A0A146MJ75_SCHMA Loading...

Cysteine-rich DPF motif domain-containing protein 1

AlphaFold DB , UniProt , Accession A0A146MJ75, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 95 aa.

						>A0A146MJ75_SCHMA|A0A146MJ75
MSSEIQNELFHCSVCDLKIRYDYKGDKPPFFKKDIKLLESVYCIRDPFADDNLGGIILGGDCSVCRRSVCISQDCSTYNMKRYCICCAKNEHGSS
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.5	Very low	67.8	Low	237 Å²	237	115.3 Å²	115.3	100%	1.167	61%	0.611	S	S	*	*				0	102.9	0	-71.7	-170.7	150.8	0	0	106.7	S3	M1-S3 PolarHBondContact O-N 3.45Å
2	S	44.4	Very low	70.3	Confident	123 Å²	123	105.7 Å²	105.7	86%	0.86	56%	0.56	S	S	*	*			trans	-66.7	113.2	-178.2	-47	0	0	0	0	107.8	E4	S2-E4 PolarHBondContact O-N 2.85Å
3	S	53.4	Low	72.5	Confident	111 Å²	111	100.8 Å²	100.8	78%	0.776	54%	0.54	S	S	*	.			trans	-55.4	115.8	170.2	-57.6	0	0	0	0	107.1	M1 I5	M1-S3 PolarHBondContact O-N 3.45Å; S3-I5 PolarHBondContact O-N 2.86Å
4	E	53.3	Low	74.3	Confident	177 Å²	177	97.8 Å²	97.8	83%	0.827	53%	0.526	S	S	*	.			trans	-47.7	118.8	172.2	-70	169.9	159.5	0	0	107.1	S2 Q6	S2-E4 PolarHBondContact O-N 2.85Å; E4-Q6 PolarHBondContact O-N 3.08Å
5	I	53.9	Low	75.9	Confident	145 Å²	145	95.7 Å²	95.7	74%	0.744	52%	0.522	S	S	*	.			trans	-64.8	92.8	174.9	-58.3	172.9	0	0	0	104.5	S3 N7	S3-I5 PolarHBondContact O-N 2.86Å; I5-N7 PolarHBondContact O-N 3.41Å
6	Q	56.3	Low	77.3	Confident	102 Å²	102	95.4 Å²	95.4	48%	0.477	52%	0.519	S	S	.	.			trans	-58.7	106.9	174.5	-77.2	-173.5	-84.2	0	0	105.8	E4 E8	E4-Q6 PolarHBondContact O-N 3.08Å; Q6-E8 HydrophobicContact CB-CG 4.38Å; Q6-E8 PolarHBondContact NE2-OE1 3.35Å; Q6-E8 PolarHBondContact O-N 3.01Å
7	N	66.3	Low	78.5	Confident	105 Å²	105	93.8 Å²	93.8	56%	0.561	51%	0.509	S	S	*	.			trans	-78.7	34.1	-175	-154.2	40.8	0	0	0	110.9	I5 R20	I5-N7 PolarHBondContact O-N 3.41Å; N7-R20 PolarHBondContact OD1-NH1 2.78Å
8	E	88.3	Confident	79.6	Confident	88 Å²	88	94.6 Å²	94.6	41%	0.411	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-87.7	138.7	-172.8	-66.3	-175.9	-151.4	0	0	110.2	Q6 Y21	Q6-E8 HydrophobicContact CB-CG 4.38Å; Q6-E8 PolarHBondContact NE2-OE1 3.35Å; Q6-E8 PolarHBondContact O-N 3.01Å; E8-Y21 HydrophobicContact CB-CD1 4.27Å; E8-Y21 HydrophobicContact CB-CE1 3.43Å; E8-Y21 VanDerWaalsContact CB-CE1 3.43Å; E8-Y21 WeakPolarHBondContact O-CD1 3.42Å; E8-Y21 PolarHBondContact O-N 2.95Å; E8-Y21 PolarHBondContact OE2-OH 2.9Å
9	L	95.9	Very high	80.4	Confident	100 Å²	100	92.9 Å²	92.9	52%	0.524	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	128.6	177.4	-67.2	173.1	0	0	0	109.1	R20	L9-R20 HydrophobicContact CD2-CB 4.33Å; L9-R20 HydrophobicContact CD2-CG 3.49Å; L9-R20 VanDerWaalsContact CD2-CG 3.49Å
10	F	97.1	Very high	81.1	Confident	1 Å²	1	95.8 Å²	95.8	0%	0.004	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	131.4	159	166	-103	0	0	0	107.6	C12 K18 I19 Y21 Y42 L58 C70	F10-C12 HydrophobicContact CE1-CB 4.13Å; F10-C12 HydrophobicContact CZ-CB 4.08Å; F10-K18 VanDerWaalsContact O-CA 3.27Å; F10-K18 WeakPolarHBondContact O-CA 3.34Å; F10-I19 PolarHBondContact N-O 2.95Å; F10-I19 PolarHBondContact O-N 3.19Å; F10-Y21 HydrophobicContact CB-CD1 4Å; F10-Y42 HydrophobicContact CB-CD1 4.01Å; F10-Y42 HydrophobicContact CB-CG 4.21Å; F10-Y42 AromaticContact CD2-CD1 3.79Å; F10-Y42 HydrophobicContact CD2-CD1 3.79Å; F10-Y42 AromaticContact CD2-CD2 3.48Å; F10-Y42 HydrophobicContact CD2-CD2 3.48Å; F10-Y42 VanDerWaalsContact CD2-CD2 3.48Å; F10-Y42 HydrophobicContact CD2-CE1 4.16Å; F10-Y42 AromaticContact CD2-CE2 3.91Å; F10-Y42 HydrophobicContact CD2-CE2 3.91Å; F10-Y42 AromaticContact CD2-CG 3.41Å; F10-Y42 HydrophobicContact CD2-CG 3.41Å; F10-Y42 VanDerWaalsContact CD2-CG 3.41Å; F10-Y42 AromaticContact CE2-CD2 3.79Å; F10-Y42 HydrophobicContact CE2-CD2 3.79Å; F10-Y42 HydrophobicContact CE2-CE2 4.17Å; F10-Y42 HydrophobicContact CE2-CG 4.15Å; F10-Y42 HydrophobicContact CG-CD1 4.34Å; F10-Y42 HydrophobicContact CG-CG 4.12Å; F10-L58 HydrophobicContact CB-CD1 4.18Å; F10-L58 HydrophobicContact CD1-CB 4.02Å; F10-L58 HydrophobicContact CD1-CD1 4.37Å; F10-L58 HydrophobicContact CE1-CB 4.31Å; F10-L58 HydrophobicContact CG-CB 4.39Å; F10-L58 HydrophobicContact CG-CD1 4.48Å; F10-C70 HydrophobicContact CE1-CB 3.89Å; F10-C70 HydrophobicContact CZ-CB 3.95Å
11	H	98.2	Very high	81.8	Confident	79 Å²	79	91.8 Å²	91.8	37%	0.366	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	115.3	178	175	-149.9	0	0	0	110.3	S13 D16 L17 K18 S68	H11-S13 PolarHBondContact O-N 3.16Å; H11-D16 IonicContact CD2-OD1 2.94Å; H11-D16 IonicContact CE1-OD1 3.45Å; H11-D16 PolarHBondContact CE1-OD1 3.5Å; H11-D16 IonicContact NE2-OD1 3.87Å; H11-D16 PolarHBondContact NE2-OD1 3.28Å; H11-L17 CarbonylContact C-O 3.59Å; H11-L17 WeakPolarHBondContact CA-O 3.3Å; H11-K18 HydrophobicContact CB-CG 4.18Å; H11-K18 VanDerWaalsContact CD2-CE 3.42Å; H11-K18 WeakPolarHBondContact CD2-CE 3.48Å; H11-K18 WeakPolarHBondContact NE2-CE 3.2Å; H11-S68 WeakPolarHBondContact O-CB 3.33Å
12	C	98.6	Very high	84.4	Confident	0 Å²	0	84.4 Å²	84.4	0%	0	44%	0.444	C	S	.	.			trans	-76.1	119.8	173.1	-179.2	0	0	0	0	110.7	F10 V14 C15 D16 L17 S68 C70	F10-C12 HydrophobicContact CE1-CB 4.13Å; F10-C12 HydrophobicContact CZ-CB 4.08Å; C12-V14 PolarHBondContact O-N 3.36Å; C12-V14 PolarHBondContact SG-N 3.08Å; C12-C15 VanDerWaalsContact SG-SG 3.6Å; C12-D16 VanDerWaalsContact O-CA 3.26Å; C12-D16 WeakPolarHBondContact O-CA 3.15Å; C12-D16 PolarHBondContact O-N 2.91Å; C12-L17 HydrophobicContact CB-CB 4.03Å; C12-L17 PolarHBondContact N-O 3.17Å; C12-S68 WeakPolarHBondContact CA-O 3.48Å; C12-C70 HydrophobicContact CB-CB 4.02Å; C12-C70 PolarHBondContact SG-N 2.64Å
13	S	98.3	Very high	86.8	Confident	43 Å²	43	81.5 Å²	81.5	30%	0.301	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	1.5	-180	78.9	0	0	0	0	114.9	H11 R67 S68	H11-S13 PolarHBondContact O-N 3.16Å; S13-R67 WeakPolarHBondContact OG-CB 3.42Å; S13-S68 PolarHBondContact N-O 2.97Å; S13-S68 PolarHBondContact OG-O 2.85Å
