X5J4P3_MOUSE Loading...

IgM heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4P3, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 110 aa.

						>X5J4P3_MOUSE|X5J4P3
AELVRPGSSVKLSCKASGYTFTSYWMHWVKQRPIQGLEWIGNIDPSDSETHYNQKFKDKATLTVDKSSSTAYMQLSSLTSEDSAVYYCAGVVGPYWYFDVWGTGTTVTVS
					

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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	83.5	Confident	95	Very high	105 Å²	105	82.6 Å²	82.6	87%	0.868	47%	0.473	S	S	*	.				0	136.5	0	0	0	0	0	0	107	T106	A1-T106 CarbonylContact C-O 3.59Å; A1-T106 WeakPolarHBondContact CA-O 3.42Å
2	E	91.6	Very high	95.3	Very high	90 Å²	90	76.4 Å²	76.4	42%	0.421	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.2	-173.1	-62.2	-60.5	145.3	0	0	109.5	V4 V10 L12 T105 T106 V107 T108	E2-V4 HydrophobicContact CB-CG1 4.39Å; E2-V10 HydrophobicContact CB-CG2 4.07Å; E2-V10 HydrophobicContact CG-CG2 3.94Å; E2-L12 HydrophobicContact CG-CD2 4.36Å; E2-T105 HydrophobicContact CG-CG2 4.3Å; E2-T106 PolarHBondContact N-O 2.64Å; E2-V107 HydrophobicContact CB-CG2 4.31Å; E2-V107 CarbonylContact O-C 3.5Å; E2-V107 WeakPolarHBondContact O-CA 3.1Å; E2-T108 PolarHBondContact O-N 3.49Å
3	L	95.4	Very high	95.4	Very high	128 Å²	128	76.4 Å²	76.4	67%	0.67	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	119.2	171.3	-177.5	66.3	0	0	0	108.4	T108 S110	L3-T108 WeakPolarHBondContact CA-O 3.5Å; L3-T108 HydrophobicContact CD1-CG2 3.84Å; L3-S110 WeakPolarHBondContact CD1-OG 3.43Å
4	V	96.1	Very high	95.4	Very high	19 Å²	19	71.9 Å²	71.9	12%	0.115	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	154.1	-171.8	-61.7	0	0	0	0	111.2	E2 V10 L78 V107 T108 V109 S110	E2-V4 HydrophobicContact CB-CG1 4.39Å; V4-V10 HydrophobicContact CG1-CB 4.33Å; V4-V10 HydrophobicContact CG1-CG2 4.31Å; V4-L78 HydrophobicContact CB-CD1 4.42Å; V4-L78 HydrophobicContact CG2-CD1 3.54Å; V4-V107 HydrophobicContact CG2-CG1 4.02Å; V4-T108 PolarHBondContact N-O 2.64Å; V4-V109 HydrophobicContact CG2-CB 4.43Å; V4-V109 HydrophobicContact CG2-CG2 3.85Å; V4-V109 WeakPolarHBondContact O-CA 3.34Å; V4-S110 PolarHBondContact O-N 2.98Å; V4-S110 VanDerWaalsContact O-N 3.13Å
5	R	96.3	Very high	95.3	Very high	200 Å²	200	77.4 Å²	77.4	76%	0.755	44%	0.436	S	S	*	.			trans	-84	150.5	180	-64.9	-178.7	-176.7	175.3	0.8	110.9	S8	R5-S8 PolarHBondContact N-OG 2.91Å; R5-S8 WeakPolarHBondContact O-CB 3.28Å; R5-S8 PolarHBondContact O-N 3.06Å; R5-S8 PolarHBondContact O-OG 3.35Å
6	P	97.1	Very high	95	Very high	78 Å²	78	73.3 Å²	73.3	51%	0.506	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	141.3	169.4	-25.2	33.5	0	0	0	112.2	S8 L78 V109	P6-S8 PolarHBondContact O-N 2.76Å; P6-L78 CarbonylContact C-O 3.54Å; P6-L78 WeakPolarHBondContact CA-O 3.4Å; P6-V109 HydrophobicContact CB-CG1 4.38Å; P6-V109 HydrophobicContact CG-CG1 4.1Å
7	G	96	Very high	94.6	Very high	56 Å²	56	74.9 Å²	74.9	58%	0.577	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	-10.6	-177.6	0	0	0	0	0	115.1	L78	G7-L78 PolarHBondContact N-O 3.04Å
8	S	96.8	Very high	93.9	Very high	39 Å²	39	75.8 Å²	75.8	27%	0.273	46%	0.461	S	S	.	.			trans	-80.2	174.6	176.9	72.1	0	0	0	0	112.8	R5 P6 S77 L78	R5-S8 PolarHBondContact N-OG 2.91Å; R5-S8 WeakPolarHBondContact O-CB 3.28Å; R5-S8 PolarHBondContact O-N 3.06Å; R5-S8 PolarHBondContact O-OG 3.35Å; P6-S8 PolarHBondContact O-N 2.76Å; S8-S77 PolarHBondContact O-N 2.95Å; S8-L78 WeakPolarHBondContact O-CB 3.17Å; S8-L78 WeakPolarHBondContact O-CG 3.35Å; S8-L78 PolarHBondContact O-N 2.88Å
9	S	97.1	Very high	93.4	Very high	60 Å²	60	74.5 Å²	74.5	42%	0.42	45%	0.447	S	S	.	.			trans	-115.5	151.7	174	-59.9	0	0	0	0	110.7	L75 S76	S9-L75 CarbonylContact C-O 3.55Å; S9-L75 WeakPolarHBondContact CA-O 3.27Å; S9-L75 WeakPolarHBondContact CB-O 3.37Å; S9-S76 WeakPolarHBondContact OG-CA 3.2Å; S9-S76 PolarHBondContact OG-OG 2.86Å
10	V	97.5	Very high	93.1	Very high	12 Å²	12	75.2 Å²	75.2	7%	0.073	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	143.6	171.7	73.2	0	0	0	0	109.8	E2 V4 L12 Q74 L75 L78 V107	E2-V10 HydrophobicContact CB-CG2 4.07Å; E2-V10 HydrophobicContact CG-CG2 3.94Å; V4-V10 HydrophobicContact CG1-CB 4.33Å; V4-V10 HydrophobicContact CG1-CG2 4.31Å; V10-L12 HydrophobicContact CG1-CD2 4.41Å; V10-L12 HydrophobicContact CG1-CG 4.48Å; V10-L12 HydrophobicContact CG2-CD2 4.06Å; V10-Q74 CarbonylContact O-C 3.52Å; V10-Q74 WeakPolarHBondContact O-CA 3.29Å; V10-L75 HydrophobicContact CG1-CB 4.15Å; V10-L75 HydrophobicContact CG1-CD1 4.28Å; V10-L75 PolarHBondContact N-O 2.77Å; V10-L75 PolarHBondContact O-N 2.82Å; V10-L78 HydrophobicContact CB-CD1 4.04Å; V10-L78 HydrophobicContact CG1-CD1 3.83Å; V10-V107 HydrophobicContact CG1-CG1 4.35Å; V10-V107 HydrophobicContact CG1-CG2 4.42Å
11	K	97.8	Very high	92.9	Very high	122 Å²	122	72 Å²	72	53%	0.53	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	114.9	173.9	-172.4	178.3	-177.5	-178.5	0	109.4	Y72 M73	K11-Y72 HydrophobicContact CD-CD1 4.38Å; K11-Y72 VanDerWaalsContact CE-CD1 3.48Å; K11-Y72 HydrophobicContact CG-CD1 4.39Å; K11-M73 WeakPolarHBondContact CA-O 3.41Å
12	L	97.9	Very high	93.3	Very high	8 Å²	8	69.8 Å²	69.8	4%	0.042	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	146.9	175.4	-54.5	-175.5	0	0	0	109.6	E2 V10 W28 Y72 M73 Y86 T105 V107	E2-L12 HydrophobicContact CG-CD2 4.36Å; V10-L12 HydrophobicContact CG1-CD2 4.41Å; V10-L12 HydrophobicContact CG1-CG 4.48Å; V10-L12 HydrophobicContact CG2-CD2 4.06Å; L12-W28 HydrophobicContact CB-CH2 4.07Å; L12-W28 HydrophobicContact CB-CZ3 3.93Å; L12-Y72 CarbonylContact O-C 3.58Å; L12-Y72 WeakPolarHBondContact O-CA 3.34Å; L12-M73 HydrophobicContact CD1-CE 3.73Å; L12-M73 PolarHBondContact N-O 2.96Å; L12-M73 PolarHBondContact O-N 2.79Å; L12-Y86 VanDerWaalsContact CD1-CB 3.45Å; L12-Y86 HydrophobicContact CD1-CD1 4.48Å; L12-Y86 HydrophobicContact CD1-CD2 4.19Å; L12-Y86 HydrophobicContact CD1-CG 3.8Å; L12-T105 HydrophobicContact CD2-CG2 3.96Å; L12-V107 HydrophobicContact CD1-CG2 4.22Å; L12-V107 HydrophobicContact CD2-CG2 4.03Å
13	S	97.1	Very high	93.1	Very high	76 Å²	76	68.8 Å²	68.8	53%	0.531	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	149.2	177.1	63	0	0	0	0	110.9	A71 Y72	S13-A71 CarbonylContact C-O 3.54Å; S13-A71 WeakPolarHBondContact CA-O 3.32Å; S13-Y72 VanDerWaalsContact CB-CD1 3.49Å; S13-Y72 VanDerWaalsContact CB-CE1 3.44Å
14	C	95.6	Very high	92.7	Very high	13 Å²	13	66 Å²	66	9%	0.088	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	109.5	174.3	-179.4	0	0	0	0	109.1	W28 T70 A71 C88	C14-W28 HydrophobicContact CB-CH2 3.81Å; C14-W28 HydrophobicContact CB-CZ2 3.95Å; C14-T70 CarbonylContact O-C 3.47Å; C14-T70 WeakPolarHBondContact O-CA 3.48Å; C14-A71 PolarHBondContact N-O 3.12Å; C14-A71 PolarHBondContact O-N 3.1Å; C14-C88 HydrophobicContact CB-CB 3.39Å; C14-C88 WeakPolarHBondContact CB-SG 3Å; C14-C88 WeakPolarHBondContact SG-CB 3.47Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 2.87Å
15	K	94.5	Very high	92.5	Very high	155 Å²	155	68 Å²	68	67%	0.674	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	121.1	178.5	-173.5	173.7	-176.4	177.9	0	109.5
16	A	90.4	Very high	92.4	Very high	12 Å²	12	58.5 Å²	58.5	10%	0.099	36%	0.361	C	S	.	.			trans	-73.3	146.4	175	0	0	0	0	0	111	Y19 F21 M26 S69	A16-Y19 HydrophobicContact CB-CE1 4.14Å; A16-Y19 HydrophobicContact CB-CE2 4.01Å; A16-Y19 WeakPolarHBondContact CB-OH 3.42Å; A16-F21 HydrophobicContact CB-CB 4.14Å; A16-F21 HydrophobicContact CB-CD2 3.33Å; A16-F21 HydrophobicContact CB-CE2 4.02Å; A16-F21 HydrophobicContact CB-CG 4.06Å; A16-M26 HydrophobicContact CB-CE 4.41Å; A16-S69 PolarHBondContact N-O 3.23Å
17	S	86.9	Confident	92.3	Very high	100 Å²	100	55.9 Å²	55.9	70%	0.699	34%	0.342	S	S	*	.			trans	-149	148.4	175.3	66.3	0	0	0	0	110.1	Y19	S17-Y19 VanDerWaalsContact C-N 3.34Å; S17-Y19 VanDerWaalsContact O-CD1 3.28Å; S17-Y19 WeakPolarHBondContact O-CD1 3.42Å; S17-Y19 PolarHBondContact O-N 3.3Å
18	G	83.5	Confident	92.3	Very high	92 Å²	92	53.4 Å²	53.4	95%	0.948	32%	0.315	S	S	*	.	S	Bend	trans	82.6	1.5	177.1	0	0	0	0	0	115.9
