A0A087XQB8_POEFO Loading...

phosphatidate phosphatase

AlphaFold DB , UniProt , Accession A0A087XQB8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 875 aa.

						>A0A087XQB8_POEFO|A0A087XQB8
MNYVGQLAGQVFVQVKELYRGLNPATLSGCIDVIVVRHPDGSLHCSPFHVRFGKMGVLRSREKVVDIEINGEPVDLHMKLGDNGEAFFVQQTNNDQEVVPSYLATSPILSDAAFSMSSPLMGKSSGPPVQILGSLGSNGESSGAVTKKRRKRRRKSRADSTRREESGDYSADEDMFSIDISSDEEAEMESSRSLSRDALQDETTVASGICSFKQAGLYTRSDGEWSPIHSRDNSRPTSPKSDSELITNHSEADSQNPAMHWAWGELPQAAAPPFLSLKPAGPHIFPVSVPVSKNTHFRAIRHETSSDQCAPSSKMQAPSLPIEEEAEVKRETPDPVTMESESMRMETQTLPSEETAACASSKTDSPSKKKDKRSRHLGSDGIYLDDITELEPEVAALYFPKSESASAMRSISDPGLHCTSLSPQSMSSGGDSGVDSYCDPISDMPSMAISLCGGLTDNKEITREQFCDKIVSFQQFAENPSIIDDPNLVVKIGSKYYNWTTAAPLVLAIQAFQKPLPKATVENIMKEKMPKKGGRWWFSWRGRNNNAKSDSVTECGACGAAEVDEMKSRLKEESSSSDEDHIAANQSSPVIQSEPGVSSGGVSYKKTLRLTSEQLLSLQLQDGPNDVVFSVTTQYQGTCRCQGTIYLWNWDDKIIISDIDGTITRSDTLGHILPTLGKDWTHQGIAQLYHKVSQNGYKFLYCSARAIGMADMTRGYLNWVNERGTMLPMGPVLLSPSSLFSALHREVIEKKPEKFKVECLTDIRHLFYPNTEPFYAAFGNRPTDVYSYKEVGVPLNRIFTVNPKGELVQEHAKTNISSYARLSEVVDHVFPLKMRSCSSDFPCSDTYSHFTYWREQLPQVEQEETTSPQTTSSGS
					

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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	41.8	Very low	38	Very low	210 Å²	210	108.4 Å²	108.4	100%	1.034	60%	0.596	S	S	*	*				0	78.8	0	-66.2	101.8	79	0	0	109.9
2	N	42.2	Very low	38.2	Very low	132 Å²	132	108.1 Å²	108.1	71%	0.706	59%	0.585	S	S	*	*			trans	-95.9	-17	-151.5	-59.4	19.6	0	0	0	115	V4 G5 Q6	N2-V4 VanDerWaalsContact C-N 3.27Å; N2-V4 PolarHBondContact O-N 3.02Å; N2-G5 PolarHBondContact O-N 3.4Å; N2-G5 VanDerWaalsContact O-N 3.11Å; N2-Q6 PolarHBondContact O-N 3.38Å
3	Y	31.3	Very low	38.7	Very low	187 Å²	187	106.1 Å²	106.1	73%	0.733	58%	0.578	S	S	*	*	H	α-helix	trans	-58.3	-34	179.5	-89.3	-87	0	0	0	113.9	G5 Q6 L7	Y3-G5 VanDerWaalsContact C-N 3.33Å; Y3-G5 PolarHBondContact O-N 3.43Å; Y3-Q6 PolarHBondContact O-N 3.23Å; Y3-L7 WeakPolarHBondContact O-CB 3.48Å; Y3-L7 PolarHBondContact O-N 3.05Å
4	V	38.3	Very low	38.9	Very low	113 Å²	113	107.1 Å²	107.1	69%	0.685	58%	0.577	S	S	*	*	H	α-helix	trans	-65.9	-36.9	178.6	-174.9	0	0	0	0	111.4	N2 A8	N2-V4 VanDerWaalsContact C-N 3.27Å; N2-V4 PolarHBondContact O-N 3.02Å; V4-A8 VanDerWaalsContact O-CB 3.3Å; V4-A8 WeakPolarHBondContact O-CB 3.34Å; V4-A8 PolarHBondContact O-N 2.94Å
5	G	33.4	Very low	39.1	Very low	52 Å²	52	100.2 Å²	100.2	54%	0.536	54%	0.54	S	S	.	.	H	α-helix	trans	-69.9	-40.6	178	0	0	0	0	0	113	N2 Y3 A8 G9	N2-G5 PolarHBondContact O-N 3.4Å; N2-G5 VanDerWaalsContact O-N 3.11Å; Y3-G5 VanDerWaalsContact C-N 3.33Å; Y3-G5 PolarHBondContact O-N 3.43Å; G5-A8 PolarHBondContact O-N 2.74Å; G5-G9 PolarHBondContact O-N 3.46Å
6	Q	38.7	Very low	39.1	Very low	130 Å²	130	102.5 Å²	102.5	61%	0.607	54%	0.544	S	S	*	.	H	α-helix	trans	-69	-40.7	176.3	-78	179.2	-44	0	0	112.4	N2 Y3 G9 Q10	N2-Q6 PolarHBondContact O-N 3.38Å; Y3-Q6 PolarHBondContact O-N 3.23Å; Q6-G9 PolarHBondContact O-N 3.41Å; Q6-Q10 PolarHBondContact O-N 3.15Å
7	L	36.4	Very low	39.3	Very low	102 Å²	102	104.2 Å²	104.2	53%	0.534	55%	0.548	S	S	.	.	H	α-helix	trans	-62.5	-44.5	172.6	-91.6	155.6	0	0	0	112	Y3 G9 Q10 V11	Y3-L7 WeakPolarHBondContact O-CB 3.48Å; Y3-L7 PolarHBondContact O-N 3.05Å; L7-G9 VanDerWaalsContact C-N 3.32Å; L7-G9 PolarHBondContact O-N 3.45Å; L7-Q10 PolarHBondContact O-N 3.13Å; L7-V11 WeakPolarHBondContact O-CG2 3.46Å; L7-V11 PolarHBondContact O-N 2.87Å
8	A	38	Very low	39.5	Very low	60 Å²	60	103.6 Å²	103.6	50%	0.496	54%	0.544	S	S	.	.	H	α-helix	trans	-59.3	-43.1	174.4	0	0	0	0	0	111.8	V4 G5 F12	V4-A8 VanDerWaalsContact O-CB 3.3Å; V4-A8 WeakPolarHBondContact O-CB 3.34Å; V4-A8 PolarHBondContact O-N 2.94Å; G5-A8 PolarHBondContact O-N 2.74Å; A8-F12 VanDerWaalsContact O-CB 3.25Å; A8-F12 WeakPolarHBondContact O-CB 3.5Å; A8-F12 PolarHBondContact O-N 3.3Å
9	G	37.5	Very low	39.6	Very low	37 Å²	37	101.5 Å²	101.5	38%	0.381	53%	0.529	S	S	.	.	H	α-helix	trans	-62.2	-47.8	176	0	0	0	0	0	113.5	G5 Q6 L7 F12 V13	G5-G9 PolarHBondContact O-N 3.46Å; Q6-G9 PolarHBondContact O-N 3.41Å; L7-G9 VanDerWaalsContact C-N 3.32Å; L7-G9 PolarHBondContact O-N 3.45Å; G9-F12 PolarHBondContact O-N 3.35Å; G9-V13 WeakPolarHBondContact O-CG2 3.38Å; G9-V13 PolarHBondContact O-N 2.7Å
10	Q	40	Very low	39.8	Very low	128 Å²	128	107.3 Å²	107.3	60%	0.598	54%	0.543	S	S	*	.	H	α-helix	trans	-63.5	-43.2	178.6	-75.4	-175.8	-59.4	0	0	112.3	Q6 L7 V13 Q14	Q6-Q10 PolarHBondContact O-N 3.15Å; L7-Q10 PolarHBondContact O-N 3.13Å; Q10-V13 PolarHBondContact O-N 3.09Å; Q10-Q14 WeakPolarHBondContact O-CG 3.39Å; Q10-Q14 PolarHBondContact O-N 2.96Å; Q10-Q14 VanDerWaalsContact O-N 3.08Å
11	V	40.7	Very low	39.8	Very low	41 Å²	41	105.3 Å²	105.3	25%	0.248	55%	0.55	C	S	.	.	H	α-helix	trans	-64.8	-45.1	176.2	174.9	0	0	0	0	110.5	L7 V13 Q14 V15 L676	L7-V11 WeakPolarHBondContact O-CG2 3.46Å; L7-V11 PolarHBondContact O-N 2.87Å; V11-V13 VanDerWaalsContact C-N 3.27Å; V11-V13 PolarHBondContact O-N 3.19Å; V11-Q14 PolarHBondContact O-N 3Å; V11-Q14 VanDerWaalsContact O-N 3.09Å; V11-V15 HydrophobicContact CG1-CG2 4.23Å; V11-V15 WeakPolarHBondContact O-CG2 3.19Å; V11-V15 PolarHBondContact O-N 3.28Å; V11-L676 HydrophobicContact CG1-CD1 3.92Å; V11-L676 HydrophobicContact CG1-CD2 3.89Å; V11-L676 HydrophobicContact CG1-CG 3.86Å
12	F	39.8	Very low	40.1	Very low	105 Å²	105	99 Å²	99	46%	0.461	52%	0.52	S	S	.	.	H	α-helix	trans	-60.6	-35.4	179.4	-164.8	-95.2	0	0	0	112.7	A8 G9 K16 L669 I672	A8-F12 VanDerWaalsContact O-CB 3.25Å; A8-F12 WeakPolarHBondContact O-CB 3.5Å; A8-F12 PolarHBondContact O-N 3.3Å; G9-F12 PolarHBondContact O-N 3.35Å; F12-K16 VanDerWaalsContact O-CB 3.28Å; F12-K16 WeakPolarHBondContact O-CB 3.23Å; F12-K16 PolarHBondContact O-N 3.2Å; F12-K16 VanDerWaalsContact O-N 3.1Å; F12-L669 HydrophobicContact CE2-CD2 4.15Å; F12-I672 HydrophobicContact CD2-CD1 4.41Å; F12-I672 HydrophobicContact CE2-CD1 3.61Å; F12-I672 HydrophobicContact CZ-CD1 4.07Å
13	V	44.6	Very low	40.6	Very low	82 Å²	82	96.6 Å²	96.6	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-65.7	-48.7	171.5	171.7	0	0	0	0	111.2	G9 Q10 V11 V15 K16 E17	G9-V13 WeakPolarHBondContact O-CG2 3.38Å; G9-V13 PolarHBondContact O-N 2.7Å; Q10-V13 PolarHBondContact O-N 3.09Å; V11-V13 VanDerWaalsContact C-N 3.27Å; V11-V13 PolarHBondContact O-N 3.19Å; V13-V15 VanDerWaalsContact C-N 3.35Å; V13-V15 PolarHBondContact O-N 3.03Å; V13-K16 WeakPolarHBondContact O-CB 3.43Å; V13-K16 PolarHBondContact O-N 2.64Å; V13-K16 VanDerWaalsContact O-N 3.14Å; V13-E17 PolarHBondContact O-N 3.08Å
14	Q	41.7	Very low	41.7	Very low	121 Å²	121	90.4 Å²	90.4	57%	0.565	49%	0.489	S	S	*	.	H	α-helix	trans	-60.9	-39.3	-179.9	-72.7	176.9	-6.2	0	0	113	Q10 V11 E17 L18	Q10-Q14 WeakPolarHBondContact O-CG 3.39Å; Q10-Q14 PolarHBondContact O-N 2.96Å; Q10-Q14 VanDerWaalsContact O-N 3.08Å; V11-Q14 PolarHBondContact O-N 3Å; V11-Q14 VanDerWaalsContact O-N 3.09Å; Q14-E17 PolarHBondContact O-N 3.1Å; Q14-L18 PolarHBondContact O-N 2.93Å
15	V	41.6	Very low	42.3	Very low	3 Å²	3	85.5 Å²	85.5	2%	0.018	46%	0.461	C	S	.	.	H	α-helix	trans	-70.8	-36.8	175.5	-169.8	0	0	0	0	111.6	V11 V13 E17 L18 Y19 I672 T675 L676	V11-V15 HydrophobicContact CG1-CG2 4.23Å; V11-V15 WeakPolarHBondContact O-CG2 3.19Å; V11-V15 PolarHBondContact O-N 3.28Å; V13-V15 VanDerWaalsContact C-N 3.35Å; V13-V15 PolarHBondContact O-N 3.03Å; V15-E17 VanDerWaalsContact C-N 3.25Å; V15-E17 PolarHBondContact O-N 3.26Å; V15-L18 WeakPolarHBondContact O-CB 3.26Å; V15-L18 PolarHBondContact O-N 3.06Å; V15-Y19 HydrophobicContact CG1-CD2 3.83Å; V15-Y19 HydrophobicContact CG1-CE2 4.02Å; V15-Y19 PolarHBondContact O-N 2.81Å; V15-I672 HydrophobicContact CB-CG2 4.03Å; V15-I672 HydrophobicContact CG1-CB 4.49Å; V15-I672 HydrophobicContact CG1-CG2 3.55Å; V15-I672 HydrophobicContact CG2-CG2 4.45Å; V15-T675 WeakPolarHBondContact CG1-OG1 3.48Å; V15-T675 VanDerWaalsContact CG2-CB 3.45Å; V15-T675 HydrophobicContact CG2-CG2 3.94Å; V15-T675 WeakPolarHBondContact CG2-OG1 3.44Å; V15-L676 HydrophobicContact CG2-CD1 3.97Å
16	K	39.3	Very low	43.7	Very low	137 Å²	137	85.4 Å²	85.4	60%	0.596	45%	0.45	S	S	*	.	H	α-helix	trans	-63.4	-32	173.7	-170.4	173	-177.2	176.4	0	111.9	F12 V13 R20	F12-K16 VanDerWaalsContact O-CB 3.28Å; F12-K16 WeakPolarHBondContact O-CB 3.23Å; F12-K16 PolarHBondContact O-N 3.2Å; F12-K16 VanDerWaalsContact O-N 3.1Å; V13-K16 WeakPolarHBondContact O-CB 3.43Å; V13-K16 PolarHBondContact O-N 2.64Å; V13-K16 VanDerWaalsContact O-N 3.14Å; K16-R20 WeakPolarHBondContact O-CB 3.49Å; K16-R20 VanDerWaalsContact O-CG 3.29Å; K16-R20 WeakPolarHBondContact O-CG 3.48Å; K16-R20 PolarHBondContact O-N 3.27Å; K16-R20 VanDerWaalsContact O-N 3.11Å
17	E	42.7	Very low	45.3	Very low	131 Å²	131	81.1 Å²	81.1	61%	0.612	43%	0.431	S	S	*	.	H	α-helix	trans	-73.8	-42.4	172.2	-70.3	-172.1	135.2	0	0	112.5	V13 Q14 V15 Y19 R20 G21	V13-E17 PolarHBondContact O-N 3.08Å; Q14-E17 PolarHBondContact O-N 3.1Å; V15-E17 VanDerWaalsContact C-N 3.25Å; V15-E17 PolarHBondContact O-N 3.26Å; E17-Y19 VanDerWaalsContact C-N 3.34Å; E17-Y19 PolarHBondContact O-N 3.43Å; E17-R20 CarbonylContact O-C 3.58Å; E17-R20 PolarHBondContact O-N 3.17Å; E17-R20 VanDerWaalsContact O-N 3.13Å; E17-G21 PolarHBondContact O-N 3.32Å
18	L	43	Very low	47.6	Very low	93 Å²	93	77.5 Å²	77.5	49%	0.487	41%	0.414	S	S	.	.	H	α-helix	trans	-53.5	-49	171.6	-87.7	158.5	0	0	0	111.8	Q14 V15 R20 G21 L22 T675	Q14-L18 PolarHBondContact O-N 2.93Å; V15-L18 WeakPolarHBondContact O-CB 3.26Å; V15-L18 PolarHBondContact O-N 3.06Å; L18-R20 PolarHBondContact O-N 3.08Å; L18-G21 PolarHBondContact O-N 3.2Å; L18-L22 WeakPolarHBondContact O-CG 3.37Å; L18-L22 PolarHBondContact O-N 2.91Å; L18-T675 HydrophobicContact CD1-CG2 3.83Å
19	Y	42.3	Very low	50	Low	65 Å²	65	74.7 Å²	74.7	26%	0.255	39%	0.391	S	S	.	.	H	α-helix	trans	-70.5	-26	177.7	-88.9	-89	0	0	0	114.3	V15 E17 H671 P674 M709 M712	V15-Y19 HydrophobicContact CG1-CD2 3.83Å; V15-Y19 HydrophobicContact CG1-CE2 4.02Å; V15-Y19 PolarHBondContact O-N 2.81Å; E17-Y19 VanDerWaalsContact C-N 3.34Å; E17-Y19 PolarHBondContact O-N 3.43Å; Y19-H671 WeakPolarHBondContact CE1-O 3.48Å; Y19-H671 WeakPolarHBondContact CE2-O 3.46Å; Y19-H671 PolarHBondContact OH-O 2.84Å; Y19-P674 HydrophobicContact CE2-CG 3.95Å; Y19-P674 VanDerWaalsContact OH-CD 3.27Å; Y19-P674 WeakPolarHBondContact OH-CD 3.47Å; Y19-M709 HydrophobicContact CE1-CE 3.92Å; Y19-M712 PolarHBondContact OH-SD 2.81Å
20	R	43.6	Very low	52.6	Low	217 Å²	217	73 Å²	73	82%	0.819	37%	0.373	S	S	*	.	H	α-helix	trans	-77.4	-21.2	170.2	-73.7	-174	81.7	-166.8	7.3	113.2	K16 E17 L18	K16-R20 WeakPolarHBondContact O-CB 3.49Å; K16-R20 VanDerWaalsContact O-CG 3.29Å; K16-R20 WeakPolarHBondContact O-CG 3.48Å; K16-R20 PolarHBondContact O-N 3.27Å; K16-R20 VanDerWaalsContact O-N 3.11Å; E17-R20 CarbonylContact O-C 3.58Å; E17-R20 PolarHBondContact O-N 3.17Å; E17-R20 VanDerWaalsContact O-N 3.13Å; L18-R20 PolarHBondContact O-N 3.08Å
21	G	38.7	Very low	55.1	Low	65 Å²	65	67.4 Å²	67.4	67%	0.67	35%	0.347	S	S	*	.	H	α-helix	trans	-79.9	-32.8	171.5	0	0	0	0	0	113.6	E17 L18 N23	E17-G21 PolarHBondContact O-N 3.32Å; L18-G21 PolarHBondContact O-N 3.2Å; G21-N23 PolarHBondContact O-N 3.26Å
22	L	48.1	Very low	57.8	Low	78 Å²	78	65.6 Å²	65.6	41%	0.408	34%	0.336	S	S	.	.			trans	-78.3	97.6	177.8	-69.6	175.8	0	0	0	111.8	L18 P24 L27	L18-L22 WeakPolarHBondContact O-CG 3.37Å; L18-L22 PolarHBondContact O-N 2.91Å; L22-P24 VanDerWaalsContact O-CD 3.31Å; L22-P24 WeakPolarHBondContact O-CD 3.5Å; L22-L27 HydrophobicContact CD2-CD2 4.41Å
23	N	53.4	Low	60.5	Low	81 Å²	81	60.7 Å²	60.7	43%	0.433	32%	0.315	S	S	.	.			trans	-73.6	118.8	171	-176.3	-6.9	0	0	0	110.7	G21 A25 T26	G21-N23 PolarHBondContact O-N 3.26Å; N23-A25 PolarHBondContact O-N 3.42Å; N23-A25 WeakPolarHBondContact OD1-CB 3.48Å; N23-A25 PolarHBondContact OD1-N 3.27Å; N23-T26 HydrophobicContact CB-CG2 4.39Å; N23-T26 PolarHBondContact O-N 2.86Å; N23-T26 PolarHBondContact O-OG1 2.92Å
24	P	53.1	Low	63.1	Low	57 Å²	57	56.8 Å²	56.8	37%	0.37	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-17.8	177.7	-23.7	35.7	0	0	0	114.1	L22 T26	L22-P24 VanDerWaalsContact O-CD 3.31Å; L22-P24 WeakPolarHBondContact O-CD 3.5Å; P24-T26 PolarHBondContact O-N 3.39Å
25	A	51.3	Low	65.7	Low	10 Å²	10	51 Å²	51	8%	0.083	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-25.9	172.1	0	0	0	0	0	113.8	N23 K54 F740	N23-A25 PolarHBondContact O-N 3.42Å; N23-A25 WeakPolarHBondContact OD1-CB 3.48Å; N23-A25 PolarHBondContact OD1-N 3.27Å; A25-K54 PolarHBondContact O-N 3.27Å; A25-F740 HydrophobicContact CB-CD2 4.36Å; A25-F740 HydrophobicContact CB-CE2 3.33Å; A25-F740 HydrophobicContact CB-CZ 3.62Å
26	T	62.2	Low	68.4	Low	50 Å²	50	50.9 Å²	50.9	31%	0.307	26%	0.264	S	S	.	.	S	Bend	trans	-109	-0.9	-170.6	60.8	0	0	0	0	113.6	N23 P24 M55	N23-T26 HydrophobicContact CB-CG2 4.39Å; N23-T26 PolarHBondContact O-N 2.86Å; N23-T26 PolarHBondContact O-OG1 2.92Å; P24-T26 PolarHBondContact O-N 3.39Å; T26-M55 HydrophobicContact CG2-CB 3.58Å; T26-M55 HydrophobicContact CG2-CE 4.13Å
27	L	72.9	Confident	71.2	Confident	41 Å²	41	48 Å²	48	22%	0.215	25%	0.249	C	C	.	.			trans	-82.9	132.8	171.9	-66.2	173	0	0	0	110.6	L22 G708 M709	L22-L27 HydrophobicContact CD2-CD2 4.41Å; L27-G708 WeakPolarHBondContact CD1-O 3.28Å; L27-M709 HydrophobicContact CD1-SD 3.63Å
28	S	84.4	Confident	73.7	Confident	25 Å²	25	42.6 Å²	42.6	18%	0.175	22%	0.224	C	C	.	.			trans	-89.9	162	165.5	-57	0	0	0	0	109.8	R51 F52 G53 C639	S28-R51 CarbonylContact C-O 3.57Å; S28-R51 VanDerWaalsContact CA-O 3.24Å; S28-R51 WeakPolarHBondContact CA-O 3.49Å; S28-F52 WeakPolarHBondContact OG-CA 3.4Å; S28-G53 PolarHBondContact OG-N 2.92Å; S28-C639 PolarHBondContact OG-SG 2.94Å
29	G	88.8	Confident	76.1	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.2	159.6	175.4	0	0	0	0	0	112.1	R51	G29-R51 PolarHBondContact N-O 3.48Å; G29-R51 PolarHBondContact O-N 3Å; G29-R51 VanDerWaalsContact O-O 3.12Å
30	C	92.6	Very high	78.5	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.007	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	157.4	168.9	63.9	0	0	0	0	111.3	H49 V50 F629 Q642 A710	C30-H49 CarbonylContact C-O 3.59Å; C30-H49 VanDerWaalsContact CA-O 3.24Å; C30-H49 WeakPolarHBondContact CA-O 3.39Å; C30-H49 WeakPolarHBondContact CB-O 3.38Å; C30-V50 HydrophobicContact CB-CB 4.24Å; C30-V50 HydrophobicContact CB-CG1 4.39Å; C30-V50 HydrophobicContact CB-CG2 3.82Å; C30-F629 HydrophobicContact CB-CD2 4.17Å; C30-F629 HydrophobicContact CB-CE2 4.12Å; C30-Q642 PolarHBondContact SG-O 3.41Å; C30-A710 WeakPolarHBondContact O-CB 3.34Å
31	I	93.2	Very high	80.8	Confident	11 Å²	11	36.5 Å²	36.5	6%	0.056	23%	0.227	C	C	.	.			trans	-89.6	141.9	172	-52.5	-172.9	0	0	0	107.9	H49 I707 V732 L733 L734 P736	I31-H49 HydrophobicContact CB-CB 4.11Å; I31-H49 HydrophobicContact CD1-CB 3.79Å; I31-H49 HydrophobicContact CG1-CB 3.84Å; I31-H49 PolarHBondContact N-O 3.44Å; I31-I707 HydrophobicContact CD1-CD1 4.44Å; I31-I707 HydrophobicContact CG1-CB 4.33Å; I31-I707 HydrophobicContact CG1-CD1 3.91Å; I31-I707 HydrophobicContact CG1-CG1 3.84Å; I31-V732 WeakPolarHBondContact CG2-O 3.25Å; I31-L733 HydrophobicContact CG2-CD2 4.26Å; I31-L734 HydrophobicContact CD1-CB 4.03Å; I31-L734 WeakPolarHBondContact CD1-O 3.33Å; I31-L734 HydrophobicContact CG1-CB 4.2Å; I31-P736 HydrophobicContact CD1-CB 4.35Å; I31-P736 HydrophobicContact CD1-CG 4Å
32	D	96.4	Very high	83.5	Confident	3 Å²	3	34.4 Å²	34.4	2%	0.016	20%	0.201	C	C	.	.			trans	-63.5	143.7	176.5	-60.7	-29.7	0	0	0	110.8	T644 Y646 R714 P731 V732	D32-T644 WeakPolarHBondContact CA-O 3.41Å; D32-T644 WeakPolarHBondContact CB-O 3.31Å; D32-T644 PolarHBondContact OD1-N 3.1Å; D32-Y646 HydrophobicContact CB-CE2 4.27Å; D32-R714 WeakPolarHBondContact OD1-CD 3.38Å; D32-R714 IonicContact OD1-NE 2.68Å; D32-R714 PolarHBondContact OD1-NE 2.68Å; D32-R714 VanDerWaalsContact OD1-NE 3.14Å; D32-R714 WeakPolarHBondContact OD2-CD 3.39Å; D32-R714 IonicContact OD2-NE 3.35Å; D32-P731 HydrophobicContact CB-CB 3.83Å; D32-V732 PolarHBondContact OD2-N 2.93Å
33	V	97	Very high	85.8	Confident	3 Å²	3	31.2 Å²	31.2	2%	0.018	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	137.1	-175.1	178.1	0	0	0	0	109.6	V35 C45 S46 F48 T644 I645 Y646	V33-V35 HydrophobicContact CG1-CG2 4.16Å; V33-C45 HydrophobicContact CG1-CB 4.26Å; V33-S46 WeakPolarHBondContact CA-OG 3.39Å; V33-F48 HydrophobicContact CG1-CD2 4.18Å; V33-F48 HydrophobicContact CG1-CE2 3.79Å; V33-F48 HydrophobicContact CG1-CZ 3.99Å; V33-F48 HydrophobicContact CG2-CD1 3.89Å; V33-F48 HydrophobicContact CG2-CD2 4.19Å; V33-F48 HydrophobicContact CG2-CE1 4.08Å; V33-F48 HydrophobicContact CG2-CE2 4.37Å; V33-F48 HydrophobicContact CG2-CG 3.94Å; V33-F48 HydrophobicContact CG2-CZ 4.32Å; V33-T644 PolarHBondContact N-O 3.47Å; V33-I645 HydrophobicContact CB-CG1 4.28Å; V33-I645 HydrophobicContact CB-CG2 4.28Å; V33-I645 HydrophobicContact CG1-CG2 4.34Å; V33-I645 CarbonylContact O-C 3.58Å; V33-I645 WeakPolarHBondContact O-CA 3.34Å; V33-Y646 PolarHBondContact O-N 3.37Å
34	I	97.9	Very high	87.8	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	125.2	171.8	-48.3	-172.4	0	0	0	107.7	V36 C45 S46 W648 L700 P731 I763 L766 F767	I34-V36 HydrophobicContact CG2-CG2 4.17Å; I34-C45 CarbonylContact O-C 3.48Å; I34-C45 VanDerWaalsContact O-CA 3.27Å; I34-C45 WeakPolarHBondContact O-CA 3.47Å; I34-S46 PolarHBondContact N-OG 3.03Å; I34-S46 PolarHBondContact O-N 2.94Å; I34-W648 HydrophobicContact CD1-CZ3 4.28Å; I34-W648 HydrophobicContact CG2-CD2 4.5Å; I34-W648 HydrophobicContact CG2-CE3 4.03Å; I34-W648 HydrophobicContact CG2-CZ3 4.37Å; I34-L700 HydrophobicContact CD1-CD1 3.66Å; I34-P731 HydrophobicContact CD1-CB 4.22Å; I34-P731 HydrophobicContact CD1-CG 3.65Å; I34-P731 HydrophobicContact CG1-CB 4.01Å; I34-P731 HydrophobicContact CG1-CG 3.8Å; I34-I763 HydrophobicContact CD1-CD1 4.04Å; I34-I763 HydrophobicContact CD1-CG1 4.47Å; I34-I763 HydrophobicContact CD1-CG2 4.15Å; I34-I763 HydrophobicContact CG1-CD1 4.45Å; I34-L766 HydrophobicContact CB-CD1 4.43Å; I34-F767 HydrophobicContact CG2-CZ 4.3Å
35	V	98	Very high	89.9	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	128.8	171.4	-175.5	0	0	0	0	107.5	V33 L43 H44 C45 L615 L620 I645 Y646 L647 W648	V33-V35 HydrophobicContact CG1-CG2 4.16Å; V35-L43 HydrophobicContact CG1-CB 4.04Å; V35-L43 HydrophobicContact CG1-CD1 4.38Å; V35-L43 HydrophobicContact CG1-CD2 4.4Å; V35-H44 CarbonylContact C-O 3.56Å; V35-H44 WeakPolarHBondContact CA-O 3.11Å; V35-C45 HydrophobicContact CG2-CB 3.93Å; V35-L615 HydrophobicContact CG1-CD1 4.47Å; V35-L615 HydrophobicContact CG1-CD2 4.45Å; V35-L615 HydrophobicContact CG2-CD2 4.11Å; V35-L620 HydrophobicContact CB-CD1 4.22Å; V35-L620 HydrophobicContact CG1-CD1 4.28Å; V35-L620 HydrophobicContact CG2-CD1 3.87Å; V35-I645 HydrophobicContact CG2-CG2 3.59Å; V35-Y646 PolarHBondContact N-O 3.19Å; V35-Y646 VanDerWaalsContact O-O 3.13Å; V35-L647 HydrophobicContact CB-CD1 4.04Å; V35-L647 HydrophobicContact CG1-CD1 3.77Å; V35-L647 WeakPolarHBondContact O-CA 3.28Å; V35-W648 PolarHBondContact O-N 2.99Å
36	V	97.8	Very high	92	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	128.4	-179.9	-172.8	0	0	0	0	109.4	I34 L43 H44 W648 W650 L766 F767	I34-V36 HydrophobicContact CG2-CG2 4.17Å; V36-L43 WeakPolarHBondContact O-CA 3.34Å; V36-H44 PolarHBondContact N-O 3.22Å; V36-H44 PolarHBondContact O-N 2.85Å; V36-H44 VanDerWaalsContact O-N 3.07Å; V36-W648 WeakPolarHBondContact CA-O 3.46Å; V36-W650 HydrophobicContact CG1-CB 4.11Å; V36-L766 HydrophobicContact CB-CB 4.34Å; V36-L766 WeakPolarHBondContact CB-O 3.43Å; V36-L766 VanDerWaalsContact CG1-O 3.25Å; V36-L766 WeakPolarHBondContact CG1-O 3.25Å; V36-L766 HydrophobicContact CG2-CB 3.67Å; V36-L766 WeakPolarHBondContact CG2-O 3.3Å; V36-F767 HydrophobicContact CB-CE1 4.46Å; V36-F767 HydrophobicContact CG1-CD1 3.89Å; V36-F767 HydrophobicContact CG1-CE1 3.93Å; V36-F767 HydrophobicContact CG1-CG 4.46Å; V36-F767 HydrophobicContact CG2-CD1 4.14Å; V36-F767 HydrophobicContact CG2-CD2 4.28Å; V36-F767 HydrophobicContact CG2-CE1 3.6Å; V36-F767 HydrophobicContact CG2-CE2 3.76Å; V36-F767 HydrophobicContact CG2-CG 4.42Å; V36-F767 HydrophobicContact CG2-CZ 3.36Å
37	R	96.9	Very high	93.5	Very high	75 Å²	75	27.3 Å²	27.3	28%	0.283	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	117.1	169.5	-174.6	-173.6	-69.8	131.7	-5.8	109.5	L43 D622 W648 N649 W650	R37-L43 HydrophobicContact CB-CD2 3.88Å; R37-L43 HydrophobicContact CG-CD2 4.12Å; R37-D622 IonicContact CZ-OD1 2.76Å; R37-D622 VanDerWaalsContact CZ-OD1 3.24Å; R37-D622 IonicContact NH1-OD1 2.72Å; R37-D622 PolarHBondContact NH1-OD1 3.36Å; R37-D622 IonicContact NH1-OD2 3.68Å; R37-D622 PolarHBondContact NH1-OD2 3.14Å; R37-D622 VanDerWaalsContact NH1-OD2 3.1Å; R37-D622 IonicContact NH2-OD1 3.74Å; R37-D622 PolarHBondContact NH2-OD1 3.14Å; R37-W648 PolarHBondContact N-O 3.07Å; R37-N649 PolarHBondContact NH1-OD1 2.9Å; R37-W650 PolarHBondContact O-N 2.99Å
38	H	95.8	Very high	94.5	Very high	19 Å²	19	25.5 Å²	25.5	9%	0.088	15%	0.147	C	C	.	.			trans	-81.9	165.5	178	-80.8	-140.6	0	0	0	112	D40 G41 S42 H44 L766 Y768	H38-D40 WeakPolarHBondContact CB-OD1 3.37Å; H38-D40 PolarHBondContact O-N 3.27Å; H38-G41 PolarHBondContact O-N 2.79Å; H38-S42 WeakPolarHBondContact CB-OG 3.39Å; H38-S42 PolarHBondContact N-O 3.18Å; H38-H44 AromaticContact CD2-CD2 3.63Å; H38-H44 AromaticContact CE1-CD2 3.39Å; H38-H44 PolarHBondContact CE1-CD2 3.2Å; H38-H44 AromaticContact CE1-CG 3.84Å; H38-H44 AromaticContact CE1-NE2 3.79Å; H38-H44 AromaticContact CG-CD2 3.86Å; H38-H44 AromaticContact ND1-CD2 3.69Å; H38-H44 AromaticContact ND1-NE2 3.98Å; H38-H44 AromaticContact NE2-CD2 3.34Å; H38-H44 PolarHBondContact NE2-CD2 3.47Å; H38-H44 VanDerWaalsContact NE2-CD2 3.34Å; H38-H44 AromaticContact NE2-CG 3.55Å; H38-L766 PolarHBondContact NE2-O 3.35Å; H38-L766 VanDerWaalsContact NE2-O 3.11Å; H38-Y768 PolarHBondContact CE1-O 3.34Å; H38-Y768 VanDerWaalsContact CE1-O 3.24Å; H38-Y768 PolarHBondContact ND1-O 2.85Å
39	P	93.4	Very high	94.9	Very high	82 Å²	82	26.7 Å²	26.7	53%	0.532	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-24.2	-179.7	-20.5	30.1	0	0	0	115	G41 W650 P769	P39-G41 VanDerWaalsContact C-N 3.31Å; P39-W650 HydrophobicContact CG-CD2 3.86Å; P39-W650 HydrophobicContact CG-CE3 4.5Å; P39-W650 HydrophobicContact CG-CG 4Å; P39-W650 HydrophobicContact CG-CZ2 4.29Å; P39-P769 HydrophobicContact CG-CG 4.03Å
40	D	93	Very high	95.1	Very high	124 Å²	124	27 Å²	27	66%	0.663	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	1.2	178.2	61.8	-1.7	0	0	0	113.3	H38 S42	H38-D40 WeakPolarHBondContact CB-OD1 3.37Å; H38-D40 PolarHBondContact O-N 3.27Å; D40-S42 VanDerWaalsContact C-N 3.28Å; D40-S42 VanDerWaalsContact OD1-CB 3.26Å; D40-S42 WeakPolarHBondContact OD1-CB 3.33Å; D40-S42 PolarHBondContact OD1-N 2.56Å; D40-S42 PolarHBondContact OD1-OG 2.94Å; D40-S42 PolarHBondContact OD2-OG 3.45Å
41	G	91.8	Very high	94.8	Very high	41 Å²	41	28 Å²	28	42%	0.423	16%	0.155	S	C	.	.	S	Bend	trans	81.5	-0.2	-175.3	0	0	0	0	0	114.6	H38 P39	H38-G41 PolarHBondContact O-N 2.79Å; P39-G41 VanDerWaalsContact C-N 3.31Å
42	S	95.3	Very high	94.5	Very high	20 Å²	20	27.5 Å²	27.5	14%	0.14	15%	0.152	C	C	.	.			trans	-69.5	153.7	172.8	69.7	0	0	0	0	111.6	H38 D40 S612	H38-S42 WeakPolarHBondContact CB-OG 3.39Å; H38-S42 PolarHBondContact N-O 3.18Å; D40-S42 VanDerWaalsContact C-N 3.28Å; D40-S42 VanDerWaalsContact OD1-CB 3.26Å; D40-S42 WeakPolarHBondContact OD1-CB 3.33Å; D40-S42 PolarHBondContact OD1-N 2.56Å; D40-S42 PolarHBondContact OD1-OG 2.94Å; D40-S42 PolarHBondContact OD2-OG 3.45Å; S42-S612 WeakPolarHBondContact CA-OG 3.48Å
43	L	96.6	Very high	93.7	Very high	11 Å²	11	27.3 Å²	27.3	6%	0.058	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	127.2	178.4	-61.8	-173.1	0	0	0	110	V35 V36 R37 S612 L615 L616 L647	V35-L43 HydrophobicContact CG1-CB 4.04Å; V35-L43 HydrophobicContact CG1-CD1 4.38Å; V35-L43 HydrophobicContact CG1-CD2 4.4Å; V36-L43 WeakPolarHBondContact O-CA 3.34Å; R37-L43 HydrophobicContact CB-CD2 3.88Å; R37-L43 HydrophobicContact CG-CD2 4.12Å; L43-S612 PolarHBondContact N-OG 2.94Å; L43-S612 WeakPolarHBondContact O-CA 3.36Å; L43-S612 WeakPolarHBondContact O-CB 3.44Å; L43-L615 HydrophobicContact CB-CB 3.77Å; L43-L615 HydrophobicContact CB-CD1 3.99Å; L43-L615 HydrophobicContact CD1-CB 3.87Å; L43-L615 HydrophobicContact CG-CB 4.47Å; L43-L615 WeakPolarHBondContact O-CD1 3.48Å; L43-L616 HydrophobicContact CD1-CD2 3.76Å; L43-L616 HydrophobicContact CD1-CG 3.95Å; L43-L616 HydrophobicContact CG-CD2 4.04Å; L43-L616 HydrophobicContact CG-CG 4.22Å; L43-L647 HydrophobicContact CD2-CD1 4.06Å
44	H	96.3	Very high	92.3	Very high	83 Å²	83	31 Å²	31	38%	0.384	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	132.1	175.3	-75.2	-102.5	0	0	0	110	V35 V36 H38 L766	V35-H44 CarbonylContact C-O 3.56Å; V35-H44 WeakPolarHBondContact CA-O 3.11Å; V36-H44 PolarHBondContact N-O 3.22Å; V36-H44 PolarHBondContact O-N 2.85Å; V36-H44 VanDerWaalsContact O-N 3.07Å; H38-H44 AromaticContact CD2-CD2 3.63Å; H38-H44 AromaticContact CE1-CD2 3.39Å; H38-H44 PolarHBondContact CE1-CD2 3.2Å; H38-H44 AromaticContact CE1-CG 3.84Å; H38-H44 AromaticContact CE1-NE2 3.79Å; H38-H44 AromaticContact CG-CD2 3.86Å; H38-H44 AromaticContact ND1-CD2 3.69Å; H38-H44 AromaticContact ND1-NE2 3.98Å; H38-H44 AromaticContact NE2-CD2 3.34Å; H38-H44 PolarHBondContact NE2-CD2 3.47Å; H38-H44 VanDerWaalsContact NE2-CD2 3.34Å; H38-H44 AromaticContact NE2-CG 3.55Å; H44-L766 HydrophobicContact CB-CD2 4.21Å
45	C	96.6	Very high	90.4	Very high	4 Å²	4	36.4 Å²	36.4	3%	0.027	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	151.7	-177.3	75.7	0	0	0	0	114	V33 I34 V35 F48 R609 L615	V33-C45 HydrophobicContact CG1-CB 4.26Å; I34-C45 CarbonylContact O-C 3.48Å; I34-C45 VanDerWaalsContact O-CA 3.27Å; I34-C45 WeakPolarHBondContact O-CA 3.47Å; V35-C45 HydrophobicContact CG2-CB 3.93Å; C45-F48 HydrophobicContact CB-CE2 4.27Å; C45-R609 PolarHBondContact O-NE 2.83Å; C45-R609 PolarHBondContact O-NH1 3.01Å; C45-L615 HydrophobicContact CB-CD1 3.76Å; C45-L615 HydrophobicContact CB-CD2 3.86Å; C45-L615 HydrophobicContact CB-CG 4.47Å
46	S	95.8	Very high	88.4	Confident	4 Å²	4	37.3 Å²	37.3	3%	0.028	20%	0.203	C	C	.	.			trans	-65.5	167.6	161.5	70	0	0	0	0	111.3	V33 I34 F48	V33-S46 WeakPolarHBondContact CA-OG 3.39Å; I34-S46 PolarHBondContact N-OG 3.03Å; I34-S46 PolarHBondContact O-N 2.94Å; S46-F48 PolarHBondContact O-N 3.15Å
47	P	93.8	Very high	86.5	Confident	25 Å²	25	38.3 Å²	38.3	16%	0.162	21%	0.209	C	C	.	.			trans	-67.1	132.4	176.8	-19.4	32.8	0	0	0	112.9	H49 L608 R609 D762	P47-H49 VanDerWaalsContact C-N 3.35Å; P47-H49 PolarHBondContact O-N 3.06Å; P47-L608 CarbonylContact C-O 3.5Å; P47-L608 WeakPolarHBondContact CA-O 3.37Å; P47-L608 HydrophobicContact CB-CB 3.91Å; P47-L608 HydrophobicContact CB-CD1 4.47Å; P47-R609 HydrophobicContact CG-CG 4.44Å; P47-D762 WeakPolarHBondContact CD-OD2 3.5Å
48	F	94.3	Very high	84.5	Confident	4 Å²	4	39.9 Å²	39.9	2%	0.018	22%	0.222	C	C	.	.			trans	-73.8	83.1	170.4	-76.2	-110.9	0	0	0	110.1	V33 C45 S46 V50 M78 F88 L608 L610 L615 F629 I645	V33-F48 HydrophobicContact CG1-CD2 4.18Å; V33-F48 HydrophobicContact CG1-CE2 3.79Å; V33-F48 HydrophobicContact CG1-CZ 3.99Å; V33-F48 HydrophobicContact CG2-CD1 3.89Å; V33-F48 HydrophobicContact CG2-CD2 4.19Å; V33-F48 HydrophobicContact CG2-CE1 4.08Å; V33-F48 HydrophobicContact CG2-CE2 4.37Å; V33-F48 HydrophobicContact CG2-CG 3.94Å; V33-F48 HydrophobicContact CG2-CZ 4.32Å; C45-F48 HydrophobicContact CB-CE2 4.27Å; S46-F48 PolarHBondContact O-N 3.15Å; F48-V50 PolarHBondContact O-N 2.94Å; F48-M78 HydrophobicContact CB-CE 4.09Å; F48-F88 HydrophobicContact CB-CE2 3.79Å; F48-F88 HydrophobicContact CB-CZ 4.45Å; F48-F88 HydrophobicContact CD1-CE2 4.08Å; F48-F88 HydrophobicContact CD1-CZ 4.02Å; F48-F88 AromaticContact CD2-CE2 3.91Å; F48-F88 HydrophobicContact CD2-CE2 3.91Å; F48-F88 HydrophobicContact CE1-CZ 4.38Å; F48-F88 AromaticContact CG-CE2 3.67Å; F48-F88 HydrophobicContact CG-CE2 3.67Å; F48-F88 HydrophobicContact CG-CZ 4.1Å; F48-L608 WeakPolarHBondContact CB-O 3.4Å; F48-L608 PolarHBondContact N-O 3.49Å; F48-L610 HydrophobicContact CE1-CD1 4.45Å; F48-L610 HydrophobicContact CE2-CD1 3.77Å; F48-L610 HydrophobicContact CE2-CG 4.06Å; F48-L610 HydrophobicContact CZ-CD1 3.7Å; F48-L610 HydrophobicContact CZ-CG 4.47Å; F48-L615 HydrophobicContact CE2-CD2 4.48Å; F48-F629 HydrophobicContact CD1-CE1 4.22Å; F48-F629 AromaticContact CD1-CZ 3.93Å; F48-F629 HydrophobicContact CD1-CZ 3.93Å; F48-F629 HydrophobicContact CE1-CZ 4.35Å; F48-I645 HydrophobicContact CE1-CD1 4.08Å; F48-I645 HydrophobicContact CZ-CD1 4.33Å
49	H	92.4	Very high	82.5	Confident	50 Å²	50	48 Å²	48	23%	0.231	25%	0.252	C	S	.	.			trans	-80.5	104.1	171.8	-68.4	-62.5	0	0	0	110.2	C30 I31 P47 I707 P736	C30-H49 CarbonylContact C-O 3.59Å; C30-H49 VanDerWaalsContact CA-O 3.24Å; C30-H49 WeakPolarHBondContact CA-O 3.39Å; C30-H49 WeakPolarHBondContact CB-O 3.38Å; I31-H49 HydrophobicContact CB-CB 4.11Å; I31-H49 HydrophobicContact CD1-CB 3.79Å; I31-H49 HydrophobicContact CG1-CB 3.84Å; I31-H49 PolarHBondContact N-O 3.44Å; P47-H49 VanDerWaalsContact C-N 3.35Å; P47-H49 PolarHBondContact O-N 3.06Å; H49-I707 HydrophobicContact CB-CD1 4.06Å; H49-I707 WeakPolarHBondContact O-CD1 3.45Å; H49-P736 HydrophobicContact CB-CB 4.49Å
50	V	91.8	Very high	80.7	Confident	6 Å²	6	45 Å²	45	4%	0.036	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	133.7	-179.3	178.4	0	0	0	0	109.3	C30 F48 F52 M78 A86 F629	C30-V50 HydrophobicContact CB-CB 4.24Å; C30-V50 HydrophobicContact CB-CG1 4.39Å; C30-V50 HydrophobicContact CB-CG2 3.82Å; F48-V50 PolarHBondContact O-N 2.94Å; V50-F52 HydrophobicContact CG1-CE2 3.78Å; V50-F52 HydrophobicContact CG1-CZ 4.29Å; V50-M78 HydrophobicContact CB-CE 4.26Å; V50-M78 HydrophobicContact CB-SD 3.99Å; V50-M78 HydrophobicContact CG1-SD 4.22Å; V50-M78 HydrophobicContact CG2-CE 4.1Å; V50-M78 HydrophobicContact CG2-SD 3.88Å; V50-A86 HydrophobicContact CB-CB 4.07Å; V50-A86 HydrophobicContact CG1-CB 4.04Å; V50-A86 PolarHBondContact O-N 2.91Å; V50-F629 HydrophobicContact CG1-CB 3.83Å; V50-F629 HydrophobicContact CG1-CD1 4.18Å; V50-F629 HydrophobicContact CG1-CD2 3.99Å; V50-F629 HydrophobicContact CG1-CG 3.73Å; V50-F629 HydrophobicContact CG2-CD1 3.94Å; V50-F629 HydrophobicContact CG2-CD2 3.76Å; V50-F629 HydrophobicContact CG2-CE1 3.79Å; V50-F629 HydrophobicContact CG2-CE2 3.59Å; V50-F629 HydrophobicContact CG2-CG 3.94Å; V50-F629 HydrophobicContact CG2-CZ 3.61Å
51	R	87.6	Confident	78.8	Confident	23 Å²	23	48 Å²	48	9%	0.087	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	137.5	-178.9	-177.6	162.9	175.1	166.4	-5.1	113.4	S28 G29 G84 I707 S738	S28-R51 CarbonylContact C-O 3.57Å; S28-R51 VanDerWaalsContact CA-O 3.24Å; S28-R51 WeakPolarHBondContact CA-O 3.49Å; G29-R51 PolarHBondContact N-O 3.48Å; G29-R51 PolarHBondContact O-N 3Å; G29-R51 VanDerWaalsContact O-O 3.12Å; R51-G84 CarbonylContact C-O 3.54Å; R51-G84 WeakPolarHBondContact CA-O 3.46Å; R51-I707 HydrophobicContact CB-CD1 4.14Å; R51-S738 WeakPolarHBondContact CD-OG 3.49Å; R51-S738 PolarHBondContact NE-OG 3.4Å
52	F	86.9	Confident	77.3	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.236	C	C	.	.			trans	-107.2	139.5	173.1	-61.8	-91.7	0	0	0	110.4	S28 V50 V57 V65 L80 G84 A86 F629 V631 C639	S28-F52 WeakPolarHBondContact OG-CA 3.4Å; V50-F52 HydrophobicContact CG1-CE2 3.78Å; V50-F52 HydrophobicContact CG1-CZ 4.29Å; F52-V57 HydrophobicContact CB-CG2 3.62Å; F52-V65 HydrophobicContact CE2-CG1 3.71Å; F52-V65 HydrophobicContact CE2-CG2 4.24Å; F52-V65 HydrophobicContact CZ-CG1 3.81Å; F52-L80 HydrophobicContact CD2-CD1 3.78Å; F52-G84 PolarHBondContact N-O 3.22Å; F52-G84 WeakPolarHBondContact O-CA 3.31Å; F52-A86 HydrophobicContact CE2-CB 4.45Å; F52-F629 HydrophobicContact CZ-CB 3.87Å; F52-V631 HydrophobicContact CD1-CB 4.35Å; F52-V631 HydrophobicContact CD1-CG2 4.02Å; F52-V631 HydrophobicContact CD2-CG2 3.83Å; F52-V631 HydrophobicContact CE1-CB 4.22Å; F52-V631 HydrophobicContact CE1-CG2 3.74Å; F52-V631 HydrophobicContact CE2-CG2 3.55Å; F52-V631 HydrophobicContact CG-CG2 4.07Å; F52-V631 HydrophobicContact CZ-CB 4.43Å; F52-V631 HydrophobicContact CZ-CG2 3.51Å; F52-C639 HydrophobicContact CD1-CB 4.17Å
53	G	78.1	Confident	76.3	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	24%	0.244	C	C	.	.			trans	-64.3	133.2	-179.5	0	0	0	0	0	112.2	S28 M55 G56	S28-G53 PolarHBondContact OG-N 2.92Å; G53-M55 PolarHBondContact O-N 3.24Å; G53-G56 PolarHBondContact O-N 3.11Å
54	K	67.5	Low	75.9	Confident	79 Å²	79	53.9 Å²	53.9	34%	0.343	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-56.1	-30.8	-171.9	-88.2	-168.6	174.6	-178.5	0	114.3	A25 G56 D82 N83	A25-K54 PolarHBondContact O-N 3.27Å; K54-G56 VanDerWaalsContact C-N 3.32Å; K54-D82 WeakPolarHBondContact CE-O 3.18Å; K54-N83 VanDerWaalsContact CE-O 3.27Å; K54-N83 WeakPolarHBondContact CE-O 3.25Å; K54-N83 PolarHBondContact NZ-OD1 2.86Å
55	M	59.4	Low	75.7	Confident	115 Å²	115	50 Å²	50	57%	0.567	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-70.3	-28.2	177.5	-171.1	158	70.6	0	0	112.7	T26 G53 Q636	T26-M55 HydrophobicContact CG2-CB 3.58Å; T26-M55 HydrophobicContact CG2-CE 4.13Å; G53-M55 PolarHBondContact O-N 3.24Å; M55-Q636 VanDerWaalsContact O-CD 3.3Å; M55-Q636 PolarHBondContact O-NE2 3.07Å; M55-Q636 PolarHBondContact O-OE1 3.25Å
56	G	56.1	Low	75.6	Confident	18 Å²	18	52.6 Å²	52.6	19%	0.186	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-86.1	1.4	179.9	0	0	0	0	0	115.6	G53 K54 Q636	G53-G56 PolarHBondContact O-N 3.11Å; K54-G56 VanDerWaalsContact C-N 3.32Å; G56-Q636 VanDerWaalsContact C-OE1 3.3Å; G56-Q636 PolarHBondContact O-OE1 2.92Å
57	V	57.8	Low	75.5	Confident	22 Å²	22	52.7 Å²	52.7	13%	0.133	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-132.5	23.5	-179	-158.5	0	0	0	0	111.4	F52 R59 L80 V631	F52-V57 HydrophobicContact CB-CG2 3.62Å; V57-R59 PolarHBondContact O-N 3.34Å; V57-L80 HydrophobicContact CB-CD2 4.45Å; V57-L80 HydrophobicContact CG1-CD2 3.35Å; V57-L80 HydrophobicContact CG1-CG 4.27Å; V57-L80 HydrophobicContact CG2-CD2 4.26Å; V57-V631 HydrophobicContact CG1-CG1 4.45Å
58	L	54.3	Low	75.7	Confident	108 Å²	108	53.5 Å²	53.5	57%	0.565	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	106.1	-177.5	-107.5	163	0	0	0	110.5
59	R	53.4	Low	75.8	Confident	188 Å²	188	53.8 Å²	53.8	71%	0.709	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.7	40.9	-179.8	-45	172.9	178	178.9	0.3	115.2	V57 Y635	V57-R59 PolarHBondContact O-N 3.34Å; R59-Y635 HydrophobicContact CB-CD2 4.49Å; R59-Y635 HydrophobicContact CB-CE2 4.14Å
60	S	55.7	Low	75.9	Confident	20 Å²	20	54.7 Å²	54.7	14%	0.14	26%	0.256	C	S	.	.			trans	-59.2	139.8	163.2	75.5	0	0	0	0	109.9	E62	S60-E62 WeakPolarHBondContact CB-O 3.24Å; S60-E62 PolarHBondContact OG-O 3.39Å
61	R	53.3	Low	76	Confident	187 Å²	187	57.2 Å²	57.2	71%	0.706	28%	0.283	S	S	*	.	S	Bend	trans	-88.1	-50.2	173.6	-64.7	-165.1	-154.5	-176.9	6.1	109.5	Q634	R61-Q634 VanDerWaalsContact CZ-OE1 3.31Å
62	E	60.8	Low	76.3	Confident	92 Å²	92	62.8 Å²	62.8	43%	0.43	31%	0.31	S	S	.	.			trans	-62.3	134.1	160.3	-56.5	84.1	-96.9	0	0	109.7	S60	S60-E62 WeakPolarHBondContact CB-O 3.24Å; S60-E62 PolarHBondContact OG-O 3.39Å
63	K	74.9	Confident	76.6	Confident	72 Å²	72	67.7 Å²	67.7	31%	0.313	34%	0.342	S	S	.	.			trans	-116.6	36.7	170	-77.6	-173.6	162.9	-169.5	0	110	K79 L80 D82	K63-K79 CarbonylContact O-C 3.59Å; K63-K79 VanDerWaalsContact O-CA 3.3Å; K63-K79 WeakPolarHBondContact O-CA 3.25Å; K63-L80 HydrophobicContact CB-CB 4.4Å; K63-L80 WeakPolarHBondContact CD-O 3.48Å; K63-L80 PolarHBondContact O-N 3.11Å; K63-D82 IonicContact NZ-OD1 2.93Å; K63-D82 PolarHBondContact NZ-OD1 3.19Å; K63-D82 IonicContact NZ-OD2 2.68Å; K63-D82 PolarHBondContact NZ-OD2 2.69Å
64	V	88.3	Confident	77.3	Confident	32 Å²	32	69 Å²	69	19%	0.194	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	147.5	-178.9	-166.2	0	0	0	0	108.4	H77 I108	V64-H77 HydrophobicContact CG1-CB 3.77Å; V64-I108 HydrophobicContact CG1-CG2 4.47Å; V64-I108 HydrophobicContact CG2-CG2 4.01Å
65	V	91.7	Very high	78.4	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	117.2	171.7	-171.3	0	0	0	0	107.2	F52 H77 M78 L80 A86 F629 S630 V631	F52-V65 HydrophobicContact CE2-CG1 3.71Å; F52-V65 HydrophobicContact CE2-CG2 4.24Å; F52-V65 HydrophobicContact CZ-CG1 3.81Å; V65-H77 WeakPolarHBondContact O-CA 3.42Å; V65-M78 HydrophobicContact CB-CB 3.81Å; V65-M78 HydrophobicContact CB-CG 4.17Å; V65-M78 HydrophobicContact CG1-CG 4.43Å; V65-M78 HydrophobicContact CG1-SD 4.45Å; V65-M78 HydrophobicContact CG2-CB 4.06Å; V65-M78 PolarHBondContact N-O 2.84Å; V65-M78 PolarHBondContact O-N 3.14Å; V65-L80 HydrophobicContact CG2-CB 4.02Å; V65-L80 HydrophobicContact CG2-CD1 4.31Å; V65-A86 HydrophobicContact CG2-CB 3.85Å; V65-F629 HydrophobicContact CG1-CB 3.99Å; V65-S630 CarbonylContact C-O 3.56Å; V65-S630 WeakPolarHBondContact CA-O 3.3Å; V65-S630 WeakPolarHBondContact CG1-O 3.37Å; V65-V631 HydrophobicContact CB-CG2 4.19Å; V65-V631 HydrophobicContact CG1-CG2 3.97Å; V65-V631 HydrophobicContact CG2-CG2 3.82Å
66	D	93.1	Very high	79.8	Confident	60 Å²	60	68.5 Å²	68.5	32%	0.321	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	150	179	-43.5	-54.5	0	0	0	109.6	F629 S630	D66-F629 WeakPolarHBondContact O-CA 3.31Å; D66-S630 PolarHBondContact N-O 2.87Å; D66-S630 PolarHBondContact O-N 2.98Å; D66-S630 PolarHBondContact OD2-OG 2.96Å
67	I	95.4	Very high	81.4	Confident	6 Å²	6	71 Å²	71	3%	0.031	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	121.3	-176.2	-48.3	-179.1	0	0	0	109.3	I69 V74 L76 M78 F88 V627 F629	I67-I69 HydrophobicContact CG2-CD1 4.45Å; I67-I69 HydrophobicContact CG2-CG1 4.09Å; I67-V74 PolarHBondContact O-N 2.84Å; I67-L76 HydrophobicContact CD1-CD2 4.4Å; I67-L76 HydrophobicContact CD1-CG 4.33Å; I67-L76 WeakPolarHBondContact CG1-O 3.29Å; I67-M78 HydrophobicContact CD1-CG 3.91Å; I67-M78 HydrophobicContact CG1-CG 4.4Å; I67-F88 HydrophobicContact CD1-CE1 3.73Å; I67-F88 HydrophobicContact CD1-CZ 4.13Å; I67-V627 HydrophobicContact CG2-CG2 3.81Å; I67-F629 HydrophobicContact CD1-CD1 4.43Å; I67-F629 HydrophobicContact CD1-CE1 4.18Å; I67-F629 HydrophobicContact CG1-CD1 4.04Å; I67-F629 HydrophobicContact CG1-CE1 4.22Å; I67-F629 HydrophobicContact CG2-CD1 4.36Å; I67-F629 HydrophobicContact CG2-CE1 4.12Å
68	E	96.1	Very high	83.1	Confident	42 Å²	42	70 Å²	70	20%	0.196	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	131.9	168.7	-55.7	167.3	171.9	0	0	108	E72 V627 V628 R640	E68-E72 CarbonylContact C-O 3.5Å; E68-E72 VanDerWaalsContact CA-O 3.3Å; E68-E72 WeakPolarHBondContact CA-O 3.27Å; E68-V627 WeakPolarHBondContact O-CA 3.39Å; E68-V628 HydrophobicContact CB-CB 4.2Å; E68-V628 PolarHBondContact N-O 3.37Å; E68-V628 PolarHBondContact O-N 2.94Å; E68-R640 VanDerWaalsContact CD-NH1 3.28Å; E68-R640 IonicContact OE1-CZ 3.14Å; E68-R640 VanDerWaalsContact OE1-CZ 3.23Å; E68-R640 IonicContact OE1-NH1 2.68Å; E68-R640 PolarHBondContact OE1-NH1 3.28Å; E68-R640 IonicContact OE1-NH2 2.91Å; E68-R640 PolarHBondContact OE1-NH2 3.22Å; E68-R640 IonicContact OE2-CZ 2.68Å; E68-R640 IonicContact OE2-NH1 2.88Å; E68-R640 PolarHBondContact OE2-NH1 2.89Å; E68-R640 IonicContact OE2-NH2 2.58Å
69	I	96.3	Very high	84.8	Confident	9 Å²	9	66 Å²	66	5%	0.046	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	128.3	175.5	-62.9	-178.5	0	0	0	109	I67 G71 E72 V74 L618 L620 N625 D626 V627 I645	I67-I69 HydrophobicContact CG2-CD1 4.45Å; I67-I69 HydrophobicContact CG2-CG1 4.09Å; I69-G71 PolarHBondContact O-N 3.05Å; I69-E72 PolarHBondContact N-O 3.07Å; I69-E72 PolarHBondContact O-N 3.02Å; I69-V74 HydrophobicContact CB-CG2 4.15Å; I69-V74 HydrophobicContact CD1-CG2 3.96Å; I69-V74 HydrophobicContact CG1-CG2 3.91Å; I69-L618 HydrophobicContact CD1-CB 3.93Å; I69-L618 HydrophobicContact CD1-CD1 3.86Å; I69-L618 HydrophobicContact CD1-CD2 3.87Å; I69-L618 HydrophobicContact CD1-CG 4.08Å; I69-L620 HydrophobicContact CD1-CD2 4.49Å; I69-L620 HydrophobicContact CG2-CD2 4.11Å; I69-N625 HydrophobicContact CG2-CB 4.43Å; I69-D626 CarbonylContact C-O 3.58Å; I69-D626 WeakPolarHBondContact CA-O 3.39Å; I69-V627 HydrophobicContact CG1-CB 4.47Å; I69-V627 HydrophobicContact CG1-CG2 4.08Å; I69-I645 HydrophobicContact CD1-CD1 3.99Å; I69-I645 HydrophobicContact CG1-CD1 4.49Å
70	N	95.4	Very high	86.5	Confident	70 Å²	70	57.1 Å²	57.1	37%	0.374	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	21.5	-174.4	-61.3	-37.1	0	0	0	114.2	N625 D626	N70-N625 PolarHBondContact ND2-OD1 3.4Å; N70-N625 VanDerWaalsContact OD1-CA 3.24Å; N70-N625 WeakPolarHBondContact OD1-CA 3.3Å; N70-N625 WeakPolarHBondContact OD1-CB 3.1Å; N70-D626 PolarHBondContact N-O 3.03Å; N70-D626 PolarHBondContact OD1-N 2.88Å
71	G	93.1	Very high	87.7	Confident	58 Å²	58	56.7 Å²	56.7	60%	0.598	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.5	-13.1	-176.4	0	0	0	0	0	115.4	I69	I69-G71 PolarHBondContact O-N 3.05Å
72	E	94.6	Very high	88.8	Confident	140 Å²	140	54 Å²	54	65%	0.654	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	136.9	-179	-65	-61.8	153.6	0	0	111.6	E68 I69	E68-E72 CarbonylContact C-O 3.5Å; E68-E72 VanDerWaalsContact CA-O 3.3Å; E68-E72 WeakPolarHBondContact CA-O 3.27Å; I69-E72 PolarHBondContact N-O 3.07Å; I69-E72 PolarHBondContact O-N 3.02Å
73	P	93.1	Very high	89.4	Confident	104 Å²	104	52.9 Å²	52.9	68%	0.675	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	140.1	178.3	31.3	-34.5	0	0	0	112
74	V	93.3	Very high	89.7	Confident	27 Å²	27	49.6 Å²	49.6	16%	0.164	28%	0.281	C	S	.	.			trans	-105.9	142	-178.3	-172.7	0	0	0	0	111.2	I67 I69 L76 L618	I67-V74 PolarHBondContact O-N 2.84Å; I69-V74 HydrophobicContact CB-CG2 4.15Å; I69-V74 HydrophobicContact CD1-CG2 3.96Å; I69-V74 HydrophobicContact CG1-CG2 3.91Å; V74-L76 HydrophobicContact CG1-CB 3.78Å; V74-L76 PolarHBondContact O-N 2.91Å; V74-L618 HydrophobicContact CG1-CD2 3.78Å
75	D	89.5	Confident	89.6	Confident	161 Å²	161	51.6 Å²	51.6	86%	0.861	29%	0.288	S	S	*	.	S	Bend	trans	-74.1	53.7	169.6	-167.4	24.5	0	0	0	111.8
76	L	90.3	Very high	89.5	Confident	22 Å²	22	51.8 Å²	51.8	12%	0.115	29%	0.289	C	S	.	.			trans	-149.6	128.3	179.4	-176.7	69.3	0	0	0	108.3	I67 V74 F88 L610 L618	I67-L76 HydrophobicContact CD1-CD2 4.4Å; I67-L76 HydrophobicContact CD1-CG 4.33Å; I67-L76 WeakPolarHBondContact CG1-O 3.29Å; V74-L76 HydrophobicContact CG1-CB 3.78Å; V74-L76 PolarHBondContact O-N 2.91Å; L76-F88 HydrophobicContact CD1-CD1 4.43Å; L76-F88 HydrophobicContact CD1-CE1 4.43Å; L76-F88 HydrophobicContact CD2-CE1 3.91Å; L76-F88 HydrophobicContact CD2-CZ 4.4Å; L76-F88 HydrophobicContact CG-CD1 4.41Å; L76-F88 HydrophobicContact CG-CE1 3.96Å; L76-L610 HydrophobicContact CD1-CD2 4.29Å; L76-L610 HydrophobicContact CD2-CD1 3.66Å; L76-L610 HydrophobicContact CD2-CD2 3.84Å; L76-L610 HydrophobicContact CD2-CG 4.42Å; L76-L618 HydrophobicContact CD2-CD2 3.9Å