14	V	98.3	Very high	88.8	Confident	58 Å²	58	79.8 Å²	79.8	35%	0.352	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-54.6	-178	-179.3	0	0	0	0	110.5	C12 V69 C75 I85	C12-V14 PolarHBondContact O-N 3.36Å; C12-V14 PolarHBondContact SG-N 3.08Å; V14-V69 HydrophobicContact CG2-CG1 3.89Å; V14-C75 HydrophobicContact CB-CB 4.02Å; V14-C75 HydrophobicContact CG1-CB 4.27Å; V14-C75 HydrophobicContact CG2-CB 4.43Å; V14-I85 HydrophobicContact CG1-CG2 4.18Å; V14-I85 HydrophobicContact CG2-CG2 4.42Å
15	C	98.3	Very high	90.8	Very high	67 Å²	67	71.8 Å²	71.8	45%	0.453	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	4.9	-179	66.4	0	0	0	0	114.8	C12 L17 C75	C12-C15 VanDerWaalsContact SG-SG 3.6Å; C15-L17 PolarHBondContact O-N 3.39Å; C15-L17 VanDerWaalsContact O-N 3.07Å; C15-L17 VanDerWaalsContact SG-CB 3.55Å; C15-C75 VanDerWaalsContact SG-SG 3.61Å
16	D	97.9	Very high	92.8	Very high	90 Å²	90	67.8 Å²	67.8	48%	0.481	34%	0.339	S	S	.	.			trans	60.3	12.1	-176.9	-156.5	56.6	0	0	0	115.3	H11 C12 K18	H11-D16 IonicContact CD2-OD1 2.94Å; H11-D16 IonicContact CE1-OD1 3.45Å; H11-D16 PolarHBondContact CE1-OD1 3.5Å; H11-D16 IonicContact NE2-OD1 3.87Å; H11-D16 PolarHBondContact NE2-OD1 3.28Å; C12-D16 VanDerWaalsContact O-CA 3.26Å; C12-D16 WeakPolarHBondContact O-CA 3.15Å; C12-D16 PolarHBondContact O-N 2.91Å; D16-K18 WeakPolarHBondContact O-CG 3.41Å; D16-K18 PolarHBondContact O-N 3.34Å; D16-K18 WeakPolarHBondContact OD1-CE 3.47Å; D16-K18 IonicContact OD1-NZ 2.89Å; D16-K18 PolarHBondContact OD1-NZ 3.49Å; D16-K18 IonicContact OD2-NZ 2.77Å; D16-K18 PolarHBondContact OD2-NZ 2.98Å
17	L	98	Very high	94.6	Very high	68 Å²	68	68.9 Å²	68.9	36%	0.356	34%	0.342	S	S	.	.			trans	-54.1	123.3	174.9	-178.1	65.1	0	0	0	110.5	H11 C12 C15 I19 C70	H11-L17 CarbonylContact C-O 3.59Å; H11-L17 WeakPolarHBondContact CA-O 3.3Å; C12-L17 HydrophobicContact CB-CB 4.03Å; C12-L17 PolarHBondContact N-O 3.17Å; C15-L17 PolarHBondContact O-N 3.39Å; C15-L17 VanDerWaalsContact O-N 3.07Å; C15-L17 VanDerWaalsContact SG-CB 3.55Å; L17-I19 HydrophobicContact CD1-CD1 3.77Å; L17-I19 HydrophobicContact CD1-CG1 3.89Å; L17-I19 HydrophobicContact CD2-CD1 3.83Å; L17-I19 HydrophobicContact CD2-CG1 4.45Å; L17-I19 HydrophobicContact CG-CD1 3.86Å; L17-I19 HydrophobicContact CG-CG1 3.97Å; L17-C70 HydrophobicContact CD2-CB 4.13Å
18	K	97.6	Very high	95.8	Very high	109 Å²	109	64.2 Å²	64.2	47%	0.474	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	114.6	178.6	-73.4	162	-171.2	148.3	0	109.8	F10 H11 D16	F10-K18 VanDerWaalsContact O-CA 3.27Å; F10-K18 WeakPolarHBondContact O-CA 3.34Å; H11-K18 HydrophobicContact CB-CG 4.18Å; H11-K18 VanDerWaalsContact CD2-CE 3.42Å; H11-K18 WeakPolarHBondContact CD2-CE 3.48Å; H11-K18 WeakPolarHBondContact NE2-CE 3.2Å; D16-K18 WeakPolarHBondContact O-CG 3.41Å; D16-K18 PolarHBondContact O-N 3.34Å; D16-K18 WeakPolarHBondContact OD1-CE 3.47Å; D16-K18 IonicContact OD1-NZ 2.89Å; D16-K18 PolarHBondContact OD1-NZ 3.49Å; D16-K18 IonicContact OD2-NZ 2.77Å; D16-K18 PolarHBondContact OD2-NZ 2.98Å
19	I	95.3	Very high	95.8	Very high	62 Å²	62	65 Å²	65	32%	0.318	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	143.1	-179.2	-56.7	176.8	0	0	0	107.9	F10 L17 L58	F10-I19 PolarHBondContact N-O 2.95Å; F10-I19 PolarHBondContact O-N 3.19Å; L17-I19 HydrophobicContact CD1-CD1 3.77Å; L17-I19 HydrophobicContact CD1-CG1 3.89Å; L17-I19 HydrophobicContact CD2-CD1 3.83Å; L17-I19 HydrophobicContact CD2-CG1 4.45Å; L17-I19 HydrophobicContact CG-CD1 3.86Å; L17-I19 HydrophobicContact CG-CG1 3.97Å; I19-L58 HydrophobicContact CB-CD1 4.22Å; I19-L58 HydrophobicContact CD1-CD2 4.34Å; I19-L58 HydrophobicContact CG2-CD1 4.13Å; I19-L58 HydrophobicContact CG2-CD2 4.48Å
20	R	94.7	Very high	95.5	Very high	150 Å²	150	60.6 Å²	60.6	57%	0.566	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.6	142.1	170.8	-68	-177.8	-174.1	-160.1	-0.3	110.1	N7 L9 I44	N7-R20 PolarHBondContact OD1-NH1 2.78Å; L9-R20 HydrophobicContact CD2-CB 4.33Å; L9-R20 HydrophobicContact CD2-CG 3.49Å; L9-R20 VanDerWaalsContact CD2-CG 3.49Å; R20-I44 WeakPolarHBondContact O-CG2 3.47Å
21	Y	95.4	Very high	95.3	Very high	13 Å²	13	61.6 Å²	61.6	5%	0.051	31%	0.311	C	S	.	.			trans	-122.9	147.7	175.3	74.9	-87.1	0	0	0	109.9	E8 F10 Y23 K24 Y42	E8-Y21 HydrophobicContact CB-CD1 4.27Å; E8-Y21 HydrophobicContact CB-CE1 3.43Å; E8-Y21 VanDerWaalsContact CB-CE1 3.43Å; E8-Y21 WeakPolarHBondContact O-CD1 3.42Å; E8-Y21 PolarHBondContact O-N 2.95Å; E8-Y21 PolarHBondContact OE2-OH 2.9Å; F10-Y21 HydrophobicContact CB-CD1 4Å; Y21-Y23 VanDerWaalsContact CD2-C 3.43Å; Y21-Y23 WeakPolarHBondContact CD2-O 3.19Å; Y21-K24 HydrophobicContact CD2-CB 4.37Å; Y21-K24 HydrophobicContact CE2-CB 3.6Å; Y21-Y42 AromaticContact CD1-CD1 3.71Å; Y21-Y42 HydrophobicContact CD1-CD1 3.71Å; Y21-Y42 HydrophobicContact CD1-CE1 4.28Å; Y21-Y42 AromaticContact CD2-CD1 3.91Å; Y21-Y42 HydrophobicContact CD2-CD1 3.91Å; Y21-Y42 AromaticContact CE1-CD1 3.7Å; Y21-Y42 HydrophobicContact CE1-CD1 3.7Å; Y21-Y42 AromaticContact CE1-CE1 3.84Å; Y21-Y42 HydrophobicContact CE1-CE1 3.84Å; Y21-Y42 AromaticContact CE2-CD1 3.93Å; Y21-Y42 HydrophobicContact CE2-CD1 3.93Å; Y21-Y42 HydrophobicContact CE2-CE1 4.39Å; Y21-Y42 AromaticContact CG-CD1 3.79Å; Y21-Y42 HydrophobicContact CG-CD1 3.79Å; Y21-Y42 AromaticContact CZ-CD1 3.81Å; Y21-Y42 AromaticContact CZ-CE1 3.9Å
22	D	93.5	Very high	94.8	Very high	81 Å²	81	62.8 Å²	62.8	43%	0.433	32%	0.315	S	S	.	.	S	Bend	trans	-92.3	-23.5	-177.7	-62.8	-40.7	0	0	0	112.1	F30 C43 I44 R45	D22-F30 HydrophobicContact CB-CE1 3.98Å; D22-F30 HydrophobicContact CB-CZ 4.17Å; D22-C43 PolarHBondContact N-O 3.21Å; D22-I44 VanDerWaalsContact OD2-CA 3.32Å; D22-I44 WeakPolarHBondContact OD2-CA 3.43Å; D22-R45 PolarHBondContact OD2-N 2.94Å
