S68-T70 PolarHBondContact OG-OG1 3.03Å
69	S	96.1	Very high	96.7	Very high	42 Å²	42	43.8 Å²	43.8	29%	0.294	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	41.7	-173.8	-63.6	0	0	0	0	113.1	A16 F21 D65 K66 P67	A16-S69 PolarHBondContact N-O 3.05Å; F21-S69 VanDerWaalsContact CD1-CA 3.47Å; D65-S69 PolarHBondContact O-N 2.86Å; D65-S69 VanDerWaalsContact O-N 3.11Å; K66-S69 PolarHBondContact O-N 2.88Å; P67-S69 VanDerWaalsContact C-N 3.35Å
70	T	97.3	Very high	96.6	Very high	8 Å²	8	45.8 Å²	45.8	5%	0.049	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	128.4	-173.6	-55.5	0	0	0	0	111.2	C14 K15 D65 S68 Y72	C14-T70 WeakPolarHBondContact O-CA 3.16Å; K15-T70 HydrophobicContact CB-CG2 4.49Å; D65-T70 PolarHBondContact N-O 3.06Å; D65-T70 PolarHBondContact O-N 2.87Å; S68-T70 PolarHBondContact O-N 3.03Å; S68-T70 PolarHBondContact O-OG1 2.91Å; S68-T70 WeakPolarHBondContact OG-CB 3.48Å; S68-T70 PolarHBondContact OG-OG1 3.03Å; T70-Y72 HydrophobicContact CG2-CD1 4.27Å; T70-Y72 HydrophobicContact CG2-CD2 4.29Å; T70-Y72 HydrophobicContact CG2-CE1 3.7Å; T70-Y72 HydrophobicContact CG2-CE2 3.7Å
71	A	97.5	Very high	96.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	147	166.6	0	0	0	0	0	109.8	S13 C14 F21 M26 W28 I43 V64	S13-A71 CarbonylContact C-O 3.59Å; S13-A71 WeakPolarHBondContact CA-O 3.45Å; C14-A71 PolarHBondContact N-O 2.91Å; C14-A71 PolarHBondContact O-N 3.42Å; F21-A71 HydrophobicContact CE2-CB 4.31Å; F21-A71 HydrophobicContact CZ-CB 3.96Å; M26-A71 HydrophobicContact CB-CB 4.11Å; M26-A71 HydrophobicContact CG-CB 3.68Å; W28-A71 HydrophobicContact CZ2-CB 4.37Å; I43-A71 HydrophobicContact CG2-CB 4.49Å; V64-A71 HydrophobicContact CG1-CB 4.27Å
72	Y	98.1	Very high	96.2	Very high	53 Å²	53	48.5 Å²	48.5	21%	0.208	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	147.3	175.2	-55.3	-91.3	0	0	0	111.3	K11 L12 S13 L62 T63 D65 T70	K11-Y72 HydrophobicContact CD-CD1 4.4Å; K11-Y72 VanDerWaalsContact CE-CD1 3.46Å; K11-Y72 HydrophobicContact CG-CD1 4.35Å; L12-Y72 CarbonylContact O-C 3.59Å; L12-Y72 WeakPolarHBondContact O-CA 3.43Å; L12-Y72 WeakPolarHBondContact O-CB 3.47Å; S13-Y72 VanDerWaalsContact CB-CD1 3.47Å; S13-Y72 VanDerWaalsContact CB-CE1 3.43Å; L62-Y72 WeakPolarHBondContact CA-O 3.35Å; T63-Y72 PolarHBondContact N-O 3.15Å; T63-Y72 PolarHBondContact O-N 3.23Å; D65-Y72 HydrophobicContact CB-CE2 3.77Å; T70-Y72 HydrophobicContact CG2-CD1 4.27Å; T70-Y72 HydrophobicContact CG2-CD2 4.29Å; T70-Y72 HydrophobicContact CG2-CE1 3.7Å; T70-Y72 HydrophobicContact CG2-CE2 3.7Å
73	M	98.2	Very high	96.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	120.7	167.6	176	176.9	71.2	0	0	108.7	K11 L12 W28 I40 A60 T61 L62 L75 Y86	K11-M73 WeakPolarHBondContact CA-O 3.29Å; L12-M73 HydrophobicContact CD1-CE 3.62Å; L12-M73 PolarHBondContact N-O 2.99Å; L12-M73 PolarHBondContact O-N 3.03Å; W28-M73 HydrophobicContact CB-SD 3.81Å; W28-M73 HydrophobicContact CD2-CB 3.63Å; W28-M73 HydrophobicContact CD2-CE 4.23Å; W28-M73 HydrophobicContact CD2-CG 4.41Å; W28-M73 HydrophobicContact CD2-SD 4.01Å; W28-M73 HydrophobicContact CE3-CB 3.89Å; W28-M73 HydrophobicContact