77	H	90.1	Very high	89.5	Confident	72 Å²	72	49.6 Å²	49.6	33%	0.333	28%	0.277	S	S	.	.			trans	-129.5	142.4	-174.6	-54.1	-19.9	0	0	0	110.9	V64 V65 I108	V64-H77 HydrophobicContact CG1-CB 3.77Å; V65-H77 WeakPolarHBondContact O-CA 3.42Å; H77-I108 HydrophobicContact CB-CD1 4.25Å
78	M	92.8	Very high	89.3	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	163.8	166.5	-29.6	-179.1	77.2	0	0	110.1	F48 V50 V65 I67 A86 F88 F629	F48-M78 HydrophobicContact CB-CE 4.09Å; V50-M78 HydrophobicContact CB-CE 4.26Å; V50-M78 HydrophobicContact CB-SD 3.99Å; V50-M78 HydrophobicContact CG1-SD 4.22Å; V50-M78 HydrophobicContact CG2-CE 4.1Å; V50-M78 HydrophobicContact CG2-SD 3.88Å; V65-M78 HydrophobicContact CB-CB 3.81Å; V65-M78 HydrophobicContact CB-CG 4.17Å; V65-M78 HydrophobicContact CG1-CG 4.43Å; V65-M78 HydrophobicContact CG1-SD 4.45Å; V65-M78 HydrophobicContact CG2-CB 4.06Å; V65-M78 PolarHBondContact N-O 2.84Å; V65-M78 PolarHBondContact O-N 3.14Å; I67-M78 HydrophobicContact CD1-CG 3.91Å; I67-M78 HydrophobicContact CG1-CG 4.4Å; M78-A86 HydrophobicContact CB-CB 4.14Å; M78-A86 HydrophobicContact CE-CB 4.15Å; M78-A86 HydrophobicContact SD-CB 3.77Å; M78-F88 HydrophobicContact CB-CD1 4.44Å; M78-F88 HydrophobicContact CE-CD2 4.22Å; M78-F88 HydrophobicContact CE-CE1 4.38Å; M78-F88 HydrophobicContact CE-CE2 3.87Å; M78-F88 HydrophobicContact CE-CZ 3.95Å; M78-F88 HydrophobicContact CG-CD1 4.1Å; M78-F88 HydrophobicContact CG-CE1 3.71Å; M78-F88 HydrophobicContact CG-CZ 4.11Å; M78-F88 HydrophobicContact SD-CZ 4.5Å; M78-F629 HydrophobicContact SD-CD1 3.72Å; M78-F629 HydrophobicContact SD-CE1 3.85Å
79	K	89.9	Confident	88.9	Confident	23 Å²	23	49.2 Å²	49.2	10%	0.1	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	138.9	170.3	-173.1	176.6	177.7	-170.4	0	110.3	K63 A86 F87 V89 T105 S106 I108	K63-K79 CarbonylContact O-C 3.59Å; K63-K79 VanDerWaalsContact O-CA 3.3Å; K63-K79 WeakPolarHBondContact O-CA 3.25Å; K79-A86 WeakPolarHBondContact O-CA 3.27Å; K79-F87 HydrophobicContact CB-CD2 4.24Å; K79-F87 HydrophobicContact CB-CE2 3.79Å; K79-F87 HydrophobicContact CB-CZ 4.16Å; K79-F87 HydrophobicContact CD-CE2 3.92Å; K79-F87 HydrophobicContact CD-CZ 4.09Å; K79-F87 HydrophobicContact CG-CE2 4.09Å; K79-F87 HydrophobicContact CG-CZ 4.08Å; K79-F87 PolarHBondContact N-O 2.99Å; K79-F87 PolarHBondContact O-N 3.27Å; K79-V89 HydrophobicContact CB-CG2 3.73Å; K79-V89 HydrophobicContact CD-CG2 3.74Å; K79-V89 HydrophobicContact CG-CG2 4.42Å; K79-T105 PolarHBondContact NZ-OG1 2.86Å; K79-S106 PolarHBondContact NZ-O 2.81Å; K79-S106 PolarHBondContact NZ-OG 2.67Å; K79-I108 HydrophobicContact CB-CD1 4.24Å; K79-I108 HydrophobicContact CB-CG1 4.06Å; K79-I108 HydrophobicContact CD-CG1 4.4Å; K79-I108 HydrophobicContact CG-CG1 4.49Å
80	L	88.3	Confident	88.3	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.016	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	120	-176	-164.6	53.5	0	0	0	111.6	F52 V57 K63 V65 G84 A86 V631	F52-L80 HydrophobicContact CD2-CD1 3.78Å; V57-L80 HydrophobicContact CB-CD2 4.45Å; V57-L80 HydrophobicContact CG1-CD2 3.35Å; V57-L80 HydrophobicContact CG1-CG 4.27Å; V57-L80 HydrophobicContact CG2-CD2 4.26Å; K63-L80 HydrophobicContact CB-CB 4.4Å; K63-L80 WeakPolarHBondContact CD-O 3.48Å; K63-L80 PolarHBondContact O-N 3.11Å; V65-L80 HydrophobicContact CG2-CB 4.02Å; V65-L80 HydrophobicContact CG2-CD1 4.31Å; L80-G84 WeakPolarHBondContact CD1-O 2.94Å; L80-A86 HydrophobicContact CD1-CB 4.28Å; L80-V631 HydrophobicContact CD2-CB 4.35Å; L80-V631 HydrophobicContact CD2-CG1 3.62Å; L80-V631 HydrophobicContact CD2-CG2 3.8Å
81	G	82.4	Confident	87.6	Confident	11 Å²	11	53.7 Å²	53.7	11%	0.113	30%	0.295	C	S	.	.			trans	-79.8	159.5	175.9	0	0	0	0	0	113	N83 G84 E85	G81-N83 PolarHBondContact O-N 2.89Å; G81-G84 PolarHBondContact O-N 3.36Å; G81-E85 PolarHBondContact N-O 2.9Å
82	D	75	Confident	86.7	Confident	130 Å²	130	51.3 Å²	51.3	70%	0.695	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-6.9	-179.7	-60.3	-84.4	0	0	0	114.1	K54 K63	K54-D82 WeakPolarHBondContact CE-O 3.18Å; K63-D82 IonicContact NZ-OD1 2.93Å; K63-D82 PolarHBondContact NZ-OD1 3.19Å; K63-D82 IonicContact NZ-OD2 2.68Å; K63-D82 PolarHBondContact NZ-OD2 2.69Å
83	N	74.6	Confident	85.2	Confident	68 Å²	68	50.6 Å²	50.6	36%	0.364	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-9.7	171.6	-77.3	-35.1	0	0	0	115.2	K54 G81 E85	K54-N83 VanDerWaalsContact CE-O 3.27Å; K54-N83 WeakPolarHBondContact CE-O 3.25Å; K54-N83 PolarHBondContact NZ-OD1 2.86Å; G81-N83 PolarHBondContact O-N 2.89Å; N83-E85 VanDerWaalsContact C-N 3.31Å; N83-E85 VanDerWaalsContact CB-CD 3.46Å; N83-E85 HydrophobicContact CB-CG 4.09Å; N83-E85 WeakPolarHBondContact CB-OE2 3.21Å; N83-E85 PolarHBondContact ND2-OE1 2.84Å; N83-E85 PolarHBondContact ND2-OE2 3.28Å
84	G	81.1	Confident	83.5	Confident	4 Å²	4	50 Å²	50	4%	0.041	26%	0.261	C	S	.	.	S	Bend	trans	86.9	-3.3	-167.8	0	0	0	0	0	113.9	R51 F52 L80 G81	R51-G84 CarbonylContact C-O 3.54Å; R51-G84 WeakPolarHBondContact CA-O 3.46Å; F52-G84 PolarHBondContact N-O 3.22Å; F52-G84 WeakPolarHBondContact O-CA 3.31Å; L80-G84 WeakPolarHBondContact CD1-O 2.94Å; G81-G84 PolarHBondContact O-N 3.36Å
85	E	85.9	Confident	81.7	Confident	74 Å²	74	54.5 Å²	54.5	35%	0.346	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	135	171.7	65.9	-146	-176.7	0	0	111.3	G81 N83	G81-E85 PolarHBondContact N-O 2.9Å; N83-E85 VanDerWaalsContact C-N 3.31Å; N83-E85 VanDerWaalsContact CB-CD 3.46Å; N83-E85 HydrophobicContact CB-CG 4.09Å; N83-E85 WeakPolarHBondContact CB-OE2 3.21Å; N83-E85 PolarHBondContact ND2-OE1 2.84Å; N83-E85 PolarHBondContact ND2-OE2 3.28Å
86	A	90.3	Very high	80	Confident	3 Å²	3	54.9 Å²	54.9	3%	0.025	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	142.8	175	0	0	0	0	0	111.1	V50 F52 V65 M78 K79 L80	V50-A86 HydrophobicContact CB-CB 4.07Å; V50-A86 HydrophobicContact CG1-CB 4.04Å; V50-A86 PolarHBondContact O-N 2.91Å; F52-A86 HydrophobicContact CE2-CB 4.45Å; V65-A86 HydrophobicContact CG2-CB 3.85Å; M78-A86 HydrophobicContact CB-CB 4.14Å; M78-A86 HydrophobicContact CE-CB 4.15Å; M78-A86 HydrophobicContact SD-CB 3.77Å; K79-A86 WeakPolarHBondContact O-CA 3.27Å; L80-A86 HydrophobicContact CD1-CB 4.28Å
87	F	91.5	Very high	78.5	Confident	14 Å²	14	57.8 Å²	57.8	6%	0.061	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	149.6	-177.9	55.4	-96.3	0	0	0	111.3	K79 V89 T105 K606 L608	K79-F87 HydrophobicContact CB-CD2 4.24Å; K79-F87 HydrophobicContact CB-CE2 3.79Å; K79-F87 HydrophobicContact CB-CZ 4.16Å; K79-F87 HydrophobicContact CD-CE2 3.92Å; K79-F87 HydrophobicContact CD-CZ 4.09Å; K79-F87 HydrophobicContact CG-CE2 4.09Å; K79-F87 HydrophobicContact CG-CZ 4.08Å; K79-F87 PolarHBondContact N-O 2.99Å; K79-F87 PolarHBondContact O-N 3.27Å; F87-V89 HydrophobicContact CD2-CG2 4.34Å; F87-V89 HydrophobicContact CE2-CG2 4.09Å; F87-T105 HydrophobicContact CE2-CG2 4.45Å; F87-K606 HydrophobicContact CD1-CD 4.39Å; F87-K606 HydrophobicContact CD2-CB 3.96Å; F87-K606 HydrophobicContact CD2-CD 4.29Å; F87-K606 HydrophobicContact CD2-CG 3.64Å; F87-K606 HydrophobicContact CE1-CD 4.3Å; F87-K606 HydrophobicContact CE2-CB 4.46Å; F87-K606 HydrophobicContact CE2-CD 4.21Å; F87-K606 HydrophobicContact CE2-CG 3.65Å; F87-K606 HydrophobicContact CG-CB 4.3Å; F87-K606 HydrophobicContact CG-CD 4.38Å; F87-K606 HydrophobicContact CG-CG 4.15Å; F87-K606 HydrophobicContact CZ-CD 4.21Å; F87-K606 HydrophobicContact CZ-CG 4.15Å; F87-L608 HydrophobicContact CB-CD2 3.78Å
88	F	92.1	Very high	77.4	Confident	6 Å²	6	60.8 Å²	60.8	3%	0.026	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	154.6	171.8	-57.9	-74.8	0	0	0	111.1	F48 I67 L76 M78 T607 L610	F48-F88 HydrophobicContact CB-CE2 3.79Å; F48-F88 HydrophobicContact CB-CZ 4.45Å; F48-F88 HydrophobicContact CD1-CE2 4.08Å; F48-F88 HydrophobicContact CD1-CZ 4.02Å; F48-F88 AromaticContact CD2-CE2 3.91Å; F48-F88 HydrophobicContact CD2-CE2 3.91Å; F48-F88 HydrophobicContact CE1-CZ 4.38Å; F48-F88 AromaticContact CG-CE2 3.67Å; F48-F88 HydrophobicContact CG-CE2 3.67Å; F48-F88 HydrophobicContact CG-CZ 4.1Å; I67-F88 HydrophobicContact CD1-CE1 3.73Å; I67-F88 HydrophobicContact CD1-CZ 4.13Å; L76-F88 HydrophobicContact CD1-CD1 4.43Å; L76-F88 HydrophobicContact CD1-CE1 4.43Å; L76-F88 HydrophobicContact CD2-CE1 3.91Å; L76-F88 HydrophobicContact CD2-CZ 4.4Å; L76-F88 HydrophobicContact CG-CD1 4.41Å; L76-F88 HydrophobicContact CG-CE1 3.96Å; M78-F88 HydrophobicContact CB-CD1 4.44Å; M78-F88 HydrophobicContact CE-CD2 4.22Å; M78-F88 HydrophobicContact CE-CE1 4.38Å; M78-F88 HydrophobicContact CE-CE2 3.87Å; M78-F88 HydrophobicContact CE-CZ 3.95Å; M78-F88 HydrophobicContact CG-CD1 4.1Å; M78-F88 HydrophobicContact CG-CE1 3.71Å; M78-F88 HydrophobicContact CG-CZ 4.11Å; M78-F88 HydrophobicContact SD-CZ 4.5Å; F88-T607 HydrophobicContact CB-CG2 3.81Å; F88-T607 PolarHBondContact N-O 3.02Å; F88-T607 PolarHBondContact O-N 3.49Å; F88-L610 HydrophobicContact CD1-CD2 3.83Å; F88-L610 HydrophobicContact CD2-CD2 3.66Å; F88-L610 HydrophobicContact CD2-CG 4.17Å; F88-L610 HydrophobicContact CE1-CD2 3.79Å; F88-L610 HydrophobicContact CE2-CD1 4.24Å; F88-L610 HydrophobicContact CE2-CD2 3.62Å; F88-L610 HydrophobicContact CE2-CG 3.76Å; F88-L610 HydrophobicContact CG-CD2 3.77Å; F88-L610 HydrophobicContact CZ-CD1 4.01Å; F88-L610 HydrophobicContact CZ-CD2 3.69Å; F88-L610 HydrophobicContact CZ-CG 3.97Å
89	V	88.4	Confident	76	Confident	35 Å²	35	62 Å²	62	21%	0.212	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	108	178.1	-178.9	0	0	0	0	109.2	K79 F87 T105 I108 Y604	K79-V89 HydrophobicContact CB-CG2 3.73Å; K79-V89 HydrophobicContact CD-CG2 3.74Å; K79-V89 HydrophobicContact CG-CG2 4.42Å; F87-V89 HydrophobicContact CD2-CG2 4.34Å; F87-V89 HydrophobicContact CE2-CG2 4.09Å; V89-T105 HydrophobicContact CG1-CG2 3.83Å; V89-T105 HydrophobicContact CG2-CG2 4.15Å; V89-I108 HydrophobicContact CB-CG1 4.44Å; V89-I108 HydrophobicContact CG2-CD1 4.34Å; V89-I108 HydrophobicContact CG2-CG1 4Å; V89-Y604 HydrophobicContact CG1-CD1 3.83Å; V89-Y604 HydrophobicContact CG1-CG 4.23Å
90	Q	83.7	Confident	75.2	Confident	75 Å²	75	63.4 Å²	63.4	35%	0.35	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	136.8	172.9	-172	176.2	30.7	0	0	109.6	Y604 K605 T607	Q90-Y604 CarbonylContact O-C 3.59Å; Q90-Y604 WeakPolarHBondContact O-CA 3.39Å; Q90-K605 HydrophobicContact CB-CB 4.45Å; Q90-K605 PolarHBondContact N-O 2.81Å; Q90-K605 PolarHBondContact O-N 2.83Å; Q90-T607 HydrophobicContact CB-CG2 4.1Å
91	Q	80.5	Confident	73.7	Confident	97 Å²	97	68.8 Å²	68.8	45%	0.453	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	127.9	170.9	-171.1	176	-52.6	0	0	109.8	N93 V602 Y604	Q91-N93 PolarHBondContact NE2-OD1 2.94Å; Q91-V602 VanDerWaalsContact CD-CG1 3.4Å; Q91-V602 HydrophobicContact CG-CG1 3.42Å; Q91-V602 VanDerWaalsContact CG-CG1 3.42Å; Q91-Y604 HydrophobicContact CB-CD1 4.04Å; Q91-Y604 HydrophobicContact CB-CE1 3.92Å; Q91-Y604 HydrophobicContact CG-CD1 4.16Å; Q91-Y604 HydrophobicContact CG-CE1 3.76Å
92	T	73	Confident	72.8	Confident	9 Å²	9	76 Å²	76	6%	0.055	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	107.9	176.9	29.9	0	0	0	0	109.7	N94 V99 S603 K605	T92-N94 VanDerWaalsContact C-N 3.34Å; T92-V99 HydrophobicContact CG2-CG2 4.47Å; T92-S603 WeakPolarHBondContact CB-OG 3.33Å; T92-S603 PolarHBondContact N-O 2.93Å; T92-S603 PolarHBondContact O-N 3.17Å; T92-S603 PolarHBondContact O-OG 2.9Å; T92-S603 PolarHBondContact OG1-O 3.01Å; T92-S603 PolarHBondContact OG1-OG 2.88Å; T92-K605 HydrophobicContact CG2-CB 4.17Å; T92-K605 HydrophobicContact CG2-CD 3.87Å
93	N	62.7	Low	72.6	Confident	124 Å²	124	72.1 Å²	72.1	66%	0.663	38%	0.378	S	S	*	.			trans	-89.2	7.6	-176.8	-66	-21.5	0	0	0	113.8	Q91	Q91-N93 PolarHBondContact NE2-OD1 2.94Å
94	N	57.4	Low	72.4	Confident	92 Å²	92	71.1 Å²	71.1	49%	0.492	38%	0.379	S	S	.	.			trans	-117.1	105.3	-166.5	-166	12	0	0	0	110.5	T92 Q96 E97	T92-N94 VanDerWaalsContact C-N 3.34Å; N94-Q96 PolarHBondContact O-N 3.04Å; N94-E97 PolarHBondContact O-N 2.69Å; N94-E97 VanDerWaalsContact O-N 3.07Å
95	D	56.9	Low	72.1	Confident	121 Å²	121	72.5 Å²	72.5	65%	0.647	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-4.2	-175.6	-64.2	-54.9	0	0	0	114.1
96	Q	53.4	Low	71.6	Confident	170 Å²	170	72.2 Å²	72.2	79%	0.794	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-15.9	176.7	-60.9	-177	6.7	0	0	114.2	N94 V98	N94-Q96 PolarHBondContact O-N 3.04Å; Q96-V98 PolarHBondContact O-N 3.29Å
97	E	59.5	Low	70.9	Confident	83 Å²	83	74.3 Å²	74.3	39%	0.388	41%	0.406	S	S	.	.			trans	-86.2	97	176.7	-166.5	-175	160.8	0	0	110.1	N94 V99 K605	N94-E97 PolarHBondContact O-N 2.69Å; N94-E97 VanDerWaalsContact O-N 3.07Å; E97-V99 VanDerWaalsContact C-N 3.3Å; E97-V99 PolarHBondContact O-N 3.18Å; E97-K605 IonicContact OE1-NZ 2.88Å; E97-K605 PolarHBondContact OE1-NZ 3.08Å; E97-K605 IonicContact OE2-NZ 3.28Å
98	V	65.8	Low	70	Confident	134 Å²	134	75.9 Å²	75.9	81%	0.812	42%	0.415	S	S	*	.			trans	-70.1	85.6	176.6	-176.1	0	0	0	0	110	Q96 P100	Q96-V98 PolarHBondContact O-N 3.29Å; V98-P100 VanDerWaalsContact O-CD 3.28Å; V98-P100 WeakPolarHBondContact O-CD 3.32Å
99	V	64.2	Low	68.2	Low	27 Å²	27	81.9 Å²	81.9	16%	0.164	45%	0.447	C	S	.	.			trans	-58.1	118.6	-179.9	-179.1	0	0	0	0	110.1	T92 E97 L103 K605	T92-V99 HydrophobicContact CG2-CG2 4.47Å; E97-V99 VanDerWaalsContact C-N 3.3Å; E97-V99 PolarHBondContact O-N 3.18Å; V99-L103 HydrophobicContact CG1-CB 4.08Å; V99-K605 HydrophobicContact CG1-CB 4.35Å
100	P	72	Confident	66.3	Low	52 Å²	52	83.6 Å²	83.6	34%	0.338	46%	0.46	S	S	.	.			trans	-59.3	143.3	179.3	-26.7	35.8	0	0	0	112.4	V98 Y102 L103 A104	V98-P100 VanDerWaalsContact O-CD 3.28Å; V98-P100 WeakPolarHBondContact O-CD 3.32Å; P100-Y102 HydrophobicContact CB-CD1 3.66Å; P100-Y102 HydrophobicContact CB-CE1 3.31Å; P100-Y102 HydrophobicContact CG-CE1 4.13Å; P100-Y102 PolarHBondContact O-N 3.23Å; P100-L103 WeakPolarHBondContact O-CA 3.49Å; P100-L103 PolarHBondContact O-N 2.8Å; P100-A104 PolarHBondContact O-N 3.36Å; P100-A104 VanDerWaalsContact O-N 3.08Å
101	S	57.9	Low	64.3	Low	116 Å²	116	86.2 Å²	86.2	81%	0.811	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-26.1	-172.9	57.4	0	0	0	0	114.8
102	Y	62.9	Low	62.3	Low	163 Å²	163	85 Å²	85	64%	0.639	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-24.3	174.6	68.5	-87.2	0	0	0	113.5	P100 K606	P100-Y102 HydrophobicContact CB-CD1 3.66Å; P100-Y102 HydrophobicContact CB-CE1 3.31Å; P100-Y102 HydrophobicContact CG-CE1 4.13Å; P100-Y102 PolarHBondContact O-N 3.23Å; Y102-K606 PolarHBondContact O-NZ 2.86Å
103	L	70.1	Confident	60.5	Low	47 Å²	47	87.1 Å²	87.1	25%	0.246	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-14.6	174.8	-62.7	-177.1	0	0	0	113.5	V99 P100 K605 K606	V99-L103 HydrophobicContact CG1-CB 4.08Å; P100-L103 WeakPolarHBondContact O-CA 3.49Å; P100-L103 PolarHBondContact O-N 2.8Å; L103-K605 CarbonylContact O-C 3.57Å; L103-K605 WeakPolarHBondContact O-CA 3.42Å; L103-K606 WeakPolarHBondContact O-CG 3.48Å; L103-K606 PolarHBondContact O-N 3.28Å
104	A	70.8	Confident	59.1	Low	48 Å²	48	88.1 Å²	88.1	40%	0.397	50%	0.5	S	S	.	.	B	Isolated β-bridge	trans	-62.5	142.3	175.4	0	0	0	0	0	111.9	P100 K606	P100-A104 PolarHBondContact O-N 3.36Å; P100-A104 VanDerWaalsContact O-N 3.08Å; A104-K606 WeakPolarHBondContact O-CE 3.49Å
105	T	75.8	Confident	57.8	Low	33 Å²	33	88.7 Å²	88.7	20%	0.202	51%	0.511	C	S	.	.			trans	-150.2	172.4	176.3	-172.7	0	0	0	0	111	K79 F87 V89 Y604 K606	K79-T105 PolarHBondContact NZ-OG1 2.86Å; F87-T105 HydrophobicContact CE2-CG2 4.45Å; V89-T105 HydrophobicContact CG1-CG2 3.83Å; V89-T105 HydrophobicContact CG2-CG2 4.15Å; T105-Y604 PolarHBondContact N-O 3.21Å; T105-K606 HydrophobicContact CG2-CG 4.1Å
106	S	74.8	Confident	56.9	Low	67 Å²	67	91.2 Å²	91.2	47%	0.469	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-94.2	161.5	166.3	79.3	0	0	0	0	110.4	K79	K79-S106 PolarHBondContact NZ-O 2.81Å; K79-S106 PolarHBondContact NZ-OG 2.67Å
107	P	75.4	Confident	56	Low	48 Å²	48	87.4 Å²	87.4	31%	0.312	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-59	164.7	171.4	24.7	-34.1	0	0	0	112.4	Y604	P107-Y604 HydrophobicContact CB-CD1 4.33Å; P107-Y604 HydrophobicContact CB-CE1 3.91Å; P107-Y604 HydrophobicContact CB-CE2 4.19Å; P107-Y604 HydrophobicContact CG-CD2 4.5Å; P107-Y604 HydrophobicContact CG-CE2 4.03Å
108	I	73.4	Confident	54.5	Low	46 Å²	46	87.9 Å²	87.9	24%	0.236	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-75.1	131.6	163.6	-61.1	178.5	0	0	0	107.3	V64 H77 K79 V89 S110	V64-I108 HydrophobicContact CG1-CG2 4.47Å; V64-I108 HydrophobicContact CG2-CG2 4.01Å; H77-I108 HydrophobicContact CB-CD1 4.25Å; K79-I108 HydrophobicContact CB-CD1 4.24Å; K79-I108 HydrophobicContact CB-CG1 4.06Å; K79-I108 HydrophobicContact CD-CG1 4.4Å; K79-I108 HydrophobicContact CG-CG1 4.49Å; V89-I108 HydrophobicContact CB-CG1 4.44Å; V89-I108 HydrophobicContact CG2-CD1 4.34Å; V89-I108 HydrophobicContact CG2-CG1 4Å; I108-S110 PolarHBondContact O-N 2.83Å
109	L	53	Low	53.2	Low	133 Å²	133	87.9 Å²	87.9	70%	0.696	53%	0.528	S	S	*	.			trans	-84.8	93.4	174.8	-65	175.2	0	0	0	108.4
110	S	49.5	Very low	51.5	Low	71 Å²	71	94.4 Å²	94.4	50%	0.497	56%	0.562	S	S	.	*			trans	-76.3	150.7	172.9	55.4	0	0	0	0	111.4	I108 A112 A113	I108-S110 PolarHBondContact O-N 2.83Å; S110-A112 PolarHBondContact O-N 2.85Å; S110-A113 WeakPolarHBondContact O-CB 3.4Å; S110-A113 PolarHBondContact O-N 3.2Å
111	D	42.1	Very low	49.9	Very low	130 Å²	130	100.7 Å²	100.7	70%	0.695	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-18.4	-176.8	-89.2	-26.8	0	0	0	114.3	A113 F114 S115	D111-A113 PolarHBondContact O-N 3.34Å; D111-A113 VanDerWaalsContact O-N 3.15Å; D111-F114 PolarHBondContact O-N 2.74Å; D111-F114 WeakPolarHBondContact OD1-CD2 3.48Å; D111-S115 PolarHBondContact O-N 3.3Å
112	A	37.3	Very low	48.5	Very low	70 Å²	70	98.7 Å²	98.7	58%	0.579	59%	0.586	S	S	*	*	H	α-helix	trans	-52.7	-32.6	168.4	0	0	0	0	0	112.6	S110 S115	S110-A112 PolarHBondContact O-N 2.85Å; A112-S115 PolarHBondContact O-N 2.82Å
113	A	35.7	Very low	47	Very low	54 Å²	54	100.7 Å²	100.7	45%	0.446	60%	0.598	S	S	.	*	H	α-helix	trans	-69.5	-33.1	176.6	0	0	0	0	0	113.2	S110 D111 S115 M116	S110-A113 WeakPolarHBondContact O-CB 3.4Å; S110-A113 PolarHBondContact O-N 3.2Å; D111-A113 PolarHBondContact O-N 3.34Å; D111-A113 VanDerWaalsContact O-N 3.15Å; A113-S115 VanDerWaalsContact C-N 3.31Å; A113-S115 PolarHBondContact O-N 3.28Å; A113-M116 PolarHBondContact O-N 3.02Å
114	F	33.6	Very low	45.2	Very low	146 Å²	146	104.4 Å²	104.4	64%	0.64	63%	0.628	S	S	*	*	H	α-helix	trans	-70.5	-27.4	177.1	-79.7	-71.3	0	0	0	112.7	D111	D111-F114 PolarHBondContact O-N 2.74Å; D111-F114 WeakPolarHBondContact OD1-CD2 3.48Å
115	S	30	Very low	43.2	Very low	103 Å²	103	108.2 Å²	108.2	72%	0.72	65%	0.652	S	S	*	*	H	α-helix	trans	-72.5	-27.4	176.9	-145.4	0	0	0	0	113.1	D111 A112 A113	D111-S115 PolarHBondContact O-N 3.3Å; A112-S115 PolarHBondContact O-N 2.82Å; A113-S115 VanDerWaalsContact C-N 3.31Å; A113-S115 PolarHBondContact O-N 3.28Å
116	M	37.3	Very low	41.1	Very low	175 Å²	175	109.9 Å²	109.9	86%	0.862	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	4.5	-173.9	-75.6	-64.7	-160.8	0	0	115.4	A113	A113-M116 PolarHBondContact O-N 3.02Å
117	S	35.6	Very low	39.2	Very low	89 Å²	89	112.7 Å²	112.7	62%	0.622	69%	0.692	S	S	*	*			trans	-118.3	51.7	179.8	76.1	0	0	0	0	114.4
118	S	27.6	Very low	37.3	Very low	93 Å²	93	116.3 Å²	116.3	65%	0.65	72%	0.716	S	S	*	*			trans	-115.2	123.7	164.5	-78.4	0	0	0	0	111	L120	S118-L120 PolarHBondContact O-N 2.9Å
119	P	37.3	Very low	35.2	Very low	135 Å²	135	121.1 Å²	121.1	88%	0.877	75%	0.747	S	S	*	*			trans	-79.1	83	-173.3	32	-35.6	0	0	0	112.2
120	L	30.2	Very low	34.1	Very low	164 Å²	164	122.9 Å²	122.9	86%	0.859	75%	0.752	S	S	*	*			trans	-75.8	126.5	174.1	-80.5	169.6	0	0	0	112	S118 G122	S118-L120 PolarHBondContact O-N 2.9Å; L120-G122 PolarHBondContact O-N 2.98Å
121	M	36.6	Very low	33.1	Very low	184 Å²	184	127.1 Å²	127.1	91%	0.906	77%	0.767	S	S	*	*			trans	-75	90.6	176.4	-66.2	-174.6	72.1	0	0	111.7
122	G	29.7	Very low	32.4	Very low	74 Å²	74	129.1 Å²	129.1	76%	0.763	78%	0.777	S	S	*	*			trans	-82.2	113.2	169.5	0	0	0	0	0	112.2	L120	L120-G122 PolarHBondContact O-N 2.98Å
123	K	30.8	Very low	31.9	Very low	205 Å²	205	129.1 Å²	129.1	89%	0.891	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-80.9	118.8	173.7	-66.3	175.2	-178.7	173.3	0	110.3
124	S	32.2	Very low	31.5	Very low	124 Å²	124	132.1 Å²	132.1	87%	0.867	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-81.3	136.4	165	48.4	0	0	0	0	110.8
125	S	30.3	Very low	31.3	Very low	128 Å²	128	133.5 Å²	133.5	90%	0.895	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-92.5	131.3	179.2	44.4	0	0	0	0	111.6
126	G	30.2	Very low	31.2	Very low	68 Å²	68	132 Å²	132	70%	0.701	82%	0.815	S	S	*	*			trans	-145.8	149	173	0	0	0	0	0	110.6
127	P	35.4	Very low	30.9	Very low	127 Å²	127	129.5 Å²	129.5	83%	0.825	82%	0.815	S	S	*	*			trans	-76.3	158.9	-168.9	30.5	-35.7	0	0	0	113.9
128	P	34.6	Very low	30.5	Very low	123 Å²	123	133.1 Å²	133.1	80%	0.799	83%	0.828	S	S	*	*			trans	-87.6	148.3	-168.1	34.4	-36.1	0	0	0	114.2
129	V	30.9	Very low	30.6	Very low	147 Å²	147	132.6 Å²	132.6	89%	0.891	84%	0.837	S	S	*	*			trans	-122.2	137	156.4	-179.8	0	0	0	0	107.9
130	Q	29.5	Very low	30.2	Very low	171 Å²	171	135.5 Å²	135.5	80%	0.799	84%	0.838	S	S	*	*			trans	-81.1	155.5	-177.2	-58.2	169.6	-1.2	0	0	111.2
131	I	28	Very low	30.1	Very low	160 Å²	160	133.7 Å²	133.7	82%	0.821	84%	0.84	S	S	*	*				172.3	121.8	122.8	-88.8	157	0	0	0	111.6
132	L	28.1	Very low	29.7	Very low	171 Å²	171	130.9 Å²	130.9	90%	0.895	84%	0.838	S	S	*	*			trans	38.6	127.9	142	-158.6	72.1	0	0	0	121.4
133	G	25.4	Very low	29.6	Very low	71 Å²	71	130.8 Å²	130.8	73%	0.732	84%	0.837	S	S	*	*			trans	174.9	45.9	168.2	0	0	0	0	0	122
134	S	28.9	Very low	29.5	Very low	116 Å²	116	126.4 Å²	126.4	81%	0.811	84%	0.839	S	S	*	*			trans	43.4	113.2	151.3	-60.5	0	0	0	0	123.5
135	L	28.2	Very low	29.6	Very low	175 Å²	175	126.7 Å²	126.7	92%	0.916	84%	0.836	S	S	*	*				79.4	110.1	114.5	-168.5	67.3	0	0	0	122.5
136	G	29	Very low	29.6	Very low	71 Å²	71	126.9 Å²	126.9	73%	0.732	83%	0.832	S	S	*	*			trans	86.7	157.5	142.3	0	0	0	0	0	117.7
137	S	29.9	Very low	29.8	Very low	123 Å²	123	133.5 Å²	133.5	86%	0.86	84%	0.841	S	S	*	*			cis	-156.8	167.9	-11.8	-166	0	0	0	0	110.3
138	N	27.8	Very low	29.8	Very low	166 Å²	166	137.2 Å²	137.2	89%	0.888	84%	0.844	S	S	*	*			trans	-64.9	154.8	-179.8	-62.7	-13.6	0	0	0	113.2
139	G	29.1	Very low	29.6	Very low	82 Å²	82	143.1 Å²	143.1	85%	0.845	85%	0.85	S	S	*	*			trans	178.7	94.3	169.3	0	0	0	0	0	113.9
140	E	28.6	Very low	29.9	Very low	195 Å²	195	148.2 Å²	148.2	91%	0.911	85%	0.854	S	S	*	*			trans	-79.9	147.1	171.6	-63.6	168.3	93.2	0	0	111.8
141	S	28.6	Very low	30	Very low	126 Å²	126	149.5 Å²	149.5	88%	0.881	86%	0.857	S	S	*	*				175.6	163.5	128.7	42.1	0	0	0	0	113
142	S	27.5	Very low	30.3	Very low	125 Å²	125	154 Å²	154	87%	0.874	86%	0.863	S	S	*	*			trans	-80.8	155.3	-177.7	52.7	0	0	0	0	113.8
143	G	27.9	Very low	30.5	Very low	73 Å²	73	157.4 Å²	157.4	75%	0.753	86%	0.864	S	S	*	*			trans	175.4	90.2	169.2	0	0	0	0	0	119.9
144	A	29.1	Very low	30.9	Very low	112 Å²	112	165.6 Å²	165.6	93%	0.926	87%	0.873	S	S	*	*			trans	65.5	158.5	144.1	0	0	0	0	0	122.3
145	V	34.3	Very low	31.1	Very low	131 Å²	131	169.9 Å²	169.9	79%	0.794	88%	0.877	S	S	*	*			trans	-106.4	138.7	-175	170	0	0	0	0	111.3
146	T	30	Very low	31	Very low	132 Å²	132	166 Å²	166	81%	0.81	87%	0.865	S	S	*	*			trans	-151.2	144.8	146.6	37.1	0	0	0	0	113.3
147	K	35.9	Very low	30.9	Very low	206 Å²	206	174.2 Å²	174.2	90%	0.896	87%	0.874	S	S	*	*			trans	-89.2	136.4	177.7	-63.4	170	179.9	172.3	0	110.8
148	K	34.6	Very low	30.8	Very low	206 Å²	206	172.6 Å²	172.6	90%	0.896	87%	0.868	S	S	*	*			trans	-117.8	107.9	172.2	-81.1	179.2	178.3	169	0	112.5
149	R	30.7	Very low	30.5	Very low	246 Å²	246	171.6 Å²	171.6	93%	0.928	86%	0.862	S	S	*	*			trans	-90.5	112.6	176.6	-168	171.5	75.5	177.8	3.5	110.3
150	R	38	Very low	30.5	Very low	255 Å²	255	173 Å²	173	96%	0.962	86%	0.859	S	S	*	*			trans	-72.4	144.6	-174.4	-159.4	167.5	-179.9	166.5	-2.1	112
151	K	31.1	Very low	30.4	Very low	198 Å²	198	169 Å²	169	86%	0.861	85%	0.848	S	S	*	*			trans	-110.6	120	-164.5	-172	177	-178	179	0	110.9
152	R	33	Very low	30.4	Very low	254 Å²	254	173.9 Å²	173.9	96%	0.958	85%	0.847	S	S	*	*			trans	-71.8	146.8	170.2	-87.9	-175.4	169.9	178.7	-3.4	110.4
153	R	34	Very low	30.4	Very low	243 Å²	243	176.6 Å²	176.6	92%	0.917	84%	0.838	S	S	*	*			trans	-114.8	133.1	-177.1	-166.6	168.1	83.5	164.9	2.8	110.2
154	R	33.4	Very low	30.4	Very low	243 Å²	243	179.8 Å²	179.8	92%	0.917	83%	0.834	S	S	*	*			trans	-88.2	157.9	169.4	-76.9	-179.2	168.2	175.2	-5	110.6
155	K	32.5	Very low	30.3	Very low	205 Å²	205	182.8 Å²	182.8	89%	0.891	83%	0.829	S	S	*	*			trans	-137.3	171.7	153.6	-159.7	165.5	178.5	-174.2	0	108.6
156	S	25.5	Very low	30.1	Very low	94 Å²	94	182 Å²	182	66%	0.657	83%	0.829	S	S	*	*			trans	-168.2	164.5	-147	54	0	0	0	0	114.3
157	R	27.8	Very low	30	Very low	244 Å²	244	179.1 Å²	179.1	92%	0.921	83%	0.825	S	S	*	*			trans	72.3	158.4	170.1	-62.5	-173.4	173.8	-160.9	-3.6	114.5
158	A	26.9	Very low	29.7	Very low	89 Å²	89	175.7 Å²	175.7	74%	0.736	82%	0.817	S	S	*	*			cis	-155.2	157.1	-3.3	0	0	0	0	0	107.2
159	D	22.9	Very low	29.5	Very low	144 Å²	144	175.9 Å²	175.9	77%	0.77	81%	0.814	S	S	*	*			cis	104.1	99.5	29.2	-174.5	20.1	0	0	0	113.9
160	S	29	Very low	29.6	Very low	111 Å²	111	168.2 Å²	168.2	78%	0.776	80%	0.798	S	S	*	*			trans	179.9	152.1	161.9	55	0	0	0	0	110.9
161	T	27	Very low	29.1	Very low	113 Å²	113	157.9 Å²	157.9	69%	0.693	77%	0.766	S	S	*	*				178	153.4	-60.5	34.8	0	0	0	0	107.3
162	R	27.3	Very low	29	Very low	228 Å²	228	151.6 Å²	151.6	86%	0.86	74%	0.742	S	S	*	*			trans	78.2	144.5	168.1	-64.1	-177	169.6	-175.9	-4.1	117.8
163	R	27.8	Very low	28.9	Very low	181 Å²	181	146.6 Å²	146.6	68%	0.683	73%	0.73	S	S	*	*			cis	-165.3	148.7	-5.4	-132.3	-169.2	146.2	178.5	-18.3	113.3
164	E	28.4	Very low	28.8	Very low	140 Å²	140	141.6 Å²	141.6	65%	0.654	72%	0.721	S	S	*	*			trans	62.2	155.8	157	-36.4	-164.8	128	0	0	117.2
165	E	27.1	Very low	28.5	Very low	176 Å²	176	138.5 Å²	138.5	82%	0.822	72%	0.719	S	S	*	*			cis	-141.9	165.6	5.6	-161.1	169.4	158.5	0	0	112.7
166	S	28.9	Very low	28.2	Very low	113 Å²	113	137.1 Å²	137.1	79%	0.79	71%	0.714	S	S	*	*			trans	-37.4	157.2	-178.9	-39.3	0	0	0	0	120.2
167	G	28.4	Very low	28.2	Very low	72 Å²	72	137.4 Å²	137.4	74%	0.742	72%	0.716	S	S	*	*			trans	-175	-29.7	168.1	0	0	0	0	0	124.1
168	D	30.3	Very low	28.2	Very low	135 Å²	135	133.8 Å²	133.8	72%	0.722	71%	0.713	S	S	*	*			trans	33.7	112.4	168.2	-78.1	31.4	0	0	0	124
169	Y	29.6	Very low	28.2	Very low	210 Å²	210	136.1 Å²	136.1	82%	0.824	71%	0.713	S	S	*	*			trans	54.9	163.8	143.9	-51	-73	0	0	0	121.2
170	S	31.9	Very low	28.4	Very low	85 Å²	85	137 Å²	137	59%	0.594	72%	0.716	S	S	*	*			cis	-156	152.2	6.4	-153.8	0	0	0	0	112.3
171	A	28.3	Very low	28.1	Very low	37 Å²	37	137.2 Å²	137.2	31%	0.306	72%	0.718	S	S	.	*			trans	44.9	161.4	135.7	0	0	0	0	0	124.2	G556	A171-G556 VanDerWaalsContact CB-CA 3.4Å; A171-G556 WeakPolarHBondContact CB-O 3.45Å
172	D	29.9	Very low	28.1	Very low	66 Å²	66	137 Å²	137	35%	0.353	72%	0.721	S	S	.	*			cis	-169.9	162.4	-19.2	-84.9	-29.9	0	0	0	105.7	C555 G556 A557 C558	D172-C555 PolarHBondContact OD2-SG 3.11Å; D172-G556 VanDerWaalsContact OD2-CA 3.31Å; D172-G556 WeakPolarHBondContact OD2-CA 3.38Å; D172-G556 PolarHBondContact OD2-N 2.85Å; D172-A557 HydrophobicContact CB-CB 4.31Å; D172-C558 WeakPolarHBondContact O-CB 3.3Å
173	E	30.1	Very low	28	Very low	150 Å²	150	133.2 Å²	133.2	70%	0.701	72%	0.718	S	S	*	*			trans	63.8	150.3	173.9	-37.4	-53.2	165.5	0	0	117.3
174	D	32.5	Very low	28.2	Very low	138 Å²	138	133.4 Å²	133.4	74%	0.738	73%	0.726	S	S	*	*			cis	-154.2	-175.1	4.1	-153.6	-24.4	0	0	0	110.3
175	M	26	Very low	28.3	Very low	177 Å²	177	136.1 Å²	136.1	87%	0.872	74%	0.739	S	S	*	*			trans	107.2	154	154	-152.3	158.8	61.3	0	0	118.8
176	F	26.5	Very low	28.4	Very low	176 Å²	176	132.5 Å²	132.5	77%	0.772	74%	0.739	S	S	*	*			trans	-108.9	175.1	-151.5	-77.5	-106.9	0	0	0	115.7
177	S	25.7	Very low	28.2	Very low	101 Å²	101	136.9 Å²	136.9	71%	0.706	75%	0.747	S	S	*	*			trans	106.7	138.5	142.2	-57	0	0	0	0	118.2
178	I	27.7	Very low	28.2	Very low	167 Å²	167	142 Å²	142	86%	0.856	75%	0.754	S	S	*	*				-163.6	154.2	113.4	-94	155.2	0	0	0	109.1
179	D	26.9	Very low	28	Very low	138 Å²	138	144.8 Å²	144.8	74%	0.738	76%	0.763	S	S	*	*			trans	-83.8	172.3	-148.9	-58.9	-86.5	0	0	0	118.2
180	I	26.5	Very low	27.8	Very low	162 Å²	162	140.5 Å²	140.5	83%	0.831	76%	0.763	S	S	*	*			trans	-74.1	146.1	161.7	-164.7	167.8	0	0	0	110.3
181	S	24	Very low	27.7	Very low	117 Å²	117	141 Å²	141	82%	0.818	77%	0.767	S	S	*	*			trans	-114.4	132.6	167.2	179.4	0	0	0	0	109.2
182	S	26.4	Very low	27.9	Very low	108 Å²	108	150 Å²	150	76%	0.755	79%	0.793	S	S	*	*			trans	-145.8	148.3	166.9	-162	0	0	0	0	108.2
183	D	24.3	Very low	27.7	Very low	149 Å²	149	151.7 Å²	151.7	80%	0.797	81%	0.81	S	S	*	*			trans	-128.2	128	-167.9	-170.7	21.3	0	0	0	107.6
184	E	33.4	Very low	27.6	Very low	184 Å²	184	152.1 Å²	152.1	86%	0.86	82%	0.816	S	S	*	*			trans	-138.8	123.4	179.4	-69.7	-154.2	146.8	0	0	111.6
185	E	28.9	Very low	27.4	Very low	198 Å²	198	150.5 Å²	150.5	93%	0.925	82%	0.816	S	S	*	*			trans	-83.9	134.4	168.5	-63.7	-173.3	143.1	0	0	110.8
186	A	31.1	Very low	27.6	Very low	99 Å²	99	152.2 Å²	152.2	82%	0.818	81%	0.813	S	S	*	*			trans	-150.6	115.4	160.6	0	0	0	0	0	110.5
187	E	24.6	Very low	27.5	Very low	205 Å²	205	149.3 Å²	149.3	96%	0.958	81%	0.805	S	S	*	*			trans	-71.1	153.7	169.7	-62.8	-168	134.3	0	0	111.2
188	M	27.8	Very low	27.7	Very low	179 Å²	179	148.7 Å²	148.7	88%	0.882	81%	0.806	S	S	*	*			trans	-133.8	115.2	168.5	-173.3	173.3	-171.7	0	0	110.9	S190	M188-S190 PolarHBondContact O-N 3.5Å
189	E	25.9	Very low	27.7	Very low	195 Å²	195	147.9 Å²	147.9	91%	0.911	80%	0.803	S	S	*	*			trans	-64.7	128.1	167.7	-71.9	-165.5	117.9	0	0	110.8
190	S	26.3	Very low	27.9	Very low	119 Å²	119	148.8 Å²	148.8	83%	0.832	80%	0.802	S	S	*	*			trans	-149.5	145.7	154.7	-167.8	0	0	0	0	110.6	M188	M188-S190 PolarHBondContact O-N 3.5Å
191	S	29.6	Very low	28	Very low	96 Å²	96	146.5 Å²	146.5	67%	0.671	79%	0.792	S	S	*	*			trans	-96	140	-158.5	73	0	0	0	0	114.5
192	R	31.1	Very low	28.3	Very low	226 Å²	226	148.1 Å²	148.1	85%	0.853	79%	0.786	S	S	*	*			trans	76.6	95.2	153.7	-62.2	170.9	-179.3	174.7	1.5	119.3
193	S	26	Very low	28.3	Very low	102 Å²	102	147.3 Å²	147.3	71%	0.713	78%	0.777	S	S	*	*				50.8	124.4	121.5	64.8	0	0	0	0	121.9
194	L	28.3	Very low	28.4	Very low	158 Å²	158	146 Å²	146	83%	0.827	77%	0.774	S	S	*	*				173.4	137.6	110.8	-92.8	165.2	0	0	0	113.5
195	S	28.5	Very low	28	Very low	105 Å²	105	143.7 Å²	143.7	73%	0.734	77%	0.772	S	S	*	*			trans	58.8	130.3	163.2	31.2	0	0	0	0	119
196	R	29.7	Very low	28	Very low	213 Å²	213	138.3 Å²	138.3	80%	0.804	76%	0.762	S	S	*	*				64.3	132.1	64.8	-70.5	-165.5	66.9	176.8	-4.4	113.3
197	D	25.7	Very low	27.8	Very low	115 Å²	115	139.3 Å²	139.3	62%	0.615	76%	0.763	S	S	*	*			cis	-143.4	144	1.6	-82.4	-29.1	0	0	0	107.7
198	A	29.7	Very low	27.9	Very low	87 Å²	87	133.1 Å²	133.1	72%	0.719	75%	0.754	S	S	*	*				70.5	149.3	83.2	0	0	0	0	0	117.7
199	L	27.8	Very low	27.8	Very low	151 Å²	151	133.3 Å²	133.3	79%	0.791	76%	0.757	S	S	*	*			trans	88.9	132.2	-177.9	-54.3	171.4	0	0	0	115.7
200	Q	29.4	Very low	27.8	Very low	156 Å²	156	129.8 Å²	129.8	73%	0.729	75%	0.753	S	S	*	*				78.2	141	52.1	-90.4	-175.9	-65.7	0	0	113.7
201	D	29.1	Very low	27.8	Very low	115 Å²	115	128.8 Å²	128.8	62%	0.615	75%	0.746	S	S	*	*			cis	-163	177.8	4.3	-141.3	-15.3	0	0	0	113.7
202	E	29.8	Very low	27.7	Very low	151 Å²	151	133.1 Å²	133.1	71%	0.706	75%	0.753	S	S	*	*			trans	61.7	165.5	145.1	-72.1	-97.1	99	0	0	121.2
203	T	27.4	Very low	27.6	Very low	91 Å²	91	130.1 Å²	130.1	56%	0.558	75%	0.746	S	S	*	*			cis	-175.6	170.5	-39	-97.3	0	0	0	0	111.3
204	T	26.1	Very low	27.8	Very low	120 Å²	120	133.1 Å²	133.1	74%	0.736	75%	0.749	S	S	*	*			trans	78.7	107.4	159.1	34.6	0	0	0	0	124.5
205	V	26.2	Very low	28	Very low	136 Å²	136	130.1 Å²	130.1	82%	0.824	75%	0.747	S	S	*	*				70	133	106.8	169.8	0	0	0	0	124.2
206	A	27.2	Very low	27.9	Very low	85 Å²	85	128.7 Å²	128.7	70%	0.702	75%	0.748	S	S	*	*			trans	94.2	109.9	146.1	0	0	0	0	0	124.9
207	S	27.5	Very low	27.9	Very low	121 Å²	121	126.9 Å²	126.9	85%	0.846	75%	0.754	S	S	*	*				66.6	90.3	118.2	-53.1	0	0	0	0	124.4
208	G	26.8	Very low	28.2	Very low	75 Å²	75	131.4 Å²	131.4	77%	0.773	76%	0.764	S	S	*	*				63.1	140.5	109.9	0	0	0	0	0	124.4
209	I	25.3	Very low	28.4	Very low	183 Å²	183	133.3 Å²	133.3	94%	0.938	77%	0.767	S	S	*	*			trans	-170.9	173.4	151.7	-102.9	157.9	0	0	0	110.1
210	C	25.4	Very low	28.7	Very low	121 Å²	121	136.1 Å²	136.1	82%	0.818	77%	0.767	S	S	*	*			trans	-135.8	161.6	-162.8	177.2	0	0	0	0	114.4
211	S	26.7	Very low	28.8	Very low	98 Å²	98	132.1 Å²	132.1	69%	0.685	76%	0.756	S	S	*	*			trans	134.9	112.4	137.2	-161.7	0	0	0	0	120.3
212	F	27.8	Very low	29.1	Very low	186 Å²	186	133.5 Å²	133.5	82%	0.816	76%	0.763	S	S	*	*			trans	59.8	133.1	135.1	-91.2	-68.2	0	0	0	127.6
213	K	29.5	Very low	29.2	Very low	164 Å²	164	130 Å²	130	71%	0.713	77%	0.768	S	S	*	*				128	122.5	118.2	-94.2	175.8	177.4	-174.6	0	123.2
214	Q	29.8	Very low	29.6	Very low	165 Å²	165	133.6 Å²	133.6	77%	0.771	78%	0.778	S	S	*	*			trans	61.1	161.4	135	-70.5	178.9	-92.8	0	0	124
215	A	31.9	Very low	29.6	Very low	95 Å²	95	138.4 Å²	138.4	79%	0.785	78%	0.783	S	S	*	*			cis	177.3	155.9	-34.2	0	0	0	0	0	114.1
216	G	27.5	Very low	29.7	Very low	75 Å²	75	137 Å²	137	77%	0.773	78%	0.78	S	S	*	*			trans	124.2	157	161.2	0	0	0	0	0	116.6
217	L	30.2	Very low	30.8	Very low	175 Å²	175	138.2 Å²	138.2	92%	0.916	78%	0.78	S	S	*	*			cis	-159.7	-175.9	-6.3	-108.5	170	0	0	0	112.4
218	Y	30.7	Very low	30.8	Very low	210 Å²	210	139 Å²	139	82%	0.824	77%	0.774	S	S	*	*			trans	-98.4	166.1	-156.1	-105.4	-91.6	0	0	0	120.3
219	T	35	Very low	30.8	Very low	127 Å²	127	143.7 Å²	143.7	78%	0.779	78%	0.775	S	S	*	*				169.5	133.9	113.5	32.9	0	0	0	0	119.9
220	R	33.3	Very low	31	Very low	209 Å²	209	139 Å²	139	79%	0.789	76%	0.759	S	S	*	*			trans	67	158.8	149.2	-74	-72.3	-177.5	172	1.6	121.9	D222	R220-D222 IonicContact NH1-OD1 3.99Å; R220-D222 IonicContact NH1-OD2 3.5Å; R220-D222 PolarHBondContact NH1-OD2 3.42Å
221	S	30.8	Very low	31	Very low	72 Å²	72	143.9 Å²	143.9	50%	0.503	76%	0.76	S	S	.	*			cis	-176.5	159.5	-28.3	-126.6	0	0	0	0	116.8
222	D	37.2	Very low	31	Very low	145 Å²	145	144.9 Å²	144.9	78%	0.775	76%	0.757	S	S	*	*			trans	59.5	164.7	147.1	-40.4	-21.8	0	0	0	119.9	R220	R220-D222 IonicContact NH1-OD1 3.99Å; R220-D222 IonicContact NH1-OD2 3.5Å; R220-D222 PolarHBondContact NH1-OD2 3.42Å
223	G	31.7	Very low	31	Very low	78 Å²	78	142.9 Å²	142.9	80%	0.804	76%	0.755	S	S	*	*			cis	168.1	170.2	-3.9	0	0	0	0	0	109.8
224	E	34.3	Very low	31	Very low	165 Å²	165	141 Å²	141	77%	0.771	76%	0.762	S	S	*	*			cis	-173	172.6	-12.4	-168.6	178.1	-137.7	0	0	111.2
225	W	27.3	Very low	31.1	Very low	221 Å²	221	144.4 Å²	144.4	84%	0.837	77%	0.768	S	S	*	*			trans	91.7	158.7	164.4	-61.6	88.2	0	0	0	125.1
226	S	28.1	Very low	32.2	Very low	108 Å²	108	145.1 Å²	145.1	76%	0.755	77%	0.765	S	S	*	*			trans	-157.4	-153	-177.3	-50.9	0	0	0	0	110
227	P	49.5	Very low	32.2	Very low	110 Å²	110	148.6 Å²	148.6	71%	0.714	77%	0.771	S	S	*	*			cis	-136.5	-152.4	-27.7	26.2	1.6	0	0	0	114
228	I	28.7	Very low	32.4	Very low	138 Å²	138	145.3 Å²	145.3	71%	0.708	76%	0.763	S	S	*	*			trans	121.8	128.3	141.4	-69.6	165.1	0	0	0	123.6
229	H	26.7	Very low	33.2	Very low	173 Å²	173	140 Å²	140	80%	0.801	75%	0.754	S	S	*	*			trans	46.6	167.3	153.1	-70.4	-23.5	0	0	0	125.5
230	S	28.4	Very low	33	Very low	85 Å²	85	142.9 Å²	142.9	59%	0.594	76%	0.756	S	S	*	*			cis	-178.7	158.2	-41.9	70.7	0	0	0	0	113.9
231	R	26.7	Very low	32.8	Very low	223 Å²	223	137.6 Å²	137.6	84%	0.842	75%	0.751	S	S	*	*			trans	69.6	164.9	154.1	-86.7	174.8	143.4	130.5	1.8	119
232	D	26.6	Very low	32.8	Very low	119 Å²	119	140.7 Å²	140.7	64%	0.636	76%	0.762	S	S	*	*			cis	-146.5	-169.5	-0.8	-137.1	-50.9	0	0	0	114.4
233	N	27.1	Very low	32.6	Very low	144 Å²	144	138.5 Å²	138.5	77%	0.77	76%	0.758	S	S	*	*			trans	-84.3	160.8	-171.1	-70.8	-92.2	0	0	0	117.4
234	S	30.6	Very low	32.5	Very low	123 Å²	123	143 Å²	143	86%	0.86	76%	0.758	S	S	*	*				-179.5	-177.8	117.7	48.1	0	0	0	0	114.1
235	R	31.3	Very low	32.4	Very low	238 Å²	238	141.7 Å²	141.7	90%	0.898	76%	0.756	S	S	*	*			trans	-126.7	-154.9	-167.9	-65.8	177	156.2	-163.4	0.5	112.1
236	P	54.3	Low	32.5	Very low	109 Å²	109	137.6 Å²	137.6	71%	0.708	75%	0.749	S	S	*	*				-134	178.4	-92.9	43.4	-26.2	0	0	0	115.4
237	T	28.7	Very low	32.5	Very low	148 Å²	148	137.4 Å²	137.4	91%	0.908	74%	0.743	S	S	*	*			trans	-158.6	167.7	152.2	21.2	0	0	0	0	113.3
238	S	34.1	Very low	31.4	Very low	107 Å²	107	139.1 Å²	139.1	75%	0.748	75%	0.747	S	S	*	*			trans	-136.9	-170.2	167.5	62.9	0	0	0	0	107.3
239	P	46.2	Very low	31.4	Very low	98 Å²	98	141 Å²	141	64%	0.636	75%	0.752	S	S	*	*			cis	-144.4	-158.4	2.3	42.8	-21.1	0	0	0	115.6
240	K	31.3	Very low	31.5	Very low	187 Å²	187	137.4 Å²	137.4	81%	0.813	75%	0.747	S	S	*	*			trans	78.2	138.9	151.5	-79.8	177.5	-174.9	-174.5	0	118.5
241	S	30.2	Very low	31.5	Very low	99 Å²	99	142.6 Å²	142.6	69%	0.692	76%	0.761	S	S	*	*				69.2	145.2	74.3	-89.6	0	0	0	0	113.2
242	D	28.9	Very low	31.7	Very low	137 Å²	137	137.1 Å²	137.1	73%	0.733	76%	0.764	S	S	*	*			cis	-162.3	-166.2	8.8	-124.6	-52.5	0	0	0	112.2
243	S	33.6	Very low	31.8	Very low	99 Å²	99	138.8 Å²	138.8	69%	0.692	77%	0.773	S	S	*	*			trans	83	144.3	163.2	-52.9	0	0	0	0	118.7
244	E	30.7	Very low	31.9	Very low	171 Å²	171	137.1 Å²	137.1	80%	0.799	77%	0.772	S	S	*	*			cis	80.6	141.2	30.2	-67.4	-169	-141.7	0	0	115.6
245	L	31.7	Very low	31.9	Very low	139 Å²	139	140 Å²	140	73%	0.728	77%	0.772	S	S	*	*			cis	-169.8	170.8	-22.7	-118.4	177.3	0	0	0	109.9
246	I	29.4	Very low	31.9	Very low	134 Å²	134	136.3 Å²	136.3	69%	0.687	77%	0.77	S	S	*	*			trans	78.8	106	151.5	-70.6	161.2	0	0	0	122.3
247	T	28.6	Very low	31.1	Very low	104 Å²	104	137.2 Å²	137.2	64%	0.638	78%	0.776	S	S	*	*			trans	45.8	138.6	136.8	71.4	0	0	0	0	125.5
248	N	26.6	Very low	31.2	Very low	147 Å²	147	133.7 Å²	133.7	79%	0.786	76%	0.762	S	S	*	*				-165.7	170.9	99.9	-101.2	-54.1	0	0	0	115
249	H	28	Very low	31	Very low	176 Å²	176	136.1 Å²	136.1	82%	0.815	76%	0.763	S	S	*	*			trans	-71.1	166	-170.2	-66.6	-101.3	0	0	0	114.2
250	S	28.4	Very low	30.2	Very low	99 Å²	99	139.7 Å²	139.7	69%	0.692	77%	0.771	S	S	*	*			cis	-166.5	155.5	46.8	53.4	0	0	0	0	117
251	E	29.3	Very low	30.4	Very low	193 Å²	193	140.9 Å²	140.9	90%	0.902	77%	0.771	S	S	*	*			trans	33.7	119.6	146.6	-59.7	178.8	153.7	0	0	123
252	A	29.7	Very low	30.6	Very low	108 Å²	108	140.7 Å²	140.7	89%	0.893	78%	0.775	S	S	*	*				-173.6	145.7	125.6	0	0	0	0	0	113.1
253	D	28.8	Very low	30.7	Very low	155 Å²	155	146.6 Å²	146.6	83%	0.829	79%	0.787	S	S	*	*			trans	-50.5	158.3	-168.1	-83.9	-58.3	0	0	0	122.8
254	S	29.7	Very low	31.2	Very low	109 Å²	109	145.5 Å²	145.5	76%	0.762	79%	0.792	S	S	*	*			trans	70.9	147.6	141.9	73	0	0	0	0	121.1
255	Q	30.8	Very low	31.5	Very low	184 Å²	184	146.7 Å²	146.7	86%	0.86	80%	0.797	S	S	*	*			cis	-158	113.4	-36.1	-138.4	176.2	12.4	0	0	107.4
256	N	32	Very low	31.6	Very low	159 Å²	159	148.1 Å²	148.1	85%	0.85	81%	0.805	S	S	*	*			trans	-158.9	99.6	176.1	-127.4	-24.6	0	0	0	110.4	A258	N256-A258 PolarHBondContact O-N 2.85Å; N256-A258 VanDerWaalsContact O-N 3.11Å
257	P	36	Very low	31.8	Very low	129 Å²	129	147.6 Å²	147.6	84%	0.838	81%	0.81	S	S	*	*			trans	-73.7	104.1	179.8	28.7	-32.2	0	0	0	110.4
258	A	30.6	Very low	32	Very low	73 Å²	73	151.8 Å²	151.8	60%	0.603	82%	0.822	S	S	*	*			trans	-63.2	149.1	174	0	0	0	0	0	111.6	N256 H260	N256-A258 PolarHBondContact O-N 2.85Å; N256-A258 VanDerWaalsContact O-N 3.11Å; A258-H260 PolarHBondContact O-CD2 2.96Å; A258-H260 VanDerWaalsContact O-CD2 3.28Å; A258-H260 PolarHBondContact O-N 3.05Å
259	M	30.1	Very low	32.2	Very low	158 Å²	158	149.9 Å²	149.9	78%	0.778	83%	0.827	S	S	*	*			trans	-73.6	94.9	-179.5	-169.6	-175.8	-61.9	0	0	110.8	W261	M259-W261 HydrophobicContact SD-CZ2 4.37Å
260	H	30.6	Very low	32.3	Very low	174 Å²	174	146.4 Å²	146.4	81%	0.806	83%	0.829	S	S	*	*			trans	-77.8	122	175.6	-77.2	-90	0	0	0	111.3	A258	A258-H260 PolarHBondContact O-CD2 2.96Å; A258-H260 VanDerWaalsContact O-CD2 3.28Å; A258-H260 PolarHBondContact O-N 3.05Å
261	W	34.8	Very low	32.7	Very low	212 Å²	212	146 Å²	146	80%	0.803	83%	0.831	S	S	*	*			trans	-86.1	117.4	174.7	-73.3	84.8	0	0	0	111.2	M259	M259-W261 HydrophobicContact SD-CZ2 4.37Å
262	A	33.4	Very low	32.9	Very low	95 Å²	95	142.7 Å²	142.7	79%	0.785	83%	0.826	S	S	*	*			trans	-107.4	132.2	165.1	0	0	0	0	0	109.4
263	W	31.8	Very low	33	Very low	261 Å²	261	143 Å²	143	99%	0.989	82%	0.819	S	S	*	*	S	Bend	trans	-88.6	115.8	174.3	-77.8	82.4	0	0	0	109.5
264	G	45	Very low	33.2	Very low	76 Å²	76	145 Å²	145	78%	0.784	82%	0.821	S	S	*	*	S	Bend	trans	166	-25.8	168.5	0	0	0	0	0	119.2
265	E	36.1	Very low	33.4	Very low	196 Å²	196	147.7 Å²	147.7	92%	0.916	83%	0.826	S	S	*	*			trans	-130.4	158.6	-165.8	-64.2	-171.8	138	0	0	114.8
266	L	34.9	Very low	33.4	Very low	168 Å²	168	144.6 Å²	144.6	88%	0.88	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-85.8	136.3	180	-79.5	161.5	0	0	0	111.6
267	P	33.3	Very low	33.4	Very low	123 Å²	123	145.7 Å²	145.7	80%	0.799	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-77.2	126.3	-179.3	30.4	-34	0	0	0	112.5
268	Q	32.1	Very low	33.2	Very low	193 Å²	193	148.5 Å²	148.5	90%	0.902	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-83	141.7	162.5	-70.8	-175	-11.8	0	0	110.4
269	A	30.5	Very low	33.6	Very low	107 Å²	107	150.4 Å²	150.4	88%	0.884	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-75.7	129.6	-178	0	0	0	0	0	112.1
270	A	30.1	Very low	33.5	Very low	103 Å²	103	147.3 Å²	147.3	85%	0.851	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-87.3	127	174.2	0	0	0	0	0	111.3
271	A	36.7	Very low	33.5	Very low	90 Å²	90	142.8 Å²	142.8	74%	0.744	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-87.8	145.1	168.3	0	0	0	0	0	110.8
272	P	33.8	Very low	33.7	Very low	123 Å²	123	138.5 Å²	138.5	80%	0.799	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-73.6	139.3	-177.1	29.6	-34.8	0	0	0	112.2
273	P	32.3	Very low	33.4	Very low	115 Å²	115	142.4 Å²	142.4	75%	0.747	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-92.7	126.5	-176	33.9	-32.8	0	0	0	113.2
274	F	31.7	Very low	33.2	Very low	198 Å²	198	137.6 Å²	137.6	87%	0.868	83%	0.828	S	S	*	*			trans	-145.6	134.9	149.9	-102.9	-76.8	0	0	0	111.1
275	L	34.2	Very low	32.5	Very low	165 Å²	165	142.9 Å²	142.9	86%	0.864	83%	0.83	S	S	*	*			trans	65.9	96.3	173	-51.4	-175.3	0	0	0	117.8