23	Y	94.3	Very high	94.1	Very high	63 Å²	63	73.1 Å²	73.1	25%	0.247	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	140.7	-178.9	-178.6	-94.5	0	0	0	113.5	Y21 K27 P28 P29 C43	Y21-Y23 VanDerWaalsContact CD2-C 3.43Å; Y21-Y23 WeakPolarHBondContact CD2-O 3.19Å; Y23-K27 PolarHBondContact OH-O 3.13Å; Y23-P28 HydrophobicContact CD1-CB 3.65Å; Y23-P28 HydrophobicContact CD1-CG 3.75Å; Y23-P28 VanDerWaalsContact CE1-CA 3.46Å; Y23-P28 HydrophobicContact CE1-CB 4.03Å; Y23-P28 HydrophobicContact CE1-CG 3.93Å; Y23-P28 HydrophobicContact CG-CB 4.25Å; Y23-P29 HydrophobicContact CD2-CG 4.45Å; Y23-C43 PolarHBondContact N-O 3.35Å; Y23-C43 VanDerWaalsContact N-O 3.16Å; Y23-C43 PolarHBondContact O-N 2.91Å; Y23-C43 PolarHBondContact O-SG 2.72Å
24	K	96.1	Very high	93.6	Very high	75 Å²	75	77.7 Å²	77.7	33%	0.326	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	119	167.4	-175.3	-179.7	-176.8	172.9	0	110.7	Y21 V41 Y42 D61	Y21-K24 HydrophobicContact CD2-CB 4.37Å; Y21-K24 HydrophobicContact CE2-CB 3.6Å; K24-V41 VanDerWaalsContact CA-O 3.24Å; K24-V41 WeakPolarHBondContact CA-O 3.2Å; K24-Y42 HydrophobicContact CB-CD1 4.37Å; K24-Y42 HydrophobicContact CB-CE1 4.5Å; K24-Y42 HydrophobicContact CD-CD1 4.28Å; K24-Y42 HydrophobicContact CD-CE1 3.67Å; K24-Y42 HydrophobicContact CD-CE2 4.22Å; K24-Y42 WeakPolarHBondContact CE-OH 3.42Å; K24-Y42 HydrophobicContact CG-CD1 4.34Å; K24-Y42 HydrophobicContact CG-CE1 4.22Å; K24-Y42 PolarHBondContact NZ-OH 2.92Å; K24-D61 WeakPolarHBondContact CE-OD2 3.42Å; K24-D61 IonicContact NZ-OD1 2.64Å; K24-D61 IonicContact NZ-OD2 3.58Å; K24-D61 PolarHBondContact NZ-OD2 3.18Å
25	G	95.6	Very high	93.1	Very high	8 Å²	8	78.7 Å²	78.7	8%	0.082	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.6	-174.6	179.6	0	0	0	0	0	113.5	S40 V41	G25-S40 VanDerWaalsContact CA-OG 3.31Å; G25-S40 WeakPolarHBondContact CA-OG 3.16Å; G25-S40 PolarHBondContact N-OG 2.63Å; G25-V41 PolarHBondContact N-O 2.91Å; G25-V41 PolarHBondContact O-N 2.79Å
26	D	94.6	Very high	92.6	Very high	61 Å²	61	82 Å²	82	33%	0.326	39%	0.39	S	S	.	.	S	Bend	trans	-100.5	-5.9	-179	70.6	-29	0	0	0	113.7	L37	D26-L37 WeakPolarHBondContact O-CB 3.12Å; D26-L37 PolarHBondContact O-N 2.93Å
27	K	93.5	Very high	92.4	Very high	126 Å²	126	78.9 Å²	78.9	55%	0.548	37%	0.373	S	S	.	.	S	Bend	trans	-136.4	70.2	179.6	-63.7	178.5	-172.7	176.2	0	111.8	Y23	Y23-K27 PolarHBondContact OH-O 3.13Å
28	P	91.6	Very high	92.2	Very high	7 Å²	7	82.5 Å²	82.5	5%	0.045	39%	0.392	C	S	.	.			trans	-59.4	133.3	178.5	-18.9	31.2	0	0	0	111.1	Y23 F30 F31 L37 C43	Y23-P28 HydrophobicContact CD1-CB 3.65Å; Y23-P28 HydrophobicContact CD1-CG 3.75Å; Y23-P28 VanDerWaalsContact CE1-CA 3.46Å; Y23-P28 HydrophobicContact CE1-CB 4.03Å; Y23-P28 HydrophobicContact CE1-CG 3.93Å; Y23-P28 HydrophobicContact CG-CB 4.25Å; P28-F30 HydrophobicContact CB-CD2 4.38Å; P28-F30 HydrophobicContact CB-CE1 4.29Å; P28-F30 HydrophobicContact CB-CE2 4.06Å; P28-F30 HydrophobicContact CB-CZ 4.02Å; P28-F30 PolarHBondContact O-N 2.88Å; P28-F30 VanDerWaalsContact O-N 3.17Å; P28-F31 HydrophobicContact CB-CB 4.31Å; P28-F31 HydrophobicContact CB-CD1 3.7Å; P28-F31 HydrophobicContact CB-CE1 4.12Å; P28-F31 HydrophobicContact CB-CG 3.95Å; P28-F31 HydrophobicContact CG-CD1 3.99Å; P28-F31 HydrophobicContact CG-CD2 4.08Å; P28-F31 HydrophobicContact CG-CE1 4.13Å; P28-F31 HydrophobicContact CG-CE2 4.26Å; P28-F31 HydrophobicContact CG-CG 3.95Å; P28-F31 HydrophobicContact CG-CZ 4.29Å; P28-F31 PolarHBondContact O-N 3.25Å; P28-L37 HydrophobicContact CG-CD1 4.02Å; P28-C43 VanDerWaalsContact CG-SG 3.52Å
29	P	89.8	Confident	92	Very high	103 Å²	103	78.9 Å²	78.9	67%	0.669	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-15.5	-175	26.9	-34.8	0	0	0	114	Y23	Y23-P29 HydrophobicContact CD2-CG 4.45Å
30	F	89.7	Confident	92	Very high	9 Å²	9	78.6 Å²	78.6	4%	0.039	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	3.3	176.3	48.9	-95.1	0	0	0	113.1	D22 P28 C43 I44 R45 N52 L53 G54	D22-F30 HydrophobicContact CB-CE1 3.98Å; D22-F30 HydrophobicContact CB-CZ 4.17Å; P28-F30 HydrophobicContact CB-CD2 4.38Å; P28-F30 HydrophobicContact CB-CE1 4.29Å; P28-F30 HydrophobicContact CB-CE2 4.06Å; P28-F30 HydrophobicContact CB-CZ 4.02Å; P28-F30 PolarHBondContact O-N 2.88Å; P28-F30 VanDerWaalsContact O-N 3.17Å; F30-C43 HydrophobicContact CE2-CB 4.31Å; F30-C43 HydrophobicContact CZ-CB 4.31Å; F30-C43 WeakPolarHBondContact CZ-SG 3.18Å; F30-I44 WeakPolarHBondContact CE2-O 3.5Å; F30-R45 HydrophobicContact CB-CG 4.29Å; F30-R45 HydrophobicContact CD2-CB 4.25Å; F30-R45 HydrophobicContact CG-CB 4.26Å; F30-R45 HydrophobicContact CG-CG 4.4Å; F30-N52 VanDerWaalsContact O-O 3.09Å; F30-L53 CarbonylContact O-C 3.42Å; F30-L53 WeakPolarHBondContact O-CA 3.45Å; F30-G54 PolarHBondContact O-N 3.11Å
31	F	90.9	Very high	92.1	Very high	21 Å²	21	71.5 Å²	71.5	9%	0.092	35%	0.354	C	S	.	.	S	Bend	trans	-87.4	158.4	166.5	-78.8	31.4	0	0	0	108.7	P28 K33 I35 L37 C43 G55 I57	P28-F31 HydrophobicContact CB-CB 4.31Å; P28-F31 HydrophobicContact CB-CD1 3.7Å; P28-F31 HydrophobicContact CB-CE1 4.12Å; P28-F31 HydrophobicContact CB-CG 3.95Å; P28-F31 HydrophobicContact CG-CD1 3.99Å; P28-F31 HydrophobicContact CG-CD2 4.08Å; P28-F31 HydrophobicContact CG-CE1 4.13Å; P28-F31 HydrophobicContact CG-CE2 4.26Å; P28-F31 HydrophobicContact CG-CG 3.95Å; P28-F31 HydrophobicContact CG-CZ 4.29Å; P28-F31 PolarHBondContact O-N 3.25Å; F31-K33 PolarHBondContact O-N 3.3Å; F31-I35 HydrophobicContact CD2-CG2 4.25Å; F31-L37 HydrophobicContact CD2-CD1 4.37Å; F31-L37 HydrophobicContact CD2-CD2 4.33Å; F31-L37 HydrophobicContact CD2-CG 4.5Å; F31-L37 HydrophobicContact CE2-CD1 3.97Å; F31-L37 HydrophobicContact CE2-CD2 4.05Å; F31-L37 HydrophobicContact CE2-CG 4.39Å; F31-C43 HydrophobicContact CE1-CB 4.37Å; F31-C43 HydrophobicContact CZ-CB 4.34Å; F31-G55 VanDerWaalsContact CE1-CA 3.48Å; F31-I57 HydrophobicContact CE2-CD1 4.29Å; F31-I57 HydrophobicContact CE2-CG1 4.25Å; F31-I57 HydrophobicContact CZ-CD1 4.46Å; F31-I57 HydrophobicContact CZ-CG1 3.92Å
