A0A087WNP5_MOUSE Loading...

Predicted gene 10778

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession A0A087WNP5, Species MOUSE (Mus musculus, Mouse), Gene Gm10778, Length 499 aa.

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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	39.6	Very low	65.3	Low	243 Å²	243	101.3 Å²	101.3	100%	1.197	55%	0.55	S	S	*	*				0	120	0	-76.1	177.4	-169.3	0	0	106
2	D	55.2	Low	65.9	Low	162 Å²	162	106.4 Å²	106.4	87%	0.866	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-64.2	139.8	174.9	-64.2	-43.8	0	0	0	109.3	V4	D2-V4 PolarHBondContact O-N 3.04Å
3	A	66.8	Low	65.7	Low	88 Å²	88	103.2 Å²	103.2	73%	0.727	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-70.1	117.7	179.9	0	0	0	0	0	109	T5	A3-T5 WeakPolarHBondContact O-CG2 3.38Å; A3-T5 PolarHBondContact O-N 3.12Å
4	V	68.5	Low	65.7	Low	73 Å²	73	100.4 Å²	100.4	44%	0.442	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-57.2	124.2	175.1	180	0	0	0	0	109.2	D2 D8 V9 L40 I43	D2-V4 PolarHBondContact O-N 3.04Å; V4-D8 HydrophobicContact CG1-CB 4.28Å; V4-V9 HydrophobicContact CG1-CG1 3.65Å; V4-L40 HydrophobicContact CG1-CD2 4.32Å; V4-I43 HydrophobicContact CB-CD1 4.5Å
5	T	71.2	Confident	64.8	Low	46 Å²	46	104.1 Å²	104.1	28%	0.282	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-100.4	165.9	179	73.4	0	0	0	0	111.6	A3 E7 D8 Y45	A3-T5 WeakPolarHBondContact O-CG2 3.38Å; A3-T5 PolarHBondContact O-N 3.12Å; T5-E7 PolarHBondContact O-N 3.34Å; T5-E7 PolarHBondContact OG1-N 3.12Å; T5-D8 WeakPolarHBondContact CA-OD2 3.48Å; T5-D8 WeakPolarHBondContact CB-OD2 3.48Å; T5-D8 PolarHBondContact N-OD2 2.77Å; T5-D8 WeakPolarHBondContact O-CB 3.36Å; T5-D8 PolarHBondContact O-N 3.5Å; T5-D8 VanDerWaalsContact O-N 3.15Å; T5-D8 VanDerWaalsContact OG1-CG 3.23Å; T5-D8 PolarHBondContact OG1-N 3.33Å; T5-D8 PolarHBondContact OG1-OD2 3.12Å; T5-Y45 VanDerWaalsContact CA-CE2 3.49Å; T5-Y45 HydrophobicContact CG2-CE2 4.32Å
6	Y	65.2	Low	64.7	Low	39 Å²	39	105.6 Å²	105.6	15%	0.153	55%	0.548	C	S	.	.	H	α-helix	trans	-58.1	-36.6	173	-177.9	-99.7	0	0	0	112.3	D8 V9 Y10 L40 Y45 L47	Y6-D8 PolarHBondContact O-N 3.05Å; Y6-V9 PolarHBondContact O-N 3.24Å; Y6-Y10 HydrophobicContact CD1-CG 4.37Å; Y6-Y10 HydrophobicContact CE1-CD1 4.44Å; Y6-Y10 AromaticContact CE1-CD2 3.66Å; Y6-Y10 HydrophobicContact CE1-CD2 3.66Å; Y6-Y10 HydrophobicContact CE1-CE2 4.35Å; Y6-Y10 AromaticContact CE1-CG 3.71Å; Y6-Y10 HydrophobicContact CE1-CG 3.71Å; Y6-Y10 AromaticContact CZ-CD2 3.56Å; Y6-Y10 WeakPolarHBondContact O-CB 3.27Å; Y6-Y10 PolarHBondContact O-N 3.05Å; Y6-Y10 WeakPolarHBondContact OH-CD2 3.15Å; Y6-L40 HydrophobicContact CD2-CD1 3.59Å; Y6-L40 HydrophobicContact CG-CD1 4.24Å; Y6-Y45 VanDerWaalsContact CB-CE1 3.48Å; Y6-Y45 VanDerWaalsContact CB-CZ 3.5Å; Y6-Y45 VanDerWaalsContact CB-OH 3.26Å; Y6-Y45 WeakPolarHBondContact CB-OH 3.49Å; Y6-Y45 VanDerWaalsContact N-CZ 3.27Å; Y6-Y45 PolarHBondContact N-OH 3.23Å; Y6-L47 HydrophobicContact CD1-CD2 4.46Å; Y6-L47 HydrophobicContact CD2-CD2 4.02Å; Y6-L47 HydrophobicContact CE2-CD2 4.41Å; Y6-L47 HydrophobicContact CG-CD2 4.05Å
7	E	68.4	Low	64.8	Low	166 Å²	166	104.8 Å²	104.8	78%	0.776	54%	0.541	S	S	*	.	H	α-helix	trans	-66.9	-24.8	179.7	-65.1	176.8	176	0	0	112.3	T5	T5-E7 PolarHBondContact O-N 3.34Å; T5-E7 PolarHBondContact OG1-N 3.12Å
8	D	72.2	Confident	65.3	Low	112 Å²	112	103.3 Å²	103.3	60%	0.599	53%	0.527	S	S	*	.	H	α-helix	trans	-77.7	-23.5	179	-59.4	-49.7	0	0	0	113.5	V4 T5 Y6	V4-D8 HydrophobicContact CG1-CB 4.28Å; T5-D8 WeakPolarHBondContact CA-OD2 3.48Å; T5-D8 WeakPolarHBondContact CB-OD2 3.48Å; T5-D8 PolarHBondContact N-OD2 2.77Å; T5-D8 WeakPolarHBondContact O-CB 3.36Å; T5-D8 PolarHBondContact O-N 3.5Å; T5-D8 VanDerWaalsContact O-N 3.15Å; T5-D8 VanDerWaalsContact OG1-CG 3.23Å; T5-D8 PolarHBondContact OG1-N 3.33Å; T5-D8 PolarHBondContact OG1-OD2 3.12Å; Y6-D8 PolarHBondContact O-N 3.05Å
9	V	73.2	Confident	65.5	Low	56 Å²	56	101.3 Å²	101.3	34%	0.339	53%	0.527	S	S	.	.	H	α-helix	trans	-117.9	-9.2	-174	-65.9	0	0	0	0	113.5	V4 Y6 T36 L40	V4-V9 HydrophobicContact CG1-CG1 3.65Å; Y6-V9 PolarHBondContact O-N 3.24Å; V9-T36 HydrophobicContact CB-CG2 3.81Å; V9-T36 HydrophobicContact CG2-CG2 3.27Å; V9-L40 HydrophobicContact CG2-CD1 3.73Å; V9-L40 HydrophobicContact CG2-CD2 4.08Å; V9-L40 HydrophobicContact CG2-CG 4.16Å
10	Y	67.7	Low	66.1	Low	51 Å²	51	103.6 Å²	103.6	20%	0.2	54%	0.54	C	S	.	.			trans	-78.4	130.7	179.2	168.9	-104.8	0	0	0	111.4	Y6 K12 Y29 M33 E100	Y6-Y10 HydrophobicContact CD1-CG 4.37Å; Y6-Y10 HydrophobicContact CE1-CD1 4.44Å; Y6-Y10 AromaticContact CE1-CD2 3.66Å; Y6-Y10 HydrophobicContact CE1-CD2 3.66Å; Y6-Y10 HydrophobicContact CE1-CE2 4.35Å; Y6-Y10 AromaticContact CE1-CG 3.71Å; Y6-Y10 HydrophobicContact CE1-CG 3.71Å; Y6-Y10 AromaticContact CZ-CD2 3.56Å; Y6-Y10 WeakPolarHBondContact O-CB 3.27Å; Y6-Y10 PolarHBondContact O-N 3.05Å; Y6-Y10 WeakPolarHBondContact OH-CD2 3.15Å; Y10-K12 HydrophobicContact CD1-CB 4.26Å; Y10-K12 HydrophobicContact CE1-CB 3.54Å; Y10-K12 HydrophobicContact CE1-CD 4.4Å; Y10-K12 HydrophobicContact CE1-CG 3.88Å; Y10-Y29 WeakPolarHBondContact CE2-OH 3.41Å; Y10-M33 HydrophobicContact CD2-SD 3.79Å; Y10-M33 HydrophobicContact CE2-SD 4.31Å; Y10-E100 PolarHBondContact OH-OE1 3.46Å
11	V	70.8	Confident	66.5	Low	78 Å²	78	100 Å²	100	47%	0.473	52%	0.521	S	S	.	.			trans	-99.6	114.5	175.8	178.5	0	0	0	0	108.5	F13 Y29	V11-F13 HydrophobicContact CG1-CE2 4.14Å; V11-F13 HydrophobicContact CG1-CZ 4.4Å; V11-Y29 HydrophobicContact CB-CE2 4.42Å; V11-Y29 WeakPolarHBondContact O-CE2 3.36Å; V11-Y29 PolarHBondContact O-OH 2.75Å; V11-Y29 VanDerWaalsContact O-OH 3.08Å
12	K	71.6	Confident	68.4	Low	163 Å²	163	91.6 Å²	91.6	71%	0.709	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-92.3	126.2	-179.8	-166.9	176.9	-179.6	-177.7	0	111.2	Y10	Y10-K12 HydrophobicContact CD1-CB 4.26Å; Y10-K12 HydrophobicContact CE1-CB 3.54Å; Y10-K12 HydrophobicContact CE1-CD 4.4Å; Y10-K12 HydrophobicContact CE1-CG 3.88Å
13	F	63.9	Low	69.1	Low	64 Å²	64	89.2 Å²	89.2	28%	0.281	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-97.5	139.5	164.9	-71.2	-78.4	0	0	0	110.6	V11 E17 W18 L21 Y29	V11-F13 HydrophobicContact CG1-CE2 4.14Å; V11-F13 HydrophobicContact CG1-CZ 4.4Å; F13-E17 HydrophobicContact CB-CB 4.42Å; F13-E17 HydrophobicContact CD1-CB 3.81Å; F13-W18 HydrophobicContact CB-CB 4.2Å; F13-W18 HydrophobicContact CB-CE3 4.13Å; F13-W18 AromaticContact CD2-CE3 3.97Å; F13-W18 HydrophobicContact CD2-CE3 3.97Å; F13-W18 HydrophobicContact CD2-CZ3 4.19Å; F13-W18 HydrophobicContact CG-CE3 4.19Å; F13-L21 HydrophobicContact CD1-CD1 4.25Å; F13-L21 HydrophobicContact CD2-CD1 4.26Å; F13-L21 HydrophobicContact CE1-CD1 4.04Å; F13-L21 HydrophobicContact CE1-CD2 4.3Å; F13-L21 HydrophobicContact CE2-CD1 4.06Å; F13-L21 HydrophobicContact CG-CD1 4.34Å; F13-L21 HydrophobicContact CZ-CD1 3.94Å; F13-Y29 AromaticContact CD2-CD2 3.97Å; F13-Y29 HydrophobicContact CD2-CD2 3.97Å; F13-Y29 AromaticContact CD2-CE2 3.69Å; F13-Y29 HydrophobicContact CD2-CE2 3.69Å; F13-Y29 AromaticContact CE2-CD2 3.47Å; F13-Y29 HydrophobicContact CE2-CD2 3.47Å; F13-Y29 VanDerWaalsContact CE2-CD2 3.47Å; F13-Y29 AromaticContact CE2-CE2 3.59Å; F13-Y29 HydrophobicContact CE2-CE2 3.59Å; F13-Y29 HydrophobicContact CE2-CG 4.25Å
14	T	65.1	Low	69.5	Low	65 Å²	65	88.8 Å²	88.8	40%	0.399	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-67.6	163.8	161	60	0	0	0	0	110.3	E16 E17 W18	T14-E16 PolarHBondContact O-N 2.85Å; T14-E17 WeakPolarHBondContact CB-OE2 3.37Å; T14-E17 WeakPolarHBondContact CG2-OE2 3.42Å; T14-E17 PolarHBondContact N-OE2 3.29Å; T14-E17 PolarHBondContact O-N 3.17Å; T14-E17 WeakPolarHBondContact OG1-CB 3.33Å; T14-E17 WeakPolarHBondContact OG1-CG 3.45Å; T14-E17 PolarHBondContact OG1-N 2.72Å; T14-E17 PolarHBondContact OG1-OE2 3.43Å; T14-W18 WeakPolarHBondContact O-CB 3.31Å; T14-W18 PolarHBondContact O-N 3.45Å
15	H	53.2	Low	69.7	Low	156 Å²	156	89.5 Å²	89.5	72%	0.722	47%	0.465	S	S	*	.	H	α-helix	trans	-62.1	-36.2	178.5	-177.1	-92.3	0	0	0	111.2	A19	H15-A19 WeakPolarHBondContact O-CB 3.17Å; H15-A19 PolarHBondContact O-N 3.3Å; H15-A19 VanDerWaalsContact O-N 3.08Å
16	E	61.9	Low	69.8	Low	128 Å²	128	90 Å²	90	60%	0.598	46%	0.463	S	S	*	.	H	α-helix	trans	-66.8	-48.2	176.5	-62.4	73.3	-158.6	0	0	111.5	T14 W18 A19 L20	T14-E16 PolarHBondContact O-N 2.85Å; E16-W18 PolarHBondContact O-N 3.34Å; E16-A19 WeakPolarHBondContact O-CB 3.48Å; E16-A19 PolarHBondContact O-N 3.42Å; E16-L20 WeakPolarHBondContact O-CG 3.39Å; E16-L20 PolarHBondContact O-N 3.46Å
17	E	66.5	Low	70.1	Confident	92 Å²	92	91 Å²	91	43%	0.43	48%	0.476	S	S	.	.	H	α-helix	trans	-64.6	-40.7	178	-67.9	160.1	149.5	0	0	111.6	F13 T14 A19 L20 L21	F13-E17 HydrophobicContact CB-CB 4.42Å; F13-E17 HydrophobicContact CD1-CB 3.81Å; T14-E17 WeakPolarHBondContact CB-OE2 3.37Å; T14-E17 WeakPolarHBondContact CG2-OE2 3.42Å; T14-E17 PolarHBondContact N-OE2 3.29Å; T14-E17 PolarHBondContact O-N 3.17Å; T14-E17 WeakPolarHBondContact OG1-CB 3.33Å; T14-E17 WeakPolarHBondContact OG1-CG 3.45Å; T14-E17 PolarHBondContact OG1-N 2.72Å; T14-E17 PolarHBondContact OG1-OE2 3.43Å; E17-A19 VanDerWaalsContact C-N 3.28Å; E17-A19 PolarHBondContact O-N 2.85Å; E17-L20 WeakPolarHBondContact O-CB 3.45Å; E17-L20 PolarHBondContact O-N 2.8Å; E17-L20 VanDerWaalsContact O-N 3.15Å; E17-L21 PolarHBondContact O-N 2.93Å