276	S	31.6	Very low	32.6	Very low	119 Å²	119	139.2 Å²	139.2	83%	0.832	82%	0.823	S	S	*	*			trans	-86.1	151.5	159.9	-61.3	0	0	0	0	111.7
277	L	32.3	Very low	32.3	Very low	181 Å²	181	137.9 Å²	137.9	95%	0.948	82%	0.821	S	S	*	*				-171	151.4	128.1	-100.8	159.1	0	0	0	112.9
278	K	30.4	Very low	32.2	Very low	188 Å²	188	137.4 Å²	137.4	82%	0.817	82%	0.821	S	S	*	*			trans	-100.2	179	178.7	-115.1	-169.7	177	177.8	0	109.6
279	P	39.7	Very low	32	Very low	114 Å²	114	134.7 Å²	134.7	74%	0.74	82%	0.817	S	S	*	*			cis	-144.2	149.3	22.3	38.3	-16.5	0	0	0	120.4
280	A	28	Very low	32.3	Very low	92 Å²	92	135.6 Å²	135.6	76%	0.76	81%	0.814	S	S	*	*			trans	53.1	98.4	133.5	0	0	0	0	0	125.1
281	G	30.1	Very low	32.6	Very low	79 Å²	79	137.5 Å²	137.5	81%	0.814	81%	0.814	S	S	*	*			trans	71.6	173.7	134.7	0	0	0	0	0	120.6
282	P	39.1	Very low	32.5	Very low	122 Å²	122	138.6 Å²	138.6	79%	0.792	82%	0.817	S	S	*	*			cis	-130.5	172.7	-3.9	42.6	-27.3	0	0	0	116.4
283	H	27.1	Very low	32.7	Very low	178 Å²	178	141.6 Å²	141.6	82%	0.824	82%	0.818	S	S	*	*			trans	15.5	143.6	152.8	-79.1	-81.1	0	0	0	125
284	I	28.3	Very low	32.9	Very low	160 Å²	160	143.1 Å²	143.1	82%	0.821	82%	0.819	S	S	*	*			trans	122.5	149.4	147.1	-72.5	148.8	0	0	0	117.9
285	F	30.2	Very low	33.2	Very low	187 Å²	187	140.5 Å²	140.5	82%	0.82	82%	0.82	S	S	*	*			trans	-58.2	166.6	-166.9	-80.5	-89.9	0	0	0	118.2
286	P	38.1	Very low	33.2	Very low	118 Å²	118	141.4 Å²	141.4	77%	0.766	82%	0.819	S	S	*	*			trans	-84	151.9	-165.3	34.1	-36.9	0	0	0	115
287	V	28.2	Very low	33.1	Very low	141 Å²	141	146 Å²	146	86%	0.855	83%	0.825	S	S	*	*			trans	-135.6	143.5	167.4	179.3	0	0	0	0	108.8
288	S	31	Very low	33.2	Very low	113 Å²	113	148.5 Å²	148.5	79%	0.79	82%	0.821	S	S	*	*			trans	-98.5	152.8	-172.3	45.2	0	0	0	0	113.9
289	V	29.5	Very low	33.1	Very low	136 Å²	136	144.5 Å²	144.5	82%	0.824	82%	0.823	S	S	*	*			trans	-136.1	140	175.4	177.9	0	0	0	0	107.6
290	P	37	Very low	32.8	Very low	125 Å²	125	145.8 Å²	145.8	81%	0.812	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-88.9	162.5	-153.3	34	-37.7	0	0	0	116.3
291	V	34.5	Very low	32.8	Very low	143 Å²	143	152.9 Å²	152.9	87%	0.867	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-81	128.9	179.2	176.4	0	0	0	0	111.6
292	S	36.4	Very low	32.7	Very low	114 Å²	114	157.8 Å²	157.8	80%	0.797	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-83	157.1	168.1	-168.1	0	0	0	0	111.6
293	K	36.6	Very low	32.1	Very low	186 Å²	186	161.3 Å²	161.3	81%	0.809	84%	0.837	S	S	*	*	S	Bend	trans	-85	161	-173.8	-60.2	-179.5	-179.3	178.3	0	112.6
294	N	37.7	Very low	32.1	Very low	147 Å²	147	159.4 Å²	159.4	79%	0.786	84%	0.838	S	S	*	*			trans	83.4	61.5	165.3	-56.2	4.1	0	0	0	119
295	T	37.3	Very low	32.2	Very low	143 Å²	143	157.6 Å²	157.6	88%	0.877	84%	0.84	S	S	*	*			trans	-141.9	136.6	136.6	35.2	0	0	0	0	110.4
296	H	33.7	Very low	32.1	Very low	183 Å²	183	153.6 Å²	153.6	85%	0.847	83%	0.834	S	S	*	*			trans	-98.6	106.9	179.9	-79.2	-105	0	0	0	111.2
297	F	30.3	Very low	31.7	Very low	217 Å²	217	153.7 Å²	153.7	95%	0.952	83%	0.829	S	S	*	*			trans	-141.8	125.5	157.3	-99.3	-86.4	0	0	0	108.7
298	R	33.2	Very low	31.8	Very low	233 Å²	233	154.9 Å²	154.9	88%	0.879	83%	0.825	S	S	*	*			trans	-122.2	91.3	-177.7	-164.1	179.8	-166	-172.5	3.8	110
299	A	29.3	Very low	31.5	Very low	103 Å²	103	155.8 Å²	155.8	85%	0.851	83%	0.83	S	S	*	*			trans	-67.7	135.6	164.9	0	0	0	0	0	109.2
300	I	32.7	Very low	31.3	Very low	142 Å²	142	153.6 Å²	153.6	73%	0.728	83%	0.826	S	S	*	*			trans	-104.2	126.9	173.7	-61.1	174.9	0	0	0	107.8
301	R	27.8	Very low	31.6	Very low	241 Å²	241	152.8 Å²	152.8	91%	0.909	82%	0.821	S	S	*	*			trans	-127.3	149.9	154.6	-85.9	-171.3	167.8	175.5	-4.1	108.5
302	H	28.3	Very low	31.1	Very low	181 Å²	181	151.3 Å²	151.3	84%	0.838	82%	0.817	S	S	*	*			trans	-73.2	145.5	-176.2	-63.6	-129.9	0	0	0	110.3
303	E	27.3	Very low	30.7	Very low	196 Å²	196	150.3 Å²	150.3	92%	0.916	81%	0.809	S	S	*	*			trans	-137.2	163	138.1	-80.2	-153	162.4	0	0	109.7
304	T	27.5	Very low	30.2	Very low	139 Å²	139	149.7 Å²	149.7	85%	0.853	81%	0.807	S	S	*	*			trans	-79.8	148.5	-169.2	49.2	0	0	0	0	113.9
305	S	29.7	Very low	29.7	Very low	122 Å²	122	150.4 Å²	150.4	85%	0.853	81%	0.807	S	S	*	*			trans	-142.4	149.1	148	55.3	0	0	0	0	109.7
306	S	28.4	Very low	29.1	Very low	102 Å²	102	151.2 Å²	151.2	71%	0.713	80%	0.801	S	S	*	*			trans	-124.6	168.3	171.6	92.6	0	0	0	0	110.4
307	D	29.5	Very low	29	Very low	121 Å²	121	146.8 Å²	146.8	65%	0.647	80%	0.797	S	S	*	*			trans	70.7	116.3	157.2	-77.1	63.6	0	0	0	121.3
308	Q	30.1	Very low	29.1	Very low	166 Å²	166	142.7 Å²	142.7	78%	0.776	79%	0.791	S	S	*	*				98.3	110.2	128.4	-71.4	174.1	48.8	0	0	121.6
309	C	25.2	Very low	28.7	Very low	132 Å²	132	136.3 Å²	136.3	89%	0.892	78%	0.783	S	S	*	*			trans	79.5	152	138.4	-79.3	0	0	0	0	121.5
310	A	25.2	Very low	28.6	Very low	90 Å²	90	139.2 Å²	139.2	74%	0.744	78%	0.783	S	S	*	*			trans	-120.6	-162.2	-172	0	0	0	0	0	108.4
311	P	42.3	Very low	29.1	Very low	108 Å²	108	137.1 Å²	137.1	70%	0.701	78%	0.779	S	S	*	*			cis	-139.4	178.2	-2.1	42.2	-24.2	0	0	0	116.9
312	S	24.4	Very low	29	Very low	112 Å²	112	132.6 Å²	132.6	78%	0.783	77%	0.771	S	S	*	*			trans	74.3	163.3	160.9	88.4	0	0	0	0	116.8
313	S	27.9	Very low	29	Very low	92 Å²	92	132.6 Å²	132.6	64%	0.643	77%	0.771	S	S	*	*			cis	-158.6	158.9	3.4	-145.3	0	0	0	0	112.9
314	K	26.6	Very low	29.2	Very low	174 Å²	174	131.7 Å²	131.7	76%	0.757	77%	0.767	S	S	*	*			trans	59.9	124.3	151.4	-74.3	173	-179.6	179.2	0	122.1
315	M	26.9	Very low	29.3	Very low	161 Å²	161	132.9 Å²	132.9	79%	0.793	76%	0.763	S	S	*	*				63.5	154.1	126.3	-67.7	177.7	137	0	0	120
316	Q	25.3	Very low	29.5	Very low	160 Å²	160	130.9 Å²	130.9	75%	0.748	75%	0.754	S	S	*	*			cis	-164	165.4	-19	175.8	168.3	7.3	0	0	106.8
317	A	30.3	Very low	29.3	Very low	91 Å²	91	134 Å²	134	75%	0.752	76%	0.757	S	S	*	*			trans	-61.6	155.8	179.5	0	0	0	0	0	113.7
318	P	32.3	Very low	29.4	Very low	130 Å²	130	133.9 Å²	133.9	84%	0.844	76%	0.761	S	S	*	*				-138.7	-174.2	106.5	40.5	-29.9	0	0	0	114.1
319	S	26.5	Very low	29.3	Very low	99 Å²	99	133.6 Å²	133.6	69%	0.692	76%	0.757	S	S	*	*			trans	-133.1	152.7	-169.6	53.6	0	0	0	0	113.3
320	L	27.4	Very low	29.3	Very low	164 Å²	164	137.1 Å²	137.1	86%	0.859	75%	0.752	S	S	*	*			trans	64.7	178.7	163	-62.3	170.5	0	0	0	115.9
321	P	42.1	Very low	29.4	Very low	99 Å²	99	138 Å²	138	64%	0.643	74%	0.74	S	S	*	*			cis	-133.7	-174.5	-16.5	21.8	3.3	0	0	0	115.2
322	I	26.8	Very low	28.7	Very low	146 Å²	146	139 Å²	139	75%	0.749	75%	0.745	S	S	*	*			trans	74.1	149.3	141.3	-83.4	161.7	0	0	0	117.3
323	E	26.8	Very low	29.6	Very low	180 Å²	180	139.5 Å²	139.5	84%	0.841	75%	0.745	S	S	*	*			cis	-142.2	-143.7	44.4	-153.9	146.4	-97.5	0	0	116.5
324	E	31.8	Very low	29.5	Very low	178 Å²	178	142.4 Å²	142.4	83%	0.832	75%	0.754	S	S	*	*			trans	-118.7	175.9	-161.3	-63.5	-178.1	160.5	0	0	112.7
325	E	30.4	Very low	30.7	Very low	163 Å²	163	139.4 Å²	139.4	76%	0.762	75%	0.752	S	S	*	*			cis	-144.4	-150.6	-1.9	-127.5	-78.5	81.7	0	0	105.7
326	A	33	Very low	30.9	Very low	80 Å²	80	137.4 Å²	137.4	66%	0.661	75%	0.748	S	S	*	*			cis	-152.7	-179.7	7.1	0	0	0	0	0	109
327	E	25.3	Very low	31	Very low	167 Å²	167	135.6 Å²	135.6	78%	0.78	75%	0.748	S	S	*	*			cis	-151.6	156	10.1	173.2	167.2	-162.2	0	0	111.8
328	V	30.3	Very low	31	Very low	120 Å²	120	138.4 Å²	138.4	73%	0.727	75%	0.748	S	S	*	*			trans	-9.1	132.3	155.7	168.3	0	0	0	0	116.9
329	K	28.8	Very low	30.9	Very low	159 Å²	159	139.8 Å²	139.8	69%	0.691	74%	0.743	S	S	*	*			cis	-178.7	-162.8	-4.8	-152.8	-162.3	177.8	-160.2	0	110.2	E331	K329-E331 WeakPolarHBondContact CD-OE1 3.36Å; K329-E331 WeakPolarHBondContact CE-OE1 3.38Å; K329-E331 IonicContact NZ-OE1 2.7Å; K329-E331 PolarHBondContact NZ-OE1 2.82Å
330	R	25.2	Very low	31.1	Very low	207 Å²	207	139.2 Å²	139.2	78%	0.781	74%	0.739	S	S	*	*			trans	100.9	153	154.9	-50.5	-146.9	97.2	117.6	11.5	117.1
331	E	26.3	Very low	31.2	Very low	107 Å²	107	140.2 Å²	140.2	50%	0.5	74%	0.739	S	S	.	*			cis	-169.8	174.3	-45.3	-110.6	154.6	-155.8	0	0	110.1	K329	K329-E331 WeakPolarHBondContact CD-OE1 3.36Å; K329-E331 WeakPolarHBondContact CE-OE1 3.38Å; K329-E331 IonicContact NZ-OE1 2.7Å; K329-E331 PolarHBondContact NZ-OE1 2.82Å
332	T	27.7	Very low	30.5	Very low	130 Å²	130	140 Å²	140	80%	0.798	74%	0.74	S	S	*	*			trans	-139	165.1	-166	61	0	0	0	0	113.3
333	P	43	Very low	30.5	Very low	122 Å²	122	141.2 Å²	141.2	79%	0.792	75%	0.745	S	S	*	*				-152.6	168.8	84.8	41.7	-22.7	0	0	0	118.4
334	D	26.6	Very low	30.5	Very low	154 Å²	154	142.5 Å²	142.5	82%	0.824	74%	0.742	S	S	*	*			trans	-87	-172.2	164.5	-75.4	-59.9	0	0	0	112.1
335	P	51.3	Low	30.2	Very low	111 Å²	111	140.9 Å²	140.9	72%	0.721	74%	0.736	S	S	*	*			cis	-136.2	-169.5	-0.4	29.5	-4.7	0	0	0	115.8
336	V	31.3	Very low	29.9	Very low	118 Å²	118	140.6 Å²	140.6	72%	0.715	74%	0.735	S	S	*	*				156.5	115.5	124.5	160.5	0	0	0	0	116.6
337	T	27.9	Very low	29.4	Very low	123 Å²	123	142.6 Å²	142.6	76%	0.755	74%	0.739	S	S	*	*			trans	62.2	155.8	155.8	57.2	0	0	0	0	121.4
338	M	30	Very low	29.4	Very low	149 Å²	149	142.2 Å²	142.2	73%	0.734	74%	0.737	S	S	*	*			cis	-158.8	151.2	-2.6	-129	164.7	156.9	0	0	113.1
339	E	30.6	Very low	29.1	Very low	159 Å²	159	142.9 Å²	142.9	74%	0.743	74%	0.741	S	S	*	*			trans	29.8	153.7	139.6	-68.3	-172.9	-136.6	0	0	124.1
340	S	31.1	Very low	29	Very low	87 Å²	87	142.8 Å²	142.8	61%	0.608	75%	0.748	S	S	*	*			cis	-170.9	154.1	-6	-96.1	0	0	0	0	113.6
341	E	29.1	Very low	29.4	Very low	185 Å²	185	138.3 Å²	138.3	86%	0.864	75%	0.746	S	S	*	*			trans	57.5	160.6	149	-69.3	-166.9	165.7	0	0	123.8
342	S	28.1	Very low	29.3	Very low	95 Å²	95	137.3 Å²	137.3	66%	0.664	75%	0.751	S	S	*	*			cis	-167.6	163.6	-24.7	62.8	0	0	0	0	115.5
343	M	25.7	Very low	29.2	Very low	172 Å²	172	139.2 Å²	139.2	85%	0.847	75%	0.75	S	S	*	*			trans	51.1	118.3	150.5	-68	-162.3	-168.9	0	0	128.3
344	R	27.3	Very low	28.4	Very low	206 Å²	206	140.7 Å²	140.7	78%	0.777	75%	0.746	S	S	*	*				63.6	131.7	108.7	-158.4	-174.1	176.3	173.1	-0.2	125.2
345	M	25.6	Very low	28.3	Very low	144 Å²	144	139 Å²	139	71%	0.709	74%	0.742	S	S	*	*			trans	68	166.6	156.5	-87.6	163	149.5	0	0	118.1
346	E	24.3	Very low	27.3	Very low	158 Å²	158	138 Å²	138	74%	0.738	74%	0.744	S	S	*	*			cis	-146.9	-156.1	14.7	-148.3	168.9	-140.1	0	0	114.3
347	T	22.5	Very low	27	Very low	122 Å²	122	137 Å²	137	75%	0.748	75%	0.747	S	S	*	*			trans	-136.4	143	-174.3	-56.7	0	0	0	0	112
348	Q	24.6	Very low	26.8	Very low	159 Å²	159	137.1 Å²	137.1	74%	0.743	75%	0.752	S	S	*	*			trans	179.5	119.8	160.9	-99.7	149.9	92.4	0	0	108.8
349	T	23.9	Very low	26.6	Very low	133 Å²	133	134 Å²	134	82%	0.816	75%	0.75	S	S	*	*				85.4	155.4	78.1	50.5	0	0	0	0	117.6
350	L	26.8	Very low	26.7	Very low	157 Å²	157	132.1 Å²	132.1	82%	0.822	75%	0.754	S	S	*	*			trans	-77.3	168.9	-167.8	-60.9	165.8	0	0	0	114.2
351	P	34.4	Very low	26.6	Very low	114 Å²	114	133.9 Å²	133.9	74%	0.74	77%	0.766	S	S	*	*				-120.1	163.2	86.1	4.7	18.1	0	0	0	112.3
352	S	23.7	Very low	26.6	Very low	86 Å²	86	134 Å²	134	60%	0.601	76%	0.764	S	S	*	*				61	144.4	55	-63.9	0	0	0	0	113.1
353	E	25.9	Very low	26.7	Very low	170 Å²	170	135.8 Å²	135.8	79%	0.794	77%	0.771	S	S	*	*			cis	-170.2	157.1	-6.4	-110.2	154	-120	0	0	105.7
354	E	25.9	Very low	26.7	Very low	152 Å²	152	134.7 Å²	134.7	71%	0.71	77%	0.769	S	S	*	*			cis	-163.8	177.6	-6.7	-142.4	-64.8	90	0	0	107.7
355	T	25.2	Very low	27	Very low	119 Å²	119	129.8 Å²	129.8	73%	0.73	77%	0.766	S	S	*	*			trans	77.1	161.2	170.1	79.5	0	0	0	0	116.2
356	A	28.7	Very low	28	Very low	91 Å²	91	128.4 Å²	128.4	75%	0.752	77%	0.768	S	S	*	*			cis	-146.6	170.7	3.6	0	0	0	0	0	111.6
357	A	25.1	Very low	28.3	Very low	96 Å²	96	126.8 Å²	126.8	79%	0.793	77%	0.774	S	S	*	*			trans	-79.8	157.4	168.1	0	0	0	0	0	112.4
358	C	23.9	Very low	28.9	Very low	125 Å²	125	130.4 Å²	130.4	85%	0.845	78%	0.779	S	S	*	*				164.3	163.2	105.3	-155.2	0	0	0	0	113.8
359	A	26.8	Very low	29.4	Very low	85 Å²	85	133.3 Å²	133.3	70%	0.702	79%	0.789	S	S	*	*			trans	56	111.8	149.4	0	0	0	0	0	121.4
360	S	32.5	Very low	29.9	Very low	119 Å²	119	135.7 Å²	135.7	83%	0.832	79%	0.788	S	S	*	*			trans	-38.6	144.4	148.3	54.9	0	0	0	0	116.7
361	S	27.9	Very low	30.4	Very low	123 Å²	123	133.8 Å²	133.8	86%	0.86	78%	0.779	S	S	*	*			trans	-145.9	153.1	145.7	66.9	0	0	0	0	111.8
362	K	29.6	Very low	30.5	Very low	188 Å²	188	137.2 Å²	137.2	82%	0.817	78%	0.782	S	S	*	*			trans	-82.6	159.5	-167.2	-61.3	173	177.8	177.5	0	113
363	T	31.2	Very low	31.1	Very low	133 Å²	133	142.1 Å²	142.1	82%	0.816	79%	0.788	S	S	*	*			trans	50.7	122.4	146.2	51.3	0	0	0	0	119.5
364	D	25.8	Very low	31.3	Very low	149 Å²	149	139.7 Å²	139.7	80%	0.797	79%	0.79	S	S	*	*				-163.9	171.8	89	-161.5	14.3	0	0	0	111.9
365	S	32.4	Very low	32	Very low	103 Å²	103	141.2 Å²	141.2	72%	0.72	79%	0.789	S	S	*	*			trans	-154.8	127.9	168.6	-78.9	0	0	0	0	109.1
366	P	47.1	Very low	32.5	Very low	114 Å²	114	144.8 Å²	144.8	74%	0.74	80%	0.797	S	S	*	*				-156.9	170.7	84.1	40.6	-22.7	0	0	0	116.7
367	S	30.8	Very low	33	Very low	124 Å²	124	148.3 Å²	148.3	87%	0.867	80%	0.802	S	S	*	*				-171	161.6	122.3	49.6	0	0	0	0	112
368	K	35.1	Very low	33.5	Very low	199 Å²	199	146.8 Å²	146.8	87%	0.865	80%	0.796	S	S	*	*			trans	-106.1	137.7	-169	-63.5	164.5	-177.9	165.8	0	111.5
369	K	34.8	Very low	34.2	Very low	219 Å²	219	146.6 Å²	146.6	95%	0.952	80%	0.796	S	S	*	*			trans	-121.8	143	143.3	-80.1	-174.6	177.1	175.9	0	108.8
370	K	35.2	Very low	35	Very low	183 Å²	183	149.6 Å²	149.6	80%	0.796	80%	0.8	S	S	*	*			trans	-152.1	123.9	-166.2	173.3	-170.5	174.2	-173.9	0	109.3
371	D	36.6	Very low	35.5	Very low	117 Å²	117	146.9 Å²	146.9	63%	0.626	79%	0.791	S	S	*	*			trans	166	151	151.7	-93.3	-9.3	0	0	0	108.1
372	K	37	Very low	36.6	Very low	186 Å²	186	145.1 Å²	145.1	81%	0.809	77%	0.771	S	S	*	*			cis	-141.3	172.2	4.7	-120.7	147.4	-173.8	126.5	0	110.3
373	R	35	Very low	37.8	Very low	190 Å²	190	144.5 Å²	144.5	72%	0.717	77%	0.765	S	S	*	*			trans	-121.2	138.1	-164.3	174.9	-178.6	-171.6	177	6.6	112.1	R375	R373-R375 HydrophobicContact CG-CG 4.27Å
374	S	31.5	Very low	38.4	Very low	119 Å²	119	145.1 Å²	145.1	83%	0.832	76%	0.762	S	S	*	*			trans	-99.8	154.2	148.8	60.5	0	0	0	0	109.7
375	R	40.2	Very low	39.6	Very low	183 Å²	183	144.2 Å²	144.2	69%	0.691	76%	0.757	S	S	*	*			trans	-120.3	128.8	-177.8	-80.3	172.1	159.3	162.1	-8.6	108.3	R373	R373-R375 HydrophobicContact CG-CG 4.27Å
376	H	35.5	Very low	40.5	Very low	195 Å²	195	142.8 Å²	142.8	90%	0.903	74%	0.742	S	S	*	*			trans	-176.2	71.9	140.8	-82	-42.6	0	0	0	109.7
377	L	39.1	Very low	41	Very low	164 Å²	164	141.2 Å²	141.2	86%	0.859	73%	0.726	S	S	*	*			trans	-139.9	146.8	165.2	-73.2	176.4	0	0	0	108
378	G	35.7	Very low	42.2	Very low	64 Å²	64	141.4 Å²	141.4	66%	0.66	72%	0.722	S	S	*	*			trans	-121.1	134.9	169.6	0	0	0	0	0	109.3
379	S	38.7	Very low	43.2	Very low	122 Å²	122	140.5 Å²	140.5	85%	0.853	72%	0.721	S	S	*	*	S	Bend	trans	42.1	101.1	177	55	0	0	0	0	116
380	D	42.7	Very low	44.4	Very low	147 Å²	147	133.2 Å²	133.2	79%	0.786	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-56.1	138.6	174.4	-51.4	-77	0	0	0	111.8
381	G	43.7	Very low	45.5	Very low	62 Å²	62	131.6 Å²	131.6	64%	0.639	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-91.8	132.2	-179.7	0	0	0	0	0	112
382	I	51.5	Low	46.5	Very low	87 Å²	87	131.4 Å²	131.4	45%	0.446	69%	0.693	S	S	.	*	P	Polyproline II helix	trans	-76.8	133.2	172.8	-57.9	173.9	0	0	0	108.5	D386 I387 Y398	I382-D386 HydrophobicContact CG2-CB 3.65Å; I382-I387 HydrophobicContact CG2-CG1 4.49Å; I382-Y398 HydrophobicContact CD1-CE1 4.12Å
383	Y	54.9	Low	47.3	Very low	174 Å²	174	130.8 Å²	130.8	68%	0.682	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-86.2	160.6	176	-82	-99.3	0	0	0	111.2	D385 D386	Y383-D385 PolarHBondContact O-N 3.02Å; Y383-D386 PolarHBondContact N-OD2 2.97Å; Y383-D386 WeakPolarHBondContact O-CB 3.4Å; Y383-D386 PolarHBondContact O-N 3.25Å
384	L	42.3	Very low	48.6	Very low	147 Å²	147	124.5 Å²	124.5	77%	0.77	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-63.4	-28.4	-174.3	-75.8	167.8	0	0	0	113.4	I387	L384-I387 HydrophobicContact CD2-CD1 3.96Å
385	D	50.9	Low	50.2	Low	129 Å²	129	119.9 Å²	119.9	69%	0.69	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-74.6	-27.6	179.3	-52.1	-64.3	0	0	0	112.3	Y383 I387 T388	Y383-D385 PolarHBondContact O-N 3.02Å; D385-I387 PolarHBondContact O-N 3.21Å; D385-T388 PolarHBondContact O-OG1 3.03Å
386	D	51.5	Low	51.3	Low	74 Å²	74	113.3 Å²	113.3	40%	0.396	63%	0.629	S	S	.	*	G	3₁₀ helix	trans	-68.9	-21.2	178	-51.3	-32.6	0	0	0	112.1	I382 Y383 T388 E389	I382-D386 HydrophobicContact CG2-CB 3.65Å; Y383-D386 PolarHBondContact N-OD2 2.97Å; Y383-D386 WeakPolarHBondContact O-CB 3.4Å; Y383-D386 PolarHBondContact O-N 3.25Å; D386-T388 VanDerWaalsContact C-N 3.26Å; D386-T388 PolarHBondContact O-N 3.48Å; D386-E389 PolarHBondContact O-N 2.81Å
387	I	58.3	Low	52.1	Low	81 Å²	81	110.1 Å²	110.1	42%	0.415	62%	0.618	S	S	.	*	G	3₁₀ helix	trans	-67.8	-27.5	-173.2	-58.9	-179.2	0	0	0	111.6	I382 L384 D385 E389	I382-I387 HydrophobicContact CG2-CG1 4.49Å; L384-I387 HydrophobicContact CD2-CD1 3.96Å; D385-I387 PolarHBondContact O-N 3.21Å; I387-E389 VanDerWaalsContact C-N 3.31Å; I387-E389 PolarHBondContact O-N 2.81Å
388	T	56.1	Low	52.5	Low	128 Å²	128	110 Å²	110	79%	0.785	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-77	-10.2	176.8	30.1	0	0	0	0	114.8	D385 D386	D385-T388 PolarHBondContact O-OG1 3.03Å; D386-T388 VanDerWaalsContact C-N 3.26Å; D386-T388 PolarHBondContact O-N 3.48Å
389	E	55.7	Low	53.3	Low	179 Å²	179	113.8 Å²	113.8	84%	0.836	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-100.8	-2.5	178.5	-58.3	-164.3	161.8	0	0	113.6	D386 I387	D386-E389 PolarHBondContact O-N 2.81Å; I387-E389 VanDerWaalsContact C-N 3.31Å; I387-E389 PolarHBondContact O-N 2.81Å
390	L	60.7	Low	53.3	Low	67 Å²	67	114.1 Å²	114.1	35%	0.351	61%	0.605	S	S	.	*	S	Bend	trans	-87.5	140.2	-178.6	-81.7	161.9	0	0	0	113	V394	L390-V394 HydrophobicContact CD2-CB 4.37Å; L390-V394 HydrophobicContact CD2-CG1 3.95Å
391	E	57.3	Low	52.9	Low	149 Å²	149	115 Å²	115	70%	0.696	60%	0.602	S	S	*	*			trans	-63.3	142.6	171.9	-77.4	-171.5	135.4	0	0	111.6	E393 V394 A395	E391-E393 VanDerWaalsContact C-N 3.28Å; E391-E393 PolarHBondContact O-N 2.75Å; E391-E393 VanDerWaalsContact O-N 3.13Å; E391-V394 HydrophobicContact CB-CG2 4.34Å; E391-V394 PolarHBondContact O-N 2.78Å; E391-A395 PolarHBondContact O-N 2.84Å; E391-A395 VanDerWaalsContact O-N 3.14Å
392	P	58.4	Low	52.4	Low	113 Å²	113	117.3 Å²	117.3	73%	0.734	61%	0.609	S	S	*	*	H	α-helix	trans	-56.1	-35.2	-172.2	-28.8	35.6	0	0	0	115.2	V394 A396	P392-V394 VanDerWaalsContact C-N 3.34Å; P392-A396 WeakPolarHBondContact O-CB 3.43Å; P392-A396 PolarHBondContact O-N 2.76Å; P392-A396 VanDerWaalsContact O-N 3.12Å
393	E	54	Low	51.5	Low	172 Å²	172	122.6 Å²	122.6	80%	0.804	63%	0.631	S	S	*	*	H	α-helix	trans	-70	-30.3	178.8	-61.5	-162.2	141.3	0	0	112.8	E391	E391-E393 VanDerWaalsContact C-N 3.28Å; E391-E393 PolarHBondContact O-N 2.75Å; E391-E393 VanDerWaalsContact O-N 3.13Å
394	V	61.5	Low	50.2	Low	58 Å²	58	119.9 Å²	119.9	35%	0.352	64%	0.638	S	S	.	*	H	α-helix	trans	-77.1	-43.2	177.6	-173.8	0	0	0	0	110.2	L390 E391 P392 A396 L397	L390-V394 HydrophobicContact CD2-CB 4.37Å; L390-V394 HydrophobicContact CD2-CG1 3.95Å; E391-V394 HydrophobicContact CB-CG2 4.34Å; E391-V394 PolarHBondContact O-N 2.78Å; P392-V394 VanDerWaalsContact C-N 3.34Å; V394-A396 PolarHBondContact O-N 2.73Å; V394-L397 WeakPolarHBondContact O-CB 3.49Å; V394-L397 PolarHBondContact O-N 2.92Å; V394-L397 VanDerWaalsContact O-N 3.1Å
395	A	64.6	Low	49.6	Very low	23 Å²	23	117.4 Å²	117.4	19%	0.19	64%	0.639	C	S	.	*	H	α-helix	trans	-57.3	-38.9	173.8	0	0	0	0	0	111.7	E391 L397 Y398 F399	E391-A395 PolarHBondContact O-N 2.84Å; E391-A395 VanDerWaalsContact O-N 3.14Å; A395-L397 PolarHBondContact O-N 2.79Å; A395-L397 VanDerWaalsContact O-N 3.08Å; A395-Y398 PolarHBondContact O-N 2.8Å; A395-F399 WeakPolarHBondContact O-CD2 3.33Å
396	A	63.2	Low	48.7	Very low	44 Å²	44	117.1 Å²	117.1	36%	0.364	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.9	-5.3	177.7	0	0	0	0	0	115.4	P392 V394	P392-A396 WeakPolarHBondContact O-CB 3.43Å; P392-A396 PolarHBondContact O-N 2.76Å; P392-A396 VanDerWaalsContact O-N 3.12Å; V394-A396 PolarHBondContact O-N 2.73Å
397	L	52.8	Low	47.5	Very low	129 Å²	129	118.7 Å²	118.7	68%	0.675	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-17.1	171.4	-63.5	174	0	0	0	113.3	V394 A395	V394-L397 WeakPolarHBondContact O-CB 3.49Å; V394-L397 PolarHBondContact O-N 2.92Å; V394-L397 VanDerWaalsContact O-N 3.1Å; A395-L397 PolarHBondContact O-N 2.79Å; A395-L397 VanDerWaalsContact O-N 3.08Å
398	Y	48.4	Very low	46	Very low	162 Å²	162	123.8 Å²	123.8	64%	0.635	69%	0.694	S	S	*	*	S	Bend	trans	-93.1	-6.7	179.9	-70.4	-90.2	0	0	0	113.6	I382 A395	I382-Y398 HydrophobicContact CD1-CE1 4.12Å; A395-Y398 PolarHBondContact O-N 2.8Å
399	F	51.6	Low	44.8	Very low	142 Å²	142	129.4 Å²	129.4	62%	0.623	70%	0.701	S	S	*	*	S	Bend	trans	-104.7	133.2	174.7	-64.3	-77.6	0	0	0	111.2	A395 K401	A395-F399 WeakPolarHBondContact O-CD2 3.33Å; F399-K401 PolarHBondContact O-N 2.85Å
400	P	39.2	Very low	43.3	Very low	129 Å²	129	125.5 Å²	125.5	84%	0.838	69%	0.693	S	S	*	*			trans	-63.1	120.7	176.9	-22.1	33.5	0	0	0	111.9	S402	P400-S402 PolarHBondContact O-N 2.99Å
401	K	35.2	Very low	41.6	Very low	166 Å²	166	129.6 Å²	129.6	72%	0.722	71%	0.714	S	S	*	*			trans	-75	115.2	176.8	-67.7	-178.2	175.4	179.4	0	110.5	F399	F399-K401 PolarHBondContact O-N 2.85Å
402	S	32.8	Very low	40.1	Very low	111 Å²	111	127.9 Å²	127.9	78%	0.776	72%	0.719	S	S	*	*			trans	-87.6	108.6	169.9	54.8	0	0	0	0	110.5	P400	P400-S402 PolarHBondContact O-N 2.99Å
403	E	32.2	Very low	38.6	Very low	198 Å²	198	129.8 Å²	129.8	93%	0.925	72%	0.723	S	S	*	*			trans	-79.9	118	174	-68.6	-169.4	136.6	0	0	111.8
404	S	28.4	Very low	38	Very low	117 Å²	117	127 Å²	127	82%	0.818	72%	0.72	S	S	*	*			trans	-159	69.2	164.4	63.7	0	0	0	0	112.7
405	A	29	Very low	36.2	Very low	95 Å²	95	127.1 Å²	127.1	79%	0.785	73%	0.733	S	S	*	*			trans	-141.7	89	173.7	0	0	0	0	0	112.6
406	S	30.9	Very low	34.5	Very low	123 Å²	123	133.4 Å²	133.4	86%	0.86	76%	0.762	S	S	*	*			trans	40.3	104.9	154	59.6	0	0	0	0	120.2
407	A	27.7	Very low	32.7	Very low	107 Å²	107	139 Å²	139	88%	0.884	78%	0.78	S	S	*	*			trans	-133	119.3	151.7	0	0	0	0	0	110.3
408	M	27.2	Very low	31.3	Very low	188 Å²	188	137.2 Å²	137.2	93%	0.926	78%	0.778	S	S	*	*			trans	-97.5	116.6	-169.5	176.4	-175.9	-179.9	0	0	111.6
409	R	29.2	Very low	30.2	Very low	245 Å²	245	135.6 Å²	135.6	93%	0.925	79%	0.785	S	S	*	*			trans	-156.9	94.6	170.3	-110.7	168.1	-151.4	-166.6	5.9	115.7
410	S	24.6	Very low	29.2	Very low	97 Å²	97	133.6 Å²	133.6	68%	0.678	79%	0.789	S	S	*	*			trans	13.7	119.4	135.5	-179.8	0	0	0	0	121.6
411	I	25.4	Very low	28.6	Very low	153 Å²	153	135.2 Å²	135.2	79%	0.785	79%	0.789	S	S	*	*			trans	78.6	143.7	136.9	-65.6	174.4	0	0	0	120.7
412	S	26.1	Very low	28.3	Very low	113 Å²	113	132.1 Å²	132.1	79%	0.79	79%	0.789	S	S	*	*			trans	79.7	110.4	161.3	47.8	0	0	0	0	121.8
413	D	25.6	Very low	28.9	Very low	153 Å²	153	133.2 Å²	133.2	82%	0.818	79%	0.793	S	S	*	*			trans	-62	173.8	143.8	-130.9	-1.2	0	0	0	110.7
414	P	42.8	Very low	28.9	Very low	114 Å²	114	130.8 Å²	130.8	74%	0.74	78%	0.782	S	S	*	*			cis	-140.6	173.3	2.7	42.3	-24.2	0	0	0	117.7
415	G	24.2	Very low	28.9	Very low	61 Å²	61	131.2 Å²	131.2	63%	0.629	79%	0.785	S	S	*	*			trans	110.6	118.5	131.4	0	0	0	0	0	121.6
416	L	27.7	Very low	29.1	Very low	154 Å²	154	133.9 Å²	133.9	81%	0.806	78%	0.783	S	S	*	*			trans	50.8	113.5	135.1	-57.2	168	0	0	0	121.3
417	H	26.1	Very low	29	Very low	162 Å²	162	134 Å²	134	75%	0.75	78%	0.784	S	S	*	*				175.4	141.6	95.7	-102.9	-71.3	0	0	0	117.2
418	C	23	Very low	29.5	Very low	92 Å²	92	134.6 Å²	134.6	62%	0.622	78%	0.781	S	S	*	*			trans	28.1	121.7	142.2	-67.3	0	0	0	0	124.6
419	T	26.3	Very low	29.6	Very low	128 Å²	128	129.6 Å²	129.6	79%	0.785	78%	0.778	S	S	*	*				64.6	142.8	128.1	68.5	0	0	0	0	120
420	S	29.5	Very low	29.8	Very low	100 Å²	100	121.7 Å²	121.7	70%	0.699	77%	0.773	S	S	*	*				178.8	176.5	60.8	48.9	0	0	0	0	113.8
421	L	27.5	Very low	30.2	Very low	163 Å²	163	124.7 Å²	124.7	85%	0.853	78%	0.781	S	S	*	*			trans	78.7	103.8	161.8	-52.9	-174.7	0	0	0	120.1
422	S	29	Very low	30.6	Very low	101 Å²	101	122.8 Å²	122.8	71%	0.706	78%	0.781	S	S	*	*			trans	-77.8	174.2	141.3	-43	0	0	0	0	110.3
423	P	45.1	Very low	31.3	Very low	134 Å²	134	121.2 Å²	121.2	87%	0.87	78%	0.783	S	S	*	*				-135.5	173.2	97.8	38.3	-28.4	0	0	0	114.6
424	Q	30.8	Very low	31.8	Very low	147 Å²	147	120.5 Å²	120.5	69%	0.687	78%	0.784	S	S	*	*			trans	-99	168.5	-172.1	-58.4	169.1	-13.7	0	0	112.8	M426	Q424-M426 HydrophobicContact CB-CE 4.27Å; Q424-M426 HydrophobicContact CG-CE 4.12Å
425	S	30.3	Very low	31.3	Very low	126 Å²	126	122 Å²	122	88%	0.881	79%	0.786	S	S	*	*			trans	-152.4	147.9	139.9	-80.8	0	0	0	0	109.7
426	M	31.9	Very low	31.6	Very low	150 Å²	150	124.2 Å²	124.2	74%	0.739	79%	0.791	S	S	*	*			trans	-125.8	150.4	-161.7	-63.3	-74.8	-177.3	0	0	112.5	Q424	Q424-M426 HydrophobicContact CB-CE 4.27Å; Q424-M426 HydrophobicContact CG-CE 4.12Å
427	S	29.6	Very low	31.7	Very low	126 Å²	126	126.5 Å²	126.5	88%	0.881	79%	0.791	S	S	*	*			trans	-156.4	159.2	140.6	-161.1	0	0	0	0	109.6
428	S	37	Very low	32	Very low	119 Å²	119	124.5 Å²	124.5	83%	0.832	79%	0.793	S	S	*	*			trans	-140.5	164.3	-161.3	61.7	0	0	0	0	115.3
429	G	30.8	Very low	32.2	Very low	84 Å²	84	126.6 Å²	126.6	87%	0.866	80%	0.798	S	S	*	*			trans	110.4	122.5	157.3	0	0	0	0	0	115.4
430	G	32.3	Very low	32.9	Very low	78 Å²	78	125 Å²	125	80%	0.804	79%	0.791	S	S	*	*			trans	158.6	77.5	176.2	0	0	0	0	0	114.1
431	D	33	Very low	33.2	Very low	160 Å²	160	128.5 Å²	128.5	86%	0.856	80%	0.799	S	S	*	*			trans	-43.2	128.4	173.8	174.8	30.6	0	0	0	115.9
432	S	33.4	Very low	33.8	Very low	113 Å²	113	125 Å²	125	79%	0.79	79%	0.789	S	S	*	*			trans	-178.7	142	134.1	34.2	0	0	0	0	110.8
433	G	40.8	Very low	34.3	Very low	80 Å²	80	127.7 Å²	127.7	83%	0.825	80%	0.795	S	S	*	*			trans	-97.9	146.1	-171.6	0	0	0	0	0	115.5
434	V	37.3	Very low	34.1	Very low	138 Å²	138	126.4 Å²	126.4	84%	0.836	78%	0.779	S	S	*	*			trans	-150.3	143.5	152.3	72	0	0	0	0	108.9	S436	V434-S436 PolarHBondContact O-N 2.86Å
435	D	31.8	Very low	35	Very low	147 Å²	147	121.8 Å²	121.8	79%	0.786	76%	0.762	S	S	*	*			trans	-67.5	121.1	-176.4	-63.5	-74.2	0	0	0	112.4
436	S	31.4	Very low	36.8	Very low	106 Å²	106	119.9 Å²	119.9	74%	0.741	75%	0.748	S	S	*	*			trans	-108.9	79.4	-179.9	-166.4	0	0	0	0	111.4	V434 C438	V434-S436 PolarHBondContact O-N 2.86Å; S436-C438 PolarHBondContact O-N 2.91Å; S436-C438 VanDerWaalsContact O-N 3.12Å
437	Y	28.6	Very low	39.3	Very low	203 Å²	203	116.7 Å²	116.7	80%	0.796	73%	0.732	S	S	*	*			trans	-80.2	81.8	171.3	-86.4	-78.4	0	0	0	111.2
438	C	31.5	Very low	42.1	Very low	119 Å²	119	112 Å²	112	80%	0.804	70%	0.702	S	S	*	*			trans	-107.2	76.5	163.9	-78.1	0	0	0	0	110.8	S436	S436-C438 PolarHBondContact O-N 2.91Å; S436-C438 VanDerWaalsContact O-N 3.12Å
439	D	29.3	Very low	44.7	Very low	136 Å²	136	108 Å²	108	73%	0.727	67%	0.671	S	S	*	*			trans	-81.6	155	160.7	-95.3	-49.4	0	0	0	110.8
440	P	40.8	Very low	47.6	Very low	96 Å²	96	104 Å²	104	62%	0.623	63%	0.629	S	S	*	*			trans	-79.6	148.2	-155.5	29.5	-36.6	0	0	0	115.7	S442	P440-S442 PolarHBondContact O-N 3Å
441	I	34.5	Very low	50.3	Low	172 Å²	172	102.3 Å²	102.3	88%	0.882	60%	0.602	S	S	*	*	S	Bend	trans	-78.6	60.6	174.9	-44.4	176.4	0	0	0	110
442	S	39.7	Very low	52.7	Low	91 Å²	91	96.1 Å²	96.1	64%	0.636	57%	0.571	S	S	*	*			trans	-140.4	38.1	-170.2	69.3	0	0	0	0	114.9	P440	P440-S442 PolarHBondContact O-N 3Å
443	D	40.9	Very low	55	Low	157 Å²	157	91 Å²	91	84%	0.84	54%	0.535	S	S	*	.			trans	-151	53.2	160.5	-145.1	1.2	0	0	0	112.8
444	M	39.4	Very low	56.5	Low	107 Å²	107	88.8 Å²	88.8	53%	0.527	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-71.5	129.2	168.1	-75.9	-59.1	-66.9	0	0	109.5	S446 I509	M444-S446 PolarHBondContact O-N 2.91Å; M444-S446 VanDerWaalsContact O-N 3.13Å; M444-I509 HydrophobicContact CE-CG2 3.61Å
445	P	50.9	Low	58.1	Low	49 Å²	49	84.9 Å²	84.9	32%	0.318	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-63.7	119.1	-173.9	25	-34.1	0	0	0	110.5	M447 I509	P445-M447 WeakPolarHBondContact O-CG 3.47Å; P445-M447 PolarHBondContact O-N 2.9Å; P445-M447 VanDerWaalsContact O-N 3.07Å; P445-I509 HydrophobicContact CG-CD1 4.5Å
446	S	67.3	Low	59.6	Low	86 Å²	86	82.1 Å²	82.1	60%	0.601	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-51.2	118.5	178.7	53.4	0	0	0	0	111.3	M444 G493	M444-S446 PolarHBondContact O-N 2.91Å; M444-S446 VanDerWaalsContact O-N 3.13Å; S446-G493 PolarHBondContact O-N 2.86Å
447	M	85	Confident	60.8	Low	83 Å²	83	81.4 Å²	81.4	41%	0.409	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	135.1	176.6	-67.7	-173.6	-70.2	0	0	109.2	P445 K491 I492 V506 I509	P445-M447 WeakPolarHBondContact O-CG 3.47Å; P445-M447 PolarHBondContact O-N 2.9Å; P445-M447 VanDerWaalsContact O-N 3.07Å; M447-K491 WeakPolarHBondContact CA-O 3.43Å; M447-I492 HydrophobicContact CG-CG1 4.4Å; M447-I492 HydrophobicContact CG-CG2 4.23Å; M447-V506 HydrophobicContact SD-CG1 4.32Å; M447-V506 HydrophobicContact SD-CG2 3.98Å; M447-I509 HydrophobicContact CE-CG2 3.99Å; M447-I509 HydrophobicContact SD-CD1 4.28Å; M447-I509 HydrophobicContact SD-CG2 4.48Å
448	A	88.3	Confident	62.2	Low	28 Å²	28	76.5 Å²	76.5	23%	0.231	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	157.9	178.3	0	0	0	0	0	110.3	F466 I470 K491	A448-F466 HydrophobicContact CB-CE1 3.8Å; A448-F466 HydrophobicContact CB-CZ 3.87Å; A448-I470 HydrophobicContact CB-CD1 4.21Å; A448-K491 HydrophobicContact CB-CB 4.49Å; A448-K491 PolarHBondContact N-O 2.74Å; A448-K491 VanDerWaalsContact N-O 3.14Å; A448-K491 PolarHBondContact O-N 3.16Å
449	I	92.1	Very high	63.5	Low	36 Å²	36	78.3 Å²	78.3	19%	0.185	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	145.2	176.4	46.7	161.6	0	0	0	110.9	I470 V471 F476 L488 V489 V490	I449-I470 WeakPolarHBondContact O-CG1 3.47Å; I449-V471 HydrophobicContact CD1-CB 3.92Å; I449-V471 HydrophobicContact CD1-CG1 4.1Å; I449-V471 HydrophobicContact CG1-CB 4.04Å; I449-V471 PolarHBondContact O-N 3.08Å; I449-F476 HydrophobicContact CD1-CD2 3.71Å; I449-F476 HydrophobicContact CD1-CE2 4.09Å; I449-F476 HydrophobicContact CD1-CG 4.37Å; I449-L488 HydrophobicContact CB-CD1 3.93Å; I449-L488 HydrophobicContact CG2-CD1 4.15Å; I449-V489 WeakPolarHBondContact CA-O 3.5Å; I449-V490 HydrophobicContact CG2-CB 4.4Å; I449-V490 HydrophobicContact CG2-CG1 4.08Å; I449-V490 HydrophobicContact CG2-CG2 4.09Å
450	S	91.8	Very high	65.4	Low	0 Å²	0	80.1 Å²	80.1	0%	0	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	144.9	-177.7	-177.3	0	0	0	0	110.9	C452 F466 K469 V489	S450-C452 PolarHBondContact O-N 2.69Å; S450-F466 VanDerWaalsContact CB-O 3.3Å; S450-F466 WeakPolarHBondContact CB-O 3.28Å; S450-F466 PolarHBondContact OG-O 3.4Å; S450-K469 WeakPolarHBondContact CA-O 3.45Å; S450-K469 PolarHBondContact OG-O 3.47Å; S450-K469 VanDerWaalsContact OG-O 3.07Å; S450-V489 PolarHBondContact N-O 2.89Å; S450-V489 PolarHBondContact O-N 3.13Å
451	L	88.4	Confident	67.2	Low	42 Å²	42	76.5 Å²	76.5	22%	0.22	42%	0.424	C	S	.	.			trans	-92.8	38.2	175.6	-66.6	177.9	0	0	0	112	K469 V471 I482 D485 L488	L451-K469 PolarHBondContact N-O 3.06Å; L451-K469 WeakPolarHBondContact O-CD 3.36Å; L451-V471 HydrophobicContact CD1-CG2 4.21Å; L451-V471 HydrophobicContact CG-CG2 3.84Å; L451-I482 HydrophobicContact CD1-CG2 4.35Å; L451-I482 HydrophobicContact CD2-CG2 4.18Å; L451-I482 HydrophobicContact CG-CG2 4.47Å; L451-D485 HydrophobicContact CD2-CB 3.8Å; L451-D485 WeakPolarHBondContact CD2-OD2 3.34Å; L451-L488 HydrophobicContact CD2-CB 4.22Å; L451-L488 HydrophobicContact CD2-CD1 4.2Å
452	C	83.1	Confident	69.3	Low	30 Å²	30	71 Å²	71	20%	0.203	40%	0.399	C	S	.	.			trans	-80.7	-17.2	-178	65.9	0	0	0	0	114.7	S450 Q465 V489	S450-C452 PolarHBondContact O-N 2.69Å; C452-Q465 WeakPolarHBondContact CB-O 3.28Å; C452-V489 VanDerWaalsContact SG-CG2 3.55Å
453	G	81.9	Confident	71.2	Confident	4 Å²	4	75.3 Å²	75.3	4%	0.041	40%	0.401	C	S	.	.			trans	62.1	-147.2	178.7	0	0	0	0	0	114.2	L455 I461 N487 V489	G453-L455 VanDerWaalsContact C-N 3.3Å; G453-L455 PolarHBondContact O-N 3.36Å; G453-L455 VanDerWaalsContact O-N 3.14Å; G453-I461 WeakPolarHBondContact O-CD1 3.49Å; G453-N487 WeakPolarHBondContact CA-O 3.41Å; G453-N487 PolarHBondContact N-O 2.68Å; G453-V489 WeakPolarHBondContact O-CG2 3.35Å
454	G	72.7	Confident	73	Confident	35 Å²	35	74.6 Å²	74.6	36%	0.361	39%	0.393	S	S	.	.			trans	78.5	-10.2	168.5	0	0	0	0	0	117.8	T456 D457	G454-T456 PolarHBondContact O-N 2.85Å; G454-D457 PolarHBondContact O-N 2.84Å
455	L	71.6	Confident	75	Confident	55 Å²	55	74.4 Å²	74.4	29%	0.288	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-15.9	-179.8	-70.6	174.1	0	0	0	115	G453 I461 V489 Y497 N498 M529	G453-L455 VanDerWaalsContact C-N 3.3Å; G453-L455 PolarHBondContact O-N 3.36Å; G453-L455 VanDerWaalsContact O-N 3.14Å; L455-I461 HydrophobicContact CD2-CD1 3.45Å; L455-I461 VanDerWaalsContact CD2-CD1 3.45Å; L455-I461 HydrophobicContact CD2-CG1 4.46Å; L455-I461 HydrophobicContact CG-CD1 3.78Å; L455-V489 HydrophobicContact CD1-CB 4.4Å; L455-V489 HydrophobicContact CD1-CG1 4.23Å; L455-V489 HydrophobicContact CD1-CG2 3.84Å; L455-V489 HydrophobicContact CD2-CG1 4.45Å; L455-V489 HydrophobicContact CG-CG1 4.46Å; L455-V489 HydrophobicContact CG-CG2 3.94Å; L455-Y497 VanDerWaalsContact CD1-C 3.49Å; L455-N498 HydrophobicContact CD1-CB 3.88Å; L455-M529 HydrophobicContact CB-CE 4.19Å; L455-M529 HydrophobicContact CD1-CE 3.87Å; L455-M529 HydrophobicContact CD2-CE 3.88Å; L455-M529 HydrophobicContact CG-CE 4.21Å
456	T	63	Low	76.7	Confident	90 Å²	90	72.3 Å²	72.3	55%	0.552	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-18.8	-175.7	45.8	0	0	0	0	114.8	G454	G454-T456 PolarHBondContact O-N 2.85Å
457	D	56	Low	77.5	Confident	90 Å²	90	71.1 Å²	71.1	48%	0.481	37%	0.368	S	S	.	.	S	Bend	trans	-107.9	13	-155.1	-68.7	6.4	0	0	0	113.8	G454 K459	G454-D457 PolarHBondContact O-N 2.84Å; D457-K459 HydrophobicContact CB-CG 4.5Å; D457-K459 PolarHBondContact O-N 2.87Å
458	N	57.2	Low	77.4	Confident	101 Å²	101	73.2 Å²	73.2	54%	0.54	38%	0.38	S	S	.	.	S	Bend	trans	57.7	4.9	-171.4	-62.7	-45.4	0	0	0	115.3	K532	N458-K532 PolarHBondContact ND2-O 3.14Å
459	K	60.5	Low	77.3	Confident	157 Å²	157	78 Å²	78	68%	0.683	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-74.2	138.7	169.2	-67.5	173.4	-177.9	165.3	0	109.8	D457	D457-K459 HydrophobicContact CB-CG 4.5Å; D457-K459 PolarHBondContact O-N 2.87Å
460	E	67.3	Low	77.2	Confident	173 Å²	173	80.5 Å²	80.5	81%	0.808	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-83.2	125.7	171.3	-60.5	-167.2	154.8	0	0	109.2	T462	E460-T462 PolarHBondContact O-N 3.25Å
461	I	79.1	Confident	77	Confident	21 Å²	21	81.4 Å²	81.4	11%	0.108	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-68.9	121.9	-177	-64.4	175.5	0	0	0	109.3	G453 L455 F466 V489 Y496	G453-I461 WeakPolarHBondContact O-CD1 3.49Å; L455-I461 HydrophobicContact CD2-CD1 3.45Å; L455-I461 VanDerWaalsContact CD2-CD1 3.45Å; L455-I461 HydrophobicContact CD2-CG1 4.46Å; L455-I461 HydrophobicContact CG-CD1 3.78Å; I461-F466 HydrophobicContact CG2-CB 4.19Å; I461-V489 HydrophobicContact CD1-CG1 3.86Å; I461-V489 HydrophobicContact CD1-CG2 3.9Å; I461-Y496 HydrophobicContact CB-CD2 4.08Å; I461-Y496 HydrophobicContact CB-CE2 4.31Å; I461-Y496 HydrophobicContact CB-CG 4.46Å; I461-Y496 HydrophobicContact CG2-CD2 4.49Å; I461-Y496 HydrophobicContact CG2-CE2 4.44Å; I461-Y496 WeakPolarHBondContact O-CE2 3.39Å
462	T	79.1	Confident	77	Confident	55 Å²	55	82 Å²	82	34%	0.337	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-73.3	153.3	176.9	74.9	0	0	0	0	110.6	E460 E464 Q465 F466	E460-T462 PolarHBondContact O-N 3.25Å; T462-E464 PolarHBondContact O-N 3.09Å; T462-Q465 PolarHBondContact O-N 3.44Å; T462-Q465 WeakPolarHBondContact OG1-CG 3.24Å; T462-Q465 PolarHBondContact OG1-N 3.48Å; T462-F466 PolarHBondContact O-N 2.67Å
463	R	79.1	Confident	77	Confident	183 Å²	183	88.6 Å²	88.6	69%	0.691	45%	0.447	S	S	*	.	H	α-helix	trans	-59.7	-35.2	177.1	-179.5	178.3	174.8	174.2	-2.5	111.8	C467	R463-C467 PolarHBondContact O-N 2.84Å; R463-C467 PolarHBondContact O-SG 3.26Å
464	E	79.2	Confident	77.1	Confident	141 Å²	141	93.8 Å²	93.8	66%	0.659	47%	0.471	S	S	*	.	H	α-helix	trans	-61.5	-57.3	176.1	-69.9	130.6	-143.4	0	0	111	T462 F466 C467 D468	T462-E464 PolarHBondContact O-N 3.09Å; E464-F466 PolarHBondContact O-N 2.82Å; E464-F466 VanDerWaalsContact O-N 3.09Å; E464-C467 WeakPolarHBondContact O-CA 3.41Å; E464-C467 WeakPolarHBondContact O-CB 3.41Å; E464-C467 PolarHBondContact O-N 2.89Å; E464-D468 PolarHBondContact O-N 3.1Å
465	Q	80.7	Confident	77.6	Confident	104 Å²	104	96.7 Å²	96.7	49%	0.486	48%	0.475	S	S	.	.	H	α-helix	trans	-53.7	-36.1	178.5	-72.2	168.2	-10.7	0	0	113.2	C452 T462	C452-Q465 WeakPolarHBondContact CB-O 3.28Å; T462-Q465 PolarHBondContact O-N 3.44Å; T462-Q465 WeakPolarHBondContact OG1-CG 3.24Å; T462-Q465 PolarHBondContact OG1-N 3.48Å
466	F	86.7	Confident	78.3	Confident	4 Å²	4	97.5 Å²	97.5	2%	0.018	48%	0.476	C	S	.	.	H	α-helix	trans	-70.7	-40.3	175	-175.3	-85.6	0	0	0	112.7	A448 S450 I461 T462 E464 I470 V489 K491 Y496	A448-F466 HydrophobicContact CB-CE1 3.8Å; A448-F466 HydrophobicContact CB-CZ 3.87Å; S450-F466 VanDerWaalsContact CB-O 3.3Å; S450-F466 WeakPolarHBondContact CB-O 3.28Å; S450-F466 PolarHBondContact OG-O 3.4Å; I461-F466 HydrophobicContact CG2-CB 4.19Å; T462-F466 PolarHBondContact O-N 2.67Å; E464-F466 PolarHBondContact O-N 2.82Å; E464-F466 VanDerWaalsContact O-N 3.09Å; F466-I470 HydrophobicContact CE1-CD1 4.35Å; F466-I470 HydrophobicContact CE1-CG1 4.36Å; F466-I470 PolarHBondContact O-N 2.72Å; F466-V489 HydrophobicContact CD2-CB 4.44Å; F466-V489 HydrophobicContact CD2-CG1 4.05Å; F466-V489 HydrophobicContact CE2-CB 4.29Å; F466-V489 HydrophobicContact CE2-CG1 3.99Å; F466-K491 HydrophobicContact CD1-CD 4.42Å; F466-K491 HydrophobicContact CE1-CB 4.04Å; F466-K491 HydrophobicContact CE1-CD 4.1Å; F466-K491 HydrophobicContact CE2-CB 3.76Å; F466-K491 HydrophobicContact CZ-CB 3.46Å; F466-K491 VanDerWaalsContact CZ-CB 3.46Å; F466-K491 HydrophobicContact CZ-CD 4.37Å; F466-Y496 HydrophobicContact CB-CE1 3.96Å; F466-Y496 HydrophobicContact CD1-CE1 4.25Å; F466-Y496 AromaticContact CD2-CD1 3.62Å; F466-Y496 HydrophobicContact CD2-CD1 3.62Å; F466-Y496 AromaticContact CD2-CE1 3.42Å; F466-Y496 HydrophobicContact CD2-CE1 3.42Å; F466-Y496 VanDerWaalsContact CD2-CE1 3.42Å; F466-Y496 AromaticContact CE2-CD1 3.93Å; F466-Y496 HydrophobicContact CE2-CD1 3.93Å; F466-Y496 AromaticContact CE2-CE1 3.97Å; F466-Y496 HydrophobicContact CE2-CE1 3.97Å; F466-Y496 HydrophobicContact CG-CD1 4.27Å; F466-Y496 AromaticContact CG-CE1 3.59Å; F466-Y496 HydrophobicContact CG-CE1 3.59Å
467	C	83.6	Confident	79.1	Confident	62 Å²	62	96.1 Å²	96.1	42%	0.419	47%	0.474	S	S	.	.	H	α-helix	trans	-68.1	-39.6	177.2	-72.7	0	0	0	0	112.4	R463 E464 K469 I470	R463-C467 PolarHBondContact O-N 2.84Å; R463-C467 PolarHBondContact O-SG 3.26Å; E464-C467 WeakPolarHBondContact O-CA 3.41Å; E464-C467 WeakPolarHBondContact O-CB 3.41Å; E464-C467 PolarHBondContact O-N 2.89Å; C467-K469 PolarHBondContact O-N 3.17Å; C467-K469 VanDerWaalsContact O-N 3.09Å; C467-I470 VanDerWaalsContact O-CG2 3.32Å; C467-I470 WeakPolarHBondContact O-CG2 3.45Å; C467-I470 PolarHBondContact O-N 3.04Å
468	D	84.1	Confident	80.6	Confident	127 Å²	127	98.2 Å²	98.2	68%	0.679	48%	0.481	S	S	*	.	H	α-helix	trans	-59.5	-24.7	-174.9	-63.1	-23.7	0	0	0	113.8	E464	E464-D468 PolarHBondContact O-N 3.1Å
469	K	85.1	Confident	81.8	Confident	129 Å²	129	96.9 Å²	96.9	56%	0.561	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.1	26	179.5	-64.9	-170.7	177.9	-176.2	0	113.6	S450 L451 C467 V471	S450-K469 WeakPolarHBondContact CA-O 3.45Å; S450-K469 PolarHBondContact OG-O 3.47Å; S450-K469 VanDerWaalsContact OG-O 3.07Å; L451-K469 PolarHBondContact N-O 3.06Å; L451-K469 WeakPolarHBondContact O-CD 3.36Å; C467-K469 PolarHBondContact O-N 3.17Å; C467-K469 VanDerWaalsContact O-N 3.09Å; K469-V471 PolarHBondContact O-N 2.76Å
470	I	90.4	Very high	83	Confident	88 Å²	88	93.2 Å²	93.2	45%	0.451	47%	0.466	S	S	.	.	B	Isolated β-bridge	trans	-61.2	130.7	177.3	-163.1	174.2	0	0	0	110.5	A448 I449 F466 C467	A448-I470 HydrophobicContact CB-CD1 4.21Å; I449-I470 WeakPolarHBondContact O-CG1 3.47Å; F466-I470 HydrophobicContact CE1-CD1 4.35Å; F466-I470 HydrophobicContact CE1-CG1 4.36Å; F466-I470 PolarHBondContact O-N 2.72Å; C467-I470 VanDerWaalsContact O-CG2 3.32Å; C467-I470 WeakPolarHBondContact O-CG2 3.45Å; C467-I470 PolarHBondContact O-N 3.04Å
471	V	88.4	Confident	83.7	Confident	19 Å²	19	88.1 Å²	88.1	12%	0.115	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-85.8	121.9	-179	-177.3	0	0	0	0	108.9	I449 L451 K469 Q475 F476 I482	I449-V471 HydrophobicContact CD1-CB 3.92Å; I449-V471 HydrophobicContact CD1-CG1 4.1Å; I449-V471 HydrophobicContact CG1-CB 4.04Å; I449-V471 PolarHBondContact O-N 3.08Å; L451-V471 HydrophobicContact CD1-CG2 4.21Å; L451-V471 HydrophobicContact CG-CG2 3.84Å; K469-V471 PolarHBondContact O-N 2.76Å; V471-Q475 HydrophobicContact CG1-CB 4.12Å; V471-F476 HydrophobicContact CG1-CB 4.08Å; V471-I482 HydrophobicContact CG1-CD1 4.07Å; V471-I482 HydrophobicContact CG1-CG2 4.36Å; V471-I482 HydrophobicContact CG2-CG2 4.21Å
472	S	88.7	Confident	84	Confident	54 Å²	54	88 Å²	88	38%	0.378	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-77.2	158.2	174.5	68.8	0	0	0	0	112	Q474 Q475 F476	S472-Q474 PolarHBondContact O-N 3.11Å; S472-Q475 PolarHBondContact O-N 3.26Å; S472-Q475 VanDerWaalsContact OG-CD 3.3Å; S472-Q475 WeakPolarHBondContact OG-CG 3.35Å; S472-Q475 PolarHBondContact OG-N 3.35Å; S472-Q475 PolarHBondContact OG-OE1 2.99Å; S472-F476 PolarHBondContact O-N 3.29Å; S472-F476 VanDerWaalsContact O-N 3.08Å
473	F	81.6	Confident	84.3	Confident	168 Å²	168	87.7 Å²	87.7	74%	0.737	44%	0.444	S	S	*	.	H	α-helix	trans	-55.1	-38.8	175.4	175.9	-98.6	0	0	0	112.5	F476 A477	F473-F476 PolarHBondContact O-N 2.84Å; F473-A477 WeakPolarHBondContact O-CB 3.36Å; F473-A477 PolarHBondContact O-N 2.9Å
474	Q	84.5	Confident	84.5	Confident	114 Å²	114	85.3 Å²	85.3	53%	0.533	45%	0.446	S	S	.	.	H	α-helix	trans	-62.2	-51.6	179	-172.3	64.1	25.5	0	0	111.5	S472 F476 A477 E478	S472-Q474 PolarHBondContact O-N 3.11Å; Q474-F476 VanDerWaalsContact C-N 3.27Å; Q474-F476 PolarHBondContact O-N 2.86Å; Q474-A477 PolarHBondContact O-N 2.93Å; Q474-A477 VanDerWaalsContact O-N 3.16Å; Q474-E478 WeakPolarHBondContact CG-OE1 3.47Å; Q474-E478 PolarHBondContact NE2-OE1 2.78Å; Q474-E478 WeakPolarHBondContact O-CB 3.42Å; Q474-E478 WeakPolarHBondContact O-CG 3.36Å; Q474-E478 PolarHBondContact O-N 3.27Å