32	K	88.1	Confident	92.2	Very high	105 Å²	105	71.9 Å²	71.9	46%	0.457	36%	0.355	S	S	.	.			trans	-58.3	139.1	173	-61.6	-178.5	175.8	-179	0	110.1	D34 I35 L53	K32-D34 WeakPolarHBondContact CB-OD1 3.4Å; K32-D34 PolarHBondContact O-N 2.85Å; K32-D34 VanDerWaalsContact O-N 3.14Å; K32-I35 HydrophobicContact CB-CD1 3.89Å; K32-I35 HydrophobicContact CB-CG1 4.09Å; K32-I35 HydrophobicContact CD-CD1 4.4Å; K32-I35 HydrophobicContact CG-CD1 4.32Å; K32-I35 WeakPolarHBondContact O-CB 3.16Å; K32-I35 PolarHBondContact O-N 2.85Å; K32-L53 HydrophobicContact CG-CB 3.95Å; K32-L53 HydrophobicContact CG-CD1 4.46Å; K32-L53 HydrophobicContact CG-CD2 4.47Å
33	K	85	Confident	92.3	Very high	216 Å²	216	68 Å²	68	94%	0.939	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-22.4	-171.5	-66.6	-177.7	179.9	176.8	0	114.2	F31	F31-K33 PolarHBondContact O-N 3.3Å
34	D	88	Confident	92.3	Very high	139 Å²	139	66.9 Å²	66.9	74%	0.743	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-8.5	176.7	59.2	-23.1	0	0	0	113.1	K32	K32-D34 WeakPolarHBondContact CB-OD1 3.4Å; K32-D34 PolarHBondContact O-N 2.85Å; K32-D34 VanDerWaalsContact O-N 3.14Å
35	I	87.2	Confident	92.1	Very high	79 Å²	79	68.9 Å²	68.9	41%	0.405	34%	0.338	S	S	.	.			trans	-89.3	120.8	174.1	-61	174.7	0	0	0	109	F31 K32 L37	F31-I35 HydrophobicContact CD2-CG2 4.25Å; K32-I35 HydrophobicContact CB-CD1 3.89Å; K32-I35 HydrophobicContact CB-CG1 4.09Å; K32-I35 HydrophobicContact CD-CD1 4.4Å; K32-I35 HydrophobicContact CG-CD1 4.32Å; K32-I35 WeakPolarHBondContact O-CB 3.16Å; K32-I35 PolarHBondContact O-N 2.85Å; I35-L37 HydrophobicContact CG2-CD2 4.26Å
36	K	87.9	Confident	91.8	Very high	136 Å²	136	70.5 Å²	70.5	59%	0.591	35%	0.345	S	S	*	.			trans	-114.8	125	167.8	-177.1	-177.5	175.4	-171.7	0	109.1
37	L	93.2	Very high	91.2	Very high	25 Å²	25	72.5 Å²	72.5	13%	0.131	36%	0.361	C	S	.	.			trans	-77.2	144.9	173.6	-56.3	178.7	0	0	0	109.9	D26 P28 F31 I35 E39 V41 I57	D26-L37 WeakPolarHBondContact O-CB 3.12Å; D26-L37 PolarHBondContact O-N 2.93Å; P28-L37 HydrophobicContact CG-CD1 4.02Å; F31-L37 HydrophobicContact CD2-CD1 4.37Å; F31-L37 HydrophobicContact CD2-CD2 4.33Å; F31-L37 HydrophobicContact CD2-CG 4.5Å; F31-L37 HydrophobicContact CE2-CD1 3.97Å; F31-L37 HydrophobicContact CE2-CD2 4.05Å; F31-L37 HydrophobicContact CE2-CG 4.39Å; I35-L37 HydrophobicContact CG2-CD2 4.26Å; L37-E39 VanDerWaalsContact C-N 3.27Å; L37-E39 WeakPolarHBondContact CB-O 3.45Å; L37-V41 HydrophobicContact CD1-CB 4.44Å; L37-V41 HydrophobicContact CD1-CG1 4.25Å; L37-V41 HydrophobicContact CD1-CG2 3.34Å; L37-I57 HydrophobicContact CD1-CD1 4.3Å; L37-I57 HydrophobicContact CD2-CD1 4.15Å
38	L	93.9	Very high	90.9	Very high	144 Å²	144	75 Å²	75	75%	0.754	37%	0.372	S	S	*	.	S	Bend	trans	-84.2	-6.3	178.3	-62.4	-178.8	0	0	0	112.5	Y78	L38-Y78 WeakPolarHBondContact CB-OH 3.48Å
39	E	94.2	Very high	90.4	Very high	34 Å²	34	76 Å²	76	16%	0.159	38%	0.381	C	S	.	.	S	Bend	trans	-138.5	157.4	175.8	54.8	167	152.3	0	0	110.7	L37 V41 Y78 R82	L37-E39 VanDerWaalsContact C-N 3.27Å; L37-E39 WeakPolarHBondContact CB-O 3.45Å; E39-V41 HydrophobicContact CG-CG1 3.64Å; E39-Y78 HydrophobicContact CB-CE2 4.16Å; E39-Y78 HydrophobicContact CG-CD2 4.35Å; E39-Y78 HydrophobicContact CG-CE2 3.8Å; E39-Y78 WeakPolarHBondContact OE1-CD2 3.39Å; E39-Y78 WeakPolarHBondContact OE1-CE2 3.27Å; E39-R82 IonicContact OE1-CZ 3.65Å; E39-R82 IonicContact OE1-NE 2.73Å; E39-R82 PolarHBondContact OE1-NE 3.33Å; E39-R82 IonicContact OE1-NH2 2.72Å; E39-R82 PolarHBondContact OE1-NH2 2.77Å; E39-R82 WeakPolarHBondContact OE2-CB 3.43Å; E39-R82 IonicContact OE2-CZ 3.39Å; E39-R82 IonicContact OE2-NE 3.22Å; E39-R82 PolarHBondContact OE2-NE 2.81Å; E39-R82 IonicContact OE2-NH2 3.91Å
40	S	95	Very high	89.6	Confident	56 Å²	56	78 Å²	78	39%	0.392	39%	0.386	S	S	.	.			trans	-76.7	121.5	167.9	-179.2	0	0	0	0	109	G25	G25-S40 VanDerWaalsContact CA-OG 3.31Å; G25-S40 WeakPolarHBondContact CA-OG 3.16Å; G25-S40 PolarHBondContact N-OG 2.63Å
41	V	97	Very high	88.7	Confident	1 Å²	1	84.2 Å²	84.2	1%	0.006	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	157.2	-175.5	-56.1	0	0	0	0	111.8	K24 G25 L37 E39 C43 I57 G59	K24-V41 VanDerWaalsContact CA-O 3.24Å; K24-V41 WeakPolarHBondContact CA-O 3.2Å; G25-V41 PolarHBondContact N-O 2.91Å; G25-V41 PolarHBondContact O-N 2.79Å; L37-V41 HydrophobicContact CD1-CB 4.44Å; L37-V41 HydrophobicContact CD1-CG1 4.25Å; L37-V41 HydrophobicContact CD1-CG2 3.34Å; E39-V41 HydrophobicContact CG-CG1 3.64Å; V41-C43 HydrophobicContact CG2-CB 4.28Å; V41-I57 HydrophobicContact CB-CG2 3.89Å; V41-I57 HydrophobicContact CG1-CG2 4.01Å; V41-I57 HydrophobicContact CG2-CG1 4.25Å; V41-I57 HydrophobicContact CG2-CG2 4.21Å; V41-G59 CarbonylContact C-O 3.57Å; V41-G59 WeakPolarHBondContact CA-O 3.12Å; V41-G59 WeakPolarHBondContact CB-O 3.45Å
42	Y	97.7	Very high	87.4	Confident	20 Å²	20	87.9 Å²	87.9	8%	0.078	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	127.3	162.3	-61	-97.6	0	0	0	108.4	F10 Y21 K24 L58 G59 D61 S68	F10-Y42 HydrophobicContact CB-CD1 4.01Å; F10-Y42 HydrophobicContact CB-CG 4.21Å; F10-Y42 AromaticContact CD2-CD1 3.79Å; F10-Y42 HydrophobicContact CD2-CD1 3.79Å; F10-Y42 AromaticContact CD2-CD2 3.48Å; F10-Y42 HydrophobicContact CD2-CD2 3.48Å; F10-Y42 VanDerWaalsContact CD2-CD2 3.48Å; F10-Y42 HydrophobicContact CD2-CE1 4.16Å; F10-Y42 AromaticContact CD2-CE2 3.91Å; F10-Y42 HydrophobicContact CD2-CE2 3.91Å; F10-Y42 AromaticContact CD2-CG 3.41Å; F10-Y42 HydrophobicContact CD2-CG 3.41Å; F10-Y42 VanDerWaalsContact CD2-CG 3.41Å; F10-Y42 AromaticContact CE2-CD2 3.79Å; F10-Y42 HydrophobicContact CE2-CD2 3.79Å; F10-Y42 HydrophobicContact CE2-CE2 4.17Å; F10-Y42 HydrophobicContact CE2-CG 4.15Å; F10-Y42 HydrophobicContact CG-CD1 4.34Å; F10-Y42 HydrophobicContact CG-CG 4.12Å; Y21-Y42 AromaticContact CD1-CD1 3.71Å; Y21-Y42 HydrophobicContact CD1-CD1 3.71Å; Y21-Y42 HydrophobicContact CD1-CE1 4.28Å; Y21-Y42 AromaticContact CD2-CD1 3.91Å; Y21-Y42 HydrophobicContact CD2-CD1 3.91Å; Y21-Y42 AromaticContact CE1-CD1 3.7Å; Y21-Y42 HydrophobicContact CE1-CD1 3.7Å; Y21-Y42 AromaticContact CE1-CE1 3.84Å; Y21-Y42 HydrophobicContact CE1-CE1 3.84Å; Y21-Y42 AromaticContact CE2-CD1 3.93Å; Y21-Y42 HydrophobicContact CE2-CD1 3.93Å; Y21-Y42 HydrophobicContact CE2-CE1 4.39Å; Y21-Y42 AromaticContact CG-CD1 3.79Å; Y21-Y42 HydrophobicContact CG-CD1 3.79Å; Y21-Y42 AromaticContact CZ-CD1 3.81Å; Y21-Y42 AromaticContact CZ-CE1 3.9Å; K24-Y42 HydrophobicContact CB-CD1 4.37Å; K24-Y42 HydrophobicContact CB-CE1 4.5Å; K24-Y42 HydrophobicContact CD-CD1 4.28Å; K24-Y42 HydrophobicContact CD-CE1 3.67Å; K24-Y42 HydrophobicContact CD-CE2 4.22Å; K24-Y42 WeakPolarHBondContact CE-OH 3.42Å; K24-Y42 HydrophobicContact CG-CD1 4.34Å; K24-Y42 HydrophobicContact CG-CE1 4.22Å; K24-Y42 PolarHBondContact NZ-OH 2.92Å; Y42-L58 PolarHBondContact O-N 2.73Å; Y42-G59 PolarHBondContact N-O 3.41Å; Y42-D61 WeakPolarHBondContact CE2-OD1 3.32Å; Y42-D61 PolarHBondContact OH-OD1 3.07Å; Y42-S68 PolarHBondContact OH-OG 3.06Å; Y42-S68 VanDerWaalsContact OH-OG 3.07Å