CE3-CE 3.67Å; W28-M73 HydrophobicContact CE3-SD 4.07Å; W28-M73 HydrophobicContact CG-CB 4.14Å; W28-M73 HydrophobicContact CG-SD 3.92Å; W28-M73 HydrophobicContact CH2-CB 4.07Å; W28-M73 HydrophobicContact CZ2-CB 3.84Å; W28-M73 HydrophobicContact CZ3-CB 4.1Å; W28-M73 HydrophobicContact CZ3-CE 4.2Å; I40-M73 HydrophobicContact CB-SD 4.48Å; I40-M73 HydrophobicContact CD1-CE 3.82Å; I40-M73 HydrophobicContact CD1-SD 3.6Å; I40-M73 HydrophobicContact CG2-SD 3.84Å; A60-M73 HydrophobicContact CB-CG 4.4Å; A60-M73 HydrophobicContact CB-SD 4.44Å; T61-M73 WeakPolarHBondContact O-CA 3.48Å; L62-M73 HydrophobicContact CD2-CB 3.65Å; L62-M73 HydrophobicContact CD2-CG 3.61Å; L62-M73 HydrophobicContact CD2-SD 4.16Å; M73-L75 HydrophobicContact CE-CD1 3.95Å; M73-L75 HydrophobicContact CE-CD2 4.32Å; M73-L75 HydrophobicContact CE-CG 4.07Å; M73-L75 HydrophobicContact CG-CD2 4.43Å; M73-L75 HydrophobicContact CG-CG 4.36Å; M73-L75 HydrophobicContact SD-CD2 4.16Å; M73-L75 HydrophobicContact SD-CG 4.41Å; M73-Y86 HydrophobicContact CE-CD1 3.62Å; M73-Y86 HydrophobicContact CE-CE1 4.18Å; M73-Y86 HydrophobicContact CE-CG 4.26Å
74	Q	98.1	Very high	96	Very high	88 Å²	88	47.2 Å²	47.2	41%	0.411	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	123.7	169.4	-175.4	173.6	-0.5	0	0	109.2	V10 A60 T61	V10-Q74 CarbonylContact O-C 3.53Å; V10-Q74 VanDerWaalsContact O-CA 3.28Å; V10-Q74 WeakPolarHBondContact O-CA 3Å; A60-Q74 CarbonylContact C-O 3.54Å; A60-Q74 WeakPolarHBondContact CA-O 3.11Å; T61-Q74 PolarHBondContact N-O 2.87Å; T61-Q74 PolarHBondContact O-N 2.8Å
75	L	97.2	Very high	96	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	132.1	170.5	-64.3	166.2	0	0	0	108.8	S9 V10 K59 A60 M73 L78 Y86	S9-L75 CarbonylContact C-O 3.35Å; S9-L75 WeakPolarHBondContact CA-O 3.43Å; S9-L75 VanDerWaalsContact CB-O 3.3Å; S9-L75 WeakPolarHBondContact CB-O 3.47Å; V10-L75 HydrophobicContact CG1-CB 4.22Å; V10-L75 HydrophobicContact CG1-CD1 4.34Å; V10-L75 PolarHBondContact N-O 3.18Å; V10-L75 PolarHBondContact O-N 2.95Å; K59-L75 WeakPolarHBondContact O-CA 2.99Å; A60-L75 HydrophobicContact CB-CD2 3.93Å; M73-L75 HydrophobicContact CE-CD1 3.95Å; M73-L75 HydrophobicContact CE-CD2 4.32Å; M73-L75 HydrophobicContact CE-CG 4.07Å; M73-L75 HydrophobicContact CG-CD2 4.43Å; M73-L75 HydrophobicContact CG-CG 4.36Å; M73-L75 HydrophobicContact SD-CD2 4.16Å; M73-L75 HydrophobicContact SD-CG 4.41Å; L75-L78 HydrophobicContact CB-CD2 3.73Å; L75-L78 HydrophobicContact CB-CG 4.48Å; L75-L78 HydrophobicContact CD1-CD2 4.25Å; L75-Y86 HydrophobicContact CD1-CD1 4.14Å; L75-Y86 HydrophobicContact CD1-CE1 3.49Å; L75-Y86 VanDerWaalsContact CD1-CE1 3.49Å; L75-Y86 HydrophobicContact CD1-CE2 4.19Å
76	S	96.6	Very high	96.1	Very high	36 Å²	36	44.4 Å²	44.4	25%	0.252	26%	0.258	S	S	.	.			trans	-109.1	160	178.3	58.6	0	0	0	0	112.2	S9 K59 L78	S9-S76 WeakPolarHBondContact OG-CA 3.17Å; K59-S76 WeakPolarHBondContact CE-O 3.3Å; K59-S76 WeakPolarHBondContact CG-O 3.42Å; K59-S76 PolarHBondContact O-N 3.3Å; K59-S76 PolarHBondContact O-OG 2.98Å; S76-L78 VanDerWaalsContact C-N 3.34Å; S76-L78 PolarHBondContact O-N 3.29Å