19	Y	82.7	Confident	92.4	Very high	51 Å²	51	51.7 Å²	51.7	20%	0.2	30%	0.303	C	S	.	.	S	Bend	trans	-152.9	166.2	175.6	62.5	-90.6	0	0	0	111.6	A16 S17 F21 Y24 M26	A16-Y19 HydrophobicContact CB-CE1 4.14Å; A16-Y19 HydrophobicContact CB-CE2 4.01Å; A16-Y19 WeakPolarHBondContact CB-OH 3.42Å; S17-Y19 VanDerWaalsContact C-N 3.34Å; S17-Y19 VanDerWaalsContact O-CD1 3.28Å; S17-Y19 WeakPolarHBondContact O-CD1 3.42Å; S17-Y19 PolarHBondContact O-N 3.3Å; Y19-F21 PolarHBondContact O-N 3.27Å; Y19-F21 VanDerWaalsContact O-N 3.17Å; Y19-Y24 AromaticContact CD2-CD2 3.6Å; Y19-Y24 HydrophobicContact CD2-CD2 3.6Å; Y19-Y24 HydrophobicContact CD2-CE2 4.17Å; Y19-Y24 HydrophobicContact CE2-CD2 4.07Å; Y19-Y24 HydrophobicContact CG-CD2 4.31Å; Y19-M26 WeakPolarHBondContact OH-CE 3.33Å
20	T	88.4	Confident	92.3	Very high	88 Å²	88	48.8 Å²	48.8	54%	0.54	28%	0.283	S	S	.	.			trans	-69.8	107.4	173.4	-57.6	0	0	0	0	109.7	T22 S23	T20-T22 PolarHBondContact O-N 3.15Å; T20-T22 VanDerWaalsContact O-N 3.1Å; T20-S23 WeakPolarHBondContact CB-OG 3.37Å; T20-S23 WeakPolarHBondContact CG2-OG 3.22Å; T20-S23 WeakPolarHBondContact O-CB 3.37Å; T20-S23 PolarHBondContact O-N 2.96Å
21	F	89.2	Confident	92.3	Very high	8 Å²	8	51.7 Å²	51.7	4%	0.035	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-53	-36.7	-173.4	177.6	-125.8	0	0	0	114	A16 Y19 S23 M26 P45 V64 S69 A71	A16-F21 HydrophobicContact CB-CB 4.14Å; A16-F21 HydrophobicContact CB-CD2 3.33Å; A16-F21 HydrophobicContact CB-CE2 4.02Å; A16-F21 HydrophobicContact CB-CG 4.06Å; Y19-F21 PolarHBondContact O-N 3.27Å; Y19-F21 VanDerWaalsContact O-N 3.17Å; F21-S23 VanDerWaalsContact C-N 3.26Å; F21-S23 PolarHBondContact O-N 2.75Å; F21-M26 HydrophobicContact CD2-CE 4.45Å; F21-M26 HydrophobicContact CE2-CE 3.91Å; F21-P45 HydrophobicContact CD1-CB 3.81Å; F21-P45 HydrophobicContact CD2-CB 4.32Å; F21-P45 HydrophobicContact CD2-CG 4.15Å; F21-P45 HydrophobicContact CE1-CB 3.56Å; F21-P45 HydrophobicContact CE1-CG 4.2Å; F21-P45 HydrophobicContact CE2-CB 4.09Å; F21-P45 HydrophobicContact CE2-CG 3.81Å; F21-P45 HydrophobicContact CG-CB 4.22Å; F21-P45 HydrophobicContact CZ-CB 3.72Å; F21-P45 HydrophobicContact CZ-CG 3.85Å; F21-P45 WeakPolarHBondContact O-CG 3.34Å; F21-V64 HydrophobicContact CE1-CB 4.38Å; F21-V64 HydrophobicContact CE1-CG1 4.4Å; F21-V64 HydrophobicContact CZ-CB 4.45Å; F21-V64 HydrophobicContact CZ-CG1 4.04Å; F21-S69 VanDerWaalsContact CD1-CA 3.45Å; F21-A71 HydrophobicContact CE2-CB 4.32Å; F21-A71 HydrophobicContact CZ-CB 4.04Å
22	T	91.4	Very high	92	Very high	58 Å²	58	48 Å²	48	36%	0.356	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-81.1	2	-179.4	58.6	0	0	0	0	114.3	T20 S46 K66	T20-T22 PolarHBondContact O-N 3.15Å; T20-T22 VanDerWaalsContact O-N 3.1Å; T22-S46 WeakPolarHBondContact O-CB 3.41Å; T22-K66 HydrophobicContact CG2-CD 4.42Å
23	S	88.2	Confident	91.2	Very high	70 Å²	70	53.9 Å²	53.9	49%	0.49	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-92.3	-10.4	-179.8	-64	0	0	0	0	113.4	T20 F21	T20-S23 WeakPolarHBondContact CB-OG 3.37Å; T20-S23 WeakPolarHBondContact CG2-OG 3.22Å; T20-S23 WeakPolarHBondContact O-CB 3.37Å; T20-S23 PolarHBondContact O-N 2.96Å; F21-S23 VanDerWaalsContact C-N 3.26Å; F21-S23 PolarHBondContact O-N 2.75Å
24	Y	86.6	Confident	90.6	Very high	68 Å²	68	58.2 Å²	58.2	27%	0.267	33%	0.333	S	S	.	.	S	Bend	trans	-143.9	145.8	-171.2	-57.5	-71.8	0	0	0	112.2	Y19 P45 V91 V92	Y19-Y24 AromaticContact CD2-CD2 3.6Å; Y19-Y24 HydrophobicContact CD2-CD2 3.6Å; Y19-Y24 HydrophobicContact CD2-CE2 4.17Å; Y19-Y24 HydrophobicContact CE2-CD2 4.07Å; Y19-Y24 HydrophobicContact CG-CD2 4.31Å; Y24-P45 WeakPolarHBondContact O-CD 3.32Å; Y24-P45 WeakPolarHBondContact O-CG 3.02Å; Y24-V91 WeakPolarHBondContact CB-O 3.39Å; Y24-V91 WeakPolarHBondContact CD1-O 3.36Å; Y24-V92 HydrophobicContact CE2-CG1 4.27Å
25	W	91.6	Very high	90	Very high	61 Å²	61	64 Å²	64	23%	0.231	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-68	139.8	175.7	-71.6	57	0	0	0	110.5	N42 D44 E49 H51	W25-N42 HydrophobicContact CE3-CB 3.93Å; W25-N42 VanDerWaalsContact CE3-ND2 3.26Å; W25-N42 WeakPolarHBondContact CZ3-OD1 3.35Å; W25-D44 HydrophobicContact CD2-CB 3.92Å; W25-D44 HydrophobicContact CE3-CB 4.24Å; W25-D44 HydrophobicContact CG-CB 4.41Å; W25-D44 HydrophobicContact CH2-CB 4.23Å; W25-D44 HydrophobicContact CZ2-CB 3.85Å; W25-D44 HydrophobicContact CZ3-CB 4.41Å; W25-D44 PolarHBondContact NE1-OD2 3Å; W25-E49 HydrophobicContact CH2-CB 4.27Å; W25-E49 HydrophobicContact CH2-CG 4.05Å; W25-H51 AromaticContact CH2-CE1 3.35Å; W25-H51 WeakPolarHBondContact CH2-CE1 3.39Å; W25-H51 AromaticContact CH2-ND1 3.82Å; W25-H51 AromaticContact CH2-NE2 3.75Å; W25-H51 AromaticContact CZ3-CE1 3.73Å; W25-H51 AromaticContact CZ3-ND1 3.7Å
26	M	93.7	Very high	89.8	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.01	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	118.9	172.4	-174.9	66	68.4	0	0	109.5	A16 Y19 F21 N42 I43 A71 C88	A16-M26 HydrophobicContact CB-CE 4.41Å; Y19-M26 WeakPolarHBondContact OH-CE 3.33Å; F21-M26 HydrophobicContact CD2-CE 4.45Å; F21-M26 HydrophobicContact CE2-CE 3.91Å; M26-N42 CarbonylContact O-C 3.38Å; M26-N42 WeakPolarHBondContact O-CA 3.27Å; M26-N42 WeakPolarHBondContact O-CB 3.42Å; M26-I43 HydrophobicContact CB-CG2 4.04Å; M26-I43 PolarHBondContact N-O 3.03Å; M26-I43 PolarHBondContact O-N 2.88Å; M26-A71 HydrophobicContact CB-CB 4.12Å; M26-A71 HydrophobicContact CG-CB 3.65Å; M26-C88 HydrophobicContact SD-CB 3.82Å
27	H	95.3	Very high	90	Very high	22 Å²	22	62.1 Å²	62.1	10%	0.102	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	147.7	179.9	-64.1	-108.9	0	0	0	110.9	W39 N42 C88 A89 F98	H27-W39 AromaticContact CG-NE1 3.96Å; H27-W39 AromaticContact ND1-NE1 3.24Å; H27-W39 PolarHBondContact ND1-NE1 3.09Å; H27-N42 HydrophobicContact CB-CB 4.37Å; H27-N42 PolarHBondContact CE1-ND2 3.04Å; H27-N42 WeakPolarHBondContact ND1-CB 3.06Å; H27-C88 CarbonylContact O-C 3.56Å; H27-C88 WeakPolarHBondContact O-CA 3.16Å; H27-A89 PolarHBondContact N-O 3.47Å; H27-A89 PolarHBondContact O-N 2.93Å; H27-F98 HydrophobicContact CB-CD1 4.2Å; H27-F98 HydrophobicContact CB-CE1 3.59Å; H27-F98 HydrophobicContact CB-CZ 3.94Å; H27-F98 AromaticContact CD2-CE1 3.46Å; H27-F98 VanDerWaalsContact CD2-CE1 3.46Å; H27-F98 WeakPolarHBondContact CD2-CE1 3.32Å; H27-F98 AromaticContact CE1-CE1 3.55Å; H27-F98 AromaticContact CG-CD1 4Å; H27-F98 AromaticContact CG-CE1 3.14Å; H27-F98 AromaticContact CG-CZ 3.71Å; H27-F98 AromaticContact ND1-CE1 3.21Å; H27-F98 WeakPolarHBondContact ND1-CE1 3.48Å; H27-F98 AromaticContact ND1-CZ 3.46Å; H27-F98 WeakPolarHBondContact ND1-CZ 3.42Å; H27-F98 AromaticContact NE2-CE1 3.72Å
28	W	97.3	Very high	90.4	Very high	4 Å²	4	58.8 Å²	58.8	2%	0.015	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.6	174.6	-69.6	90.4	0	0	0	110.3	L12 C14 I40 G41 L62 A71 M73 Y87 C88	L12-W28 HydrophobicContact CB-CH2 4.07Å; L12-W28 HydrophobicContact CB-CZ3 3.93Å; C14-W28 HydrophobicContact CB-CH2 3.81Å; C14-W28 HydrophobicContact CB-CZ2 3.95Å; W28-I40 HydrophobicContact CB-CB 4.17Å; W28-I40 HydrophobicContact CB-CD1 4.36Å; W28-I40 WeakPolarHBondContact O-CB 3.4Å; W28-I40 PolarHBondContact O-N 2.56Å; W28-G41 PolarHBondContact N-O 2.95Å; W28-L62 HydrophobicContact CG-CD2 4.05Å; W28-A71 HydrophobicContact CZ2-CB 4.35Å; W28-M73 HydrophobicContact CB-SD 3.88Å; W28-M73 HydrophobicContact CD2-CB 3.63Å; W28-M73 HydrophobicContact CD2-CE 4.29Å; W28-M73 HydrophobicContact CD2-CG 4.43Å; W28-M73 HydrophobicContact CD2-SD 4.08Å; W28-M73 HydrophobicContact CE3-CB 3.86Å; W28-M73 HydrophobicContact CE3-CE 3.71Å; W28-M73 HydrophobicContact CE3-SD 4.12Å; W28-M73 HydrophobicContact CG-CB 4.15Å; W28-M73 HydrophobicContact CG-SD 4.01Å; W28-M73 HydrophobicContact CH2-CB 4.07Å; W28-M73 HydrophobicContact CZ2-CB 3.87Å; W28-M73 HydrophobicContact CZ3-CB 4.08Å; W28-M73 HydrophobicContact CZ3-CE 4.22Å; W28-Y87 WeakPolarHBondContact CA-O 3.39Å; W28-C88 HydrophobicContact CD2-CB 4.42Å; W28-C88 HydrophobicContact CE3-CB 4.23Å; W28-C88 HydrophobicContact CH2-CB 4.34Å; W28-C88 HydrophobicContact CZ2-CB 4.48Å; W28-C88 HydrophobicContact CZ3-CB 4.2Å