43	C	95.3	Very high	86.6	Confident	0 Å²	0	86.8 Å²	86.8	0%	0	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	155.4	-180	56.6	0	0	0	0	112.5	D22 Y23 P28 F30 F31 V41 I56	D22-C43 PolarHBondContact N-O 3.21Å; Y23-C43 PolarHBondContact N-O 3.35Å; Y23-C43 VanDerWaalsContact N-O 3.16Å; Y23-C43 PolarHBondContact O-N 2.91Å; Y23-C43 PolarHBondContact O-SG 2.72Å; P28-C43 VanDerWaalsContact CG-SG 3.52Å; F30-C43 HydrophobicContact CE2-CB 4.31Å; F30-C43 HydrophobicContact CZ-CB 4.31Å; F30-C43 WeakPolarHBondContact CZ-SG 3.18Å; F31-C43 HydrophobicContact CE1-CB 4.37Å; F31-C43 HydrophobicContact CZ-CB 4.34Å; V41-C43 HydrophobicContact CG2-CB 4.28Å; C43-I56 CarbonylContact C-O 3.53Å; C43-I56 WeakPolarHBondContact CA-O 3.23Å; C43-I56 VanDerWaalsContact CB-O 3.31Å; C43-I56 WeakPolarHBondContact CB-O 3.24Å
44	I	93.7	Very high	86.6	Confident	39 Å²	39	77.2 Å²	77.2	20%	0.2	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	152.3	170.5	55.9	176.6	0	0	0	109.5	R20 D22 F30 G55 I56 L58	R20-I44 WeakPolarHBondContact O-CG2 3.47Å; D22-I44 VanDerWaalsContact OD2-CA 3.32Å; D22-I44 WeakPolarHBondContact OD2-CA 3.43Å; F30-I44 WeakPolarHBondContact CE2-O 3.5Å; I44-G55 CarbonylContact O-C 3.42Å; I44-G55 WeakPolarHBondContact O-CA 3.41Å; I44-I56 HydrophobicContact CD1-CB 4.19Å; I44-I56 HydrophobicContact CD1-CD1 4.12Å; I44-I56 HydrophobicContact CG1-CB 3.74Å; I44-I56 HydrophobicContact CG1-CD1 4.4Å; I44-I56 HydrophobicContact CG1-CG1 4.47Å; I44-I56 PolarHBondContact N-O 3.48Å; I44-I56 PolarHBondContact O-N 3.42Å; I44-L58 HydrophobicContact CD1-CD2 4.32Å; I44-L58 HydrophobicContact CG1-CD2 4.34Å; I44-L58 HydrophobicContact CG2-CD1 4.08Å
45	R	91.8	Very high	86.6	Confident	118 Å²	118	71.7 Å²	71.7	45%	0.445	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	135.1	165.6	-172.2	176	-57.9	-173.6	5.3	108.5	D22 F30 P47	D22-R45 PolarHBondContact OD2-N 2.94Å; F30-R45 HydrophobicContact CB-CG 4.29Å; F30-R45 HydrophobicContact CD2-CB 4.25Å; F30-R45 HydrophobicContact CG-CB 4.26Å; F30-R45 HydrophobicContact CG-CG 4.4Å; R45-P47 VanDerWaalsContact O-CD 3.3Å; R45-P47 WeakPolarHBondContact O-CD 3.31Å
46	D	88.9	Confident	86.9	Confident	41 Å²	41	71.5 Å²	71.5	22%	0.219	38%	0.377	C	S	.	.			trans	-79.9	113.8	172.8	-174.2	-12.8	0	0	0	108.5	F48 A49 G54 I56	D46-F48 PolarHBondContact O-N 3.22Å; D46-F48 WeakPolarHBondContact OD1-CA 3.47Å; D46-F48 WeakPolarHBondContact OD1-CB 3.38Å; D46-F48 PolarHBondContact OD1-N 2.98Å; D46-A49 HydrophobicContact CB-CB 3.78Å; D46-A49 PolarHBondContact O-N 3.06Å; D46-G54 PolarHBondContact N-O 2.88Å; D46-I56 HydrophobicContact CB-CD1 4.45Å; D46-I56 HydrophobicContact CB-CG1 4.27Å
47	P	82.9	Confident	87.3	Confident	103 Å²	103	67.5 Å²	67.5	67%	0.669	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-11.5	179.8	31.3	-35.3	0	0	0	112.7	R45	R45-P47 VanDerWaalsContact O-CD 3.3Å; R45-P47 WeakPolarHBondContact O-CD 3.31Å
48	F	86.4	Confident	87.5	Confident	179 Å²	179	67 Å²	67	79%	0.785	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-2	179.6	-49.8	-71.7	0	0	0	112.7	D46 D50	D46-F48 PolarHBondContact O-N 3.22Å; D46-F48 WeakPolarHBondContact OD1-CA 3.47Å; D46-F48 WeakPolarHBondContact OD1-CB 3.38Å; D46-F48 PolarHBondContact OD1-N 2.98Å; F48-D50 PolarHBondContact O-N 3.48Å
49	A	81.5	Confident	87.7	Confident	27 Å²	27	60.1 Å²	60.1	22%	0.223	32%	0.323	C	S	.	.	S	Bend	trans	-78.8	121.4	174.8	0	0	0	0	0	110.6	D46 N52	D46-A49 HydrophobicContact CB-CB 3.78Å; D46-A49 PolarHBondContact O-N 3.06Å; A49-N52 PolarHBondContact O-N 3.34Å
50	D	73.9	Confident	87.9	Confident	145 Å²	145	58.5 Å²	58.5	78%	0.775	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-56.4	147.3	170	-65.3	-39	0	0	0	110.6	F48 N52 L53	F48-D50 PolarHBondContact O-N 3.48Å; D50-N52 PolarHBondContact O-N 2.81Å; D50-N52 VanDerWaalsContact O-N 3.15Å; D50-L53 PolarHBondContact O-N 2.85Å
51	D	71.1	Confident	88	Confident	141 Å²	141	56.9 Å²	56.9	75%	0.754	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	61.5	13.3	180	-61.9	-31.3	0	0	0	117	L53	D51-L53 HydrophobicContact CB-CD1 4.18Å; D51-L53 HydrophobicContact CB-CG 4.28Å; D51-L53 WeakPolarHBondContact O-CG 3.41Å; D51-L53 PolarHBondContact O-N 3.49Å; D51-L53 VanDerWaalsContact O-N 3.13Å
52	N	63.4	Low	88.1	Confident	98 Å²	98	56.9 Å²	56.9	52%	0.524	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	56.2	21.7	-174.5	-64.1	-81.5	0	0	0	113.5	F30 A49 D50	F30-N52 VanDerWaalsContact O-O 3.09Å; A49-N52 PolarHBondContact O-N 3.34Å; D50-N52 PolarHBondContact O-N 2.81Å; D50-N52 VanDerWaalsContact O-N 3.15Å
53	L	71.5	Confident	88	Confident	81 Å²	81	58.4 Å²	58.4	42%	0.424	32%	0.315	S	S	.	.			trans	-105.7	48.6	-175.6	-71.2	177.5	0	0	0	111.7	F30 K32 D50 D51	F30-L53 CarbonylContact O-C 3.42Å; F30-L53 WeakPolarHBondContact O-CA 3.45Å; K32-L53 HydrophobicContact CG-CB 3.95Å; K32-L53 HydrophobicContact CG-CD1 4.46Å; K32-L53 HydrophobicContact CG-CD2 4.47Å; D50-L53 PolarHBondContact O-N 2.85Å; D51-L53 HydrophobicContact CB-CD1 4.18Å; D51-L53 HydrophobicContact CB-CG 4.28Å; D51-L53 WeakPolarHBondContact O-CG 3.41Å; D51-L53 PolarHBondContact O-N 3.49Å; D51-L53 VanDerWaalsContact O-N 3.13Å
54	G	83.1	Confident	88.1	Confident	15 Å²	15	62 Å²	62	16%	0.155	34%	0.337	C	S	.	.			trans	-158.7	153.2	-179.9	0	0	0	0	0	111.9	F30 D46	F30-G54 PolarHBondContact O-N 3.11Å; D46-G54 PolarHBondContact N-O 2.88Å