18	W	74.7	Confident	70.4	Confident	77 Å²	77	88.4 Å²	88.4	29%	0.292	47%	0.467	S	S	.	.	H	α-helix	trans	-61.9	-36.8	176.3	-174.7	-100.3	0	0	0	112.4	F13 T14 E16 L20 L21 K26 Y29	F13-W18 HydrophobicContact CB-CB 4.2Å; F13-W18 HydrophobicContact CB-CE3 4.13Å; F13-W18 AromaticContact CD2-CE3 3.97Å; F13-W18 HydrophobicContact CD2-CE3 3.97Å; F13-W18 HydrophobicContact CD2-CZ3 4.19Å; F13-W18 HydrophobicContact CG-CE3 4.19Å; T14-W18 WeakPolarHBondContact O-CB 3.31Å; T14-W18 PolarHBondContact O-N 3.45Å; E16-W18 PolarHBondContact O-N 3.34Å; W18-L20 VanDerWaalsContact C-N 3.26Å; W18-L20 PolarHBondContact O-N 2.94Å; W18-L21 HydrophobicContact CD2-CD1 4.46Å; W18-L21 HydrophobicContact CE3-CD1 3.76Å; W18-L21 HydrophobicContact CZ3-CD1 4.05Å; W18-L21 PolarHBondContact O-N 2.85Å; W18-K26 HydrophobicContact CH2-CB 4.33Å; W18-K26 HydrophobicContact CH2-CG 4.18Å; W18-K26 HydrophobicContact CZ2-CB 4.25Å; W18-K26 HydrophobicContact CZ2-CD 4.29Å; W18-K26 HydrophobicContact CZ2-CG 3.92Å; W18-K26 WeakPolarHBondContact O-CE 3.47Å; W18-K26 PolarHBondContact O-NZ 3.32Å; W18-K26 VanDerWaalsContact O-NZ 3.15Å; W18-Y29 AromaticContact CH2-CD1 3.43Å; W18-Y29 HydrophobicContact CH2-CD1 3.43Å; W18-Y29 VanDerWaalsContact CH2-CD1 3.43Å; W18-Y29 AromaticContact CH2-CE1 3.82Å; W18-Y29 HydrophobicContact CH2-CE1 3.82Å; W18-Y29 HydrophobicContact CH2-CG 4.2Å; W18-Y29 AromaticContact CZ3-CD1 3.29Å; W18-Y29 HydrophobicContact CZ3-CD1 3.29Å; W18-Y29 HydrophobicContact CZ3-CD2 4.48Å; W18-Y29 AromaticContact CZ3-CE1 3.53Å; W18-Y29 HydrophobicContact CZ3-CE1 3.53Å; W18-Y29 AromaticContact CZ3-CG 3.78Å; W18-Y29 HydrophobicContact CZ3-CG 3.78Å
19	A	69.3	Low	70.5	Confident	65 Å²	65	84.6 Å²	84.6	54%	0.537	44%	0.444	S	S	.	.	H	α-helix	trans	-65.3	-30.9	177.4	0	0	0	0	0	112.4	H15 E16 E17 L21	H15-A19 WeakPolarHBondContact O-CB 3.17Å; H15-A19 PolarHBondContact O-N 3.3Å; H15-A19 VanDerWaalsContact O-N 3.08Å; E16-A19 WeakPolarHBondContact O-CB 3.48Å; E16-A19 PolarHBondContact O-N 3.42Å; E17-A19 VanDerWaalsContact C-N 3.28Å; E17-A19 PolarHBondContact O-N 2.85Å; A19-L21 VanDerWaalsContact C-N 3.34Å
20	L	77.9	Confident	70.2	Confident	148 Å²	148	85.3 Å²	85.3	78%	0.775	44%	0.443	S	S	*	.	H	α-helix	trans	-76.3	-19.6	178.8	-64.3	172.7	0	0	0	113.6	E16 E17 W18	E16-L20 WeakPolarHBondContact O-CG 3.39Å; E16-L20 PolarHBondContact O-N 3.46Å; E17-L20 WeakPolarHBondContact O-CB 3.45Å; E17-L20 PolarHBondContact O-N 2.8Å; E17-L20 VanDerWaalsContact O-N 3.15Å; W18-L20 VanDerWaalsContact C-N 3.26Å; W18-L20 PolarHBondContact O-N 2.94Å
21	L	73.5	Confident	70.3	Confident	27 Å²	27	87.3 Å²	87.3	14%	0.141	46%	0.457	C	S	.	.	S	Bend	trans	-70.4	132.5	179.5	-61	177.1	0	0	0	111.3	F13 E17 W18 A19 Q25 K26	F13-L21 HydrophobicContact CD1-CD1 4.25Å; F13-L21 HydrophobicContact CD2-CD1 4.26Å; F13-L21 HydrophobicContact CE1-CD1 4.04Å; F13-L21 HydrophobicContact CE1-CD2 4.3Å; F13-L21 HydrophobicContact CE2-CD1 4.06Å; F13-L21 HydrophobicContact CG-CD1 4.34Å; F13-L21 HydrophobicContact CZ-CD1 3.94Å; E17-L21 PolarHBondContact O-N 2.93Å; W18-L21 HydrophobicContact CD2-CD1 4.46Å; W18-L21 HydrophobicContact CE3-CD1 3.76Å; W18-L21 HydrophobicContact CZ3-CD1 4.05Å; W18-L21 PolarHBondContact O-N 2.85Å; A19-L21 VanDerWaalsContact C-N 3.34Å; L21-Q25 VanDerWaalsContact CA-OE1 3.3Å; L21-Q25 HydrophobicContact CB-CB 4.09Å; L21-Q25 HydrophobicContact CD2-CB 4.16Å; L21-K26 HydrophobicContact CB-CD 4.47Å; L21-K26 HydrophobicContact CB-CG 3.8Å; L21-K26 HydrophobicContact CD1-CG 4.46Å; L21-K26 WeakPolarHBondContact O-CE 3.23Å; L21-K26 PolarHBondContact O-NZ 3.12Å
22	D	79.1	Confident	70.4	Confident	67 Å²	67	86.8 Å²	86.8	36%	0.358	45%	0.454	S	S	.	.			trans	-72.3	163.5	172.8	79.1	73.2	0	0	0	111.2	S24 Q25 K26	D22-S24 PolarHBondContact O-N 3.37Å; D22-S24 WeakPolarHBondContact OD1-CA 3.46Å; D22-S24 VanDerWaalsContact OD1-CB 3.28Å; D22-S24 WeakPolarHBondContact OD1-CB 3.48Å; D22-S24 PolarHBondContact OD1-N 3.3Å; D22-S24 PolarHBondContact OD1-OG 2.92Å; D22-Q25 PolarHBondContact O-N 3.27Å; D22-Q25 VanDerWaalsContact O-N 3.16Å; D22-Q25 PolarHBondContact OD1-N 3.4Å; D22-Q25 WeakPolarHBondContact OD2-CG 3.44Å; D22-Q25 PolarHBondContact OD2-OE1 2.96Å; D22-Q25 VanDerWaalsContact OD2-OE1 3.12Å; D22-K26 PolarHBondContact O-N 3.4Å
23	P	70.8	Confident	70.3	Confident	112 Å²	112	79.2 Å²	79.2	73%	0.727	42%	0.421	S	S	*	.	H	α-helix	trans	-56.3	-34.2	-176.8	-27.4	36.2	0	0	0	114.7	S27	P23-S27 WeakPolarHBondContact O-CB 3.49Å; P23-S27 PolarHBondContact O-N 3.28Å
24	S	74.7	Confident	70.3	Confident	80 Å²	80	77.1 Å²	77.1	56%	0.559	41%	0.412	S	S	*	.	H	α-helix	trans	-71.9	-39.1	179.3	74.4	0	0	0	0	111.5	D22 S27 L28	D22-S24 PolarHBondContact O-N 3.37Å; D22-S24 WeakPolarHBondContact OD1-CA 3.46Å; D22-S24 VanDerWaalsContact OD1-CB 3.28Å; D22-S24 WeakPolarHBondContact OD1-CB 3.48Å; D22-S24 PolarHBondContact OD1-N 3.3Å; D22-S24 PolarHBondContact OD1-OG 2.92Å; S24-S27 WeakPolarHBondContact O-CB 3.31Å; S24-S27 PolarHBondContact O-N 3.5Å; S24-L28 WeakPolarHBondContact O-CB 3.41Å; S24-L28 PolarHBondContact O-N 2.87Å
25	Q	73.3	Confident	70.4	Confident	88 Å²	88	78 Å²	78	41%	0.411	41%	0.412	S	S	.	.	H	α-helix	trans	-64.4	-42.8	173.3	-71.8	172.8	-26.8	0	0	112	L21 D22 S27 L28 Y29	L21-Q25 VanDerWaalsContact CA-OE1 3.3Å; L21-Q25 HydrophobicContact CB-CB 4.09Å; L21-Q25 HydrophobicContact CD2-CB 4.16Å; D22-Q25 PolarHBondContact O-N 3.27Å; D22-Q25 VanDerWaalsContact O-N 3.16Å; D22-Q25 PolarHBondContact OD1-N 3.4Å; D22-Q25 WeakPolarHBondContact OD2-CG 3.44Å; D22-Q25 PolarHBondContact OD2-OE1 2.96Å; D22-Q25 VanDerWaalsContact OD2-OE1 3.12Å; Q25-S27 VanDerWaalsContact C-N 3.3Å; Q25-S27 PolarHBondContact O-N 3.31Å; Q25-L28 PolarHBondContact O-N 3.47Å; Q25-Y29 WeakPolarHBondContact O-CB 3.4Å; Q25-Y29 PolarHBondContact O-N 3.44Å
26	K	73.5	Confident	71.1	Confident	55 Å²	55	71.8 Å²	71.8	24%	0.239	39%	0.385	C	S	.	.	H	α-helix	trans	-61.3	-40.4	174.2	-71.9	174.2	173.9	150.5	0	111.5	W18 L21 D22 K30	W18-K26 HydrophobicContact CH2-CB 4.33Å; W18-K26 HydrophobicContact CH2-CG 4.18Å; W18-K26 HydrophobicContact CZ2-CB 4.25Å; W18-K26 HydrophobicContact CZ2-CD 4.29Å; W18-K26 HydrophobicContact CZ2-CG 3.92Å; W18-K26 WeakPolarHBondContact O-CE 3.47Å; W18-K26 PolarHBondContact O-NZ 3.32Å; W18-K26 VanDerWaalsContact O-NZ 3.15Å; L21-K26 HydrophobicContact CB-CD 4.47Å; L21-K26 HydrophobicContact CB-CG 3.8Å; L21-K26 HydrophobicContact CD1-CG 4.46Å; L21-K26 WeakPolarHBondContact O-CE 3.23Å; L21-K26 PolarHBondContact O-NZ 3.12Å; D22-K26 PolarHBondContact O-N 3.4Å; K26-K30 WeakPolarHBondContact O-CG 3.47Å; K26-K30 PolarHBondContact O-N 3.1Å; K26-K30 VanDerWaalsContact O-N 3.12Å
27	S	70.1	Confident	71.1	Confident	62 Å²	62	65.7 Å²	65.7	43%	0.434	36%	0.357	S	S	.	.	H	α-helix	trans	-63.7	-50.1	174.8	-166.2	0	0	0	0	111.4	P23 S24 Q25 Y29 K30 D31	P23-S27 WeakPolarHBondContact O-CB 3.49Å; P23-S27 PolarHBondContact O-N 3.28Å; S24-S27 WeakPolarHBondContact O-CB 3.31Å; S24-S27 PolarHBondContact O-N 3.5Å; Q25-S27 VanDerWaalsContact C-N 3.3Å; Q25-S27 PolarHBondContact O-N 3.31Å; S27-Y29 VanDerWaalsContact C-N 3.31Å; S27-Y29 PolarHBondContact O-N 3.48Å; S27-K30 WeakPolarHBondContact O-CB 3.41Å; S27-K30 PolarHBondContact O-N 3.18Å; S27-K30 VanDerWaalsContact O-N 3.09Å; S27-D31 PolarHBondContact O-N 3.13Å
28	L	74.9	Confident	71.1	Confident	110 Å²	110	66.2 Å²	66.2	58%	0.576	36%	0.355	S	S	*	.	H	α-helix	trans	-60	-41.9	179.1	-179.6	63	0	0	0	111.5	S24 Q25 K30 D31 V32	S24-L28 WeakPolarHBondContact O-CB 3.41Å; S24-L28 PolarHBondContact O-N 2.87Å; Q25-L28 PolarHBondContact O-N 3.47Å; L28-K30 VanDerWaalsContact C-N 3.34Å; L28-K30 PolarHBondContact O-N 3.38Å; L28-D31 PolarHBondContact O-N 3.42Å; L28-V32 HydrophobicContact CD1-CG2 4.25Å; L28-V32 HydrophobicContact CG-CG2 4.39Å; L28-V32 VanDerWaalsContact O-CG2 3.27Å; L28-V32 WeakPolarHBondContact O-CG2 2.96Å; L28-V32 PolarHBondContact O-N 3.43Å
29	Y	75.4	Confident	70.8	Confident	33 Å²	33	66.6 Å²	66.6	13%	0.129	36%	0.363	C	S	.	.	H	α-helix	trans	-58.6	-45.7	174.4	172.6	-94	0	0	0	111.9	Y10 V11 F13 W18 Q25 S27 D31 V32 M33	Y10-Y29 WeakPolarHBondContact CE2-OH 3.41Å; V11-Y29 HydrophobicContact CB-CE2 4.42Å; V11-Y29 WeakPolarHBondContact O-CE2 3.36Å; V11-Y29 PolarHBondContact O-OH 2.75Å; V11-Y29 VanDerWaalsContact O-OH 3.08Å; F13-Y29 AromaticContact CD2-CD2 3.97Å; F13-Y29 HydrophobicContact CD2-CD2 3.97Å; F13-Y29 AromaticContact CD2-CE2 3.69Å; F13-Y29 HydrophobicContact CD2-CE2 3.69Å; F13-Y29 AromaticContact CE2-CD2 3.47Å; F13-Y29 HydrophobicContact CE2-CD2 3.47Å; F13-Y29 VanDerWaalsContact CE2-CD2 3.47Å; F13-Y29 AromaticContact CE2-CE2 3.59Å; F13-Y29 HydrophobicContact CE2-CE2 3.59Å; F13-Y29 HydrophobicContact CE2-CG 4.25Å; W18-Y29 AromaticContact CH2-CD1 3.43Å; W18-Y29 HydrophobicContact CH2-CD1 3.43Å; W18-Y29 VanDerWaalsContact CH2-CD1 3.43Å; W18-Y29 AromaticContact CH2-CE1 3.82Å; W18-Y29 HydrophobicContact CH2-CE1 3.82Å; W18-Y29 HydrophobicContact CH2-CG 4.2Å; W18-Y29 AromaticContact CZ3-CD1 3.29Å; W18-Y29 HydrophobicContact CZ3-CD1 3.29Å; W18-Y29 HydrophobicContact CZ3-CD2 4.48Å; W18-Y29 AromaticContact CZ3-CE1 3.53Å; W18-Y29 HydrophobicContact CZ3-CE1 3.53Å; W18-Y29 AromaticContact CZ3-CG 3.78Å; W18-Y29 HydrophobicContact CZ3-CG 3.78Å; Q25-Y29 WeakPolarHBondContact O-CB 3.4Å; Q25-Y29 PolarHBondContact O-N 3.44Å; S27-Y29 VanDerWaalsContact C-N 3.31Å; S27-Y29 PolarHBondContact O-N 3.48Å; Y29-D31 VanDerWaalsContact C-N 3.31Å; Y29-D31 PolarHBondContact O-N 2.86Å; Y29-V32 PolarHBondContact O-N 3.34Å; Y29-M33 HydrophobicContact CD1-CG 4.08Å; Y29-M33 HydrophobicContact CD2-CG 4.1Å; Y29-M33 HydrophobicContact CE1-CG 3.69Å; Y29-M33 HydrophobicContact CE2-CE 4.26Å; Y29-M33 HydrophobicContact CE2-CG 3.7Å; Y29-M33 HydrophobicContact CE2-SD 3.97Å; Y29-M33 HydrophobicContact CG-CG 4.33Å; Y29-M33 WeakPolarHBondContact O-CB 3.39Å; Y29-M33 VanDerWaalsContact O-CG 3.31Å; Y29-M33 WeakPolarHBondContact O-CG 3.27Å; Y29-M33 PolarHBondContact O-N 3.12Å