77	S	95.5	Very high	96.2	Very high	79 Å²	79	41.6 Å²	41.6	55%	0.552	25%	0.245	S	C	*	.	S	Bend	trans	50.2	52.4	173.1	-56.2	0	0	0	0	112.7	A8	A8-S77 PolarHBondContact O-N 2.85Å
78	L	95.6	Very high	96.3	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	21%	0.209	C	C	.	.			trans	-65.1	139.1	-174	-70.2	173.2	0	0	0	112	V4 P6 G7 A8 V10 L75 S76 D82 V108	V4-L78 HydrophobicContact CB-CD1 4.45Å; V4-L78 HydrophobicContact CG2-CD1 3.65Å; P6-L78 CarbonylContact C-O 3.58Å; P6-L78 WeakPolarHBondContact CA-O 3.39Å; G7-L78 PolarHBondContact N-O 2.03Å; A8-L78 WeakPolarHBondContact O-CB 3.34Å; A8-L78 WeakPolarHBondContact O-CG 3.43Å; A8-L78 PolarHBondContact O-N 2.81Å; V10-L78 HydrophobicContact CB-CD1 3.88Å; V10-L78 HydrophobicContact CG1-CD1 3.75Å; L75-L78 HydrophobicContact CB-CD2 3.73Å; L75-L78 HydrophobicContact CB-CG 4.48Å; L75-L78 HydrophobicContact CD1-CD2 4.25Å; S76-L78 VanDerWaalsContact C-N 3.34Å; S76-L78 PolarHBondContact O-N 3.29Å; L78-D82 WeakPolarHBondContact CA-OD2 3.41Å; L78-D82 HydrophobicContact CD2-CB 3.64Å; L78-V108 HydrophobicContact CB-CG1 4.48Å; L78-V108 HydrophobicContact CB-CG2 3.97Å
79	T	95.1	Very high	96.3	Very high	60 Å²	60	34.4 Å²	34.4	37%	0.368	20%	0.198	S	C	.	.			trans	-121.8	167.3	176	66.9	0	0	0	0	109.9	E81 D82 V108	T79-E81 PolarHBondContact O-N 2.88Å; T79-D82 PolarHBondContact N-OD2 2.93Å; T79-D82 WeakPolarHBondContact O-CB 3.28Å; T79-D82 PolarHBondContact O-N 2.79Å; T79-D82 PolarHBondContact OG1-OD2 2.86Å; T79-V108 WeakPolarHBondContact O-CB 3.22Å; T79-V108 VanDerWaalsContact O-CG2 3.24Å; T79-V108 WeakPolarHBondContact O-CG2 3.23Å
80	S	93.4	Very high	96.1	Very high	81 Å²	81	34.1 Å²	34.1	57%	0.566	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-51.7	-32.8	176.8	54.7	0	0	0	0	112.8	D82 S83	S80-D82 PolarHBondContact O-N 2.92Å; S80-S83 WeakPolarHBondContact O-CB 3.44Å; S80-S83 PolarHBondContact O-N 2.85Å; S80-S83 VanDerWaalsContact O-N 3.11Å; S80-S83 PolarHBondContact O-OG 2.96Å
81	E	92.1	Very high	95.6	Very high	129 Å²	129	37 Å²	37	60%	0.603	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-66.4	-14.3	176.4	-63.3	-166.6	-179.3	0	0	115	K30 R32 T79 S83	K30-E81 PolarHBondContact NZ-O 2.87Å; R32-E81 PolarHBondContact NE-O 3.45Å; R32-E81 PolarHBondContact NH2-O 2.95Å; R32-E81 IonicContact NH2-OE2 3.72Å; T79-E81 PolarHBondContact O-N 2.88Å; E81-S83 VanDerWaalsContact C-N 3.33Å
82	D	94.8	Very high	94.6	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.021	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-84	-8.2	173.8	-59	-49.9	0	0	0	113.8	K30 K59 L78 T79 S80 A84 Y86 V108	K30-D82 IonicContact NZ-OD1 2.91Å; K30-D82 PolarHBondContact NZ-OD1 2.92Å; K59-D82 WeakPolarHBondContact CE-OD1 3.5Å; K59-D82 WeakPolarHBondContact CE-OD2 3.46Å; K59-D82 IonicContact NZ-OD1 2.89Å; K59-D82 PolarHBondContact NZ-OD1 2.88Å; K59-D82 IonicContact NZ-OD2 2.54Å; K59-D82 PolarHBondContact NZ-OD2 2.88Å; L78-D82 WeakPolarHBondContact CA-OD2 3.41Å; L78-D82 HydrophobicContact CD2-CB 3.64Å; T79-D82 PolarHBondContact N-OD2 2.93Å; T79-D82 WeakPolarHBondContact O-CB 3.28Å; T79-D82 PolarHBondContact O-N 2.79Å; T79-D82 PolarHBondContact OG1-OD2 2.86Å; S80-D82 PolarHBondContact O-N 2.92Å; D82-A84 PolarHBondContact O-N 2.86Å; D82-Y86 WeakPolarHBondContact O-CE2 3.17Å; D82-Y86 PolarHBondContact O-OH 2.81Å; D82-V108 HydrophobicContact CB-CG2 4.21Å