29	V	96.9	Very high	90.9	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.018	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	133.2	-173.5	-174.8	0	0	0	0	109.6	L37 E38 Y86 Y87 W101	V29-L37 HydrophobicContact CG1-CB 3.84Å; V29-L37 HydrophobicContact CG1-CD2 3.76Å; V29-L37 HydrophobicContact CG1-CG 4.31Å; V29-E38 CarbonylContact C-O 3.58Å; V29-E38 WeakPolarHBondContact CA-O 3.38Å; V29-E38 WeakPolarHBondContact CG1-O 3.04Å; V29-Y86 WeakPolarHBondContact O-CA 3.43Å; V29-Y87 PolarHBondContact N-O 3.22Å; V29-Y87 PolarHBondContact O-N 2.79Å; V29-W101 HydrophobicContact CB-CH2 4.18Å; V29-W101 HydrophobicContact CB-CZ3 3.91Å; V29-W101 HydrophobicContact CG1-CH2 4.14Å; V29-W101 HydrophobicContact CG1-CZ3 4.14Å; V29-W101 HydrophobicContact CG2-CH2 3.84Å; V29-W101 HydrophobicContact CG2-CZ3 3.93Å
30	K	96.8	Very high	91.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	127.5	172.7	-179.4	179.1	-177.5	179	0	109	R32 L37 E38 I40 F56 E81 D82 A84 Y86	K30-R32 HydrophobicContact CG-CG 4.47Å; K30-L37 CarbonylContact O-C 3.57Å; K30-L37 WeakPolarHBondContact O-CA 3.45Å; K30-E38 HydrophobicContact CB-CB 4.37Å; K30-E38 PolarHBondContact N-O 2.89Å; K30-E38 PolarHBondContact O-N 2.9Å; K30-I40 HydrophobicContact CB-CD1 4.03Å; K30-I40 HydrophobicContact CB-CG1 4.18Å; K30-F56 HydrophobicContact CD-CE1 4.06Å; K30-F56 HydrophobicContact CD-CZ 4.11Å; K30-E81 PolarHBondContact NZ-O 2.9Å; K30-D82 IonicContact NZ-OD1 3.27Å; K30-A84 HydrophobicContact CD-CB 4.2Å; K30-A84 HydrophobicContact CG-CB 3.59Å; K30-Y86 HydrophobicContact CB-CD1 4.1Å; K30-Y86 HydrophobicContact CB-CE1 3.84Å; K30-Y86 HydrophobicContact CD-CE1 3.96Å; K30-Y86 WeakPolarHBondContact CE-OH 3.35Å; K30-Y86 HydrophobicContact CG-CD1 4.29Å; K30-Y86 HydrophobicContact CG-CE1 3.72Å
31	Q	96.4	Very high	92	Very high	72 Å²	72	51.5 Å²	51.5	34%	0.336	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	122.8	170.9	-166.4	-175.9	38.7	0	0	110.5	G36 L37 A84 V85 Y87	Q31-G36 WeakPolarHBondContact CA-O 3.5Å; Q31-L37 HydrophobicContact CB-CD2 3.68Å; Q31-L37 HydrophobicContact CG-CD2 3.72Å; Q31-A84 VanDerWaalsContact O-CB 3.28Å; Q31-A84 WeakPolarHBondContact O-CB 3.14Å; Q31-V85 HydrophobicContact CB-CB 4.48Å; Q31-V85 PolarHBondContact N-O 3.1Å; Q31-V85 PolarHBondContact O-N 3.02Å; Q31-Y87 HydrophobicContact CB-CD2 4.1Å; Q31-Y87 HydrophobicContact CB-CE2 3.62Å; Q31-Y87 HydrophobicContact CG-CE2 4.45Å; Q31-Y87 PolarHBondContact OE1-OH 2.83Å
32	R	92.7	Very high	92.3	Very high	46 Å²	46	51.7 Å²	51.7	17%	0.174	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	144.1	170.8	-63.6	-178.9	-163.3	-147.7	1	109.5	K30 I34 Q35 G36 E38 A84	K30-R32 HydrophobicContact CG-CG 4.47Å; R32-I34 PolarHBondContact O-N 2.66Å; R32-Q35 HydrophobicContact CB-CB 3.96Å; R32-Q35 VanDerWaalsContact NH1-OE1 3.07Å; R32-G36 PolarHBondContact N-O 3.13Å; R32-G36 PolarHBondContact O-N 3.46Å; R32-E38 IonicContact CZ-OE2 3.39Å; R32-E38 IonicContact NE-OE2 2.82Å; R32-E38 PolarHBondContact NE-OE2 2.82Å; R32-E38 IonicContact NH2-OE2 2.75Å; R32-E38 PolarHBondContact NH2-OE2 3.43Å; R32-A84 HydrophobicContact CG-CB 4.33Å
33	P	80.4	Confident	92.6	Very high	130 Å²	130	49 Å²	49	84%	0.844	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-20.6	-175.7	-28.6	35	0	0	0	116
34	I	83.4	Confident	92.9	Very high	168 Å²	168	46.7 Å²	46.7	86%	0.862	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-126.1	-32.6	-177.3	-58.6	172.1	0	0	0	112.5	R32	R32-I34 PolarHBondContact O-N 2.66Å
35	Q	84.3	Confident	93.3	Very high	133 Å²	133	43.5 Å²	43.5	62%	0.621	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-2.4	-174.1	-81.6	163.9	-26.2	0	0	113.9	R32	R32-Q35 HydrophobicContact CB-CB 3.96Å; R32-Q35 VanDerWaalsContact NH1-OE1 3.07Å
36	G	89.7	Confident	93.4	Very high	33 Å²	33	43 Å²	43	34%	0.34	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	78.5	-154	177.6	0	0	0	0	0	113.3	Q31 R32	Q31-G36 WeakPolarHBondContact CA-O 3.5Å; R32-G36 PolarHBondContact N-O 3.13Å; R32-G36 PolarHBondContact O-N 3.46Å
37	L	93.8	Very high	93.5	Very high	95 Å²	95	47.4 Å²	47.4	50%	0.497	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	125.8	-178.2	-64.8	172.1	0	0	0	110.8	V29 K30 Q31 W101	V29-L37 HydrophobicContact CG1-CB 3.84Å; V29-L37 HydrophobicContact CG1-CD2 3.76Å; V29-L37 HydrophobicContact CG1-CG 4.31Å; K30-L37 CarbonylContact O-C 3.57Å; K30-L37 WeakPolarHBondContact O-CA 3.45Å; Q31-L37 HydrophobicContact CB-CD2 3.68Å; Q31-L37 HydrophobicContact CG-CD2 3.72Å; L37-W101 HydrophobicContact CD1-CH2 4.04Å
38	E	95.4	Very high	93.5	Very high	30 Å²	30	49.1 Å²	49.1	14%	0.14	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	117.2	172.5	-61	-172.1	93.8	0	0	109.1	V29 K30 R32 I40 K55 F56	V29-E38 CarbonylContact C-O 3.58Å; V29-E38 WeakPolarHBondContact CA-O 3.38Å; V29-E38 WeakPolarHBondContact CG1-O 3.04Å; K30-E38 HydrophobicContact CB-CB 4.37Å; K30-E38 PolarHBondContact N-O 2.89Å; K30-E38 PolarHBondContact O-N 2.9Å; R32-E38 IonicContact CZ-OE2 3.39Å; R32-E38 IonicContact NE-OE2 2.82Å; R32-E38 PolarHBondContact NE-OE2 2.82Å; R32-E38 IonicContact NH2-OE2 2.75Å; R32-E38 PolarHBondContact NH2-OE2 3.43Å; E38-I40 PolarHBondContact O-N 2.95Å; E38-K55 IonicContact OE1-NZ 3.3Å; E38-K55 PolarHBondContact OE1-NZ 2.92Å; E38-F56 HydrophobicContact CB-CE2 4.35Å; E38-F56 HydrophobicContact CB-CZ 4.3Å
39	W	95.4	Very high	93.5	Very high	78 Å²	78	53.3 Å²	53.3	30%	0.295	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	127.6	173.4	-179	73.2	0	0	0	110.5	H27 G41 N42 H51 N53	H27-W39 AromaticContact CG-NE1 3.96Å; H27-W39 AromaticContact ND1-NE1 3.24Å; H27-W39 PolarHBondContact ND1-NE1 3.09Å; W39-G41 VanDerWaalsContact CE2-C 3.47Å; W39-G41 PolarHBondContact NE1-O 2.89Å; W39-G41 VanDerWaalsContact NE1-O 3.07Å; W39-N42 HydrophobicContact CZ2-CB 3.98Å; W39-H51 HydrophobicContact CH2-CB 4.2Å; W39-N53 HydrophobicContact CE3-CB 3.85Å; W39-N53 HydrophobicContact CZ3-CB 4.05Å; W39-N53 WeakPolarHBondContact O-CB 3.46Å; W39-N53 PolarHBondContact O-ND2 2.77Å
40	I	97.4	Very high	93.5	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-48.3	-177.5	-61.9	175.7	0	0	0	110.3	W28 K30 E38 N53 F56 A60 M73 Y86	W28-I40 HydrophobicContact CB-CB 4.17Å; W28-I40 HydrophobicContact CB-CD1 4.36Å; W28-I40 WeakPolarHBondContact O-CB 3.4Å; W28-I40 PolarHBondContact O-N 2.56Å; K30-I40 HydrophobicContact CB-CD1 4.03Å; K30-I40 HydrophobicContact CB-CG1 4.18Å; E38-I40 PolarHBondContact O-N 2.95Å; I40-N53 WeakPolarHBondContact O-CB 3.21Å; I40-N53 PolarHBondContact O-N 2.79Å; I40-F56 HydrophobicContact CB-CD2 4.31Å; I40-F56 HydrophobicContact CB-CG 4.27Å; I40-F56 HydrophobicContact CG1-CD1 4.19Å; I40-F56 HydrophobicContact CG1-CD2 4.25Å; I40-F56 HydrophobicContact CG1-CE1 4.16Å; I40-F56 HydrophobicContact CG1-CE2 4.21Å; I40-F56 HydrophobicContact CG1-CG 4.23Å; I40-F56 HydrophobicContact CG1-CZ 4.16Å; I40-F56 HydrophobicContact CG2-CB 3.73Å; I40-F56 HydrophobicContact CG2-CD1 4.2Å; I40-F56 HydrophobicContact CG2-CD2 4.37Å; I40-F56 HydrophobicContact CG2-CG 3.86Å; I40-A60 HydrophobicContact CG2-CB 3.73Å; I40-M73 HydrophobicContact CD1-CE 3.92Å; I40-M73 HydrophobicContact CD1-SD 3.58Å; I40-M73 VanDerWaalsContact CD1-SD 3.58Å; I40-M73 HydrophobicContact CG2-SD 3.95Å; I40-Y86 HydrophobicContact CD1-CD1 3.78Å; I40-Y86 HydrophobicContact CD1-CE1 3.9Å
41	G	96.6	Very high	93.5	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.2	179.2	-170.6	0	0	0	0	0	111.4	W28 W39 H51	W28-G41 PolarHBondContact N-O 2.95Å; W39-G41 VanDerWaalsContact CE2-C 3.47Å; W39-G41 PolarHBondContact NE1-O 2.89Å; W39-G41 VanDerWaalsContact NE1-O 3.07Å; G41-H51 CarbonylContact C-O 3.5Å; G41-H51 WeakPolarHBondContact CA-O 3.46Å