30	K	66.2	Low	70.6	Confident	71 Å²	71	63.8 Å²	63.8	31%	0.309	34%	0.338	S	S	.	.	H	α-helix	trans	-59.6	-43.3	176.4	-71.8	179.8	-175.9	-163.6	0	111.3	K26 S27 L28 M33 L34 E101	K26-K30 WeakPolarHBondContact O-CG 3.47Å; K26-K30 PolarHBondContact O-N 3.1Å; K26-K30 VanDerWaalsContact O-N 3.12Å; S27-K30 WeakPolarHBondContact O-CB 3.41Å; S27-K30 PolarHBondContact O-N 3.18Å; S27-K30 VanDerWaalsContact O-N 3.09Å; L28-K30 VanDerWaalsContact C-N 3.34Å; L28-K30 PolarHBondContact O-N 3.38Å; K30-M33 PolarHBondContact O-N 2.86Å; K30-L34 WeakPolarHBondContact O-CB 3.24Å; K30-L34 PolarHBondContact O-N 2.77Å; K30-E101 IonicContact NZ-OE1 3.2Å; K30-E101 PolarHBondContact NZ-OE1 3.23Å
31	D	69.5	Low	69.7	Low	93 Å²	93	59.3 Å²	59.3	50%	0.497	32%	0.317	S	S	.	.	H	α-helix	trans	-63.7	-44.5	178.5	-66.4	-28.5	0	0	0	111.7	S27 L28 Y29 L34 E35	S27-D31 PolarHBondContact O-N 3.13Å; L28-D31 PolarHBondContact O-N 3.42Å; Y29-D31 VanDerWaalsContact C-N 3.31Å; Y29-D31 PolarHBondContact O-N 2.86Å; D31-L34 PolarHBondContact O-N 2.73Å; D31-E35 WeakPolarHBondContact O-CB 3.22Å; D31-E35 PolarHBondContact O-N 3.14Å
32	V	72.9	Confident	69.1	Low	67 Å²	67	62.1 Å²	62.1	41%	0.406	35%	0.345	S	S	.	.	H	α-helix	trans	-65.2	-44.4	177.8	175.3	0	0	0	0	111	L28 Y29 L34 E35 T36	L28-V32 HydrophobicContact CD1-CG2 4.25Å; L28-V32 HydrophobicContact CG-CG2 4.39Å; L28-V32 VanDerWaalsContact O-CG2 3.27Å; L28-V32 WeakPolarHBondContact O-CG2 2.96Å; L28-V32 PolarHBondContact O-N 3.43Å; Y29-V32 PolarHBondContact O-N 3.34Å; V32-L34 VanDerWaalsContact C-N 3.33Å; V32-L34 PolarHBondContact O-N 2.94Å; V32-E35 PolarHBondContact O-N 3.24Å; V32-T36 WeakPolarHBondContact O-CB 3.48Å; V32-T36 PolarHBondContact O-N 3.5Å; V32-T36 PolarHBondContact O-OG1 2.87Å
33	M	70.9	Confident	68.6	Low	3 Å²	3	64.6 Å²	64.6	2%	0.015	36%	0.356	C	S	.	.	H	α-helix	trans	-64.2	-38.7	178.2	-69.8	-58.1	96.8	0	0	112	Y10 Y29 K30 E35 T36 C37	Y10-M33 HydrophobicContact CD2-SD 3.79Å; Y10-M33 HydrophobicContact CE2-SD 4.31Å; Y29-M33 HydrophobicContact CD1-CG 4.08Å; Y29-M33 HydrophobicContact CD2-CG 4.1Å; Y29-M33 HydrophobicContact CE1-CG 3.69Å; Y29-M33 HydrophobicContact CE2-CE 4.26Å; Y29-M33 HydrophobicContact CE2-CG 3.7Å; Y29-M33 HydrophobicContact CE2-SD 3.97Å; Y29-M33 HydrophobicContact CG-CG 4.33Å; Y29-M33 WeakPolarHBondContact O-CB 3.39Å; Y29-M33 VanDerWaalsContact O-CG 3.31Å; Y29-M33 WeakPolarHBondContact O-CG 3.27Å; Y29-M33 PolarHBondContact O-N 3.12Å; K30-M33 PolarHBondContact O-N 2.86Å; M33-E35 VanDerWaalsContact C-N 3.33Å; M33-E35 PolarHBondContact O-N 2.82Å; M33-T36 PolarHBondContact O-N 2.96Å; M33-C37 VanDerWaalsContact O-CB 3.29Å; M33-C37 WeakPolarHBondContact O-CB 3.23Å; M33-C37 PolarHBondContact O-N 3.4Å; M33-C37 PolarHBondContact O-SG 3.47Å; M33-C37 VanDerWaalsContact O-SG 3.34Å
34	L	62.2	Low	68	Low	20 Å²	20	61.8 Å²	61.8	11%	0.105	35%	0.348	C	S	.	.	H	α-helix	trans	-61.2	-43	174	-169.4	72.7	0	0	0	111.7	K30 D31 V32 C37 R38 Y94 E95	K30-L34 WeakPolarHBondContact O-CB 3.24Å; K30-L34 PolarHBondContact O-N 2.77Å; D31-L34 PolarHBondContact O-N 2.73Å; V32-L34 VanDerWaalsContact C-N 3.33Å; V32-L34 PolarHBondContact O-N 2.94Å; L34-C37 WeakPolarHBondContact O-CB 3.17Å; L34-C37 PolarHBondContact O-N 3.14Å; L34-R38 WeakPolarHBondContact O-CG 3.46Å; L34-R38 PolarHBondContact O-N 2.9Å; L34-Y94 HydrophobicContact CD1-CD1 4.26Å; L34-E95 HydrophobicContact CD1-CB 4.16Å; L34-E95 HydrophobicContact CD1-CG 3.38Å; L34-E95 HydrophobicContact CD2-CG 4.15Å; L34-E95 HydrophobicContact CG-CG 4.42Å
35	E	68	Low	67.1	Low	83 Å²	83	60.6 Å²	60.6	39%	0.388	33%	0.331	S	S	.	.	H	α-helix	trans	-70.2	-42.4	179.5	-166.7	58.4	-156.9	0	0	112.1	D31 V32 M33 C37 R38 N39	D31-E35 WeakPolarHBondContact O-CB 3.22Å; D31-E35 PolarHBondContact O-N 3.14Å; V32-E35 PolarHBondContact O-N 3.24Å; M33-E35 VanDerWaalsContact C-N 3.33Å; M33-E35 PolarHBondContact O-N 2.82Å; E35-C37 VanDerWaalsContact C-N 3.32Å; E35-C37 PolarHBondContact O-N 3.39Å; E35-R38 WeakPolarHBondContact O-CB 3.47Å; E35-R38 PolarHBondContact O-N 3.25Å; E35-R38 IonicContact OE2-NH1 3.13Å; E35-R38 PolarHBondContact OE2-NH1 3.27Å; E35-N39 WeakPolarHBondContact O-CB 3.35Å; E35-N39 PolarHBondContact O-N 3.17Å; E35-N39 PolarHBondContact O-ND2 3.06Å
36	T	68.2	Low	66.3	Low	26 Å²	26	63.3 Å²	63.3	16%	0.16	34%	0.342	C	S	.	.	H	α-helix	trans	-56.7	-46.6	172.1	-63.4	0	0	0	0	111.2	V9 V32 M33 R38 N39 L40	V9-T36 HydrophobicContact CB-CG2 3.81Å; V9-T36 HydrophobicContact CG2-CG2 3.27Å; V32-T36 WeakPolarHBondContact O-CB 3.48Å; V32-T36 PolarHBondContact O-N 3.5Å; V32-T36 PolarHBondContact O-OG1 2.87Å; M33-T36 PolarHBondContact O-N 2.96Å; T36-R38 PolarHBondContact O-N 3.3Å; T36-N39 PolarHBondContact O-N 2.81Å; T36-L40 HydrophobicContact CG2-CD1 4.07Å; T36-L40 HydrophobicContact CG2-CG 4.49Å; T36-L40 WeakPolarHBondContact O-CB 3.4Å; T36-L40 VanDerWaalsContact O-CG 3.26Å; T36-L40 WeakPolarHBondContact O-CG 3.45Å; T36-L40 PolarHBondContact O-N 2.78Å
37	C	62.4	Low	65.2	Low	0 Å²	0	62 Å²	62	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-57.7	-47.2	174.6	-82.2	0	0	0	0	111.9	M33 L34 E35 N39 L40 T41 Y94 C98	M33-C37 VanDerWaalsContact O-CB 3.29Å; M33-C37 WeakPolarHBondContact O-CB 3.23Å; M33-C37 PolarHBondContact O-N 3.4Å; M33-C37 PolarHBondContact O-SG 3.47Å; M33-C37 VanDerWaalsContact O-SG 3.34Å; L34-C37 WeakPolarHBondContact O-CB 3.17Å; L34-C37 PolarHBondContact O-N 3.14Å; E35-C37 VanDerWaalsContact C-N 3.32Å; E35-C37 PolarHBondContact O-N 3.39Å; C37-N39 PolarHBondContact O-N 3.41Å; C37-L40 PolarHBondContact O-N 3.31Å; C37-T41 PolarHBondContact O-N 3.24Å; C37-T41 PolarHBondContact O-OG1 3.35Å; C37-Y94 HydrophobicContact CB-CE1 3.64Å; C37-Y94 VanDerWaalsContact CB-OH 3.32Å; C37-Y94 WeakPolarHBondContact CB-OH 3.31Å; C37-Y94 PolarHBondContact O-OH 3.07Å; C37-C98 HydrophobicContact CB-CB 4.3Å; C37-C98 WeakPolarHBondContact CB-SG 3.49Å; C37-C98 WeakPolarHBondContact SG-CB 3.43Å; C37-C98 CovalentContact SG-SG 2.07Å; C37-C98 PolarHBondContact SG-SG 3.37Å
38	R	64.7	Low	64	Low	104 Å²	104	67.9 Å²	67.9	39%	0.392	36%	0.358	S	S	.	.	H	α-helix	trans	-59.9	-45.4	176.5	-74.5	172.9	-176.2	153.1	0.3	112.2	L34 E35 T36 T41 A42	L34-R38 WeakPolarHBondContact O-CG 3.46Å; L34-R38 PolarHBondContact O-N 2.9Å; E35-R38 WeakPolarHBondContact O-CB 3.47Å; E35-R38 PolarHBondContact O-N 3.25Å; E35-R38 IonicContact OE2-NH1 3.13Å; E35-R38 PolarHBondContact OE2-NH1 3.27Å; T36-R38 PolarHBondContact O-N 3.3Å; R38-T41 PolarHBondContact O-N 3.47Å; R38-A42 PolarHBondContact O-N 3.24Å
39	N	69.8	Low	62.4	Low	85 Å²	85	65.7 Å²	65.7	46%	0.455	35%	0.347	S	S	.	.	H	α-helix	trans	-63.8	-44.7	179.2	-73.2	-34.1	0	0	0	112	E35 T36 C37 T41 A42 I43	E35-N39 WeakPolarHBondContact O-CB 3.35Å; E35-N39 PolarHBondContact O-N 3.17Å; E35-N39 PolarHBondContact O-ND2 3.06Å; T36-N39 PolarHBondContact O-N 2.81Å; C37-N39 PolarHBondContact O-N 3.41Å; N39-T41 VanDerWaalsContact C-N 3.3Å; N39-T41 PolarHBondContact O-N 3.2Å; N39-A42 WeakPolarHBondContact O-CB 3.48Å; N39-A42 PolarHBondContact O-N 3.49Å; N39-I43 PolarHBondContact O-N 3.21Å; N39-I43 VanDerWaalsContact O-N 3.13Å
40	L	64.5	Low	60.6	Low	5 Å²	5	71 Å²	71	3%	0.026	38%	0.377	C	S	.	.	H	α-helix	trans	-58	-43.7	173.4	-74.8	172.2	0	0	0	111.3	V4 Y6 V9 T36 C37 A42 I43 G44 Y45	V4-L40 HydrophobicContact CG1-CD2 4.32Å; Y6-L40 HydrophobicContact CD2-CD1 3.59Å; Y6-L40 HydrophobicContact CG-CD1 4.24Å; V9-L40 HydrophobicContact CG2-CD1 3.73Å; V9-L40 HydrophobicContact CG2-CD2 4.08Å; V9-L40 HydrophobicContact CG2-CG 4.16Å; T36-L40 HydrophobicContact CG2-CD1 4.07Å; T36-L40 HydrophobicContact CG2-CG 4.49Å; T36-L40 WeakPolarHBondContact O-CB 3.4Å; T36-L40 VanDerWaalsContact O-CG 3.26Å; T36-L40 WeakPolarHBondContact O-CG 3.45Å; T36-L40 PolarHBondContact O-N 2.78Å; C37-L40 PolarHBondContact O-N 3.31Å; L40-A42 PolarHBondContact O-N 3.08Å; L40-I43 HydrophobicContact CD2-CD1 4.26Å; L40-I43 WeakPolarHBondContact O-CG1 3.29Å; L40-I43 PolarHBondContact O-N 3.24Å; L40-G44 PolarHBondContact O-N 3.4Å; L40-Y45 HydrophobicContact CB-CD1 4.04Å; L40-Y45 HydrophobicContact CB-CG 4.14Å; L40-Y45 HydrophobicContact CD1-CD1 4.26Å; L40-Y45 HydrophobicContact CD2-CG 4.22Å; L40-Y45 WeakPolarHBondContact O-CB 3.49Å; L40-Y45 PolarHBondContact O-N 3.07Å
41	T	59	Low	59.5	Low	54 Å²	54	71.3 Å²	71.3	33%	0.331	38%	0.383	S	S	.	.	H	α-helix	trans	-65.2	-38.9	177.8	-52.9	0	0	0	0	111.8	C37 R38 N39 I43 G44 Y94	C37-T41 PolarHBondContact O-N 3.24Å; C37-T41 PolarHBondContact O-OG1 3.35Å; R38-T41 PolarHBondContact O-N 3.47Å; N39-T41 VanDerWaalsContact C-N 3.3Å; N39-T41 PolarHBondContact O-N 3.2Å; T41-I43 VanDerWaalsContact C-N 3.29Å; T41-I43 PolarHBondContact O-N 3.28Å; T41-G44 PolarHBondContact O-N 3.32Å; T41-Y94 PolarHBondContact OG1-OH 3.31Å
42	A	61.5	Low	58.3	Low	87 Å²	87	67.7 Å²	67.7	72%	0.719	36%	0.363	S	S	*	.	H	α-helix	trans	-63.4	-32.5	177.2	0	0	0	0	0	112.9	R38 N39 L40 G44	R38-A42 PolarHBondContact O-N 3.24Å; N39-A42 WeakPolarHBondContact O-CB 3.48Å; N39-A42 PolarHBondContact O-N 3.49Å; L40-A42 PolarHBondContact O-N 3.08Å; A42-G44 VanDerWaalsContact C-N 3.28Å
43	I	68.8	Low	56.8	Low	118 Å²	118	70 Å²	70	61%	0.605	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	7	173.6	66.6	173.4	0	0	0	113.4	V4 N39 L40 T41	V4-I43 HydrophobicContact CB-CD1 4.5Å; N39-I43 PolarHBondContact O-N 3.21Å; N39-I43 VanDerWaalsContact O-N 3.13Å; L40-I43 HydrophobicContact CD2-CD1 4.26Å; L40-I43 WeakPolarHBondContact O-CG1 3.29Å; L40-I43 PolarHBondContact O-N 3.24Å; T41-I43 VanDerWaalsContact C-N 3.29Å; T41-I43 PolarHBondContact O-N 3.28Å