83	S	96.1	Very high	93.3	Very high	36 Å²	36	44.8 Å²	44.8	25%	0.252	23%	0.234	S	C	.	.			trans	-61.7	112.8	173.7	-56.2	0	0	0	0	110.2	S80 E81 V106 V108	S80-S83 WeakPolarHBondContact O-CB 3.44Å; S80-S83 PolarHBondContact O-N 2.85Å; S80-S83 VanDerWaalsContact O-N 3.11Å; S80-S83 PolarHBondContact O-OG 2.96Å; E81-S83 VanDerWaalsContact C-N 3.33Å; S83-V106 CarbonylContact C-O 3.32Å; S83-V106 VanDerWaalsContact CA-O 3.27Å; S83-V106 WeakPolarHBondContact CA-O 3.33Å; S83-V108 PolarHBondContact OG-N 3.43Å
84	A	97	Very high	91.9	Very high	6 Å²	6	51.6 Å²	51.6	5%	0.05	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.6	169.4	-170.3	0	0	0	0	0	111.1	K30 Q31 R32 D82 Y86 V106	K30-A84 HydrophobicContact CD-CB 4.18Å; K30-A84 HydrophobicContact CG-CB 3.53Å; Q31-A84 WeakPolarHBondContact O-CA 3.46Å; Q31-A84 VanDerWaalsContact O-CB 3.29Å; Q31-A84 WeakPolarHBondContact O-CB 3.31Å; R32-A84 HydrophobicContact CG-CB 4.13Å; D82-A84 PolarHBondContact O-N 2.86Å; A84-Y86 HydrophobicContact CB-CD2 4.38Å; A84-Y86 HydrophobicContact CB-CE2 3.86Å; A84-V106 PolarHBondContact N-O 3.01Å; A84-V106 PolarHBondContact O-N 3.11Å
85	V	97.7	Very high	90.1	Very high	39 Å²	39	53.4 Å²	53.4	24%	0.236	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	130.5	162.9	-170.7	0	0	0	0	108.7	Q31 Y87	Q31-V85 PolarHBondContact N-O 2.83Å; Q31-V85 PolarHBondContact O-N 3.14Å; V85-Y87 HydrophobicContact CB-CE2 3.81Å; V85-Y87 HydrophobicContact CG1-CD1 4.48Å; V85-Y87 HydrophobicContact CG1-CD2 4.29Å; V85-Y87 HydrophobicContact CG1-CE1 3.81Å; V85-Y87 HydrophobicContact CG1-CE2 3.6Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.4Å
86	Y	97.9	Very high	88.9	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.008	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.2	180	-70.6	-90.1	0	0	0	110.1	L12 V29 K30 I40 M73 L75 D82 A84 G103 T104 V106	L12-Y86 VanDerWaalsContact CD1-CB 3.45Å; L12-Y86 HydrophobicContact CD1-CD1 4.32Å; L12-Y86 HydrophobicContact CD1-CD2 4.14Å; L12-Y86 HydrophobicContact CD1-CG 3.72Å; V29-Y86 CarbonylContact O-C 3.59Å; V29-Y86 WeakPolarHBondContact O-CA 3.24Å; K30-Y86 HydrophobicContact CB-CD1 4.12Å; K30-Y86 HydrophobicContact CB-CE1 3.89Å; K30-Y86 HydrophobicContact CD-CE1 4.01Å; K30-Y86 HydrophobicContact CG-CD1 4.28Å; K30-Y86 HydrophobicContact CG-CE1 3.76Å; I40-Y86 HydrophobicContact CD1-CD1 3.68Å; I40-Y86 HydrophobicContact CD1-CE1 3.76Å; M73-Y86 HydrophobicContact CE-CD1 3.62Å; M73-Y86 HydrophobicContact CE-CE1 4.18Å; M73-Y86 HydrophobicContact CE-CG 4.26Å; L75-Y86 HydrophobicContact CD1-CD1 4.14Å; L75-Y86 HydrophobicContact CD1-CE1 3.49Å; L75-Y86 VanDerWaalsContact CD1-CE1 3.49Å; L75-Y86 HydrophobicContact CD1-CE2 4.19Å; D82-Y86 WeakPolarHBondContact O-CE2 3.17Å; D82-Y86 PolarHBondContact O-OH 2.81Å; A84-Y86 HydrophobicContact CB-CD2 4.38Å; A84-Y86 HydrophobicContact CB-CE2 3.86Å; Y86-G103 CarbonylContact O-C 3.38Å; Y86-G103 VanDerWaalsContact O-CA 3.26Å; Y86-G103 WeakPolarHBondContact O-CA 3.48Å; Y86-T104 PolarHBondContact N-O 3.3Å; Y86-T104 PolarHBondContact O-N 3.17Å; Y86-V106 HydrophobicContact CD2-CB 3.96Å; Y86-V106 HydrophobicContact CD2-CG2 3.7Å; Y86-V106 HydrophobicContact CE2-CB 3.82Å; Y86-V106 HydrophobicContact CE2-CG2 4Å