55	G	89.5	Confident	88.2	Confident	23 Å²	23	62.4 Å²	62.4	24%	0.237	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	163.2	169.3	0	0	0	0	0	112.5	F31 I44	F31-G55 VanDerWaalsContact CE1-CA 3.48Å; I44-G55 CarbonylContact O-C 3.42Å; I44-G55 WeakPolarHBondContact O-CA 3.41Å
56	I	93.4	Very high	88.5	Confident	75 Å²	75	65 Å²	65	39%	0.385	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	121.8	-172.5	-59.1	164.7	0	0	0	107.5	C43 I44 D46	C43-I56 CarbonylContact C-O 3.53Å; C43-I56 WeakPolarHBondContact CA-O 3.23Å; C43-I56 VanDerWaalsContact CB-O 3.31Å; C43-I56 WeakPolarHBondContact CB-O 3.24Å; I44-I56 HydrophobicContact CD1-CB 4.19Å; I44-I56 HydrophobicContact CD1-CD1 4.12Å; I44-I56 HydrophobicContact CG1-CB 3.74Å; I44-I56 HydrophobicContact CG1-CD1 4.4Å; I44-I56 HydrophobicContact CG1-CG1 4.47Å; I44-I56 PolarHBondContact N-O 3.48Å; I44-I56 PolarHBondContact O-N 3.42Å; D46-I56 HydrophobicContact CB-CD1 4.45Å; D46-I56 HydrophobicContact CB-CG1 4.27Å
57	I	95.7	Very high	88.9	Confident	52 Å²	52	68 Å²	68	27%	0.267	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	121.8	174.3	-60.6	178	0	0	0	108.5	F31 L37 V41 I71	F31-I57 HydrophobicContact CE2-CD1 4.29Å; F31-I57 HydrophobicContact CE2-CG1 4.25Å; F31-I57 HydrophobicContact CZ-CD1 4.46Å; F31-I57 HydrophobicContact CZ-CG1 3.92Å; L37-I57 HydrophobicContact CD1-CD1 4.3Å; L37-I57 HydrophobicContact CD2-CD1 4.15Å; V41-I57 HydrophobicContact CB-CG2 3.89Å; V41-I57 HydrophobicContact CG1-CG2 4.01Å; V41-I57 HydrophobicContact CG2-CG1 4.25Å; V41-I57 HydrophobicContact CG2-CG2 4.21Å; I57-I71 HydrophobicContact CG2-CG2 3.92Å; I57-I71 WeakPolarHBondContact O-CD1 3.41Å
58	L	97.3	Very high	89.7	Confident	15 Å²	15	64.3 Å²	64.3	8%	0.079	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-39	179	-57.5	-179.6	0	0	0	111.9	F10 I19 Y42 I44 C70 I71	F10-L58 HydrophobicContact CB-CD1 4.18Å; F10-L58 HydrophobicContact CD1-CB 4.02Å; F10-L58 HydrophobicContact CD1-CD1 4.37Å; F10-L58 HydrophobicContact CE1-CB 4.31Å; F10-L58 HydrophobicContact CG-CB 4.39Å; F10-L58 HydrophobicContact CG-CD1 4.48Å; I19-L58 HydrophobicContact CB-CD1 4.22Å; I19-L58 HydrophobicContact CD1-CD2 4.34Å; I19-L58 HydrophobicContact CG2-CD1 4.13Å; I19-L58 HydrophobicContact CG2-CD2 4.48Å; Y42-L58 PolarHBondContact O-N 2.73Å; I44-L58 HydrophobicContact CD1-CD2 4.32Å; I44-L58 HydrophobicContact CG1-CD2 4.34Å; I44-L58 HydrophobicContact CG2-CD1 4.08Å; L58-C70 VanDerWaalsContact O-CA 3.23Å; L58-C70 WeakPolarHBondContact O-CA 3.4Å; L58-C70 WeakPolarHBondContact O-CB 3.34Å; L58-I71 PolarHBondContact O-N 2.89Å
59	G	98.1	Very high	90.2	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.6	-170.8	-173	0	0	0	0	0	113.1	V41 Y42 V69	V41-G59 CarbonylContact C-O 3.57Å; V41-G59 WeakPolarHBondContact CA-O 3.12Å; V41-G59 WeakPolarHBondContact CB-O 3.45Å; Y42-G59 PolarHBondContact N-O 3.41Å; G59-V69 CarbonylContact C-O 3.58Å; G59-V69 WeakPolarHBondContact CA-O 3.08Å
60	G	97.7	Very high	91.1	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	-177.7	178.1	0	0	0	0	0	111.3	V69	G60-V69 PolarHBondContact N-O 2.87Å; G60-V69 PolarHBondContact O-N 2.82Å
61	D	98.4	Very high	92.2	Very high	22 Å²	22	52.4 Å²	52.4	12%	0.118	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	134.9	177.9	-64.3	-28.5	0	0	0	110.7	K24 Y42 S63 S68	K24-D61 WeakPolarHBondContact CE-OD2 3.42Å; K24-D61 IonicContact NZ-OD1 2.64Å; K24-D61 IonicContact NZ-OD2 3.58Å; K24-D61 PolarHBondContact NZ-OD2 3.18Å; Y42-D61 WeakPolarHBondContact CE2-OD1 3.32Å; Y42-D61 PolarHBondContact OH-OD1 3.07Å; D61-S63 PolarHBondContact O-N 3.06Å; D61-S68 PolarHBondContact OD1-OG 3.46Å
62	C	97.9	Very high	93.5	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.258	C	S	.	.			trans	-58.3	128.5	171.3	177.6	0	0	0	0	110.2	V64 R66 R67 R82 C84 C87	C62-V64 PolarHBondContact O-N 3.34Å; C62-R66 WeakPolarHBondContact O-CA 3.45Å; C62-R66 PolarHBondContact O-N 3.06Å; C62-R67 WeakPolarHBondContact CB-O 3.26Å; C62-R67 PolarHBondContact N-O 2.94Å; C62-R82 CarbonylContact C-O 3.59Å; C62-C84 HydrophobicContact CB-CB 4.01Å; C62-C84 PolarHBondContact SG-N 3.33Å; C62-C87 VanDerWaalsContact SG-SG 3.69Å
63	S	96.7	Very high	95	Very high	52 Å²	52	51.4 Å²	51.4	36%	0.364	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-15.4	-176.1	-64.9	0	0	0	0	113.7	D61 K81 R82	D61-S63 PolarHBondContact O-N 3.06Å; S63-K81 WeakPolarHBondContact OG-CB 3.37Å; S63-R82 WeakPolarHBondContact CB-O 3.48Å; S63-R82 PolarHBondContact N-O 3.06Å; S63-R82 PolarHBondContact OG-O 3.17Å; S63-R82 VanDerWaalsContact OG-O 3.13Å
64	V	96.3	Very high	96.3	Very high	75 Å²	75	53.7 Å²	53.7	46%	0.455	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-62	178.3	179	0	0	0	0	110.6	C62 Y83 C87	C62-V64 PolarHBondContact O-N 3.34Å; V64-Y83 HydrophobicContact CG2-CD1 3.75Å; V64-Y83 HydrophobicContact CG2-CE1 3.77Å; V64-C87 HydrophobicContact CB-CB 4.08Å; V64-C87 HydrophobicContact CG1-CB 4.46Å; V64-C87 HydrophobicContact CG2-CB 4.29Å
65	C	97	Very high	97	Very high	48 Å²	48	53.1 Å²	53.1	32%	0.324	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	1.5	-173.8	67.9	0	0	0	0	114.9	R67 C87	C65-R67 PolarHBondContact O-N 2.99Å; C65-R67 PolarHBondContact SG-NE 3.07Å; C65-C87 VanDerWaalsContact SG-SG 3.67Å
66	R	97.6	Very high	97.4	Very high	174 Å²	174	52.2 Å²	52.2	66%	0.657	27%	0.267	S	S	*	.			trans	61.5	1.3	178.6	-55.9	-62.5	-59.3	-170.4	0.6	116.5	C62	C62-R66 WeakPolarHBondContact O-CA 3.45Å; C62-R66 PolarHBondContact O-N 3.06Å
67	R	98	Very high	97.6	Very high	103 Å²	103	51.4 Å²	51.4	39%	0.389	27%	0.266	S	S	.	.			trans	-67.7	137.8	174.6	-66.9	-173.4	-70.7	170.1	-2.1	111.1	S13 C62 C65	S13-R67 WeakPolarHBondContact OG-CB 3.42Å; C62-R67 WeakPolarHBondContact CB-O 3.26Å; C62-R67 PolarHBondContact N-O 2.94Å; C65-R67 PolarHBondContact O-N 2.99Å; C65-R67 PolarHBondContact SG-NE 3.07Å