44	G	57.7	Low	55.5	Low	53 Å²	53	72 Å²	72	55%	0.546	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	13	175.2	0	0	0	0	0	115.3	L40 T41 A42	L40-G44 PolarHBondContact O-N 3.4Å; T41-G44 PolarHBondContact O-N 3.32Å; A42-G44 VanDerWaalsContact C-N 3.28Å
45	Y	55.6	Low	54.5	Low	55 Å²	55	76.5 Å²	76.5	22%	0.216	40%	0.399	C	S	.	.			trans	-62.3	135	172.5	-177.9	-97.9	0	0	0	110.8	T5 Y6 L40 L47	T5-Y45 VanDerWaalsContact CA-CE2 3.49Å; T5-Y45 HydrophobicContact CG2-CE2 4.32Å; Y6-Y45 VanDerWaalsContact CB-CE1 3.48Å; Y6-Y45 VanDerWaalsContact CB-CZ 3.5Å; Y6-Y45 VanDerWaalsContact CB-OH 3.26Å; Y6-Y45 WeakPolarHBondContact CB-OH 3.49Å; Y6-Y45 VanDerWaalsContact N-CZ 3.27Å; Y6-Y45 PolarHBondContact N-OH 3.23Å; L40-Y45 HydrophobicContact CB-CD1 4.04Å; L40-Y45 HydrophobicContact CB-CG 4.14Å; L40-Y45 HydrophobicContact CD1-CD1 4.26Å; L40-Y45 HydrophobicContact CD2-CG 4.22Å; L40-Y45 WeakPolarHBondContact O-CB 3.49Å; L40-Y45 PolarHBondContact O-N 3.07Å; Y45-L47 HydrophobicContact CD1-CG 4.24Å; Y45-L47 HydrophobicContact CE1-CB 4.38Å; Y45-L47 HydrophobicContact CE1-CD2 4.12Å; Y45-L47 HydrophobicContact CE1-CG 3.85Å
46	K	55.4	Low	53.2	Low	145 Å²	145	73.5 Å²	73.5	63%	0.63	39%	0.387	S	S	*	.			trans	-108.1	98.6	179	-62.8	179.5	-175.9	174.3	0	109.3	Q48 Y68	K46-Q48 PolarHBondContact O-N 3.46Å; K46-Q48 VanDerWaalsContact O-N 3.17Å; K46-Y68 VanDerWaalsContact CA-CE1 3.47Å; K46-Y68 HydrophobicContact CB-CD1 3.76Å; K46-Y68 HydrophobicContact CB-CE1 3.52Å; K46-Y68 HydrophobicContact CG-CD1 3.73Å; K46-Y68 HydrophobicContact CG-CE1 4.03Å; K46-Y68 HydrophobicContact CG-CG 4.26Å
47	L	51.3	Low	52	Low	29 Å²	29	77 Å²	77	15%	0.152	41%	0.411	C	S	.	.			trans	-53.6	117.4	168.2	-87.5	156.9	0	0	0	109.4	Y6 Y45 D49 Y68 Y94	Y6-L47 HydrophobicContact CD1-CD2 4.46Å; Y6-L47 HydrophobicContact CD2-CD2 4.02Å; Y6-L47 HydrophobicContact CE2-CD2 4.41Å; Y6-L47 HydrophobicContact CG-CD2 4.05Å; Y45-L47 HydrophobicContact CD1-CG 4.24Å; Y45-L47 HydrophobicContact CE1-CB 4.38Å; Y45-L47 HydrophobicContact CE1-CD2 4.12Å; Y45-L47 HydrophobicContact CE1-CG 3.85Å; L47-D49 VanDerWaalsContact C-N 3.32Å; L47-D49 PolarHBondContact O-N 2.77Å; L47-Y68 WeakPolarHBondContact O-CE1 3.44Å; L47-Y68 PolarHBondContact O-OH 3.15Å; L47-Y94 HydrophobicContact CD1-CE2 4.36Å
48	Q	44.9	Very low	51	Low	184 Å²	184	79.7 Å²	79.7	86%	0.86	43%	0.429	S	S	*	.	S	Bend	trans	-72.4	79.3	-177.7	-70.4	179.8	0.6	0	0	111.7	K46	K46-Q48 PolarHBondContact O-N 3.46Å; K46-Q48 VanDerWaalsContact O-N 3.17Å
49	D	42.3	Very low	49.8	Very low	65 Å²	65	78.3 Å²	78.3	35%	0.348	44%	0.435	S	S	.	.			trans	-134.6	98.1	154.7	-165.7	-13.1	0	0	0	109.3	L47 N51	L47-D49 VanDerWaalsContact C-N 3.32Å; L47-D49 PolarHBondContact O-N 2.77Å; D49-N51 PolarHBondContact O-N 2.81Å; D49-N51 PolarHBondContact OD1-ND2 3.09Å
50	D	37.5	Very low	48.6	Very low	143 Å²	143	87.2 Å²	87.2	77%	0.765	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	11.2	-173.6	-68.4	-38	0	0	0	114.9
51	N	41.9	Very low	47.4	Very low	79 Å²	79	89.2 Å²	89.2	42%	0.422	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	16.2	-165.3	-63.2	-79.6	0	0	0	117.2	D49 K121	D49-N51 PolarHBondContact O-N 2.81Å; D49-N51 PolarHBondContact OD1-ND2 3.09Å; N51-K121 PolarHBondContact OD1-NZ 3.16Å
52	I	44.9	Very low	46.5	Very low	17 Å²	17	87.9 Å²	87.9	9%	0.087	48%	0.477	C	S	.	.			trans	-112.9	84	177.5	-50.3	179.7	0	0	0	111.3	E54 T93 I97	I52-E54 HydrophobicContact CG2-CG 4.16Å; I52-T93 HydrophobicContact CD1-CG2 4.24Å; I52-I97 HydrophobicContact CD1-CD1 3.29Å; I52-I97 HydrophobicContact CD1-CG1 4.47Å
53	E	42.1	Very low	45.6	Very low	116 Å²	116	86.1 Å²	86.1	54%	0.542	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	112.4	160.4	-69.6	-170.9	159.6	0	0	109
54	E	42	Very low	44.4	Very low	43 Å²	43	89.6 Å²	89.6	20%	0.201	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	136.7	173.1	-70.2	-147.4	140	0	0	111.5	I52 Y65 R89	I52-E54 HydrophobicContact CG2-CG 4.16Å; E54-Y65 PolarHBondContact N-O 3.05Å; E54-R89 IonicContact OE1-CZ 3.86Å; E54-R89 IonicContact OE1-NE 2.74Å; E54-R89 PolarHBondContact OE1-NE 3.27Å; E54-R89 IonicContact OE1-NH2 3.69Å; E54-R89 PolarHBondContact OE1-NH2 3.36Å; E54-R89 IonicContact OE2-CZ 3.79Å; E54-R89 IonicContact OE2-NE 2.9Å; E54-R89 PolarHBondContact OE2-NE 3.45Å; E54-R89 IonicContact OE2-NH2 3.04Å
55	H	42.7	Very low	43.8	Very low	115 Å²	115	89.4 Å²	89.4	53%	0.532	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-103.9	132.2	174.1	-74.1	64.5	0	0	0	109.4	P57	H55-P57 WeakPolarHBondContact O-CD 3.41Å
56	C	40	Very low	43	Very low	21 Å²	21	90.1 Å²	90.1	14%	0.142	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-66.7	121.8	172.9	-170.3	0	0	0	0	109.6	S58 C62	C56-S58 PolarHBondContact O-N 3.02Å; C56-S58 PolarHBondContact SG-OG 3.21Å; C56-C62 HydrophobicContact CB-CB 4.03Å
57	P	42.5	Very low	42.3	Very low	100 Å²	100	84 Å²	84	65%	0.649	44%	0.437	S	S	*	.	S	Bend	trans	-66.7	-25.5	180	-19.3	31.3	0	0	0	113.3	H55 S59	H55-P57 WeakPolarHBondContact O-CD 3.41Å; P57-S59 PolarHBondContact O-N 3.3Å
58	S	41.8	Very low	41.8	Very low	55 Å²	55	86 Å²	86	39%	0.385	44%	0.443	S	S	.	.	S	Bend	trans	-88.8	109.4	178.8	56.8	0	0	0	0	110.4	C56	C56-S58 PolarHBondContact O-N 3.02Å; C56-S58 PolarHBondContact SG-OG 3.21Å
59	S	39.5	Very low	41.6	Very low	76 Å²	76	79 Å²	79	53%	0.531	42%	0.42	S	S	.	.			trans	79.6	116.2	166.7	-53.4	0	0	0	0	116.2	P57 G61 C62	P57-S59 PolarHBondContact O-N 3.3Å; S59-G61 PolarHBondContact O-N 2.95Å; S59-C62 PolarHBondContact O-N 3.27Å; S59-C62 VanDerWaalsContact O-N 3.13Å
60	R	45.4	Very low	41.5	Very low	272 Å²	272	83.2 Å²	83.2	100%	1.026	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	10.3	175.7	-80.5	177.8	169.3	152.5	-3.4	116.6
61	G	39.7	Very low	41.7	Very low	46 Å²	46	84.5 Å²	84.5	47%	0.474	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121	-7.8	178.1	0	0	0	0	0	114.8	S59 G63 H75	S59-G61 PolarHBondContact O-N 2.95Å; G61-G63 PolarHBondContact O-N 3.46Å; G61-H75 PolarHBondContact O-CE1 3.28Å
62	C	39.2	Very low	41.7	Very low	27 Å²	27	84.4 Å²	84.4	18%	0.182	44%	0.435	C	S	.	.	S	Bend	trans	-77.9	113.5	177.3	-152.2	0	0	0	0	108.8	C56 S59 Y65	C56-C62 HydrophobicContact CB-CB 4.03Å; S59-C62 PolarHBondContact O-N 3.27Å; S59-C62 VanDerWaalsContact O-N 3.13Å; C62-Y65 PolarHBondContact SG-OH 3.36Å
63	G	42.4	Very low	41.7	Very low	50 Å²	50	86.1 Å²	86.1	52%	0.515	45%	0.448	S	S	.	.			trans	-57.3	164.8	-175	0	0	0	0	0	114	G61 Y65	G61-G63 PolarHBondContact O-N 3.46Å; G63-Y65 VanDerWaalsContact O-CD2 3.3Å; G63-Y65 WeakPolarHBondContact O-CD2 3.36Å; G63-Y65 VanDerWaalsContact O-CE2 3.25Å; G63-Y65 WeakPolarHBondContact O-CE2 3.25Å
64	R	43.5	Very low	41.6	Very low	190 Å²	190	89.4 Å²	89.4	72%	0.717	46%	0.463	S	S	*	.			trans	-61.5	133.5	177.6	-66.4	-179.2	-179.9	165.2	3.1	110.6
65	Y	45.2	Very low	41.8	Very low	50 Å²	50	92.4 Å²	92.4	20%	0.196	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	131.9	171.2	-60	-76.3	0	0	0	109.5	E54 C62 G63 K71	E54-Y65 PolarHBondContact N-O 3.05Å; C62-Y65 PolarHBondContact SG-OH 3.36Å; G63-Y65 VanDerWaalsContact O-CD2 3.3Å; G63-Y65 WeakPolarHBondContact O-CD2 3.36Å; G63-Y65 VanDerWaalsContact O-CE2 3.25Å; G63-Y65 WeakPolarHBondContact O-CE2 3.25Å; Y65-K71 WeakPolarHBondContact CE1-O 3.31Å
66	N	39.3	Very low	41.7	Very low	69 Å²	69	97.3 Å²	97.3	37%	0.369	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	156.8	168.4	-172.2	-9	0	0	0	107.7	Y68 G69	N66-Y68 WeakPolarHBondContact ND2-CD2 3.36Å; N66-Y68 PolarHBondContact O-N 2.95Å; N66-Y68 WeakPolarHBondContact OD1-CD2 3.32Å; N66-G69 PolarHBondContact O-N 3.45Å
67	I	39.9	Very low	41.9	Very low	16 Å²	16	99.8 Å²	99.8	8%	0.082	53%	0.526	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-25.9	176.2	-159.8	168.6	0	0	0	113.9	F90 Y94 I97	I67-F90 HydrophobicContact CB-CE2 4.31Å; I67-F90 HydrophobicContact CG1-CE2 4.1Å; I67-F90 HydrophobicContact CG1-CZ 4.04Å; I67-Y94 HydrophobicContact CD1-CD2 3.97Å; I67-Y94 HydrophobicContact CD1-CE2 4.31Å; I67-Y94 HydrophobicContact CG1-CD2 4.04Å; I67-Y94 HydrophobicContact CG1-CE2 4.27Å; I67-I97 HydrophobicContact CD1-CD1 4.19Å
68	Y	40.4	Very low	41.8	Very low	73 Å²	73	102.7 Å²	102.7	29%	0.286	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	1.5	-177.4	-45.4	-66.7	0	0	0	115.8	K46 L47 N66	K46-Y68 VanDerWaalsContact CA-CE1 3.47Å; K46-Y68 HydrophobicContact CB-CD1 3.76Å; K46-Y68 HydrophobicContact CB-CE1 3.52Å; K46-Y68 HydrophobicContact CG-CD1 3.73Å; K46-Y68 HydrophobicContact CG-CE1 4.03Å; K46-Y68 HydrophobicContact CG-CG 4.26Å; L47-Y68 WeakPolarHBondContact O-CE1 3.44Å; L47-Y68 PolarHBondContact O-OH 3.15Å; N66-Y68 WeakPolarHBondContact ND2-CD2 3.36Å; N66-Y68 PolarHBondContact O-N 2.95Å; N66-Y68 WeakPolarHBondContact OD1-CD2 3.32Å
69	G	40.4	Very low	41.6	Very low	36 Å²	36	102.7 Å²	102.7	37%	0.371	53%	0.534	S	S	.	.			trans	-149	84.8	-167.8	0	0	0	0	0	114.6	N66 K71	N66-G69 PolarHBondContact O-N 3.45Å; G69-K71 PolarHBondContact O-N 3.41Å
70	Y	41.1	Very low	41.8	Very low	153 Å²	153	109 Å²	109	60%	0.6	55%	0.552	S	S	*	*			trans	-74.7	103	161.7	-178.4	-105	0	0	0	109.3	P72 Q87	Y70-P72 HydrophobicContact CD1-CG 4.28Å; Y70-P72 HydrophobicContact CE1-CB 4.47Å; Y70-P72 HydrophobicContact CE1-CG 3.66Å; Y70-Q87 HydrophobicContact CE2-CG 4.21Å; Y70-Q87 PolarHBondContact OH-NE2 2.79Å