42	N	95.9	Very high	93.5	Very high	13 Å²	13	58.8 Å²	58.8	7%	0.07	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	163	173.4	62.6	10.6	0	0	0	111	W25 M26 H27 W39 T50 H51 L62	W25-N42 HydrophobicContact CE3-CB 3.93Å; W25-N42 VanDerWaalsContact CE3-ND2 3.26Å; W25-N42 WeakPolarHBondContact CZ3-OD1 3.35Å; M26-N42 CarbonylContact O-C 3.38Å; M26-N42 WeakPolarHBondContact O-CA 3.27Å; M26-N42 WeakPolarHBondContact O-CB 3.42Å; H27-N42 HydrophobicContact CB-CB 4.37Å; H27-N42 PolarHBondContact CE1-ND2 3.04Å; H27-N42 WeakPolarHBondContact ND1-CB 3.06Å; W39-N42 HydrophobicContact CZ2-CB 3.98Å; N42-T50 VanDerWaalsContact O-CA 3.32Å; N42-T50 WeakPolarHBondContact O-CA 3.44Å; N42-H51 PolarHBondContact N-O 3.28Å; N42-H51 PolarHBondContact O-N 2.85Å; N42-H51 VanDerWaalsContact O-N 3.1Å; N42-H51 VanDerWaalsContact OD1-CB 3.26Å; N42-H51 WeakPolarHBondContact OD1-CB 3.26Å; N42-H51 PolarHBondContact OD1-N 3.12Å; N42-L62 WeakPolarHBondContact O-CD1 3.44Å
43	I	96.4	Very high	93.7	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.01	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	132.8	174.7	-174.5	160	0	0	0	109.1	M26 P45 E49 T50 L62 V64 A71	M26-I43 HydrophobicContact CB-CG2 4.04Å; M26-I43 PolarHBondContact N-O 3.03Å; M26-I43 PolarHBondContact O-N 2.88Å; I43-P45 VanDerWaalsContact O-CD 3.29Å; I43-P45 WeakPolarHBondContact O-CD 3.43Å; I43-E49 CarbonylContact C-O 3.58Å; I43-E49 VanDerWaalsContact CA-O 3.26Å; I43-E49 WeakPolarHBondContact CA-O 3.4Å; I43-T50 HydrophobicContact CB-CG2 3.9Å; I43-T50 HydrophobicContact CD1-CG2 3.6Å; I43-T50 HydrophobicContact CG1-CG2 3.66Å; I43-L62 HydrophobicContact CB-CB 4.14Å; I43-L62 HydrophobicContact CB-CD1 4.41Å; I43-L62 HydrophobicContact CD1-CB 4.16Å; I43-L62 HydrophobicContact CG2-CB 4.44Å; I43-V64 HydrophobicContact CB-CG1 4.49Å; I43-V64 HydrophobicContact CD1-CB 4.38Å; I43-V64 HydrophobicContact CD1-CG1 3.71Å; I43-V64 HydrophobicContact CD1-CG2 4.13Å; I43-V64 HydrophobicContact CG1-CG1 3.89Å; I43-V64 HydrophobicContact CG2-CG1 3.79Å; I43-A71 HydrophobicContact CG2-CB 4.49Å
44	D	94.7	Very high	94.5	Very high	21 Å²	21	59.3 Å²	59.3	11%	0.112	31%	0.308	C	S	.	.			trans	-80.3	114.4	168	-168	-37	0	0	0	108.6	W25 S46 D47 S48 E49	W25-D44 HydrophobicContact CD2-CB 3.92Å; W25-D44 HydrophobicContact CE3-CB 4.24Å; W25-D44 HydrophobicContact CG-CB 4.41Å; W25-D44 HydrophobicContact CH2-CB 4.23Å; W25-D44 HydrophobicContact CZ2-CB 3.85Å; W25-D44 HydrophobicContact CZ3-CB 4.41Å; W25-D44 PolarHBondContact NE1-OD2 3Å; D44-S46 VanDerWaalsContact CG-OG 3.23Å; D44-S46 PolarHBondContact O-N 3.17Å; D44-S46 WeakPolarHBondContact OD1-CA 3.46Å; D44-S46 WeakPolarHBondContact OD1-CB 3Å; D44-S46 PolarHBondContact OD1-N 2.8Å; D44-S46 PolarHBondContact OD1-OG 3.19Å; D44-S46 PolarHBondContact OD2-OG 3.05Å; D44-D47 WeakPolarHBondContact CB-OD1 3.47Å; D44-S48 WeakPolarHBondContact O-CA 3.33Å; D44-S48 PolarHBondContact O-N 2.82Å; D44-E49 HydrophobicContact CB-CB 4.32Å; D44-E49 PolarHBondContact N-O 3.21Å
45	P	94.5	Very high	95	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-11.3	-179.6	-17.2	33.5	0	0	0	113.8	F21 Y24 I43 V64 K66	F21-P45 HydrophobicContact CD1-CB 3.81Å; F21-P45 HydrophobicContact CD2-CB 4.32Å; F21-P45 HydrophobicContact CD2-CG 4.15Å; F21-P45 HydrophobicContact CE1-CB 3.56Å; F21-P45 HydrophobicContact CE1-CG 4.2Å; F21-P45 HydrophobicContact CE2-CB 4.09Å; F21-P45 HydrophobicContact CE2-CG 3.81Å; F21-P45 HydrophobicContact CG-CB 4.22Å; F21-P45 HydrophobicContact CZ-CB 3.72Å; F21-P45 HydrophobicContact CZ-CG 3.85Å; F21-P45 WeakPolarHBondContact O-CG 3.34Å; Y24-P45 WeakPolarHBondContact O-CD 3.32Å; Y24-P45 WeakPolarHBondContact O-CG 3.02Å; I43-P45 VanDerWaalsContact O-CD 3.29Å; I43-P45 WeakPolarHBondContact O-CD 3.43Å; P45-V64 HydrophobicContact CB-CG1 4.05Å; P45-V64 HydrophobicContact CG-CG1 4.31Å; P45-K66 WeakPolarHBondContact O-CE 3.33Å
46	S	93.9	Very high	95.5	Very high	50 Å²	50	52.4 Å²	52.4	35%	0.35	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-42	179.5	75.6	0	0	0	0	112.9	T22 D44 K66	T22-S46 WeakPolarHBondContact O-CB 3.41Å; D44-S46 VanDerWaalsContact CG-OG 3.23Å; D44-S46 PolarHBondContact O-N 3.17Å; D44-S46 WeakPolarHBondContact OD1-CA 3.46Å; D44-S46 WeakPolarHBondContact OD1-CB 3Å; D44-S46 PolarHBondContact OD1-N 2.8Å; D44-S46 PolarHBondContact OD1-OG 3.19Å; D44-S46 PolarHBondContact OD2-OG 3.05Å; S46-K66 PolarHBondContact O-NZ 2.62Å
47	D	95.6	Very high	95.7	Very high	95 Å²	95	56.3 Å²	56.3	51%	0.508	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	-1.8	-176.2	64.3	9.3	0	0	0	114	D44 E49	D44-D47 WeakPolarHBondContact CB-OD1 3.47Å; D47-E49 VanDerWaalsContact C-N 3.28Å; D47-E49 WeakPolarHBondContact OD1-CB 3.34Å; D47-E49 PolarHBondContact OD1-N 3.21Å
48	S	95.8	Very high	95.8	Very high	58 Å²	58	59 Å²	59	41%	0.406	29%	0.292	S	S	.	.			trans	67.6	21.6	-178.2	-42	0	0	0	0	114.3	D44 V64	D44-S48 WeakPolarHBondContact O-CA 3.33Å; D44-S48 PolarHBondContact O-N 2.82Å; S48-V64 WeakPolarHBondContact OG-CG2 3.49Å
49	E	96.7	Very high	95.8	Very high	92 Å²	92	59.8 Å²	59.8	43%	0.43	30%	0.295	S	S	.	.			trans	-59	137.6	167.2	-172.7	175.6	176.7	0	0	110	W25 I43 D44 D47 H51	W25-E49 HydrophobicContact CH2-CB 4.27Å; W25-E49 HydrophobicContact CH2-CG 4.05Å; I43-E49 CarbonylContact C-O 3.58Å; I43-E49 VanDerWaalsContact CA-O 3.26Å; I43-E49 WeakPolarHBondContact CA-O 3.4Å; D44-E49 HydrophobicContact CB-CB 4.32Å; D44-E49 PolarHBondContact N-O 3.21Å; D47-E49 VanDerWaalsContact C-N 3.28Å; D47-E49 WeakPolarHBondContact OD1-CB 3.34Å; D47-E49 PolarHBondContact OD1-N 3.21Å; E49-H51 IonicContact OE1-CD2 2.79Å; E49-H51 IonicContact OE1-CE1 2.56Å; E49-H51 IonicContact OE1-NE2 3.51Å; E49-H51 PolarHBondContact OE1-NE2 2.83Å
50	T	97.4	Very high	96	Very high	49 Å²	49	56.2 Å²	56.2	30%	0.301	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	132.9	-178.9	51.5	0	0	0	0	111.5	N42 I43 Y52 L62	N42-T50 VanDerWaalsContact O-CA 3.32Å; N42-T50 WeakPolarHBondContact O-CA 3.44Å; I43-T50 HydrophobicContact CB-CG2 3.9Å; I43-T50 HydrophobicContact CD1-CG2 3.6Å; I43-T50 HydrophobicContact CG1-CG2 3.66Å; T50-Y52 WeakPolarHBondContact OG1-CE2 3.39Å; T50-L62 HydrophobicContact CG2-CB 3.98Å
51	H	96.8	Very high	96	Very high	81 Å²	81	59.5 Å²	59.5	38%	0.375	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	145.2	166.7	-51.7	154.7	0	0	0	110.1	W25 W39 G41 N42 E49	W25-H51 AromaticContact CH2-CE1 3.35Å; W25-H51 WeakPolarHBondContact CH2-CE1 3.39Å; W25-H51 AromaticContact CH2-ND1 3.82Å; W25-H51 AromaticContact CH2-NE2 3.75Å; W25-H51 AromaticContact CZ3-CE1 3.73Å; W25-H51 AromaticContact CZ3-ND1 3.7Å; W39-H51 HydrophobicContact CH2-CB 4.2Å; G41-H51 CarbonylContact C-O 3.5Å; G41-H51 WeakPolarHBondContact CA-O 3.46Å; N42-H51 PolarHBondContact N-O 3.28Å; N42-H51 PolarHBondContact O-N 2.85Å; N42-H51 VanDerWaalsContact O-N 3.1Å; N42-H51 VanDerWaalsContact OD1-CB 3.26Å; N42-H51 WeakPolarHBondContact OD1-CB 3.26Å; N42-H51 PolarHBondContact OD1-N 3.12Å; E49-H51 IonicContact OE1-CD2 2.79Å; E49-H51 IonicContact OE1-CE1 2.56Å; E49-H51 IonicContact OE1-NE2 3.51Å; E49-H51 PolarHBondContact OE1-NE2 2.83Å
52	Y	97.6	Very high	96.1	Very high	60 Å²	60	59.9 Å²	59.9	24%	0.235	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	145.9	-177.9	-65.5	-89.2	0	0	0	110.7	T50 A60 L62	T50-Y52 WeakPolarHBondContact OG1-CE2 3.39Å; Y52-A60 HydrophobicContact CE1-CB 4.31Å; Y52-A60 WeakPolarHBondContact CE1-O 2.89Å; Y52-L62 HydrophobicContact CE1-CD1 4.04Å; Y52-L62 HydrophobicContact CE1-CG 3.73Å; Y52-L62 PolarHBondContact OH-N 2.87Å
53	N	96.5	Very high	96.2	Very high	47 Å²	47	62.1 Å²	62.1	25%	0.251	32%	0.318	S	S	.	.			trans	-69.3	134.9	156.7	-178.9	-27.5	0	0	0	108.7	W39 I40 K55 F56 K57	W39-N53 HydrophobicContact CE3-CB 3.85Å; W39-N53 HydrophobicContact CZ3-CB 4.05Å; W39-N53 WeakPolarHBondContact O-CB 3.46Å; W39-N53 PolarHBondContact O-ND2 2.77Å; I40-N53 WeakPolarHBondContact O-CB 3.21Å; I40-N53 PolarHBondContact O-N 2.79Å; N53-K55 PolarHBondContact O-N 2.87Å; N53-K55 PolarHBondContact OD1-N 3.43Å; N53-K55 VanDerWaalsContact OD1-N 3.12Å; N53-F56 HydrophobicContact CB-CD2 4.06Å; N53-F56 PolarHBondContact O-N 2.84Å; N53-K57 PolarHBondContact O-N 2.81Å