475	Q	84.7	Confident	84.7	Confident	96 Å²	96	81.1 Å²	81.1	45%	0.449	43%	0.427	S	S	.	.	H	α-helix	trans	-60.9	-35.7	178.3	-69.8	160.7	-49.7	0	0	112.5	V471 S472 N479	V471-Q475 HydrophobicContact CG1-CB 4.12Å; S472-Q475 PolarHBondContact O-N 3.26Å; S472-Q475 VanDerWaalsContact OG-CD 3.3Å; S472-Q475 WeakPolarHBondContact OG-CG 3.35Å; S472-Q475 PolarHBondContact OG-N 3.35Å; S472-Q475 PolarHBondContact OG-OE1 2.99Å; Q475-N479 PolarHBondContact O-N 3.44Å
476	F	84.8	Confident	84.7	Confident	72 Å²	72	82.2 Å²	82.2	32%	0.316	44%	0.444	S	S	.	.	H	α-helix	trans	-73.2	-34.5	177.1	-174	-96.7	0	0	0	113	I449 V471 S472 F473 Q474 N479 I482 I483	I449-F476 HydrophobicContact CD1-CD2 3.71Å; I449-F476 HydrophobicContact CD1-CE2 4.09Å; I449-F476 HydrophobicContact CD1-CG 4.37Å; V471-F476 HydrophobicContact CG1-CB 4.08Å; S472-F476 PolarHBondContact O-N 3.29Å; S472-F476 VanDerWaalsContact O-N 3.08Å; F473-F476 PolarHBondContact O-N 2.84Å; Q474-F476 VanDerWaalsContact C-N 3.27Å; Q474-F476 PolarHBondContact O-N 2.86Å; F476-N479 CarbonylContact O-C 3.6Å; F476-N479 VanDerWaalsContact O-C 3.28Å; F476-I482 HydrophobicContact CD2-CG2 4.45Å; F476-I483 HydrophobicContact CE2-CD1 4.22Å; F476-I483 HydrophobicContact CE2-CG1 3.7Å; F476-I483 HydrophobicContact CZ-CD1 3.9Å; F476-I483 HydrophobicContact CZ-CG1 3.91Å
477	A	79.4	Confident	84.6	Confident	61 Å²	61	85.7 Å²	85.7	50%	0.504	46%	0.463	S	S	.	.	H	α-helix	trans	-72.7	-35.2	174.4	0	0	0	0	0	112.2	F473 Q474	F473-A477 WeakPolarHBondContact O-CB 3.36Å; F473-A477 PolarHBondContact O-N 2.9Å; Q474-A477 PolarHBondContact O-N 2.93Å; Q474-A477 VanDerWaalsContact O-N 3.16Å
478	E	87.7	Confident	84.9	Confident	133 Å²	133	83.1 Å²	83.1	62%	0.621	44%	0.444	S	S	*	.	H	α-helix	trans	-71.3	-36.4	174.2	-73	167.5	178.5	0	0	112.4	Q474	Q474-E478 WeakPolarHBondContact CG-OE1 3.47Å; Q474-E478 PolarHBondContact NE2-OE1 2.78Å; Q474-E478 WeakPolarHBondContact O-CB 3.42Å; Q474-E478 WeakPolarHBondContact O-CG 3.36Å; Q474-E478 PolarHBondContact O-N 3.27Å
479	N	83.4	Confident	85.1	Confident	73 Å²	73	77 Å²	77	39%	0.39	41%	0.412	S	S	.	.			trans	-136.3	93.4	174.7	-173.4	15.4	0	0	0	113.5	Q475 F476 S481 I482	Q475-N479 PolarHBondContact O-N 3.44Å; F476-N479 CarbonylContact O-C 3.6Å; F476-N479 VanDerWaalsContact O-C 3.28Å; N479-S481 PolarHBondContact ND2-OG 3.3Å; N479-S481 PolarHBondContact O-N 2.91Å; N479-S481 PolarHBondContact OD1-N 3.12Å; N479-S481 VanDerWaalsContact OD1-N 3.12Å; N479-S481 PolarHBondContact OD1-OG 3.22Å; N479-I482 HydrophobicContact CB-CD1 4.24Å; N479-I482 HydrophobicContact CB-CG1 4.35Å; N479-I482 WeakPolarHBondContact O-CD1 3.49Å; N479-I482 VanDerWaalsContact O-CG1 3.28Å; N479-I482 WeakPolarHBondContact O-CG1 3.38Å; N479-I482 PolarHBondContact O-N 2.94Å
480	P	85.6	Confident	85.5	Confident	80 Å²	80	71.1 Å²	71.1	52%	0.519	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-70.8	-12.3	176.6	28.3	-34.9	0	0	0	114.2	I482 I483	P480-I482 PolarHBondContact O-N 3Å; P480-I483 WeakPolarHBondContact O-CG1 3.45Å; P480-I483 PolarHBondContact O-N 3.3Å
481	S	82.4	Confident	85.4	Confident	66 Å²	66	68.8 Å²	68.8	46%	0.462	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-72.5	-5.8	177	76.1	0	0	0	0	113.7	N479 I483 D484	N479-S481 PolarHBondContact ND2-OG 3.3Å; N479-S481 PolarHBondContact O-N 2.91Å; N479-S481 PolarHBondContact OD1-N 3.12Å; N479-S481 VanDerWaalsContact OD1-N 3.12Å; N479-S481 PolarHBondContact OD1-OG 3.22Å; S481-I483 PolarHBondContact O-N 2.99Å; S481-D484 PolarHBondContact O-N 2.87Å
482	I	85.8	Confident	85.4	Confident	19 Å²	19	68.7 Å²	68.7	10%	0.097	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-52.4	-24.7	167.9	-71.4	173.1	0	0	0	112.1	L451 V471 F476 N479 P480 D484 D485 L488	L451-I482 HydrophobicContact CD1-CG2 4.35Å; L451-I482 HydrophobicContact CD2-CG2 4.18Å; L451-I482 HydrophobicContact CG-CG2 4.47Å; V471-I482 HydrophobicContact CG1-CD1 4.07Å; V471-I482 HydrophobicContact CG1-CG2 4.36Å; V471-I482 HydrophobicContact CG2-CG2 4.21Å; F476-I482 HydrophobicContact CD2-CG2 4.45Å; N479-I482 HydrophobicContact CB-CD1 4.24Å; N479-I482 HydrophobicContact CB-CG1 4.35Å; N479-I482 WeakPolarHBondContact O-CD1 3.49Å; N479-I482 VanDerWaalsContact O-CG1 3.28Å; N479-I482 WeakPolarHBondContact O-CG1 3.38Å; N479-I482 PolarHBondContact O-N 2.94Å; P480-I482 PolarHBondContact O-N 3Å; I482-D484 PolarHBondContact O-N 3.14Å; I482-D485 PolarHBondContact O-N 2.98Å; I482-L488 HydrophobicContact CG2-CD1 4.49Å
483	I	85.4	Confident	85.2	Confident	48 Å²	48	67.2 Å²	67.2	25%	0.246	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-57.6	-34.6	173.3	-63.8	175.4	0	0	0	112.6	F476 P480 S481 W499	F476-I483 HydrophobicContact CE2-CD1 4.22Å; F476-I483 HydrophobicContact CE2-CG1 3.7Å; F476-I483 HydrophobicContact CZ-CD1 3.9Å; F476-I483 HydrophobicContact CZ-CG1 3.91Å; P480-I483 WeakPolarHBondContact O-CG1 3.45Å; P480-I483 PolarHBondContact O-N 3.3Å; S481-I483 PolarHBondContact O-N 2.99Å; I483-W499 HydrophobicContact CG2-CD2 4.14Å; I483-W499 HydrophobicContact CG2-CG 4.31Å; I483-W499 HydrophobicContact CG2-CZ2 3.91Å
484	D	82.1	Confident	85.1	Confident	134 Å²	134	64.7 Å²	64.7	72%	0.717	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-95.1	0	-173	-59.9	-55.6	0	0	0	113	S481 I482	S481-D484 PolarHBondContact O-N 2.87Å; I482-D484 PolarHBondContact O-N 3.14Å
485	D	83.9	Confident	85.1	Confident	52 Å²	52	63.7 Å²	63.7	28%	0.278	36%	0.362	S	S	.	.			trans	-66.8	124.5	176.3	-170.9	-34.9	0	0	0	110.7	L451 I482 N487 L488	L451-D485 HydrophobicContact CD2-CB 3.8Å; L451-D485 WeakPolarHBondContact CD2-OD2 3.34Å; I482-D485 PolarHBondContact O-N 2.98Å; D485-N487 PolarHBondContact O-N 2.96Å; D485-N487 WeakPolarHBondContact OD1-CA 3.48Å; D485-N487 VanDerWaalsContact OD1-CB 3.24Å; D485-N487 WeakPolarHBondContact OD1-CB 3.33Å; D485-N487 PolarHBondContact OD1-N 2.8Å; D485-N487 PolarHBondContact OD1-ND2 2.91Å; D485-L488 VanDerWaalsContact O-CB 3.27Å; D485-L488 WeakPolarHBondContact O-CB 3.47Å; D485-L488 PolarHBondContact O-N 2.96Å
486	P	80.5	Confident	85.2	Confident	128 Å²	128	61.4 Å²	61.4	83%	0.831	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-14.9	178.5	26.5	-35.8	0	0	0	114.1
487	N	84.4	Confident	85.4	Confident	77 Å²	77	58.7 Å²	58.7	41%	0.412	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-0	175.5	-54.9	-81.5	0	0	0	113.5	G453 D485 V489	G453-N487 WeakPolarHBondContact CA-O 3.41Å; G453-N487 PolarHBondContact N-O 2.68Å; D485-N487 PolarHBondContact O-N 2.96Å; D485-N487 WeakPolarHBondContact OD1-CA 3.48Å; D485-N487 VanDerWaalsContact OD1-CB 3.24Å; D485-N487 WeakPolarHBondContact OD1-CB 3.33Å; D485-N487 PolarHBondContact OD1-N 2.8Å; D485-N487 PolarHBondContact OD1-ND2 2.91Å; N487-V489 PolarHBondContact O-N 2.97Å
488	L	89.6	Confident	85.9	Confident	7 Å²	7	57.7 Å²	57.7	4%	0.037	32%	0.324	C	S	.	.			trans	-68.4	114.2	-178.4	-178.2	62	0	0	0	112.2	I449 L451 I482 D485 W499	I449-L488 HydrophobicContact CB-CD1 3.93Å; I449-L488 HydrophobicContact CG2-CD1 4.15Å; L451-L488 HydrophobicContact CD2-CB 4.22Å; L451-L488 HydrophobicContact CD2-CD1 4.2Å; I482-L488 HydrophobicContact CG2-CD1 4.49Å; D485-L488 VanDerWaalsContact O-CB 3.27Å; D485-L488 WeakPolarHBondContact O-CB 3.47Å; D485-L488 PolarHBondContact O-N 2.96Å; L488-W499 HydrophobicContact CD2-CB 4.12Å; L488-W499 HydrophobicContact CD2-CD2 4.48Å; L488-W499 HydrophobicContact CD2-CE3 4.39Å; L488-W499 HydrophobicContact CD2-CG 4.37Å
489	V	89.9	Confident	85.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	124.2	174.9	-176.8	0	0	0	0	109.3	I449 S450 C452 G453 L455 I461 F466 N487 Y496	I449-V489 WeakPolarHBondContact CA-O 3.5Å; S450-V489 PolarHBondContact N-O 2.89Å; S450-V489 PolarHBondContact O-N 3.13Å; C452-V489 VanDerWaalsContact SG-CG2 3.55Å; G453-V489 WeakPolarHBondContact O-CG2 3.35Å; L455-V489 HydrophobicContact CD1-CB 4.4Å; L455-V489 HydrophobicContact CD1-CG1 4.23Å; L455-V489 HydrophobicContact CD1-CG2 3.84Å; L455-V489 HydrophobicContact CD2-CG1 4.45Å; L455-V489 HydrophobicContact CG-CG1 4.46Å; L455-V489 HydrophobicContact CG-CG2 3.94Å; I461-V489 HydrophobicContact CD1-CG1 3.86Å; I461-V489 HydrophobicContact CD1-CG2 3.9Å; F466-V489 HydrophobicContact CD2-CB 4.44Å; F466-V489 HydrophobicContact CD2-CG1 4.05Å; F466-V489 HydrophobicContact CE2-CB 4.29Å; F466-V489 HydrophobicContact CE2-CG1 3.99Å; N487-V489 PolarHBondContact O-N 2.97Å; V489-Y496 HydrophobicContact CG1-CD1 4.02Å; V489-Y496 HydrophobicContact CG1-CG 4.28Å
490	V	91.4	Very high	86.1	Confident	4 Å²	4	56.3 Å²	56.3	2%	0.024	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	124.2	173.1	-164.7	0	0	0	0	109.2	I449 I492 Y496 Y497 W499 A502	I449-V490 HydrophobicContact CG2-CB 4.4Å; I449-V490 HydrophobicContact CG2-CG1 4.08Å; I449-V490 HydrophobicContact CG2-CG2 4.09Å; V490-I492 HydrophobicContact CG1-CG1 4.09Å; V490-Y496 CarbonylContact O-C 3.28Å; V490-Y496 WeakPolarHBondContact O-CA 3.48Å; V490-Y497 PolarHBondContact N-O 2.86Å; V490-Y497 PolarHBondContact O-N 2.95Å; V490-W499 HydrophobicContact CG2-CE3 3.92Å; V490-A502 HydrophobicContact CB-CB 3.53Å; V490-A502 HydrophobicContact CG1-CB 3.88Å; V490-A502 HydrophobicContact CG2-CB 3.46Å; V490-A502 VanDerWaalsContact CG2-CB 3.46Å
491	K	89.4	Confident	86.3	Confident	39 Å²	39	52.6 Å²	52.6	17%	0.17	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	128.4	169.2	-176.4	-176.3	-179.9	-179.5	0	109.1	M447 A448 F466 G493 K495 Y496	M447-K491 WeakPolarHBondContact CA-O 3.43Å; A448-K491 HydrophobicContact CB-CB 4.49Å; A448-K491 PolarHBondContact N-O 2.74Å; A448-K491 VanDerWaalsContact N-O 3.14Å; A448-K491 PolarHBondContact O-N 3.16Å; F466-K491 HydrophobicContact CD1-CD 4.42Å; F466-K491 HydrophobicContact CE1-CB 4.04Å; F466-K491 HydrophobicContact CE1-CD 4.1Å; F466-K491 HydrophobicContact CE2-CB 3.76Å; F466-K491 HydrophobicContact CZ-CB 3.46Å; F466-K491 VanDerWaalsContact CZ-CB 3.46Å; F466-K491 HydrophobicContact CZ-CD 4.37Å; K491-G493 WeakPolarHBondContact CE-O 3.38Å; K491-K495 WeakPolarHBondContact CA-O 3.5Å; K491-Y496 HydrophobicContact CB-CD1 3.84Å; K491-Y496 HydrophobicContact CB-CE1 3.91Å; K491-Y496 HydrophobicContact CD-CE1 3.81Å; K491-Y496 HydrophobicContact CG-CD1 4.02Å; K491-Y496 HydrophobicContact CG-CE1 3.77Å
492	I	88.4	Confident	86.6	Confident	18 Å²	18	49.4 Å²	49.4	9%	0.092	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	103.4	171.3	-51.6	176.9	0	0	0	107.2	M447 V490 S494 K495 Y497 A502 L505 V506 I509	M447-I492 HydrophobicContact CG-CG1 4.4Å; M447-I492 HydrophobicContact CG-CG2 4.23Å; V490-I492 HydrophobicContact CG1-CG1 4.09Å; I492-S494 PolarHBondContact O-N 2.97Å; I492-K495 PolarHBondContact N-O 2.71Å; I492-K495 PolarHBondContact O-N 2.87Å; I492-Y497 HydrophobicContact CB-CD2 4.25Å; I492-Y497 HydrophobicContact CB-CE2 3.95Å; I492-Y497 HydrophobicContact CD1-CD2 4.23Å; I492-Y497 HydrophobicContact CD1-CE2 4.42Å; I492-Y497 HydrophobicContact CG1-CD2 4.17Å; I492-Y497 HydrophobicContact CG1-CE2 4.34Å; I492-A502 HydrophobicContact CD1-CB 4.28Å; I492-L505 HydrophobicContact CD1-CB 3.72Å; I492-L505 HydrophobicContact CD1-CD1 4.07Å; I492-V506 HydrophobicContact CD1-CG2 3.83Å; I492-I509 HydrophobicContact CG2-CD1 4.09Å
493	G	83.5	Confident	86.8	Confident	23 Å²	23	50 Å²	50	24%	0.237	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	66	-118.8	-173.5	0	0	0	0	0	111.7	S446 K491	S446-G493 PolarHBondContact O-N 2.86Å; K491-G493 WeakPolarHBondContact CE-O 3.38Å
494	S	79.8	Confident	86.9	Confident	114 Å²	114	50.2 Å²	50.2	80%	0.797	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	1.1	-179.2	57.5	0	0	0	0	114.9	I492	I492-S494 PolarHBondContact O-N 2.97Å
495	K	84.5	Confident	87.2	Confident	93 Å²	93	44.3 Å²	44.3	40%	0.404	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	148.4	-177	-73.5	-177.7	173.4	-175.2	0	112.4	K491 I492 Y497	K491-K495 WeakPolarHBondContact CA-O 3.5Å; I492-K495 PolarHBondContact N-O 2.71Å; I492-K495 PolarHBondContact O-N 2.87Å; K495-Y497 HydrophobicContact CB-CD2 4.38Å; K495-Y497 HydrophobicContact CB-CE2 3.5Å; K495-Y497 VanDerWaalsContact CB-CE2 3.5Å; K495-Y497 WeakPolarHBondContact CB-OH 3.33Å; K495-Y497 VanDerWaalsContact CD-OH 3.29Å; K495-Y497 WeakPolarHBondContact CD-OH 3.33Å
496	Y	87.8	Confident	87.3	Confident	49 Å²	49	43.6 Å²	43.6	19%	0.192	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	140.8	175.2	-55.6	-73.6	0	0	0	110.4	I461 F466 V489 V490 K491	I461-Y496 HydrophobicContact CB-CD2 4.08Å; I461-Y496 HydrophobicContact CB-CE2 4.31Å; I461-Y496 HydrophobicContact CB-CG 4.46Å; I461-Y496 HydrophobicContact CG2-CD2 4.49Å; I461-Y496 HydrophobicContact CG2-CE2 4.44Å; I461-Y496 WeakPolarHBondContact O-CE2 3.39Å; F466-Y496 HydrophobicContact CB-CE1 3.96Å; F466-Y496 HydrophobicContact CD1-CE1 4.25Å; F466-Y496 AromaticContact CD2-CD1 3.62Å; F466-Y496 HydrophobicContact CD2-CD1 3.62Å; F466-Y496 AromaticContact CD2-CE1 3.42Å; F466-Y496 HydrophobicContact CD2-CE1 3.42Å; F466-Y496 VanDerWaalsContact CD2-CE1 3.42Å; F466-Y496 AromaticContact CE2-CD1 3.93Å; F466-Y496 HydrophobicContact CE2-CD1 3.93Å; F466-Y496 AromaticContact CE2-CE1 3.97Å; F466-Y496 HydrophobicContact CE2-CE1 3.97Å; F466-Y496 HydrophobicContact CG-CD1 4.27Å; F466-Y496 AromaticContact CG-CE1 3.59Å; F466-Y496 HydrophobicContact CG-CE1 3.59Å; V489-Y496 HydrophobicContact CG1-CD1 4.02Å; V489-Y496 HydrophobicContact CG1-CG 4.28Å; V490-Y496 CarbonylContact O-C 3.28Å; V490-Y496 WeakPolarHBondContact O-CA 3.48Å; K491-Y496 HydrophobicContact CB-CD1 3.84Å; K491-Y496 HydrophobicContact CB-CE1 3.91Å; K491-Y496 HydrophobicContact CD-CE1 3.81Å; K491-Y496 HydrophobicContact CG-CD1 4.02Å; K491-Y496 HydrophobicContact CG-CE1 3.77Å
497	Y	88.1	Confident	87.6	Confident	15 Å²	15	42.9 Å²	42.9	6%	0.059	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	153.8	-173.3	-58.4	-86.9	0	0	0	110.4	L455 V490 I492 K495 T501 L505 V521 M525 M529	L455-Y497 VanDerWaalsContact CD1-C 3.49Å; V490-Y497 PolarHBondContact N-O 2.86Å; V490-Y497 PolarHBondContact O-N 2.95Å; I492-Y497 HydrophobicContact CB-CD2 4.25Å; I492-Y497 HydrophobicContact CB-CE2 3.95Å; I492-Y497 HydrophobicContact CD1-CD2 4.23Å; I492-Y497 HydrophobicContact CD1-CE2 4.42Å; I492-Y497 HydrophobicContact CG1-CD2 4.17Å; I492-Y497 HydrophobicContact CG1-CE2 4.34Å; K495-Y497 HydrophobicContact CB-CD2 4.38Å; K495-Y497 HydrophobicContact CB-CE2 3.5Å; K495-Y497 VanDerWaalsContact CB-CE2 3.5Å; K495-Y497 WeakPolarHBondContact CB-OH 3.33Å; K495-Y497 VanDerWaalsContact CD-OH 3.29Å; K495-Y497 WeakPolarHBondContact CD-OH 3.33Å; Y497-T501 HydrophobicContact CD1-CG2 3.65Å; Y497-T501 HydrophobicContact CE1-CG2 4.31Å; Y497-T501 HydrophobicContact CG-CG2 4.49Å; Y497-L505 HydrophobicContact CD1-CD1 4.1Å; Y497-L505 HydrophobicContact CD2-CD1 4.46Å; Y497-L505 HydrophobicContact CE1-CD1 3.85Å; Y497-L505 HydrophobicContact CE2-CD1 4.25Å; Y497-L505 HydrophobicContact CG-CD1 4.38Å; Y497-V521 HydrophobicContact CE1-CG1 4.31Å; Y497-M525 HydrophobicContact CD1-CE 4.38Å; Y497-M525 HydrophobicContact CD1-CG 4.37Å; Y497-M525 HydrophobicContact CE1-CE 3.98Å; Y497-M525 HydrophobicContact CE1-CG 4.03Å; Y497-M525 HydrophobicContact CE1-SD 3.77Å; Y497-M529 HydrophobicContact CD1-SD 4.42Å
498	N	89.8	Confident	87.8	Confident	40 Å²	40	39.4 Å²	39.4	21%	0.214	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	159.1	164.5	63	1.3	0	0	0	109.9	L455 T500 T501 A502 K528 M529	L455-N498 HydrophobicContact CD1-CB 3.88Å; N498-T500 PolarHBondContact ND2-OG1 3.41Å; N498-T500 PolarHBondContact O-N 3.43Å; N498-T500 PolarHBondContact OD1-OG1 2.67Å; N498-T501 PolarHBondContact O-N 2.92Å; N498-T501 VanDerWaalsContact O-N 3.08Å; N498-T501 WeakPolarHBondContact OD1-CB 3.38Å; N498-T501 PolarHBondContact OD1-N 3.32Å; N498-T501 VanDerWaalsContact OD1-N 3.09Å; N498-T501 PolarHBondContact OD1-OG1 3.26Å; N498-A502 WeakPolarHBondContact O-CB 3.46Å; N498-A502 PolarHBondContact O-N 3.06Å; N498-K528 PolarHBondContact ND2-O 3.37Å; N498-K528 VanDerWaalsContact ND2-O 3.16Å; N498-M529 HydrophobicContact CB-CE 4.28Å; N498-M529 HydrophobicContact CB-SD 4.45Å; N498-M529 WeakPolarHBondContact OD1-CG 3.35Å; N498-M529 PolarHBondContact OD1-SD 3.12Å
499	W	89.5	Confident	87.5	Confident	94 Å²	94	39.6 Å²	39.6	36%	0.356	22%	0.22	S	C	.	.	H	α-helix	trans	-52.4	-41.1	-179.2	178.2	-121.3	0	0	0	113.3	I483 L488 V490 T501 A502 A503	I483-W499 HydrophobicContact CG2-CD2 4.14Å; I483-W499 HydrophobicContact CG2-CG 4.31Å; I483-W499 HydrophobicContact CG2-CZ2 3.91Å; L488-W499 HydrophobicContact CD2-CB 4.12Å; L488-W499 HydrophobicContact CD2-CD2 4.48Å; L488-W499 HydrophobicContact CD2-CE3 4.39Å; L488-W499 HydrophobicContact CD2-CG 4.37Å; V490-W499 HydrophobicContact CG2-CE3 3.92Å; W499-T501 VanDerWaalsContact C-N 3.31Å; W499-T501 PolarHBondContact O-N 2.94Å; W499-A502 PolarHBondContact O-N 3.06Å; W499-A503 HydrophobicContact CD2-CB 4.35Å; W499-A503 HydrophobicContact CH2-CB 4.34Å; W499-A503 HydrophobicContact CZ2-CB 4.06Å; W499-A503 WeakPolarHBondContact O-CB 3.46Å; W499-A503 PolarHBondContact O-N 3.32Å
500	T	87.3	Confident	87.1	Confident	83 Å²	83	46.8 Å²	46.8	51%	0.509	25%	0.253	S	S	.	.	H	α-helix	trans	-66.8	-25.4	-179	55.5	0	0	0	0	114.5	N498	N498-T500 PolarHBondContact ND2-OG1 3.41Å; N498-T500 PolarHBondContact O-N 3.43Å; N498-T500 PolarHBondContact OD1-OG1 2.67Å
501	T	88.5	Confident	86.7	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-90	-32.2	171.2	-55.7	0	0	0	0	111.8	Y497 N498 W499 L505 I524 M525 K528 M529	Y497-T501 HydrophobicContact CD1-CG2 3.65Å; Y497-T501 HydrophobicContact CE1-CG2 4.31Å; Y497-T501 HydrophobicContact CG-CG2 4.49Å; N498-T501 PolarHBondContact O-N 2.92Å; N498-T501 VanDerWaalsContact O-N 3.08Å; N498-T501 WeakPolarHBondContact OD1-CB 3.38Å; N498-T501 PolarHBondContact OD1-N 3.32Å; N498-T501 VanDerWaalsContact OD1-N 3.09Å; N498-T501 PolarHBondContact OD1-OG1 3.26Å; W499-T501 VanDerWaalsContact C-N 3.31Å; W499-T501 PolarHBondContact O-N 2.94Å; T501-L505 WeakPolarHBondContact O-CD1 3.47Å; T501-L505 WeakPolarHBondContact O-CG 3.37Å; T501-I524 HydrophobicContact CG2-CG2 4.09Å; T501-M525 HydrophobicContact CG2-CG 3.94Å; T501-K528 WeakPolarHBondContact OG1-CB 3.39Å; T501-M529 HydrophobicContact CG2-SD 4.21Å; T501-M529 WeakPolarHBondContact OG1-CG 3.29Å
502	A	89.5	Confident	86.4	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-72.7	-41.9	-178.8	0	0	0	0	0	112.9	V490 I492 N498 W499 L505 V506	V490-A502 HydrophobicContact CB-CB 3.53Å; V490-A502 HydrophobicContact CG1-CB 3.88Å; V490-A502 HydrophobicContact CG2-CB 3.46Å; V490-A502 VanDerWaalsContact CG2-CB 3.46Å; I492-A502 HydrophobicContact CD1-CB 4.28Å; N498-A502 WeakPolarHBondContact O-CB 3.46Å; N498-A502 PolarHBondContact O-N 3.06Å; W499-A502 PolarHBondContact O-N 3.06Å; A502-L505 WeakPolarHBondContact O-CA 3.12Å; A502-L505 WeakPolarHBondContact O-CB 3.38Å; A502-L505 PolarHBondContact O-N 3.49Å; A502-V506 WeakPolarHBondContact O-CG2 3.4Å; A502-V506 PolarHBondContact O-N 2.96Å
503	A	89.3	Confident	86.2	Confident	30 Å²	30	61.8 Å²	61.8	25%	0.248	33%	0.332	C	S	.	.	H	α-helix	trans	-56.6	-43.1	-173.6	0	0	0	0	0	113.6	W499 L505 L507	W499-A503 HydrophobicContact CD2-CB 4.35Å; W499-A503 HydrophobicContact CH2-CB 4.34Å; W499-A503 HydrophobicContact CZ2-CB 4.06Å; W499-A503 WeakPolarHBondContact O-CB 3.46Å; W499-A503 PolarHBondContact O-N 3.32Å; A503-L505 VanDerWaalsContact C-N 3.31Å; A503-L505 PolarHBondContact O-N 2.86Å; A503-L507 WeakPolarHBondContact O-CB 3.46Å; A503-L507 PolarHBondContact O-N 3.25Å
504	P	88.1	Confident	86.1	Confident	53 Å²	53	67.9 Å²	67.9	34%	0.344	35%	0.352	S	S	.	.	H	α-helix	trans	-62.7	-31.9	171.7	-24.1	34.9	0	0	0	114.5	A508 I524	P504-A508 WeakPolarHBondContact O-CB 3.42Å; P504-A508 PolarHBondContact O-N 2.75Å; P504-A508 VanDerWaalsContact O-N 3.07Å; P504-I524 HydrophobicContact CB-CD1 4.43Å
505	L	87.5	Confident	86.3	Confident	10 Å²	10	67.2 Å²	67.2	5%	0.052	35%	0.345	C	S	.	.	H	α-helix	trans	-74.8	-46.3	179.2	-59.3	170.4	0	0	0	111.2	I492 Y497 T501 A502 A503 A508 I509 L516 V521	I492-L505 HydrophobicContact CD1-CB 3.72Å; I492-L505 HydrophobicContact CD1-CD1 4.07Å; Y497-L505 HydrophobicContact CD1-CD1 4.1Å; Y497-L505 HydrophobicContact CD2-CD1 4.46Å; Y497-L505 HydrophobicContact CE1-CD1 3.85Å; Y497-L505 HydrophobicContact CE2-CD1 4.25Å; Y497-L505 HydrophobicContact CG-CD1 4.38Å; T501-L505 WeakPolarHBondContact O-CD1 3.47Å; T501-L505 WeakPolarHBondContact O-CG 3.37Å; A502-L505 WeakPolarHBondContact O-CA 3.12Å; A502-L505 WeakPolarHBondContact O-CB 3.38Å; A502-L505 PolarHBondContact O-N 3.49Å; A503-L505 VanDerWaalsContact C-N 3.31Å; A503-L505 PolarHBondContact O-N 2.86Å; L505-A508 PolarHBondContact O-N 3.18Å; L505-I509 WeakPolarHBondContact O-CB 3.46Å; L505-I509 WeakPolarHBondContact O-CG1 2.94Å; L505-I509 PolarHBondContact O-N 3Å; L505-L516 HydrophobicContact CD2-CB 4.18Å; L505-L516 HydrophobicContact CD2-CD1 3.98Å; L505-L516 HydrophobicContact CD2-CG 4.28Å; L505-V521 HydrophobicContact CD1-CG1 4.22Å; L505-V521 HydrophobicContact CD2-CB 4.31Å; L505-V521 HydrophobicContact CD2-CG1 3.98Å; L505-V521 HydrophobicContact CD2-CG2 3.65Å
506	V	86.3	Confident	86.3	Confident	38 Å²	38	65.1 Å²	65.1	23%	0.23	34%	0.338	C	S	.	.	H	α-helix	trans	-63.4	-43.4	175.6	178	0	0	0	0	110.3	M447 I492 A502 I509 Q510	M447-V506 HydrophobicContact SD-CG1 4.32Å; M447-V506 HydrophobicContact SD-CG2 3.98Å; I492-V506 HydrophobicContact CD1-CG2 3.83Å; A502-V506 WeakPolarHBondContact O-CG2 3.4Å; A502-V506 PolarHBondContact O-N 2.96Å; V506-I509 PolarHBondContact O-N 3Å; V506-Q510 WeakPolarHBondContact O-CB 3.46Å; V506-Q510 PolarHBondContact O-N 3.07Å
507	L	87.6	Confident	86.4	Confident	112 Å²	112	66.9 Å²	66.9	59%	0.586	36%	0.355	S	S	*	.	H	α-helix	trans	-64.4	-41	177.2	-173.5	149.7	0	0	0	111.8	A503 Q510 A511	A503-L507 WeakPolarHBondContact O-CB 3.46Å; A503-L507 PolarHBondContact O-N 3.25Å; L507-Q510 PolarHBondContact O-N 3.22Å; L507-A511 HydrophobicContact CD2-CB 4.44Å; L507-A511 WeakPolarHBondContact O-CB 3.38Å; L507-A511 PolarHBondContact O-N 3.33Å
508	A	87.6	Confident	86.2	Confident	4 Å²	4	74.4 Å²	74.4	3%	0.033	39%	0.389	C	S	.	.	H	α-helix	trans	-62.6	-43.9	175.4	0	0	0	0	0	112.3	P504 L505 F512 K514 L516	P504-A508 WeakPolarHBondContact O-CB 3.42Å; P504-A508 PolarHBondContact O-N 2.75Å; P504-A508 VanDerWaalsContact O-N 3.07Å; L505-A508 PolarHBondContact O-N 3.18Å; A508-F512 WeakPolarHBondContact O-CB 3.43Å; A508-F512 PolarHBondContact O-N 2.8Å; A508-K514 CarbonylContact C-O 3.55Å; A508-L516 HydrophobicContact CB-CD1 4.45Å; A508-L516 HydrophobicContact CB-CD2 3.54Å; A508-L516 HydrophobicContact CB-CG 3.65Å
509	I	83.3	Confident	86	Confident	11 Å²	11	75.6 Å²	75.6	6%	0.056	40%	0.404	C	S	.	.	H	α-helix	trans	-60.2	-47.2	174.3	-74.9	167.2	0	0	0	110.9	M444 P445 M447 I492 L505 V506 Q513 P515	M444-I509 HydrophobicContact CE-CG2 3.61Å; P445-I509 HydrophobicContact CG-CD1 4.5Å; M447-I509 HydrophobicContact CE-CG2 3.99Å; M447-I509 HydrophobicContact SD-CD1 4.28Å; M447-I509 HydrophobicContact SD-CG2 4.48Å; I492-I509 HydrophobicContact CG2-CD1 4.09Å; L505-I509 WeakPolarHBondContact O-CB 3.46Å; L505-I509 WeakPolarHBondContact O-CG1 2.94Å; L505-I509 PolarHBondContact O-N 3Å; V506-I509 PolarHBondContact O-N 3Å; I509-Q513 WeakPolarHBondContact O-CA 3.16Å; I509-Q513 PolarHBondContact O-N 3.24Å; I509-P515 HydrophobicContact CG1-CB 4.5Å
510	Q	83	Confident	85.8	Confident	152 Å²	152	73.9 Å²	73.9	71%	0.71	40%	0.404	S	S	*	.	H	α-helix	trans	-75.4	-37	-174.6	-170	64.1	16.1	0	0	113.4	V506 L507	V506-Q510 WeakPolarHBondContact O-CB 3.46Å; V506-Q510 PolarHBondContact O-N 3.07Å; L507-Q510 PolarHBondContact O-N 3.22Å
511	A	81.4	Confident	85.8	Confident	63 Å²	63	70.7 Å²	70.7	52%	0.521	38%	0.384	S	S	.	.	H	α-helix	trans	-85.9	-32.6	-176.3	0	0	0	0	0	113.6	L507	L507-A511 HydrophobicContact CD2-CB 4.44Å; L507-A511 WeakPolarHBondContact O-CB 3.38Å; L507-A511 PolarHBondContact O-N 3.33Å
512	F	83.4	Confident	85.6	Confident	147 Å²	147	75.9 Å²	75.9	65%	0.645	41%	0.408	S	S	*	.	H	α-helix	trans	-120.4	-0.1	-173.8	-52.4	-70	0	0	0	114.2	A508 K514	A508-F512 WeakPolarHBondContact O-CB 3.43Å; A508-F512 PolarHBondContact O-N 2.8Å; F512-K514 WeakPolarHBondContact O-CG 3.36Å; F512-K514 PolarHBondContact O-N 2.78Å; F512-K514 VanDerWaalsContact O-N 3.11Å
513	Q	85.5	Confident	85.4	Confident	166 Å²	166	81.1 Å²	81.1	78%	0.776	44%	0.436	S	S	*	.	S	Bend	trans	54.3	26.4	-175.5	-59.1	-177.2	1.1	0	0	113.2	I509	I509-Q513 WeakPolarHBondContact O-CA 3.16Å; I509-Q513 PolarHBondContact O-N 3.24Å
514	K	79.9	Confident	85.2	Confident	150 Å²	150	81.1 Å²	81.1	65%	0.652	43%	0.432	S	S	*	.	S	Bend	trans	-141.4	132.1	-173.8	-72.1	175.4	-176.5	177.2	0	110.8	A508 F512	A508-K514 CarbonylContact C-O 3.55Å; F512-K514 WeakPolarHBondContact O-CG 3.36Å; F512-K514 PolarHBondContact O-N 2.78Å; F512-K514 VanDerWaalsContact O-N 3.11Å
515	P	84.2	Confident	84.9	Confident	100 Å²	100	80.9 Å²	80.9	65%	0.649	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-70.3	151.8	173.5	30.8	-35	0	0	0	111.1	I509	I509-P515 HydrophobicContact CG1-CB 4.5Å
516	L	84.9	Confident	84.7	Confident	49 Å²	49	88.3 Å²	88.3	26%	0.257	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-63.9	148	175.1	-67.8	-174.6	0	0	0	111.8	L505 A508 T520 V521 I524	L505-L516 HydrophobicContact CD2-CB 4.18Å; L505-L516 HydrophobicContact CD2-CD1 3.98Å; L505-L516 HydrophobicContact CD2-CG 4.28Å; A508-L516 HydrophobicContact CB-CD1 4.45Å; A508-L516 HydrophobicContact CB-CD2 3.54Å; A508-L516 HydrophobicContact CB-CG 3.65Å; L516-T520 HydrophobicContact CD1-CG2 4.24Å; L516-V521 HydrophobicContact CB-CG2 3.98Å; L516-I524 HydrophobicContact CD1-CD1 3.94Å
517	P	89.8	Confident	84.4	Confident	86 Å²	86	92.5 Å²	92.5	56%	0.558	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-55.7	139.3	174.4	-24.8	34.3	0	0	0	112	A519 T520 V521	P517-A519 VanDerWaalsContact C-N 3.28Å; P517-A519 PolarHBondContact O-N 2.71Å; P517-A519 VanDerWaalsContact O-N 3.13Å; P517-T520 WeakPolarHBondContact O-CA 3.29Å; P517-T520 VanDerWaalsContact O-CB 3.27Å; P517-T520 WeakPolarHBondContact O-CB 3.39Å; P517-T520 PolarHBondContact O-N 2.92Å; P517-V521 PolarHBondContact O-N 2.82Å; P517-V521 VanDerWaalsContact O-N 3.07Å
518	K	84	Confident	84	Confident	174 Å²	174	91.6 Å²	91.6	76%	0.757	47%	0.467	S	S	*	.	H	α-helix	trans	-52.1	-41.8	-172.9	-65.9	178.9	-179.3	175.2	0	113.5	T520 V521 E522	K518-T520 VanDerWaalsContact C-N 3.33Å; K518-T520 PolarHBondContact O-N 2.85Å; K518-V521 WeakPolarHBondContact O-CB 3.49Å; K518-V521 PolarHBondContact O-N 3.26Å; K518-E522 WeakPolarHBondContact O-CG 3.38Å; K518-E522 PolarHBondContact O-N 2.98Å
519	A	85.1	Confident	83.4	Confident	64 Å²	64	93.3 Å²	93.3	53%	0.529	48%	0.475	S	S	.	.	H	α-helix	trans	-62.8	-35.1	175.9	0	0	0	0	0	113.4	P517 N523	P517-A519 VanDerWaalsContact C-N 3.28Å; P517-A519 PolarHBondContact O-N 2.71Å; P517-A519 VanDerWaalsContact O-N 3.13Å; A519-N523 WeakPolarHBondContact O-CB 3.29Å; A519-N523 VanDerWaalsContact O-CG 3.28Å; A519-N523 PolarHBondContact O-N 3.44Å; A519-N523 PolarHBondContact O-ND2 3.12Å
520	T	86.4	Confident	82.5	Confident	59 Å²	59	97.1 Å²	97.1	36%	0.362	50%	0.5	S	S	.	.	H	α-helix	trans	-68.1	-43.3	173.3	-49.9	0	0	0	0	110.7	L516 P517 K518 E522 N523 I524	L516-T520 HydrophobicContact CD1-CG2 4.24Å; P517-T520 WeakPolarHBondContact O-CA 3.29Å; P517-T520 VanDerWaalsContact O-CB 3.27Å; P517-T520 WeakPolarHBondContact O-CB 3.39Å; P517-T520 PolarHBondContact O-N 2.92Å; K518-T520 VanDerWaalsContact C-N 3.33Å; K518-T520 PolarHBondContact O-N 2.85Å; T520-E522 PolarHBondContact O-N 3.43Å; T520-N523 PolarHBondContact O-N 2.96Å; T520-I524 HydrophobicContact CG2-CD1 4.09Å; T520-I524 VanDerWaalsContact O-CG1 3.31Å; T520-I524 WeakPolarHBondContact O-CG1 3.47Å; T520-I524 PolarHBondContact O-N 3.3Å
521	V	85.8	Confident	81.3	Confident	15 Å²	15	98 Å²	98	9%	0.091	50%	0.502	C	S	.	.	H	α-helix	trans	-59.1	-47	174.8	-172.8	0	0	0	0	110.7	Y497 L505 L516 P517 K518 N523 I524 M525	Y497-V521 HydrophobicContact CE1-CG1 4.31Å; L505-V521 HydrophobicContact CD1-CG1 4.22Å; L505-V521 HydrophobicContact CD2-CB 4.31Å; L505-V521 HydrophobicContact CD2-CG1 3.98Å; L505-V521 HydrophobicContact CD2-CG2 3.65Å; L516-V521 HydrophobicContact CB-CG2 3.98Å; P517-V521 PolarHBondContact O-N 2.82Å; P517-V521 VanDerWaalsContact O-N 3.07Å; K518-V521 WeakPolarHBondContact O-CB 3.49Å; K518-V521 PolarHBondContact O-N 3.26Å; V521-N523 PolarHBondContact O-N 3.36Å; V521-I524 PolarHBondContact O-N 2.93Å; V521-M525 HydrophobicContact CG1-CG 4.32Å; V521-M525 HydrophobicContact CG1-SD 4.14Å; V521-M525 WeakPolarHBondContact O-CB 3.42Å; V521-M525 VanDerWaalsContact O-CG 3.27Å; V521-M525 WeakPolarHBondContact O-CG 3.43Å; V521-M525 PolarHBondContact O-N 2.89Å
522	E	84.6	Confident	79.6	Confident	111 Å²	111	102.9 Å²	102.9	52%	0.519	51%	0.511	S	S	.	.	H	α-helix	trans	-65.6	-35.9	-179.8	-74	166.9	-162	0	0	112.8	K518 T520 K526	K518-E522 WeakPolarHBondContact O-CG 3.38Å; K518-E522 PolarHBondContact O-N 2.98Å; T520-E522 PolarHBondContact O-N 3.43Å; E522-K526 VanDerWaalsContact O-CB 3.26Å; E522-K526 WeakPolarHBondContact O-CB 3.41Å; E522-K526 PolarHBondContact O-N 2.73Å
523	N	86.1	Confident	77.4	Confident	109 Å²	109	99.7 Å²	99.7	58%	0.583	52%	0.519	S	S	*	.	H	α-helix	trans	-64.7	-46.6	171.7	-76.7	-26.2	0	0	0	112.1	A519 T520 V521 K526 E527	A519-N523 WeakPolarHBondContact O-CB 3.29Å; A519-N523 VanDerWaalsContact O-CG 3.28Å; A519-N523 PolarHBondContact O-N 3.44Å; A519-N523 PolarHBondContact O-ND2 3.12Å; T520-N523 PolarHBondContact O-N 2.96Å; V521-N523 PolarHBondContact O-N 3.36Å; N523-K526 PolarHBondContact O-N 2.95Å; N523-E527 PolarHBondContact O-N 2.83Å
524	I	85	Confident	74.9	Confident	30 Å²	30	95.7 Å²	95.7	15%	0.154	52%	0.523	C	S	.	.	H	α-helix	trans	-64.2	-43.6	177.6	-61.2	165.1	0	0	0	110.2	T501 P504 L516 T520 V521 K526 E527 K528	T501-I524 HydrophobicContact CG2-CG2 4.09Å; P504-I524 HydrophobicContact CB-CD1 4.43Å; L516-I524 HydrophobicContact CD1-CD1 3.94Å; T520-I524 HydrophobicContact CG2-CD1 4.09Å; T520-I524 VanDerWaalsContact O-CG1 3.31Å; T520-I524 WeakPolarHBondContact O-CG1 3.47Å; T520-I524 PolarHBondContact O-N 3.3Å; V521-I524 PolarHBondContact O-N 2.93Å; I524-K526 VanDerWaalsContact C-N 3.31Å; I524-K526 PolarHBondContact O-N 2.92Å; I524-E527 PolarHBondContact O-N 2.91Å; I524-K528 HydrophobicContact CG2-CG 4Å; I524-K528 WeakPolarHBondContact O-CB 3.36Å; I524-K528 PolarHBondContact O-N 3.29Å
525	M	82.3	Confident	73.3	Confident	49 Å²	49	100.3 Å²	100.3	24%	0.241	54%	0.536	C	S	.	.	H	α-helix	trans	-58.4	-41.7	174	-72.2	-179.4	83.1	0	0	111.9	Y497 T501 V521 E527 M529	Y497-M525 HydrophobicContact CD1-CE 4.38Å; Y497-M525 HydrophobicContact CD1-CG 4.37Å; Y497-M525 HydrophobicContact CE1-CE 3.98Å; Y497-M525 HydrophobicContact CE1-CG 4.03Å; Y497-M525 HydrophobicContact CE1-SD 3.77Å; T501-M525 HydrophobicContact CG2-CG 3.94Å; V521-M525 HydrophobicContact CG1-CG 4.32Å; V521-M525 HydrophobicContact CG1-SD 4.14Å; V521-M525 WeakPolarHBondContact O-CB 3.42Å; V521-M525 VanDerWaalsContact O-CG 3.27Å; V521-M525 WeakPolarHBondContact O-CG 3.43Å; V521-M525 PolarHBondContact O-N 2.89Å; M525-E527 VanDerWaalsContact C-N 3.3Å; M525-E527 PolarHBondContact O-N 2.97Å; M525-M529 CarbonylContact O-C 3.6Å; M525-M529 VanDerWaalsContact O-CA 3.23Å; M525-M529 WeakPolarHBondContact O-CA 3.13Å; M525-M529 WeakPolarHBondContact O-CB 3.32Å; M525-M529 PolarHBondContact O-N 3.46Å
526	K	82	Confident	70.9	Confident	165 Å²	165	106.7 Å²	106.7	72%	0.717	55%	0.547	S	S	*	.	H	α-helix	trans	-66.6	-30.9	178.7	-175.5	178.1	178.3	-177.7	0	112.9	E522 N523 I524	E522-K526 VanDerWaalsContact O-CB 3.26Å; E522-K526 WeakPolarHBondContact O-CB 3.41Å; E522-K526 PolarHBondContact O-N 2.73Å; N523-K526 PolarHBondContact O-N 2.95Å; I524-K526 VanDerWaalsContact C-N 3.31Å; I524-K526 PolarHBondContact O-N 2.92Å
527	E	80.6	Confident	68.6	Low	127 Å²	127	112.6 Å²	112.6	59%	0.593	57%	0.566	S	S	*	*	H	α-helix	trans	-84.3	-43.3	178.4	-161.7	-159.3	141.1	0	0	112.9	N523 I524 M525	N523-E527 PolarHBondContact O-N 2.83Å; I524-E527 PolarHBondContact O-N 2.91Å; M525-E527 VanDerWaalsContact C-N 3.3Å; M525-E527 PolarHBondContact O-N 2.97Å
528	K	79.8	Confident	65.8	Low	93 Å²	93	116.2 Å²	116.2	40%	0.404	57%	0.573	S	S	.	*	H	α-helix	trans	-103.9	-11.3	-170.2	-53.7	-51.9	-169.7	-168.4	0	114.7	N498 T501 I524 P530	N498-K528 PolarHBondContact ND2-O 3.37Å; N498-K528 VanDerWaalsContact ND2-O 3.16Å; T501-K528 WeakPolarHBondContact OG1-CB 3.39Å; I524-K528 HydrophobicContact CG2-CG 4Å; I524-K528 WeakPolarHBondContact O-CB 3.36Å; I524-K528 PolarHBondContact O-N 3.29Å; K528-P530 VanDerWaalsContact C-CD 3.5Å
529	M	74.8	Confident	63.4	Low	40 Å²	40	112.8 Å²	112.8	20%	0.197	57%	0.572	C	S	.	*	S	Bend	trans	-135.5	56.3	172.3	-63.1	-179.8	83.3	0	0	111.9	L455 Y497 N498 T501 M525 K531	L455-M529 HydrophobicContact CB-CE 4.19Å; L455-M529 HydrophobicContact CD1-CE 3.87Å; L455-M529 HydrophobicContact CD2-CE 3.88Å; L455-M529 HydrophobicContact CG-CE 4.21Å; Y497-M529 HydrophobicContact CD1-SD 4.42Å; N498-M529 HydrophobicContact CB-CE 4.28Å; N498-M529 HydrophobicContact CB-SD 4.45Å; N498-M529 WeakPolarHBondContact OD1-CG 3.35Å; N498-M529 PolarHBondContact OD1-SD 3.12Å; T501-M529 HydrophobicContact CG2-SD 4.21Å; T501-M529 WeakPolarHBondContact OG1-CG 3.29Å; M525-M529 CarbonylContact O-C 3.6Å; M525-M529 VanDerWaalsContact O-CA 3.23Å; M525-M529 WeakPolarHBondContact O-CA 3.13Å; M525-M529 WeakPolarHBondContact O-CB 3.32Å; M525-M529 PolarHBondContact O-N 3.46Å; M529-K531 PolarHBondContact O-N 3.26Å
530	P	63.2	Low	60.7	Low	91 Å²	91	121.3 Å²	121.3	59%	0.591	59%	0.59	S	S	*	*			trans	-65.4	108.8	177.5	28.4	-34.8	0	0	0	110.9	K528 K532	K528-P530 VanDerWaalsContact C-CD 3.5Å; P530-K532 PolarHBondContact O-N 3.36Å
531	K	59	Low	58.3	Low	171 Å²	171	129.8 Å²	129.8	74%	0.743	62%	0.616	S	S	*	*			trans	-53.8	126.8	173.6	-65.4	-167.5	176.2	-165.7	0	109.8	M529 G533	M529-K531 PolarHBondContact O-N 3.26Å; K531-G533 PolarHBondContact O-N 2.97Å
532	K	44.9	Very low	55.5	Low	165 Å²	165	132.6 Å²	132.6	72%	0.717	65%	0.648	S	S	*	*	S	Bend	trans	-65.1	95.4	-178.6	-78.9	178.1	177.7	170.2	0	110.4	N458 P530	N458-K532 PolarHBondContact ND2-O 3.14Å; P530-K532 PolarHBondContact O-N 3.36Å
533	G	37.9	Very low	52.9	Low	79 Å²	79	138.5 Å²	138.5	81%	0.814	67%	0.665	S	S	*	*			trans	172.7	85.7	176.7	0	0	0	0	0	115.3	K531	K531-G533 PolarHBondContact O-N 2.97Å
534	G	33.4	Very low	50.1	Low	82 Å²	82	139.4 Å²	139.4	85%	0.845	67%	0.671	S	S	*	*			trans	141.6	113.3	167.5	0	0	0	0	0	114.6
535	R	46.2	Very low	47.3	Very low	248 Å²	248	145.2 Å²	145.2	94%	0.936	70%	0.702	S	S	*	*			trans	-93.7	137	175	-61.8	-177.5	-177.3	-163.4	0.6	111.2
536	W	32.1	Very low	44.5	Very low	234 Å²	234	149.7 Å²	149.7	89%	0.886	73%	0.727	S	S	*	*			trans	-159	146.1	162.9	-112.7	30.8	0	0	0	108.5
537	W	37.2	Very low	41.8	Very low	172 Å²	172	146.3 Å²	146.3	65%	0.652	73%	0.73	S	S	*	*			cis	-159.3	-19.2	-12	60.1	-55.8	0	0	0	115	S539	W537-S539 PolarHBondContact O-N 2.87Å
538	F	32	Very low	39.3	Very low	162 Å²	162	149.2 Å²	149.2	71%	0.711	74%	0.74	S	S	*	*			trans	-73.2	91.8	-171.5	-86.1	-67.7	0	0	0	114.8
539	S	33.6	Very low	36.7	Very low	103 Å²	103	150.1 Å²	150.1	72%	0.72	76%	0.758	S	S	*	*			trans	-122.5	115.8	165.4	59.1	0	0	0	0	111.5	W537 R541	W537-S539 PolarHBondContact O-N 2.87Å; S539-R541 PolarHBondContact O-N 2.88Å
540	W	27.9	Very low	34.4	Very low	242 Å²	242	155.2 Å²	155.2	92%	0.917	79%	0.786	S	S	*	*			trans	-86.7	77.8	176.5	-90.4	40.7	0	0	0	111.6
541	R	36.3	Very low	32.6	Very low	237 Å²	237	156.2 Å²	156.2	89%	0.894	80%	0.796	S	S	*	*	S	Bend	trans	160	144.9	146	-91.3	170.9	-155.1	-68.2	0.5	113.5	S539	S539-R541 PolarHBondContact O-N 2.88Å
542	G	27	Very low	31	Very low	75 Å²	75	153.5 Å²	153.5	77%	0.773	79%	0.793	S	S	*	*				101.4	39.9	123.4	0	0	0	0	0	121.7
543	R	28.9	Very low	30	Very low	234 Å²	234	151.4 Å²	151.4	88%	0.883	79%	0.794	S	S	*	*			trans	-20.3	128	165.4	-177.2	178.5	-176.1	167.5	0.9	118.5
544	N	27.1	Very low	29.3	Very low	129 Å²	129	155.6 Å²	155.6	69%	0.69	79%	0.792	S	S	*	*			trans	62.9	141.6	163.8	-78.4	70.9	0	0	0	117.8
545	N	26.4	Very low	28.9	Very low	151 Å²	151	156.6 Å²	156.6	81%	0.807	79%	0.786	S	S	*	*			cis	-138.8	171.3	32.3	-129.6	11.7	0	0	0	114.2
546	N	24.4	Very low	27.9	Very low	144 Å²	144	146.4 Å²	146.4	77%	0.77	76%	0.758	S	S	*	*			trans	-81.8	137.3	-175	-174.5	19.1	0	0	0	113.7
547	A	26.1	Very low	27.6	Very low	94 Å²	94	138.9 Å²	138.9	78%	0.777	75%	0.745	S	S	*	*			trans	-148.2	134.6	157.3	0	0	0	0	0	108.6
548	K	26.4	Very low	27	Very low	188 Å²	188	135.4 Å²	135.4	82%	0.817	75%	0.746	S	S	*	*			trans	-83.5	147.7	175.3	-60.2	-179.6	176	-171.1	0	110.7
549	S	26.2	Very low	26.7	Very low	111 Å²	111	130.4 Å²	130.4	78%	0.776	74%	0.74	S	S	*	*				-158.5	149.7	116.7	58.9	0	0	0	0	110.3
550	D	25.3	Very low	26.4	Very low	147 Å²	147	130.5 Å²	130.5	79%	0.786	75%	0.747	S	S	*	*			trans	-73.9	177.5	165.8	-42.9	-89.2	0	0	0	108.7
551	S	25.4	Very low	26.3	Very low	113 Å²	113	123.6 Å²	123.6	79%	0.79	74%	0.742	S	S	*	*			cis	-150.6	175	10.8	62.3	0	0	0	0	112.5
552	V	26.5	Very low	25.7	Very low	114 Å²	114	120.9 Å²	120.9	69%	0.691	74%	0.739	S	S	*	*			trans	-78.9	157.5	159.5	176.5	0	0	0	0	106.4
553	T	24	Very low	25.5	Very low	121 Å²	121	123 Å²	123	74%	0.742	74%	0.737	S	S	*	*				-168.4	157.6	70.4	-50.7	0	0	0	0	114.1
554	E	23.1	Very low	25.2	Very low	166 Å²	166	119.3 Å²	119.3	78%	0.776	74%	0.735	S	S	*	*			trans	-43.4	175.9	156.7	-70.2	145.2	120.4	0	0	115.8
555	C	25.3	Very low	25	Very low	104 Å²	104	119.4 Å²	119.4	70%	0.703	73%	0.731	S	S	*	*			cis	177.2	166.3	-29.4	-154.9	0	0	0	0	107	D172	D172-C555 PolarHBondContact OD2-SG 3.11Å
556	G	24	Very low	25	Very low	34 Å²	34	120 Å²	120	35%	0.351	73%	0.731	S	S	.	*			trans	75.1	163.9	173.3	0	0	0	0	0	115.6	A171 D172	A171-G556 VanDerWaalsContact CB-CA 3.4Å; A171-G556 WeakPolarHBondContact CB-O 3.45Å; D172-G556 VanDerWaalsContact OD2-CA 3.31Å; D172-G556 WeakPolarHBondContact OD2-CA 3.38Å; D172-G556 PolarHBondContact OD2-N 2.85Å
557	A	26	Very low	25	Very low	76 Å²	76	121 Å²	121	63%	0.628	73%	0.729	S	S	*	*			cis	-179.1	149.4	-25.9	0	0	0	0	0	106.2	D172	D172-A557 HydrophobicContact CB-CB 4.31Å
558	C	24.6	Very low	24.8	Very low	99 Å²	99	120.5 Å²	120.5	67%	0.669	72%	0.719	S	S	*	*			cis	-151.6	-171.4	-8.5	63.4	0	0	0	0	106	D172	D172-C558 WeakPolarHBondContact O-CB 3.3Å
559	G	26	Very low	24.7	Very low	57 Å²	57	121.8 Å²	121.8	59%	0.588	72%	0.719	S	S	*	*			cis	164.3	174.1	4.4	0	0	0	0	0	110.2
560	A	27.4	Very low	24.6	Very low	104 Å²	104	124 Å²	124	86%	0.86	72%	0.721	S	S	*	*			trans	70.1	129.7	165.8	0	0	0	0	0	122.9
561	A	25.7	Very low	24.6	Very low	98 Å²	98	125.7 Å²	125.7	81%	0.81	72%	0.722	S	S	*	*			trans	66.3	145.8	143.1	0	0	0	0	0	122.2
562	E	23.2	Very low	24.5	Very low	179 Å²	179	127.9 Å²	127.9	84%	0.836	72%	0.719	S	S	*	*			cis	-169.6	-177.4	-27.5	-149.6	-177.1	-147.6	0	0	108.7
563	V	24.6	Very low	24.4	Very low	121 Å²	121	131.4 Å²	131.4	73%	0.733	73%	0.728	S	S	*	*			trans	68.6	110.9	171	-166.2	0	0	0	0	114.9
564	D	22.1	Very low	24.4	Very low	155 Å²	155	131.6 Å²	131.6	83%	0.829	74%	0.735	S	S	*	*			cis	93.7	167.3	46.5	-168	37.5	0	0	0	114.4
565	E	22.3	Very low	24.4	Very low	132 Å²	132	129.2 Å²	129.2	62%	0.617	74%	0.736	S	S	*	*			trans	86.8	63.5	176.5	-139.2	-164.2	146.7	0	0	120.2	K567	E565-K567 IonicContact OE1-NZ 2.69Å; E565-K567 PolarHBondContact OE1-NZ 2.75Å
566	M	27.2	Very low	24.5	Very low	163 Å²	163	130.1 Å²	130.1	80%	0.803	74%	0.744	S	S	*	*				22.9	102.1	115.5	-179.7	53.2	162.7	0	0	119.4
567	K	22.7	Very low	24.5	Very low	166 Å²	166	132.8 Å²	132.8	72%	0.722	76%	0.757	S	S	*	*			trans	-172.9	147.1	148.7	-98.5	135.9	-171.1	164.7	0	110.7	E565	E565-K567 IonicContact OE1-NZ 2.69Å; E565-K567 PolarHBondContact OE1-NZ 2.75Å
568	S	21.9	Very low	24.6	Very low	82 Å²	82	135.4 Å²	135.4	57%	0.573	76%	0.761	S	S	*	*			cis	-170.9	173.1	-17.7	63.2	0	0	0	0	110.7
569	R	24.3	Very low	25	Very low	215 Å²	215	140 Å²	140	81%	0.811	77%	0.772	S	S	*	*			trans	77.4	116.9	151.7	-72	169.2	-178.8	-177.8	0.1	120.5
570	L	26.1	Very low	25	Very low	159 Å²	159	143.7 Å²	143.7	83%	0.832	78%	0.778	S	S	*	*				67	99.8	129.5	-58.2	170.2	0	0	0	118.8
571	K	23.3	Very low	25.1	Very low	182 Å²	182	146.3 Å²	146.3	79%	0.791	77%	0.773	S	S	*	*				-163.9	143	110.8	-118.4	-171.3	170.6	-144.4	0	115
572	E	25.2	Very low	25	Very low	159 Å²	159	149.6 Å²	149.6	74%	0.743	78%	0.775	S	S	*	*			trans	64.5	153	154.5	-75.5	164.3	-137.7	0	0	119.6
573	E	22.4	Very low	25.5	Very low	187 Å²	187	145.5 Å²	145.5	87%	0.874	77%	0.772	S	S	*	*			trans	-103	132.9	-161.3	-60.5	-177.5	123.3	0	0	111.5
574	S	24.7	Very low	25.9	Very low	126 Å²	126	143.8 Å²	143.8	88%	0.881	77%	0.77	S	S	*	*			trans	-155.6	61.3	164.7	-74.7	0	0	0	0	108.9	S576	S574-S576 PolarHBondContact O-N 2.96Å
575	S	23.2	Very low	26.3	Very low	115 Å²	115	143.6 Å²	143.6	80%	0.804	77%	0.769	S	S	*	*			trans	-68.7	120.7	163	-173.3	0	0	0	0	108.4
576	S	28.4	Very low	26.8	Very low	124 Å²	124	145.8 Å²	145.8	87%	0.867	78%	0.779	S	S	*	*			trans	-102	83.2	162.3	-170.6	0	0	0	0	107.1	S574	S574-S576 PolarHBondContact O-N 2.96Å
577	S	23.9	Very low	27	Very low	89 Å²	89	143.2 Å²	143.2	62%	0.622	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-54.6	163.9	169.5	-176	0	0	0	0	111.4
578	D	26.6	Very low	27.5	Very low	132 Å²	132	140.6 Å²	140.6	71%	0.706	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-48.2	141.8	151.2	-55.1	-87.6	0	0	0	110.6
579	E	33	Very low	28.2	Very low	194 Å²	194	142.6 Å²	142.6	91%	0.907	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-92.4	137.4	143.6	-87.4	-73.5	135.6	0	0	106.6
580	D	26.4	Very low	28.8	Very low	135 Å²	135	138.1 Å²	138.1	72%	0.722	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-83.8	171.8	-147.5	-139.8	-38.4	0	0	0	115.5
581	H	29.6	Very low	29	Very low	160 Å²	160	138.7 Å²	138.7	74%	0.741	79%	0.789	S	S	*	*			trans	-64.2	-179.4	173.5	-70.3	-101.5	0	0	0	114.4
582	I	24.4	Very low	29.9	Very low	167 Å²	167	138.3 Å²	138.3	86%	0.856	79%	0.79	S	S	*	*			trans	92.7	133.4	153.9	-52.2	-167.1	0	0	0	116.7
583	A	32.4	Very low	30.2	Very low	93 Å²	93	136.4 Å²	136.4	77%	0.769	80%	0.795	S	S	*	*			trans	-105.5	138.8	173.6	0	0	0	0	0	111.5
584	A	34	Very low	30.6	Very low	85 Å²	85	135.8 Å²	135.8	70%	0.702	79%	0.792	S	S	*	*			trans	-171.4	134.8	141.8	0	0	0	0	0	111.6
585	N	30.2	Very low	31.3	Very low	151 Å²	151	134.8 Å²	134.8	81%	0.807	78%	0.782	S	S	*	*			trans	36.2	126.5	145.7	-50.4	-34.4	0	0	0	118.5
586	Q	33.5	Very low	31.6	Very low	178 Å²	178	132.8 Å²	132.8	83%	0.832	78%	0.78	S	S	*	*				-161.7	164.8	56.1	-74.7	177.7	31	0	0	113.7
587	S	30.2	Very low	32.3	Very low	109 Å²	109	133.5 Å²	133.5	76%	0.762	78%	0.779	S	S	*	*			trans	58.1	119.3	154.4	56.5	0	0	0	0	120.3
588	S	33.4	Very low	33.1	Very low	110 Å²	110	134 Å²	134	77%	0.769	78%	0.782	S	S	*	*			trans	-59.9	158.6	158.2	54	0	0	0	0	112.4
589	P	36	Very low	34	Very low	125 Å²	125	133.4 Å²	133.4	81%	0.812	79%	0.788	S	S	*	*				-136.3	162.1	94.3	39	-29.6	0	0	0	115.9