71	K	41.8	Very low	41.6	Very low	170 Å²	170	104.9 Å²	104.9	74%	0.739	54%	0.541	S	S	*	.			trans	-101.9	118.6	158.3	-84	-171	175.5	-175.6	0	108.6	Y65 G69 C73	Y65-K71 WeakPolarHBondContact CE1-O 3.31Å; G69-K71 PolarHBondContact O-N 3.41Å; K71-C73 PolarHBondContact O-N 3.46Å
72	P	42.3	Very low	41.7	Very low	77 Å²	77	108.1 Å²	108.1	50%	0.5	54%	0.544	S	S	.	.			trans	-51	133.6	168.6	-22.5	30.6	0	0	0	110.2	Y70 E74	Y70-P72 HydrophobicContact CD1-CG 4.28Å; Y70-P72 HydrophobicContact CE1-CB 4.47Å; Y70-P72 HydrophobicContact CE1-CG 3.66Å; P72-E74 PolarHBondContact O-N 2.95Å; P72-E74 VanDerWaalsContact O-N 3.11Å
73	C	43.7	Very low	41.8	Very low	54 Å²	54	108.4 Å²	108.4	37%	0.365	55%	0.546	S	S	.	.			trans	-64.8	110.2	175.1	177.4	0	0	0	0	109.3	K71 H75	K71-C73 PolarHBondContact O-N 3.46Å; C73-H75 VanDerWaalsContact C-N 3.26Å; C73-H75 PolarHBondContact O-N 2.58Å; C73-H75 PolarHBondContact SG-ND1 3.1Å
74	E	41	Very low	41.7	Very low	185 Å²	185	109.6 Å²	109.6	86%	0.864	54%	0.543	S	S	*	.			trans	-87.1	27.6	-178.5	-66.5	-170.1	161.8	0	0	113.7	P72 K76	P72-E74 PolarHBondContact O-N 2.95Å; P72-E74 VanDerWaalsContact O-N 3.11Å; E74-K76 PolarHBondContact O-N 3.33Å
75	H	45.2	Very low	41.4	Very low	106 Å²	106	107 Å²	107	49%	0.491	54%	0.537	S	S	.	.			trans	-70.4	106.7	175.6	-82.6	100.6	0	0	0	111.2	G61 C73 G77	G61-H75 PolarHBondContact O-CE1 3.28Å; C73-H75 VanDerWaalsContact C-N 3.26Å; C73-H75 PolarHBondContact O-N 2.58Å; C73-H75 PolarHBondContact SG-ND1 3.1Å; H75-G77 PolarHBondContact O-N 2.89Å
76	K	40.9	Very low	41.3	Very low	217 Å²	217	105.6 Å²	105.6	94%	0.943	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	99.3	167.3	-66.6	-175.9	-179.3	179.3	0	109.2	E74	E74-K76 PolarHBondContact O-N 3.33Å
77	G	45.3	Very low	41.5	Very low	73 Å²	73	105.8 Å²	105.8	75%	0.753	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	145.2	-29.1	170.5	0	0	0	0	0	114.9	H75	H75-G77 PolarHBondContact O-N 2.89Å
78	Y	39.1	Very low	41.8	Very low	161 Å²	161	111.6 Å²	111.6	63%	0.631	56%	0.559	S	S	*	*	S	Bend	trans	-99.9	100.9	170.5	-74.7	-88.3	0	0	0	107.9	Q82	Y78-Q82 VanDerWaalsContact CD1-OE1 3.24Å
79	G	39.1	Very low	42.2	Very low	55 Å²	55	113.3 Å²	113.3	57%	0.567	57%	0.565	S	S	*	*			trans	-48.5	147.5	179.1	0	0	0	0	0	111.5	K81 Q82	G79-K81 PolarHBondContact O-N 3.25Å; G79-Q82 PolarHBondContact O-N 3.14Å
80	K	43.1	Very low	42.7	Very low	209 Å²	209	114.6 Å²	114.6	91%	0.909	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-40.4	-9	-178	-73.3	175.1	173.5	176.4	0	117.3
81	K	41.3	Very low	43.2	Very low	185 Å²	185	110.9 Å²	110.9	80%	0.804	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-26.3	-176.8	-63.8	-172.9	177.1	-178	0	114.8	G79 T84	G79-K81 PolarHBondContact O-N 3.25Å; K81-T84 PolarHBondContact O-OG1 2.88Å
82	Q	41.1	Very low	43.9	Very low	115 Å²	115	106.3 Å²	106.3	54%	0.537	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-17.1	-170.8	-76	-174	-2.7	0	0	116.5	Y78 G79 T84	Y78-Q82 VanDerWaalsContact CD1-OE1 3.24Å; G79-Q82 PolarHBondContact O-N 3.14Å; Q82-T84 VanDerWaalsContact C-N 3.28Å; Q82-T84 PolarHBondContact O-N 3.43Å
83	C	42.3	Very low	44.3	Very low	32 Å²	32	103.8 Å²	103.8	22%	0.216	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	14.2	177	-145.6	0	0	0	0	113.9	Q87	C83-Q87 WeakPolarHBondContact O-CG 3.29Å
84	T	39.1	Very low	44.7	Very low	75 Å²	75	101.9 Å²	101.9	46%	0.46	50%	0.501	S	S	.	.	H	α-helix	trans	-73.4	-29.2	178.8	52.1	0	0	0	0	112.6	K81 Q82 Q87 K88	K81-T84 PolarHBondContact O-OG1 2.88Å; Q82-T84 VanDerWaalsContact C-N 3.28Å; Q82-T84 PolarHBondContact O-N 3.43Å; T84-Q87 PolarHBondContact O-N 2.78Å; T84-K88 PolarHBondContact O-N 2.8Å
85	F	38.4	Very low	45.3	Very low	135 Å²	135	96.5 Å²	96.5	59%	0.592	48%	0.476	S	S	*	.	H	α-helix	trans	-67.6	-43.8	-179.4	-173.6	-97.9	0	0	0	112.7	K88 R89	F85-K88 PolarHBondContact O-N 3.27Å; F85-R89 PolarHBondContact O-N 3.38Å; F85-R89 VanDerWaalsContact O-N 3.15Å
86	A	43.3	Very low	46	Very low	22 Å²	22	95.5 Å²	95.5	18%	0.182	47%	0.467	C	S	.	.	H	α-helix	trans	-66.4	-39.4	175.4	0	0	0	0	0	111.6	K88 R89 F90	A86-K88 PolarHBondContact O-N 3.3Å; A86-R89 PolarHBondContact O-N 3.42Å; A86-F90 WeakPolarHBondContact O-CB 3.49Å; A86-F90 PolarHBondContact O-N 2.89Å
87	Q	41.7	Very low	46.6	Very low	72 Å²	72	87.3 Å²	87.3	34%	0.336	43%	0.433	S	S	.	.	H	α-helix	trans	-59.4	-45	173.8	-71.8	169.3	-9.1	0	0	112.1	Y70 C83 T84 L91	Y70-Q87 HydrophobicContact CE2-CG 4.21Å; Y70-Q87 PolarHBondContact OH-NE2 2.79Å; C83-Q87 WeakPolarHBondContact O-CG 3.29Å; T84-Q87 PolarHBondContact O-N 2.78Å; Q87-L91 WeakPolarHBondContact O-CB 3.38Å; Q87-L91 VanDerWaalsContact O-CG 3.29Å; Q87-L91 WeakPolarHBondContact O-CG 3.46Å; Q87-L91 PolarHBondContact O-N 3.4Å
88	K	48	Very low	46.9	Very low	138 Å²	138	84 Å²	84	60%	0.6	40%	0.399	S	S	*	.	H	α-helix	trans	-65.1	-42.6	179.4	-170	176.5	-177.1	177.8	0	112.3	T84 F85 A86 L91 Q92	T84-K88 PolarHBondContact O-N 2.8Å; F85-K88 PolarHBondContact O-N 3.27Å; A86-K88 PolarHBondContact O-N 3.3Å; K88-L91 PolarHBondContact O-N 3.42Å; K88-Q92 WeakPolarHBondContact O-CB 3.42Å; K88-Q92 VanDerWaalsContact O-CG 3.26Å; K88-Q92 WeakPolarHBondContact O-CG 3.32Å; K88-Q92 PolarHBondContact O-N 3.11Å
89	R	48.3	Very low	47.7	Very low	109 Å²	109	77.8 Å²	77.8	41%	0.411	38%	0.379	S	S	.	.	H	α-helix	trans	-71.3	-35.3	-179.5	-146.9	179.1	87.6	160	9.7	112.6	E54 F85 A86 Q92 T93	E54-R89 IonicContact OE1-CZ 3.86Å; E54-R89 IonicContact OE1-NE 2.74Å; E54-R89 PolarHBondContact OE1-NE 3.27Å; E54-R89 IonicContact OE1-NH2 3.69Å; E54-R89 PolarHBondContact OE1-NH2 3.36Å; E54-R89 IonicContact OE2-CZ 3.79Å; E54-R89 IonicContact OE2-NE 2.9Å; E54-R89 PolarHBondContact OE2-NE 3.45Å; E54-R89 IonicContact OE2-NH2 3.04Å; F85-R89 PolarHBondContact O-N 3.38Å; F85-R89 VanDerWaalsContact O-N 3.15Å; A86-R89 PolarHBondContact O-N 3.42Å; R89-Q92 PolarHBondContact O-N 3.32Å; R89-T93 WeakPolarHBondContact O-CB 3.35Å; R89-T93 PolarHBondContact O-N 2.91Å; R89-T93 PolarHBondContact O-OG1 3.01Å
90	F	51.3	Low	48.5	Very low	64 Å²	64	81.2 Å²	81.2	28%	0.281	38%	0.38	S	S	.	.	H	α-helix	trans	-60.5	-52.6	170.6	179.6	-99.7	0	0	0	111.3	I67 A86 Q92 T93 Y94	I67-F90 HydrophobicContact CB-CE2 4.31Å; I67-F90 HydrophobicContact CG1-CE2 4.1Å; I67-F90 HydrophobicContact CG1-CZ 4.04Å; A86-F90 WeakPolarHBondContact O-CB 3.49Å; A86-F90 PolarHBondContact O-N 2.89Å; F90-Q92 VanDerWaalsContact C-N 3.33Å; F90-Q92 PolarHBondContact O-N 3.29Å; F90-T93 PolarHBondContact O-N 2.78Å; F90-Y94 HydrophobicContact CZ-CD2 4.47Å; F90-Y94 VanDerWaalsContact O-CB 3.27Å; F90-Y94 WeakPolarHBondContact O-CB 3.38Å; F90-Y94 PolarHBondContact O-N 3.45Å
91	L	51.1	Low	49.2	Very low	75 Å²	75	75.5 Å²	75.5	39%	0.393	36%	0.357	S	S	.	.	H	α-helix	trans	-58.6	-43.2	176.6	-72.7	170.9	0	0	0	111.6	Q87 K88 T93 Y94 E95	Q87-L91 WeakPolarHBondContact O-CB 3.38Å; Q87-L91 VanDerWaalsContact O-CG 3.29Å; Q87-L91 WeakPolarHBondContact O-CG 3.46Å; Q87-L91 PolarHBondContact O-N 3.4Å; K88-L91 PolarHBondContact O-N 3.42Å; L91-T93 PolarHBondContact O-N 3.38Å; L91-Y94 WeakPolarHBondContact O-CB 3.48Å; L91-Y94 PolarHBondContact O-N 2.94Å; L91-E95 VanDerWaalsContact O-CB 3.27Å; L91-E95 WeakPolarHBondContact O-CB 3.39Å; L91-E95 WeakPolarHBondContact O-CG 3.23Å; L91-E95 PolarHBondContact O-N 3.18Å
92	Q	56	Low	50.6	Low	74 Å²	74	72 Å²	72	35%	0.346	34%	0.341	S	S	.	.	H	α-helix	trans	-62.9	-38.4	176.4	-76.3	175.6	-12.8	0	0	113.5	K88 R89 F90 R96	K88-Q92 WeakPolarHBondContact O-CB 3.42Å; K88-Q92 VanDerWaalsContact O-CG 3.26Å; K88-Q92 WeakPolarHBondContact O-CG 3.32Å; K88-Q92 PolarHBondContact O-N 3.11Å; R89-Q92 PolarHBondContact O-N 3.32Å; F90-Q92 VanDerWaalsContact C-N 3.33Å; F90-Q92 PolarHBondContact O-N 3.29Å; Q92-R96 VanDerWaalsContact O-CG 3.26Å; Q92-R96 WeakPolarHBondContact O-CG 3.4Å; Q92-R96 PolarHBondContact O-N 3.22Å
93	T	52	Low	52	Low	23 Å²	23	70.4 Å²	70.4	14%	0.141	34%	0.341	C	S	.	.	H	α-helix	trans	-71.8	-38.4	177.5	-53.7	0	0	0	0	110.6	I52 R89 F90 L91 R96 I97	I52-T93 HydrophobicContact CD1-CG2 4.24Å; R89-T93 WeakPolarHBondContact O-CB 3.35Å; R89-T93 PolarHBondContact O-N 2.91Å; R89-T93 PolarHBondContact O-OG1 3.01Å; F90-T93 PolarHBondContact O-N 2.78Å; L91-T93 PolarHBondContact O-N 3.38Å; T93-R96 PolarHBondContact O-N 3.24Å; T93-I97 HydrophobicContact CG2-CD1 4.3Å; T93-I97 WeakPolarHBondContact O-CD1 3.2Å; T93-I97 VanDerWaalsContact O-CG1 3.28Å; T93-I97 WeakPolarHBondContact O-CG1 3.34Å; T93-I97 PolarHBondContact O-N 3.06Å; T93-I97 VanDerWaalsContact O-N 3.17Å
94	Y	52	Low	53.3	Low	14 Å²	14	72.5 Å²	72.5	6%	0.055	35%	0.345	C	S	.	.	H	α-helix	trans	-65.8	-45.7	175.9	-169	-93.7	0	0	0	112.4	L34 C37 T41 L47 I67 F90 L91 R96 I97 C98	L34-Y94 HydrophobicContact CD1-CD1 4.26Å; C37-Y94 HydrophobicContact CB-CE1 3.64Å; C37-Y94 VanDerWaalsContact CB-OH 3.32Å; C37-Y94 WeakPolarHBondContact CB-OH 3.31Å; C37-Y94 PolarHBondContact O-OH 3.07Å; T41-Y94 PolarHBondContact OG1-OH 3.31Å; L47-Y94 HydrophobicContact CD1-CE2 4.36Å; I67-Y94 HydrophobicContact CD1-CD2 3.97Å; I67-Y94 HydrophobicContact CD1-CE2 4.31Å; I67-Y94 HydrophobicContact CG1-CD2 4.04Å; I67-Y94 HydrophobicContact CG1-CE2 4.27Å; F90-Y94 HydrophobicContact CZ-CD2 4.47Å; F90-Y94 VanDerWaalsContact O-CB 3.27Å; F90-Y94 WeakPolarHBondContact O-CB 3.38Å; F90-Y94 PolarHBondContact O-N 3.45Å; L91-Y94 WeakPolarHBondContact O-CB 3.48Å; L91-Y94 PolarHBondContact O-N 2.94Å; Y94-R96 VanDerWaalsContact C-N 3.28Å; Y94-R96 PolarHBondContact O-N 2.91Å; Y94-I97 PolarHBondContact O-N 3.49Å; Y94-C98 PolarHBondContact O-N 3.39Å; Y94-C98 VanDerWaalsContact O-N 3.07Å