54	Q	95.9	Very high	96.3	Very high	140 Å²	140	63.3 Å²	63.3	65%	0.654	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-31.8	-176.8	-167.4	62.1	25.3	0	0	113.3	F56	Q54-F56 PolarHBondContact O-N 3.48Å
55	K	93.8	Very high	96.3	Very high	147 Å²	147	64.9 Å²	64.9	64%	0.639	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-25.7	176.6	-69	-175.9	179.8	-179.5	0	114.3	E38 N53	E38-K55 IonicContact OE1-NZ 3.3Å; E38-K55 PolarHBondContact OE1-NZ 2.92Å; N53-K55 PolarHBondContact O-N 2.87Å; N53-K55 PolarHBondContact OD1-N 3.43Å; N53-K55 VanDerWaalsContact OD1-N 3.12Å
56	F	95.9	Very high	96.3	Very high	9 Å²	9	69.9 Å²	69.9	4%	0.039	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-4.7	-172.1	-61.8	-84.3	0	0	0	113.4	K30 E38 I40 N53 Q54 D58 K59 A60	K30-F56 HydrophobicContact CD-CE1 4.06Å; K30-F56 HydrophobicContact CD-CZ 4.11Å; E38-F56 HydrophobicContact CB-CE2 4.35Å; E38-F56 HydrophobicContact CB-CZ 4.3Å; I40-F56 HydrophobicContact CB-CD2 4.31Å; I40-F56 HydrophobicContact CB-CG 4.27Å; I40-F56 HydrophobicContact CG1-CD1 4.19Å; I40-F56 HydrophobicContact CG1-CD2 4.25Å; I40-F56 HydrophobicContact CG1-CE1 4.16Å; I40-F56 HydrophobicContact CG1-CE2 4.21Å; I40-F56 HydrophobicContact CG1-CG 4.23Å; I40-F56 HydrophobicContact CG1-CZ 4.16Å; I40-F56 HydrophobicContact CG2-CB 3.73Å; I40-F56 HydrophobicContact CG2-CD1 4.2Å; I40-F56 HydrophobicContact CG2-CD2 4.37Å; I40-F56 HydrophobicContact CG2-CG 3.86Å; N53-F56 HydrophobicContact CB-CD2 4.06Å; N53-F56 PolarHBondContact O-N 2.84Å; Q54-F56 PolarHBondContact O-N 3.48Å; F56-D58 VanDerWaalsContact C-N 3.25Å; F56-D58 PolarHBondContact O-N 2.99Å; F56-K59 PolarHBondContact O-N 3.2Å; F56-A60 HydrophobicContact CB-CB 4.35Å; F56-A60 PolarHBondContact O-N 2.83Å
57	K	94.7	Very high	96.3	Very high	115 Å²	115	72.8 Å²	72.8	50%	0.5	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-38.7	-174.3	-171.8	175.9	-178.1	177.3	0	113.6	N53	N53-K57 PolarHBondContact O-N 2.81Å
58	D	95.2	Very high	96.3	Very high	153 Å²	153	70 Å²	70	82%	0.818	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-0.4	-179.8	-55.6	-38.8	0	0	0	113	F56	F56-D58 VanDerWaalsContact C-N 3.25Å; F56-D58 PolarHBondContact O-N 2.99Å
59	K	96.3	Very high	96.3	Very high	46 Å²	46	69.3 Å²	69.3	20%	0.2	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-34.5	-172	-162.8	165	-163.9	169.6	0	113.6	F56 L75 S76 D82	F56-K59 PolarHBondContact O-N 3.2Å; K59-L75 WeakPolarHBondContact O-CA 2.98Å; K59-S76 WeakPolarHBondContact CG-O 2.96Å; K59-S76 PolarHBondContact O-N 3.26Å; K59-D82 VanDerWaalsContact CE-CG 3.5Å; K59-D82 WeakPolarHBondContact CE-OD1 3.28Å; K59-D82 WeakPolarHBondContact CE-OD2 3.43Å; K59-D82 IonicContact NZ-OD1 3.73Å; K59-D82 PolarHBondContact NZ-OD1 3.1Å; K59-D82 IonicContact NZ-OD2 3.65Å; K59-D82 PolarHBondContact NZ-OD2 2.75Å
60	A	98	Very high	96.3	Very high	3 Å²	3	65.4 Å²	65.4	3%	0.025	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	135.9	-177.2	0	0	0	0	0	110.7	I40 Y52 F56 M73 Q74 L75	I40-A60 HydrophobicContact CG2-CB 3.73Å; Y52-A60 HydrophobicContact CE1-CB 4.31Å; Y52-A60 WeakPolarHBondContact CE1-O 2.89Å; F56-A60 HydrophobicContact CB-CB 4.35Å; F56-A60 PolarHBondContact O-N 2.83Å; A60-M73 HydrophobicContact CB-CG 4.37Å; A60-M73 HydrophobicContact CB-SD 4.4Å; A60-Q74 CarbonylContact C-O 3.45Å; A60-Q74 WeakPolarHBondContact CA-O 3.21Å; A60-L75 HydrophobicContact CB-CD2 3.93Å
61	T	98.4	Very high	96.2	Very high	68 Å²	68	63 Å²	63	42%	0.417	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	120.4	168.9	-54.2	0	0	0	0	108.7	T63 M73 Q74	T61-T63 HydrophobicContact CG2-CG2 4.41Å; T61-M73 WeakPolarHBondContact O-CA 3.26Å; T61-Q74 PolarHBondContact N-O 2.81Å; T61-Q74 PolarHBondContact O-N 2.88Å
62	L	98.4	Very high	96.3	Very high	8 Å²	8	61.7 Å²	61.7	4%	0.042	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	134.8	178.1	-52.6	-176.6	0	0	0	110.5	W28 N42 I43 T50 Y52 Y72 M73	W28-L62 HydrophobicContact CG-CD2 4.05Å; N42-L62 WeakPolarHBondContact O-CD1 3.44Å; I43-L62 HydrophobicContact CB-CB 4.14Å; I43-L62 HydrophobicContact CB-CD1 4.41Å; I43-L62 HydrophobicContact CD1-CB 4.16Å; I43-L62 HydrophobicContact CG2-CB 4.44Å; T50-L62 HydrophobicContact CG2-CB 3.98Å; Y52-L62 HydrophobicContact CE1-CD1 4.04Å; Y52-L62 HydrophobicContact CE1-CG 3.73Å; Y52-L62 PolarHBondContact OH-N 2.87Å; L62-Y72 WeakPolarHBondContact CA-O 3.17Å; L62-M73 HydrophobicContact CD2-CB 3.68Å; L62-M73 HydrophobicContact CD2-CG 3.62Å; L62-M73 HydrophobicContact CD2-SD 4.21Å
63	T	98.2	Very high	96.3	Very high	60 Å²	60	58.8 Å²	58.8	37%	0.368	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	159.3	177.1	53.5	0	0	0	0	110.6	T61 A71 Y72	T61-T63 HydrophobicContact CG2-CG2 4.41Å; T63-A71 CarbonylContact O-C 3.59Å; T63-Y72 PolarHBondContact N-O 2.02Å; T63-Y72 PolarHBondContact O-N 3.19Å
64	V	97.4	Very high	96.4	Very high	28 Å²	28	60.4 Å²	60.4	17%	0.17	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	143.9	178.4	-73.2	0	0	0	0	110.7	F21 I43 P45 S48 A71	F21-V64 HydrophobicContact CE1-CB 4.38Å; F21-V64 HydrophobicContact CE1-CG1 4.4Å; F21-V64 HydrophobicContact CZ-CB 4.45Å; F21-V64 HydrophobicContact CZ-CG1 4.04Å; I43-V64 HydrophobicContact CB-CG1 4.49Å; I43-V64 HydrophobicContact CD1-CB 4.38Å; I43-V64 HydrophobicContact CD1-CG1 3.71Å; I43-V64 HydrophobicContact CD1-CG2 4.13Å; I43-V64 HydrophobicContact CG1-CG1 3.89Å; I43-V64 HydrophobicContact CG2-CG1 3.79Å; P45-V64 HydrophobicContact CB-CG1 4.05Å; P45-V64 HydrophobicContact CG-CG1 4.31Å; S48-V64 WeakPolarHBondContact OG-CG2 3.49Å; V64-A71 HydrophobicContact CG1-CB 4.16Å
65	D	96.4	Very high	96.5	Very high	54 Å²	54	53.8 Å²	53.8	29%	0.289	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	104.9	164.9	174.5	8.8	0	0	0	108.4	S67 S68 S69 T70 Y72	D65-S67 VanDerWaalsContact C-N 3.28Å; D65-S67 PolarHBondContact O-N 3.18Å; D65-S67 WeakPolarHBondContact OD1-CB 3.09Å; D65-S67 PolarHBondContact OD1-N 3.24Å; D65-S67 PolarHBondContact OD1-OG 3.24Å; D65-S67 PolarHBondContact OD2-OG 2.88Å; D65-S68 WeakPolarHBondContact CB-OG 3.41Å; D65-S68 PolarHBondContact OD1-N 3.07Å; D65-S68 WeakPolarHBondContact OD2-CB 3.29Å; D65-S68 PolarHBondContact OD2-OG 2.94Å; D65-S69 PolarHBondContact O-N 3.36Å; D65-S69 VanDerWaalsContact O-N 3.08Å; D65-T70 PolarHBondContact N-O 2.76Å; D65-T70 PolarHBondContact O-N 3.35Å; D65-Y72 HydrophobicContact CB-CE2 3.89Å
66	K	94.3	Very high	96.7	Very high	104 Å²	104	48.4 Å²	48.4	45%	0.452	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-32.1	-178.2	-56	-176.2	-163.5	-175.9	0	111.7	T22 P45 S46 S68 S69	T22-K66 HydrophobicContact CG2-CD 4.42Å; P45-K66 WeakPolarHBondContact O-CE 3.33Å; S46-K66 PolarHBondContact O-NZ 2.62Å; K66-S68 VanDerWaalsContact C-N 3.33Å; K66-S68 PolarHBondContact O-N 3.33Å; K66-S69 PolarHBondContact O-N 2.96Å
67	S	93.5	Very high	96.7	Very high	112 Å²	112	52 Å²	52	78%	0.783	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-37.1	-176.8	74	0	0	0	0	112	D65	D65-S67 VanDerWaalsContact C-N 3.28Å; D65-S67 PolarHBondContact O-N 3.18Å; D65-S67 WeakPolarHBondContact OD1-CB 3.09Å; D65-S67 PolarHBondContact OD1-N 3.24Å; D65-S67 PolarHBondContact OD1-OG 3.24Å; D65-S67 PolarHBondContact OD2-OG 2.88Å
68	S	95.3	Very high	96.8	Very high	36 Å²	36	46.5 Å²	46.5	25%	0.252	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	1	177.6	66.1	0	0	0	0	113.6	D65 K66 T70	D65-S68 WeakPolarHBondContact CB-OG 3.41Å; D65-S68 PolarHBondContact OD1-N 3.07Å; D65-S68 WeakPolarHBondContact OD2-CB 3.29Å; D65-S68 PolarHBondContact OD2-OG 2.94Å; K66-S68 VanDerWaalsContact C-N 3.33Å; K66-S68 PolarHBondContact O-N 3.33Å; S68-T70 PolarHBondContact O-N 2.87Å; S68-T70 PolarHBondContact O-OG1 2.85Å; S68-T70 VanDerWaalsContact O-OG1 3.06Å; S68-T70 WeakPolarHBondContact OG-CB 3.13Å; S68-T70 PolarHBondContact OG-OG1 2.91Å