87	Y	97.3	Very high	88	Confident	45 Å²	45	58.1 Å²	58.1	18%	0.176	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	149	-178.7	-57	-87.8	0	0	0	110.6	W28 V29 Q31 V85 W100 G101	W28-Y87 WeakPolarHBondContact CA-O 3.35Å; V29-Y87 PolarHBondContact N-O 3.46Å; V29-Y87 PolarHBondContact O-N 3.22Å; Q31-Y87 HydrophobicContact CB-CD2 4.3Å; Q31-Y87 HydrophobicContact CB-CE2 3.68Å; Q31-Y87 VanDerWaalsContact OE1-CE2 3.28Å; Q31-Y87 PolarHBondContact OE1-OH 2.89Å; V85-Y87 HydrophobicContact CB-CE2 3.81Å; V85-Y87 HydrophobicContact CG1-CD1 4.48Å; V85-Y87 HydrophobicContact CG1-CD2 4.29Å; V85-Y87 HydrophobicContact CG1-CE1 3.81Å; V85-Y87 HydrophobicContact CG1-CE2 3.6Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.4Å; Y87-W100 HydrophobicContact CG-CE3 4.08Å; Y87-W100 HydrophobicContact CG-CZ3 4.32Å; Y87-G101 WeakPolarHBondContact CD1-O 3.44Å
88	C	96	Very high	87.2	Confident	13 Å²	13	58.2 Å²	58.2	9%	0.088	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	146.2	159.9	62.3	0	0	0	0	109.6	C14 M26 H27 W28 W100 G101	C14-C88 HydrophobicContact CB-CB 3.45Å; C14-C88 VanDerWaalsContact CB-CB 3.45Å; C14-C88 WeakPolarHBondContact CB-SG 3.41Å; C14-C88 WeakPolarHBondContact SG-CB 3.37Å; C14-C88 CovalentContact SG-SG 2.03Å; C14-C88 PolarHBondContact SG-SG 2.88Å; M26-C88 HydrophobicContact CG-CB 4.41Å; M26-C88 HydrophobicContact SD-CB 3.7Å; H27-C88 CarbonylContact O-C 3.55Å; H27-C88 WeakPolarHBondContact O-CA 3.33Å; W28-C88 HydrophobicContact CD2-CB 4.43Å; W28-C88 HydrophobicContact CE3-CB 4.27Å; W28-C88 HydrophobicContact CH2-CB 4.4Å; W28-C88 HydrophobicContact CZ3-CB 4.26Å; C88-W100 WeakPolarHBondContact O-CA 3.39Å; C88-G101 PolarHBondContact O-N 3.08Å
89	A	94.5	Very high	86.8	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.008	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	140.7	176.7	0	0	0	0	0	110.6	H27 M97 Y99 W100	H27-A89 HydrophobicContact CB-CB 4.48Å; H27-A89 PolarHBondContact N-O 2.96Å; H27-A89 PolarHBondContact O-N 3.36Å; A89-M97 HydrophobicContact CB-CB 4.22Å; A89-M97 HydrophobicContact CB-CG 4.25Å; A89-M97 HydrophobicContact CB-SD 4.17Å; A89-Y99 VanDerWaalsContact CA-O 3.27Å; A89-Y99 WeakPolarHBondContact CA-O 3.41Å; A89-W100 HydrophobicContact CB-CD2 3.8Å; A89-W100 HydrophobicContact CB-CE3 4.12Å; A89-W100 HydrophobicContact CB-CG 4.19Å; A89-W100 HydrophobicContact CB-CH2 4.43Å; A89-W100 HydrophobicContact CB-CZ2 4.15Å; A89-W100 HydrophobicContact CB-CZ3 4.42Å