95	E	53.4	Low	54.9	Low	73 Å²	73	74.6 Å²	74.6	34%	0.341	35%	0.35	S	S	.	.	H	α-helix	trans	-55	-42.1	173	-79.2	164.7	-172.7	0	0	111.5	L34 L91 S99	L34-E95 HydrophobicContact CD1-CB 4.16Å; L34-E95 HydrophobicContact CD1-CG 3.38Å; L34-E95 HydrophobicContact CD2-CG 4.15Å; L34-E95 HydrophobicContact CG-CG 4.42Å; L91-E95 VanDerWaalsContact O-CB 3.27Å; L91-E95 WeakPolarHBondContact O-CB 3.39Å; L91-E95 WeakPolarHBondContact O-CG 3.23Å; L91-E95 PolarHBondContact O-N 3.18Å; E95-S99 WeakPolarHBondContact O-CB 3.43Å; E95-S99 PolarHBondContact O-N 2.87Å; E95-S99 PolarHBondContact O-OG 3.06Å
96	R	59.1	Low	56.5	Low	84 Å²	84	68.2 Å²	68.2	32%	0.317	32%	0.322	S	S	.	.	H	α-helix	trans	-67.9	-37.9	177.6	-73.1	172	-166.2	174.1	3.9	113.4	Q92 T93 Y94 S99 E100 E101	Q92-R96 VanDerWaalsContact O-CG 3.26Å; Q92-R96 WeakPolarHBondContact O-CG 3.4Å; Q92-R96 PolarHBondContact O-N 3.22Å; T93-R96 PolarHBondContact O-N 3.24Å; Y94-R96 VanDerWaalsContact C-N 3.28Å; Y94-R96 PolarHBondContact O-N 2.91Å; R96-S99 PolarHBondContact O-N 3.27Å; R96-E100 PolarHBondContact O-N 3.35Å; R96-E101 PolarHBondContact O-N 3.12Å
97	I	52.7	Low	57.9	Low	45 Å²	45	74.4 Å²	74.4	23%	0.231	35%	0.352	C	S	.	.	H	α-helix	trans	-67.1	-45.4	178.8	-66	160.2	0	0	0	110.3	I52 I67 T93 Y94 S99	I52-I97 HydrophobicContact CD1-CD1 3.29Å; I52-I97 HydrophobicContact CD1-CG1 4.47Å; I67-I97 HydrophobicContact CD1-CD1 4.19Å; T93-I97 HydrophobicContact CG2-CD1 4.3Å; T93-I97 WeakPolarHBondContact O-CD1 3.2Å; T93-I97 VanDerWaalsContact O-CG1 3.28Å; T93-I97 WeakPolarHBondContact O-CG1 3.34Å; T93-I97 PolarHBondContact O-N 3.06Å; T93-I97 VanDerWaalsContact O-N 3.17Å; Y94-I97 PolarHBondContact O-N 3.49Å; I97-S99 VanDerWaalsContact C-N 3.29Å; I97-S99 PolarHBondContact O-N 3.35Å
98	C	53.1	Low	59	Low	4 Å²	4	77.4 Å²	77.4	3%	0.027	37%	0.366	C	S	.	.	H	α-helix	trans	-71.7	-22.1	177.6	-62.1	0	0	0	0	112.7	C37 Y94	C37-C98 HydrophobicContact CB-CB 4.3Å; C37-C98 WeakPolarHBondContact CB-SG 3.49Å; C37-C98 WeakPolarHBondContact SG-CB 3.43Å; C37-C98 CovalentContact SG-SG 2.07Å; C37-C98 PolarHBondContact SG-SG 3.37Å; Y94-C98 PolarHBondContact O-N 3.39Å; Y94-C98 VanDerWaalsContact O-N 3.07Å
99	S	56.2	Low	60.4	Low	30 Å²	30	73.2 Å²	73.2	21%	0.21	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	6	-179.6	-56.2	0	0	0	0	115.2	E95 R96 I97 E101	E95-S99 WeakPolarHBondContact O-CB 3.43Å; E95-S99 PolarHBondContact O-N 2.87Å; E95-S99 PolarHBondContact O-OG 3.06Å; R96-S99 PolarHBondContact O-N 3.27Å; I97-S99 VanDerWaalsContact C-N 3.29Å; I97-S99 PolarHBondContact O-N 3.35Å; S99-E101 PolarHBondContact O-N 3.49Å
100	E	55.2	Low	61.5	Low	127 Å²	127	72.5 Å²	72.5	59%	0.593	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	14.7	-173.4	-73.3	-163.4	-167.1	0	0	115.9	Y10 R96 K102	Y10-E100 PolarHBondContact OH-OE1 3.46Å; R96-E100 PolarHBondContact O-N 3.35Å; E100-K102 PolarHBondContact O-N 2.79Å; E100-K102 VanDerWaalsContact O-N 3.12Å
101	E	58.1	Low	62.6	Low	90 Å²	90	75.4 Å²	75.4	42%	0.421	38%	0.378	S	S	.	.			trans	-71.1	111.9	177.8	-72.2	-176.7	-174	0	0	109.8	K30 R96 S99 P103	K30-E101 IonicContact NZ-OE1 3.2Å; K30-E101 PolarHBondContact NZ-OE1 3.23Å; R96-E101 PolarHBondContact O-N 3.12Å; S99-E101 PolarHBondContact O-N 3.49Å; E101-P103 WeakPolarHBondContact O-CD 3.45Å
102	K	70.7	Confident	63.6	Low	110 Å²	110	73.6 Å²	73.6	48%	0.478	37%	0.373	S	S	.	.			trans	-113.1	68.7	179.5	-67.3	176.5	-175.5	169.1	0	111.6	E100 Y104 A112 F113 A114	E100-K102 PolarHBondContact O-N 2.79Å; E100-K102 VanDerWaalsContact O-N 3.12Å; K102-Y104 PolarHBondContact O-N 3.07Å; K102-A112 HydrophobicContact CB-CB 3.62Å; K102-A112 HydrophobicContact CD-CB 4.35Å; K102-A112 WeakPolarHBondContact O-CB 3.43Å; K102-F113 CarbonylContact C-O 3.5Å; K102-F113 VanDerWaalsContact C-O 3.28Å; K102-F113 VanDerWaalsContact CA-O 3.3Å; K102-F113 WeakPolarHBondContact CA-O 3.48Å; K102-A114 HydrophobicContact CG-CB 4.45Å
103	P	69.7	Low	64.2	Low	83 Å²	83	71.9 Å²	71.9	54%	0.539	37%	0.365	S	S	.	.			trans	-72	-10.3	-172.2	28.8	-35.1	0	0	0	114.3	E101	E101-P103 WeakPolarHBondContact O-CD 3.45Å
104	Y	69.1	Low	65.1	Low	75 Å²	75	72.1 Å²	72.1	29%	0.294	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	95.6	-176.2	-59.5	-80.6	0	0	0	110.4	K102 A112 F113 N115 F116	K102-Y104 PolarHBondContact O-N 3.07Å; Y104-A112 CarbonylContact O-C 3.49Å; Y104-A112 WeakPolarHBondContact O-CA 3.01Å; Y104-F113 WeakPolarHBondContact CB-O 3.48Å; Y104-F113 WeakPolarHBondContact CD2-O 3.49Å; Y104-F113 PolarHBondContact N-O 3.33Å; Y104-F113 VanDerWaalsContact N-O 3.17Å; Y104-F113 WeakPolarHBondContact O-CD2 3.38Å; Y104-F113 PolarHBondContact O-N 3.5Å; Y104-N115 VanDerWaalsContact CD2-CA 3.42Å; Y104-F116 HydrophobicContact CD1-CB 3.91Å; Y104-F116 HydrophobicContact CD1-CD2 4.01Å; Y104-F116 HydrophobicContact CD1-CG 4.48Å; Y104-F116 HydrophobicContact CE1-CB 3.73Å; Y104-F116 HydrophobicContact CE1-CD2 4.2Å; Y104-F116 HydrophobicContact CE1-CG 4.43Å; Y104-F116 HydrophobicContact CG-CB 4.39Å
105	E	72.9	Confident	65.9	Low	119 Å²	119	72.8 Å²	72.8	56%	0.556	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	138.1	179.3	-68.3	-176.8	178.2	0	0	112.4	N107 K111 A112	E105-N107 PolarHBondContact O-N 3.18Å; E105-K111 CarbonylContact C-O 3.52Å; E105-K111 WeakPolarHBondContact CA-O 3.46Å; E105-A112 HydrophobicContact CG-CB 3.88Å
106	C	72.9	Confident	66.8	Low	1 Å²	1	74.7 Å²	74.7	1%	0.007	38%	0.381	C	S	.	.			trans	-78.5	116.5	172.1	-178.3	0	0	0	0	110.4	Q108 C109 S110 K111 F113 L119 H122 H126	C106-Q108 PolarHBondContact O-N 3.19Å; C106-Q108 PolarHBondContact SG-N 3.06Å; C106-C109 PolarHBondContact O-N 2.77Å; C106-S110 VanDerWaalsContact O-CA 3.22Å; C106-S110 WeakPolarHBondContact O-CA 3.49Å; C106-S110 PolarHBondContact O-N 2.79Å; C106-K111 PolarHBondContact N-O 2.84Å; C106-F113 HydrophobicContact CB-CE2 4.28Å; C106-L119 HydrophobicContact CB-CD1 3.56Å; C106-H122 WeakPolarHBondContact CB-NE2 3.38Å; C106-H122 PolarHBondContact SG-NE2 3.17Å; C106-H122 VanDerWaalsContact SG-NE2 3.4Å; C106-H126 PolarHBondContact SG-CD2 3.15Å; C106-H126 PolarHBondContact SG-NE2 2.73Å; C106-H126 VanDerWaalsContact SG-NE2 3.41Å
107	N	72.5	Confident	67.3	Low	153 Å²	153	79.1 Å²	79.1	82%	0.818	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-17.9	178.9	-65.3	-29.7	0	0	0	114.3	E105	E105-N107 PolarHBondContact O-N 3.18Å
108	Q	65.8	Low	68.2	Low	135 Å²	135	78.5 Å²	78.5	63%	0.631	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-22.6	-178.2	-63.5	-165.5	28.6	0	0	114.8	C106 H126	C106-Q108 PolarHBondContact O-N 3.19Å; C106-Q108 PolarHBondContact SG-N 3.06Å; Q108-H126 VanDerWaalsContact CB-CE1 3.41Å; Q108-H126 WeakPolarHBondContact CB-CE1 3.07Å; Q108-H126 WeakPolarHBondContact CB-ND1 3.46Å; Q108-H126 VanDerWaalsContact OE1-CG 3.23Å; Q108-H126 PolarHBondContact OE1-ND1 3.42Å
109	C	75.6	Confident	69.1	Low	49 Å²	49	78.8 Å²	78.8	33%	0.331	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.8	8.7	177.2	70.4	0	0	0	0	115.1	C106 K111 H122 H126	C106-C109 PolarHBondContact O-N 2.77Å; C109-K111 PolarHBondContact O-N 3.17Å; C109-K111 VanDerWaalsContact O-N 3.11Å; C109-K111 VanDerWaalsContact SG-CG 3.56Å; C109-H122 PolarHBondContact SG-CE1 3.44Å; C109-H122 PolarHBondContact SG-NE2 3.24Å; C109-H126 PolarHBondContact SG-NE2 3.12Å
110	S	72.7	Confident	69.7	Low	95 Å²	95	82.1 Å²	82.1	66%	0.664	41%	0.411	S	S	*	.			trans	56.5	21.2	-179.4	-48.8	0	0	0	0	114.5	C106 A112	C106-S110 VanDerWaalsContact O-CA 3.22Å; C106-S110 WeakPolarHBondContact O-CA 3.49Å; C106-S110 PolarHBondContact O-N 2.79Å; S110-A112 PolarHBondContact O-N 3.32Å
111	K	73.8	Confident	70.3	Confident	125 Å²	125	82 Å²	82	54%	0.543	41%	0.409	S	S	.	.			trans	-75.5	126.2	173.1	-76.5	-177.9	-178.4	178.4	0	110	E105 C106 C109 F113	E105-K111 CarbonylContact C-O 3.52Å; E105-K111 WeakPolarHBondContact CA-O 3.46Å; C106-K111 PolarHBondContact N-O 2.84Å; C109-K111 PolarHBondContact O-N 3.17Å; C109-K111 VanDerWaalsContact O-N 3.11Å; C109-K111 VanDerWaalsContact SG-CG 3.56Å; K111-F113 HydrophobicContact CB-CE2 3.72Å; K111-F113 HydrophobicContact CB-CZ 3.83Å; K111-F113 VanDerWaalsContact O-CD2 3.32Å; K111-F113 WeakPolarHBondContact O-CD2 3.41Å; K111-F113 WeakPolarHBondContact O-CE2 3.34Å
112	A	71.7	Confident	70.8	Confident	36 Å²	36	78.9 Å²	78.9	30%	0.298	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	140.6	178.6	0	0	0	0	0	111.9	K102 Y104 E105 S110	K102-A112 HydrophobicContact CB-CB 3.62Å; K102-A112 HydrophobicContact CD-CB 4.35Å; K102-A112 WeakPolarHBondContact O-CB 3.43Å; Y104-A112 CarbonylContact O-C 3.49Å; Y104-A112 WeakPolarHBondContact O-CA 3.01Å; E105-A112 HydrophobicContact CG-CB 3.88Å; S110-A112 PolarHBondContact O-N 3.32Å
113	F	69.4	Low	70.8	Confident	39 Å²	39	76.9 Å²	76.9	17%	0.171	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	144.7	-178.7	-60.1	-87.6	0	0	0	111	K102 Y104 C106 K111 N115 L119 H122	K102-F113 CarbonylContact C-O 3.5Å; K102-F113 VanDerWaalsContact C-O 3.28Å; K102-F113 VanDerWaalsContact CA-O 3.3Å; K102-F113 WeakPolarHBondContact CA-O 3.48Å; Y104-F113 WeakPolarHBondContact CB-O 3.48Å; Y104-F113 WeakPolarHBondContact CD2-O 3.49Å; Y104-F113 PolarHBondContact N-O 3.33Å; Y104-F113 VanDerWaalsContact N-O 3.17Å; Y104-F113 WeakPolarHBondContact O-CD2 3.38Å; Y104-F113 PolarHBondContact O-N 3.5Å; C106-F113 HydrophobicContact CB-CE2 4.28Å; K111-F113 HydrophobicContact CB-CE2 3.72Å; K111-F113 HydrophobicContact CB-CZ 3.83Å; K111-F113 VanDerWaalsContact O-CD2 3.32Å; K111-F113 WeakPolarHBondContact O-CD2 3.41Å; K111-F113 WeakPolarHBondContact O-CE2 3.34Å; F113-N115 VanDerWaalsContact C-N 3.26Å; F113-N115 PolarHBondContact O-N 2.99Å; F113-L119 HydrophobicContact CB-CB 4.2Å; F113-L119 HydrophobicContact CD2-CB 3.82Å; F113-L119 HydrophobicContact CD2-CD1 3.68Å; F113-L119 HydrophobicContact CD2-CG 4.36Å; F113-L119 HydrophobicContact CE2-CD1 3.85Å; F113-L119 HydrophobicContact CG-CB 4.15Å; F113-H122 HydrophobicContact CE1-CB 3.77Å; F113-H122 HydrophobicContact CE2-CB 3.85Å; F113-H122 AromaticContact CE2-CD2 3.37Å; F113-H122 WeakPolarHBondContact CE2-CD2 3.47Å; F113-H122 AromaticContact CE2-CG 3.58Å; F113-H122 HydrophobicContact CZ-CB 3.32Å; F113-H122 AromaticContact CZ-CD2 3.44Å; F113-H122 VanDerWaalsContact CZ-CD2 3.44Å; F113-H122 WeakPolarHBondContact CZ-CD2 3.4Å; F113-H122 AromaticContact CZ-CG 3.13Å; F113-H122 AromaticContact CZ-ND1 3.65Å