590	V	38.7	Very low	34.7	Very low	120 Å²	120	126.4 Å²	126.4	73%	0.727	77%	0.768	S	S	*	*			trans	-53.2	140.3	173.3	175.3	0	0	0	0	113.4
591	I	29.9	Very low	36.3	Very low	171 Å²	171	122.4 Å²	122.4	88%	0.877	76%	0.759	S	S	*	*			trans	-148.2	145.2	139	-101	151.1	0	0	0	108.4
592	Q	42.2	Very low	38.3	Very low	175 Å²	175	118.5 Å²	118.5	82%	0.818	75%	0.746	S	S	*	*			trans	-94.9	152.1	-174.4	-63.6	157.8	-45.2	0	0	111.8
593	S	32	Very low	40.8	Very low	119 Å²	119	112.3 Å²	112.3	83%	0.832	72%	0.718	S	S	*	*			trans	-138.6	123.2	158.4	60.5	0	0	0	0	110
594	E	30.6	Very low	43.1	Very low	174 Å²	174	110.7 Å²	110.7	81%	0.813	69%	0.692	S	S	*	*			trans	-58.2	153.4	-173.3	-77	-80.6	107.2	0	0	115	G596	E594-G596 PolarHBondContact O-N 2.83Å; E594-G596 VanDerWaalsContact O-N 3.15Å
595	P	38.4	Very low	45.5	Very low	104 Å²	104	108.9 Å²	108.9	68%	0.675	67%	0.668	S	S	*	*			trans	-72.8	104.1	175	30.6	-33.9	0	0	0	111.5	V597	P595-V597 PolarHBondContact O-N 3.29Å; P595-V597 VanDerWaalsContact O-N 3.13Å
596	G	30	Very low	48.2	Very low	73 Å²	73	104.6 Å²	104.6	75%	0.753	64%	0.642	S	S	*	*			trans	-65.5	109.1	166.9	0	0	0	0	0	110.6	E594 S598	E594-G596 PolarHBondContact O-N 2.83Å; E594-G596 VanDerWaalsContact O-N 3.15Å; G596-S598 PolarHBondContact O-N 3.01Å
597	V	43.4	Very low	50.9	Low	140 Å²	140	97.6 Å²	97.6	85%	0.848	61%	0.612	S	S	*	*			trans	-65.6	93.6	-177	-178.6	0	0	0	0	111.1	P595	P595-V597 PolarHBondContact O-N 3.29Å; P595-V597 VanDerWaalsContact O-N 3.13Å
598	S	40.3	Very low	53.8	Low	98 Å²	98	95.2 Å²	95.2	69%	0.685	59%	0.59	S	S	*	*			trans	-69.5	122.7	159.9	50.7	0	0	0	0	108.8	G596 G600	G596-S598 PolarHBondContact O-N 3.01Å; S598-G600 PolarHBondContact O-N 2.87Å; S598-G600 VanDerWaalsContact O-N 3.09Å
599	S	45.1	Very low	56.6	Low	120 Å²	120	93.7 Å²	93.7	84%	0.839	57%	0.568	S	S	*	*			trans	-57.3	115.8	177.2	-176	0	0	0	0	110.3	G601	S599-G601 PolarHBondContact O-N 2.86Å
600	G	47.4	Very low	59.4	Low	48 Å²	48	88.4 Å²	88.4	50%	0.495	53%	0.533	S	S	.	.			trans	-48.9	121.9	-170.9	0	0	0	0	0	113.1	S598 V602	S598-G600 PolarHBondContact O-N 2.87Å; S598-G600 VanDerWaalsContact O-N 3.09Å; G600-V602 PolarHBondContact O-N 2.82Å
601	G	60.7	Low	62.1	Low	50 Å²	50	85.3 Å²	85.3	52%	0.515	51%	0.514	S	S	.	.			trans	-94.8	93.9	-171	0	0	0	0	0	111	S599 S603	S599-G601 PolarHBondContact O-N 2.86Å; G601-S603 PolarHBondContact O-N 3.39Å
602	V	70.7	Confident	65.2	Low	78 Å²	78	78.8 Å²	78.8	47%	0.473	48%	0.484	S	S	.	.			trans	-53.3	111	177.4	-178.7	0	0	0	0	110.1	Q91 G600 Y604	Q91-V602 VanDerWaalsContact CD-CG1 3.4Å; Q91-V602 HydrophobicContact CG-CG1 3.42Å; Q91-V602 VanDerWaalsContact CG-CG1 3.42Å; G600-V602 PolarHBondContact O-N 2.82Å; V602-Y604 HydrophobicContact CG1-CE1 4.33Å; V602-Y604 HydrophobicContact CG1-CE2 3.8Å
603	S	77	Confident	67.6	Low	38 Å²	38	78.1 Å²	78.1	27%	0.266	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	158.9	-179.5	60	0	0	0	0	110.4	T92 G601	T92-S603 WeakPolarHBondContact CB-OG 3.33Å; T92-S603 PolarHBondContact N-O 2.93Å; T92-S603 PolarHBondContact O-N 3.17Å; T92-S603 PolarHBondContact O-OG 2.9Å; T92-S603 PolarHBondContact OG1-O 3.01Å; T92-S603 PolarHBondContact OG1-OG 2.88Å; G601-S603 PolarHBondContact O-N 3.39Å
604	Y	80.7	Confident	70.6	Confident	58 Å²	58	75.7 Å²	75.7	23%	0.227	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	134.3	-179.7	-60	-92.3	0	0	0	111.2	V89 Q90 Q91 T105 P107 V602	V89-Y604 HydrophobicContact CG1-CD1 3.83Å; V89-Y604 HydrophobicContact CG1-CG 4.23Å; Q90-Y604 CarbonylContact O-C 3.59Å; Q90-Y604 WeakPolarHBondContact O-CA 3.39Å; Q91-Y604 HydrophobicContact CB-CD1 4.04Å; Q91-Y604 HydrophobicContact CB-CE1 3.92Å; Q91-Y604 HydrophobicContact CG-CD1 4.16Å; Q91-Y604 HydrophobicContact CG-CE1 3.76Å; T105-Y604 PolarHBondContact N-O 3.21Å; P107-Y604 HydrophobicContact CB-CD1 4.33Å; P107-Y604 HydrophobicContact CB-CE1 3.91Å; P107-Y604 HydrophobicContact CB-CE2 4.19Å; P107-Y604 HydrophobicContact CG-CD2 4.5Å; P107-Y604 HydrophobicContact CG-CE2 4.03Å; V602-Y604 HydrophobicContact CG1-CE1 4.33Å; V602-Y604 HydrophobicContact CG1-CE2 3.8Å
605	K	85.4	Confident	73.7	Confident	47 Å²	47	67.5 Å²	67.5	20%	0.204	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	132.6	-169.9	173.5	176.1	174.1	177.4	0	109.4	Q90 T92 E97 V99 L103	Q90-K605 HydrophobicContact CB-CB 4.45Å; Q90-K605 PolarHBondContact N-O 2.81Å; Q90-K605 PolarHBondContact O-N 2.83Å; T92-K605 HydrophobicContact CG2-CB 4.17Å; T92-K605 HydrophobicContact CG2-CD 3.87Å; E97-K605 IonicContact OE1-NZ 2.88Å; E97-K605 PolarHBondContact OE1-NZ 3.08Å; E97-K605 IonicContact OE2-NZ 3.28Å; V99-K605 HydrophobicContact CG1-CB 4.35Å; L103-K605 CarbonylContact O-C 3.57Å; L103-K605 WeakPolarHBondContact O-CA 3.42Å
606	K	85.9	Confident	76.4	Confident	61 Å²	61	67.1 Å²	67.1	27%	0.265	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	131.9	169.2	-60.8	175.2	-167.7	164	0	108.9	F87 Y102 L103 A104 T105	F87-K606 HydrophobicContact CD1-CD 4.39Å; F87-K606 HydrophobicContact CD2-CB 3.96Å; F87-K606 HydrophobicContact CD2-CD 4.29Å; F87-K606 HydrophobicContact CD2-CG 3.64Å; F87-K606 HydrophobicContact CE1-CD 4.3Å; F87-K606 HydrophobicContact CE2-CB 4.46Å; F87-K606 HydrophobicContact CE2-CD 4.21Å; F87-K606 HydrophobicContact CE2-CG 3.65Å; F87-K606 HydrophobicContact CG-CB 4.3Å; F87-K606 HydrophobicContact CG-CD 4.38Å; F87-K606 HydrophobicContact CG-CG 4.15Å; F87-K606 HydrophobicContact CZ-CD 4.21Å; F87-K606 HydrophobicContact CZ-CG 4.15Å; Y102-K606 PolarHBondContact O-NZ 2.86Å; L103-K606 WeakPolarHBondContact O-CG 3.48Å; L103-K606 PolarHBondContact O-N 3.28Å; A104-K606 WeakPolarHBondContact O-CE 3.49Å; T105-K606 HydrophobicContact CG2-CG 4.1Å
607	T	90.1	Very high	79.4	Confident	32 Å²	32	67.1 Å²	67.1	20%	0.196	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	149.3	167.3	-177.7	0	0	0	0	110.7	F88 Q90 R609	F88-T607 HydrophobicContact CB-CG2 3.81Å; F88-T607 PolarHBondContact N-O 3.02Å; F88-T607 PolarHBondContact O-N 3.49Å; Q90-T607 HydrophobicContact CB-CG2 4.1Å; T607-R609 WeakPolarHBondContact CG2-O 3.24Å; T607-R609 PolarHBondContact OG1-N 3.28Å; T607-R609 PolarHBondContact OG1-O 3.02Å
608	L	90.9	Very high	81.8	Confident	59 Å²	59	61.1 Å²	61.1	31%	0.309	36%	0.361	S	S	.	.	S	Bend	trans	-105	-4	169.3	-59.3	-178.7	0	0	0	111.9	P47 F48 F87	P47-L608 CarbonylContact C-O 3.5Å; P47-L608 WeakPolarHBondContact CA-O 3.37Å; P47-L608 HydrophobicContact CB-CB 3.91Å; P47-L608 HydrophobicContact CB-CD1 4.47Å; F48-L608 WeakPolarHBondContact CB-O 3.4Å; F48-L608 PolarHBondContact N-O 3.49Å; F87-L608 HydrophobicContact CB-CD2 3.78Å
609	R	93.7	Very high	84.4	Confident	77 Å²	77	64.4 Å²	64.4	29%	0.291	37%	0.366	S	S	.	.	S	Bend	trans	-115	142.7	177.7	-73.1	173.3	166.4	-120.1	2.5	110	C45 P47 T607 D762	C45-R609 PolarHBondContact O-NE 2.83Å; C45-R609 PolarHBondContact O-NH1 3.01Å; P47-R609 HydrophobicContact CG-CG 4.44Å; T607-R609 WeakPolarHBondContact CG2-O 3.24Å; T607-R609 PolarHBondContact OG1-N 3.28Å; T607-R609 PolarHBondContact OG1-O 3.02Å; R609-D762 IonicContact CZ-OD1 3.16Å; R609-D762 IonicContact CZ-OD2 3.1Å; R609-D762 IonicContact NE-OD2 3.63Å; R609-D762 IonicContact NH2-OD1 3.65Å; R609-D762 PolarHBondContact NH2-OD1 3.39Å; R609-D762 IonicContact NH2-OD2 3.24Å; R609-D762 PolarHBondContact NH2-OD2 3.4Å
610	L	94.3	Very high	86.8	Confident	15 Å²	15	59.6 Å²	59.6	8%	0.079	33%	0.33	C	S	.	.			trans	-91.8	159.3	176.6	-66.9	176.3	0	0	0	110.9	F48 L76 F88 Q614 L615 L618	F48-L610 HydrophobicContact CE1-CD1 4.45Å; F48-L610 HydrophobicContact CE2-CD1 3.77Å; F48-L610 HydrophobicContact CE2-CG 4.06Å; F48-L610 HydrophobicContact CZ-CD1 3.7Å; F48-L610 HydrophobicContact CZ-CG 4.47Å; L76-L610 HydrophobicContact CD1-CD2 4.29Å; L76-L610 HydrophobicContact CD2-CD1 3.66Å; L76-L610 HydrophobicContact CD2-CD2 3.84Å; L76-L610 HydrophobicContact CD2-CG 4.42Å; F88-L610 HydrophobicContact CD1-CD2 3.83Å; F88-L610 HydrophobicContact CD2-CD2 3.66Å; F88-L610 HydrophobicContact CD2-CG 4.17Å; F88-L610 HydrophobicContact CE1-CD2 3.79Å; F88-L610 HydrophobicContact CE2-CD1 4.24Å; F88-L610 HydrophobicContact CE2-CD2 3.62Å; F88-L610 HydrophobicContact CE2-CG 3.76Å; F88-L610 HydrophobicContact CG-CD2 3.77Å; F88-L610 HydrophobicContact CZ-CD1 4.01Å; F88-L610 HydrophobicContact CZ-CD2 3.69Å; F88-L610 HydrophobicContact CZ-CG 3.97Å; L610-Q614 HydrophobicContact CB-CB 4.07Å; L610-Q614 HydrophobicContact CD2-CB 4.29Å; L610-L615 HydrophobicContact CB-CD1 4.46Å; L610-L615 HydrophobicContact CB-CD2 4Å; L610-L615 HydrophobicContact CB-CG 3.86Å; L610-L615 HydrophobicContact CD1-CD2 4Å; L610-L618 HydrophobicContact CD1-CD1 4.16Å
611	T	94.6	Very high	89.1	Confident	55 Å²	55	63.6 Å²	63.6	34%	0.337	34%	0.336	S	S	.	.			trans	-76.4	160.3	169.8	67.4	0	0	0	0	110.9	E613 Q614 L615	T611-E613 PolarHBondContact O-N 2.79Å; T611-Q614 PolarHBondContact O-N 2.84Å; T611-Q614 VanDerWaalsContact O-N 3.14Å; T611-Q614 WeakPolarHBondContact OG1-CG 3.18Å; T611-Q614 PolarHBondContact OG1-N 3.08Å; T611-Q614 PolarHBondContact OG1-OE1 3.22Å; T611-L615 WeakPolarHBondContact O-CG 3.44Å; T611-L615 PolarHBondContact O-N 3.35Å
612	S	95.1	Very high	90.7	Very high	34 Å²	34	66 Å²	66	24%	0.238	34%	0.338	C	S	.	.	H	α-helix	trans	-57	-36.2	174.8	-176.2	0	0	0	0	112.3	S42 L43 L615 L616	S42-S612 WeakPolarHBondContact CA-OG 3.48Å; L43-S612 PolarHBondContact N-OG 2.94Å; L43-S612 WeakPolarHBondContact O-CA 3.36Å; L43-S612 WeakPolarHBondContact O-CB 3.44Å; S612-L615 PolarHBondContact O-N 3.41Å; S612-L616 WeakPolarHBondContact O-CB 3.44Å; S612-L616 WeakPolarHBondContact O-CD1 3.24Å; S612-L616 VanDerWaalsContact O-CG 3.23Å; S612-L616 WeakPolarHBondContact O-CG 3.24Å; S612-L616 PolarHBondContact O-N 3.07Å
613	E	94.3	Very high	91.9	Very high	161 Å²	161	63 Å²	63	75%	0.752	32%	0.321	S	S	*	.	H	α-helix	trans	-63.6	-45.5	176.2	-63.4	173.8	174.4	0	0	111.7	T611 L616 S617	T611-E613 PolarHBondContact O-N 2.79Å; E613-L616 PolarHBondContact O-N 2.92Å; E613-S617 PolarHBondContact O-N 2.83Å
614	Q	94.2	Very high	92.8	Very high	68 Å²	68	64.8 Å²	64.8	32%	0.318	33%	0.332	S	S	.	.	H	α-helix	trans	-64.8	-38.2	175.6	-71.9	173.5	-40.6	0	0	112	L610 T611 S617 L618	L610-Q614 HydrophobicContact CB-CB 4.07Å; L610-Q614 HydrophobicContact CD2-CB 4.29Å; T611-Q614 PolarHBondContact O-N 2.84Å; T611-Q614 VanDerWaalsContact O-N 3.14Å; T611-Q614 WeakPolarHBondContact OG1-CG 3.18Å; T611-Q614 PolarHBondContact OG1-N 3.08Å; T611-Q614 PolarHBondContact OG1-OE1 3.22Å; Q614-S617 PolarHBondContact O-N 2.89Å; Q614-S617 PolarHBondContact O-OG 3.43Å; Q614-L618 WeakPolarHBondContact O-CG 3.3Å; Q614-L618 PolarHBondContact O-N 2.94Å
615	L	95.6	Very high	93.6	Very high	1 Å²	1	62 Å²	62	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-67.6	-37.9	176.5	-70.7	166.1	0	0	0	111.9	V35 L43 C45 F48 L610 T611 S612 L618	V35-L615 HydrophobicContact CG1-CD1 4.47Å; V35-L615 HydrophobicContact CG1-CD2 4.45Å; V35-L615 HydrophobicContact CG2-CD2 4.11Å; L43-L615 HydrophobicContact CB-CB 3.77Å; L43-L615 HydrophobicContact CB-CD1 3.99Å; L43-L615 HydrophobicContact CD1-CB 3.87Å; L43-L615 HydrophobicContact CG-CB 4.47Å; L43-L615 WeakPolarHBondContact O-CD1 3.48Å; C45-L615 HydrophobicContact CB-CD1 3.76Å; C45-L615 HydrophobicContact CB-CD2 3.86Å; C45-L615 HydrophobicContact CB-CG 4.47Å; F48-L615 HydrophobicContact CE2-CD2 4.48Å; L610-L615 HydrophobicContact CB-CD1 4.46Å; L610-L615 HydrophobicContact CB-CD2 4Å; L610-L615 HydrophobicContact CB-CG 3.86Å; L610-L615 HydrophobicContact CD1-CD2 4Å; T611-L615 WeakPolarHBondContact O-CG 3.44Å; T611-L615 PolarHBondContact O-N 3.35Å; S612-L615 PolarHBondContact O-N 3.41Å; L615-L618 HydrophobicContact CD2-CD1 4.08Å; L615-L618 WeakPolarHBondContact O-CB 3.1Å; L615-L618 PolarHBondContact O-N 2.8Å
616	L	94.5	Very high	94.1	Very high	97 Å²	97	64.9 Å²	64.9	51%	0.508	34%	0.339	S	S	.	.	H	α-helix	trans	-66.3	-36.4	174.1	-73.5	165	0	0	0	111.7	L43 S612 E613 L618 Q619	L43-L616 HydrophobicContact CD1-CD2 3.76Å; L43-L616 HydrophobicContact CD1-CG 3.95Å; L43-L616 HydrophobicContact CG-CD2 4.04Å; L43-L616 HydrophobicContact CG-CG 4.22Å; S612-L616 WeakPolarHBondContact O-CB 3.44Å; S612-L616 WeakPolarHBondContact O-CD1 3.24Å; S612-L616 VanDerWaalsContact O-CG 3.23Å; S612-L616 WeakPolarHBondContact O-CG 3.24Å; S612-L616 PolarHBondContact O-N 3.07Å; E613-L616 PolarHBondContact O-N 2.92Å; L616-L618 PolarHBondContact O-N 3.35Å; L616-Q619 PolarHBondContact O-N 2.94Å
617	S	94	Very high	94.7	Very high	73 Å²	73	62.1 Å²	62.1	51%	0.51	33%	0.327	S	S	.	.	H	α-helix	trans	-66.9	-15.7	175.7	67.2	0	0	0	0	114.2	E613 Q614 Q619	E613-S617 PolarHBondContact O-N 2.83Å; Q614-S617 PolarHBondContact O-N 2.89Å; Q614-S617 PolarHBondContact O-OG 3.43Å; S617-Q619 VanDerWaalsContact C-N 3.27Å; S617-Q619 PolarHBondContact O-N 3.23Å
618	L	93.8	Very high	94.9	Very high	13 Å²	13	61.4 Å²	61.4	7%	0.068	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-13.1	174.3	-52.8	-173.8	0	0	0	113.7	I69 V74 L76 L610 Q614 L615 L616 L620	I69-L618 HydrophobicContact CD1-CB 3.93Å; I69-L618 HydrophobicContact CD1-CD1 3.86Å; I69-L618 HydrophobicContact CD1-CD2 3.87Å; I69-L618 HydrophobicContact CD1-CG 4.08Å; V74-L618 HydrophobicContact CG1-CD2 3.78Å; L76-L618 HydrophobicContact CD2-CD2 3.9Å; L610-L618 HydrophobicContact CD1-CD1 4.16Å; Q614-L618 WeakPolarHBondContact O-CG 3.3Å; Q614-L618 PolarHBondContact O-N 2.94Å; L615-L618 HydrophobicContact CD2-CD1 4.08Å; L615-L618 WeakPolarHBondContact O-CB 3.1Å; L615-L618 PolarHBondContact O-N 2.8Å; L616-L618 PolarHBondContact O-N 3.35Å; L618-L620 VanDerWaalsContact C-N 3.25Å; L618-L620 HydrophobicContact CB-CD2 4.18Å; L618-L620 HydrophobicContact CB-CG 3.93Å; L618-L620 HydrophobicContact CD1-CD1 4.39Å; L618-L620 PolarHBondContact O-N 2.99Å
619	Q	93.5	Very high	95.1	Very high	167 Å²	167	58.7 Å²	58.7	78%	0.78	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	40.2	179.6	-55.5	-176	30	0	0	114.2	L616 S617	L616-Q619 PolarHBondContact O-N 2.94Å; S617-Q619 VanDerWaalsContact C-N 3.27Å; S617-Q619 PolarHBondContact O-N 3.23Å
620	L	95.8	Very high	95	Very high	19 Å²	19	55.3 Å²	55.3	10%	0.099	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-59.5	136.4	-178.8	-62.6	172.4	0	0	0	112.2	V35 I69 L618 N625 I645 L647	V35-L620 HydrophobicContact CB-CD1 4.22Å; V35-L620 HydrophobicContact CG1-CD1 4.28Å; V35-L620 HydrophobicContact CG2-CD1 3.87Å; I69-L620 HydrophobicContact CD1-CD2 4.49Å; I69-L620 HydrophobicContact CG2-CD2 4.11Å; L618-L620 VanDerWaalsContact C-N 3.25Å; L618-L620 HydrophobicContact CB-CD2 4.18Å; L618-L620 HydrophobicContact CB-CG 3.93Å; L618-L620 HydrophobicContact CD1-CD1 4.39Å; L618-L620 PolarHBondContact O-N 2.99Å; L620-N625 HydrophobicContact CD2-CB 3.99Å; L620-I645 HydrophobicContact CD1-CG2 3.82Å; L620-I645 HydrophobicContact CD2-CB 4.27Å; L620-I645 HydrophobicContact CD2-CD1 4.29Å; L620-I645 HydrophobicContact CD2-CG2 4.02Å; L620-L647 HydrophobicContact CB-CB 4.43Å; L620-L647 HydrophobicContact CB-CD2 3.97Å; L620-L647 WeakPolarHBondContact O-CD2 3.44Å
621	Q	96.1	Very high	94.7	Very high	133 Å²	133	54.6 Å²	54.6	62%	0.621	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-84.3	153.3	172.3	-55.7	-177.2	22	0	0	110.5	G623 N625 L647	Q621-G623 PolarHBondContact O-N 3.4Å; Q621-N625 PolarHBondContact N-OD1 3.16Å; Q621-N625 PolarHBondContact O-ND2 3.03Å; Q621-L647 WeakPolarHBondContact O-CB 3.42Å
622	D	94.9	Very high	94.2	Very high	101 Å²	101	55 Å²	55	54%	0.54	30%	0.296	S	S	.	.	S	Bend	trans	-64.9	124.8	178.4	-76.3	11.2	0	0	0	111.2	R37 L647	R37-D622 IonicContact CZ-OD1 2.76Å; R37-D622 VanDerWaalsContact CZ-OD1 3.24Å; R37-D622 IonicContact NH1-OD1 2.72Å; R37-D622 PolarHBondContact NH1-OD1 3.36Å; R37-D622 IonicContact NH1-OD2 3.68Å; R37-D622 PolarHBondContact NH1-OD2 3.14Å; R37-D622 VanDerWaalsContact NH1-OD2 3.1Å; R37-D622 IonicContact NH2-OD1 3.74Å; R37-D622 PolarHBondContact NH2-OD1 3.14Å; D622-L647 WeakPolarHBondContact OD1-CD2 3.43Å
623	G	94.8	Very high	93.3	Very high	13 Å²	13	53.9 Å²	53.9	13%	0.134	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	96.8	-149.2	-172.3	0	0	0	0	0	113.4	Q621 N625 Y646 L647	Q621-G623 PolarHBondContact O-N 3.4Å; G623-N625 PolarHBondContact O-ND2 2.96Å; G623-Y646 CarbonylContact O-C 3.53Å; G623-Y646 WeakPolarHBondContact O-CA 3.15Å; G623-L647 PolarHBondContact N-O 2.81Å; G623-L647 PolarHBondContact O-N 3.42Å
624	P	96.6	Very high	92	Very high	76 Å²	76	50.4 Å²	50.4	49%	0.494	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	137.3	-176.2	30.6	-33.6	0	0	0	112.5	T644 Y646	P624-T644 HydrophobicContact CB-CG2 3.56Å; P624-Y646 HydrophobicContact CB-CD1 4.08Å; P624-Y646 HydrophobicContact CB-CE1 3.79Å
625	N	97.7	Very high	90.6	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	131.2	170.7	-61.8	-102.2	0	0	0	107.9	I69 N70 L620 Q621 G623 T644 I645	I69-N625 HydrophobicContact CG2-CB 4.43Å; N70-N625 PolarHBondContact ND2-OD1 3.4Å; N70-N625 VanDerWaalsContact OD1-CA 3.24Å; N70-N625 WeakPolarHBondContact OD1-CA 3.3Å; N70-N625 WeakPolarHBondContact OD1-CB 3.1Å; L620-N625 HydrophobicContact CD2-CB 3.99Å; Q621-N625 PolarHBondContact N-OD1 3.16Å; Q621-N625 PolarHBondContact O-ND2 3.03Å; G623-N625 PolarHBondContact O-ND2 2.96Å; N625-T644 CarbonylContact O-C 3.54Å; N625-T644 WeakPolarHBondContact O-CA 3.43Å; N625-T644 WeakPolarHBondContact O-CG2 3.42Å; N625-I645 HydrophobicContact CB-CB 4.4Å; N625-I645 WeakPolarHBondContact CB-O 3.4Å; N625-I645 PolarHBondContact N-O 2.88Å; N625-I645 PolarHBondContact ND2-O 2.9Å; N625-I645 PolarHBondContact O-N 2.98Å
626	D	96.9	Very high	89.2	Confident	107 Å²	107	59.3 Å²	59.3	57%	0.572	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	137	178.4	-73.4	-32.3	0	0	0	110.4	I69 N70	I69-D626 CarbonylContact C-O 3.58Å; I69-D626 WeakPolarHBondContact CA-O 3.39Å; N70-D626 PolarHBondContact N-O 3.03Å; N70-D626 PolarHBondContact OD1-N 2.88Å
627	V	96.8	Very high	88.3	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.018	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	135.8	174.5	62.3	0	0	0	0	111.3	I67 E68 I69 F629 Q642 G643 I645	I67-V627 HydrophobicContact CG2-CG2 3.81Å; E68-V627 WeakPolarHBondContact O-CA 3.39Å; I69-V627 HydrophobicContact CG1-CB 4.47Å; I69-V627 HydrophobicContact CG1-CG2 4.08Å; V627-F629 HydrophobicContact CB-CE2 4.34Å; V627-F629 HydrophobicContact CB-CZ 4.44Å; V627-F629 HydrophobicContact CG1-CE2 3.71Å; V627-F629 HydrophobicContact CG1-CZ 4.05Å; V627-F629 HydrophobicContact CG2-CD2 4.31Å; V627-F629 HydrophobicContact CG2-CE1 3.99Å; V627-F629 HydrophobicContact CG2-CE2 3.68Å; V627-F629 HydrophobicContact CG2-CZ 3.49Å; V627-F629 VanDerWaalsContact CG2-CZ 3.49Å; V627-Q642 WeakPolarHBondContact O-CA 3.5Å; V627-G643 WeakPolarHBondContact CG1-O 3.32Å; V627-G643 PolarHBondContact N-O 3.02Å; V627-G643 PolarHBondContact O-N 2.8Å; V627-I645 HydrophobicContact CB-CD1 3.93Å; V627-I645 HydrophobicContact CB-CG1 3.94Å; V627-I645 HydrophobicContact CG1-CD1 4.13Å; V627-I645 HydrophobicContact CG1-CG1 3.67Å; V627-I645 HydrophobicContact CG2-CD1 4.15Å
628	V	95.9	Very high	87.8	Confident	17 Å²	17	56.1 Å²	56.1	10%	0.103	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	123.2	175.6	-168.6	0	0	0	0	109.1	E68 R640 Q642	E68-V628 HydrophobicContact CB-CB 4.2Å; E68-V628 PolarHBondContact N-O 3.37Å; E68-V628 PolarHBondContact O-N 2.94Å; V628-R640 HydrophobicContact CG1-CB 4.11Å; V628-R640 HydrophobicContact CG1-CG 4.12Å; V628-Q642 HydrophobicContact CG1-CG 4.19Å; V628-Q642 HydrophobicContact CG2-CG 4.16Å
629	F	94.3	Very high	87.4	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.009	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126.1	172.7	-55.7	-84.9	0	0	0	108.8	C30 F48 V50 F52 V65 D66 I67 M78 V627 R640 C641	C30-F629 HydrophobicContact CB-CD2 4.17Å; C30-F629 HydrophobicContact CB-CE2 4.12Å; F48-F629 HydrophobicContact CD1-CE1 4.22Å; F48-F629 AromaticContact CD1-CZ 3.93Å; F48-F629 HydrophobicContact CD1-CZ 3.93Å; F48-F629 HydrophobicContact CE1-CZ 4.35Å; V50-F629 HydrophobicContact CG1-CB 3.83Å; V50-F629 HydrophobicContact CG1-CD1 4.18Å; V50-F629 HydrophobicContact CG1-CD2 3.99Å; V50-F629 HydrophobicContact CG1-CG 3.73Å; V50-F629 HydrophobicContact CG2-CD1 3.94Å; V50-F629 HydrophobicContact CG2-CD2 3.76Å; V50-F629 HydrophobicContact CG2-CE1 3.79Å; V50-F629 HydrophobicContact CG2-CE2 3.59Å; V50-F629 HydrophobicContact CG2-CG 3.94Å; V50-F629 HydrophobicContact CG2-CZ 3.61Å; F52-F629 HydrophobicContact CZ-CB 3.87Å; V65-F629 HydrophobicContact CG1-CB 3.99Å; D66-F629 WeakPolarHBondContact O-CA 3.31Å; I67-F629 HydrophobicContact CD1-CD1 4.43Å; I67-F629 HydrophobicContact CD1-CE1 4.18Å; I67-F629 HydrophobicContact CG1-CD1 4.04Å; I67-F629 HydrophobicContact CG1-CE1 4.22Å; I67-F629 HydrophobicContact CG2-CD1 4.36Å; I67-F629 HydrophobicContact CG2-CE1 4.12Å; M78-F629 HydrophobicContact SD-CD1 3.72Å; M78-F629 HydrophobicContact SD-CE1 3.85Å; V627-F629 HydrophobicContact CB-CE2 4.34Å; V627-F629 HydrophobicContact CB-CZ 4.44Å; V627-F629 HydrophobicContact CG1-CE2 3.71Å; V627-F629 HydrophobicContact CG1-CZ 4.05Å; V627-F629 HydrophobicContact CG2-CD2 4.31Å; V627-F629 HydrophobicContact CG2-CE1 3.99Å; V627-F629 HydrophobicContact CG2-CE2 3.68Å; V627-F629 HydrophobicContact CG2-CZ 3.49Å; V627-F629 VanDerWaalsContact CG2-CZ 3.49Å; F629-R640 WeakPolarHBondContact O-CA 3.38Å; F629-C641 PolarHBondContact N-O 2.84Å; F629-C641 PolarHBondContact O-N 3.44Å
630	S	91.6	Very high	87.2	Confident	5 Å²	5	55.3 Å²	55.3	4%	0.035	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	141	-173.7	133.6	0	0	0	0	112	V65 D66 T638 C639	V65-S630 CarbonylContact C-O 3.56Å; V65-S630 WeakPolarHBondContact CA-O 3.3Å; V65-S630 WeakPolarHBondContact CG1-O 3.37Å; D66-S630 PolarHBondContact N-O 2.87Å; D66-S630 PolarHBondContact O-N 2.98Å; D66-S630 PolarHBondContact OD2-OG 2.96Å; S630-T638 WeakPolarHBondContact OG-CG2 3.48Å; S630-C639 WeakPolarHBondContact CA-O 3.42Å
631	V	88.3	Confident	86.8	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	114.3	174	176.4	0	0	0	0	109	F52 V57 V65 L80 T633 T638 C639	F52-V631 HydrophobicContact CD1-CB 4.35Å; F52-V631 HydrophobicContact CD1-CG2 4.02Å; F52-V631 HydrophobicContact CD2-CG2 3.83Å; F52-V631 HydrophobicContact CE1-CB 4.22Å; F52-V631 HydrophobicContact CE1-CG2 3.74Å; F52-V631 HydrophobicContact CE2-CG2 3.55Å; F52-V631 HydrophobicContact CG-CG2 4.07Å; F52-V631 HydrophobicContact CZ-CB 4.43Å; F52-V631 HydrophobicContact CZ-CG2 3.51Å; V57-V631 HydrophobicContact CG1-CG1 4.45Å; V65-V631 HydrophobicContact CB-CG2 4.19Å; V65-V631 HydrophobicContact CG1-CG2 3.97Å; V65-V631 HydrophobicContact CG2-CG2 3.82Å; L80-V631 HydrophobicContact CD2-CB 4.35Å; L80-V631 HydrophobicContact CD2-CG1 3.62Å; L80-V631 HydrophobicContact CD2-CG2 3.8Å; V631-T633 HydrophobicContact CG1-CG2 4Å; V631-T638 CarbonylContact O-C 3.58Å; V631-T638 WeakPolarHBondContact O-CA 3.38Å; V631-C639 PolarHBondContact N-O 3.47Å; V631-C639 PolarHBondContact O-N 3.04Å
632	T	83.8	Confident	86.6	Confident	64 Å²	64	53.7 Å²	53.7	39%	0.393	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	131.6	175.1	-61.2	0	0	0	0	111.1	T638	T632-T638 WeakPolarHBondContact OG1-CG2 3.29Å; T632-T638 PolarHBondContact OG1-OG1 2.93Å
633	T	75.4	Confident	86.6	Confident	10 Å²	10	49 Å²	49	6%	0.061	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	142.9	-177.9	73.1	0	0	0	0	111.9	V631 Y635 Q636 G637	V631-T633 HydrophobicContact CG1-CG2 4Å; T633-Y635 PolarHBondContact O-N 3.35Å; T633-Y635 VanDerWaalsContact O-N 3.12Å; T633-Q636 PolarHBondContact OG1-N 2.89Å; T633-G637 PolarHBondContact N-O 2.85Å; T633-G637 WeakPolarHBondContact O-CA 3.31Å; T633-G637 PolarHBondContact O-N 2.94Å; T633-G637 PolarHBondContact OG1-O 3.28Å
634	Q	67	Low	86.7	Confident	88 Å²	88	49.2 Å²	49.2	41%	0.411	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-11.7	-174.9	-59.2	-172.9	-6	0	0	114.6	R61	R61-Q634 VanDerWaalsContact CZ-OE1 3.31Å
635	Y	65.4	Low	86.8	Confident	152 Å²	152	45.7 Å²	45.7	60%	0.596	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117	-20	-174.9	-64.8	-64.2	0	0	0	114.3	R59 T633	R59-Y635 HydrophobicContact CB-CD2 4.49Å; R59-Y635 HydrophobicContact CB-CE2 4.14Å; T633-Y635 PolarHBondContact O-N 3.35Å; T633-Y635 VanDerWaalsContact O-N 3.12Å
636	Q	66.1	Low	86.8	Confident	104 Å²	104	46.3 Å²	46.3	49%	0.486	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.8	2	-173.7	-68.5	163.3	-64.3	0	0	113.2	M55 G56 T633	M55-Q636 VanDerWaalsContact O-CD 3.3Å; M55-Q636 PolarHBondContact O-NE2 3.07Å; M55-Q636 PolarHBondContact O-OE1 3.25Å; G56-Q636 VanDerWaalsContact C-OE1 3.3Å; G56-Q636 PolarHBondContact O-OE1 2.92Å; T633-Q636 PolarHBondContact OG1-N 2.89Å
637	G	76.6	Confident	86.9	Confident	34 Å²	34	41.5 Å²	41.5	35%	0.351	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	73.4	-153.7	-175.2	0	0	0	0	0	111.9	T633	T633-G637 PolarHBondContact N-O 2.85Å; T633-G637 WeakPolarHBondContact O-CA 3.31Å; T633-G637 PolarHBondContact O-N 2.94Å; T633-G637 PolarHBondContact OG1-O 3.28Å
638	T	83.2	Confident	86.9	Confident	69 Å²	69	41.7 Å²	41.7	42%	0.423	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	113.9	-177	-48.7	0	0	0	0	111.3	S630 V631 T632 R640	S630-T638 WeakPolarHBondContact OG-CG2 3.48Å; V631-T638 CarbonylContact O-C 3.58Å; V631-T638 WeakPolarHBondContact O-CA 3.38Å; T632-T638 WeakPolarHBondContact OG1-CG2 3.29Å; T632-T638 PolarHBondContact OG1-OG1 2.93Å; T638-R640 HydrophobicContact CG2-CG 4.27Å
639	C	84.3	Confident	86.9	Confident	34 Å²	34	43.2 Å²	43.2	23%	0.23	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	136.6	165.5	-166.9	0	0	0	0	108.9	S28 F52 S630 V631	S28-C639 PolarHBondContact OG-SG 2.94Å; F52-C639 HydrophobicContact CD1-CB 4.17Å; S630-C639 WeakPolarHBondContact CA-O 3.42Å; V631-C639 PolarHBondContact N-O 3.47Å; V631-C639 PolarHBondContact O-N 3.04Å
640	R	88.8	Confident	86.9	Confident	129 Å²	129	47.3 Å²	47.3	49%	0.487	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	145.7	175.3	-74.3	179.2	176.6	-130.1	-8.3	109.5	E68 V628 F629 T638	E68-R640 VanDerWaalsContact CD-NH1 3.28Å; E68-R640 IonicContact OE1-CZ 3.14Å; E68-R640 VanDerWaalsContact OE1-CZ 3.23Å; E68-R640 IonicContact OE1-NH1 2.68Å; E68-R640 PolarHBondContact OE1-NH1 3.28Å; E68-R640 IonicContact OE1-NH2 2.91Å; E68-R640 PolarHBondContact OE1-NH2 3.22Å; E68-R640 IonicContact OE2-CZ 2.68Å; E68-R640 IonicContact OE2-NH1 2.88Å; E68-R640 PolarHBondContact OE2-NH1 2.89Å; E68-R640 IonicContact OE2-NH2 2.58Å; V628-R640 HydrophobicContact CG1-CB 4.11Å; V628-R640 HydrophobicContact CG1-CG 4.12Å; F629-R640 WeakPolarHBondContact O-CA 3.38Å; T638-R640 HydrophobicContact CG2-CG 4.27Å
641	C	89	Confident	87	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.014	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	149.5	161.9	63.5	0	0	0	0	109.5	F629	F629-C641 PolarHBondContact N-O 2.84Å; F629-C641 PolarHBondContact O-N 3.44Å
642	Q	92.2	Very high	87.4	Confident	115 Å²	115	50.7 Å²	50.7	54%	0.537	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	153.5	-170.1	-60.4	-176	-52.4	0	0	110.3	C30 V627 V628 R714	C30-Q642 PolarHBondContact SG-O 3.41Å; V627-Q642 WeakPolarHBondContact O-CA 3.5Å; V628-Q642 HydrophobicContact CG1-CG 4.19Å; V628-Q642 HydrophobicContact CG2-CG 4.16Å; Q642-R714 PolarHBondContact O-NH2 2.86Å
643	G	94.6	Very high	87.9	Confident	4 Å²	4	50.3 Å²	50.3	4%	0.041	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.8	-172	173.7	0	0	0	0	0	110.3	V627	V627-G643 WeakPolarHBondContact CG1-O 3.32Å; V627-G643 PolarHBondContact N-O 3.02Å; V627-G643 PolarHBondContact O-N 2.8Å
644	T	97.1	Very high	89	Confident	17 Å²	17	49.9 Å²	49.9	10%	0.104	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	136.4	-177.6	-52.5	0	0	0	0	111.3	D32 V33 P624 N625 Y646	D32-T644 WeakPolarHBondContact CA-O 3.41Å; D32-T644 WeakPolarHBondContact CB-O 3.31Å; D32-T644 PolarHBondContact OD1-N 3.1Å; V33-T644 PolarHBondContact N-O 3.47Å; P624-T644 HydrophobicContact CB-CG2 3.56Å; N625-T644 CarbonylContact O-C 3.54Å; N625-T644 WeakPolarHBondContact O-CA 3.43Å; N625-T644 WeakPolarHBondContact O-CG2 3.42Å; T644-Y646 HydrophobicContact CG2-CD2 3.87Å; T644-Y646 HydrophobicContact CG2-CE1 4.29Å; T644-Y646 HydrophobicContact CG2-CE2 3.43Å; T644-Y646 VanDerWaalsContact CG2-CE2 3.43Å; T644-Y646 HydrophobicContact CG2-CG 4.47Å
645	I	98	Very high	90.4	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	117.3	171	-51.8	-179.9	0	0	0	108.1	V33 V35 F48 I69 L620 N625 V627	V33-I645 HydrophobicContact CB-CG1 4.28Å; V33-I645 HydrophobicContact CB-CG2 4.28Å; V33-I645 HydrophobicContact CG1-CG2 4.34Å; V33-I645 CarbonylContact O-C 3.58Å; V33-I645 WeakPolarHBondContact O-CA 3.34Å; V35-I645 HydrophobicContact CG2-CG2 3.59Å; F48-I645 HydrophobicContact CE1-CD1 4.08Å; F48-I645 HydrophobicContact CZ-CD1 4.33Å; I69-I645 HydrophobicContact CD1-CD1 3.99Å; I69-I645 HydrophobicContact CG1-CD1 4.49Å; L620-I645 HydrophobicContact CD1-CG2 3.82Å; L620-I645 HydrophobicContact CD2-CB 4.27Å; L620-I645 HydrophobicContact CD2-CD1 4.29Å; L620-I645 HydrophobicContact CD2-CG2 4.02Å; N625-I645 HydrophobicContact CB-CB 4.4Å; N625-I645 WeakPolarHBondContact CB-O 3.4Å; N625-I645 PolarHBondContact N-O 2.88Å; N625-I645 PolarHBondContact ND2-O 2.9Å; N625-I645 PolarHBondContact O-N 2.98Å; V627-I645 HydrophobicContact CB-CD1 3.93Å; V627-I645 HydrophobicContact CB-CG1 3.94Å; V627-I645 HydrophobicContact CG1-CD1 4.13Å; V627-I645 HydrophobicContact CG1-CG1 3.67Å; V627-I645 HydrophobicContact CG2-CD1 4.15Å
646	Y	98	Very high	92	Very high	14 Å²	14	38.4 Å²	38.4	6%	0.055	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	115.1	-179.8	-70.9	-95.8	0	0	0	110.5	D32 V33 V35 G623 P624 T644 W648 G730 P731	D32-Y646 HydrophobicContact CB-CE2 4.27Å; V33-Y646 PolarHBondContact O-N 3.37Å; V35-Y646 PolarHBondContact N-O 3.19Å; V35-Y646 VanDerWaalsContact O-O 3.13Å; G623-Y646 CarbonylContact O-C 3.53Å; G623-Y646 WeakPolarHBondContact O-CA 3.15Å; P624-Y646 HydrophobicContact CB-CD1 4.08Å; P624-Y646 HydrophobicContact CB-CE1 3.79Å; T644-Y646 HydrophobicContact CG2-CD2 3.87Å; T644-Y646 HydrophobicContact CG2-CE1 4.29Å; T644-Y646 HydrophobicContact CG2-CE2 3.43Å; T644-Y646 VanDerWaalsContact CG2-CE2 3.43Å; T644-Y646 HydrophobicContact CG2-CG 4.47Å; Y646-W648 HydrophobicContact CD1-CZ2 4.33Å; Y646-W648 AromaticContact CD1-NE1 3.92Å; Y646-G730 VanDerWaalsContact OH-C 3.25Å; Y646-G730 PolarHBondContact OH-N 3.47Å; Y646-G730 PolarHBondContact OH-O 3.08Å; Y646-P731 HydrophobicContact CD2-CB 3.6Å; Y646-P731 HydrophobicContact CD2-CG 3.99Å; Y646-P731 VanDerWaalsContact CE2-CA 3.43Å; Y646-P731 HydrophobicContact CE2-CB 3.76Å; Y646-P731 HydrophobicContact CE2-CG 4.33Å; Y646-P731 HydrophobicContact CG-CB 4.34Å; Y646-P731 HydrophobicContact CG-CG 4.24Å
647	L	97.7	Very high	93.5	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.031	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	112.1	170.8	-176.8	61	0	0	0	109.9	V35 L43 L620 Q621 D622 G623	V35-L647 HydrophobicContact CB-CD1 4.04Å; V35-L647 HydrophobicContact CG1-CD1 3.77Å; V35-L647 WeakPolarHBondContact O-CA 3.28Å; L43-L647 HydrophobicContact CD2-CD1 4.06Å; L620-L647 HydrophobicContact CB-CB 4.43Å; L620-L647 HydrophobicContact CB-CD2 3.97Å; L620-L647 WeakPolarHBondContact O-CD2 3.44Å; Q621-L647 WeakPolarHBondContact O-CB 3.42Å; D622-L647 WeakPolarHBondContact OD1-CD2 3.43Å; G623-L647 PolarHBondContact N-O 2.81Å; G623-L647 PolarHBondContact O-N 3.42Å
648	W	97.1	Very high	94.3	Very high	8 Å²	8	32.1 Å²	32.1	3%	0.03	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	166	177.7	-66.5	-12.3	0	0	0	111	I34 V35 V36 R37 Y646 I654 K698 F699 P731 F767	I34-W648 HydrophobicContact CD1-CZ3 4.28Å; I34-W648 HydrophobicContact CG2-CD2 4.5Å; I34-W648 HydrophobicContact CG2-CE3 4.03Å; I34-W648 HydrophobicContact CG2-CZ3 4.37Å; V35-W648 PolarHBondContact O-N 2.99Å; V36-W648 WeakPolarHBondContact CA-O 3.46Å; R37-W648 PolarHBondContact N-O 3.07Å; Y646-W648 HydrophobicContact CD1-CZ2 4.33Å; Y646-W648 AromaticContact CD1-NE1 3.92Å; W648-I654 HydrophobicContact CE3-CD1 4.39Å; W648-I654 HydrophobicContact CE3-CG1 4.48Å; W648-I654 HydrophobicContact CZ3-CD1 4.05Å; W648-I654 HydrophobicContact CZ3-CG1 4.11Å; W648-I654 HydrophobicContact CZ3-CG2 4.38Å; W648-K698 HydrophobicContact CD2-CB 4.28Å; W648-K698 HydrophobicContact CD2-CG 4.07Å; W648-K698 HydrophobicContact CE3-CB 4.29Å; W648-K698 HydrophobicContact CE3-CG 4.38Å; W648-K698 HydrophobicContact CG-CG 4.47Å; W648-K698 HydrophobicContact CH2-CB 3.83Å; W648-K698 HydrophobicContact CZ2-CB 3.77Å; W648-K698 HydrophobicContact CZ2-CG 4.33Å; W648-K698 HydrophobicContact CZ3-CB 4.1Å; W648-F699 WeakPolarHBondContact CH2-O 3.47Å; W648-P731 HydrophobicContact CH2-CG 3.61Å; W648-P731 HydrophobicContact CZ2-CG 3.87Å; W648-P731 HydrophobicContact CZ3-CG 4.45Å; W648-F767 HydrophobicContact CE3-CE1 4.39Å; W648-F767 AromaticContact CE3-CZ 3.97Å; W648-F767 HydrophobicContact CE3-CZ 3.97Å
649	N	95.7	Very high	94.7	Very high	48 Å²	48	28.9 Å²	28.9	26%	0.257	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	153.8	174.8	-60.1	-67.8	0	0	0	110.8	R37 D651 D652	R37-N649 PolarHBondContact NH1-OD1 2.9Å; N649-D651 WeakPolarHBondContact CB-OD1 3.27Å; N649-D651 PolarHBondContact O-N 3.01Å; N649-D651 VanDerWaalsContact O-N 3.11Å; N649-D652 PolarHBondContact N-OD2 3.11Å; N649-D652 WeakPolarHBondContact O-CB 3.32Å; N649-D652 PolarHBondContact O-N 3.1Å
650	W	95.6	Very high	94.8	Very high	88 Å²	88	27.9 Å²	27.9	33%	0.333	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.7	179.8	69.2	-82.5	0	0	0	114.3	V36 R37 P39 P769 N770	V36-W650 HydrophobicContact CG1-CB 4.11Å; R37-W650 PolarHBondContact O-N 2.99Å; P39-W650 HydrophobicContact CG-CD2 3.86Å; P39-W650 HydrophobicContact CG-CE3 4.5Å; P39-W650 HydrophobicContact CG-CG 4Å; P39-W650 HydrophobicContact CG-CZ2 4.29Å; W650-P769 HydrophobicContact CE3-CG 3.97Å; W650-P769 HydrophobicContact CZ3-CG 4.01Å; W650-N770 HydrophobicContact CE3-CB 3.74Å; W650-N770 HydrophobicContact CZ3-CB 4.09Å; W650-N770 VanDerWaalsContact O-CB 3.27Å; W650-N770 WeakPolarHBondContact O-CB 3.45Å; W650-N770 PolarHBondContact O-ND2 3.28Å
651	D	94.1	Very high	94.8	Very high	66 Å²	66	21.9 Å²	21.9	35%	0.353	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-5.9	178.1	81.8	-73	0	0	0	114.2	N649 K833	N649-D651 WeakPolarHBondContact CB-OD1 3.27Å; N649-D651 PolarHBondContact O-N 3.01Å; N649-D651 VanDerWaalsContact O-N 3.11Å; D651-K833 PolarHBondContact O-NZ 3.05Å; D651-K833 IonicContact OD2-NZ 3.88Å; D651-K833 PolarHBondContact OD2-NZ 2.86Å
652	D	94.9	Very high	94.9	Very high	12 Å²	12	21.8 Å²	21.8	6%	0.064	10%	0.104	C	C	.	.			trans	-58.5	144.1	176.9	-88.1	-47.6	0	0	0	111.1	N649 K698	N649-D652 PolarHBondContact N-OD2 3.11Å; N649-D652 WeakPolarHBondContact O-CB 3.32Å; N649-D652 PolarHBondContact O-N 3.1Å; D652-K698 HydrophobicContact CB-CG 3.98Å; D652-K698 WeakPolarHBondContact OD1-CE 3.42Å; D652-K698 IonicContact OD1-NZ 2.75Å; D652-K698 WeakPolarHBondContact OD2-CE 3.5Å; D652-K698 IonicContact OD2-NZ 3.93Å
653	K	95.4	Very high	94.9	Very high	56 Å²	56	16.3 Å²	16.3	24%	0.243	8%	0.079	C	C	.	.			trans	-113.9	126.7	-179.3	-64.3	-56.1	-175.5	-177.5	0	109.9	Y697 K698 N770 E772 P773 K833	K653-Y697 HydrophobicContact CB-CD1 3.81Å; K653-Y697 HydrophobicContact CB-CE1 4Å; K653-Y697 WeakPolarHBondContact O-CA 3.33Å; K653-K698 PolarHBondContact O-N 3.03Å; K653-N770 PolarHBondContact NZ-ND2 2.77Å; K653-N770 PolarHBondContact NZ-OD1 3.01Å; K653-E772 PolarHBondContact NZ-O 2.97Å; K653-P773 WeakPolarHBondContact CA-O 3.32Å; K653-K833 HydrophobicContact CB-CD 4.3Å; K653-K833 HydrophobicContact CG-CD 4.26Å
654	I	97.4	Very high	94.5	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	138	-162.3	-50.5	173.3	0	0	0	109.8	W648 K698 L700 F767 P773 F774 Y775	W648-I654 HydrophobicContact CE3-CD1 4.39Å; W648-I654 HydrophobicContact CE3-CG1 4.48Å; W648-I654 HydrophobicContact CZ3-CD1 4.05Å; W648-I654 HydrophobicContact CZ3-CG1 4.11Å; W648-I654 HydrophobicContact CZ3-CG2 4.38Å; I654-K698 CarbonylContact C-O 3.54Å; I654-K698 WeakPolarHBondContact CA-O 3.47Å; I654-L700 HydrophobicContact CG2-CB 3.51Å; I654-L700 HydrophobicContact CG2-CD2 4.18Å; I654-L700 HydrophobicContact CG2-CG 4.49Å; I654-F767 HydrophobicContact CD1-CD2 4.22Å; I654-F767 HydrophobicContact CD1-CE1 4Å; I654-F767 HydrophobicContact CD1-CE2 3.63Å; I654-F767 HydrophobicContact CD1-CZ 3.52Å; I654-P773 HydrophobicContact CD1-CB 4Å; I654-P773 HydrophobicContact CG1-CB 4.49Å; I654-P773 PolarHBondContact N-O 2.93Å; I654-F774 HydrophobicContact CB-CD1 3.9Å; I654-F774 HydrophobicContact CB-CE1 4.43Å; I654-F774 HydrophobicContact CD1-CD1 4.2Å; I654-F774 HydrophobicContact CD1-CE1 4.06Å; I654-F774 HydrophobicContact CG2-CD1 4Å; I654-F774 HydrophobicContact CG2-CE1 4.22Å; I654-Y775 PolarHBondContact O-N 2.85Å
655	I	98.2	Very high	93.8	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	118.1	171.3	-47.6	-63	0	0	0	107.4	V692 Y697 K698 F699 L700 Y775 A776 F778 F830	I655-V692 HydrophobicContact CD1-CG1 4.08Å; I655-V692 HydrophobicContact CG1-CG1 3.8Å; I655-Y697 HydrophobicContact CD1-CD1 3.93Å; I655-Y697 HydrophobicContact CD1-CG 4.15Å; I655-Y697 HydrophobicContact CG1-CG 4.4Å; I655-K698 PolarHBondContact N-O 3.11Å; I655-F699 HydrophobicContact CB-CD1 4.03Å; I655-F699 HydrophobicContact CB-CE1 3.83Å; I655-F699 HydrophobicContact CB-CE2 4.39Å; I655-F699 HydrophobicContact CB-CG 4.39Å; I655-F699 HydrophobicContact CB-CZ 4.02Å; I655-F699 HydrophobicContact CG1-CE1 4.47Å; I655-F699 HydrophobicContact CG1-CE2 4.26Å; I655-F699 HydrophobicContact CG1-CZ 4.15Å; I655-F699 HydrophobicContact CG2-CD1 4.15Å; I655-F699 HydrophobicContact CG2-CE1 3.58Å; I655-F699 HydrophobicContact CG2-CZ 3.94Å; I655-L700 PolarHBondContact O-N 3.38Å; I655-Y775 HydrophobicContact CD1-CD1 3.91Å; I655-Y775 HydrophobicContact CD1-CG 4.47Å; I655-A776 WeakPolarHBondContact CA-O 3.26Å; I655-A776 HydrophobicContact CD1-CB 3.97Å; I655-F778 HydrophobicContact CG2-CD2 3.83Å; I655-F778 HydrophobicContact CG2-CE2 3.71Å; I655-F830 HydrophobicContact CD1-CD1 3.99Å; I655-F830 HydrophobicContact CD1-CE1 3.9Å
656	I	98	Very high	92.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	138.5	175.4	-46.7	169.3	0	0	0	108.7	L700 L760 F774 A776 A777 F778 Y788 V791 V793	I656-L700 CarbonylContact C-O 3.57Å; I656-L700 WeakPolarHBondContact CA-O 3.45Å; I656-L760 HydrophobicContact CD1-CD1 4.12Å; I656-L760 HydrophobicContact CD1-CD2 3.98Å; I656-L760 HydrophobicContact CG1-CD2 4.42Å; I656-L760 HydrophobicContact CG2-CD2 4.25Å; I656-F774 HydrophobicContact CD1-CB 4.23Å; I656-F774 HydrophobicContact CD1-CD1 3.69Å; I656-F774 HydrophobicContact CD1-CD2 4.21Å; I656-F774 HydrophobicContact CD1-CE1 4.05Å; I656-F774 HydrophobicContact CD1-CE2 4.49Å; I656-F774 HydrophobicContact CD1-CG 3.8Å; I656-F774 HydrophobicContact CD1-CZ 4.44Å; I656-F774 HydrophobicContact CG1-CD1 3.69Å; I656-F774 HydrophobicContact CG1-CE1 4.1Å; I656-F774 HydrophobicContact CG1-CG 4.24Å; I656-A776 PolarHBondContact N-O 3.07Å; I656-A777 HydrophobicContact CB-CB 3.97Å; I656-A777 HydrophobicContact CD1-CB 4.38Å; I656-A777 CarbonylContact O-C 3.5Å; I656-A777 VanDerWaalsContact O-CA 3.31Å; I656-A777 WeakPolarHBondContact O-CA 3.48Å; I656-F778 PolarHBondContact O-N 3Å; I656-Y788 HydrophobicContact CB-CD1 4.49Å; I656-Y788 HydrophobicContact CB-CE1 4.17Å; I656-Y788 HydrophobicContact CD1-CD1 3.86Å; I656-Y788 HydrophobicContact CD1-CE1 4.26Å; I656-Y788 HydrophobicContact CG2-CD1 4.25Å; I656-Y788 HydrophobicContact CG2-CE1 3.56Å; I656-V791 HydrophobicContact CD1-CG2 4.49Å; I656-V793 HydrophobicContact CD1-CG2 4.09Å
657	S	97.2	Very high	90.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	129.6	168.3	-173	0	0	0	0	109.5	Y689 L700 Y701 C702 F778	S657-Y689 WeakPolarHBondContact OG-CE2 3.47Å; S657-Y689 PolarHBondContact OG-OH 3Å; S657-L700 PolarHBondContact N-O 2.96Å; S657-Y701 CarbonylContact O-C 3.59Å; S657-Y701 WeakPolarHBondContact O-CA 3.46Å; S657-C702 PolarHBondContact O-N 3.33Å; S657-F778 WeakPolarHBondContact CA-O 3.39Å
658	D	94	Very high	88.6	Confident	6 Å²	6	27.5 Å²	27.5	3%	0.032	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	159.7	154.7	-150	-52	0	0	0	109.6	D660 T662 I663 C702 K756 F778	D658-D660 PolarHBondContact OD1-N 2.92Å; D658-T662 WeakPolarHBondContact O-CB 3.46Å; D658-I663 WeakPolarHBondContact O-CG1 3.27Å; D658-C702 CarbonylContact C-O 3.6Å; D658-C702 WeakPolarHBondContact CA-O 3.31Å; D658-C702 VanDerWaalsContact OD1-O 3.13Å; D658-K756 WeakPolarHBondContact OD2-CE 3.4Å; D658-K756 IonicContact OD2-NZ 2.69Å; D658-K756 PolarHBondContact OD2-NZ 3.09Å; D658-F778 PolarHBondContact N-O 3.11Å
659	I	90.9	Very high	86.4	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	-100	-47.3	173.4	-58	171.5	0	0	0	109.6	G661 I663 T664 C702 T713 L717 V732	I659-G661 PolarHBondContact O-N 3.23Å; I659-I663 HydrophobicContact CG1-CD1 4.24Å; I659-I663 PolarHBondContact O-N 3.36Å; I659-T664 PolarHBondContact O-N 2.69Å; I659-C702 PolarHBondContact N-O 3.04Å; I659-T713 HydrophobicContact CD1-CG2 3.55Å; I659-L717 HydrophobicContact CD1-CD1 3.98Å; I659-L717 HydrophobicContact CG1-CD2 4.46Å; I659-L717 HydrophobicContact CG2-CD2 4.43Å; I659-V732 HydrophobicContact CD1-CG1 3.93Å
660	D	87.9	Confident	84.2	Confident	13 Å²	13	27 Å²	27	7%	0.07	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	121	-172.4	-72.4	-66.1	0	0	0	109.8	D658 T662 G670 S703 R705 N780	D658-D660 PolarHBondContact OD1-N 2.92Å; D660-T662 PolarHBondContact O-N 3.06Å; D660-G670 WeakPolarHBondContact OD1-CA 3.39Å; D660-S703 PolarHBondContact OD2-OG 3.44Å; D660-R705 IonicContact OD1-CZ 2.67Å; D660-R705 IonicContact OD1-NE 3.77Å; D660-R705 PolarHBondContact OD1-NE 3.2Å; D660-R705 VanDerWaalsContact OD1-NE 3.16Å; D660-R705 IonicContact OD1-NH2 2.66Å; D660-R705 PolarHBondContact OD1-NH2 3.02Å; D660-R705 IonicContact OD2-CZ 3.18Å; D660-R705 IonicContact OD2-NE 3.04Å; D660-R705 PolarHBondContact OD2-NE 2.83Å; D660-R705 IonicContact OD2-NH2 2.86Å; D660-N780 PolarHBondContact O-OD1 3.32Å; D660-N780 VanDerWaalsContact O-OD1 3.05Å
661	G	87.4	Confident	82.1	Confident	3 Å²	3	27.7 Å²	27.7	3%	0.031	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	-5.4	-177	0	0	0	0	0	115.9	I659 T664 D667 N780 V801	I659-G661 PolarHBondContact O-N 3.23Å; G661-T664 CarbonylContact C-O 3.58Å; G661-T664 WeakPolarHBondContact CA-O 3.2Å; G661-T664 PolarHBondContact N-O 3.43Å; G661-T664 PolarHBondContact N-OG1 3.01Å; G661-D667 VanDerWaalsContact CA-OD1 3.28Å; G661-D667 WeakPolarHBondContact CA-OD1 3.27Å; G661-D667 PolarHBondContact N-OD1 2.86Å; G661-N780 WeakPolarHBondContact CA-ND2 3.15Å; G661-N780 VanDerWaalsContact O-CB 3.32Å; G661-N780 WeakPolarHBondContact O-CB 3.41Å; G661-V801 WeakPolarHBondContact O-CG1 3.29Å