90	R	91.2	Very high	86.6	Confident	36 Å²	36	65.4 Å²	65.4	14%	0.136	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	146.2	177.3	-173.6	-175	70	174.8	1.9	110.2	Y19 Y24 M97 D98 Y99	Y19-R90 VanDerWaalsContact CD1-NH1 3.34Å; Y19-R90 HydrophobicContact CE2-CG 4.17Å; Y19-R90 VanDerWaalsContact CZ-CD 3.49Å; Y24-R90 VanDerWaalsContact CB-CG 3.43Å; Y24-R90 HydrophobicContact CD1-CG 3.58Å; Y24-R90 HydrophobicContact CD2-CG 4.39Å; Y24-R90 HydrophobicContact CE1-CG 4.45Å; Y24-R90 HydrophobicContact CG-CG 3.55Å; R90-M97 WeakPolarHBondContact O-CA 2.88Å; R90-D98 IonicContact CZ-OD1 3.93Å; R90-D98 IonicContact CZ-OD2 3.86Å; R90-D98 IonicContact NE-OD1 3.49Å; R90-D98 PolarHBondContact NE-OD1 2.66Å; R90-D98 IonicContact NH2-OD1 3.47Å; R90-D98 PolarHBondContact NH2-OD1 3.17Å; R90-D98 IonicContact NH2-OD2 2.8Å; R90-D98 PolarHBondContact NH2-OD2 3.49Å; R90-Y99 PolarHBondContact N-O 2.77Å
91	Y	87.4	Confident	86.6	Confident	67 Å²	67	62.4 Å²	62.4	26%	0.263	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	142.2	173.6	178.4	-87.5	0	0	0	112.6	W25 H27 M97	W25-Y91 HydrophobicContact CD2-CD1 4.44Å; W25-Y91 AromaticContact CE3-CD1 3.62Å; W25-Y91 HydrophobicContact CE3-CD1 3.62Å; W25-Y91 AromaticContact CE3-CE1 3.97Å; W25-Y91 HydrophobicContact CE3-CE1 3.97Å; W25-Y91 HydrophobicContact CZ3-CD1 4.11Å; W25-Y91 AromaticContact CZ3-CE1 3.96Å; W25-Y91 HydrophobicContact CZ3-CE1 3.96Å; W25-Y91 PolarHBondContact N-O 2.87Å; W25-Y91 PolarHBondContact O-N 3.14Å; H27-Y91 WeakPolarHBondContact NE2-CB 3.35Å; H27-Y91 AromaticContact NE2-CG 3.87Å; Y91-M97 HydrophobicContact CD2-CG 4.39Å
92	D	77.6	Confident	86.7	Confident	38 Å²	38	65.2 Å²	65.2	20%	0.203	32%	0.315	C	S	.	.			trans	-138.1	161.6	166.7	169.3	32	0	0	0	109.8	Y24 L94 Y95	Y24-D92 HydrophobicContact CD1-CB 3.49Å; Y24-D92 VanDerWaalsContact CD1-CB 3.49Å; Y24-D92 HydrophobicContact CE1-CB 3.64Å; D92-L94 PolarHBondContact O-N 2.81Å; D92-L94 VanDerWaalsContact O-N 3.15Å; D92-Y95 CarbonylContact C-O 3.52Å; D92-Y95 PolarHBondContact N-O 3.26Å; D92-Y95 CarbonylContact O-C 3.49Å; D92-Y95 PolarHBondContact O-N 2.86Å; D92-Y95 VanDerWaalsContact O-N 3.15Å
93	Y	69.9	Low	86.7	Confident	180 Å²	180	66.3 Å²	66.3	71%	0.706	33%	0.327	S	S	*	.	S	Bend	trans	-54.3	-28.6	175.5	-66.6	-81.3	0	0	0	113.9	W25	W25-Y93 HydrophobicContact CH2-CE1 4.33Å; W25-Y93 HydrophobicContact CH2-CE2 4.31Å; W25-Y93 AromaticContact CH2-CZ 3.78Å; W25-Y93 WeakPolarHBondContact CH2-OH 3.42Å; W25-Y93 HydrophobicContact CZ2-CE2 4.24Å
94	L	68.1	Low	86.8	Confident	142 Å²	142	66.7 Å²	66.7	74%	0.743	33%	0.328	S	S	*	.	S	Bend	trans	-91.8	-22.9	178.5	-65.7	173.4	0	0	0	113.8	D92	D92-L94 PolarHBondContact O-N 2.81Å; D92-L94 VanDerWaalsContact O-N 3.15Å
95	Y	61.7	Low	86.8	Confident	127 Å²	127	68.6 Å²	68.6	50%	0.498	34%	0.341	S	S	.	.	S	Bend	trans	-130.2	114.3	-175.1	-57.3	-81.1	0	0	0	108.6	D92	D92-Y95 CarbonylContact C-O 3.52Å; D92-Y95 PolarHBondContact N-O 3.26Å; D92-Y95 CarbonylContact O-C 3.49Å; D92-Y95 PolarHBondContact O-N 2.86Å; D92-Y95 VanDerWaalsContact O-N 3.15Å
96	A	71.8	Confident	86.7	Confident	71 Å²	71	66.7 Å²	66.7	59%	0.587	33%	0.33	S	S	*	.			trans	-54.8	-175.7	171	0	0	0	0	0	111.3	D98	A96-D98 WeakPolarHBondContact O-CB 3.3Å; A96-D98 PolarHBondContact O-N 2.81Å