69	S	94.9	Very high	96.9	Very high	43 Å²	43	42.1 Å²	42.1	30%	0.301	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	42.4	-173.5	-62.8	0	0	0	0	112.8	A16 F21 D65 K66	A16-S69 PolarHBondContact N-O 3.23Å; F21-S69 VanDerWaalsContact CD1-CA 3.45Å; D65-S69 PolarHBondContact O-N 3.36Å; D65-S69 VanDerWaalsContact O-N 3.08Å; K66-S69 PolarHBondContact O-N 2.96Å
70	T	96.7	Very high	96.8	Very high	10 Å²	10	44 Å²	44	6%	0.061	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127.7	-173.5	-55.5	0	0	0	0	111	C14 D65 S68 Y72	C14-T70 CarbonylContact O-C 3.47Å; C14-T70 WeakPolarHBondContact O-CA 3.48Å; D65-T70 PolarHBondContact N-O 2.76Å; D65-T70 PolarHBondContact O-N 3.35Å; S68-T70 PolarHBondContact O-N 2.87Å; S68-T70 PolarHBondContact O-OG1 2.85Å; S68-T70 VanDerWaalsContact O-OG1 3.06Å; S68-T70 WeakPolarHBondContact OG-CB 3.13Å; S68-T70 PolarHBondContact OG-OG1 2.91Å; T70-Y72 HydrophobicContact CG2-CD1 4.32Å; T70-Y72 HydrophobicContact CG2-CD2 4.33Å; T70-Y72 HydrophobicContact CG2-CE1 3.73Å; T70-Y72 HydrophobicContact CG2-CE2 3.73Å
71	A	97.1	Very high	96.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	151	167.3	0	0	0	0	0	109.9	S13 C14 F21 M26 W28 I43 T63 V64	S13-A71 CarbonylContact C-O 3.54Å; S13-A71 WeakPolarHBondContact CA-O 3.32Å; C14-A71 PolarHBondContact N-O 3.12Å; C14-A71 PolarHBondContact O-N 3.1Å; F21-A71 HydrophobicContact CE2-CB 4.32Å; F21-A71 HydrophobicContact CZ-CB 4.04Å; M26-A71 HydrophobicContact CB-CB 4.12Å; M26-A71 HydrophobicContact CG-CB 3.65Å; W28-A71 HydrophobicContact CZ2-CB 4.35Å; I43-A71 HydrophobicContact CG2-CB 4.49Å; T63-A71 CarbonylContact O-C 3.59Å; V64-A71 HydrophobicContact CG1-CB 4.16Å
72	Y	98.2	Very high	96.4	Very high	52 Å²	52	47 Å²	47	20%	0.204	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	146	178.3	-57.2	-89.4	0	0	0	110.9	K11 L12 S13 L62 T63 D65 T70	K11-Y72 HydrophobicContact CD-CD1 4.38Å; K11-Y72 VanDerWaalsContact CE-CD1 3.48Å; K11-Y72 HydrophobicContact CG-CD1 4.39Å; L12-Y72 CarbonylContact O-C 3.58Å; L12-Y72 WeakPolarHBondContact O-CA 3.34Å; S13-Y72 VanDerWaalsContact CB-CD1 3.49Å; S13-Y72 VanDerWaalsContact CB-CE1 3.44Å; L62-Y72 WeakPolarHBondContact CA-O 3.17Å; T63-Y72 PolarHBondContact N-O 2.02Å; T63-Y72 PolarHBondContact O-N 3.19Å; D65-Y72 HydrophobicContact CB-CE2 3.89Å; T70-Y72 HydrophobicContact CG2-CD1 4.32Å; T70-Y72 HydrophobicContact CG2-CD2 4.33Å; T70-Y72 HydrophobicContact CG2-CE1 3.73Å; T70-Y72 HydrophobicContact CG2-CE2 3.73Å
73	M	98.3	Very high	96.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	121.6	167.6	176.6	178.9	68.2	0	0	108.8	K11 L12 W28 I40 A60 T61 L62 L75 Y86	K11-M73 WeakPolarHBondContact CA-O 3.41Å; L12-M73 HydrophobicContact CD1-CE 3.73Å; L12-M73 PolarHBondContact N-O 2.96Å; L12-M73 PolarHBondContact O-N 2.79Å; W28-M73 HydrophobicContact CB-SD 3.88Å; W28-M73 HydrophobicContact CD2-CB 3.63Å; W28-M73 HydrophobicContact CD2-CE 4.29Å; W28-M73 HydrophobicContact CD2-CG 4.43Å; W28-M73 HydrophobicContact CD2-SD 4.08Å; W28-M73 HydrophobicContact CE3-CB 3.86Å; W28-M73 HydrophobicContact CE3-CE 3.71Å; W28-M73 HydrophobicContact CE3-SD 4.12Å; W28-M73 HydrophobicContact CG-CB 4.15Å; W28-M73 HydrophobicContact CG-SD 4.01Å; W28-M73 HydrophobicContact CH2-CB 4.07Å; W28-M73 HydrophobicContact CZ2-CB 3.87Å; W28-M73 HydrophobicContact CZ3-CB 4.08Å; W28-M73 HydrophobicContact CZ3-CE 4.22Å; I40-M73 HydrophobicContact CD1-CE 3.92Å; I40-M73 HydrophobicContact CD1-SD 3.58Å; I40-M73 VanDerWaalsContact CD1-SD 3.58Å; I40-M73 HydrophobicContact CG2-SD 3.95Å; A60-M73 HydrophobicContact CB-CG 4.37Å; A60-M73 HydrophobicContact CB-SD 4.4Å; T61-M73 WeakPolarHBondContact O-CA 3.26Å; L62-M73 HydrophobicContact CD2-CB 3.68Å; L62-M73 HydrophobicContact CD2-CG 3.62Å; L62-M73 HydrophobicContact CD2-SD 4.21Å; M73-L75 HydrophobicContact CE-CD1 3.89Å; M73-L75 HydrophobicContact CE-CD2 4.22Å; M73-L75 HydrophobicContact CE-CG 3.98Å; M73-L75 HydrophobicContact CG-CD2 4.35Å; M73-L75 HydrophobicContact CG-CG 4.33Å; M73-L75 HydrophobicContact SD-CD2 4.02Å; M73-L75 HydrophobicContact SD-CG 4.31Å; M73-Y86 HydrophobicContact CE-CD1 3.67Å; M73-Y86 HydrophobicContact CE-CE1 4.31Å; M73-Y86 HydrophobicContact CE-CG 4.25Å
74	Q	98.3	Very high	96.2	Very high	81 Å²	81	46.1 Å²	46.1	38%	0.379	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.3	168.8	-176.8	172.2	-2.8	0	0	109.2	V10 A60 T61	V10-Q74 CarbonylContact O-C 3.52Å; V10-Q74 WeakPolarHBondContact O-CA 3.29Å; A60-Q74 CarbonylContact C-O 3.45Å; A60-Q74 WeakPolarHBondContact CA-O 3.21Å; T61-Q74 PolarHBondContact N-O 2.81Å; T61-Q74 PolarHBondContact O-N 2.88Å
75	L	97.8	Very high	96.2	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	133.2	170.5	-64	167.7	0	0	0	108.7	S9 V10 K59 A60 M73 L78 Y86	S9-L75 CarbonylContact C-O 3.55Å; S9-L75 WeakPolarHBondContact CA-O 3.27Å; S9-L75 WeakPolarHBondContact CB-O 3.37Å; V10-L75 HydrophobicContact CG1-CB 4.15Å; V10-L75 HydrophobicContact CG1-CD1 4.28Å; V10-L75 PolarHBondContact N-O 2.77Å; V10-L75 PolarHBondContact O-N 2.82Å; K59-L75 WeakPolarHBondContact O-CA 2.98Å; A60-L75 HydrophobicContact CB-CD2 3.93Å; M73-L75 HydrophobicContact CE-CD1 3.89Å; M73-L75 HydrophobicContact CE-CD2 4.22Å; M73-L75 HydrophobicContact CE-CG 3.98Å; M73-L75 HydrophobicContact CG-CD2 4.35Å; M73-L75 HydrophobicContact CG-CG 4.33Å; M73-L75 HydrophobicContact SD-CD2 4.02Å; M73-L75 HydrophobicContact SD-CG 4.31Å; L75-L78 HydrophobicContact CB-CD2 3.74Å; L75-L78 HydrophobicContact CD1-CD2 4.33Å; L75-Y86 HydrophobicContact CD1-CD1 4.06Å; L75-Y86 HydrophobicContact CD1-CE1 3.51Å; L75-Y86 HydrophobicContact CD1-CE2 4.19Å
76	S	97.4	Very high	96.3	Very high	33 Å²	33	44 Å²	44	23%	0.231	26%	0.258	C	S	.	.			trans	-116.8	157.7	-178.2	-62.1	0	0	0	0	112.7	S9 K59 L78	S9-S76 WeakPolarHBondContact OG-CA 3.2Å; S9-S76 PolarHBondContact OG-OG 2.86Å; K59-S76 WeakPolarHBondContact CG-O 2.96Å; K59-S76 PolarHBondContact O-N 3.26Å; S76-L78 VanDerWaalsContact C-N 3.34Å; S76-L78 PolarHBondContact O-N 2.9Å
77	S	96.4	Very high	96.4	Very high	85 Å²	85	41.2 Å²	41.2	59%	0.594	25%	0.245	S	C	*	.	S	Bend	trans	52.2	51.2	176.5	-56	0	0	0	0	112.3	S8	S8-S77 PolarHBondContact O-N 2.95Å
78	L	96.8	Very high	96.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.213	C	C	.	.			trans	-64.2	139.9	-173.1	-70.5	172.3	0	0	0	112.2	V4 P6 G7 S8 V10 L75 S76 D82 V109	V4-L78 HydrophobicContact CB-CD1 4.42Å; V4-L78 HydrophobicContact CG2-CD1 3.54Å; P6-L78 CarbonylContact C-O 3.54Å; P6-L78 WeakPolarHBondContact CA-O 3.4Å; G7-L78 PolarHBondContact N-O 3.04Å; S8-L78 WeakPolarHBondContact O-CB 3.17Å; S8-L78 WeakPolarHBondContact O-CG 3.35Å; S8-L78 PolarHBondContact O-N 2.88Å; V10-L78 HydrophobicContact CB-CD1 4.04Å; V10-L78 HydrophobicContact CG1-CD1 3.83Å; L75-L78 HydrophobicContact CB-CD2 3.74Å; L75-L78 HydrophobicContact CD1-CD2 4.33Å; S76-L78 VanDerWaalsContact C-N 3.34Å; S76-L78 PolarHBondContact O-N 2.9Å; L78-D82 WeakPolarHBondContact CA-OD2 3.45Å; L78-D82 HydrophobicContact CD2-CB 3.64Å; L78-V109 HydrophobicContact CB-CG1 4.22Å; L78-V109 HydrophobicContact CB-CG2 4.05Å; L78-V109 HydrophobicContact CD1-CG2 4.48Å
79	T	96.1	Very high	96.4	Very high	60 Å²	60	34.9 Å²	34.9	37%	0.368	20%	0.201	S	C	.	.			trans	-120.6	168.5	174.5	67.3	0	0	0	0	109.9	E81 D82 V109	T79-E81 PolarHBondContact O-N 3.28Å; T79-E81 VanDerWaalsContact O-N 3.12Å; T79-D82 PolarHBondContact N-OD2 3.47Å; T79-D82 WeakPolarHBondContact O-CB 3.32Å; T79-D82 PolarHBondContact O-N 3.28Å; T79-D82 PolarHBondContact OG1-OD2 2.91Å; T79-V109 WeakPolarHBondContact O-CB 3.43Å; T79-V109 WeakPolarHBondContact O-CG2 3.41Å
80	S	94.6	Very high	96	Very high	86 Å²	86	33 Å²	33	60%	0.601	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-54.1	-32.2	176.8	52.4	0	0	0	0	112.8	D82 S83	S80-D82 PolarHBondContact O-N 2.86Å; S80-S83 VanDerWaalsContact O-CB 3.29Å; S80-S83 WeakPolarHBondContact O-CB 3.38Å; S80-S83 PolarHBondContact O-N 2.85Å; S80-S83 VanDerWaalsContact O-N 3.1Å; S80-S83 PolarHBondContact O-OG 2.85Å