114	A	71.6	Confident	70.7	Confident	28 Å²	28	79.4 Å²	79.4	23%	0.231	39%	0.388	C	S	.	.	S	Bend	trans	-68	-26	179.7	0	0	0	0	0	113	K102	K102-A114 HydrophobicContact CG-CB 4.45Å
115	N	67.1	Low	70.5	Confident	27 Å²	27	80.7 Å²	80.7	14%	0.144	40%	0.401	C	S	.	.	S	Bend	trans	-142.4	155.4	178.8	68.5	63.2	0	0	0	112.1	Y104 F113 R117 S118 L119	Y104-N115 VanDerWaalsContact CD2-CA 3.42Å; F113-N115 VanDerWaalsContact C-N 3.26Å; F113-N115 PolarHBondContact O-N 2.99Å; N115-R117 VanDerWaalsContact C-N 3.3Å; N115-R117 PolarHBondContact O-N 3.44Å; N115-R117 PolarHBondContact OD1-N 3.31Å; N115-S118 PolarHBondContact O-N 3.4Å; N115-S118 WeakPolarHBondContact OD1-CB 3.29Å; N115-S118 PolarHBondContact OD1-N 2.94Å; N115-S118 PolarHBondContact OD1-OG 3.18Å; N115-S118 VanDerWaalsContact OD1-OG 3.14Å; N115-L119 PolarHBondContact O-N 3.04Å
116	F	72.8	Confident	70.3	Confident	114 Å²	114	77.5 Å²	77.5	50%	0.5	39%	0.385	S	S	.	.	H	α-helix	trans	-61.2	-34.1	-178.2	-178.1	-103.5	0	0	0	113.5	Y104 S118 L119 Q120	Y104-F116 HydrophobicContact CD1-CB 3.91Å; Y104-F116 HydrophobicContact CD1-CD2 4.01Å; Y104-F116 HydrophobicContact CD1-CG 4.48Å; Y104-F116 HydrophobicContact CE1-CB 3.73Å; Y104-F116 HydrophobicContact CE1-CD2 4.2Å; Y104-F116 HydrophobicContact CE1-CG 4.43Å; Y104-F116 HydrophobicContact CG-CB 4.39Å; F116-S118 VanDerWaalsContact C-N 3.35Å; F116-S118 PolarHBondContact O-N 3.37Å; F116-L119 WeakPolarHBondContact O-CB 3.49Å; F116-L119 PolarHBondContact O-N 2.89Å; F116-Q120 WeakPolarHBondContact O-CB 3.48Å; F116-Q120 PolarHBondContact O-N 3.49Å
117	R	69.3	Low	69.9	Low	177 Å²	177	80.4 Å²	80.4	67%	0.668	40%	0.404	S	S	*	.	H	α-helix	trans	-66.3	-38.8	-179.2	-176.5	178.8	-75.3	-107.9	-0.6	111.4	N115 Q120 K121	N115-R117 VanDerWaalsContact C-N 3.3Å; N115-R117 PolarHBondContact O-N 3.44Å; N115-R117 PolarHBondContact OD1-N 3.31Å; R117-Q120 PolarHBondContact O-N 3.41Å; R117-K121 WeakPolarHBondContact O-CB 3.33Å; R117-K121 PolarHBondContact O-N 2.93Å
118	S	72.6	Confident	69.3	Low	31 Å²	31	84.7 Å²	84.7	22%	0.217	41%	0.408	C	S	.	.	H	α-helix	trans	-65.4	-42.1	174	-67.2	0	0	0	0	111.7	N115 F116 K121 H122	N115-S118 PolarHBondContact O-N 3.4Å; N115-S118 WeakPolarHBondContact OD1-CB 3.29Å; N115-S118 PolarHBondContact OD1-N 2.94Å; N115-S118 PolarHBondContact OD1-OG 3.18Å; N115-S118 VanDerWaalsContact OD1-OG 3.14Å; F116-S118 VanDerWaalsContact C-N 3.35Å; F116-S118 PolarHBondContact O-N 3.37Å; S118-K121 PolarHBondContact O-N 3.37Å; S118-H122 WeakPolarHBondContact O-CB 3.43Å; S118-H122 PolarHBondContact O-N 3.32Å
119	L	71	Confident	69.3	Low	11 Å²	11	85 Å²	85	6%	0.058	41%	0.41	C	S	.	.	H	α-helix	trans	-59.3	-50.3	171.8	172.6	62.5	0	0	0	111.2	C106 F113 N115 F116 K121 H122 E123	C106-L119 HydrophobicContact CB-CD1 3.56Å; F113-L119 HydrophobicContact CB-CB 4.2Å; F113-L119 HydrophobicContact CD2-CB 3.82Å; F113-L119 HydrophobicContact CD2-CD1 3.68Å; F113-L119 HydrophobicContact CD2-CG 4.36Å; F113-L119 HydrophobicContact CE2-CD1 3.85Å; F113-L119 HydrophobicContact CG-CB 4.15Å; N115-L119 PolarHBondContact O-N 3.04Å; F116-L119 WeakPolarHBondContact O-CB 3.49Å; F116-L119 PolarHBondContact O-N 2.89Å; L119-K121 VanDerWaalsContact C-N 3.32Å; L119-K121 PolarHBondContact O-N 3.39Å; L119-H122 CarbonylContact O-C 3.27Å; L119-H122 WeakPolarHBondContact O-CA 3.35Å; L119-H122 VanDerWaalsContact O-CB 3.31Å; L119-H122 WeakPolarHBondContact O-CB 3.35Å; L119-H122 PolarHBondContact O-N 3.29Å; L119-E123 HydrophobicContact CD1-CG 3.94Å; L119-E123 HydrophobicContact CG-CG 4.28Å; L119-E123 WeakPolarHBondContact O-CG 3.34Å; L119-E123 PolarHBondContact O-N 3.35Å
120	Q	69.1	Low	69.4	Low	99 Å²	99	88.3 Å²	88.3	46%	0.463	42%	0.418	S	S	.	.	H	α-helix	trans	-59.9	-40.1	-179	-168.5	-176.3	34.7	0	0	112.5	F116 R117 H122 E123 K124	F116-Q120 WeakPolarHBondContact O-CB 3.48Å; F116-Q120 PolarHBondContact O-N 3.49Å; R117-Q120 PolarHBondContact O-N 3.41Å; Q120-H122 VanDerWaalsContact C-N 3.32Å; Q120-E123 PolarHBondContact O-N 3.36Å; Q120-K124 PolarHBondContact O-N 3.4Å
121	K	68.2	Low	69.8	Low	126 Å²	126	88.2 Å²	88.2	55%	0.548	42%	0.416	S	S	.	.	H	α-helix	trans	-66.3	-35.9	173.7	-174.2	-179.7	180	-177.8	0	111.6	N51 R117 S118 L119	N51-K121 PolarHBondContact OD1-NZ 3.16Å; R117-K121 WeakPolarHBondContact O-CB 3.33Å; R117-K121 PolarHBondContact O-N 2.93Å; S118-K121 PolarHBondContact O-N 3.37Å; L119-K121 VanDerWaalsContact C-N 3.32Å; L119-K121 PolarHBondContact O-N 3.39Å
122	H	69.1	Low	70.3	Confident	24 Å²	24	87 Å²	87	11%	0.111	41%	0.408	C	S	.	.	H	α-helix	trans	-68.4	-42.5	175.5	164	73.4	0	0	0	112.3	C106 C109 F113 S118 L119 Q120 K124 N125 H126	C106-H122 WeakPolarHBondContact CB-NE2 3.38Å; C106-H122 PolarHBondContact SG-NE2 3.17Å; C106-H122 VanDerWaalsContact SG-NE2 3.4Å; C109-H122 PolarHBondContact SG-CE1 3.44Å; C109-H122 PolarHBondContact SG-NE2 3.24Å; F113-H122 HydrophobicContact CE1-CB 3.77Å; F113-H122 HydrophobicContact CE2-CB 3.85Å; F113-H122 AromaticContact CE2-CD2 3.37Å; F113-H122 WeakPolarHBondContact CE2-CD2 3.47Å; F113-H122 AromaticContact CE2-CG 3.58Å; F113-H122 HydrophobicContact CZ-CB 3.32Å; F113-H122 AromaticContact CZ-CD2 3.44Å; F113-H122 VanDerWaalsContact CZ-CD2 3.44Å; F113-H122 WeakPolarHBondContact CZ-CD2 3.4Å; F113-H122 AromaticContact CZ-CG 3.13Å; F113-H122 AromaticContact CZ-ND1 3.65Å; S118-H122 WeakPolarHBondContact O-CB 3.43Å; S118-H122 PolarHBondContact O-N 3.32Å; L119-H122 CarbonylContact O-C 3.27Å; L119-H122 WeakPolarHBondContact O-CA 3.35Å; L119-H122 VanDerWaalsContact O-CB 3.31Å; L119-H122 WeakPolarHBondContact O-CB 3.35Å; L119-H122 PolarHBondContact O-N 3.29Å; Q120-H122 VanDerWaalsContact C-N 3.32Å; H122-K124 PolarHBondContact O-N 2.82Å; H122-N125 VanDerWaalsContact O-CB 3.28Å; H122-N125 WeakPolarHBondContact O-CB 3.37Å; H122-N125 PolarHBondContact O-N 3.2Å; H122-N125 PolarHBondContact O-ND2 2.82Å; H122-N125 VanDerWaalsContact O-ND2 3.08Å; H122-H126 AromaticContact CE1-NE2 3.61Å; H122-H126 AromaticContact NE2-CD2 3.57Å; H122-H126 AromaticContact NE2-NE2 3.22Å; H122-H126 PolarHBondContact NE2-NE2 3.03Å
123	E	69.8	Low	70.9	Confident	68 Å²	68	90.8 Å²	90.8	32%	0.318	42%	0.42	S	S	.	.	H	α-helix	trans	-60.6	-28	177.2	-73.1	-179.6	150.3	0	0	113	L119 Q120 N125 H126 T127	L119-E123 HydrophobicContact CD1-CG 3.94Å; L119-E123 HydrophobicContact CG-CG 4.28Å; L119-E123 WeakPolarHBondContact O-CG 3.34Å; L119-E123 PolarHBondContact O-N 3.35Å; Q120-E123 PolarHBondContact O-N 3.36Å; E123-N125 PolarHBondContact O-N 3.34Å; E123-N125 VanDerWaalsContact O-N 3.14Å; E123-H126 WeakPolarHBondContact O-CA 3.39Å; E123-H126 VanDerWaalsContact O-CB 3.27Å; E123-H126 WeakPolarHBondContact O-CB 3.22Å; E123-H126 PolarHBondContact O-N 2.76Å; E123-T127 PolarHBondContact O-N 3.36Å
124	K	68.5	Low	71.8	Confident	135 Å²	135	89 Å²	89	59%	0.587	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-17.3	169.6	-69.4	-175.1	178	-170.4	0	114.3	Q120 H122 T127	Q120-K124 PolarHBondContact O-N 3.4Å; H122-K124 PolarHBondContact O-N 2.82Å; K124-T127 PolarHBondContact O-OG1 2.58Å; K124-T127 VanDerWaalsContact O-OG1 3.09Å
125	N	64.4	Low	72.6	Confident	103 Å²	103	95.4 Å²	95.4	55%	0.551	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-20.7	172.2	-58	-65.4	0	0	0	112.4	H122 E123	H122-N125 VanDerWaalsContact O-CB 3.28Å; H122-N125 WeakPolarHBondContact O-CB 3.37Å; H122-N125 PolarHBondContact O-N 3.2Å; H122-N125 PolarHBondContact O-ND2 2.82Å; H122-N125 VanDerWaalsContact O-ND2 3.08Å; E123-N125 PolarHBondContact O-N 3.34Å; E123-N125 VanDerWaalsContact O-N 3.14Å
126	H	67.9	Low	73.4	Confident	51 Å²	51	101.2 Å²	101.2	24%	0.236	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-38.2	174.7	-81.2	-67.4	0	0	0	111.5	C106 Q108 C109 H122 E123 R128	C106-H126 PolarHBondContact SG-CD2 3.15Å; C106-H126 PolarHBondContact SG-NE2 2.73Å; C106-H126 VanDerWaalsContact SG-NE2 3.41Å; Q108-H126 VanDerWaalsContact CB-CE1 3.41Å; Q108-H126 WeakPolarHBondContact CB-CE1 3.07Å; Q108-H126 WeakPolarHBondContact CB-ND1 3.46Å; Q108-H126 VanDerWaalsContact OE1-CG 3.23Å; Q108-H126 PolarHBondContact OE1-ND1 3.42Å; C109-H126 PolarHBondContact SG-NE2 3.12Å; H122-H126 AromaticContact CE1-NE2 3.61Å; H122-H126 AromaticContact NE2-CD2 3.57Å; H122-H126 AromaticContact NE2-NE2 3.22Å; H122-H126 PolarHBondContact NE2-NE2 3.03Å; E123-H126 WeakPolarHBondContact O-CA 3.39Å; E123-H126 VanDerWaalsContact O-CB 3.27Å; E123-H126 WeakPolarHBondContact O-CB 3.22Å; E123-H126 PolarHBondContact O-N 2.76Å; H126-R128 PolarHBondContact O-N 3.44Å
127	T	65.5	Low	74.1	Confident	63 Å²	63	98.4 Å²	98.4	39%	0.387	46%	0.462	S	S	.	.	S	Bend	trans	-64.4	122.1	165.7	61.8	0	0	0	0	107.2	E123 K124 E129	E123-T127 PolarHBondContact O-N 3.36Å; K124-T127 PolarHBondContact O-OG1 2.58Å; K124-T127 VanDerWaalsContact O-OG1 3.09Å; T127-E129 PolarHBondContact O-N 2.89Å
128	R	59.3	Low	74.8	Confident	243 Å²	243	91.9 Å²	91.9	92%	0.917	45%	0.45	S	S	*	.			trans	-64.2	8.3	174.7	-73.9	-176.1	175.1	-164	0.9	112.9	H126 K130	H126-R128 PolarHBondContact O-N 3.44Å; R128-K130 PolarHBondContact O-N 2.77Å