662	T	91.8	Very high	80.2	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-48.4	177.3	-62.5	0	0	0	0	112.2	D658 D660 T664 H682 F778 G779 N780 V801 Y819	D658-T662 WeakPolarHBondContact O-CB 3.46Å; D660-T662 PolarHBondContact O-N 3.06Å; T662-T664 PolarHBondContact N-O 3.36Å; T662-H682 PolarHBondContact O-CD2 3Å; T662-F778 HydrophobicContact CG2-CB 3.91Å; T662-G779 VanDerWaalsContact OG1-CA 3.23Å; T662-G779 WeakPolarHBondContact OG1-CA 3.42Å; T662-N780 WeakPolarHBondContact OG1-CB 3.22Å; T662-N780 PolarHBondContact OG1-N 2.84Å; T662-N780 PolarHBondContact OG1-OD1 3.47Å; T662-V801 HydrophobicContact CG2-CG1 4.39Å; T662-Y819 PolarHBondContact O-OH 3.2Å
663	I	91.4	Very high	78.2	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-48	168.7	-61.5	174.8	0	0	0	109.2	D658 I659 T681 H682 I685 Y689 Y701 Y716 L717 L727	D658-I663 WeakPolarHBondContact O-CG1 3.27Å; I659-I663 HydrophobicContact CG1-CD1 4.24Å; I659-I663 PolarHBondContact O-N 3.36Å; I663-T681 HydrophobicContact CG2-CG2 4.29Å; I663-T681 VanDerWaalsContact O-CA 3.29Å; I663-T681 WeakPolarHBondContact O-CA 3.14Å; I663-H682 PolarHBondContact O-N 3Å; I663-H682 VanDerWaalsContact O-N 3.12Å; I663-I685 HydrophobicContact CB-CD1 4.18Å; I663-I685 HydrophobicContact CG1-CD1 3.79Å; I663-I685 HydrophobicContact CG2-CD1 4.43Å; I663-Y689 HydrophobicContact CD1-CE2 4.46Å; I663-Y689 HydrophobicContact CG1-CE2 4.47Å; I663-Y701 HydrophobicContact CD1-CD1 3.79Å; I663-Y701 HydrophobicContact CD1-CE1 3.8Å; I663-Y716 HydrophobicContact CG2-CE1 4.24Å; I663-L717 HydrophobicContact CD1-CD2 3.74Å; I663-L727 HydrophobicContact CD1-CD1 4.4Å; I663-L727 HydrophobicContact CG2-CD1 4.19Å
664	T	87.1	Confident	76	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.012	15%	0.146	C	C	.	.	B	Isolated β-bridge	trans	-76.1	151.2	169.8	77.8	0	0	0	0	110.4	I659 G661 T662 S666 L673 W680 Y716	I659-T664 PolarHBondContact O-N 2.69Å; G661-T664 CarbonylContact C-O 3.58Å; G661-T664 WeakPolarHBondContact CA-O 3.2Å; G661-T664 PolarHBondContact N-O 3.43Å; G661-T664 PolarHBondContact N-OG1 3.01Å; T662-T664 PolarHBondContact N-O 3.36Å; T664-S666 PolarHBondContact O-N 2.93Å; T664-S666 PolarHBondContact OG1-O 3.47Å; T664-L673 HydrophobicContact CG2-CD1 3.77Å; T664-W680 CarbonylContact C-O 3.39Å; T664-W680 WeakPolarHBondContact CA-O 3.41Å; T664-Y716 HydrophobicContact CG2-CE1 4.19Å
665	R	82.4	Confident	73.5	Confident	103 Å²	103	30.4 Å²	30.4	39%	0.389	16%	0.164	S	C	.	.	S	Bend	trans	-72.2	-4.3	178.4	-66	-179	-161.6	-155.9	1.7	115.3	W680 T681 H682	R665-W680 WeakPolarHBondContact CG-O 3.41Å; R665-W680 PolarHBondContact N-O 3.37Å; R665-T681 VanDerWaalsContact CZ-O 3.25Å; R665-T681 PolarHBondContact NE-O 3.07Å; R665-T681 PolarHBondContact NH2-O 3.4Å; R665-H682 WeakPolarHBondContact CA-NE2 3.21Å
666	S	68.6	Low	71.1	Confident	30 Å²	30	33.2 Å²	33.2	21%	0.21	18%	0.179	C	C	.	.			trans	-167.5	146.5	177.7	59.1	0	0	0	0	112.5	T664 L669 G670	T664-S666 PolarHBondContact O-N 2.93Å; T664-S666 PolarHBondContact OG1-O 3.47Å; S666-L669 WeakPolarHBondContact OG-CB 3.4Å; S666-L669 WeakPolarHBondContact OG-CG 3.41Å; S666-G670 PolarHBondContact O-N 3.31Å
667	D	60.4	Low	68.6	Low	36 Å²	36	36.6 Å²	36.6	19%	0.193	21%	0.214	C	C	.	.	H	α-helix	trans	-62	-43.7	177	-46.6	-14.5	0	0	0	112	G661 L669 G670 H671 N780 R781	G661-D667 VanDerWaalsContact CA-OD1 3.28Å; G661-D667 WeakPolarHBondContact CA-OD1 3.27Å; G661-D667 PolarHBondContact N-OD1 2.86Å; D667-L669 PolarHBondContact O-N 3.45Å; D667-G670 WeakPolarHBondContact O-CA 3.44Å; D667-G670 PolarHBondContact O-N 3.26Å; D667-G670 VanDerWaalsContact O-N 3.08Å; D667-H671 PolarHBondContact O-CD2 3.31Å; D667-H671 PolarHBondContact O-N 3.31Å; D667-N780 PolarHBondContact OD1-ND2 3.13Å; D667-R781 IonicContact OD2-CZ 3.92Å; D667-R781 IonicContact OD2-NE 3.57Å; D667-R781 PolarHBondContact OD2-NE 3.25Å; D667-R781 IonicContact OD2-NH2 3.31Å; D667-R781 PolarHBondContact OD2-NH2 3.03Å
668	T	54.1	Low	66.4	Low	106 Å²	106	44.3 Å²	44.3	65%	0.65	25%	0.247	S	C	*	.	H	α-helix	trans	-70.1	-35.7	-173.2	51.5	0	0	0	0	113
669	L	51	Low	64.9	Low	47 Å²	47	49 Å²	49	25%	0.246	27%	0.273	C	S	.	.	H	α-helix	trans	-82.7	-16.1	170.6	-52.8	-178.7	0	0	0	112.1	F12 S666 D667 H671 I672 W680	F12-L669 HydrophobicContact CE2-CD2 4.15Å; S666-L669 WeakPolarHBondContact OG-CB 3.4Å; S666-L669 WeakPolarHBondContact OG-CG 3.41Å; D667-L669 PolarHBondContact O-N 3.45Å; L669-H671 PolarHBondContact O-N 3.17Å; L669-I672 HydrophobicContact CD2-CD1 3.99Å; L669-I672 WeakPolarHBondContact O-CA 3.49Å; L669-I672 WeakPolarHBondContact O-CB 3.5Å; L669-I672 PolarHBondContact O-N 3.44Å; L669-W680 HydrophobicContact CD1-CD2 4.41Å; L669-W680 HydrophobicContact CD1-CE3 3.74Å; L669-W680 HydrophobicContact CD1-CH2 3.85Å; L669-W680 HydrophobicContact CD1-CZ2 4.49Å; L669-W680 HydrophobicContact CD1-CZ3 3.43Å; L669-W680 VanDerWaalsContact CD1-CZ3 3.43Å
670	G	50.7	Low	63.9	Low	0 Å²	0	54 Å²	54	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-54.2	-40.3	169	0	0	0	0	0	112.3	D660 S666 D667 I672 R705	D660-G670 WeakPolarHBondContact OD1-CA 3.39Å; S666-G670 PolarHBondContact O-N 3.31Å; D667-G670 WeakPolarHBondContact O-CA 3.44Å; D667-G670 PolarHBondContact O-N 3.26Å; D667-G670 VanDerWaalsContact O-N 3.08Å; G670-I672 PolarHBondContact O-N 2.87Å; G670-R705 PolarHBondContact O-NH2 2.66Å; G670-R705 VanDerWaalsContact O-NH2 3.12Å
671	H	51.9	Low	63.8	Low	102 Å²	102	54.4 Å²	54.4	47%	0.472	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	4.6	173.6	-59	-53.9	0	0	0	115.2	Y19 D667 L669	Y19-H671 WeakPolarHBondContact CE1-O 3.48Å; Y19-H671 WeakPolarHBondContact CE2-O 3.46Å; Y19-H671 PolarHBondContact OH-O 2.84Å; D667-H671 PolarHBondContact O-CD2 3.31Å; D667-H671 PolarHBondContact O-N 3.31Å; L669-H671 PolarHBondContact O-N 3.17Å
672	I	52.7	Low	63.9	Low	34 Å²	34	54.4 Å²	54.4	17%	0.174	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121	12.3	-174.5	-53.5	-174.1	0	0	0	110.6	F12 V15 L669 G670 P674 L676	F12-I672 HydrophobicContact CD2-CD1 4.41Å; F12-I672 HydrophobicContact CE2-CD1 3.61Å; F12-I672 HydrophobicContact CZ-CD1 4.07Å; V15-I672 HydrophobicContact CB-CG2 4.03Å; V15-I672 HydrophobicContact CG1-CB 4.49Å; V15-I672 HydrophobicContact CG1-CG2 3.55Å; V15-I672 HydrophobicContact CG2-CG2 4.45Å; L669-I672 HydrophobicContact CD2-CD1 3.99Å; L669-I672 WeakPolarHBondContact O-CA 3.49Å; L669-I672 WeakPolarHBondContact O-CB 3.5Å; L669-I672 PolarHBondContact O-N 3.44Å; G670-I672 PolarHBondContact O-N 2.87Å; I672-P674 WeakPolarHBondContact O-CD 3.41Å; I672-L676 HydrophobicContact CG2-CD1 4.29Å
673	L	54	Low	63.8	Low	21 Å²	21	60.5 Å²	60.5	11%	0.11	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-57.3	-35.3	-167.6	-126.9	59	0	0	0	119.5	T664 T675 M712 Y716	T664-L673 HydrophobicContact CG2-CD1 3.77Å; L673-T675 VanDerWaalsContact C-N 3.29Å; L673-T675 PolarHBondContact O-N 3.22Å; L673-M712 HydrophobicContact CB-CE 4.15Å; L673-Y716 HydrophobicContact CD1-CD2 4.37Å; L673-Y716 HydrophobicContact CD1-CE2 4.01Å; L673-Y716 HydrophobicContact CD2-CD1 3.46Å; L673-Y716 VanDerWaalsContact CD2-CD1 3.46Å; L673-Y716 HydrophobicContact CD2-CD2 3.56Å; L673-Y716 HydrophobicContact CD2-CE1 3.81Å; L673-Y716 HydrophobicContact CD2-CE2 3.91Å; L673-Y716 HydrophobicContact CD2-CG 3.29Å; L673-Y716 HydrophobicContact CG-CD1 4.36Å; L673-Y716 HydrophobicContact CG-CD2 3.58Å; L673-Y716 HydrophobicContact CG-CE1 4.49Å; L673-Y716 HydrophobicContact CG-CE2 3.74Å; L673-Y716 HydrophobicContact CG-CG 3.89Å
674	P	48.8	Very low	63.8	Low	74 Å²	74	60.5 Å²	60.5	48%	0.481	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-79.4	-3.9	-164.6	30.3	-35.1	0	0	0	114.9	Y19 I672 M712	Y19-P674 HydrophobicContact CE2-CG 3.95Å; Y19-P674 VanDerWaalsContact OH-CD 3.27Å; Y19-P674 WeakPolarHBondContact OH-CD 3.47Å; I672-P674 WeakPolarHBondContact O-CD 3.41Å; P674-M712 HydrophobicContact CB-CG 3.93Å; P674-M712 HydrophobicContact CB-SD 3.78Å; P674-M712 HydrophobicContact CG-CG 4.38Å; P674-M712 HydrophobicContact CG-SD 3.56Å; P674-M712 VanDerWaalsContact CG-SD 3.56Å
675	T	44.3	Very low	64.1	Low	61 Å²	61	60.5 Å²	60.5	37%	0.374	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-125.5	0.2	-163.3	-13.8	0	0	0	0	115.7	V15 L18 L673	V15-T675 WeakPolarHBondContact CG1-OG1 3.48Å; V15-T675 VanDerWaalsContact CG2-CB 3.45Å; V15-T675 HydrophobicContact CG2-CG2 3.94Å; V15-T675 WeakPolarHBondContact CG2-OG1 3.44Å; L18-T675 HydrophobicContact CD1-CG2 3.83Å; L673-T675 VanDerWaalsContact C-N 3.29Å; L673-T675 PolarHBondContact O-N 3.22Å
676	L	47.7	Very low	64.6	Low	60 Å²	60	55.6 Å²	55.6	31%	0.314	30%	0.303	S	S	.	.			trans	-129.6	95.6	175.4	-69.8	95.6	0	0	0	111	V11 V15 I672 K678 W680	V11-L676 HydrophobicContact CG1-CD1 3.92Å; V11-L676 HydrophobicContact CG1-CD2 3.89Å; V11-L676 HydrophobicContact CG1-CG 3.86Å; V15-L676 HydrophobicContact CG2-CD1 3.97Å; I672-L676 HydrophobicContact CG2-CD1 4.29Å; L676-K678 PolarHBondContact O-N 2.68Å; L676-W680 HydrophobicContact CD2-CZ2 4.32Å
677	G	46.9	Very low	65.8	Low	71 Å²	71	58.5 Å²	58.5	73%	0.732	31%	0.314	S	S	*	.			trans	-70.6	69.3	171.4	0	0	0	0	0	112.5
678	K	51.1	Low	67.5	Low	161 Å²	161	56.8 Å²	56.8	70%	0.7	31%	0.305	S	S	*	.	S	Bend	trans	-148.8	152.5	173.6	-156.2	171.7	-172.6	177.9	0	109.1	L676 W680	L676-K678 PolarHBondContact O-N 2.68Å; K678-W680 VanDerWaalsContact C-N 3.32Å; K678-W680 PolarHBondContact O-N 2.58Å
679	D	61	Low	69.6	Low	106 Å²	106	51.7 Å²	51.7	57%	0.567	27%	0.274	S	S	*	.			trans	-74.4	76.4	-161.6	-47.8	-51.4	0	0	0	114.3	T681	D679-T681 PolarHBondContact O-N 3.18Å
680	W	71.1	Confident	71.7	Confident	105 Å²	105	52.9 Å²	52.9	40%	0.398	28%	0.278	S	S	.	.			trans	-73.4	6.9	169.6	-63.3	108.8	0	0	0	113.3	T664 R665 L669 L676 K678	T664-W680 CarbonylContact C-O 3.39Å; T664-W680 WeakPolarHBondContact CA-O 3.41Å; R665-W680 WeakPolarHBondContact CG-O 3.41Å; R665-W680 PolarHBondContact N-O 3.37Å; L669-W680 HydrophobicContact CD1-CD2 4.41Å; L669-W680 HydrophobicContact CD1-CE3 3.74Å; L669-W680 HydrophobicContact CD1-CH2 3.85Å; L669-W680 HydrophobicContact CD1-CZ2 4.49Å; L669-W680 HydrophobicContact CD1-CZ3 3.43Å; L669-W680 VanDerWaalsContact CD1-CZ3 3.43Å; L676-W680 HydrophobicContact CD2-CZ2 4.32Å; K678-W680 VanDerWaalsContact C-N 3.32Å; K678-W680 PolarHBondContact O-N 2.58Å
681	T	85.9	Confident	73.8	Confident	21 Å²	21	55.7 Å²	55.7	13%	0.129	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-84.1	151.6	174.2	43.9	0	0	0	0	112.3	I663 R665 D679 Y716 V720	I663-T681 HydrophobicContact CG2-CG2 4.29Å; I663-T681 VanDerWaalsContact O-CA 3.29Å; I663-T681 WeakPolarHBondContact O-CA 3.14Å; R665-T681 VanDerWaalsContact CZ-O 3.25Å; R665-T681 PolarHBondContact NE-O 3.07Å; R665-T681 PolarHBondContact NH2-O 3.4Å; D679-T681 PolarHBondContact O-N 3.18Å; T681-Y716 WeakPolarHBondContact CG2-OH 3.37Å; T681-V720 HydrophobicContact CG2-CB 4.42Å; T681-V720 HydrophobicContact CG2-CG1 3.8Å; T681-V720 HydrophobicContact CG2-CG2 3.68Å
682	H	89	Confident	76	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.009	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-67.1	138.7	166.7	-75.2	-76.3	0	0	0	111.7	T662 I663 R665 I685 N802 G805 Y819	T662-H682 PolarHBondContact O-CD2 3Å; I663-H682 PolarHBondContact O-N 3Å; I663-H682 VanDerWaalsContact O-N 3.12Å; R665-H682 WeakPolarHBondContact CA-NE2 3.21Å; H682-I685 WeakPolarHBondContact O-CG2 3.46Å; H682-N802 PolarHBondContact CE1-O 2.96Å; H682-N802 VanDerWaalsContact CE1-O 3.23Å; H682-G805 PolarHBondContact CE1-N 2.92Å; H682-G805 WeakPolarHBondContact ND1-CA 3.4Å; H682-G805 PolarHBondContact ND1-N 3.39Å; H682-Y819 HydrophobicContact CB-CD2 3.68Å; H682-Y819 HydrophobicContact CB-CE2 3.47Å; H682-Y819 VanDerWaalsContact CB-CE2 3.47Å; H682-Y819 AromaticContact CG-CE2 3.88Å
683	Q	89.6	Confident	78	Confident	128 Å²	128	51.3 Å²	51.3	60%	0.598	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	137.8	-179.3	-167.5	-174.8	-30.4	0	0	111.2	I685 E722	Q683-I685 VanDerWaalsContact C-N 3.33Å; Q683-E722 WeakPolarHBondContact CG-OE1 3.04Å
684	G	90.8	Very high	79.9	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.01	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	-6.9	-177.3	0	0	0	0	0	114.8	Q687 L688 E722	G684-Q687 PolarHBondContact O-N 3.01Å; G684-L688 PolarHBondContact O-N 2.81Å; G684-E722 VanDerWaalsContact CA-OE2 3.22Å; G684-E722 WeakPolarHBondContact CA-OE2 3.44Å; G684-E722 PolarHBondContact N-OE1 3.42Å; G684-E722 PolarHBondContact N-OE2 3.49Å
685	I	94	Very high	82.1	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-68.7	-43.6	-172.9	-164	174.8	0	0	0	112.3	I663 H682 Q683 Q687 L688 Y689 E722 Y819	I663-I685 HydrophobicContact CB-CD1 4.18Å; I663-I685 HydrophobicContact CG1-CD1 3.79Å; I663-I685 HydrophobicContact CG2-CD1 4.43Å; H682-I685 WeakPolarHBondContact O-CG2 3.46Å; Q683-I685 VanDerWaalsContact C-N 3.33Å; I685-Q687 VanDerWaalsContact C-N 3.32Å; I685-Q687 PolarHBondContact O-N 3.4Å; I685-L688 PolarHBondContact O-N 3.18Å; I685-Y689 HydrophobicContact CD1-CE1 4.38Å; I685-Y689 HydrophobicContact CD1-CE2 4.14Å; I685-Y689 HydrophobicContact CG1-CD1 4.13Å; I685-Y689 HydrophobicContact CG1-CD2 4.38Å; I685-Y689 HydrophobicContact CG1-CE1 3.87Å; I685-Y689 HydrophobicContact CG1-CE2 4.14Å; I685-Y689 HydrophobicContact CG1-CG 4.38Å; I685-Y689 WeakPolarHBondContact O-CB 3.44Å; I685-Y689 PolarHBondContact O-N 3.05Å; I685-E722 PolarHBondContact N-OE2 3.16Å; I685-Y819 HydrophobicContact CB-CD1 4.22Å; I685-Y819 HydrophobicContact CB-CD2 3.97Å; I685-Y819 HydrophobicContact CB-CE1 4.42Å; I685-Y819 HydrophobicContact CB-CE2 4.15Å; I685-Y819 HydrophobicContact CB-CG 4Å; I685-Y819 HydrophobicContact CD1-CE1 3.9Å; I685-Y819 HydrophobicContact CD1-CE2 3.9Å; I685-Y819 HydrophobicContact CG1-CD1 3.9Å; I685-Y819 HydrophobicContact CG1-CD2 4.28Å; I685-Y819 HydrophobicContact CG1-CE1 3.72Å; I685-Y819 HydrophobicContact CG1-CE2 4.09Å; I685-Y819 HydrophobicContact CG1-CG 4.18Å
686	A	93.6	Very high	84.5	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-67.6	-37.3	178.1	0	0	0	0	0	110.6	H690 E722 L727	A686-H690 WeakPolarHBondContact O-CB 3.4Å; A686-H690 PolarHBondContact O-N 2.96Å; A686-E722 HydrophobicContact CB-CB 3.93Å; A686-L727 HydrophobicContact CB-CD2 4.22Å; A686-L727 HydrophobicContact CB-CG 4.48Å
687	Q	94.1	Very high	86.8	Confident	91 Å²	91	49.2 Å²	49.2	43%	0.425	26%	0.259	S	S	.	.	H	α-helix	trans	-64.6	-38.2	174	-164.6	-176.5	13	0	0	112.9	G684 I685 K691 S823	G684-Q687 PolarHBondContact O-N 3.01Å; I685-Q687 VanDerWaalsContact C-N 3.32Å; I685-Q687 PolarHBondContact O-N 3.4Å; Q687-K691 WeakPolarHBondContact O-CG 3.29Å; Q687-K691 PolarHBondContact O-N 3.21Å; Q687-S823 PolarHBondContact O-OG 3.07Å
688	L	95.8	Very high	89.2	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-66	-57	172.5	176.4	64.5	0	0	0	111.1	G684 I685 H690 K691 V692 F778 Y819 L822 V826	G684-L688 PolarHBondContact O-N 2.81Å; I685-L688 PolarHBondContact O-N 3.18Å; L688-H690 VanDerWaalsContact C-N 3.27Å; L688-H690 PolarHBondContact O-N 3.12Å; L688-K691 PolarHBondContact O-N 3.12Å; L688-K691 VanDerWaalsContact O-N 3.12Å; L688-V692 HydrophobicContact CD1-CG2 3.87Å; L688-V692 HydrophobicContact CG-CG2 4.21Å; L688-V692 WeakPolarHBondContact O-CG2 3.35Å; L688-V692 PolarHBondContact O-N 3.04Å; L688-F778 HydrophobicContact CD2-CE1 4Å; L688-F778 HydrophobicContact CD2-CZ 3.83Å; L688-Y819 HydrophobicContact CD2-CD1 3.77Å; L688-Y819 HydrophobicContact CD2-CE1 4.5Å; L688-L822 HydrophobicContact CD1-CB 4.34Å; L688-L822 HydrophobicContact CD1-CG 3.98Å; L688-L822 HydrophobicContact CD2-CB 4.22Å; L688-L822 HydrophobicContact CD2-CD2 3.7Å; L688-L822 HydrophobicContact CD2-CG 3.91Å; L688-V826 HydrophobicContact CD1-CB 4.48Å; L688-V826 HydrophobicContact CD1-CG2 4Å
689	Y	97.2	Very high	91.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.8	-35.5	-171.2	-74.1	14.7	0	0	0	111.4	S657 I663 I685 V692 S693 F699 Y701 L727 F778 Y819	S657-Y689 WeakPolarHBondContact OG-CE2 3.47Å; S657-Y689 PolarHBondContact OG-OH 3Å; I663-Y689 HydrophobicContact CD1-CE2 4.46Å; I663-Y689 HydrophobicContact CG1-CE2 4.47Å; I685-Y689 HydrophobicContact CD1-CE1 4.38Å; I685-Y689 HydrophobicContact CD1-CE2 4.14Å; I685-Y689 HydrophobicContact CG1-CD1 4.13Å; I685-Y689 HydrophobicContact CG1-CD2 4.38Å; I685-Y689 HydrophobicContact CG1-CE1 3.87Å; I685-Y689 HydrophobicContact CG1-CE2 4.14Å; I685-Y689 HydrophobicContact CG1-CG 4.38Å; I685-Y689 WeakPolarHBondContact O-CB 3.44Å; I685-Y689 PolarHBondContact O-N 3.05Å; Y689-V692 PolarHBondContact O-N 3.39Å; Y689-S693 WeakPolarHBondContact O-CB 3.49Å; Y689-S693 PolarHBondContact O-N 3.47Å; Y689-F699 AromaticContact CD1-CE1 3.71Å; Y689-F699 HydrophobicContact CD1-CE1 3.71Å; Y689-F699 AromaticContact CD1-CZ 3.9Å; Y689-F699 HydrophobicContact CD1-CZ 3.9Å; Y689-F699 AromaticContact CD2-CD1 3.79Å; Y689-F699 HydrophobicContact CD2-CD1 3.79Å; Y689-F699 AromaticContact CD2-CE1 3.37Å; Y689-F699 HydrophobicContact CD2-CE1 3.37Å; Y689-F699 HydrophobicContact CD2-CZ 4.09Å; Y689-F699 HydrophobicContact CE1-CE1 4.05Å; Y689-F699 HydrophobicContact CE2-CD1 4.12Å; Y689-F699 AromaticContact CE2-CE1 3.75Å; Y689-F699 HydrophobicContact CE2-CE1 3.75Å; Y689-F699 HydrophobicContact CG-CD1 4.19Å; Y689-F699 AromaticContact CG-CE1 3.36Å; Y689-F699 HydrophobicContact CG-CE1 3.36Å; Y689-F699 AromaticContact CG-CZ 3.62Å; Y689-F699 HydrophobicContact CG-CZ 3.62Å; Y689-F699 WeakPolarHBondContact O-CE2 3.42Å; Y689-Y701 HydrophobicContact CD2-CE1 4.3Å; Y689-Y701 HydrophobicContact CE2-CE1 4.23Å; Y689-L727 HydrophobicContact CD2-CD2 3.79Å; Y689-L727 HydrophobicContact CG-CD2 4.34Å; Y689-F778 HydrophobicContact CE1-CD1 4.38Å; Y689-F778 AromaticContact CE1-CD2 3.91Å; Y689-F778 HydrophobicContact CE1-CD2 3.91Å; Y689-F778 HydrophobicContact CE1-CE1 4.39Å; Y689-F778 AromaticContact CE1-CE2 3.93Å; Y689-F778 HydrophobicContact CE1-CE2 3.93Å; Y689-F778 HydrophobicContact CE1-CG 4.16Å; Y689-F778 HydrophobicContact CE1-CZ 4.17Å; Y689-F778 VanDerWaalsContact OH-CB 3.27Å; Y689-F778 WeakPolarHBondContact OH-CB 3.27Å; Y689-F778 VanDerWaalsContact OH-CG 3.32Å; Y689-F778 WeakPolarHBondContact OH-CG 3.45Å; Y689-Y819 HydrophobicContact CE1-CE1 4.26Å
690	H	95.3	Very high	93.1	Very high	71 Å²	71	36.5 Å²	36.5	33%	0.329	18%	0.179	S	C	.	.	H	α-helix	trans	-61.7	-46.8	173.7	-168.7	89.3	0	0	0	112.3	A686 L688 S693 Q694 T725	A686-H690 WeakPolarHBondContact O-CB 3.4Å; A686-H690 PolarHBondContact O-N 2.96Å; L688-H690 VanDerWaalsContact C-N 3.27Å; L688-H690 PolarHBondContact O-N 3.12Å; H690-S693 PolarHBondContact O-N 2.88Å; H690-Q694 PolarHBondContact CD2-NE2 3.1Å; H690-Q694 PolarHBondContact NE2-NE2 3.09Å; H690-Q694 WeakPolarHBondContact O-CG 3.34Å; H690-Q694 PolarHBondContact O-N 2.68Å; H690-T725 HydrophobicContact CB-CG2 3.47Å; H690-T725 VanDerWaalsContact CB-CG2 3.47Å
691	K	95.5	Very high	94.3	Very high	59 Å²	59	31.6 Å²	31.6	26%	0.257	16%	0.16	S	C	.	.	H	α-helix	trans	-64.4	-43.4	175.3	-69.8	-174.4	-165.7	167.7	0	112.4	Q687 L688 S693 Q694 N695 S823 V826	Q687-K691 WeakPolarHBondContact O-CG 3.29Å; Q687-K691 PolarHBondContact O-N 3.21Å; L688-K691 PolarHBondContact O-N 3.12Å; L688-K691 VanDerWaalsContact O-N 3.12Å; K691-S693 PolarHBondContact O-N 3.16Å; K691-Q694 WeakPolarHBondContact O-CB 3.45Å; K691-Q694 PolarHBondContact O-N 3.35Å; K691-Q694 VanDerWaalsContact O-N 3.12Å; K691-N695 PolarHBondContact O-N 2.83Å; K691-N695 PolarHBondContact O-OD1 2.89Å; K691-S823 WeakPolarHBondContact CD-OG 3.38Å; K691-S823 VanDerWaalsContact CE-OG 3.29Å; K691-S823 WeakPolarHBondContact CE-OG 3.34Å; K691-S823 PolarHBondContact NZ-O 2.83Å; K691-S823 PolarHBondContact NZ-OG 3.05Å; K691-V826 HydrophobicContact CB-CG1 4.1Å; K691-V826 HydrophobicContact CB-CG2 4.12Å; K691-V826 HydrophobicContact CD-CG1 3.73Å
692	V	96.7	Very high	94.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59.8	-36.6	176	175.6	0	0	0	0	110.8	I655 L688 Y689 N695 Y697 F699 V826 F830	I655-V692 HydrophobicContact CD1-CG1 4.08Å; I655-V692 HydrophobicContact CG1-CG1 3.8Å; L688-V692 HydrophobicContact CD1-CG2 3.87Å; L688-V692 HydrophobicContact CG-CG2 4.21Å; L688-V692 WeakPolarHBondContact O-CG2 3.35Å; L688-V692 PolarHBondContact O-N 3.04Å; Y689-V692 PolarHBondContact O-N 3.39Å; V692-N695 PolarHBondContact O-N 2.75Å; V692-Y697 HydrophobicContact CG1-CD2 4.13Å; V692-Y697 HydrophobicContact CG1-CG 4.22Å; V692-Y697 WeakPolarHBondContact O-CD2 3.23Å; V692-Y697 PolarHBondContact O-N 3.24Å; V692-F699 HydrophobicContact CB-CE2 3.98Å; V692-F699 HydrophobicContact CB-CZ 3.92Å; V692-F699 HydrophobicContact CG1-CE2 3.83Å; V692-F699 HydrophobicContact CG1-CZ 3.81Å; V692-V826 HydrophobicContact CG2-CG2 3.56Å; V692-F830 HydrophobicContact CG1-CB 4.32Å; V692-F830 HydrophobicContact CG1-CD1 3.78Å; V692-F830 HydrophobicContact CG1-CE1 4.27Å; V692-F830 HydrophobicContact CG1-CG 4.02Å; V692-F830 HydrophobicContact CG2-CB 4.21Å; V692-F830 HydrophobicContact CG2-CD1 4.17Å; V692-F830 HydrophobicContact CG2-CD2 3.62Å; V692-F830 HydrophobicContact CG2-CE1 4.49Å; V692-F830 HydrophobicContact CG2-CE2 3.97Å; V692-F830 HydrophobicContact CG2-CG 3.74Å; V692-F830 HydrophobicContact CG2-CZ 4.4Å
693	S	95.4	Very high	94.4	Very high	44 Å²	44	31.4 Å²	31.4	31%	0.308	16%	0.16	S	C	.	.	H	α-helix	trans	-70.7	-39.5	173.8	-168.1	0	0	0	0	113.2	Y689 H690 K691 N695 G696	Y689-S693 WeakPolarHBondContact O-CB 3.49Å; Y689-S693 PolarHBondContact O-N 3.47Å; H690-S693 PolarHBondContact O-N 2.88Å; K691-S693 PolarHBondContact O-N 3.16Å; S693-N695 PolarHBondContact O-N 2.61Å; S693-G696 PolarHBondContact O-N 3.22Å
694	Q	94.4	Very high	93.9	Very high	122 Å²	122	28.2 Å²	28.2	57%	0.57	16%	0.156	S	C	*	.	H	α-helix	trans	-57.1	-32.5	171.2	-72	176.7	-8.5	0	0	112.2	H690 K691 G696	H690-Q694 PolarHBondContact CD2-NE2 3.1Å; H690-Q694 PolarHBondContact NE2-NE2 3.09Å; H690-Q694 WeakPolarHBondContact O-CG 3.34Å; H690-Q694 PolarHBondContact O-N 2.68Å; K691-Q694 WeakPolarHBondContact O-CB 3.45Å; K691-Q694 PolarHBondContact O-N 3.35Å; K691-Q694 VanDerWaalsContact O-N 3.12Å; Q694-G696 PolarHBondContact O-N 3.12Å
695	N	95.3	Very high	93.4	Very high	11 Å²	11	28.6 Å²	28.6	6%	0.059	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	6.4	178.1	-68.1	12.3	0	0	0	114	K691 V692 S693 Y697 D827 F830 L832 K833	K691-N695 PolarHBondContact O-N 2.83Å; K691-N695 PolarHBondContact O-OD1 2.89Å; V692-N695 PolarHBondContact O-N 2.75Å; S693-N695 PolarHBondContact O-N 2.61Å; N695-Y697 HydrophobicContact CB-CD2 4.07Å; N695-Y697 HydrophobicContact CB-CE2 4.14Å; N695-D827 PolarHBondContact ND2-OD1 3.12Å; N695-F830 PolarHBondContact ND2-O 3.31Å; N695-L832 HydrophobicContact CB-CD2 4.03Å; N695-L832 WeakPolarHBondContact OD1-CD2 3.3Å; N695-K833 PolarHBondContact O-N 3.06Å
696	G	93.9	Very high	92.8	Very high	30 Å²	30	29.6 Å²	29.6	31%	0.309	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.9	9.2	171.8	0	0	0	0	0	115.1	S693 Q694	S693-G696 PolarHBondContact O-N 3.22Å; Q694-G696 PolarHBondContact O-N 3.12Å
697	Y	96.8	Very high	92.3	Very high	10 Å²	10	29.7 Å²	29.7	4%	0.039	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-90.3	143.5	178	-62	-89.6	0	0	0	112.1	K653 I655 V692 N695 Y775 F830 P831	K653-Y697 HydrophobicContact CB-CD1 3.81Å; K653-Y697 HydrophobicContact CB-CE1 4Å; K653-Y697 WeakPolarHBondContact O-CA 3.33Å; I655-Y697 HydrophobicContact CD1-CD1 3.93Å; I655-Y697 HydrophobicContact CD1-CG 4.15Å; I655-Y697 HydrophobicContact CG1-CG 4.4Å; V692-Y697 HydrophobicContact CG1-CD2 4.13Å; V692-Y697 HydrophobicContact CG1-CG 4.22Å; V692-Y697 WeakPolarHBondContact O-CD2 3.23Å; V692-Y697 PolarHBondContact O-N 3.24Å; N695-Y697 HydrophobicContact CB-CD2 4.07Å; N695-Y697 HydrophobicContact CB-CE2 4.14Å; Y697-Y775 HydrophobicContact CD1-CD1 4.24Å; Y697-Y775 HydrophobicContact CD1-CG 4.11Å; Y697-Y775 AromaticContact CE1-CD1 3.66Å; Y697-Y775 HydrophobicContact CE1-CD1 3.66Å; Y697-Y775 AromaticContact CE1-CD2 3.56Å; Y697-Y775 HydrophobicContact CE1-CD2 3.56Å; Y697-Y775 AromaticContact CE1-CE1 3.97Å; Y697-Y775 HydrophobicContact CE1-CE1 3.97Å; Y697-Y775 AromaticContact CE1-CE2 3.84Å; Y697-Y775 HydrophobicContact CE1-CE2 3.84Å; Y697-Y775 AromaticContact CE1-CG 3.47Å; Y697-Y775 HydrophobicContact CE1-CG 3.47Å; Y697-Y775 VanDerWaalsContact CE1-CG 3.47Å; Y697-Y775 AromaticContact CZ-CE2 3.98Å; Y697-Y775 AromaticContact CZ-CZ 3.91Å; Y697-Y775 VanDerWaalsContact OH-CE2 3.28Å; Y697-Y775 WeakPolarHBondContact OH-CE2 3.31Å; Y697-Y775 PolarHBondContact OH-OH 3.48Å; Y697-F830 HydrophobicContact CD2-CB 4.3Å; Y697-F830 HydrophobicContact CE2-CB 3.79Å; Y697-P831 WeakPolarHBondContact CE2-O 3.39Å; Y697-P831 PolarHBondContact OH-O 3.08Å; Y697-P831 VanDerWaalsContact OH-O 3.11Å
698	K	96.4	Very high	91.7	Very high	69 Å²	69	26 Å²	26	30%	0.3	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	145.1	174.9	-51.2	-61.4	-178.9	175.9	0	110.1	W648 D652 K653 I654 I655	W648-K698 HydrophobicContact CD2-CB 4.28Å; W648-K698 HydrophobicContact CD2-CG 4.07Å; W648-K698 HydrophobicContact CE3-CB 4.29Å; W648-K698 HydrophobicContact CE3-CG 4.38Å; W648-K698 HydrophobicContact CG-CG 4.47Å; W648-K698 HydrophobicContact CH2-CB 3.83Å; W648-K698 HydrophobicContact CZ2-CB 3.77Å; W648-K698 HydrophobicContact CZ2-CG 4.33Å; W648-K698 HydrophobicContact CZ3-CB 4.1Å; D652-K698 HydrophobicContact CB-CG 3.98Å; D652-K698 WeakPolarHBondContact OD1-CE 3.42Å; D652-K698 IonicContact OD1-NZ 2.75Å; D652-K698 WeakPolarHBondContact OD2-CE 3.5Å; D652-K698 IonicContact OD2-NZ 3.93Å; K653-K698 PolarHBondContact O-N 3.03Å; I654-K698 CarbonylContact C-O 3.54Å; I654-K698 WeakPolarHBondContact CA-O 3.47Å; I655-K698 PolarHBondContact N-O 3.11Å
699	F	97.7	Very high	91	Very high	1 Å²	1	27.5 Å²	27.5	0%	0.004	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	138.2	174.6	-85.5	-96.5	0	0	0	111.5	W648 I655 Y689 V692 Y701 P728 G730 P731	W648-F699 WeakPolarHBondContact CH2-O 3.47Å; I655-F699 HydrophobicContact CB-CD1 4.03Å; I655-F699 HydrophobicContact CB-CE1 3.83Å; I655-F699 HydrophobicContact CB-CE2 4.39Å; I655-F699 HydrophobicContact CB-CG 4.39Å; I655-F699 HydrophobicContact CB-CZ 4.02Å; I655-F699 HydrophobicContact CG1-CE1 4.47Å; I655-F699 HydrophobicContact CG1-CE2 4.26Å; I655-F699 HydrophobicContact CG1-CZ 4.15Å; I655-F699 HydrophobicContact CG2-CD1 4.15Å; I655-F699 HydrophobicContact CG2-CE1 3.58Å; I655-F699 HydrophobicContact CG2-CZ 3.94Å; Y689-F699 AromaticContact CD1-CE1 3.71Å; Y689-F699 HydrophobicContact CD1-CE1 3.71Å; Y689-F699 AromaticContact CD1-CZ 3.9Å; Y689-F699 HydrophobicContact CD1-CZ 3.9Å; Y689-F699 AromaticContact CD2-CD1 3.79Å; Y689-F699 HydrophobicContact CD2-CD1 3.79Å; Y689-F699 AromaticContact CD2-CE1 3.37Å; Y689-F699 HydrophobicContact CD2-CE1 3.37Å; Y689-F699 HydrophobicContact CD2-CZ 4.09Å; Y689-F699 HydrophobicContact CE1-CE1 4.05Å; Y689-F699 HydrophobicContact CE2-CD1 4.12Å; Y689-F699 AromaticContact CE2-CE1 3.75Å; Y689-F699 HydrophobicContact CE2-CE1 3.75Å; Y689-F699 HydrophobicContact CG-CD1 4.19Å; Y689-F699 AromaticContact CG-CE1 3.36Å; Y689-F699 HydrophobicContact CG-CE1 3.36Å; Y689-F699 AromaticContact CG-CZ 3.62Å; Y689-F699 HydrophobicContact CG-CZ 3.62Å; Y689-F699 WeakPolarHBondContact O-CE2 3.42Å; V692-F699 HydrophobicContact CB-CE2 3.98Å; V692-F699 HydrophobicContact CB-CZ 3.92Å; V692-F699 HydrophobicContact CG1-CE2 3.83Å; V692-F699 HydrophobicContact CG1-CZ 3.81Å; F699-Y701 HydrophobicContact CB-CE2 4.05Å; F699-Y701 HydrophobicContact CD1-CE1 4.34Å; F699-P728 HydrophobicContact CB-CG 4.27Å; F699-P728 HydrophobicContact CD1-CG 4.44Å; F699-P728 HydrophobicContact CD2-CB 4.2Å; F699-P728 HydrophobicContact CD2-CG 3.42Å; F699-P728 VanDerWaalsContact CD2-CG 3.42Å; F699-P728 HydrophobicContact CE2-CG 3.83Å; F699-P728 HydrophobicContact CG-CG 3.77Å; F699-G730 WeakPolarHBondContact O-CA 3.38Å; F699-P731 WeakPolarHBondContact O-CD 3.41Å
700	L	97.5	Very high	90.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	111.9	173.9	178	62.3	0	0	0	108.3	I34 I654 I655 I656 S657 P731 L733 L760 I763 F774	I34-L700 HydrophobicContact CD1-CD1 3.66Å; I654-L700 HydrophobicContact CG2-CB 3.51Å; I654-L700 HydrophobicContact CG2-CD2 4.18Å; I654-L700 HydrophobicContact CG2-CG 4.49Å; I655-L700 PolarHBondContact O-N 3.38Å; I656-L700 CarbonylContact C-O 3.57Å; I656-L700 WeakPolarHBondContact CA-O 3.45Å; S657-L700 PolarHBondContact N-O 2.96Å; L700-P731 HydrophobicContact CD1-CB 4.39Å; L700-P731 HydrophobicContact CD1-CG 3.77Å; L700-L733 HydrophobicContact CD1-CD1 3.75Å; L700-L733 HydrophobicContact CD1-CG 3.82Å; L700-L733 HydrophobicContact CD2-CD1 4.09Å; L700-L733 HydrophobicContact CG-CD1 4.15Å; L700-L760 HydrophobicContact CD2-CD2 3.87Å; L700-I763 HydrophobicContact CD2-CG2 4.28Å; L700-F774 HydrophobicContact CD2-CE1 3.84Å
701	Y	96.3	Very high	90.1	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.008	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	140.3	179.8	-59.5	-73.4	0	0	0	110.1	S657 I663 Y689 F699 L717 P728 P731 L733	S657-Y701 CarbonylContact O-C 3.59Å; S657-Y701 WeakPolarHBondContact O-CA 3.46Å; I663-Y701 HydrophobicContact CD1-CD1 3.79Å; I663-Y701 HydrophobicContact CD1-CE1 3.8Å; Y689-Y701 HydrophobicContact CD2-CE1 4.3Å; Y689-Y701 HydrophobicContact CE2-CE1 4.23Å; F699-Y701 HydrophobicContact CB-CE2 4.05Å; F699-Y701 HydrophobicContact CD1-CE1 4.34Å; Y701-L717 HydrophobicContact CD1-CD1 4.4Å; Y701-L717 HydrophobicContact CD2-CD1 3.95Å; Y701-L717 HydrophobicContact CE2-CD1 4.44Å; Y701-L717 HydrophobicContact CG-CD1 3.92Å; Y701-P728 WeakPolarHBondContact CE2-O 3.36Å; Y701-P728 WeakPolarHBondContact OH-CD 3Å; Y701-P728 PolarHBondContact OH-O 3.5Å; Y701-P731 PolarHBondContact N-O 3.5Å; Y701-L733 PolarHBondContact O-N 2.97Å
702	C	91.2	Very high	89.4	Confident	12 Å²	12	26.3 Å²	26.3	8%	0.081	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	146.2	179.9	-66.3	0	0	0	0	110.3	S657 D658 I659 L733	S657-C702 PolarHBondContact O-N 3.33Å; D658-C702 CarbonylContact C-O 3.6Å; D658-C702 WeakPolarHBondContact CA-O 3.31Å; D658-C702 VanDerWaalsContact OD1-O 3.13Å; I659-C702 PolarHBondContact N-O 3.04Å; C702-L733 CarbonylContact C-O 3.16Å; C702-L733 WeakPolarHBondContact CA-O 3.29Å
703	S	85.4	Confident	88.9	Confident	7 Å²	7	26.3 Å²	26.3	5%	0.049	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	150.4	169.2	166	0	0	0	0	111	D660 R705 L733 L734	D660-S703 PolarHBondContact OD2-OG 3.44Å; S703-R705 PolarHBondContact O-N 3.24Å; S703-R705 WeakPolarHBondContact OG-CB 3.38Å; S703-R705 VanDerWaalsContact OG-CD 3.26Å; S703-R705 WeakPolarHBondContact OG-CD 3.26Å; S703-R705 WeakPolarHBondContact OG-CG 3.38Å; S703-R705 PolarHBondContact OG-N 2.94Å; S703-R705 VanDerWaalsContact OG-N 3.1Å; S703-L733 PolarHBondContact N-O 3.23Å; S703-L734 WeakPolarHBondContact O-CA 3.43Å
704	A	78.6	Confident	88.6	Confident	62 Å²	62	25.6 Å²	25.6	51%	0.512	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	-3	173.7	0	0	0	0	0	113.9
705	R	79.8	Confident	88.2	Confident	9 Å²	9	21.8 Å²	21.8	3%	0.034	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	149.1	178.1	-69.1	163.7	-165.2	-162.4	4.1	111.9	D660 G670 S703 T713 L734 S735	D660-R705 IonicContact OD1-CZ 2.67Å; D660-R705 IonicContact OD1-NE 3.77Å; D660-R705 PolarHBondContact OD1-NE 3.2Å; D660-R705 VanDerWaalsContact OD1-NE 3.16Å; D660-R705 IonicContact OD1-NH2 2.66Å; D660-R705 PolarHBondContact OD1-NH2 3.02Å; D660-R705 IonicContact OD2-CZ 3.18Å; D660-R705 IonicContact OD2-NE 3.04Å; D660-R705 PolarHBondContact OD2-NE 2.83Å; D660-R705 IonicContact OD2-NH2 2.86Å; G670-R705 PolarHBondContact O-NH2 2.66Å; G670-R705 VanDerWaalsContact O-NH2 3.12Å; S703-R705 PolarHBondContact O-N 3.24Å; S703-R705 WeakPolarHBondContact OG-CB 3.38Å; S703-R705 VanDerWaalsContact OG-CD 3.26Å; S703-R705 WeakPolarHBondContact OG-CD 3.26Å; S703-R705 WeakPolarHBondContact OG-CG 3.38Å; S703-R705 PolarHBondContact OG-N 2.94Å; S703-R705 VanDerWaalsContact OG-N 3.1Å; R705-T713 PolarHBondContact NH1-OG1 2.82Å; R705-L734 HydrophobicContact CB-CD2 4.17Å; R705-S735 WeakPolarHBondContact O-CB 3.43Å; R705-S735 PolarHBondContact O-N 2.93Å
706	A	81.6	Confident	87.8	Confident	22 Å²	22	22.6 Å²	22.6	18%	0.182	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	144.4	173.9	0	0	0	0	0	112.4	G708 M709 S737	A706-G708 PolarHBondContact O-N 2.66Å; A706-M709 WeakPolarHBondContact O-CB 3.44Å; A706-M709 PolarHBondContact O-N 2.83Å; A706-S737 VanDerWaalsContact CB-O 3.28Å; A706-S737 WeakPolarHBondContact CB-O 3.14Å
707	I	84.4	Confident	87.6	Confident	2 Å²	2	21.4 Å²	21.4	1%	0.01	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-43.9	-33.8	174.1	-173.7	174.6	0	0	0	115.3	I31 H49 R51 M709 A710 S735 S738	I31-I707 HydrophobicContact CD1-CD1 4.44Å; I31-I707 HydrophobicContact CG1-CB 4.33Å; I31-I707 HydrophobicContact CG1-CD1 3.91Å; I31-I707 HydrophobicContact CG1-CG1 3.84Å; H49-I707 HydrophobicContact CB-CD1 4.06Å; H49-I707 WeakPolarHBondContact O-CD1 3.45Å; R51-I707 HydrophobicContact CB-CD1 4.14Å; I707-M709 PolarHBondContact O-N 3.05Å; I707-M709 VanDerWaalsContact O-N 3.1Å; I707-A710 VanDerWaalsContact O-CB 3.24Å; I707-A710 WeakPolarHBondContact O-CB 3.15Å; I707-A710 PolarHBondContact O-N 2.91Å; I707-A710 VanDerWaalsContact O-N 3.11Å; I707-S735 PolarHBondContact N-O 3.35Å; I707-S738 WeakPolarHBondContact CG2-OG 3.32Å
708	G	81.2	Confident	87.1	Confident	12 Å²	12	25.2 Å²	25.2	12%	0.124	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-65.8	-7.9	175.4	0	0	0	0	0	115	L27 A706	L27-G708 WeakPolarHBondContact CD1-O 3.28Å; A706-G708 PolarHBondContact O-N 2.66Å
709	M	79.8	Confident	86.5	Confident	32 Å²	32	29.2 Å²	29.2	16%	0.158	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-103.3	11.7	175.2	-53.9	-56.3	-54	0	0	112.8	Y19 L27 A706 I707 M712 T713	Y19-M709 HydrophobicContact CE1-CE 3.92Å; L27-M709 HydrophobicContact CD1-SD 3.63Å; A706-M709 WeakPolarHBondContact O-CB 3.44Å; A706-M709 PolarHBondContact O-N 2.83Å; I707-M709 PolarHBondContact O-N 3.05Å; I707-M709 VanDerWaalsContact O-N 3.1Å; M709-M712 HydrophobicContact CE-CE 3.73Å; M709-M712 HydrophobicContact CE-SD 3.38Å; M709-M712 WeakPolarHBondContact CE-SD 3.35Å; M709-T713 WeakPolarHBondContact O-CB 3.15Å; M709-T713 PolarHBondContact O-N 2.85Å; M709-T713 VanDerWaalsContact O-N 3.07Å; M709-T713 PolarHBondContact O-OG1 3.44Å
710	A	87.3	Confident	86	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.008	17%	0.165	C	C	.	.	H	α-helix	trans	-61.8	-53.3	-172.6	0	0	0	0	0	113.2	C30 I707 M712 T713 R714 L734	C30-A710 WeakPolarHBondContact O-CB 3.34Å; I707-A710 VanDerWaalsContact O-CB 3.24Å; I707-A710 WeakPolarHBondContact O-CB 3.15Å; I707-A710 PolarHBondContact O-N 2.91Å; I707-A710 VanDerWaalsContact O-N 3.11Å; A710-M712 VanDerWaalsContact C-N 3.29Å; A710-M712 PolarHBondContact O-N 3.2Å; A710-T713 PolarHBondContact O-N 2.94Å; A710-R714 PolarHBondContact O-N 3.34Å; A710-L734 HydrophobicContact CB-CD1 3.5Å
711	D	86.1	Confident	85.4	Confident	62 Å²	62	33.5 Å²	33.5	33%	0.332	19%	0.187	S	C	.	.	H	α-helix	trans	-60.9	-37.9	-177.5	-63.3	-53.5	0	0	0	112.6	T713 R714 G715	D711-T713 VanDerWaalsContact C-N 3.34Å; D711-R714 IonicContact OD1-CZ 2.94Å; D711-R714 VanDerWaalsContact OD1-CZ 3.28Å; D711-R714 IonicContact OD1-NH1 3.23Å; D711-R714 PolarHBondContact OD1-NH1 3.08Å; D711-R714 IonicContact OD1-NH2 2.89Å; D711-R714 PolarHBondContact OD1-NH2 3.24Å; D711-G715 WeakPolarHBondContact O-CA 3.14Å; D711-G715 PolarHBondContact O-N 3.31Å
712	M	82.7	Confident	84.9	Confident	42 Å²	42	35 Å²	35	21%	0.207	19%	0.194	C	C	.	.	H	α-helix	trans	-66	-35.9	173.8	-169.1	-158.6	79.5	0	0	112.4	Y19 L673 P674 M709 A710 Y716	Y19-M712 PolarHBondContact OH-SD 2.81Å; L673-M712 HydrophobicContact CB-CE 4.15Å; P674-M712 HydrophobicContact CB-CG 3.93Å; P674-M712 HydrophobicContact CB-SD 3.78Å; P674-M712 HydrophobicContact CG-CG 4.38Å; P674-M712 HydrophobicContact CG-SD 3.56Å; P674-M712 VanDerWaalsContact CG-SD 3.56Å; M709-M712 HydrophobicContact CE-CE 3.73Å; M709-M712 HydrophobicContact CE-SD 3.38Å; M709-M712 WeakPolarHBondContact CE-SD 3.35Å; A710-M712 VanDerWaalsContact C-N 3.29Å; A710-M712 PolarHBondContact O-N 3.2Å; M712-Y716 WeakPolarHBondContact O-CB 3.41Å; M712-Y716 PolarHBondContact O-N 2.85Å
713	T	85.5	Confident	84.6	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-78	-43.1	-177.3	-56.9	0	0	0	0	111.2	I659 R705 M709 A710 D711 Y716 L717 V732	I659-T713 HydrophobicContact CD1-CG2 3.55Å; R705-T713 PolarHBondContact NH1-OG1 2.82Å; M709-T713 WeakPolarHBondContact O-CB 3.15Å; M709-T713 PolarHBondContact O-N 2.85Å; M709-T713 VanDerWaalsContact O-N 3.07Å; M709-T713 PolarHBondContact O-OG1 3.44Å; A710-T713 PolarHBondContact O-N 2.94Å; D711-T713 VanDerWaalsContact C-N 3.34Å; T713-Y716 PolarHBondContact O-N 3.19Å; T713-L717 WeakPolarHBondContact O-CG 3.45Å; T713-L717 PolarHBondContact O-N 3.04Å; T713-V732 HydrophobicContact CG2-CG1 4.04Å
714	R	88.9	Confident	84.6	Confident	30 Å²	30	47.4 Å²	47.4	11%	0.113	26%	0.257	C	S	.	.	H	α-helix	trans	-59.6	-48.5	167.8	-85.1	-173.9	-89.3	90.1	9.3	111.5	D32 Q642 A710 D711 Y716 L717 N718 V732	D32-R714 WeakPolarHBondContact OD1-CD 3.38Å; D32-R714 IonicContact OD1-NE 2.68Å; D32-R714 PolarHBondContact OD1-NE 2.68Å; D32-R714 VanDerWaalsContact OD1-NE 3.14Å; D32-R714 WeakPolarHBondContact OD2-CD 3.39Å; D32-R714 IonicContact OD2-NE 3.35Å; Q642-R714 PolarHBondContact O-NH2 2.86Å; A710-R714 PolarHBondContact O-N 3.34Å; D711-R714 IonicContact OD1-CZ 2.94Å; D711-R714 VanDerWaalsContact OD1-CZ 3.28Å; D711-R714 IonicContact OD1-NH1 3.23Å; D711-R714 PolarHBondContact OD1-NH1 3.08Å; D711-R714 IonicContact OD1-NH2 2.89Å; D711-R714 PolarHBondContact OD1-NH2 3.24Å; R714-Y716 VanDerWaalsContact C-N 3.26Å; R714-Y716 PolarHBondContact O-N 2.97Å; R714-L717 PolarHBondContact O-N 3.33Å; R714-L717 VanDerWaalsContact O-N 3.14Å; R714-N718 WeakPolarHBondContact O-CB 3.38Å; R714-N718 VanDerWaalsContact O-CG 3.29Å; R714-N718 PolarHBondContact O-N 2.92Å; R714-N718 PolarHBondContact O-OD1 2.85Å; R714-V732 HydrophobicContact CG-CB 4.34Å; R714-V732 HydrophobicContact CG-CG2 3.76Å
715	G	86.7	Confident	85.1	Confident	41 Å²	41	46.1 Å²	46.1	42%	0.423	24%	0.243	S	C	.	.	H	α-helix	trans	-57.8	-35.7	178.6	0	0	0	0	0	113.6	D711 W719	D711-G715 WeakPolarHBondContact O-CA 3.14Å; D711-G715 PolarHBondContact O-N 3.31Å; G715-W719 WeakPolarHBondContact O-CB 3.27Å; G715-W719 PolarHBondContact O-N 2.81Å
716	Y	85.7	Confident	85.7	Confident	28 Å²	28	48.7 Å²	48.7	11%	0.11	26%	0.256	C	S	.	.	H	α-helix	trans	-66.3	-51.2	171.9	170.9	-102.6	0	0	0	112.8	I663 T664 L673 T681 M712 T713 R714 N718 W719 V720	I663-Y716 HydrophobicContact CG2-CE1 4.24Å; T664-Y716 HydrophobicContact CG2-CE1 4.19Å; L673-Y716 HydrophobicContact CD1-CD2 4.37Å; L673-Y716 HydrophobicContact CD1-CE2 4.01Å; L673-Y716 HydrophobicContact CD2-CD1 3.46Å; L673-Y716 VanDerWaalsContact CD2-CD1 3.46Å; L673-Y716 HydrophobicContact CD2-CD2 3.56Å; L673-Y716 HydrophobicContact CD2-CE1 3.81Å; L673-Y716 HydrophobicContact CD2-CE2 3.91Å; L673-Y716 HydrophobicContact CD2-CG 3.29Å; L673-Y716 HydrophobicContact CG-CD1 4.36Å; L673-Y716 HydrophobicContact CG-CD2 3.58Å; L673-Y716 HydrophobicContact CG-CE1 4.49Å; L673-Y716 HydrophobicContact CG-CE2 3.74Å; L673-Y716 HydrophobicContact CG-CG 3.89Å; T681-Y716 WeakPolarHBondContact CG2-OH 3.37Å; M712-Y716 WeakPolarHBondContact O-CB 3.41Å; M712-Y716 PolarHBondContact O-N 2.85Å; T713-Y716 PolarHBondContact O-N 3.19Å; R714-Y716 VanDerWaalsContact C-N 3.26Å; R714-Y716 PolarHBondContact O-N 2.97Å; Y716-N718 PolarHBondContact O-N 2.93Å; Y716-W719 WeakPolarHBondContact O-CA 3.49Å; Y716-W719 PolarHBondContact O-N 3.5Å; Y716-V720 HydrophobicContact CD1-CG2 4.2Å; Y716-V720 HydrophobicContact CD2-CG2 4.34Å; Y716-V720 HydrophobicContact CE1-CG2 3.77Å; Y716-V720 HydrophobicContact CE2-CG2 3.92Å; Y716-V720 HydrophobicContact CG-CG2 4.49Å; Y716-V720 WeakPolarHBondContact O-CG2 3.31Å; Y716-V720 PolarHBondContact O-N 2.86Å
717	L	89.2	Confident	86.3	Confident	6 Å²	6	47.9 Å²	47.9	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-58.6	-38.4	179.9	-65.7	174	0	0	0	111.4	I659 I663 Y701 T713 R714 W719 V720 L727 V732	I659-L717 HydrophobicContact CD1-CD1 3.98Å; I659-L717 HydrophobicContact CG1-CD2 4.46Å; I659-L717 HydrophobicContact CG2-CD2 4.43Å; I663-L717 HydrophobicContact CD1-CD2 3.74Å; Y701-L717 HydrophobicContact CD1-CD1 4.4Å; Y701-L717 HydrophobicContact CD2-CD1 3.95Å; Y701-L717 HydrophobicContact CE2-CD1 4.44Å; Y701-L717 HydrophobicContact CG-CD1 3.92Å; T713-L717 WeakPolarHBondContact O-CG 3.45Å; T713-L717 PolarHBondContact O-N 3.04Å; R714-L717 PolarHBondContact O-N 3.33Å; R714-L717 VanDerWaalsContact O-N 3.14Å; L717-W719 PolarHBondContact O-N 3.22Å; L717-V720 PolarHBondContact O-N 3.23Å; L717-L727 HydrophobicContact CD2-CD1 3.73Å; L717-V732 HydrophobicContact CD1-CG2 3.64Å
718	N	86.8	Confident	86.8	Confident	90 Å²	90	48.3 Å²	48.3	48%	0.481	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-13.4	175.6	-65.1	5.1	0	0	0	113.8	R714 Y716 M726 M729	R714-N718 WeakPolarHBondContact O-CB 3.38Å; R714-N718 VanDerWaalsContact O-CG 3.29Å; R714-N718 PolarHBondContact O-N 2.92Å; R714-N718 PolarHBondContact O-OD1 2.85Å; Y716-N718 PolarHBondContact O-N 2.93Å; N718-M726 WeakPolarHBondContact O-CE 3.48Å; N718-M729 WeakPolarHBondContact OD1-CE 3.48Å
719	W	85.1	Confident	87.4	Confident	153 Å²	153	52.4 Å²	52.4	58%	0.58	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-22.7	176.2	-171.3	85.7	0	0	0	113.2	G715 Y716 L717 N721	G715-W719 WeakPolarHBondContact O-CB 3.27Å; G715-W719 PolarHBondContact O-N 2.81Å; Y716-W719 WeakPolarHBondContact O-CA 3.49Å; Y716-W719 PolarHBondContact O-N 3.5Å; L717-W719 PolarHBondContact O-N 3.22Å; W719-N721 PolarHBondContact O-N 2.67Å
720	V	85.9	Confident	88.1	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.03	26%	0.264	C	S	.	.			trans	-60.9	108.6	178.4	170.9	0	0	0	0	110.6	T681 Y716 L717 M726 L727	T681-V720 HydrophobicContact CG2-CB 4.42Å; T681-V720 HydrophobicContact CG2-CG1 3.8Å; T681-V720 HydrophobicContact CG2-CG2 3.68Å; Y716-V720 HydrophobicContact CD1-CG2 4.2Å; Y716-V720 HydrophobicContact CD2-CG2 4.34Å; Y716-V720 HydrophobicContact CE1-CG2 3.77Å; Y716-V720 HydrophobicContact CE2-CG2 3.92Å; Y716-V720 HydrophobicContact CG-CG2 4.49Å; Y716-V720 WeakPolarHBondContact O-CG2 3.31Å; Y716-V720 PolarHBondContact O-N 2.86Å; L717-V720 PolarHBondContact O-N 3.23Å; V720-M726 VanDerWaalsContact O-CE 3.3Å; V720-M726 WeakPolarHBondContact O-CE 3.21Å; V720-L727 HydrophobicContact CB-CD1 3.74Å; V720-L727 HydrophobicContact CB-CG 4.1Å; V720-L727 HydrophobicContact CG1-CD1 3.77Å; V720-L727 HydrophobicContact CG1-CG 3.8Å; V720-L727 HydrophobicContact CG2-CD1 4.14Å