97	M	78	Confident	86.6	Confident	64 Å²	64	69.7 Å²	69.7	32%	0.315	35%	0.348	S	S	.	.	S	Bend	trans	-62.7	73	174.7	-66.2	-175.4	-171.8	0	0	112.1	H27 A89 R90 Y91 W100	H27-M97 HydrophobicContact CB-CE 3.79Å; H27-M97 HydrophobicContact CB-SD 4.48Å; H27-M97 VanDerWaalsContact CG-CE 3.48Å; H27-M97 WeakPolarHBondContact ND1-CE 3.32Å; A89-M97 HydrophobicContact CB-CB 4.22Å; A89-M97 HydrophobicContact CB-CG 4.25Å; A89-M97 HydrophobicContact CB-SD 4.17Å; R90-M97 WeakPolarHBondContact O-CA 2.88Å; Y91-M97 HydrophobicContact CD2-CG 4.39Å; M97-W100 HydrophobicContact CB-CZ2 4.08Å; M97-W100 PolarHBondContact O-NE1 3.47Å; M97-W100 HydrophobicContact SD-CH2 4.32Å; M97-W100 HydrophobicContact SD-CZ2 3.89Å
98	D	77.9	Confident	86.5	Confident	80 Å²	80	67.9 Å²	67.9	43%	0.428	34%	0.342	S	S	.	.			trans	-87.3	-30.5	-165.9	62.5	-21.5	0	0	0	111	R90 A96	R90-D98 IonicContact CZ-OD1 3.93Å; R90-D98 IonicContact CZ-OD2 3.86Å; R90-D98 IonicContact NE-OD1 3.49Å; R90-D98 PolarHBondContact NE-OD1 2.66Å; R90-D98 IonicContact NH2-OD1 3.47Å; R90-D98 PolarHBondContact NH2-OD1 3.17Å; R90-D98 IonicContact NH2-OD2 2.8Å; R90-D98 PolarHBondContact NH2-OD2 3.49Å; A96-D98 WeakPolarHBondContact O-CB 3.3Å; A96-D98 PolarHBondContact O-N 2.81Å
99	Y	86.4	Confident	86.3	Confident	130 Å²	130	69.4 Å²	69.4	51%	0.51	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	125.4	178.8	-169.9	-94.7	0	0	0	111.8	A89 R90	A89-Y99 VanDerWaalsContact CA-O 3.27Å; A89-Y99 WeakPolarHBondContact CA-O 3.41Å; R90-Y99 PolarHBondContact N-O 2.77Å
100	W	92.7	Very high	85.4	Confident	82 Å²	82	77.5 Å²	77.5	31%	0.311	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	140	178.7	-69	68.6	0	0	0	110.4	V29 L37 Y87 C88 A89 M97	V29-W100 HydrophobicContact CB-CH2 4.13Å; V29-W100 HydrophobicContact CB-CZ3 3.84Å; V29-W100 HydrophobicContact CG1-CH2 4.09Å; V29-W100 HydrophobicContact CG1-CZ3 4.01Å; V29-W100 HydrophobicContact CG2-CH2 3.77Å; V29-W100 HydrophobicContact CG2-CZ3 3.88Å; L37-W100 HydrophobicContact CD1-CH2 3.87Å; L37-W100 HydrophobicContact CD1-CZ3 4.4Å; Y87-W100 HydrophobicContact CG-CE3 4.08Å; Y87-W100 HydrophobicContact CG-CZ3 4.32Å; C88-W100 WeakPolarHBondContact O-CA 3.39Å; A89-W100 HydrophobicContact CB-CD2 3.8Å; A89-W100 HydrophobicContact CB-CE3 4.12Å; A89-W100 HydrophobicContact CB-CG 4.19Å; A89-W100 HydrophobicContact CB-CH2 4.43Å; A89-W100 HydrophobicContact CB-CZ2 4.15Å; A89-W100 HydrophobicContact CB-CZ3 4.42Å; M97-W100 HydrophobicContact CB-CZ2 4.08Å; M97-W100 PolarHBondContact O-NE1 3.47Å; M97-W100 HydrophobicContact SD-CH2 4.32Å; M97-W100 HydrophobicContact SD-CZ2 3.89Å
101	G	92.8	Very high	85.2	Confident	19 Å²	19	79.6 Å²	79.6	20%	0.196	42%	0.422	C	S	.	.			trans	-66.2	161.5	166.5	0	0	0	0	0	111.4	Y87 C88 G103	Y87-G101 WeakPolarHBondContact CD1-O 3.44Å; C88-G101 PolarHBondContact O-N 3.08Å; G101-G103 PolarHBondContact O-N 3.03Å
102	Q	93.9	Very high	85	Confident	187 Å²	187	80.2 Å²	80.2	87%	0.874	43%	0.431	S	S	*	.			trans	-61.4	-17	179.6	-66	-64.2	-39.6	0	0	114
103	G	95.1	Very high	85.4	Confident	27 Å²	27	82.6 Å²	82.6	28%	0.278	44%	0.443	S	S	.	.			trans	85.8	146.6	-178	0	0	0	0	0	112.8	Y86 G101	Y86-G103 CarbonylContact O-C 3.38Å; Y86-G103 VanDerWaalsContact O-CA 3.26Å; Y86-G103 WeakPolarHBondContact O-CA 3.48Å; G101-G103 PolarHBondContact O-N 3.03Å