81	E	92.9	Very high	94.9	Very high	131 Å²	131	33.5 Å²	33.5	61%	0.612	19%	0.191	S	C	*	.	G	3₁₀ helix	trans	-66.5	-14.8	176.4	-60.1	-174	-179.9	0	0	114.2	K30 T79 S83	K30-E81 PolarHBondContact NZ-O 2.9Å; T79-E81 PolarHBondContact O-N 3.28Å; T79-E81 VanDerWaalsContact O-N 3.12Å; E81-S83 VanDerWaalsContact C-N 3.29Å
82	D	95	Very high	93.4	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.021	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-83.7	-5.4	173.9	-58.1	-48.9	0	0	0	113.7	K30 K59 L78 T79 S80 A84 Y86 V109	K30-D82 IonicContact NZ-OD1 3.27Å; K59-D82 VanDerWaalsContact CE-CG 3.5Å; K59-D82 WeakPolarHBondContact CE-OD1 3.28Å; K59-D82 WeakPolarHBondContact CE-OD2 3.43Å; K59-D82 IonicContact NZ-OD1 3.73Å; K59-D82 PolarHBondContact NZ-OD1 3.1Å; K59-D82 IonicContact NZ-OD2 3.65Å; K59-D82 PolarHBondContact NZ-OD2 2.75Å; L78-D82 WeakPolarHBondContact CA-OD2 3.45Å; L78-D82 HydrophobicContact CD2-CB 3.64Å; T79-D82 PolarHBondContact N-OD2 3.47Å; T79-D82 WeakPolarHBondContact O-CB 3.32Å; T79-D82 PolarHBondContact O-N 3.28Å; T79-D82 PolarHBondContact OG1-OD2 2.91Å; S80-D82 PolarHBondContact O-N 2.86Å; D82-A84 PolarHBondContact O-N 2.78Å; D82-A84 VanDerWaalsContact O-N 3.09Å; D82-Y86 WeakPolarHBondContact O-CE2 3.2Å; D82-Y86 PolarHBondContact O-OH 2.64Å; D82-V109 HydrophobicContact CB-CG2 4.2Å
83	S	96.2	Very high	91.7	Very high	42 Å²	42	35.2 Å²	35.2	29%	0.294	21%	0.213	S	C	.	.			trans	-64	112.3	173.2	-58.9	0	0	0	0	110	S80 E81 V107 V109	S80-S83 VanDerWaalsContact O-CB 3.29Å; S80-S83 WeakPolarHBondContact O-CB 3.38Å; S80-S83 PolarHBondContact O-N 2.85Å; S80-S83 VanDerWaalsContact O-N 3.1Å; S80-S83 PolarHBondContact O-OG 2.85Å; E81-S83 VanDerWaalsContact C-N 3.29Å; S83-V107 CarbonylContact C-O 3.55Å; S83-V107 VanDerWaalsContact CA-O 3.27Å; S83-V107 WeakPolarHBondContact CA-O 3.44Å; S83-V109 PolarHBondContact OG-N 3.43Å
84	A	97	Very high	89.7	Confident	6 Å²	6	40.6 Å²	40.6	5%	0.05	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.3	172.4	-170.4	0	0	0	0	0	110.7	K30 Q31 R32 D82 Y86 V107	K30-A84 HydrophobicContact CD-CB 4.2Å; K30-A84 HydrophobicContact CG-CB 3.59Å; Q31-A84 VanDerWaalsContact O-CB 3.28Å; Q31-A84 WeakPolarHBondContact O-CB 3.14Å; R32-A84 HydrophobicContact CG-CB 4.33Å; D82-A84 PolarHBondContact O-N 2.78Å; D82-A84 VanDerWaalsContact O-N 3.09Å; A84-Y86 HydrophobicContact CB-CD2 4.39Å; A84-Y86 HydrophobicContact CB-CE2 3.79Å; A84-V107 PolarHBondContact N-O 3.37Å; A84-V107 PolarHBondContact O-N 2.93Å
85	V	97.6	Very high	87.8	Confident	33 Å²	33	44.5 Å²	44.5	20%	0.2	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	128.7	163.6	-170	0	0	0	0	108.4	Q31 Y87	Q31-V85 HydrophobicContact CB-CB 4.48Å; Q31-V85 PolarHBondContact N-O 3.1Å; Q31-V85 PolarHBondContact O-N 3.02Å; V85-Y87 HydrophobicContact CB-CE2 3.75Å; V85-Y87 HydrophobicContact CG1-CD2 4.22Å; V85-Y87 HydrophobicContact CG1-CE1 4.12Å; V85-Y87 HydrophobicContact CG1-CE2 3.48Å; V85-Y87 VanDerWaalsContact CG1-CE2 3.48Å; V85-Y87 VanDerWaalsContact CG1-CZ 3.42Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.19Å
86	Y	97.8	Very high	86.1	Confident	4 Å²	4	56.1 Å²	56.1	2%	0.016	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	127.6	179.7	-68.7	-90.6	0	0	0	109.9	L12 V29 K30 I40 M73 L75 D82 A84 G104 T105 V107	L12-Y86 VanDerWaalsContact CD1-CB 3.45Å; L12-Y86 HydrophobicContact CD1-CD1 4.48Å; L12-Y86 HydrophobicContact CD1-CD2 4.19Å; L12-Y86 HydrophobicContact CD1-CG 3.8Å; V29-Y86 WeakPolarHBondContact O-CA 3.43Å; K30-Y86 HydrophobicContact CB-CD1 4.1Å; K30-Y86 HydrophobicContact CB-CE1 3.84Å; K30-Y86 HydrophobicContact CD-CE1 3.96Å; K30-Y86 WeakPolarHBondContact CE-OH 3.35Å; K30-Y86 HydrophobicContact CG-CD1 4.29Å; K30-Y86 HydrophobicContact CG-CE1 3.72Å; I40-Y86 HydrophobicContact CD1-CD1 3.78Å; I40-Y86 HydrophobicContact CD1-CE1 3.9Å; M73-Y86 HydrophobicContact CE-CD1 3.67Å; M73-Y86 HydrophobicContact CE-CE1 4.31Å; M73-Y86 HydrophobicContact CE-CG 4.25Å; L75-Y86 HydrophobicContact CD1-CD1 4.06Å; L75-Y86 HydrophobicContact CD1-CE1 3.51Å; L75-Y86 HydrophobicContact CD1-CE2 4.19Å; D82-Y86 WeakPolarHBondContact O-CE2 3.2Å; D82-Y86 PolarHBondContact O-OH 2.64Å; A84-Y86 HydrophobicContact CB-CD2 4.39Å; A84-Y86 HydrophobicContact CB-CE2 3.79Å; Y86-G104 CarbonylContact O-C 3.43Å; Y86-G104 VanDerWaalsContact O-CA 3.27Å; Y86-G104 WeakPolarHBondContact O-CA 3.5Å; Y86-T105 PolarHBondContact N-O 2.77Å; Y86-T105 PolarHBondContact O-N 3.44Å; Y86-V107 HydrophobicContact CD2-CB 3.95Å; Y86-V107 HydrophobicContact CD2-CG2 3.62Å; Y86-V107 HydrophobicContact CE2-CB 3.78Å; Y86-V107 HydrophobicContact CE2-CG2 3.91Å
87	Y	96.9	Very high	84.4	Confident	46 Å²	46	62.5 Å²	62.5	18%	0.18	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	145.9	-179.1	-62.9	-87.7	0	0	0	110.1	W28 V29 Q31 V85 W101 G102 G104	W28-Y87 WeakPolarHBondContact CA-O 3.39Å; V29-Y87 PolarHBondContact N-O 3.22Å; V29-Y87 PolarHBondContact O-N 2.79Å; Q31-Y87 HydrophobicContact CB-CD2 4.1Å; Q31-Y87 HydrophobicContact CB-CE2 3.62Å; Q31-Y87 HydrophobicContact CG-CE2 4.45Å; Q31-Y87 PolarHBondContact OE1-OH 2.83Å; V85-Y87 HydrophobicContact CB-CE2 3.75Å; V85-Y87 HydrophobicContact CG1-CD2 4.22Å; V85-Y87 HydrophobicContact CG1-CE1 4.12Å; V85-Y87 HydrophobicContact CG1-CE2 3.48Å; V85-Y87 VanDerWaalsContact CG1-CE2 3.48Å; V85-Y87 VanDerWaalsContact CG1-CZ 3.42Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.19Å; Y87-W101 HydrophobicContact CD1-CE3 4.32Å; Y87-W101 HydrophobicContact CG-CE3 4.05Å; Y87-W101 HydrophobicContact CG-CZ3 4.22Å; Y87-G102 WeakPolarHBondContact CD1-O 3.36Å; Y87-G104 VanDerWaalsContact CD1-CA 3.43Å; Y87-G104 VanDerWaalsContact CE1-CA 3.49Å
88	C	95.3	Very high	83.3	Confident	15 Å²	15	61.8 Å²	61.8	10%	0.101	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	150.1	156.3	60.2	0	0	0	0	109.3	C14 M26 H27 W28 G102	C14-C88 HydrophobicContact CB-CB 3.39Å; C14-C88 WeakPolarHBondContact CB-SG 3Å; C14-C88 WeakPolarHBondContact SG-CB 3.47Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 2.87Å; M26-C88 HydrophobicContact SD-CB 3.82Å; H27-C88 CarbonylContact O-C 3.56Å; H27-C88 WeakPolarHBondContact O-CA 3.16Å; W28-C88 HydrophobicContact CD2-CB 4.42Å; W28-C88 HydrophobicContact CE3-CB 4.23Å; W28-C88 HydrophobicContact CH2-CB 4.34Å; W28-C88 HydrophobicContact CZ2-CB 4.48Å; W28-C88 HydrophobicContact CZ3-CB 4.2Å; C88-G102 PolarHBondContact O-N 3.27Å
89	A	92.6	Very high	82.3	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.008	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	139.5	174.8	0	0	0	0	0	111.3	H27 F98 V100 W101	H27-A89 PolarHBondContact N-O 3.47Å; H27-A89 PolarHBondContact O-N 2.93Å; A89-F98 HydrophobicContact CB-CB 3.95Å; A89-F98 HydrophobicContact CB-CD1 4.09Å; A89-F98 HydrophobicContact CB-CG 3.98Å; A89-V100 CarbonylContact C-O 3.59Å; A89-V100 WeakPolarHBondContact CA-O 3.36Å; A89-W101 HydrophobicContact CB-CD2 3.85Å; A89-W101 HydrophobicContact CB-CE3 4.07Å; A89-W101 HydrophobicContact CB-CG 4.24Å; A89-W101 HydrophobicContact CB-CZ2 4.39Å; A89-W101 HydrophobicContact CB-CZ3 4.42Å
90	G	86.6	Confident	81.6	Confident	2 Å²	2	65.9 Å²	65.9	2%	0.021	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	152.4	171.4	0	0	0	0	0	111.1	D99 V100	G90-D99 PolarHBondContact O-N 3.06Å; G90-V100 PolarHBondContact N-O 3Å; G90-V100 PolarHBondContact O-N 2.8Å
91	V	74.7	Confident	81.4	Confident	21 Å²	21	66.5 Å²	66.5	13%	0.127	32%	0.322	C	S	.	.			trans	-98.4	133.1	168	178.5	0	0	0	0	107.4	Y24 Y95 F98	Y24-V91 WeakPolarHBondContact CB-O 3.39Å; Y24-V91 WeakPolarHBondContact CD1-O 3.36Å; V91-Y95 WeakPolarHBondContact CG1-O 3.15Å; V91-F98 HydrophobicContact CG2-CD1 4.09Å; V91-F98 HydrophobicContact CG2-CE1 4.38Å
92	V	64.9	Low	81.4	Confident	59 Å²	59	61.6 Å²	61.6	36%	0.358	31%	0.306	S	S	.	.			trans	-127.6	82.9	179.8	-170	0	0	0	0	109.4	Y24 D99 V100	Y24-V92 HydrophobicContact CE2-CG1 4.27Å; V92-D99 HydrophobicContact CB-CB 4.45Å; V92-D99 PolarHBondContact N-OD2 3.34Å; V92-V100 HydrophobicContact CG2-CG2 3.64Å