721	N	85.6	Confident	88.6	Confident	86 Å²	86	51.1 Å²	51.1	46%	0.46	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	113.6	-178.7	-174.5	-30	0	0	0	109.8	W719 G724 M726	W719-N721 PolarHBondContact O-N 2.67Å; N721-G724 WeakPolarHBondContact OD1-CA 3.43Å; N721-G724 PolarHBondContact OD1-N 2.95Å; N721-M726 HydrophobicContact CB-CE 4.16Å; N721-M726 HydrophobicContact CB-SD 3.52Å; N721-M726 VanDerWaalsContact CB-SD 3.52Å; N721-M726 VanDerWaalsContact CG-SD 3.54Å; N721-M726 PolarHBondContact ND2-SD 3.45Å; N721-M726 VanDerWaalsContact ND2-SD 3.39Å
722	E	84.7	Confident	89	Confident	32 Å²	32	48.2 Å²	48.2	15%	0.15	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	106	173.1	-169.5	173.3	-167	0	0	110.2	Q683 G684 I685 A686 G724 T725	Q683-E722 WeakPolarHBondContact CG-OE1 3.04Å; G684-E722 VanDerWaalsContact CA-OE2 3.22Å; G684-E722 WeakPolarHBondContact CA-OE2 3.44Å; G684-E722 PolarHBondContact N-OE1 3.42Å; G684-E722 PolarHBondContact N-OE2 3.49Å; I685-E722 PolarHBondContact N-OE2 3.16Å; A686-E722 HydrophobicContact CB-CB 3.93Å; E722-G724 PolarHBondContact O-N 2.99Å; E722-G724 VanDerWaalsContact O-N 3.17Å; E722-T725 PolarHBondContact N-O 2.82Å; E722-T725 VanDerWaalsContact O-CB 3.3Å; E722-T725 WeakPolarHBondContact O-CB 3.23Å; E722-T725 PolarHBondContact O-N 3.21Å; E722-T725 PolarHBondContact O-OG1 2.93Å
723	R	85.1	Confident	89.4	Confident	221 Å²	221	46.8 Å²	46.8	83%	0.834	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	30.1	175.6	-52.5	178.3	-179	-156.3	-1.1	114.4
724	G	85.7	Confident	89.5	Confident	60 Å²	60	47 Å²	47	62%	0.619	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	96.8	-4.3	-174.3	0	0	0	0	0	114.4	N721 E722	N721-G724 WeakPolarHBondContact OD1-CA 3.43Å; N721-G724 PolarHBondContact OD1-N 2.95Å; E722-G724 PolarHBondContact O-N 2.99Å; E722-G724 VanDerWaalsContact O-N 3.17Å
725	T	89.7	Confident	89.2	Confident	35 Å²	35	45.9 Å²	45.9	22%	0.215	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	118.3	177.9	-44.1	0	0	0	0	110.4	H690 E722	H690-T725 HydrophobicContact CB-CG2 3.47Å; H690-T725 VanDerWaalsContact CB-CG2 3.47Å; E722-T725 PolarHBondContact N-O 2.82Å; E722-T725 VanDerWaalsContact O-CB 3.3Å; E722-T725 WeakPolarHBondContact O-CB 3.23Å; E722-T725 PolarHBondContact O-N 3.21Å; E722-T725 PolarHBondContact O-OG1 2.93Å
726	M	92.1	Very high	88.5	Confident	63 Å²	63	45.6 Å²	45.6	31%	0.31	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	155.1	174.4	-55.7	-54.8	-61.3	0	0	111.5	N718 V720 N721	N718-M726 WeakPolarHBondContact O-CE 3.48Å; V720-M726 VanDerWaalsContact O-CE 3.3Å; V720-M726 WeakPolarHBondContact O-CE 3.21Å; N721-M726 HydrophobicContact CB-CE 4.16Å; N721-M726 HydrophobicContact CB-SD 3.52Å; N721-M726 VanDerWaalsContact CB-SD 3.52Å; N721-M726 VanDerWaalsContact CG-SD 3.54Å; N721-M726 PolarHBondContact ND2-SD 3.45Å; N721-M726 VanDerWaalsContact ND2-SD 3.39Å
727	L	94.1	Very high	87.6	Confident	4 Å²	4	45.2 Å²	45.2	2%	0.021	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-60.2	144.6	161.4	-71.8	173.8	0	0	0	110.5	I663 A686 Y689 L717 V720	I663-L727 HydrophobicContact CD1-CD1 4.4Å; I663-L727 HydrophobicContact CG2-CD1 4.19Å; A686-L727 HydrophobicContact CB-CD2 4.22Å; A686-L727 HydrophobicContact CB-CG 4.48Å; Y689-L727 HydrophobicContact CD2-CD2 3.79Å; Y689-L727 HydrophobicContact CG-CD2 4.34Å; L717-L727 HydrophobicContact CD2-CD1 3.73Å; V720-L727 HydrophobicContact CB-CD1 3.74Å; V720-L727 HydrophobicContact CB-CG 4.1Å; V720-L727 HydrophobicContact CG1-CD1 3.77Å; V720-L727 HydrophobicContact CG1-CG 3.8Å; V720-L727 HydrophobicContact CG2-CD1 4.14Å
728	P	95.3	Very high	86.2	Confident	11 Å²	11	44.9 Å²	44.9	7%	0.071	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-69.6	145.7	174.5	30	-34.6	0	0	0	111	F699 Y701	F699-P728 HydrophobicContact CB-CG 4.27Å; F699-P728 HydrophobicContact CD1-CG 4.44Å; F699-P728 HydrophobicContact CD2-CB 4.2Å; F699-P728 HydrophobicContact CD2-CG 3.42Å; F699-P728 VanDerWaalsContact CD2-CG 3.42Å; F699-P728 HydrophobicContact CE2-CG 3.83Å; F699-P728 HydrophobicContact CG-CG 3.77Å; Y701-P728 WeakPolarHBondContact CE2-O 3.36Å; Y701-P728 WeakPolarHBondContact OH-CD 3Å; Y701-P728 PolarHBondContact OH-O 3.5Å
729	M	93.4	Very high	84.4	Confident	99 Å²	99	44.5 Å²	44.5	49%	0.488	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-66.1	142	175.8	-60.3	-66	90.6	0	0	111.2	N718	N718-M729 WeakPolarHBondContact OD1-CE 3.48Å
730	G	95.8	Very high	82.2	Confident	5 Å²	5	43 Å²	43	5%	0.052	23%	0.225	C	C	.	.			trans	-174.4	153.5	179.6	0	0	0	0	0	111.5	Y646 F699	Y646-G730 VanDerWaalsContact OH-C 3.25Å; Y646-G730 PolarHBondContact OH-N 3.47Å; Y646-G730 PolarHBondContact OH-O 3.08Å; F699-G730 WeakPolarHBondContact O-CA 3.38Å
731	P	96.5	Very high	80.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.25	C	S	.	.			trans	-61.2	140.6	-179.8	22	-31.8	0	0	0	112.2	D32 I34 Y646 W648 F699 L700 Y701	D32-P731 HydrophobicContact CB-CB 3.83Å; I34-P731 HydrophobicContact CD1-CB 4.22Å; I34-P731 HydrophobicContact CD1-CG 3.65Å; I34-P731 HydrophobicContact CG1-CB 4.01Å; I34-P731 HydrophobicContact CG1-CG 3.8Å; Y646-P731 HydrophobicContact CD2-CB 3.6Å; Y646-P731 HydrophobicContact CD2-CG 3.99Å; Y646-P731 VanDerWaalsContact CE2-CA 3.43Å; Y646-P731 HydrophobicContact CE2-CB 3.76Å; Y646-P731 HydrophobicContact CE2-CG 4.33Å; Y646-P731 HydrophobicContact CG-CB 4.34Å; Y646-P731 HydrophobicContact CG-CG 4.24Å; W648-P731 HydrophobicContact CH2-CG 3.61Å; W648-P731 HydrophobicContact CZ2-CG 3.87Å; W648-P731 HydrophobicContact CZ3-CG 4.45Å; F699-P731 WeakPolarHBondContact O-CD 3.41Å; L700-P731 HydrophobicContact CD1-CB 4.39Å; L700-P731 HydrophobicContact CD1-CG 3.77Å; Y701-P731 PolarHBondContact N-O 3.5Å
732	V	94.1	Very high	77.9	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.012	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	104	177.8	-174.6	0	0	0	0	110.3	I31 D32 I659 T713 R714 L717 L734	I31-V732 WeakPolarHBondContact CG2-O 3.25Å; D32-V732 PolarHBondContact OD2-N 2.93Å; I659-V732 HydrophobicContact CD1-CG1 3.93Å; T713-V732 HydrophobicContact CG2-CG1 4.04Å; R714-V732 HydrophobicContact CG-CB 4.34Å; R714-V732 HydrophobicContact CG-CG2 3.76Å; L717-V732 HydrophobicContact CD1-CG2 3.64Å; V732-L734 HydrophobicContact CG1-CD1 4.47Å; V732-L734 HydrophobicContact CG1-CD2 3.89Å; V732-L734 HydrophobicContact CG1-CG 4.06Å
733	L	91.3	Very high	75.9	Confident	12 Å²	12	51.5 Å²	51.5	6%	0.063	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	134.3	171.5	-58.3	-178.2	0	0	0	110.9	I31 L700 Y701 C702 S703 I763	I31-L733 HydrophobicContact CG2-CD2 4.26Å; L700-L733 HydrophobicContact CD1-CD1 3.75Å; L700-L733 HydrophobicContact CD1-CG 3.82Å; L700-L733 HydrophobicContact CD2-CD1 4.09Å; L700-L733 HydrophobicContact CG-CD1 4.15Å; Y701-L733 PolarHBondContact O-N 2.97Å; C702-L733 CarbonylContact C-O 3.16Å; C702-L733 WeakPolarHBondContact CA-O 3.29Å; S703-L733 PolarHBondContact N-O 3.23Å; L733-I763 HydrophobicContact CD1-CG1 4.06Å
734	L	88.4	Confident	74.2	Confident	4 Å²	4	44.6 Å²	44.6	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	170.5	-174.3	-61.9	172.2	0	0	0	110.1	I31 S703 R705 A710 V732 P736	I31-L734 HydrophobicContact CD1-CB 4.03Å; I31-L734 WeakPolarHBondContact CD1-O 3.33Å; I31-L734 HydrophobicContact CG1-CB 4.2Å; S703-L734 WeakPolarHBondContact O-CA 3.43Å; R705-L734 HydrophobicContact CB-CD2 4.17Å; A710-L734 HydrophobicContact CB-CD1 3.5Å; V732-L734 HydrophobicContact CG1-CD1 4.47Å; V732-L734 HydrophobicContact CG1-CD2 3.89Å; V732-L734 HydrophobicContact CG1-CG 4.06Å; L734-P736 VanDerWaalsContact O-CD 3.31Å; L734-P736 WeakPolarHBondContact O-CD 3.47Å
735	S	81.8	Confident	72.5	Confident	6 Å²	6	47.5 Å²	47.5	4%	0.042	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	124.2	165.7	-176.3	0	0	0	0	110.1	R705 I707 S737	R705-S735 WeakPolarHBondContact O-CB 3.43Å; R705-S735 PolarHBondContact O-N 2.93Å; I707-S735 PolarHBondContact N-O 3.35Å; S735-S737 PolarHBondContact O-N 3.22Å; S735-S737 PolarHBondContact OG-OG 2.77Å; S735-S737 VanDerWaalsContact OG-OG 3.12Å
736	P	72	Confident	70.6	Confident	36 Å²	36	50.4 Å²	50.4	23%	0.234	27%	0.269	C	S	.	.	S	Bend	trans	-62.3	-5.6	176	-25	35.3	0	0	0	114.9	I31 H49 L734 F755	I31-P736 HydrophobicContact CD1-CB 4.35Å; I31-P736 HydrophobicContact CD1-CG 4Å; H49-P736 HydrophobicContact CB-CB 4.49Å; L734-P736 VanDerWaalsContact O-CD 3.31Å; L734-P736 WeakPolarHBondContact O-CD 3.47Å; P736-F755 VanDerWaalsContact CD-CZ 3.44Å; P736-F755 HydrophobicContact CG-CE2 4.44Å; P736-F755 HydrophobicContact CG-CZ 4.31Å
737	S	68.1	Low	68.6	Low	19 Å²	19	51.7 Å²	51.7	13%	0.133	28%	0.28	C	S	.	.			trans	-104.4	115.3	-172.1	73.1	0	0	0	0	113.3	A706 S735 L739 H744	A706-S737 VanDerWaalsContact CB-O 3.28Å; A706-S737 WeakPolarHBondContact CB-O 3.14Å; S735-S737 PolarHBondContact O-N 3.22Å; S735-S737 PolarHBondContact OG-OG 2.77Å; S735-S737 VanDerWaalsContact OG-OG 3.12Å; S737-L739 PolarHBondContact O-N 2.96Å; S737-L739 VanDerWaalsContact O-N 3.09Å; S737-H744 WeakPolarHBondContact CB-ND1 3.49Å; S737-H744 PolarHBondContact OG-ND1 2.98Å
738	S	57.9	Low	66.7	Low	0 Å²	0	53 Å²	53	0%	0	29%	0.287	C	S	.	.			trans	-80.5	40.7	163.2	-36.4	0	0	0	0	112.2	R51 I707 F740	R51-S738 WeakPolarHBondContact CD-OG 3.49Å; R51-S738 PolarHBondContact NE-OG 3.4Å; I707-S738 WeakPolarHBondContact CG2-OG 3.32Å; S738-F740 WeakPolarHBondContact O-CD2 3.49Å
739	L	50.5	Low	64.6	Low	81 Å²	81	58.5 Å²	58.5	42%	0.424	31%	0.311	S	S	.	.	S	Bend	trans	48.5	69.9	173.2	-65.4	171.6	0	0	0	117.1	S737 R745	S737-L739 PolarHBondContact O-N 2.96Å; S737-L739 VanDerWaalsContact O-N 3.09Å; L739-R745 HydrophobicContact CD2-CB 4.42Å; L739-R745 HydrophobicContact CD2-CG 4.4Å
740	F	38.3	Very low	62.8	Low	123 Å²	123	60.5 Å²	60.5	54%	0.539	32%	0.317	S	S	.	.			trans	-132.7	-0.6	169.9	-90.5	-81.9	0	0	0	117.7	A25 S738	A25-F740 HydrophobicContact CB-CD2 4.36Å; A25-F740 HydrophobicContact CB-CE2 3.33Å; A25-F740 HydrophobicContact CB-CZ 3.62Å; S738-F740 WeakPolarHBondContact O-CD2 3.49Å
741	S	44.4	Very low	61.3	Low	81 Å²	81	65.4 Å²	65.4	57%	0.566	34%	0.337	S	S	*	.			trans	-106	116.2	167.8	-68.1	0	0	0	0	109.2	L743 H744 R745	S741-L743 VanDerWaalsContact C-N 3.27Å; S741-L743 PolarHBondContact O-N 3.04Å; S741-H744 PolarHBondContact O-N 2.9Å; S741-R745 PolarHBondContact O-N 3.43Å; S741-R745 VanDerWaalsContact O-N 3.08Å
742	A	35.8	Very low	59.9	Low	86 Å²	86	67.6 Å²	67.6	71%	0.711	35%	0.351	S	S	*	.	H	α-helix	trans	-56.4	-41.6	-179.4	0	0	0	0	0	112.2	H744 R745 E746	A742-H744 VanDerWaalsContact C-N 3.33Å; A742-H744 PolarHBondContact O-N 3.18Å; A742-R745 WeakPolarHBondContact O-CB 3.28Å; A742-R745 PolarHBondContact O-N 2.66Å; A742-E746 PolarHBondContact O-N 3.31Å
743	L	44.4	Very low	59	Low	134 Å²	134	69.1 Å²	69.1	70%	0.702	36%	0.359	S	S	*	.	H	α-helix	trans	-59.4	-38.5	174.1	-68.2	164.2	0	0	0	113.3	S741 E746 V747	S741-L743 VanDerWaalsContact C-N 3.27Å; S741-L743 PolarHBondContact O-N 3.04Å; L743-E746 PolarHBondContact O-N 2.75Å; L743-V747 WeakPolarHBondContact O-CG2 3.06Å; L743-V747 PolarHBondContact O-N 3.49Å
744	H	49.5	Very low	58.4	Low	75 Å²	75	74.6 Å²	74.6	35%	0.347	38%	0.382	S	S	.	.	H	α-helix	trans	-74.3	-31.9	-179.9	-159	-97.4	0	0	0	111.6	S737 S741 A742 I748	S737-H744 WeakPolarHBondContact CB-ND1 3.49Å; S737-H744 PolarHBondContact OG-ND1 2.98Å; S741-H744 PolarHBondContact O-N 2.9Å; A742-H744 VanDerWaalsContact C-N 3.33Å; A742-H744 PolarHBondContact O-N 3.18Å; H744-I748 WeakPolarHBondContact CE1-CD1 3.19Å; H744-I748 PolarHBondContact O-N 3.18Å; H744-I748 VanDerWaalsContact O-N 3.07Å
745	R	48.4	Very low	57.9	Low	122 Å²	122	76.4 Å²	76.4	46%	0.46	39%	0.39	S	S	.	.	H	α-helix	trans	-63.1	-49.4	167.8	-176.8	170.3	-172.2	136.7	14.8	110.1	L739 S741 A742 V747 I748 E749	L739-R745 HydrophobicContact CD2-CB 4.42Å; L739-R745 HydrophobicContact CD2-CG 4.4Å; S741-R745 PolarHBondContact O-N 3.43Å; S741-R745 VanDerWaalsContact O-N 3.08Å; A742-R745 WeakPolarHBondContact O-CB 3.28Å; A742-R745 PolarHBondContact O-N 2.66Å; R745-V747 VanDerWaalsContact C-N 3.33Å; R745-V747 PolarHBondContact O-N 3Å; R745-I748 PolarHBondContact O-N 3.36Å; R745-E749 WeakPolarHBondContact CD-OE2 3.49Å; R745-E749 HydrophobicContact CG-CB 4.38Å; R745-E749 WeakPolarHBondContact CG-OE2 3.2Å; R745-E749 IonicContact CZ-OE1 2.69Å; R745-E749 IonicContact CZ-OE2 3.56Å; R745-E749 IonicContact NE-OE1 3.58Å; R745-E749 PolarHBondContact NE-OE1 3.34Å; R745-E749 IonicContact NE-OE2 2.59Å; R745-E749 PolarHBondContact NE-OE2 3.14Å; R745-E749 IonicContact NH2-OE1 3.34Å; R745-E749 PolarHBondContact NH2-OE1 2.73Å; R745-E749 IonicContact NH2-OE2 2.73Å; R745-E749 WeakPolarHBondContact O-CA 3.41Å; R745-E749 WeakPolarHBondContact O-CB 3.45Å; R745-E749 PolarHBondContact O-N 2.69Å
746	E	49.7	Very low	58.1	Low	96 Å²	96	77.4 Å²	77.4	45%	0.449	39%	0.393	S	S	.	.	H	α-helix	trans	-57.2	-42.5	177.5	-178.2	169.3	-160.5	0	0	113.2	A742 L743 K750	A742-E746 PolarHBondContact O-N 3.31Å; L743-E746 PolarHBondContact O-N 2.75Å; E746-K750 HydrophobicContact CG-CD 3.84Å; E746-K750 WeakPolarHBondContact O-CB 3.48Å; E746-K750 VanDerWaalsContact O-CG 3.23Å; E746-K750 WeakPolarHBondContact O-CG 3.47Å; E746-K750 PolarHBondContact O-N 3.1Å; E746-K750 IonicContact OE1-NZ 3.81Å; E746-K750 PolarHBondContact OE1-NZ 3.38Å
747	V	51.8	Low	59	Low	90 Å²	90	77.1 Å²	77.1	55%	0.545	39%	0.391	S	S	.	.	H	α-helix	trans	-69.4	-49.5	179.3	173.2	0	0	0	0	112.2	L743 R745 K751	L743-V747 WeakPolarHBondContact O-CG2 3.06Å; L743-V747 PolarHBondContact O-N 3.49Å; R745-V747 VanDerWaalsContact C-N 3.33Å; R745-V747 PolarHBondContact O-N 3Å; V747-K751 PolarHBondContact O-N 3.27Å
748	I	52.2	Low	59.9	Low	31 Å²	31	82.9 Å²	82.9	16%	0.159	42%	0.416	C	S	.	.	H	α-helix	trans	-74.7	-36.1	-177.1	-68.7	-170	0	0	0	112.3	H744 R745 K750 P752 F755	H744-I748 WeakPolarHBondContact CE1-CD1 3.19Å; H744-I748 PolarHBondContact O-N 3.18Å; H744-I748 VanDerWaalsContact O-N 3.07Å; R745-I748 PolarHBondContact O-N 3.36Å; I748-K750 VanDerWaalsContact C-N 3.34Å; I748-P752 WeakPolarHBondContact O-CD 3.35Å; I748-F755 HydrophobicContact CD1-CB 4.41Å; I748-F755 HydrophobicContact CD1-CD2 4.12Å; I748-F755 HydrophobicContact CD1-CG 4.07Å; I748-F755 HydrophobicContact CG1-CB 4.37Å
749	E	51.2	Low	61.4	Low	126 Å²	126	84.5 Å²	84.5	59%	0.589	43%	0.426	S	S	*	.	H	α-helix	trans	-76.3	-22.4	-179.1	-160.7	163.5	-131.9	0	0	112	R745	R745-E749 WeakPolarHBondContact CD-OE2 3.49Å; R745-E749 HydrophobicContact CG-CB 4.38Å; R745-E749 WeakPolarHBondContact CG-OE2 3.2Å; R745-E749 IonicContact CZ-OE1 2.69Å; R745-E749 IonicContact CZ-OE2 3.56Å; R745-E749 IonicContact NE-OE1 3.58Å; R745-E749 PolarHBondContact NE-OE1 3.34Å; R745-E749 IonicContact NE-OE2 2.59Å; R745-E749 PolarHBondContact NE-OE2 3.14Å; R745-E749 IonicContact NH2-OE1 3.34Å; R745-E749 PolarHBondContact NH2-OE1 2.73Å; R745-E749 IonicContact NH2-OE2 2.73Å; R745-E749 WeakPolarHBondContact O-CA 3.41Å; R745-E749 WeakPolarHBondContact O-CB 3.45Å; R745-E749 PolarHBondContact O-N 2.69Å
750	K	56.1	Low	63.4	Low	142 Å²	142	80.8 Å²	80.8	62%	0.617	41%	0.407	S	S	*	.	H	α-helix	trans	-90.5	-32.7	170.2	-67.4	179.4	176.2	178	0	114.3	E746 I748	E746-K750 HydrophobicContact CG-CD 3.84Å; E746-K750 WeakPolarHBondContact O-CB 3.48Å; E746-K750 VanDerWaalsContact O-CG 3.23Å; E746-K750 WeakPolarHBondContact O-CG 3.47Å; E746-K750 PolarHBondContact O-N 3.1Å; E746-K750 IonicContact OE1-NZ 3.81Å; E746-K750 PolarHBondContact OE1-NZ 3.38Å; I748-K750 VanDerWaalsContact C-N 3.34Å
751	K	65.6	Low	66	Low	107 Å²	107	76.8 Å²	76.8	47%	0.465	39%	0.393	S	S	.	.			trans	-143.2	65.7	-172.1	-67.6	-156.9	177.6	-159.5	0	114.1	V747 E753 K754	V747-K751 PolarHBondContact O-N 3.27Å; K751-E753 VanDerWaalsContact CA-OE2 3.31Å; K751-E753 WeakPolarHBondContact CA-OE2 3.31Å; K751-E753 VanDerWaalsContact CB-OE1 3.23Å; K751-E753 WeakPolarHBondContact CB-OE1 3.34Å; K751-E753 WeakPolarHBondContact CG-OE1 3.42Å; K751-E753 PolarHBondContact O-N 3.11Å; K751-K754 HydrophobicContact CB-CB 4.47Å; K751-K754 HydrophobicContact CB-CD 4.23Å; K751-K754 HydrophobicContact CB-CG 4.2Å; K751-K754 HydrophobicContact CD-CD 4.15Å; K751-K754 PolarHBondContact O-N 3.47Å
752	P	67.1	Low	68.3	Low	46 Å²	46	75.6 Å²	75.6	30%	0.299	38%	0.38	S	S	.	.	H	α-helix	trans	-64.3	-26.3	-179.3	28.2	-36	0	0	0	113.6	I748 K754 F755 K756	I748-P752 WeakPolarHBondContact O-CD 3.35Å; P752-K754 VanDerWaalsContact C-N 3.32Å; P752-K754 PolarHBondContact O-N 3.37Å; P752-F755 PolarHBondContact O-N 2.93Å; P752-K756 PolarHBondContact O-N 2.94Å; P752-K756 VanDerWaalsContact O-N 3.16Å
753	E	74.5	Confident	71.1	Confident	35 Å²	35	71.6 Å²	71.6	16%	0.164	35%	0.346	C	S	.	.	H	α-helix	trans	-62.2	-36.8	176.2	73.5	-64.4	157.6	0	0	112.2	K751 F755 K756 V757 T783 Y786 S787	K751-E753 VanDerWaalsContact CA-OE2 3.31Å; K751-E753 WeakPolarHBondContact CA-OE2 3.31Å; K751-E753 VanDerWaalsContact CB-OE1 3.23Å; K751-E753 WeakPolarHBondContact CB-OE1 3.34Å; K751-E753 WeakPolarHBondContact CG-OE1 3.42Å; K751-E753 PolarHBondContact O-N 3.11Å; E753-F755 PolarHBondContact O-N 3.28Å; E753-K756 PolarHBondContact O-N 3.13Å; E753-V757 WeakPolarHBondContact O-CG2 3.23Å; E753-V757 PolarHBondContact O-N 3Å; E753-T783 HydrophobicContact CB-CG2 4.32Å; E753-Y786 HydrophobicContact CB-CD1 4.34Å; E753-Y786 HydrophobicContact CG-CD1 4.21Å; E753-Y786 HydrophobicContact CG-CE1 4.43Å; E753-S787 PolarHBondContact O-OG 2.88Å
754	K	78.1	Confident	73.5	Confident	127 Å²	127	68.5 Å²	68.5	55%	0.552	33%	0.326	S	S	*	.	H	α-helix	trans	-62.4	-43.5	176.1	-73.6	-167.5	167.5	-158.7	0	112.1	K751 P752 V757 E758	K751-K754 HydrophobicContact CB-CB 4.47Å; K751-K754 HydrophobicContact CB-CD 4.23Å; K751-K754 HydrophobicContact CB-CG 4.2Å; K751-K754 HydrophobicContact CD-CD 4.15Å; K751-K754 PolarHBondContact O-N 3.47Å; P752-K754 VanDerWaalsContact C-N 3.32Å; P752-K754 PolarHBondContact O-N 3.37Å; K754-V757 PolarHBondContact O-N 3.38Å; K754-E758 WeakPolarHBondContact O-CB 3.35Å; K754-E758 PolarHBondContact O-N 3.34Å
755	F	78.7	Confident	75.7	Confident	42 Å²	42	70.9 Å²	70.9	18%	0.184	34%	0.337	C	S	.	.	H	α-helix	trans	-64.8	-40.4	178	176	-98.3	0	0	0	111.7	P736 I748 P752 E753 C759	P736-F755 VanDerWaalsContact CD-CZ 3.44Å; P736-F755 HydrophobicContact CG-CE2 4.44Å; P736-F755 HydrophobicContact CG-CZ 4.31Å; I748-F755 HydrophobicContact CD1-CB 4.41Å; I748-F755 HydrophobicContact CD1-CD2 4.12Å; I748-F755 HydrophobicContact CD1-CG 4.07Å; I748-F755 HydrophobicContact CG1-CB 4.37Å; P752-F755 PolarHBondContact O-N 2.93Å; E753-F755 PolarHBondContact O-N 3.28Å; F755-C759 HydrophobicContact CE1-CB 4.49Å; F755-C759 HydrophobicContact CZ-CB 4.24Å; F755-C759 VanDerWaalsContact O-CB 3.29Å; F755-C759 WeakPolarHBondContact O-CB 3.2Å; F755-C759 PolarHBondContact O-N 3.08Å
756	K	86.7	Confident	77.9	Confident	26 Å²	26	65.2 Å²	65.2	11%	0.113	32%	0.315	C	S	.	.	H	α-helix	trans	-61.4	-46.9	173.3	-75.3	-172.2	176.2	-173	0	112	D658 P752 E753 L760 D784	D658-K756 WeakPolarHBondContact OD2-CE 3.4Å; D658-K756 IonicContact OD2-NZ 2.69Å; D658-K756 PolarHBondContact OD2-NZ 3.09Å; P752-K756 PolarHBondContact O-N 2.94Å; P752-K756 VanDerWaalsContact O-N 3.16Å; E753-K756 PolarHBondContact O-N 3.13Å; K756-L760 VanDerWaalsContact O-CB 3.29Å; K756-L760 WeakPolarHBondContact O-CB 3.31Å; K756-L760 WeakPolarHBondContact O-CG 3.49Å; K756-L760 PolarHBondContact O-N 2.92Å; K756-D784 VanDerWaalsContact NZ-CG 3.31Å; K756-D784 IonicContact NZ-OD1 2.66Å; K756-D784 PolarHBondContact NZ-OD1 3.08Å; K756-D784 IonicContact NZ-OD2 2.66Å
757	V	89.4	Confident	80.1	Confident	31 Å²	31	60.6 Å²	60.6	19%	0.188	29%	0.294	C	S	.	.	H	α-helix	trans	-59.8	-49	177	170.8	0	0	0	0	111.3	E753 K754 T761 Y786 E790	E753-V757 WeakPolarHBondContact O-CG2 3.23Å; E753-V757 PolarHBondContact O-N 3Å; K754-V757 PolarHBondContact O-N 3.38Å; V757-T761 WeakPolarHBondContact O-CB 3.47Å; V757-T761 PolarHBondContact O-N 2.96Å; V757-T761 PolarHBondContact O-OG1 2.94Å; V757-Y786 HydrophobicContact CG2-CE1 4.35Å; V757-E790 HydrophobicContact CG1-CB 4.33Å; V757-E790 HydrophobicContact CG2-CB 4.16Å; V757-E790 HydrophobicContact CG2-CG 4.47Å
758	E	87.4	Confident	81.9	Confident	140 Å²	140	64 Å²	64	65%	0.654	30%	0.298	S	S	*	.	H	α-helix	trans	-59.7	-50.6	-179.8	-175.8	176.5	-173.6	0	0	111.4	K754 T761 D762	K754-E758 WeakPolarHBondContact O-CB 3.35Å; K754-E758 PolarHBondContact O-N 3.34Å; E758-T761 PolarHBondContact O-N 3.48Å; E758-D762 PolarHBondContact O-N 3.47Å
759	C	88.6	Confident	83.7	Confident	33 Å²	33	65.3 Å²	65.3	22%	0.223	31%	0.308	C	S	.	.	H	α-helix	trans	-63.7	-45.6	-179	-172.6	0	0	0	0	112.5	F755 T761 D762 I763	F755-C759 HydrophobicContact CE1-CB 4.49Å; F755-C759 HydrophobicContact CZ-CB 4.24Å; F755-C759 VanDerWaalsContact O-CB 3.29Å; F755-C759 WeakPolarHBondContact O-CB 3.2Å; F755-C759 PolarHBondContact O-N 3.08Å; C759-T761 VanDerWaalsContact C-N 3.34Å; C759-T761 PolarHBondContact O-N 2.96Å; C759-D762 PolarHBondContact O-N 3.11Å; C759-I763 WeakPolarHBondContact O-CG1 3.47Å; C759-I763 PolarHBondContact O-N 2.91Å
760	L	92.9	Very high	85.6	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.016	29%	0.285	C	S	.	.	H	α-helix	trans	-69.9	-30.6	177.9	-70.3	169.9	0	0	0	112.5	I656 L700 K756 R764 F774 Y788 V791	I656-L760 HydrophobicContact CD1-CD1 4.12Å; I656-L760 HydrophobicContact CD1-CD2 3.98Å; I656-L760 HydrophobicContact CG1-CD2 4.42Å; I656-L760 HydrophobicContact CG2-CD2 4.25Å; L700-L760 HydrophobicContact CD2-CD2 3.87Å; K756-L760 VanDerWaalsContact O-CB 3.29Å; K756-L760 WeakPolarHBondContact O-CB 3.31Å; K756-L760 WeakPolarHBondContact O-CG 3.49Å; K756-L760 PolarHBondContact O-N 2.92Å; L760-R764 WeakPolarHBondContact O-CB 3.28Å; L760-R764 PolarHBondContact O-N 3.31Å; L760-F774 HydrophobicContact CB-CE2 4.41Å; L760-F774 HydrophobicContact CB-CZ 4.35Å; L760-F774 HydrophobicContact CD2-CE1 4.43Å; L760-F774 HydrophobicContact CD2-CZ 4.14Å; L760-F774 WeakPolarHBondContact O-CE2 3.19Å; L760-F774 WeakPolarHBondContact O-CZ 3.18Å; L760-Y788 HydrophobicContact CD1-CD1 3.95Å; L760-Y788 HydrophobicContact CD1-CE1 3.97Å; L760-V791 HydrophobicContact CB-CB 4.36Å; L760-V791 HydrophobicContact CB-CG1 3.75Å; L760-V791 HydrophobicContact CB-CG2 4.19Å; L760-V791 HydrophobicContact CD1-CG2 4.48Å
761	T	93.6	Very high	87.1	Confident	40 Å²	40	57.5 Å²	57.5	25%	0.245	28%	0.281	C	S	.	.	H	α-helix	trans	-67.8	-41.4	172.3	-61.5	0	0	0	0	111.2	V757 E758 C759 I763 R764 H765 V791	V757-T761 WeakPolarHBondContact O-CB 3.47Å; V757-T761 PolarHBondContact O-N 2.96Å; V757-T761 PolarHBondContact O-OG1 2.94Å; E758-T761 PolarHBondContact O-N 3.48Å; C759-T761 VanDerWaalsContact C-N 3.34Å; C759-T761 PolarHBondContact O-N 2.96Å; T761-I763 VanDerWaalsContact C-N 3.33Å; T761-I763 PolarHBondContact O-N 3.05Å; T761-R764 WeakPolarHBondContact O-CB 3.49Å; T761-R764 PolarHBondContact O-N 3.42Å; T761-H765 VanDerWaalsContact CG2-CE1 3.41Å; T761-H765 WeakPolarHBondContact CG2-CE1 3.48Å; T761-H765 PolarHBondContact O-N 3.24Å; T761-H765 VanDerWaalsContact O-N 3.1Å; T761-H765 PolarHBondContact O-ND1 3.04Å; T761-V791 WeakPolarHBondContact OG1-CG1 3.32Å
762	D	92.6	Very high	88.3	Confident	55 Å²	55	58.6 Å²	58.6	29%	0.294	29%	0.288	S	S	.	.	H	α-helix	trans	-62.8	-39.8	175.6	-167.7	42.1	0	0	0	111.9	P47 R609 E758 C759	P47-D762 WeakPolarHBondContact CD-OD2 3.5Å; R609-D762 IonicContact CZ-OD1 3.16Å; R609-D762 IonicContact CZ-OD2 3.1Å; R609-D762 IonicContact NE-OD2 3.63Å; R609-D762 IonicContact NH2-OD1 3.65Å; R609-D762 PolarHBondContact NH2-OD1 3.39Å; R609-D762 IonicContact NH2-OD2 3.24Å; R609-D762 PolarHBondContact NH2-OD2 3.4Å; E758-D762 PolarHBondContact O-N 3.47Å; C759-D762 PolarHBondContact O-N 3.11Å
763	I	95.2	Very high	89.7	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-65.2	-43.2	170.6	-63.8	-51.1	0	0	0	111.6	I34 L700 L733 C759 T761 H765 L766 F767 F774	I34-I763 HydrophobicContact CD1-CD1 4.04Å; I34-I763 HydrophobicContact CD1-CG1 4.47Å; I34-I763 HydrophobicContact CD1-CG2 4.15Å; I34-I763 HydrophobicContact CG1-CD1 4.45Å; L700-I763 HydrophobicContact CD2-CG2 4.28Å; L733-I763 HydrophobicContact CD1-CG1 4.06Å; C759-I763 WeakPolarHBondContact O-CG1 3.47Å; C759-I763 PolarHBondContact O-N 2.91Å; T761-I763 VanDerWaalsContact C-N 3.33Å; T761-I763 PolarHBondContact O-N 3.05Å; I763-H765 VanDerWaalsContact C-N 3.25Å; I763-H765 PolarHBondContact O-N 3.43Å; I763-L766 HydrophobicContact CD1-CD1 3.82Å; I763-L766 VanDerWaalsContact O-CB 3.31Å; I763-L766 WeakPolarHBondContact O-CB 3.34Å; I763-L766 PolarHBondContact O-N 3.46Å; I763-F767 HydrophobicContact CG2-CE2 3.94Å; I763-F767 VanDerWaalsContact O-CD2 3.25Å; I763-F767 WeakPolarHBondContact O-CD2 3.4Å; I763-F767 WeakPolarHBondContact O-CE2 3.35Å; I763-F774 HydrophobicContact CB-CZ 4.32Å; I763-F774 HydrophobicContact CG2-CE1 4.24Å; I763-F774 HydrophobicContact CG2-CZ 4.06Å
764	R	95.1	Very high	90.8	Very high	70 Å²	70	55.1 Å²	55.1	26%	0.264	27%	0.267	S	S	.	.	H	α-helix	trans	-54.3	-42.2	178.1	-171.8	-173.6	178.8	-174.9	3.1	112	L760 T761 L766 F767 T771 P773 F774 V791	L760-R764 WeakPolarHBondContact O-CB 3.28Å; L760-R764 PolarHBondContact O-N 3.31Å; T761-R764 WeakPolarHBondContact O-CB 3.49Å; T761-R764 PolarHBondContact O-N 3.42Å; R764-L766 PolarHBondContact O-N 3.29Å; R764-F767 PolarHBondContact O-N 2.82Å; R764-T771 VanDerWaalsContact CZ-O 3.29Å; R764-T771 PolarHBondContact NE-O 3.39Å; R764-T771 PolarHBondContact NH2-O 3.23Å; R764-P773 HydrophobicContact CG-CG 4.06Å; R764-F774 HydrophobicContact CB-CE2 3.88Å; R764-F774 HydrophobicContact CB-CZ 4.45Å; R764-F774 HydrophobicContact CG-CE2 4.37Å; R764-V791 WeakPolarHBondContact CD-O 3.29Å
765	H	94.6	Very high	91.6	Very high	125 Å²	125	50.3 Å²	50.3	58%	0.579	25%	0.246	S	C	*	.	H	α-helix	trans	-66.5	-19.2	-180	-64.5	145.6	0	0	0	114.1	T761 I763 F767	T761-H765 VanDerWaalsContact CG2-CE1 3.41Å; T761-H765 WeakPolarHBondContact CG2-CE1 3.48Å; T761-H765 PolarHBondContact O-N 3.24Å; T761-H765 VanDerWaalsContact O-N 3.1Å; T761-H765 PolarHBondContact O-ND1 3.04Å; I763-H765 VanDerWaalsContact C-N 3.25Å; I763-H765 PolarHBondContact O-N 3.43Å; H765-F767 PolarHBondContact O-N 3.33Å
766	L	95.1	Very high	92.5	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.01	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-13.1	174.3	-56.2	176.8	0	0	0	113.6	I34 V36 H38 H44 I763 R764	I34-L766 HydrophobicContact CB-CD1 4.43Å; V36-L766 HydrophobicContact CB-CB 4.34Å; V36-L766 WeakPolarHBondContact CB-O 3.43Å; V36-L766 VanDerWaalsContact CG1-O 3.25Å; V36-L766 WeakPolarHBondContact CG1-O 3.25Å; V36-L766 HydrophobicContact CG2-CB 3.67Å; V36-L766 WeakPolarHBondContact CG2-O 3.3Å; H38-L766 PolarHBondContact NE2-O 3.35Å; H38-L766 VanDerWaalsContact NE2-O 3.11Å; H44-L766 HydrophobicContact CB-CD2 4.21Å; I763-L766 HydrophobicContact CD1-CD1 3.82Å; I763-L766 VanDerWaalsContact O-CB 3.31Å; I763-L766 WeakPolarHBondContact O-CB 3.34Å; I763-L766 PolarHBondContact O-N 3.46Å; R764-L766 PolarHBondContact O-N 3.29Å
767	F	95.8	Very high	93	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	5.3	-176.4	-65.9	-91.5	0	0	0	113.6	I34 V36 W648 I654 I763 R764 H765 N770 P773	I34-F767 HydrophobicContact CG2-CZ 4.3Å; V36-F767 HydrophobicContact CB-CE1 4.46Å; V36-F767 HydrophobicContact CG1-CD1 3.89Å; V36-F767 HydrophobicContact CG1-CE1 3.93Å; V36-F767 HydrophobicContact CG1-CG 4.46Å; V36-F767 HydrophobicContact CG2-CD1 4.14Å; V36-F767 HydrophobicContact CG2-CD2 4.28Å; V36-F767 HydrophobicContact CG2-CE1 3.6Å; V36-F767 HydrophobicContact CG2-CE2 3.76Å; V36-F767 HydrophobicContact CG2-CG 4.42Å; V36-F767 HydrophobicContact CG2-CZ 3.36Å; W648-F767 HydrophobicContact CE3-CE1 4.39Å; W648-F767 AromaticContact CE3-CZ 3.97Å; W648-F767 HydrophobicContact CE3-CZ 3.97Å; I654-F767 HydrophobicContact CD1-CD2 4.22Å; I654-F767 HydrophobicContact CD1-CE1 4Å; I654-F767 HydrophobicContact CD1-CE2 3.63Å; I654-F767 HydrophobicContact CD1-CZ 3.52Å; I763-F767 HydrophobicContact CG2-CE2 3.94Å; I763-F767 VanDerWaalsContact O-CD2 3.25Å; I763-F767 WeakPolarHBondContact O-CD2 3.4Å; I763-F767 WeakPolarHBondContact O-CE2 3.35Å; R764-F767 PolarHBondContact O-N 2.82Å; H765-F767 PolarHBondContact O-N 3.33Å; F767-N770 HydrophobicContact CB-CB 4.48Å; F767-N770 WeakPolarHBondContact O-CA 3.47Å; F767-N770 VanDerWaalsContact O-CB 3.29Å; F767-N770 WeakPolarHBondContact O-CB 3.41Å; F767-N770 PolarHBondContact O-N 3.07Å; F767-P773 HydrophobicContact CB-CB 3.77Å; F767-P773 HydrophobicContact CB-CG 3.98Å; F767-P773 HydrophobicContact CD1-CB 4.1Å; F767-P773 HydrophobicContact CD2-CB 3.9Å; F767-P773 HydrophobicContact CD2-CG 4.01Å; F767-P773 HydrophobicContact CG-CB 3.61Å; F767-P773 HydrophobicContact CG-CG 4.06Å
768	Y	89.8	Confident	93.4	Very high	161 Å²	161	45.6 Å²	45.6	63%	0.631	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.8	128.4	178.2	-173.8	-90.7	0	0	0	111	H38	H38-Y768 PolarHBondContact CE1-O 3.34Å; H38-Y768 VanDerWaalsContact CE1-O 3.24Å; H38-Y768 PolarHBondContact ND1-O 2.85Å
769	P	89	Confident	93.8	Very high	58 Å²	58	39 Å²	39	38%	0.377	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	cis	-88.3	-2	19	34.9	-37.7	0	0	0	116.6	P39 W650 T771	P39-P769 HydrophobicContact CG-CG 4.03Å; W650-P769 HydrophobicContact CE3-CG 3.97Å; W650-P769 HydrophobicContact CZ3-CG 4.01Å; P769-T771 PolarHBondContact O-N 3.06Å; P769-T771 VanDerWaalsContact O-N 3.08Å
770	N	91.1	Very high	93.9	Very high	17 Å²	17	38.9 Å²	38.9	9%	0.091	19%	0.189	C	C	.	.			trans	-72.5	100.3	176.3	166.9	24.9	0	0	0	110.3	W650 K653 F767 E772	W650-N770 HydrophobicContact CE3-CB 3.74Å; W650-N770 HydrophobicContact CZ3-CB 4.09Å; W650-N770 VanDerWaalsContact O-CB 3.27Å; W650-N770 WeakPolarHBondContact O-CB 3.45Å; W650-N770 PolarHBondContact O-ND2 3.28Å; K653-N770 PolarHBondContact NZ-ND2 2.77Å; K653-N770 PolarHBondContact NZ-OD1 3.01Å; F767-N770 HydrophobicContact CB-CB 4.48Å; F767-N770 WeakPolarHBondContact O-CA 3.47Å; F767-N770 VanDerWaalsContact O-CB 3.29Å; F767-N770 WeakPolarHBondContact O-CB 3.41Å; F767-N770 PolarHBondContact O-N 3.07Å; N770-E772 VanDerWaalsContact C-N 3.25Å; N770-E772 PolarHBondContact O-N 3.39Å; N770-E772 PolarHBondContact OD1-N 3.43Å; N770-E772 PolarHBondContact OD1-O 3.19Å
771	T	87.4	Confident	93.8	Very high	87 Å²	87	44.3 Å²	44.3	53%	0.534	21%	0.21	S	C	.	.	S	Bend	trans	-73.2	-11.6	-179.3	50.8	0	0	0	0	114.3	R764 P769	R764-T771 VanDerWaalsContact CZ-O 3.29Å; R764-T771 PolarHBondContact NE-O 3.39Å; R764-T771 PolarHBondContact NH2-O 3.23Å; P769-T771 PolarHBondContact O-N 3.06Å; P769-T771 VanDerWaalsContact O-N 3.08Å
772	E	91.9	Very high	93.7	Very high	131 Å²	131	47.8 Å²	47.8	61%	0.612	23%	0.233	S	C	*	.			trans	-131.8	65.1	-176.1	-63.9	-175.3	167.2	0	0	111.4	K653 N770	K653-E772 PolarHBondContact NZ-O 2.97Å; N770-E772 VanDerWaalsContact C-N 3.25Å; N770-E772 PolarHBondContact O-N 3.39Å; N770-E772 PolarHBondContact OD1-N 3.43Å; N770-E772 PolarHBondContact OD1-O 3.19Å
773	P	95.5	Very high	93.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.231	C	C	.	.			trans	-73.1	-32.4	178.5	30.9	-35.2	0	0	0	112.4	K653 I654 R764 F767 Y775	K653-P773 WeakPolarHBondContact CA-O 3.32Å; I654-P773 HydrophobicContact CD1-CB 4Å; I654-P773 HydrophobicContact CG1-CB 4.49Å; I654-P773 PolarHBondContact N-O 2.93Å; R764-P773 HydrophobicContact CG-CG 4.06Å; F767-P773 HydrophobicContact CB-CB 3.77Å; F767-P773 HydrophobicContact CB-CG 3.98Å; F767-P773 HydrophobicContact CD1-CB 4.1Å; F767-P773 HydrophobicContact CD2-CB 3.9Å; F767-P773 HydrophobicContact CD2-CG 4.01Å; F767-P773 HydrophobicContact CG-CB 3.61Å; F767-P773 HydrophobicContact CG-CG 4.06Å; P773-Y775 PolarHBondContact O-N 3.03Å
774	F	97.5	Very high	93.4	Very high	8 Å²	8	47.1 Å²	47.1	4%	0.035	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	115.8	178.7	-53.7	-55.9	0	0	0	110.9	I654 I656 L700 L760 I763 R764 V791 V793	I654-F774 HydrophobicContact CB-CD1 3.9Å; I654-F774 HydrophobicContact CB-CE1 4.43Å; I654-F774 HydrophobicContact CD1-CD1 4.2Å; I654-F774 HydrophobicContact CD1-CE1 4.06Å; I654-F774 HydrophobicContact CG2-CD1 4Å; I654-F774 HydrophobicContact CG2-CE1 4.22Å; I656-F774 HydrophobicContact CD1-CB 4.23Å; I656-F774 HydrophobicContact CD1-CD1 3.69Å; I656-F774 HydrophobicContact CD1-CD2 4.21Å; I656-F774 HydrophobicContact CD1-CE1 4.05Å; I656-F774 HydrophobicContact CD1-CE2 4.49Å; I656-F774 HydrophobicContact CD1-CG 3.8Å; I656-F774 HydrophobicContact CD1-CZ 4.44Å; I656-F774 HydrophobicContact CG1-CD1 3.69Å; I656-F774 HydrophobicContact CG1-CE1 4.1Å; I656-F774 HydrophobicContact CG1-CG 4.24Å; L700-F774 HydrophobicContact CD2-CE1 3.84Å; L760-F774 HydrophobicContact CB-CE2 4.41Å; L760-F774 HydrophobicContact CB-CZ 4.35Å; L760-F774 HydrophobicContact CD2-CE1 4.43Å; L760-F774 HydrophobicContact CD2-CZ 4.14Å; L760-F774 WeakPolarHBondContact O-CE2 3.19Å; L760-F774 WeakPolarHBondContact O-CZ 3.18Å; I763-F774 HydrophobicContact CB-CZ 4.32Å; I763-F774 HydrophobicContact CG2-CE1 4.24Å; I763-F774 HydrophobicContact CG2-CZ 4.06Å; R764-F774 HydrophobicContact CB-CE2 3.88Å; R764-F774 HydrophobicContact CB-CZ 4.45Å; R764-F774 HydrophobicContact CG-CE2 4.37Å; F774-V791 HydrophobicContact CD2-CB 4.25Å; F774-V791 HydrophobicContact CD2-CG2 3.79Å; F774-V791 HydrophobicContact CE2-CB 4.08Å; F774-V791 HydrophobicContact CE2-CG2 3.87Å; F774-V793 HydrophobicContact CB-CG2 3.69Å; F774-V793 HydrophobicContact CG-CG2 4.47Å
775	Y	96.8	Very high	93.3	Very high	26 Å²	26	44.4 Å²	44.4	10%	0.102	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-39.9	-179.3	179.9	-89.1	0	0	0	112.2	I654 I655 Y697 P773 R797 V829 F830 P831	I654-Y775 PolarHBondContact O-N 2.85Å; I655-Y775 HydrophobicContact CD1-CD1 3.91Å; I655-Y775 HydrophobicContact CD1-CG 4.47Å; Y697-Y775 HydrophobicContact CD1-CD1 4.24Å; Y697-Y775 HydrophobicContact CD1-CG 4.11Å; Y697-Y775 AromaticContact CE1-CD1 3.66Å; Y697-Y775 HydrophobicContact CE1-CD1 3.66Å; Y697-Y775 AromaticContact CE1-CD2 3.56Å; Y697-Y775 HydrophobicContact CE1-CD2 3.56Å; Y697-Y775 AromaticContact CE1-CE1 3.97Å; Y697-Y775 HydrophobicContact CE1-CE1 3.97Å; Y697-Y775 AromaticContact CE1-CE2 3.84Å; Y697-Y775 HydrophobicContact CE1-CE2 3.84Å; Y697-Y775 AromaticContact CE1-CG 3.47Å; Y697-Y775 HydrophobicContact CE1-CG 3.47Å; Y697-Y775 VanDerWaalsContact CE1-CG 3.47Å; Y697-Y775 AromaticContact CZ-CE2 3.98Å; Y697-Y775 AromaticContact CZ-CZ 3.91Å; Y697-Y775 VanDerWaalsContact OH-CE2 3.28Å; Y697-Y775 WeakPolarHBondContact OH-CE2 3.31Å; Y697-Y775 PolarHBondContact OH-OH 3.48Å; P773-Y775 PolarHBondContact O-N 3.03Å; Y775-R797 VanDerWaalsContact CE2-NH1 3.28Å; Y775-R797 WeakPolarHBondContact O-CB 3.33Å; Y775-R797 WeakPolarHBondContact O-CD 3.45Å; Y775-R797 PolarHBondContact OH-NE 2.89Å; Y775-R797 PolarHBondContact OH-NH2 3.47Å; Y775-R797 VanDerWaalsContact OH-NH2 3.09Å; Y775-V829 WeakPolarHBondContact CE1-O 3.33Å; Y775-V829 PolarHBondContact OH-O 3.19Å; Y775-F830 AromaticContact CD1-CD1 3.85Å; Y775-F830 HydrophobicContact CD1-CD1 3.85Å; Y775-F830 HydrophobicContact CD1-CE1 4.13Å; Y775-F830 AromaticContact CE1-CD1 3.5Å; Y775-F830 HydrophobicContact CE1-CD1 3.5Å; Y775-F830 AromaticContact CE1-CE1 4Å; Y775-F830 HydrophobicContact CE1-CE1 4Å; Y775-F830 HydrophobicContact CE1-CG 4.31Å; Y775-P831 VanDerWaalsContact OH-CD 3.24Å; Y775-P831 WeakPolarHBondContact OH-CD 3.42Å
776	A	97.3	Very high	93.3	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	164.6	-177.6	0	0	0	0	0	111	I655 I656 R797 F830	I655-A776 WeakPolarHBondContact CA-O 3.26Å; I655-A776 HydrophobicContact CD1-CB 3.97Å; I656-A776 PolarHBondContact N-O 3.07Å; A776-R797 VanDerWaalsContact CA-O 3.31Å; A776-R797 WeakPolarHBondContact CA-O 3.31Å; A776-R797 HydrophobicContact CB-CB 3.86Å; A776-R797 WeakPolarHBondContact CB-O 3.35Å; A776-F830 HydrophobicContact CB-CE1 3.7Å; A776-F830 HydrophobicContact CB-CZ 4.36Å
777	A	97.5	Very high	93.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	143.8	174.8	0	0	0	0	0	112.9	I656 Y788 V793 R797 I798 F799	I656-A777 HydrophobicContact CB-CB 3.97Å; I656-A777 HydrophobicContact CD1-CB 4.38Å; I656-A777 CarbonylContact O-C 3.5Å; I656-A777 VanDerWaalsContact O-CA 3.31Å; I656-A777 WeakPolarHBondContact O-CA 3.48Å; A777-Y788 HydrophobicContact CB-CD1 3.81Å; A777-Y788 HydrophobicContact CB-CD2 3.36Å; A777-Y788 HydrophobicContact CB-CE1 4.22Å; A777-Y788 HydrophobicContact CB-CE2 3.8Å; A777-Y788 HydrophobicContact CB-CG 3.37Å; A777-V793 HydrophobicContact CB-CG1 4.11Å; A777-V793 HydrophobicContact CB-CG2 4.26Å; A777-R797 PolarHBondContact N-O 3.19Å; A777-I798 WeakPolarHBondContact O-CA 3.27Å; A777-F799 PolarHBondContact O-N 3.35Å
778	F	97.1	Very high	93.2	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128.9	173	-65	-91.7	0	0	0	109.6	I655 I656 S657 D658 T662 L688 Y689 Y788 F799 L807 Y819 L822 F830	I655-F778 HydrophobicContact CG2-CD2 3.83Å; I655-F778 HydrophobicContact CG2-CE2 3.71Å; I656-F778 PolarHBondContact O-N 3Å; S657-F778 WeakPolarHBondContact CA-O 3.39Å; D658-F778 PolarHBondContact N-O 3.11Å; T662-F778 HydrophobicContact CG2-CB 3.91Å; L688-F778 HydrophobicContact CD2-CE1 4Å; L688-F778 HydrophobicContact CD2-CZ 3.83Å; Y689-F778 HydrophobicContact CE1-CD1 4.38Å; Y689-F778 AromaticContact CE1-CD2 3.91Å; Y689-F778 HydrophobicContact CE1-CD2 3.91Å; Y689-F778 HydrophobicContact CE1-CE1 4.39Å; Y689-F778 AromaticContact CE1-CE2 3.93Å; Y689-F778 HydrophobicContact CE1-CE2 3.93Å; Y689-F778 HydrophobicContact CE1-CG 4.16Å; Y689-F778 HydrophobicContact CE1-CZ 4.17Å; Y689-F778 VanDerWaalsContact OH-CB 3.27Å; Y689-F778 WeakPolarHBondContact OH-CB 3.27Å; Y689-F778 VanDerWaalsContact OH-CG 3.32Å; Y689-F778 WeakPolarHBondContact OH-CG 3.45Å; F778-Y788 PolarHBondContact O-OH 3.33Å; F778-F799 WeakPolarHBondContact CA-O 3.27Å; F778-F799 HydrophobicContact CD1-CB 3.69Å; F778-F799 HydrophobicContact CD1-CD2 4.19Å; F778-F799 HydrophobicContact CD1-CG 4.24Å; F778-F799 HydrophobicContact CE1-CB 3.83Å; F778-F799 AromaticContact CE1-CD2 3.72Å; F778-F799 HydrophobicContact CE1-CD2 3.72Å; F778-F799 AromaticContact CE1-CG 3.89Å; F778-F799 HydrophobicContact CE1-CG 3.89Å; F778-F799 HydrophobicContact CE2-CD2 4.39Å; F778-F799 HydrophobicContact CG-CB 4.49Å; F778-F799 AromaticContact CZ-CD2 3.83Å; F778-F799 HydrophobicContact CZ-CD2 3.83Å; F778-F799 HydrophobicContact CZ-CE2 4.3Å; F778-F799 HydrophobicContact CZ-CG 4.44Å; F778-L807 HydrophobicContact CD1-CD2 4.49Å; F778-Y819 AromaticContact CD1-CE1 3.93Å; F778-Y819 HydrophobicContact CD1-CE1 3.93Å; F778-Y819 HydrophobicContact CE1-CE1 4.13Å; F778-L822 HydrophobicContact CE1-CD2 3.85Å; F778-L822 HydrophobicContact CZ-CD2 4.05Å; F778-F830 HydrophobicContact CE2-CZ 4.23Å; F778-F830 AromaticContact CZ-CZ 3.97Å; F778-F830 HydrophobicContact CZ-CZ 3.97Å
779	G	95	Very high	93.5	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	-174	175.5	0	0	0	0	0	111.4	T662 F799 T800 V801	T662-G779 VanDerWaalsContact OG1-CA 3.23Å; T662-G779 WeakPolarHBondContact OG1-CA 3.42Å; G779-F799 PolarHBondContact N-O 3.32Å; G779-T800 CarbonylContact O-C 3.56Å; G779-T800 VanDerWaalsContact O-CA 3.29Å; G779-T800 WeakPolarHBondContact O-CA 3.47Å; G779-V801 PolarHBondContact O-N 3.41Å
780	N	92.3	Very high	93.7	Very high	31 Å²	31	42.9 Å²	42.9	17%	0.166	21%	0.21	C	C	.	.	S	Bend	trans	-135.4	-10	-178.4	67.1	-55	0	0	0	114	D660 G661 T662 D667 D784 V801	D660-N780 PolarHBondContact O-OD1 3.32Å; D660-N780 VanDerWaalsContact O-OD1 3.05Å; G661-N780 WeakPolarHBondContact CA-ND2 3.15Å; G661-N780 VanDerWaalsContact O-CB 3.32Å; G661-N780 WeakPolarHBondContact O-CB 3.41Å; T662-N780 WeakPolarHBondContact OG1-CB 3.22Å; T662-N780 PolarHBondContact OG1-N 2.84Å; T662-N780 PolarHBondContact OG1-OD1 3.47Å; D667-N780 PolarHBondContact OD1-ND2 3.13Å; N780-D784 PolarHBondContact N-OD2 3.28Å; N780-D784 VanDerWaalsContact N-OD2 3.17Å; N780-D784 PolarHBondContact OD1-OD2 3.27Å; N780-V801 WeakPolarHBondContact CA-O 3.45Å; N780-V801 HydrophobicContact CB-CG1 4.07Å
781	R	90.1	Very high	93.9	Very high	117 Å²	117	42.1 Å²	42.1	44%	0.442	21%	0.206	S	C	.	.	S	Bend	trans	-118.5	150.4	-179.9	-63.1	163.4	158.7	-113.4	-3.2	111.3	D667 T783 D784 V785	D667-R781 IonicContact OD2-CZ 3.92Å; D667-R781 IonicContact OD2-NE 3.57Å; D667-R781 PolarHBondContact OD2-NE 3.25Å; D667-R781 IonicContact OD2-NH2 3.31Å; D667-R781 PolarHBondContact OD2-NH2 3.03Å; R781-T783 WeakPolarHBondContact CB-OG1 3.33Å; R781-T783 PolarHBondContact O-N 2.85Å; R781-D784 WeakPolarHBondContact CA-OD2 3.44Å; R781-D784 WeakPolarHBondContact CB-OD2 3.43Å; R781-D784 PolarHBondContact N-OD2 3.19Å; R781-D784 WeakPolarHBondContact O-CB 3.35Å; R781-D784 PolarHBondContact O-N 3.18Å; R781-V785 PolarHBondContact O-N 2.68Å
782	P	90.6	Very high	94.2	Very high	112 Å²	112	39.4 Å²	39.4	73%	0.727	20%	0.196	S	C	*	.	H	α-helix	trans	-62.9	-23.6	174.9	26.5	-34.9	0	0	0	112.9	D784 V785 Y786	P782-D784 PolarHBondContact O-N 3.31Å; P782-V785 PolarHBondContact O-N 3.44Å; P782-Y786 PolarHBondContact O-N 2.9Å
783	T	90.1	Very high	94.4	Very high	42 Å²	42	33.3 Å²	33.3	26%	0.258	17%	0.167	S	C	.	.	H	α-helix	trans	-59.5	-32.5	169.4	47	0	0	0	0	112.9	E753 R781 S787	E753-T783 HydrophobicContact CB-CG2 4.32Å; R781-T783 WeakPolarHBondContact CB-OG1 3.33Å; R781-T783 PolarHBondContact O-N 2.85Å; T783-S787 WeakPolarHBondContact O-CB 3.42Å; T783-S787 PolarHBondContact O-N 3.27Å; T783-S787 PolarHBondContact O-OG 3.44Å
784	D	92.4	Very high	94.4	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-80.5	-44.2	-176.7	-41.1	-30	0	0	0	108.9	K756 N780 R781 P782 Y786 S787 Y788	K756-D784 VanDerWaalsContact NZ-CG 3.31Å; K756-D784 IonicContact NZ-OD1 2.66Å; K756-D784 PolarHBondContact NZ-OD1 3.08Å; K756-D784 IonicContact NZ-OD2 2.66Å; N780-D784 PolarHBondContact N-OD2 3.28Å; N780-D784 VanDerWaalsContact N-OD2 3.17Å; N780-D784 PolarHBondContact OD1-OD2 3.27Å; R781-D784 WeakPolarHBondContact CA-OD2 3.44Å; R781-D784 WeakPolarHBondContact CB-OD2 3.43Å; R781-D784 PolarHBondContact N-OD2 3.19Å; R781-D784 WeakPolarHBondContact O-CB 3.35Å; R781-D784 PolarHBondContact O-N 3.18Å; P782-D784 PolarHBondContact O-N 3.31Å; D784-Y786 VanDerWaalsContact C-N 3.29Å; D784-Y786 PolarHBondContact O-N 2.83Å; D784-S787 CarbonylContact O-C 2.99Å; D784-S787 WeakPolarHBondContact O-CA 3.33Å; D784-S787 WeakPolarHBondContact O-CB 3.23Å; D784-S787 PolarHBondContact O-N 3.09Å; D784-Y788 HydrophobicContact CB-CD2 4.24Å; D784-Y788 HydrophobicContact CB-CE2 3.58Å; D784-Y788 WeakPolarHBondContact O-CD2 3.32Å; D784-Y788 PolarHBondContact O-N 2.89Å
785	V	93.6	Very high	94.2	Very high	14 Å²	14	38.7 Å²	38.7	9%	0.085	20%	0.199	C	C	.	.	H	α-helix	trans	-53.4	-46.3	171.2	179.1	0	0	0	0	111.3	R781 P782 K789 I798 T800 E810	R781-V785 PolarHBondContact O-N 2.68Å; P782-V785 PolarHBondContact O-N 3.44Å; V785-K789 VanDerWaalsContact O-CB 3.31Å; V785-K789 WeakPolarHBondContact O-CB 3.43Å; V785-K789 PolarHBondContact O-N 2.84Å; V785-K789 VanDerWaalsContact O-N 3.08Å; V785-I798 HydrophobicContact CB-CG2 4.36Å; V785-I798 HydrophobicContact CG1-CG2 4.2Å; V785-I798 HydrophobicContact CG2-CG2 4.04Å; V785-T800 WeakPolarHBondContact CG2-OG1 3.35Å; V785-E810 HydrophobicContact CG1-CB 4.29Å; V785-E810 HydrophobicContact CG1-CG 3.59Å