68	S	98.3	Very high	97.6	Very high	25 Å²	25	53.1 Å²	53.1	18%	0.175	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	131.1	176.9	-50.9	0	0	0	0	110.9	H11 C12 S13 Y42 D61	H11-S68 WeakPolarHBondContact O-CB 3.33Å; C12-S68 WeakPolarHBondContact CA-O 3.48Å; S13-S68 PolarHBondContact N-O 2.97Å; S13-S68 PolarHBondContact OG-O 2.85Å; Y42-S68 PolarHBondContact OH-OG 3.06Å; Y42-S68 VanDerWaalsContact OH-OG 3.07Å; D61-S68 PolarHBondContact OD1-OG 3.46Å
69	V	98.6	Very high	97.3	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	138.6	-174.7	-71.9	0	0	0	0	111.9	V14 G59 G60 R82 C84	V14-V69 HydrophobicContact CG2-CG1 3.89Å; G59-V69 CarbonylContact C-O 3.58Å; G59-V69 WeakPolarHBondContact CA-O 3.08Å; G60-V69 PolarHBondContact N-O 2.87Å; G60-V69 PolarHBondContact O-N 2.82Å; V69-R82 HydrophobicContact CG2-CG 4.04Å; V69-C84 HydrophobicContact CB-CB 4.4Å; V69-C84 HydrophobicContact CG1-CB 3.5Å; V69-C84 HydrophobicContact CG2-CB 4.23Å
70	C	98.5	Very high	97	Very high	6 Å²	6	64.5 Å²	64.5	4%	0.041	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	166.6	-176.3	71.9	0	0	0	0	111.3	F10 C12 L17 L58 S72 C75 S76	F10-C70 HydrophobicContact CE1-CB 3.89Å; F10-C70 HydrophobicContact CZ-CB 3.95Å; C12-C70 HydrophobicContact CB-CB 4.02Å; C12-C70 PolarHBondContact SG-N 2.64Å; L17-C70 HydrophobicContact CD2-CB 4.13Å; L58-C70 VanDerWaalsContact O-CA 3.23Å; L58-C70 WeakPolarHBondContact O-CA 3.4Å; L58-C70 WeakPolarHBondContact O-CB 3.34Å; C70-S72 PolarHBondContact O-N 2.58Å; C70-C75 VanDerWaalsContact SG-CB 3.56Å; C70-S76 PolarHBondContact O-OG 3.17Å
71	I	98	Very high	96.9	Very high	95 Å²	95	70.2 Å²	70.2	49%	0.487	35%	0.352	S	S	.	.	S	Bend	trans	-68.7	-7.9	-178.9	60.7	163.6	0	0	0	115.1	I57 L58 Q73	I57-I71 HydrophobicContact CG2-CG2 3.92Å; I57-I71 WeakPolarHBondContact O-CD1 3.41Å; L58-I71 PolarHBondContact O-N 2.89Å; I71-Q73 PolarHBondContact O-N 3.45Å
72	S	98	Very high	96.8	Very high	49 Å²	49	70 Å²	70	34%	0.343	35%	0.35	S	S	.	.			trans	-59.3	136.8	176.3	177.5	0	0	0	0	110.8	C70 D74 C75 S76	C70-S72 PolarHBondContact O-N 2.58Å; S72-D74 PolarHBondContact O-N 3.14Å; S72-D74 PolarHBondContact OG-N 3.46Å; S72-C75 PolarHBondContact O-N 2.99Å; S72-S76 PolarHBondContact O-N 3.07Å
73	Q	96.2	Very high	96.8	Very high	170 Å²	170	72.6 Å²	72.6	79%	0.794	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-24.4	178.3	-64.1	-178	8.1	0	0	112.5	I71 C75	I71-Q73 PolarHBondContact O-N 3.45Å; Q73-C75 PolarHBondContact O-N 2.82Å
74	D	97.9	Very high	96.9	Very high	128 Å²	128	70.1 Å²	70.1	68%	0.684	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-18.2	174.4	-60.7	-39.6	0	0	0	112.7	S72 I85	S72-D74 PolarHBondContact O-N 3.14Å; S72-D74 PolarHBondContact OG-N 3.46Å; D74-I85 WeakPolarHBondContact O-CG2 3.32Å
75	C	98.6	Very high	96.9	Very high	4 Å²	4	68.2 Å²	68.2	3%	0.027	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	-36.7	-174.5	-64.8	0	0	0	0	112.9	V14 C15 C70 S72 Q73 C84 I85	V14-C75 HydrophobicContact CB-CB 4.02Å; V14-C75 HydrophobicContact CG1-CB 4.27Å; V14-C75 HydrophobicContact CG2-CB 4.43Å; C15-C75 VanDerWaalsContact SG-SG 3.61Å; C70-C75 VanDerWaalsContact SG-CB 3.56Å; S72-C75 PolarHBondContact O-N 2.99Å; Q73-C75 PolarHBondContact O-N 2.82Å; C75-C84 CarbonylContact O-C 3.57Å; C75-C84 WeakPolarHBondContact O-CA 3.36Å; C75-I85 PolarHBondContact O-N 2.86Å
76	S	97.8	Very high	96.8	Very high	4 Å²	4	68.5 Å²	68.5	3%	0.028	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	160.3	-179.5	72.5	0	0	0	0	113.8	C70 S72 R82 Y83	C70-S76 PolarHBondContact O-OG 3.17Å; S72-S76 PolarHBondContact O-N 3.07Å; S76-R82 PolarHBondContact OG-NH1 3.32Å; S76-Y83 CarbonylContact C-O 3.59Å; S76-Y83 WeakPolarHBondContact CA-O 3.31Å; S76-Y83 WeakPolarHBondContact CB-O 3.06Å
77	T	96.8	Very high	96.8	Very high	57 Å²	57	60.7 Å²	60.7	35%	0.35	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	151.6	169.3	65.9	0	0	0	0	109	R82 Y83 A88	T77-R82 WeakPolarHBondContact O-CA 3.17Å; T77-Y83 PolarHBondContact N-O 3.47Å; T77-Y83 PolarHBondContact O-N 2.87Å; T77-A88 HydrophobicContact CG2-CB 4.46Å
78	Y	95.5	Very high	96.6	Very high	89 Å²	89	56.3 Å²	56.3	35%	0.349	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	117.7	172.9	-178.1	-93.9	0	0	0	109.5	L38 E39 M80 K81 R82	L38-Y78 WeakPolarHBondContact CB-OH 3.48Å; E39-Y78 HydrophobicContact CB-CE2 4.16Å; E39-Y78 HydrophobicContact CG-CD2 4.35Å; E39-Y78 HydrophobicContact CG-CE2 3.8Å; E39-Y78 WeakPolarHBondContact OE1-CD2 3.39Å; E39-Y78 WeakPolarHBondContact OE1-CE2 3.27Å; Y78-M80 PolarHBondContact OH-O 3.16Å; Y78-K81 WeakPolarHBondContact CA-O 3.46Å; Y78-R82 HydrophobicContact CD2-CB 4.26Å
79	N	91.2	Very high	96.4	Very high	106 Å²	106	61.7 Å²	61.7	57%	0.567	31%	0.31	S	S	*	.	S	Bend	trans	-139.9	89.3	172.3	-176.5	18.2	0	0	0	108.3	K81	N79-K81 PolarHBondContact N-O 2.98Å; N79-K81 PolarHBondContact O-N 2.78Å
80	M	92	Very high	95.9	Very high	147 Å²	147	68 Å²	68	72%	0.724	34%	0.343	S	S	*	.	S	Bend	trans	63.2	-29.4	-166.4	-50.3	-179.9	-77.3	0	0	115	Y78	Y78-M80 PolarHBondContact OH-O 3.16Å
81	K	95.1	Very high	94.6	Very high	120 Å²	120	73.8 Å²	73.8	52%	0.522	37%	0.37	S	S	.	.	S	Bend	trans	-139.4	155.9	177.9	-73.8	-176.4	-173.6	177.7	0	108.7	S63 Y78 N79 Y83	S63-K81 WeakPolarHBondContact OG-CB 3.37Å; Y78-K81 WeakPolarHBondContact CA-O 3.46Å; N79-K81 PolarHBondContact N-O 2.98Å; N79-K81 PolarHBondContact O-N 2.78Å; K81-Y83 HydrophobicContact CB-CE2 3.7Å; K81-Y83 WeakPolarHBondContact O-CD2 3.48Å; K81-Y83 WeakPolarHBondContact O-CE2 3.3Å
82	R	97.2	Very high	92.8	Very high	18 Å²	18	75.9 Å²	75.9	7%	0.068	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	136.9	174.8	-175	167.6	-61.9	-86.5	-4.7	111.3	E39 C62 S63 V69 S76 T77 Y78	E39-R82 IonicContact OE1-CZ 3.65Å; E39-R82 IonicContact OE1-NE 2.73Å; E39-R82 PolarHBondContact OE1-NE 3.33Å; E39-R82 IonicContact OE1-NH2 2.72Å; E39-R82 PolarHBondContact OE1-NH2 2.77Å; E39-R82 WeakPolarHBondContact OE2-CB 3.43Å; E39-R82 IonicContact OE2-CZ 3.39Å; E39-R82 IonicContact OE2-NE 3.22Å; E39-R82 PolarHBondContact OE2-NE 2.81Å; E39-R82 IonicContact OE2-NH2 3.91Å; C62-R82 CarbonylContact C-O 3.59Å; S63-R82 WeakPolarHBondContact CB-O 3.48Å; S63-R82 PolarHBondContact N-O 3.06Å; S63-R82 PolarHBondContact OG-O 3.17Å; S63-R82 VanDerWaalsContact OG-O 3.13Å; V69-R82 HydrophobicContact CG2-CG 4.04Å; S76-R82 PolarHBondContact OG-NH1 3.32Å; T77-R82 WeakPolarHBondContact O-CA 3.17Å; Y78-R82 HydrophobicContact CD2-CB 4.26Å