93	G	62.5	Low	81.3	Confident	29 Å²	29	68.3 Å²	68.3	30%	0.299	35%	0.347	S	S	.	.	S	Bend	trans	142.4	-173.8	177.2	0	0	0	0	0	113.4	Y95	G93-Y95 PolarHBondContact O-N 2.93Å
94	P	57.4	Low	81.2	Confident	114 Å²	114	67.3 Å²	67.3	74%	0.74	34%	0.344	S	S	*	.	S	Bend	trans	-77.2	4	179.4	33.3	-35.9	0	0	0	113.6
95	Y	58.2	Low	81.2	Confident	162 Å²	162	69 Å²	69	64%	0.635	35%	0.354	S	S	*	.	S	Bend	trans	-102.1	151.4	-174.7	-59.8	-73.3	0	0	0	111.3	V91 G93 Y97	V91-Y95 WeakPolarHBondContact CG1-O 3.15Å; G93-Y95 PolarHBondContact O-N 2.93Å; Y95-Y97 PolarHBondContact O-N 3.17Å
96	W	60.5	Low	81.2	Confident	246 Å²	246	70.5 Å²	70.5	93%	0.932	36%	0.363	S	S	*	.	S	Bend	trans	-84.2	21.8	-175.2	-55.9	98.1	0	0	0	114.3
97	Y	63.4	Low	81.2	Confident	167 Å²	167	70.3 Å²	70.3	66%	0.655	36%	0.362	S	S	*	.	S	Bend	trans	-100.5	146.5	-175	-61.8	-69.9	0	0	0	111.8	Y95 D99	Y95-Y97 PolarHBondContact O-N 3.17Å; Y97-D99 PolarHBondContact O-N 3.22Å
98	F	73	Confident	81.2	Confident	70 Å²	70	71 Å²	71	31%	0.307	37%	0.371	S	S	.	.			trans	-76.7	89	171.8	-62.6	-40.6	0	0	0	109.8	H27 A89 V91 W101	H27-F98 HydrophobicContact CB-CD1 4.2Å; H27-F98 HydrophobicContact CB-CE1 3.59Å; H27-F98 HydrophobicContact CB-CZ 3.94Å; H27-F98 AromaticContact CD2-CE1 3.46Å; H27-F98 VanDerWaalsContact CD2-CE1 3.46Å; H27-F98 WeakPolarHBondContact CD2-CE1 3.32Å; H27-F98 AromaticContact CE1-CE1 3.55Å; H27-F98 AromaticContact CG-CD1 4Å; H27-F98 AromaticContact CG-CE1 3.14Å; H27-F98 AromaticContact CG-CZ 3.71Å; H27-F98 AromaticContact ND1-CE1 3.21Å; H27-F98 WeakPolarHBondContact ND1-CE1 3.48Å; H27-F98 AromaticContact ND1-CZ 3.46Å; H27-F98 WeakPolarHBondContact ND1-CZ 3.42Å; H27-F98 AromaticContact NE2-CE1 3.72Å; A89-F98 HydrophobicContact CB-CB 3.95Å; A89-F98 HydrophobicContact CB-CD1 4.09Å; A89-F98 HydrophobicContact CB-CG 3.98Å; V91-F98 HydrophobicContact CG2-CD1 4.09Å; V91-F98 HydrophobicContact CG2-CE1 4.38Å; F98-W101 HydrophobicContact CB-CZ2 3.67Å; F98-W101 VanDerWaalsContact CB-NE1 3.32Å; F98-W101 HydrophobicContact CD2-CH2 4.1Å; F98-W101 AromaticContact CD2-CZ2 3.57Å; F98-W101 HydrophobicContact CD2-CZ2 3.57Å; F98-W101 AromaticContact CG-CZ2 3.96Å; F98-W101 HydrophobicContact CG-CZ2 3.96Å; F98-W101 PolarHBondContact O-NE1 3.08Å
99	D	74.1	Confident	81.3	Confident	79 Å²	79	70.7 Å²	70.7	42%	0.422	37%	0.369	S	S	.	.			trans	-78.3	-27.4	-173.3	-56.9	-46.6	0	0	0	112.8	G90 V92 Y97	G90-D99 PolarHBondContact O-N 3.06Å; V92-D99 HydrophobicContact CB-CB 4.45Å; V92-D99 PolarHBondContact N-OD2 3.34Å; Y97-D99 PolarHBondContact O-N 3.22Å
100	V	82.3	Confident	81.3	Confident	67 Å²	67	76.1 Å²	76.1	41%	0.406	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	122.7	-177.4	-178.8	0	0	0	0	109.8	A89 G90 V92	A89-V100 CarbonylContact C-O 3.59Å; A89-V100 WeakPolarHBondContact CA-O 3.36Å; G90-V100 PolarHBondContact N-O 3Å; G90-V100 PolarHBondContact O-N 2.8Å; V92-V100 HydrophobicContact CG2-CG2 3.64Å
101	W	91.1	Very high	81	Confident	99 Å²	99	79.8 Å²	79.8	38%	0.375	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	139.6	177.5	-70.2	73.1	0	0	0	111	V29 L37 Y87 A89 F98	V29-W101 HydrophobicContact CB-CH2 4.18Å; V29-W101 HydrophobicContact CB-CZ3 3.91Å; V29-W101 HydrophobicContact CG1-CH2 4.14Å; V29-W101 HydrophobicContact CG1-CZ3 4.14Å; V29-W101 HydrophobicContact CG2-CH2 3.84Å; V29-W101 HydrophobicContact CG2-CZ3 3.93Å; L37-W101 HydrophobicContact CD1-CH2 4.04Å; Y87-W101 HydrophobicContact CD1-CE3 4.32Å; Y87-W101 HydrophobicContact CG-CE3 4.05Å; Y87-W101 HydrophobicContact CG-CZ3 4.22Å; A89-W101 HydrophobicContact CB-CD2 3.85Å; A89-W101 HydrophobicContact CB-CE3 4.07Å; A89-W101 HydrophobicContact CB-CG 4.24Å; A89-W101 HydrophobicContact CB-CZ2 4.39Å; A89-W101 HydrophobicContact CB-CZ3 4.42Å; F98-W101 HydrophobicContact CB-CZ2 3.67Å; F98-W101 VanDerWaalsContact CB-NE1 3.32Å; F98-W101 HydrophobicContact CD2-CH2 4.1Å; F98-W101 AromaticContact CD2-CZ2 3.57Å; F98-W101 HydrophobicContact CD2-CZ2 3.57Å; F98-W101 AromaticContact CG-CZ2 3.96Å; F98-W101 HydrophobicContact CG-CZ2 3.96Å; F98-W101 PolarHBondContact O-NE1 3.08Å
102	G	92	Very high	81.3	Confident	27 Å²	27	82.9 Å²	82.9	28%	0.278	44%	0.442	S	S	.	.			trans	-66.6	163.4	165.3	0	0	0	0	0	111.4	Y87 C88 G104	Y87-G102 WeakPolarHBondContact CD1-O 3.36Å; C88-G102 PolarHBondContact O-N 3.27Å; G102-G104 PolarHBondContact O-N 2.61Å
103	T	93.3	Very high	82.2	Confident	145 Å²	145	84.2 Å²	84.2	89%	0.89	45%	0.446	S	S	*	.			trans	-66.6	-16.1	179	51.4	0	0	0	0	113.8
104	G	94.9	Very high	83.4	Confident	21 Å²	21	87.5 Å²	87.5	22%	0.216	46%	0.455	C	S	.	.			trans	86.2	147.9	-179.6	0	0	0	0	0	113.1	Y86 Y87 G102	Y86-G104 CarbonylContact O-C 3.43Å; Y86-G104 VanDerWaalsContact O-CA 3.27Å; Y86-G104 WeakPolarHBondContact O-CA 3.5Å; Y87-G104 VanDerWaalsContact CD1-CA 3.43Å; Y87-G104 VanDerWaalsContact CE1-CA 3.49Å; G102-G104 PolarHBondContact O-N 2.61Å
105	T	97.1	Very high	85	Confident	43 Å²	43	85.8 Å²	85.8	26%	0.264	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	116.9	176	-60.6	0	0	0	0	109.5	E2 L12 Y86 V107	E2-T105 HydrophobicContact CG-CG2 4.3Å; L12-T105 HydrophobicContact CD2-CG2 3.96Å; Y86-T105 PolarHBondContact N-O 2.77Å; Y86-T105 PolarHBondContact O-N 3.44Å; T105-V107 PolarHBondContact O-N 3.44Å
106	T	97.4	Very high	86.8	Confident	63 Å²	63	80.7 Å²	80.7	39%	0.387	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	124.5	170.9	-49	0	0	0	0	109.7	A1 E2	A1-T106 CarbonylContact C-O 3.59Å; A1-T106 WeakPolarHBondContact CA-O 3.42Å; E2-T106 PolarHBondContact N-O 2.64Å
107	V	97.1	Very high	88.7	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.7	168.9	178.9	0	0	0	0	107.4	E2 V4 V10 L12 S83 A84 Y86 T105 V109	E2-V107 HydrophobicContact CB-CG2 4.31Å; E2-V107 CarbonylContact O-C 3.5Å; E2-V107 WeakPolarHBondContact O-CA 3.1Å; V4-V107 HydrophobicContact CG2-CG1 4.02Å; V10-V107 HydrophobicContact CG1-CG1 4.35Å; V10-V107 HydrophobicContact CG1-CG2 4.42Å; L12-V107 HydrophobicContact CD1-CG2 4.22Å; L12-V107 HydrophobicContact CD2-CG2 4.03Å; S83-V107 CarbonylContact C-O 3.55Å; S83-V107 VanDerWaalsContact CA-O 3.27Å; S83-V107 WeakPolarHBondContact CA-O 3.44Å; A84-V107 PolarHBondContact N-O 3.37Å; A84-V107 PolarHBondContact O-N 2.93Å; Y86-V107 HydrophobicContact CD2-CB 3.95Å; Y86-V107 HydrophobicContact CD2-CG2 3.62Å; Y86-V107 HydrophobicContact CE2-CB 3.78Å; Y86-V107 HydrophobicContact CE2-CG2 3.91Å; T105-V107 PolarHBondContact O-N 3.44Å; V107-V109 HydrophobicContact CG1-CG2 4.41Å
108	T	96.9	Very high	90.6	Very high	61 Å²	61	61.4 Å²	61.4	37%	0.374	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	126.6	177.3	-57.5	0	0	0	0	108.9	E2 L3 V4	E2-T108 PolarHBondContact O-N 3.49Å; L3-T108 WeakPolarHBondContact CA-O 3.5Å; L3-T108 HydrophobicContact CD1-CG2 3.84Å; V4-T108 PolarHBondContact N-O 2.64Å
109	V	96.3	Very high	92.1	Very high	9 Å²	9	60.7 Å²	60.7	6%	0.055	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	110.2	179.9	-168.6	0	0	0	0	108.9	V4 P6 L78 T79 D82 S83 V107	V4-V109 HydrophobicContact CG2-CB 4.43Å; V4-V109 HydrophobicContact CG2-CG2 3.85Å; V4-V109 WeakPolarHBondContact O-CA 3.34Å; P6-V109 HydrophobicContact CB-CG1 4.38Å; P6-V109 HydrophobicContact CG-CG1 4.1Å; L78-V109 HydrophobicContact CB-CG1 4.22Å; L78-V109 HydrophobicContact CB-CG2 4.05Å; L78-V109 HydrophobicContact CD1-CG2 4.48Å; T79-V109 WeakPolarHBondContact O-CB 3.43Å; T79-V109 WeakPolarHBondContact O-CG2 3.41Å; D82-V109 HydrophobicContact CB-CG2 4.2Å; S83-V109 PolarHBondContact OG-N 3.43Å; V107-V109 HydrophobicContact CG1-CG2 4.41Å
110	S	92.6	Very high	93.7	Very high	114 Å²	114	59 Å²	59	80%	0.797	37%	0.367	S	S	*	.			trans	-146	0	-177.7	67.7	0	0	0	0	112.8	L3 V4	L3-S110 WeakPolarHBondContact CD1-OG 3.43Å; V4-S110 PolarHBondContact O-N 2.98Å; V4-S110 VanDerWaalsContact O-N 3.13Å

Retrieved 110 of 110 residues in 44.5 ms (Link to these results)

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