786	Y	93.6	Very high	94	Very high	116 Å²	116	41 Å²	41	46%	0.455	21%	0.213	S	C	.	.	H	α-helix	trans	-58.3	-52.2	171.5	177.7	-96.3	0	0	0	111.1	E753 V757 P782 D784 Y788 K789 E790	E753-Y786 HydrophobicContact CB-CD1 4.34Å; E753-Y786 HydrophobicContact CG-CD1 4.21Å; E753-Y786 HydrophobicContact CG-CE1 4.43Å; V757-Y786 HydrophobicContact CG2-CE1 4.35Å; P782-Y786 PolarHBondContact O-N 2.9Å; D784-Y786 VanDerWaalsContact C-N 3.29Å; D784-Y786 PolarHBondContact O-N 2.83Å; Y786-Y788 VanDerWaalsContact C-N 3.34Å; Y786-Y788 PolarHBondContact O-N 3.16Å; Y786-K789 PolarHBondContact O-N 2.86Å; Y786-E790 HydrophobicContact CD1-CG 4.29Å; Y786-E790 HydrophobicContact CD2-CG 4.38Å; Y786-E790 HydrophobicContact CE1-CG 3.85Å; Y786-E790 HydrophobicContact CE2-CG 3.92Å; Y786-E790 WeakPolarHBondContact O-CG 3.45Å; Y786-E790 PolarHBondContact O-N 2.9Å; Y786-E790 VanDerWaalsContact O-N 3.07Å
787	S	93.6	Very high	93.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-58.3	-42.5	-177.5	-56.2	0	0	0	0	113.3	E753 T783 D784 V791	E753-S787 PolarHBondContact O-OG 2.88Å; T783-S787 WeakPolarHBondContact O-CB 3.42Å; T783-S787 PolarHBondContact O-N 3.27Å; T783-S787 PolarHBondContact O-OG 3.44Å; D784-S787 CarbonylContact O-C 2.99Å; D784-S787 WeakPolarHBondContact O-CA 3.33Å; D784-S787 WeakPolarHBondContact O-CB 3.23Å; D784-S787 PolarHBondContact O-N 3.09Å; S787-V791 PolarHBondContact O-N 3.05Å
788	Y	95.8	Very high	93.8	Very high	1 Å²	1	44.6 Å²	44.6	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-71.4	-36.9	-179.9	-56.4	-37.3	0	0	0	112.2	I656 L760 A777 F778 D784 Y786 V791 G792 V793 I798	I656-Y788 HydrophobicContact CB-CD1 4.49Å; I656-Y788 HydrophobicContact CB-CE1 4.17Å; I656-Y788 HydrophobicContact CD1-CD1 3.86Å; I656-Y788 HydrophobicContact CD1-CE1 4.26Å; I656-Y788 HydrophobicContact CG2-CD1 4.25Å; I656-Y788 HydrophobicContact CG2-CE1 3.56Å; L760-Y788 HydrophobicContact CD1-CD1 3.95Å; L760-Y788 HydrophobicContact CD1-CE1 3.97Å; A777-Y788 HydrophobicContact CB-CD1 3.81Å; A777-Y788 HydrophobicContact CB-CD2 3.36Å; A777-Y788 HydrophobicContact CB-CE1 4.22Å; A777-Y788 HydrophobicContact CB-CE2 3.8Å; A777-Y788 HydrophobicContact CB-CG 3.37Å; F778-Y788 PolarHBondContact O-OH 3.33Å; D784-Y788 HydrophobicContact CB-CD2 4.24Å; D784-Y788 HydrophobicContact CB-CE2 3.58Å; D784-Y788 WeakPolarHBondContact O-CD2 3.32Å; D784-Y788 PolarHBondContact O-N 2.89Å; Y786-Y788 VanDerWaalsContact C-N 3.34Å; Y786-Y788 PolarHBondContact O-N 3.16Å; Y788-V791 WeakPolarHBondContact O-CG2 3.14Å; Y788-G792 PolarHBondContact O-N 3.01Å; Y788-V793 VanDerWaalsContact O-CB 3.29Å; Y788-V793 WeakPolarHBondContact O-CB 3.35Å; Y788-V793 WeakPolarHBondContact O-CG2 3.49Å; Y788-V793 PolarHBondContact O-N 3.43Å; Y788-I798 HydrophobicContact CD2-CG2 4.22Å
789	K	95.3	Very high	93.7	Very high	109 Å²	109	45.1 Å²	45.1	47%	0.474	23%	0.229	S	C	.	.	H	α-helix	trans	-62.3	-47.8	174.8	-178.3	-162.2	172.3	-143.5	0	111.4	V785 Y786 V791 G792 L795 I798	V785-K789 VanDerWaalsContact O-CB 3.31Å; V785-K789 WeakPolarHBondContact O-CB 3.43Å; V785-K789 PolarHBondContact O-N 2.84Å; V785-K789 VanDerWaalsContact O-N 3.08Å; Y786-K789 PolarHBondContact O-N 2.86Å; K789-V791 VanDerWaalsContact C-N 3.29Å; K789-V791 PolarHBondContact O-N 3.39Å; K789-G792 PolarHBondContact O-N 3.03Å; K789-L795 HydrophobicContact CB-CD2 4.29Å; K789-L795 HydrophobicContact CD-CD2 4.19Å; K789-L795 HydrophobicContact CG-CD2 3.95Å; K789-I798 HydrophobicContact CB-CD1 4.23Å
790	E	94.1	Very high	93.7	Very high	87 Å²	87	46.5 Å²	46.5	41%	0.407	24%	0.237	S	C	.	.	H	α-helix	trans	-63.8	-32.7	-177.6	-63.4	-60.2	109.4	0	0	112.6	V757 Y786 G792	V757-E790 HydrophobicContact CG1-CB 4.33Å; V757-E790 HydrophobicContact CG2-CB 4.16Å; V757-E790 HydrophobicContact CG2-CG 4.47Å; Y786-E790 HydrophobicContact CD1-CG 4.29Å; Y786-E790 HydrophobicContact CD2-CG 4.38Å; Y786-E790 HydrophobicContact CE1-CG 3.85Å; Y786-E790 HydrophobicContact CE2-CG 3.92Å; Y786-E790 WeakPolarHBondContact O-CG 3.45Å; Y786-E790 PolarHBondContact O-N 2.9Å; Y786-E790 VanDerWaalsContact O-N 3.07Å; E790-G792 VanDerWaalsContact C-N 3.26Å; E790-G792 PolarHBondContact O-N 3.34Å
791	V	94	Very high	93.8	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.006	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	4.5	175.5	-54.4	0	0	0	0	114.5	I656 L760 T761 R764 F774 S787 Y788 K789 V793	I656-V791 HydrophobicContact CD1-CG2 4.49Å; L760-V791 HydrophobicContact CB-CB 4.36Å; L760-V791 HydrophobicContact CB-CG1 3.75Å; L760-V791 HydrophobicContact CB-CG2 4.19Å; L760-V791 HydrophobicContact CD1-CG2 4.48Å; T761-V791 WeakPolarHBondContact OG1-CG1 3.32Å; R764-V791 WeakPolarHBondContact CD-O 3.29Å; F774-V791 HydrophobicContact CD2-CB 4.25Å; F774-V791 HydrophobicContact CD2-CG2 3.79Å; F774-V791 HydrophobicContact CE2-CB 4.08Å; F774-V791 HydrophobicContact CE2-CG2 3.87Å; S787-V791 PolarHBondContact O-N 3.05Å; Y788-V791 WeakPolarHBondContact O-CG2 3.14Å; K789-V791 VanDerWaalsContact C-N 3.29Å; K789-V791 PolarHBondContact O-N 3.39Å; V791-V793 HydrophobicContact CG2-CG2 4.38Å
792	G	93.9	Very high	93.9	Very high	31 Å²	31	41.9 Å²	41.9	32%	0.32	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	97	13.5	171.3	0	0	0	0	0	116.2	Y788 K789 E790	Y788-G792 PolarHBondContact O-N 3.01Å; K789-G792 PolarHBondContact O-N 3.03Å; E790-G792 VanDerWaalsContact C-N 3.26Å; E790-G792 PolarHBondContact O-N 3.34Å
793	V	96.9	Very high	93.7	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.018	22%	0.217	C	C	.	.			trans	-72.1	125	171.3	-173.1	0	0	0	0	109.1	I656 F774 A777 Y788 V791 I798	I656-V793 HydrophobicContact CD1-CG2 4.09Å; F774-V793 HydrophobicContact CB-CG2 3.69Å; F774-V793 HydrophobicContact CG-CG2 4.47Å; A777-V793 HydrophobicContact CB-CG1 4.11Å; A777-V793 HydrophobicContact CB-CG2 4.26Å; Y788-V793 VanDerWaalsContact O-CB 3.29Å; Y788-V793 WeakPolarHBondContact O-CB 3.35Å; Y788-V793 WeakPolarHBondContact O-CG2 3.49Å; Y788-V793 PolarHBondContact O-N 3.43Å; V791-V793 HydrophobicContact CG2-CG2 4.38Å; V793-I798 HydrophobicContact CB-CD1 4.34Å; V793-I798 HydrophobicContact CB-CG1 4.07Å; V793-I798 HydrophobicContact CG1-CD1 4.44Å; V793-I798 HydrophobicContact CG1-CG1 3.65Å
794	P	94.7	Very high	93.6	Very high	51 Å²	51	47 Å²	47	33%	0.331	24%	0.238	S	C	.	.			trans	-71.1	141.3	-177.8	29.8	-35.3	0	0	0	111	N796 R797 I798	P794-N796 WeakPolarHBondContact CB-OD1 3.45Å; P794-N796 PolarHBondContact O-N 2.79Å; P794-R797 HydrophobicContact CG-CB 4.28Å; P794-R797 HydrophobicContact CG-CG 4.41Å; P794-R797 PolarHBondContact O-N 3.24Å; P794-I798 PolarHBondContact O-N 2.9Å
795	L	92.6	Very high	93.3	Very high	69 Å²	69	47.5 Å²	47.5	36%	0.361	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-58.1	-23.5	-173	-60.5	178.9	0	0	0	114.3	K789 R797 I798 E810 H811	K789-L795 HydrophobicContact CB-CD2 4.29Å; K789-L795 HydrophobicContact CD-CD2 4.19Å; K789-L795 HydrophobicContact CG-CD2 3.95Å; L795-R797 PolarHBondContact O-N 3.32Å; L795-I798 HydrophobicContact CD2-CD1 4.08Å; L795-E810 HydrophobicContact CD2-CG 4.18Å; L795-H811 HydrophobicContact CB-CB 4.07Å; L795-H811 WeakPolarHBondContact O-CB 3.48Å; L795-H811 PolarHBondContact O-N 3.37Å
796	N	92.7	Very high	93.3	Very high	74 Å²	74	49.9 Å²	49.9	40%	0.396	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-79.4	-1.4	175.6	67.3	-11.7	0	0	0	113.6	P794 Q809 H811	P794-N796 WeakPolarHBondContact CB-OD1 3.45Å; P794-N796 PolarHBondContact O-N 2.79Å; N796-Q809 PolarHBondContact O-NE2 3.04Å; N796-H811 HydrophobicContact CB-CB 4.06Å
797	R	94.9	Very high	93.2	Very high	76 Å²	76	44.5 Å²	44.5	29%	0.287	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-130	15.2	174.7	-62.6	-177.6	-179	146	-1.5	113.2	Y775 A776 A777 P794 L795	Y775-R797 VanDerWaalsContact CE2-NH1 3.28Å; Y775-R797 WeakPolarHBondContact O-CB 3.33Å; Y775-R797 WeakPolarHBondContact O-CD 3.45Å; Y775-R797 PolarHBondContact OH-NE 2.89Å; Y775-R797 PolarHBondContact OH-NH2 3.47Å; Y775-R797 VanDerWaalsContact OH-NH2 3.09Å; A776-R797 VanDerWaalsContact CA-O 3.31Å; A776-R797 WeakPolarHBondContact CA-O 3.31Å; A776-R797 HydrophobicContact CB-CB 3.86Å; A776-R797 WeakPolarHBondContact CB-O 3.35Å; A777-R797 PolarHBondContact N-O 3.19Å; P794-R797 HydrophobicContact CG-CB 4.28Å; P794-R797 HydrophobicContact CG-CG 4.41Å; P794-R797 PolarHBondContact O-N 3.24Å; L795-R797 PolarHBondContact O-N 3.32Å
798	I	96.5	Very high	93.2	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	123.5	162.9	-59.3	174.9	0	0	0	107.7	A777 V785 Y788 K789 V793 P794 L795 E810	A777-I798 WeakPolarHBondContact O-CA 3.27Å; V785-I798 HydrophobicContact CB-CG2 4.36Å; V785-I798 HydrophobicContact CG1-CG2 4.2Å; V785-I798 HydrophobicContact CG2-CG2 4.04Å; Y788-I798 HydrophobicContact CD2-CG2 4.22Å; K789-I798 HydrophobicContact CB-CD1 4.23Å; V793-I798 HydrophobicContact CB-CD1 4.34Å; V793-I798 HydrophobicContact CB-CG1 4.07Å; V793-I798 HydrophobicContact CG1-CD1 4.44Å; V793-I798 HydrophobicContact CG1-CG1 3.65Å; P794-I798 PolarHBondContact O-N 2.9Å; L795-I798 HydrophobicContact CD2-CD1 4.08Å; I798-E810 HydrophobicContact CB-CB 4.16Å; I798-E810 HydrophobicContact CG2-CB 4.32Å; I798-E810 PolarHBondContact O-N 2.84Å
799	F	95.9	Very high	93	Very high	11 Å²	11	48.7 Å²	48.7	5%	0.048	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	124.4	179	-57.3	-82.2	0	0	0	109.8	A777 F778 G779 L807 V808 Q809 L822 V829 F830	A777-F799 PolarHBondContact O-N 3.35Å; F778-F799 WeakPolarHBondContact CA-O 3.27Å; F778-F799 HydrophobicContact CD1-CB 3.69Å; F778-F799 HydrophobicContact CD1-CD2 4.19Å; F778-F799 HydrophobicContact CD1-CG 4.24Å; F778-F799 HydrophobicContact CE1-CB 3.83Å; F778-F799 AromaticContact CE1-CD2 3.72Å; F778-F799 HydrophobicContact CE1-CD2 3.72Å; F778-F799 AromaticContact CE1-CG 3.89Å; F778-F799 HydrophobicContact CE1-CG 3.89Å; F778-F799 HydrophobicContact CE2-CD2 4.39Å; F778-F799 HydrophobicContact CG-CB 4.49Å; F778-F799 AromaticContact CZ-CD2 3.83Å; F778-F799 HydrophobicContact CZ-CD2 3.83Å; F778-F799 HydrophobicContact CZ-CE2 4.3Å; F778-F799 HydrophobicContact CZ-CG 4.44Å; G779-F799 PolarHBondContact N-O 3.32Å; F799-L807 HydrophobicContact CB-CD2 4.38Å; F799-V808 WeakPolarHBondContact CA-O 3.45Å; F799-Q809 HydrophobicContact CD1-CB 4.31Å; F799-Q809 HydrophobicContact CD1-CG 4.47Å; F799-Q809 HydrophobicContact CE1-CB 4.29Å; F799-Q809 HydrophobicContact CE1-CG 4.11Å; F799-L822 HydrophobicContact CD1-CD2 4.25Å; F799-L822 HydrophobicContact CE1-CD2 4.16Å; F799-L822 HydrophobicContact CZ-CD2 4.34Å; F799-V829 HydrophobicContact CZ-CG1 3.97Å; F799-F830 HydrophobicContact CE2-CZ 4.05Å
800	T	95.2	Very high	92.7	Very high	29 Å²	29	45.6 Å²	45.6	18%	0.178	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	121.9	176	-50.7	0	0	0	0	109	G779 V785 V808	G779-T800 CarbonylContact O-C 3.56Å; G779-T800 VanDerWaalsContact O-CA 3.29Å; G779-T800 WeakPolarHBondContact O-CA 3.47Å; V785-T800 WeakPolarHBondContact CG2-OG1 3.35Å; T800-V808 PolarHBondContact N-O 2.85Å; T800-V808 PolarHBondContact O-N 3.05Å
801	V	94	Very high	92.3	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.018	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	145.9	173.4	78	0	0	0	0	111.1	G661 T662 G779 N780 E806 L807 Y819	G661-V801 WeakPolarHBondContact O-CG1 3.29Å; T662-V801 HydrophobicContact CG2-CG1 4.39Å; G779-V801 PolarHBondContact O-N 3.41Å; N780-V801 WeakPolarHBondContact CA-O 3.45Å; N780-V801 HydrophobicContact CB-CG1 4.07Å; V801-E806 WeakPolarHBondContact CA-O 3.35Å; V801-L807 HydrophobicContact CB-CD2 3.63Å; V801-L807 HydrophobicContact CG2-CD2 3.82Å; V801-L807 HydrophobicContact CG2-CG 4.43Å; V801-Y819 HydrophobicContact CB-CE2 4.48Å; V801-Y819 HydrophobicContact CG2-CE2 3.82Å
802	N	91.4	Very high	91.7	Very high	49 Å²	49	48.7 Å²	48.7	26%	0.262	26%	0.26	S	S	.	.			trans	-103.6	166.6	169.5	79.3	14.2	0	0	0	111.8	H682 K804 G805 E806	H682-N802 PolarHBondContact CE1-O 2.96Å; H682-N802 VanDerWaalsContact CE1-O 3.23Å; N802-K804 PolarHBondContact O-N 3.3Å; N802-K804 WeakPolarHBondContact OD1-CA 3.5Å; N802-K804 WeakPolarHBondContact OD1-CB 3.08Å; N802-K804 PolarHBondContact OD1-N 3.22Å; N802-G805 PolarHBondContact O-N 3.28Å; N802-G805 PolarHBondContact OD1-N 3.38Å; N802-E806 PolarHBondContact N-O 3.04Å; N802-E806 PolarHBondContact ND2-OE2 3.18Å; N802-E806 PolarHBondContact OD1-N 3.34Å
803	P	86.8	Confident	90.9	Very high	99 Å²	99	53.5 Å²	53.5	64%	0.643	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-13.6	-177.9	-28.5	37.1	0	0	0	116.4
804	K	87.1	Confident	89.9	Confident	161 Å²	161	59.3 Å²	59.3	70%	0.7	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-17.9	172.5	-55.1	175.8	-175.2	167.2	0	113.2	N802 E806	N802-K804 PolarHBondContact O-N 3.3Å; N802-K804 WeakPolarHBondContact OD1-CA 3.5Å; N802-K804 WeakPolarHBondContact OD1-CB 3.08Å; N802-K804 PolarHBondContact OD1-N 3.22Å; K804-E806 HydrophobicContact CB-CG 4.25Å; K804-E806 HydrophobicContact CD-CG 4.48Å; K804-E806 VanDerWaalsContact CD-OE1 3.31Å; K804-E806 WeakPolarHBondContact CD-OE1 3.38Å; K804-E806 WeakPolarHBondContact CD-OE2 3.28Å; K804-E806 IonicContact NZ-OE1 3.49Å; K804-E806 PolarHBondContact NZ-OE1 2.79Å; K804-E806 IonicContact NZ-OE2 3.42Å; K804-E806 PolarHBondContact NZ-OE2 2.97Å
805	G	87.4	Confident	89.1	Confident	13 Å²	13	61 Å²	61	13%	0.134	31%	0.314	C	S	.	.	S	Bend	trans	90.9	15.5	-171.5	0	0	0	0	0	114.6	H682 N802	H682-G805 PolarHBondContact CE1-N 2.92Å; H682-G805 WeakPolarHBondContact ND1-CA 3.4Å; H682-G805 PolarHBondContact ND1-N 3.39Å; N802-G805 PolarHBondContact O-N 3.28Å; N802-G805 PolarHBondContact OD1-N 3.38Å
806	E	91.9	Very high	88.6	Confident	64 Å²	64	62.5 Å²	62.5	30%	0.299	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	126.8	169.5	-60.3	161.8	171.1	0	0	108	V801 N802 K804 I816 S817	V801-E806 WeakPolarHBondContact CA-O 3.35Å; N802-E806 PolarHBondContact N-O 3.04Å; N802-E806 PolarHBondContact ND2-OE2 3.18Å; N802-E806 PolarHBondContact OD1-N 3.34Å; K804-E806 HydrophobicContact CB-CG 4.25Å; K804-E806 HydrophobicContact CD-CG 4.48Å; K804-E806 VanDerWaalsContact CD-OE1 3.31Å; K804-E806 WeakPolarHBondContact CD-OE1 3.38Å; K804-E806 WeakPolarHBondContact CD-OE2 3.28Å; K804-E806 IonicContact NZ-OE1 3.49Å; K804-E806 PolarHBondContact NZ-OE1 2.79Å; K804-E806 IonicContact NZ-OE2 3.42Å; K804-E806 PolarHBondContact NZ-OE2 2.97Å; E806-I816 HydrophobicContact CB-CG2 3.86Å; E806-I816 HydrophobicContact CG-CG2 4.32Å; E806-S817 CarbonylContact C-O 3.54Å; E806-S817 WeakPolarHBondContact CA-O 3.21Å
807	L	92.9	Very high	88.5	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.01	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	134.6	175.9	-74.5	176.3	0	0	0	110.4	F778 F799 V801 I816 S817 Y819 L822	F778-L807 HydrophobicContact CD1-CD2 4.49Å; F799-L807 HydrophobicContact CB-CD2 4.38Å; V801-L807 HydrophobicContact CB-CD2 3.63Å; V801-L807 HydrophobicContact CG2-CD2 3.82Å; V801-L807 HydrophobicContact CG2-CG 4.43Å; L807-I816 WeakPolarHBondContact O-CA 3.38Å; L807-S817 PolarHBondContact N-O 2.82Å; L807-S817 PolarHBondContact O-N 2.79Å; L807-Y819 HydrophobicContact CD1-CD1 3.73Å; L807-Y819 HydrophobicContact CD1-CE1 4.07Å; L807-Y819 HydrophobicContact CD1-CG 4.11Å; L807-Y819 HydrophobicContact CD2-CD1 4.35Å; L807-Y819 HydrophobicContact CD2-CE1 3.9Å; L807-Y819 HydrophobicContact CD2-CE2 4.45Å; L807-Y819 HydrophobicContact CG-CD1 4.38Å; L807-Y819 HydrophobicContact CG-CE1 4.42Å; L807-L822 HydrophobicContact CD1-CB 4.31Å; L807-L822 HydrophobicContact CD1-CD2 3.77Å
808	V	92.3	Very high	88.4	Confident	37 Å²	37	58.9 Å²	58.9	22%	0.224	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	130.8	171.8	-176.9	0	0	0	0	109.3	F799 T800 K813 I816	F799-V808 WeakPolarHBondContact CA-O 3.45Å; T800-V808 PolarHBondContact N-O 2.85Å; T800-V808 PolarHBondContact O-N 3.05Å; V808-K813 HydrophobicContact CG1-CB 4.36Å; V808-I816 HydrophobicContact CG2-CG1 4.45Å
809	Q	92.2	Very high	88.3	Confident	52 Å²	52	58.9 Å²	58.9	24%	0.243	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	122.1	174	-174.1	-176	25.8	0	0	109.1	N796 F799 H811 A812 K813	N796-Q809 PolarHBondContact O-NE2 3.04Å; F799-Q809 HydrophobicContact CD1-CB 4.31Å; F799-Q809 HydrophobicContact CD1-CG 4.47Å; F799-Q809 HydrophobicContact CE1-CB 4.29Å; F799-Q809 HydrophobicContact CE1-CG 4.11Å; Q809-H811 VanDerWaalsContact C-N 3.33Å; Q809-H811 PolarHBondContact O-N 3.31Å; Q809-A812 CarbonylContact O-C 3.56Å; Q809-A812 PolarHBondContact O-N 3.12Å; Q809-K813 PolarHBondContact O-N 3.36Å
810	E	89.6	Confident	88.1	Confident	45 Å²	45	60.1 Å²	60.1	21%	0.21	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-37.8	-167.4	174.4	60.9	-173.1	0	0	113.9	V785 L795 I798 A812 K813	V785-E810 HydrophobicContact CG1-CB 4.29Å; V785-E810 HydrophobicContact CG1-CG 3.59Å; L795-E810 HydrophobicContact CD2-CG 4.18Å; I798-E810 HydrophobicContact CB-CB 4.16Å; I798-E810 HydrophobicContact CG2-CB 4.32Å; I798-E810 PolarHBondContact O-N 2.84Å; E810-A812 PolarHBondContact O-N 2.59Å; E810-K813 WeakPolarHBondContact O-CG 3.24Å; E810-K813 WeakPolarHBondContact OE1-CE 3.38Å; E810-K813 IonicContact OE1-NZ 2.67Å; E810-K813 PolarHBondContact OE1-NZ 3.12Å; E810-K813 IonicContact OE2-NZ 3.84Å; E810-K813 PolarHBondContact OE2-NZ 3.48Å
811	H	84.6	Confident	88	Confident	134 Å²	134	65.9 Å²	65.9	62%	0.62	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-26.3	174.5	178.6	60.7	0	0	0	113.9	L795 N796 Q809	L795-H811 HydrophobicContact CB-CB 4.07Å; L795-H811 WeakPolarHBondContact O-CB 3.48Å; L795-H811 PolarHBondContact O-N 3.37Å; N796-H811 HydrophobicContact CB-CB 4.06Å; Q809-H811 VanDerWaalsContact C-N 3.33Å; Q809-H811 PolarHBondContact O-N 3.31Å
812	A	83.3	Confident	88	Confident	19 Å²	19	66.2 Å²	66.2	16%	0.157	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	70.9	-173	0	0	0	0	0	109.8	Q809 E810 T814 N815	Q809-A812 CarbonylContact O-C 3.56Å; Q809-A812 PolarHBondContact O-N 3.12Å; E810-A812 PolarHBondContact O-N 2.59Å; A812-T814 PolarHBondContact O-N 2.9Å; A812-N815 HydrophobicContact CB-CB 4.24Å; A812-N815 WeakPolarHBondContact CB-ND2 3.32Å; A812-N815 WeakPolarHBondContact O-CB 3.45Å; A812-N815 PolarHBondContact O-N 2.97Å
813	K	77.1	Confident	88.1	Confident	132 Å²	132	64 Å²	64	57%	0.574	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.4	-12.1	-171.6	-59.9	178.1	-173.7	-89.9	0	115.2	V808 Q809 E810	V808-K813 HydrophobicContact CG1-CB 4.36Å; Q809-K813 PolarHBondContact O-N 3.36Å; E810-K813 WeakPolarHBondContact O-CG 3.24Å; E810-K813 WeakPolarHBondContact OE1-CE 3.38Å; E810-K813 IonicContact OE1-NZ 2.67Å; E810-K813 PolarHBondContact OE1-NZ 3.12Å; E810-K813 IonicContact OE2-NZ 3.84Å; E810-K813 PolarHBondContact OE2-NZ 3.48Å
814	T	74.8	Confident	88.4	Confident	125 Å²	125	66.2 Å²	66.2	77%	0.767	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	-18.9	172.2	51.4	0	0	0	0	114	A812 I816	A812-T814 PolarHBondContact O-N 2.9Å; T814-I816 PolarHBondContact O-N 3.44Å
815	N	78.4	Confident	88.7	Confident	87 Å²	87	61.8 Å²	61.8	47%	0.465	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	80.2	-176.6	-70.3	-7.3	0	0	0	110.6	A812	A812-N815 HydrophobicContact CB-CB 4.24Å; A812-N815 WeakPolarHBondContact CB-ND2 3.32Å; A812-N815 WeakPolarHBondContact O-CB 3.45Å; A812-N815 PolarHBondContact O-N 2.97Å
816	I	82.3	Confident	89	Confident	99 Å²	99	61.3 Å²	61.3	51%	0.508	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	120.5	175.4	-51.3	179.9	0	0	0	109.9	E806 L807 V808 T814	E806-I816 HydrophobicContact CB-CG2 3.86Å; E806-I816 HydrophobicContact CG-CG2 4.32Å; L807-I816 WeakPolarHBondContact O-CA 3.38Å; V808-I816 HydrophobicContact CG2-CG1 4.45Å; T814-I816 PolarHBondContact O-N 3.44Å
817	S	89.3	Confident	89	Confident	39 Å²	39	62.4 Å²	62.4	27%	0.273	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	-165.4	-179.1	-164.9	0	0	0	0	110.8	E806 L807 R821	E806-S817 CarbonylContact C-O 3.54Å; E806-S817 WeakPolarHBondContact CA-O 3.21Å; L807-S817 PolarHBondContact N-O 2.82Å; L807-S817 PolarHBondContact O-N 2.79Å; S817-R821 WeakPolarHBondContact OG-CB 3.34Å
818	S	93.1	Very high	88.8	Confident	36 Å²	36	70.2 Å²	70.2	25%	0.252	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	163.8	171.6	68	0	0	0	0	110.1	A820 R821 L822	S818-A820 PolarHBondContact O-N 2.9Å; S818-R821 PolarHBondContact O-N 2.99Å; S818-R821 VanDerWaalsContact O-N 3.16Å; S818-R821 PolarHBondContact OG-N 2.95Å; S818-L822 WeakPolarHBondContact O-CB 3.46Å; S818-L822 PolarHBondContact O-N 3.14Å
819	Y	94.6	Very high	88.8	Confident	1 Å²	1	70.2 Å²	70.2	0%	0.004	36%	0.361	C	S	.	.	H	α-helix	trans	-54.7	-37.3	177.3	-70.7	-65.8	0	0	0	112.6	T662 H682 I685 L688 Y689 F778 V801 L807 S823	T662-Y819 PolarHBondContact O-OH 3.2Å; H682-Y819 HydrophobicContact CB-CD2 3.68Å; H682-Y819 HydrophobicContact CB-CE2 3.47Å; H682-Y819 VanDerWaalsContact CB-CE2 3.47Å; H682-Y819 AromaticContact CG-CE2 3.88Å; I685-Y819 HydrophobicContact CB-CD1 4.22Å; I685-Y819 HydrophobicContact CB-CD2 3.97Å; I685-Y819 HydrophobicContact CB-CE1 4.42Å; I685-Y819 HydrophobicContact CB-CE2 4.15Å; I685-Y819 HydrophobicContact CB-CG 4Å; I685-Y819 HydrophobicContact CD1-CE1 3.9Å; I685-Y819 HydrophobicContact CD1-CE2 3.9Å; I685-Y819 HydrophobicContact CG1-CD1 3.9Å; I685-Y819 HydrophobicContact CG1-CD2 4.28Å; I685-Y819 HydrophobicContact CG1-CE1 3.72Å; I685-Y819 HydrophobicContact CG1-CE2 4.09Å; I685-Y819 HydrophobicContact CG1-CG 4.18Å; L688-Y819 HydrophobicContact CD2-CD1 3.77Å; L688-Y819 HydrophobicContact CD2-CE1 4.5Å; Y689-Y819 HydrophobicContact CE1-CE1 4.26Å; F778-Y819 AromaticContact CD1-CE1 3.93Å; F778-Y819 HydrophobicContact CD1-CE1 3.93Å; F778-Y819 HydrophobicContact CE1-CE1 4.13Å; V801-Y819 HydrophobicContact CB-CE2 4.48Å; V801-Y819 HydrophobicContact CG2-CE2 3.82Å; L807-Y819 HydrophobicContact CD1-CD1 3.73Å; L807-Y819 HydrophobicContact CD1-CE1 4.07Å; L807-Y819 HydrophobicContact CD1-CG 4.11Å; L807-Y819 HydrophobicContact CD2-CD1 4.35Å; L807-Y819 HydrophobicContact CD2-CE1 3.9Å; L807-Y819 HydrophobicContact CD2-CE2 4.45Å; L807-Y819 HydrophobicContact CG-CD1 4.38Å; L807-Y819 HydrophobicContact CG-CE1 4.42Å; Y819-S823 WeakPolarHBondContact O-CB 3.02Å; Y819-S823 PolarHBondContact O-N 2.95Å
820	A	92.1	Very high	89	Confident	36 Å²	36	67.7 Å²	67.7	30%	0.298	35%	0.349	S	S	.	.	H	α-helix	trans	-63.4	-51.2	175.4	0	0	0	0	0	112.5	S818 L822 S823 E824	S818-A820 PolarHBondContact O-N 2.9Å; A820-L822 VanDerWaalsContact C-N 3.32Å; A820-L822 PolarHBondContact O-N 3Å; A820-S823 WeakPolarHBondContact O-CA 3.34Å; A820-S823 VanDerWaalsContact O-CB 3.27Å; A820-S823 WeakPolarHBondContact O-CB 3.43Å; A820-S823 PolarHBondContact O-N 3.14Å; A820-E824 PolarHBondContact O-N 3.13Å; A820-E824 VanDerWaalsContact O-N 3.14Å
821	R	92.7	Very high	89.2	Confident	151 Å²	151	68.4 Å²	68.4	57%	0.57	36%	0.357	S	S	*	.	H	α-helix	trans	-61.9	-39	176.9	-75	-179.3	175.9	174.8	-0.1	112.4	S817 S818 S823 E824 V825	S817-R821 WeakPolarHBondContact OG-CB 3.34Å; S818-R821 PolarHBondContact O-N 2.99Å; S818-R821 VanDerWaalsContact O-N 3.16Å; S818-R821 PolarHBondContact OG-N 2.95Å; R821-S823 PolarHBondContact O-N 2.86Å; R821-E824 WeakPolarHBondContact O-CB 3.45Å; R821-E824 PolarHBondContact O-N 3.24Å; R821-E824 VanDerWaalsContact O-N 3.14Å; R821-V825 PolarHBondContact O-N 2.89Å
822	L	93.4	Very high	89.5	Confident	10 Å²	10	67.1 Å²	67.1	5%	0.052	36%	0.355	C	S	.	.	H	α-helix	trans	-67.1	-27.9	175.2	-172.2	54.5	0	0	0	112	L688 F778 F799 L807 S818 A820 E824 V825 V826 V829 F830	L688-L822 HydrophobicContact CD1-CB 4.34Å; L688-L822 HydrophobicContact CD1-CG 3.98Å; L688-L822 HydrophobicContact CD2-CB 4.22Å; L688-L822 HydrophobicContact CD2-CD2 3.7Å; L688-L822 HydrophobicContact CD2-CG 3.91Å; F778-L822 HydrophobicContact CE1-CD2 3.85Å; F778-L822 HydrophobicContact CZ-CD2 4.05Å; F799-L822 HydrophobicContact CD1-CD2 4.25Å; F799-L822 HydrophobicContact CE1-CD2 4.16Å; F799-L822 HydrophobicContact CZ-CD2 4.34Å; L807-L822 HydrophobicContact CD1-CB 4.31Å; L807-L822 HydrophobicContact CD1-CD2 3.77Å; S818-L822 WeakPolarHBondContact O-CB 3.46Å; S818-L822 PolarHBondContact O-N 3.14Å; A820-L822 VanDerWaalsContact C-N 3.32Å; A820-L822 PolarHBondContact O-N 3Å; L822-E824 VanDerWaalsContact C-N 3.35Å; L822-V825 HydrophobicContact CD1-CG2 4.27Å; L822-V826 WeakPolarHBondContact O-CA 3.4Å; L822-V826 PolarHBondContact O-N 2.97Å; L822-V829 HydrophobicContact CD1-CB 4.26Å; L822-V829 HydrophobicContact CD1-CG1 4.21Å; L822-V829 HydrophobicContact CD1-CG2 3.93Å; L822-F830 HydrophobicContact CD1-CE2 4.35Å; L822-F830 HydrophobicContact CG-CE2 4.42Å
823	S	93.8	Very high	89.4	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.014	36%	0.36	C	S	.	.	H	α-helix	trans	-73.6	-23.6	172.4	-167.1	0	0	0	0	112.8	Q687 K691 Y819 A820 R821	Q687-S823 PolarHBondContact O-OG 3.07Å; K691-S823 WeakPolarHBondContact CD-OG 3.38Å; K691-S823 VanDerWaalsContact CE-OG 3.29Å; K691-S823 WeakPolarHBondContact CE-OG 3.34Å; K691-S823 PolarHBondContact NZ-O 2.83Å; K691-S823 PolarHBondContact NZ-OG 3.05Å; Y819-S823 WeakPolarHBondContact O-CB 3.02Å; Y819-S823 PolarHBondContact O-N 2.95Å; A820-S823 WeakPolarHBondContact O-CA 3.34Å; A820-S823 VanDerWaalsContact O-CB 3.27Å; A820-S823 WeakPolarHBondContact O-CB 3.43Å; A820-S823 PolarHBondContact O-N 3.14Å; R821-S823 PolarHBondContact O-N 2.86Å
824	E	93.3	Very high	88.3	Confident	146 Å²	146	71.6 Å²	71.6	68%	0.682	38%	0.375	S	S	*	.	H	α-helix	trans	-74	-38.8	174.8	-67.2	162	-178.2	0	0	111.6	A820 R821 L822	A820-E824 PolarHBondContact O-N 3.13Å; A820-E824 VanDerWaalsContact O-N 3.14Å; R821-E824 WeakPolarHBondContact O-CB 3.45Å; R821-E824 PolarHBondContact O-N 3.24Å; R821-E824 VanDerWaalsContact O-N 3.14Å; L822-E824 VanDerWaalsContact C-N 3.35Å
825	V	93	Very high	87.1	Confident	68 Å²	68	74.2 Å²	74.2	41%	0.412	37%	0.371	S	S	.	.	S	Bend	trans	-98.4	18.9	178.9	-59.3	0	0	0	0	113.8	R821 L822 D827 H828 V829	R821-V825 PolarHBondContact O-N 2.89Å; L822-V825 HydrophobicContact CD1-CG2 4.27Å; V825-D827 VanDerWaalsContact C-N 3.31Å; V825-D827 PolarHBondContact O-N 3.13Å; V825-H828 PolarHBondContact O-N 2.75Å; V825-H828 VanDerWaalsContact O-N 3.07Å; V825-V829 HydrophobicContact CG2-CG2 4.08Å; V825-V829 PolarHBondContact O-N 3.14Å
826	V	93.9	Very high	85.3	Confident	2 Å²	2	75.9 Å²	75.9	1%	0.012	39%	0.39	C	S	.	.	H	α-helix	trans	-56.7	-41.2	-168.1	69.3	0	0	0	0	113	L688 K691 V692 L822 H828 V829 F830	L688-V826 HydrophobicContact CD1-CB 4.48Å; L688-V826 HydrophobicContact CD1-CG2 4Å; K691-V826 HydrophobicContact CB-CG1 4.1Å; K691-V826 HydrophobicContact CB-CG2 4.12Å; K691-V826 HydrophobicContact CD-CG1 3.73Å; V692-V826 HydrophobicContact CG2-CG2 3.56Å; L822-V826 WeakPolarHBondContact O-CA 3.4Å; L822-V826 PolarHBondContact O-N 2.97Å; V826-H828 PolarHBondContact O-N 3.16Å; V826-V829 PolarHBondContact O-N 3.31Å; V826-F830 HydrophobicContact CG2-CB 4.39Å; V826-F830 HydrophobicContact CG2-CD2 3.96Å; V826-F830 CarbonylContact O-C 3.1Å; V826-F830 WeakPolarHBondContact O-CA 3.12Å; V826-F830 PolarHBondContact O-N 3.1Å
827	D	91.8	Very high	83.1	Confident	88 Å²	88	77.8 Å²	77.8	47%	0.471	41%	0.41	S	S	.	.	H	α-helix	trans	-72.5	-14.8	-176.3	-55.5	-53.8	0	0	0	113.6	N695 V825 P831	N695-D827 PolarHBondContact ND2-OD1 3.12Å; V825-D827 VanDerWaalsContact C-N 3.31Å; V825-D827 PolarHBondContact O-N 3.13Å; D827-P831 WeakPolarHBondContact O-CA 3.44Å
828	H	90.6	Very high	80.4	Confident	165 Å²	165	78.1 Å²	78.1	76%	0.764	41%	0.413	S	S	*	.	H	α-helix	trans	-88.1	-32.2	172	-63.2	-42.2	0	0	0	112.5	V825 V826	V825-H828 PolarHBondContact O-N 2.75Å; V825-H828 VanDerWaalsContact O-N 3.07Å; V826-H828 PolarHBondContact O-N 3.16Å
829	V	91.8	Very high	77.8	Confident	37 Å²	37	82 Å²	82	22%	0.224	44%	0.44	C	S	.	.	H	α-helix	trans	-90.1	-32.8	-178.9	-174.9	0	0	0	0	111.8	Y775 F799 L822 V825 V826	Y775-V829 WeakPolarHBondContact CE1-O 3.33Å; Y775-V829 PolarHBondContact OH-O 3.19Å; F799-V829 HydrophobicContact CZ-CG1 3.97Å; L822-V829 HydrophobicContact CD1-CB 4.26Å; L822-V829 HydrophobicContact CD1-CG1 4.21Å; L822-V829 HydrophobicContact CD1-CG2 3.93Å; V825-V829 HydrophobicContact CG2-CG2 4.08Å; V825-V829 PolarHBondContact O-N 3.14Å; V826-V829 PolarHBondContact O-N 3.31Å
830	F	94.9	Very high	75.1	Confident	0 Å²	0	87.1 Å²	87.1	0%	0	47%	0.467	C	S	.	.	S	Bend	trans	-129.8	69.4	179.9	-53.2	-87.8	0	0	0	109.6	I655 V692 N695 Y697 Y775 A776 F778 F799 L822 V826	I655-F830 HydrophobicContact CD1-CD1 3.99Å; I655-F830 HydrophobicContact CD1-CE1 3.9Å; V692-F830 HydrophobicContact CG1-CB 4.32Å; V692-F830 HydrophobicContact CG1-CD1 3.78Å; V692-F830 HydrophobicContact CG1-CE1 4.27Å; V692-F830 HydrophobicContact CG1-CG 4.02Å; V692-F830 HydrophobicContact CG2-CB 4.21Å; V692-F830 HydrophobicContact CG2-CD1 4.17Å; V692-F830 HydrophobicContact CG2-CD2 3.62Å; V692-F830 HydrophobicContact CG2-CE1 4.49Å; V692-F830 HydrophobicContact CG2-CE2 3.97Å; V692-F830 HydrophobicContact CG2-CG 3.74Å; V692-F830 HydrophobicContact CG2-CZ 4.4Å; N695-F830 PolarHBondContact ND2-O 3.31Å; Y697-F830 HydrophobicContact CD2-CB 4.3Å; Y697-F830 HydrophobicContact CE2-CB 3.79Å; Y775-F830 AromaticContact CD1-CD1 3.85Å; Y775-F830 HydrophobicContact CD1-CD1 3.85Å; Y775-F830 HydrophobicContact CD1-CE1 4.13Å; Y775-F830 AromaticContact CE1-CD1 3.5Å; Y775-F830 HydrophobicContact CE1-CD1 3.5Å; Y775-F830 AromaticContact CE1-CE1 4Å; Y775-F830 HydrophobicContact CE1-CE1 4Å; Y775-F830 HydrophobicContact CE1-CG 4.31Å; A776-F830 HydrophobicContact CB-CE1 3.7Å; A776-F830 HydrophobicContact CB-CZ 4.36Å; F778-F830 HydrophobicContact CE2-CZ 4.23Å; F778-F830 AromaticContact CZ-CZ 3.97Å; F778-F830 HydrophobicContact CZ-CZ 3.97Å; F799-F830 HydrophobicContact CE2-CZ 4.05Å; L822-F830 HydrophobicContact CD1-CE2 4.35Å; L822-F830 HydrophobicContact CG-CE2 4.42Å; V826-F830 HydrophobicContact CG2-CB 4.39Å; V826-F830 HydrophobicContact CG2-CD2 3.96Å; V826-F830 CarbonylContact O-C 3.1Å; V826-F830 WeakPolarHBondContact O-CA 3.12Å; V826-F830 PolarHBondContact O-N 3.1Å
831	P	94.1	Very high	72.3	Confident	59 Å²	59	93.5 Å²	93.5	38%	0.383	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-59.4	148.3	-177.8	-22	34.4	0	0	0	112.4	Y697 Y775 D827 K833	Y697-P831 WeakPolarHBondContact CE2-O 3.39Å; Y697-P831 PolarHBondContact OH-O 3.08Å; Y697-P831 VanDerWaalsContact OH-O 3.11Å; Y775-P831 VanDerWaalsContact OH-CD 3.24Å; Y775-P831 WeakPolarHBondContact OH-CD 3.42Å; D827-P831 WeakPolarHBondContact O-CA 3.44Å; P831-K833 PolarHBondContact O-N 3.4Å; P831-K833 VanDerWaalsContact O-N 3.11Å
832	L	90.8	Very high	69.7	Low	108 Å²	108	90.6 Å²	90.6	57%	0.565	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-50	116.3	177.2	-63.5	169.2	0	0	0	111.5	N695 M834	N695-L832 HydrophobicContact CB-CD2 4.03Å; N695-L832 WeakPolarHBondContact OD1-CD2 3.3Å; L832-M834 PolarHBondContact O-N 3.27Å
833	K	81.1	Confident	67.2	Low	62 Å²	62	93.4 Å²	93.4	27%	0.27	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-60.5	121.4	158.2	-76.9	-165.8	69	-178	0	106.4	D651 K653 N695 P831 R835	D651-K833 PolarHBondContact O-NZ 3.05Å; D651-K833 IonicContact OD2-NZ 3.88Å; D651-K833 PolarHBondContact OD2-NZ 2.86Å; K653-K833 HydrophobicContact CB-CD 4.3Å; K653-K833 HydrophobicContact CG-CD 4.26Å; N695-K833 PolarHBondContact O-N 3.06Å; P831-K833 PolarHBondContact O-N 3.4Å; P831-K833 VanDerWaalsContact O-N 3.11Å; K833-R835 PolarHBondContact O-N 3.25Å
834	M	55.4	Low	64.9	Low	182 Å²	182	98.2 Å²	98.2	90%	0.897	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-54.7	130	-178.3	-73.4	-175.6	71.6	0	0	110.6	L832 S836	L832-M834 PolarHBondContact O-N 3.27Å; M834-S836 PolarHBondContact O-N 3.08Å
835	R	48.2	Very low	62.6	Low	180 Å²	180	98.2 Å²	98.2	68%	0.679	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-68.4	120.9	170.4	-72.2	-177.5	179.1	174	1	109.4	K833 C837 S838 D840	K833-R835 PolarHBondContact O-N 3.25Å; R835-C837 PolarHBondContact O-N 3.38Å; R835-C837 VanDerWaalsContact O-N 3.08Å; R835-S838 WeakPolarHBondContact CD-OG 3.14Å; R835-S838 PolarHBondContact NH1-OG 3.41Å; R835-D840 IonicContact NH1-OD2 3.97Å; R835-D840 PolarHBondContact NH1-OD2 3.07Å
836	S	41.7	Very low	60.2	Low	123 Å²	123	98.7 Å²	98.7	86%	0.86	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	108.7	158.4	-58.4	0	0	0	0	108.5	M834	M834-S836 PolarHBondContact O-N 3.08Å
837	C	36.3	Very low	58	Low	138 Å²	138	108.5 Å²	108.5	93%	0.932	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	47.5	73.3	176.8	-67.3	0	0	0	0	116.5	R835	R835-C837 PolarHBondContact O-N 3.38Å; R835-C837 VanDerWaalsContact O-N 3.08Å
838	S	33	Very low	56.4	Low	47 Å²	47	107.1 Å²	107.1	33%	0.329	59%	0.586	S	S	.	*			trans	-118.5	127.7	136.2	81	0	0	0	0	109.9	R835 D840	R835-S838 WeakPolarHBondContact CD-OG 3.14Å; R835-S838 PolarHBondContact NH1-OG 3.41Å; S838-D840 VanDerWaalsContact CB-OD2 3.25Å; S838-D840 WeakPolarHBondContact CB-OD2 3.32Å; S838-D840 PolarHBondContact O-N 2.7Å; S838-D840 PolarHBondContact OG-OD2 3.01Å
839	S	38.4	Very low	54.4	Low	118 Å²	118	106.3 Å²	106.3	83%	0.825	58%	0.582	S	S	*	*			trans	-81.5	41.1	-172.2	57	0	0	0	0	112.6	F841	S839-F841 VanDerWaalsContact C-N 3.35Å
840	D	36.6	Very low	52.5	Low	107 Å²	107	111.4 Å²	111.4	57%	0.572	60%	0.602	S	S	*	*			trans	-86.5	-6.9	-174.3	-57.5	-44.4	0	0	0	113	R835 S838 P842	R835-D840 IonicContact NH1-OD2 3.97Å; R835-D840 PolarHBondContact NH1-OD2 3.07Å; S838-D840 VanDerWaalsContact CB-OD2 3.25Å; S838-D840 WeakPolarHBondContact CB-OD2 3.32Å; S838-D840 PolarHBondContact O-N 2.7Å; S838-D840 PolarHBondContact OG-OD2 3.01Å; D840-P842 WeakPolarHBondContact O-CD 3.45Å
841	F	33.5	Very low	50.6	Low	171 Å²	171	114.3 Å²	114.3	75%	0.75	62%	0.62	S	S	*	*			trans	-108.5	99.6	165.2	-74.1	-74.1	0	0	0	109.9	S839 C843	S839-F841 VanDerWaalsContact C-N 3.35Å; F841-C843 PolarHBondContact O-N 3.24Å
842	P	38.6	Very low	48.9	Very low	89 Å²	89	117.7 Å²	117.7	58%	0.578	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	38.2	173.2	33.8	-36.9	0	0	0	112.3	D840 T846	D840-P842 WeakPolarHBondContact O-CD 3.45Å; P842-T846 WeakPolarHBondContact O-CG2 3.45Å; P842-T846 PolarHBondContact O-OG1 3.35Å
843	C	41.4	Very low	47.9	Very low	70 Å²	70	121 Å²	121	47%	0.473	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121.8	10.1	-163.2	-62.5	0	0	0	0	114.5	F841	F841-C843 PolarHBondContact O-N 3.24Å
844	S	44.3	Very low	46.7	Very low	103 Å²	103	125.8 Å²	125.8	72%	0.72	65%	0.647	S	S	*	*	S	Bend	trans	-72.7	-37.6	155	50.6	0	0	0	0	111
845	D	45.3	Very low	46.6	Very low	145 Å²	145	126.1 Å²	126.1	78%	0.775	65%	0.647	S	S	*	*	S	Bend	trans	-106.7	-6.7	-164.1	-63.1	19.8	0	0	0	113.3
846	T	42.7	Very low	46.6	Very low	78 Å²	78	126.3 Å²	126.3	48%	0.479	66%	0.655	S	S	.	*	S	Bend	trans	-102.4	133.9	177.6	50.8	0	0	0	0	112.2	P842 S848	P842-T846 WeakPolarHBondContact O-CG2 3.45Å; P842-T846 PolarHBondContact O-OG1 3.35Å; T846-S848 PolarHBondContact O-N 3.36Å; T846-S848 VanDerWaalsContact O-N 3.17Å
847	Y	47.4	Very low	47.3	Very low	208 Å²	208	128.1 Å²	128.1	82%	0.816	65%	0.654	S	S	*	*			trans	-62.3	114.7	-179.9	-110.2	-110	0	0	0	111.1	Y852	Y847-Y852 HydrophobicContact CD1-CD2 4.26Å; Y847-Y852 AromaticContact CE1-CD2 3.49Å; Y847-Y852 HydrophobicContact CE1-CD2 3.49Å; Y847-Y852 VanDerWaalsContact CE1-CD2 3.49Å; Y847-Y852 AromaticContact CE1-CE2 3.87Å; Y847-Y852 HydrophobicContact CE1-CE2 3.87Å; Y847-Y852 HydrophobicContact CE1-CG 4.47Å
848	S	59.4	Low	47.9	Very low	60 Å²	60	127 Å²	127	42%	0.42	65%	0.645	S	S	.	*			trans	-122.2	146.3	168.8	175.1	0	0	0	0	109.6	T846 F850 T851 Y852	T846-S848 PolarHBondContact O-N 3.36Å; T846-S848 VanDerWaalsContact O-N 3.17Å; S848-F850 PolarHBondContact O-N 2.9Å; S848-F850 VanDerWaalsContact O-N 3.08Å; S848-F850 PolarHBondContact OG-N 3.09Å; S848-T851 WeakPolarHBondContact CB-OG1 3.33Å; S848-T851 PolarHBondContact N-OG1 3.19Å; S848-T851 PolarHBondContact O-N 3.19Å; S848-T851 PolarHBondContact O-OG1 3.38Å; S848-T851 VanDerWaalsContact O-OG1 3.1Å; S848-Y852 PolarHBondContact O-N 2.68Å
849	H	47.1	Very low	48.3	Very low	147 Å²	147	133.9 Å²	133.9	68%	0.681	67%	0.672	S	S	*	*	H	α-helix	trans	-58.3	-21.7	172.2	-169.8	-88.4	0	0	0	112.1	W853	H849-W853 AromaticContact CD2-NE1 3.5Å; H849-W853 AromaticContact CE1-CD1 3.61Å; H849-W853 AromaticContact CE1-NE1 3.19Å; H849-W853 PolarHBondContact CE1-NE1 3.31Å; H849-W853 AromaticContact CG-NE1 3.92Å; H849-W853 AromaticContact ND1-CD1 3.82Å; H849-W853 AromaticContact ND1-NE1 3.73Å; H849-W853 AromaticContact NE2-CD1 3.86Å; H849-W853 AromaticContact NE2-NE1 3Å; H849-W853 PolarHBondContact NE2-NE1 3.34Å
850	F	51.5	Low	48.6	Very low	144 Å²	144	134.3 Å²	134.3	63%	0.632	67%	0.67	S	S	*	*	H	α-helix	trans	-81.6	-25.5	175.8	-172.7	-107.8	0	0	0	114.2	S848 R854	S848-F850 PolarHBondContact O-N 2.9Å; S848-F850 VanDerWaalsContact O-N 3.08Å; S848-F850 PolarHBondContact OG-N 3.09Å; F850-R854 VanDerWaalsContact CE1-NH2 3.29Å; F850-R854 VanDerWaalsContact CZ-NH2 3.28Å
851	T	55.8	Low	48.8	Very low	62 Å²	62	138.1 Å²	138.1	38%	0.38	68%	0.684	S	S	.	*	H	α-helix	trans	-91.1	-33.1	175.5	39.6	0	0	0	0	112.4	S848 W853 R854	S848-T851 WeakPolarHBondContact CB-OG1 3.33Å; S848-T851 PolarHBondContact N-OG1 3.19Å; S848-T851 PolarHBondContact O-N 3.19Å; S848-T851 PolarHBondContact O-OG1 3.38Å; S848-T851 VanDerWaalsContact O-OG1 3.1Å; T851-W853 VanDerWaalsContact C-N 3.32Å; T851-W853 PolarHBondContact O-N 3.37Å; T851-R854 PolarHBondContact O-N 3.09Å
852	Y	59.5	Low	48.9	Very low	130 Å²	130	138.7 Å²	138.7	51%	0.51	69%	0.689	S	S	.	*	H	α-helix	trans	-60.1	-34.6	-177.5	-176	-104.6	0	0	0	114.6	Y847 S848	Y847-Y852 HydrophobicContact CD1-CD2 4.26Å; Y847-Y852 AromaticContact CE1-CD2 3.49Å; Y847-Y852 HydrophobicContact CE1-CD2 3.49Å; Y847-Y852 VanDerWaalsContact CE1-CD2 3.49Å; Y847-Y852 AromaticContact CE1-CE2 3.87Å; Y847-Y852 HydrophobicContact CE1-CE2 3.87Å; Y847-Y852 HydrophobicContact CE1-CG 4.47Å; S848-Y852 PolarHBondContact O-N 2.68Å
853	W	69.5	Low	48.7	Very low	176 Å²	176	143.4 Å²	143.4	67%	0.667	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	11	-177.6	-59.3	117.8	0	0	0	114.7	H849 T851	H849-W853 AromaticContact CD2-NE1 3.5Å; H849-W853 AromaticContact CE1-CD1 3.61Å; H849-W853 AromaticContact CE1-NE1 3.19Å; H849-W853 PolarHBondContact CE1-NE1 3.31Å; H849-W853 AromaticContact CG-NE1 3.92Å; H849-W853 AromaticContact ND1-CD1 3.82Å; H849-W853 AromaticContact ND1-NE1 3.73Å; H849-W853 AromaticContact NE2-CD1 3.86Å; H849-W853 AromaticContact NE2-NE1 3Å; H849-W853 PolarHBondContact NE2-NE1 3.34Å; T851-W853 VanDerWaalsContact C-N 3.32Å; T851-W853 PolarHBondContact O-N 3.37Å
854	R	55	Low	48.4	Very low	164 Å²	164	148.6 Å²	148.6	62%	0.619	72%	0.72	S	S	*	*	S	Bend	trans	-94.8	128.8	171.7	-68.2	-162.2	-169.2	-157	5.3	111.1	F850 T851	F850-R854 VanDerWaalsContact CE1-NH2 3.29Å; F850-R854 VanDerWaalsContact CZ-NH2 3.28Å; T851-R854 PolarHBondContact O-N 3.09Å
855	E	52.5	Low	47.9	Very low	189 Å²	189	150.6 Å²	150.6	88%	0.883	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-62.4	130.9	164.2	-163.8	162.1	-136.4	0	0	109.3
856	Q	49.2	Very low	47.4	Very low	184 Å²	184	149.8 Å²	149.8	86%	0.86	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-75	133.9	-179.6	-72	-173.8	-25.8	0	0	110.1
857	L	55.6	Low	46.9	Very low	160 Å²	160	151 Å²	151	84%	0.838	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-65.5	137.4	176.8	-65.6	175.3	0	0	0	110.1	Q859	L857-Q859 PolarHBondContact O-N 2.87Å
858	P	48.7	Very low	46.5	Very low	114 Å²	114	147.2 Å²	147.2	74%	0.74	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-56.9	135	175	-24.9	34.3	0	0	0	111.7	V860	P858-V860 PolarHBondContact O-N 2.92Å
859	Q	41.4	Very low	45.3	Very low	192 Å²	192	153 Å²	153	90%	0.897	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-68.8	129.8	169.7	-67.6	-177.3	-68.6	0	0	109.3	L857	L857-Q859 PolarHBondContact O-N 2.87Å
860	V	44.9	Very low	44.9	Very low	128 Å²	128	153 Å²	153	78%	0.776	77%	0.773	S	S	*	*			trans	-100.1	106.6	170.2	179.1	0	0	0	0	107.2	P858	P858-V860 PolarHBondContact O-N 2.92Å
861	E	40.6	Very low	44.2	Very low	186 Å²	186	152.7 Å²	152.7	87%	0.869	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-68.1	134	169.8	-63	-177.2	144.5	0	0	109
862	Q	36.1	Very low	43.5	Very low	183 Å²	183	155.7 Å²	155.7	86%	0.855	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-97	119.5	174.6	-68.8	-175.4	-14	0	0	108.8	E864	Q862-E864 PolarHBondContact O-N 3.06Å
863	E	35.3	Very low	42.6	Very low	188 Å²	188	155.5 Å²	155.5	88%	0.879	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-68.2	124.1	178.2	-66.5	-175.4	124.9	0	0	111.3	T865	E863-T865 PolarHBondContact O-N 3.28Å
864	E	35.2	Very low	41.2	Very low	179 Å²	179	150.7 Å²	150.7	84%	0.836	83%	0.829	S	S	*	*			trans	-70.8	110.4	174.6	-66.8	-170.2	149.5	0	0	111	Q862 T866	Q862-E864 PolarHBondContact O-N 3.06Å; E864-T866 PolarHBondContact O-N 3.25Å
865	T	33.7	Very low	40.3	Very low	146 Å²	146	152.5 Å²	152.5	90%	0.896	87%	0.867	S	S	*	*			trans	-80.6	81.8	175.2	34.6	0	0	0	0	111.5	E863	E863-T865 PolarHBondContact O-N 3.28Å
866	T	33.8	Very low	39.7	Very low	128 Å²	128	150.7 Å²	150.7	79%	0.785	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-68.4	141.6	174.1	-5.6	0	0	0	0	111.7	E864	E864-T866 PolarHBondContact O-N 3.25Å
867	S	32	Very low	39.2	Very low	103 Å²	103	148.9 Å²	148.9	72%	0.72	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-80.7	143.5	-179.8	52.9	0	0	0	0	112.7	Q869	S867-Q869 PolarHBondContact O-N 3.5Å
868	P	38.6	Very low	38.3	Very low	129 Å²	129	148.3 Å²	148.3	84%	0.838	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-78.2	117.7	-175.5	29.8	-34	0	0	0	112
869	Q	34.4	Very low	37.6	Very low	182 Å²	182	150.4 Å²	150.4	85%	0.85	88%	0.876	S	S	*	*	P	Polyproline II helix	trans	-74.1	137.5	164.6	-73.5	-168.6	-7.2	0	0	111	S867	S867-Q869 PolarHBondContact O-N 3.5Å
870	T	39.7	Very low	37.4	Very low	147 Å²	147	147.8 Å²	147.8	90%	0.902	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-71.5	127.5	173.4	38.5	0	0	0	0	111
871	T	36.3	Very low	36.9	Very low	137 Å²	137	149.1 Å²	149.1	84%	0.84	88%	0.881	S	S	*	*			trans	-122	137.7	166.5	46.8	0	0	0	0	109.8
872	S	40.9	Very low	36.7	Very low	125 Å²	125	146.4 Å²	146.4	87%	0.874	88%	0.882	S	S	*	*			trans	-98.8	130.7	-179.2	46.4	0	0	0	0	110.8
873	S	41.6	Very low	36.7	Very low	125 Å²	125	143.6 Å²	143.6	87%	0.874	88%	0.884	S	S	*	*			trans	-143	137	161.9	57.3	0	0	0	0	108.5
874	G	39.9	Very low	36.8	Very low	75 Å²	75	139.9 Å²	139.9	77%	0.773	88%	0.884	S	S	*	*			trans	-112.8	135.2	178.5	0	0	0	0	0	110.6
875	S	35.7	Very low	37	Very low	203 Å²	203	136.4 Å²	136.4	100%	1.42	89%	0.888	S	S	*	*			trans	-159.2	0	161.2	-72	0	0	0	0	107.8

Retrieved 875 of 875 residues in 255.6 ms (Link to these results)

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