83	Y	97.4	Very high	90.7	Very high	55 Å²	55	76.1 Å²	76.1	22%	0.216	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	132.6	176.4	-59.6	-91.7	0	0	0	108.6	V64 S76 T77 K81	V64-Y83 HydrophobicContact CG2-CD1 3.75Å; V64-Y83 HydrophobicContact CG2-CE1 3.77Å; S76-Y83 CarbonylContact C-O 3.59Å; S76-Y83 WeakPolarHBondContact CA-O 3.31Å; S76-Y83 WeakPolarHBondContact CB-O 3.06Å; T77-Y83 PolarHBondContact N-O 3.47Å; T77-Y83 PolarHBondContact O-N 2.87Å; K81-Y83 HydrophobicContact CB-CE2 3.7Å; K81-Y83 WeakPolarHBondContact O-CD2 3.48Å; K81-Y83 WeakPolarHBondContact O-CE2 3.3Å
84	C	98	Very high	88.4	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	154.5	167.2	71.5	0	0	0	0	109.6	C62 V69 C75 C86 C87 A88	C62-C84 HydrophobicContact CB-CB 4.01Å; C62-C84 PolarHBondContact SG-N 3.33Å; V69-C84 HydrophobicContact CB-CB 4.4Å; V69-C84 HydrophobicContact CG1-CB 3.5Å; V69-C84 HydrophobicContact CG2-CB 4.23Å; C75-C84 CarbonylContact O-C 3.57Å; C75-C84 WeakPolarHBondContact O-CA 3.36Å; C84-C86 PolarHBondContact O-N 3.01Å; C84-C86 VanDerWaalsContact O-N 3.11Å; C84-C87 PolarHBondContact O-N 3.02Å; C84-C87 PolarHBondContact SG-N 3.22Å; C84-C87 PolarHBondContact SG-SG 2.84Å; C84-A88 PolarHBondContact O-N 2.74Å
85	I	97.1	Very high	85.7	Confident	34 Å²	34	76.2 Å²	76.2	17%	0.174	42%	0.417	C	S	.	.	H	α-helix	trans	-56.7	-33.5	-176.2	-165.3	60	0	0	0	112.7	V14 D74 C75 K89	V14-I85 HydrophobicContact CG1-CG2 4.18Å; V14-I85 HydrophobicContact CG2-CG2 4.42Å; D74-I85 WeakPolarHBondContact O-CG2 3.32Å; C75-I85 PolarHBondContact O-N 2.86Å; I85-K89 HydrophobicContact CG1-CD 4.31Å; I85-K89 WeakPolarHBondContact O-CB 3.1Å; I85-K89 VanDerWaalsContact O-CG 3.3Å; I85-K89 WeakPolarHBondContact O-CG 3.45Å; I85-K89 PolarHBondContact O-N 3.06Å; I85-K89 VanDerWaalsContact O-N 3.08Å
86	C	96	Very high	85.1	Confident	54 Å²	54	79.9 Å²	79.9	37%	0.365	44%	0.436	S	S	.	.	H	α-helix	trans	-63.2	-47.9	175.2	-51.5	0	0	0	0	111.7	C84 N90	C84-C86 PolarHBondContact O-N 3.01Å; C84-C86 VanDerWaalsContact O-N 3.11Å; C86-N90 PolarHBondContact O-N 3.05Å; C86-N90 VanDerWaalsContact O-N 3.16Å; C86-N90 PolarHBondContact O-ND2 3.5Å; C86-N90 PolarHBondContact O-OD1 3.33Å
87	C	96.7	Very high	84.4	Confident	11 Å²	11	83.8 Å²	83.8	7%	0.074	46%	0.458	C	S	.	.	H	α-helix	trans	-69.4	-40.4	179.5	-68.7	0	0	0	0	111.2	C62 V64 C65 C84 K89 N90 E91	C62-C87 VanDerWaalsContact SG-SG 3.69Å; V64-C87 HydrophobicContact CB-CB 4.08Å; V64-C87 HydrophobicContact CG1-CB 4.46Å; V64-C87 HydrophobicContact CG2-CB 4.29Å; C65-C87 VanDerWaalsContact SG-SG 3.67Å; C84-C87 PolarHBondContact O-N 3.02Å; C84-C87 PolarHBondContact SG-N 3.22Å; C84-C87 PolarHBondContact SG-SG 2.84Å; C87-K89 VanDerWaalsContact C-N 3.3Å; C87-K89 PolarHBondContact O-N 2.75Å; C87-N90 PolarHBondContact O-N 2.88Å; C87-N90 VanDerWaalsContact O-N 3.17Å; C87-E91 WeakPolarHBondContact O-CG 3.5Å; C87-E91 PolarHBondContact O-N 3.13Å
88	A	94.8	Very high	83.7	Confident	11 Å²	11	85.3 Å²	85.3	9%	0.091	46%	0.464	C	S	.	.	H	α-helix	trans	-58.9	-41.5	177.4	0	0	0	0	0	112.3	T77 C84 H92	T77-A88 HydrophobicContact CG2-CB 4.46Å; C84-A88 PolarHBondContact O-N 2.74Å; A88-H92 PolarHBondContact O-CD2 2.87Å; A88-H92 VanDerWaalsContact O-CD2 3.28Å; A88-H92 PolarHBondContact O-N 3.48Å
89	K	92.6	Very high	83	Confident	138 Å²	138	85.1 Å²	85.1	60%	0.6	47%	0.471	S	S	*	.	H	α-helix	trans	-68.5	-36.5	176.4	-72.3	176	176.9	-178.8	0	112.8	I85 C87 H92 G93	I85-K89 HydrophobicContact CG1-CD 4.31Å; I85-K89 WeakPolarHBondContact O-CB 3.1Å; I85-K89 VanDerWaalsContact O-CG 3.3Å; I85-K89 WeakPolarHBondContact O-CG 3.45Å; I85-K89 PolarHBondContact O-N 3.06Å; I85-K89 VanDerWaalsContact O-N 3.08Å; C87-K89 VanDerWaalsContact C-N 3.3Å; C87-K89 PolarHBondContact O-N 2.75Å; K89-H92 PolarHBondContact O-N 3.15Å; K89-G93 PolarHBondContact O-N 2.86Å; K89-G93 VanDerWaalsContact O-N 3.08Å
90	N	88.7	Confident	82.5	Confident	131 Å²	131	83.8 Å²	83.8	70%	0.701	47%	0.465	S	S	*	.	H	α-helix	trans	-69.9	-35.2	178.7	-67.4	-12.7	0	0	0	112.6	C86 C87 H92	C86-N90 PolarHBondContact O-N 3.05Å; C86-N90 VanDerWaalsContact O-N 3.16Å; C86-N90 PolarHBondContact O-ND2 3.5Å; C86-N90 PolarHBondContact O-OD1 3.33Å; C87-N90 PolarHBondContact O-N 2.88Å; C87-N90 VanDerWaalsContact O-N 3.17Å; N90-H92 VanDerWaalsContact C-N 3.32Å
91	E	70.4	Confident	81.9	Confident	128 Å²	128	79.6 Å²	79.6	60%	0.598	45%	0.447	S	S	*	.	H	α-helix	trans	-69	-30.7	175.9	-66.6	-70.8	153.6	0	0	112.2	C87	C87-E91 WeakPolarHBondContact O-CG 3.5Å; C87-E91 PolarHBondContact O-N 3.13Å
92	H	61.4	Low	81	Confident	140 Å²	140	76.7 Å²	76.7	65%	0.648	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	3.7	-177.8	-68.7	-55.7	0	0	0	114.8	A88 K89 N90 S94	A88-H92 PolarHBondContact O-CD2 2.87Å; A88-H92 VanDerWaalsContact O-CD2 3.28Å; A88-H92 PolarHBondContact O-N 3.48Å; K89-H92 PolarHBondContact O-N 3.15Å; N90-H92 VanDerWaalsContact C-N 3.32Å; H92-S94 PolarHBondContact O-N 3.48Å; H92-S94 PolarHBondContact O-OG 3.25Å
93	G	53.6	Low	79.7	Confident	54 Å²	54	81.2 Å²	81.2	56%	0.557	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.5	33.2	165.9	0	0	0	0	0	115.3	K89 S95	K89-G93 PolarHBondContact O-N 2.86Å; K89-G93 VanDerWaalsContact O-N 3.08Å; G93-S95 PolarHBondContact O-N 3.2Å
94	S	48.3	Very low	78.2	Confident	112 Å²	112	83.4 Å²	83.4	78%	0.783	49%	0.492	S	S	*	.			trans	-75.7	82.6	175.1	-51.1	0	0	0	0	108	H92	H92-S94 PolarHBondContact O-N 3.48Å; H92-S94 PolarHBondContact O-OG 3.25Å
95	S	41.3	Very low	76.4	Confident	188 Å²	188	91 Å²	91	100%	1.315	54%	0.537	S	S	*	.			trans	-78.7	0	159.1	-54.4	0	0	0	0	109.5	G93	G93-S95 PolarHBondContact O-N 3.2Å

Retrieved 95 of 95 residues in 237.9 ms (Link to these results)

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