104	T	97	Very high	86.4	Confident	44 Å²	44	76.8 Å²	76.8	27%	0.27	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	116.7	175	-58.3	0	0	0	0	109	L12 Y86 V106	L12-T104 HydrophobicContact CD2-CG2 3.61Å; Y86-T104 PolarHBondContact N-O 3.3Å; Y86-T104 PolarHBondContact O-N 3.17Å; T104-V106 PolarHBondContact O-N 3.24Å
105	S	97	Very high	87.5	Confident	46 Å²	46	72.8 Å²	72.8	32%	0.322	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	123.9	171.2	-173.3	0	0	0	0	109.8	A1 E2	A1-S105 CarbonylContact C-O 3.58Å; A1-S105 WeakPolarHBondContact CA-O 3.2Å; E2-S105 PolarHBondContact N-O 2.97Å
106	V	96.7	Very high	89.2	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.6	169.9	178.3	0	0	0	0	107.5	E2 V4 V10 L12 S83 A84 Y86 T104	E2-V106 HydrophobicContact CB-CG2 4.48Å; E2-V106 CarbonylContact O-C 3.59Å; E2-V106 WeakPolarHBondContact O-CA 3.29Å; V4-V106 HydrophobicContact CG2-CG1 4.14Å; V10-V106 HydrophobicContact CG1-CG1 4.39Å; V10-V106 HydrophobicContact CG1-CG2 4.46Å; L12-V106 HydrophobicContact CD1-CG2 4.24Å; L12-V106 HydrophobicContact CD2-CG2 4.04Å; S83-V106 CarbonylContact C-O 3.32Å; S83-V106 VanDerWaalsContact CA-O 3.27Å; S83-V106 WeakPolarHBondContact CA-O 3.33Å; A84-V106 PolarHBondContact N-O 3.01Å; A84-V106 PolarHBondContact O-N 3.11Å; Y86-V106 HydrophobicContact CD2-CB 3.96Å; Y86-V106 HydrophobicContact CD2-CG2 3.7Å; Y86-V106 HydrophobicContact CE2-CB 3.82Å; Y86-V106 HydrophobicContact CE2-CG2 4Å; T104-V106 PolarHBondContact O-N 3.24Å
107	T	96.6	Very high	90.5	Very high	65 Å²	65	69 Å²	69	40%	0.399	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	123.1	178.3	-56.8	0	0	0	0	108.6	E2 L3 V4	E2-T107 PolarHBondContact O-N 3.29Å; L3-T107 WeakPolarHBondContact CA-O 3.33Å; L3-T107 HydrophobicContact CD1-CG2 3.97Å; V4-T107 PolarHBondContact N-O 2.55Å
108	V	95.1	Very high	91.4	Very high	7 Å²	7	69.4 Å²	69.4	4%	0.042	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	116.8	175.4	-170.5	0	0	0	0	108	V4 P6 L78 T79 D82 S83	V4-V108 HydrophobicContact CG2-CB 4.29Å; V4-V108 HydrophobicContact CG2-CG1 4.43Å; V4-V108 HydrophobicContact CG2-CG2 3.77Å; V4-V108 CarbonylContact O-C 3.48Å; V4-V108 WeakPolarHBondContact O-CA 3.42Å; P6-V108 HydrophobicContact CB-CG1 4.47Å; P6-V108 HydrophobicContact CG-CG1 4.16Å; L78-V108 HydrophobicContact CB-CG1 4.48Å; L78-V108 HydrophobicContact CB-CG2 3.97Å; T79-V108 WeakPolarHBondContact O-CB 3.22Å; T79-V108 VanDerWaalsContact O-CG2 3.24Å; T79-V108 WeakPolarHBondContact O-CG2 3.23Å; D82-V108 HydrophobicContact CB-CG2 4.21Å; S83-V108 PolarHBondContact OG-N 3.43Å
109	S	90.3	Very high	92.6	Very high	45 Å²	45	68.5 Å²	68.5	32%	0.315	39%	0.392	S	S	.	.			trans	-63	141.3	178.7	62.3	0	0	0	0	110.3	V4 P6	V4-S109 PolarHBondContact O-N 3.47Å; V4-S109 PolarHBondContact O-OG 2.77Å; P6-S109 WeakPolarHBondContact CD-O 3.33Å; P6-S109 WeakPolarHBondContact CG-O 2.93Å
110	S	77.1	Confident	93.1	Very high	170 Å²	170	62.9 Å²	62.9	100%	1.189	38%	0.381	S	S	*	.			trans	-71.4	0	171.8	55.9	0	0	0	0	112.3

Retrieved 110 of 110 residues in 23.1 ms (Link to these results)

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