129	E	66.2	Low	75.4	Confident	141 Å²	141	96.4 Å²	96.4	66%	0.659	47%	0.466	S	S	*	.			trans	-68.9	100.1	175.9	-66.1	-175.5	176	0	0	109.3	T127 P131	T127-E129 PolarHBondContact O-N 2.89Å; E129-P131 WeakPolarHBondContact O-CD 3.32Å
130	K	77.6	Confident	75.9	Confident	119 Å²	119	97.5 Å²	97.5	52%	0.517	48%	0.476	S	S	.	.			trans	-111.6	83.8	169.5	-73.7	166.9	165.1	-167.8	0	106.7	R128 Y132 A140 F141	R128-K130 PolarHBondContact O-N 2.77Å; K130-Y132 PolarHBondContact O-N 3.04Å; K130-A140 HydrophobicContact CB-CB 3.44Å; K130-A140 VanDerWaalsContact CB-CB 3.44Å; K130-A140 HydrophobicContact CD-CB 4.22Å; K130-A140 WeakPolarHBondContact CD-O 3.21Å; K130-A140 HydrophobicContact CG-CB 4.47Å; K130-A140 WeakPolarHBondContact O-CB 3.32Å; K130-F141 CarbonylContact C-O 3.39Å; K130-F141 WeakPolarHBondContact CA-O 3.46Å
131	P	80.2	Confident	76.6	Confident	93 Å²	93	94.6 Å²	94.6	60%	0.604	46%	0.462	S	S	*	.			trans	-70.1	-17.2	-168.6	-18.2	32.6	0	0	0	113.4	E129	E129-P131 WeakPolarHBondContact O-CD 3.32Å
132	Y	85.1	Confident	77.2	Confident	99 Å²	99	91.4 Å²	91.4	39%	0.388	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	92.7	-171.7	-57.1	-78.8	0	0	0	110.4	K130 A140 F141 S143 R144	K130-Y132 PolarHBondContact O-N 3.04Å; Y132-A140 CarbonylContact O-C 3.56Å; Y132-A140 WeakPolarHBondContact O-CA 3.39Å; Y132-F141 PolarHBondContact N-O 3.21Å; Y132-F141 PolarHBondContact O-N 2.94Å; Y132-S143 VanDerWaalsContact CD2-C 3.42Å; Y132-S143 VanDerWaalsContact CD2-CA 3.5Å; Y132-R144 HydrophobicContact CD1-CB 4.09Å; Y132-R144 HydrophobicContact CE1-CB 3.96Å
133	E	85.1	Confident	77.8	Confident	115 Å²	115	92.6 Å²	92.6	54%	0.537	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	141.7	179.5	-165.5	175.6	168.2	0	0	112.6	G138	E133-G138 VanDerWaalsContact OE1-CA 3.3Å; E133-G138 WeakPolarHBondContact OE1-CA 3.31Å
134	C	88.7	Confident	78.6	Confident	2 Å²	2	98.5 Å²	98.5	1%	0.014	48%	0.484	C	S	.	.			trans	-84.3	112.4	170.9	-177.6	0	0	0	0	110.6	H136 C137 G138 K139 F141 L147	C134-H136 PolarHBondContact O-N 2.85Å; C134-C137 PolarHBondContact O-N 3.02Å; C134-G138 WeakPolarHBondContact O-CA 3.39Å; C134-G138 PolarHBondContact O-N 3.24Å; C134-K139 WeakPolarHBondContact CB-O 3.44Å; C134-K139 PolarHBondContact N-O 3.18Å; C134-F141 HydrophobicContact CB-CE2 4.33Å; C134-L147 HydrophobicContact CB-CD1 3.65Å
135	N	88.1	Confident	79.5	Confident	163 Å²	163	95.6 Å²	95.6	87%	0.872	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-18.8	178.6	-61.5	-14.2	0	0	0	114.8
136	H	83.6	Confident	80.5	Confident	149 Å²	149	92 Å²	92	69%	0.69	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-25.8	-177.8	-159.4	74.3	0	0	0	113.7	C134 H154	C134-H136 PolarHBondContact O-N 2.85Å; H136-H154 AromaticContact CD2-CE1 3.72Å; H136-H154 AromaticContact CD2-CG 3.68Å; H136-H154 AromaticContact CD2-ND1 3.35Å; H136-H154 PolarHBondContact CD2-ND1 2.86Å
137	C	87.3	Confident	81.5	Confident	55 Å²	55	90.5 Å²	90.5	37%	0.372	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.7	2.8	-178	71.2	0	0	0	0	115.5	C134 K139 H150 H154	C134-C137 PolarHBondContact O-N 3.02Å; C137-K139 PolarHBondContact O-N 3.39Å; C137-H150 PolarHBondContact SG-NE2 3.34Å; C137-H154 PolarHBondContact SG-NE2 3.45Å; C137-H154 VanDerWaalsContact SG-NE2 3.35Å
138	G	83.2	Confident	82.8	Confident	39 Å²	39	92.5 Å²	92.5	40%	0.402	47%	0.465	S	S	.	.			trans	69.9	5.1	-179.6	0	0	0	0	0	115	E133 C134 A140	E133-G138 VanDerWaalsContact OE1-CA 3.3Å; E133-G138 WeakPolarHBondContact OE1-CA 3.31Å; C134-G138 WeakPolarHBondContact O-CA 3.39Å; C134-G138 PolarHBondContact O-N 3.24Å; G138-A140 PolarHBondContact O-N 3.12Å
139	K	84.8	Confident	84.2	Confident	127 Å²	127	83.4 Å²	83.4	55%	0.552	43%	0.434	S	S	*	.			trans	-72.8	128.2	178.8	-72.6	-177.9	-177.9	177.2	0	110.5	C134 C137 F141	C134-K139 WeakPolarHBondContact CB-O 3.44Å; C134-K139 PolarHBondContact N-O 3.18Å; C137-K139 PolarHBondContact O-N 3.39Å; K139-F141 HydrophobicContact CB-CE2 3.76Å; K139-F141 HydrophobicContact CB-CZ 3.93Å; K139-F141 WeakPolarHBondContact O-CD2 3.31Å; K139-F141 WeakPolarHBondContact O-CE2 3.23Å
140	A	82.7	Confident	85.3	Confident	33 Å²	33	77.6 Å²	77.6	27%	0.273	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	142.9	179	0	0	0	0	0	112.5	K130 Y132 G138	K130-A140 HydrophobicContact CB-CB 3.44Å; K130-A140 VanDerWaalsContact CB-CB 3.44Å; K130-A140 HydrophobicContact CD-CB 4.22Å; K130-A140 WeakPolarHBondContact CD-O 3.21Å; K130-A140 HydrophobicContact CG-CB 4.47Å; K130-A140 WeakPolarHBondContact O-CB 3.32Å; Y132-A140 CarbonylContact O-C 3.56Å; Y132-A140 WeakPolarHBondContact O-CA 3.39Å; G138-A140 PolarHBondContact O-N 3.12Å
141	F	83.5	Confident	86	Confident	39 Å²	39	75.9 Å²	75.9	17%	0.171	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	150	-176.8	-61.9	-89.1	0	0	0	112	K130 Y132 C134 K139 S143 A146 L147 H150	K130-F141 CarbonylContact C-O 3.39Å; K130-F141 WeakPolarHBondContact CA-O 3.46Å; Y132-F141 PolarHBondContact N-O 3.21Å; Y132-F141 PolarHBondContact O-N 2.94Å; C134-F141 HydrophobicContact CB-CE2 4.33Å; K139-F141 HydrophobicContact CB-CE2 3.76Å; K139-F141 HydrophobicContact CB-CZ 3.93Å; K139-F141 WeakPolarHBondContact O-CD2 3.31Å; K139-F141 WeakPolarHBondContact O-CE2 3.23Å; F141-S143 VanDerWaalsContact C-N 3.28Å; F141-S143 PolarHBondContact O-N 3.46Å; F141-A146 HydrophobicContact CB-CB 4.15Å; F141-A146 HydrophobicContact CD1-CB 4.18Å; F141-A146 HydrophobicContact CG-CB 4.5Å; F141-L147 HydrophobicContact CB-CB 4.17Å; F141-L147 HydrophobicContact CD2-CB 4Å; F141-L147 HydrophobicContact CD2-CD1 3.68Å; F141-L147 HydrophobicContact CD2-CG 4.44Å; F141-L147 HydrophobicContact CE2-CD1 3.96Å; F141-L147 HydrophobicContact CG-CB 4.23Å; F141-H150 HydrophobicContact CD1-CB 4.47Å; F141-H150 HydrophobicContact CE1-CB 3.71Å; F141-H150 AromaticContact CE1-CG 3.9Å; F141-H150 HydrophobicContact CE2-CB 3.87Å; F141-H150 AromaticContact CE2-CD2 3.16Å; F141-H150 WeakPolarHBondContact CE2-CD2 3.16Å; F141-H150 AromaticContact CE2-CG 3.53Å; F141-H150 AromaticContact CE2-NE2 3.81Å; F141-H150 HydrophobicContact CZ-CB 3.38Å; F141-H150 AromaticContact CZ-CD2 3.23Å; F141-H150 WeakPolarHBondContact CZ-CD2 3.32Å; F141-H150 AromaticContact CZ-CG 3.09Å; F141-H150 AromaticContact CZ-ND1 3.64Å; F141-H150 AromaticContact CZ-NE2 3.8Å
142	P	80.5	Confident	86.6	Confident	59 Å²	59	73.7 Å²	73.7	38%	0.383	38%	0.38	S	S	.	.	S	Bend	trans	-74.6	-16.1	-179.6	29.8	-35.6	0	0	0	113.4
143	S	81.8	Confident	86.8	Confident	49 Å²	49	73.6 Å²	73.6	34%	0.343	39%	0.39	S	S	.	.	S	Bend	trans	-145	152.8	-179.7	71.9	0	0	0	0	112.2	Y132 F141 S145 A146 L147	Y132-S143 VanDerWaalsContact CD2-C 3.42Å; Y132-S143 VanDerWaalsContact CD2-CA 3.5Å; F141-S143 VanDerWaalsContact C-N 3.28Å; F141-S143 PolarHBondContact O-N 3.46Å; S143-S145 VanDerWaalsContact C-N 3.31Å; S143-S145 PolarHBondContact O-N 3.31Å; S143-A146 PolarHBondContact O-N 2.97Å; S143-A146 WeakPolarHBondContact OG-CB 3.4Å; S143-A146 PolarHBondContact OG-N 3.43Å; S143-L147 PolarHBondContact O-N 3.3Å; S143-L147 VanDerWaalsContact O-N 3.08Å
144	R	87.3	Confident	87.1	Confident	191 Å²	191	71.7 Å²	71.7	72%	0.721	38%	0.381	S	S	*	.	H	α-helix	trans	-59.3	-40.1	175.6	-173	173.4	-178.4	152.6	0.5	112.3	Y132 A146 L147 Q148	Y132-R144 HydrophobicContact CD1-CB 4.09Å; Y132-R144 HydrophobicContact CE1-CB 3.96Å; R144-A146 VanDerWaalsContact C-N 3.34Å; R144-A146 PolarHBondContact O-N 3.37Å; R144-L147 PolarHBondContact O-N 3.36Å; R144-Q148 WeakPolarHBondContact O-CB 3.45Å; R144-Q148 PolarHBondContact O-N 3.32Å
145	S	87.1	Confident	87.1	Confident	74 Å²	74	75.6 Å²	75.6	52%	0.517	41%	0.405	S	S	.	.	H	α-helix	trans	-62.9	-39.6	177.2	-49.4	0	0	0	0	111.9	S143 Q148 I149	S143-S145 VanDerWaalsContact C-N 3.31Å; S143-S145 PolarHBondContact O-N 3.31Å; S145-Q148 PolarHBondContact O-N 3.13Å; S145-I149 WeakPolarHBondContact O-CD1 3.31Å; S145-I149 VanDerWaalsContact O-CG1 3.22Å; S145-I149 WeakPolarHBondContact O-CG1 3.5Å; S145-I149 PolarHBondContact O-N 3.49Å
146	A	86.1	Confident	87.2	Confident	28 Å²	28	70.2 Å²	70.2	23%	0.231	39%	0.387	C	S	.	.	H	α-helix	trans	-66.4	-41.3	175.9	0	0	0	0	0	111.9	F141 S143 R144 I149 H150	F141-A146 HydrophobicContact CB-CB 4.15Å; F141-A146 HydrophobicContact CD1-CB 4.18Å; F141-A146 HydrophobicContact CG-CB 4.5Å; S143-A146 PolarHBondContact O-N 2.97Å; S143-A146 WeakPolarHBondContact OG-CB 3.4Å; S143-A146 PolarHBondContact OG-N 3.43Å; R144-A146 VanDerWaalsContact C-N 3.34Å; R144-A146 PolarHBondContact O-N 3.37Å; A146-I149 PolarHBondContact O-N 3.15Å; A146-H150 WeakPolarHBondContact O-CB 3.3Å; A146-H150 PolarHBondContact O-N 3.33Å
147	L	89	Confident	87.6	Confident	19 Å²	19	68.4 Å²	68.4	10%	0.099	38%	0.379	C	S	.	.	H	α-helix	trans	-60.4	-47.2	172.6	173.1	61.8	0	0	0	111.4	C134 F141 S143 R144 I149 H150 Q151	C134-L147 HydrophobicContact CB-CD1 3.65Å; F141-L147 HydrophobicContact CB-CB 4.17Å; F141-L147 HydrophobicContact CD2-CB 4Å; F141-L147 HydrophobicContact CD2-CD1 3.68Å; F141-L147 HydrophobicContact CD2-CG 4.44Å; F141-L147 HydrophobicContact CE2-CD1 3.96Å; F141-L147 HydrophobicContact CG-CB 4.23Å; S143-L147 PolarHBondContact O-N 3.3Å; S143-L147 VanDerWaalsContact O-N 3.08Å; R144-L147 PolarHBondContact O-N 3.36Å; L147-I149 VanDerWaalsContact C-N 3.34Å; L147-I149 PolarHBondContact O-N 2.77Å; L147-H150 CarbonylContact O-C 3.52Å; L147-H150 WeakPolarHBondContact O-CA 3.43Å; L147-H150 WeakPolarHBondContact O-CB 3.33Å; L147-H150 PolarHBondContact O-N 3.43Å; L147-Q151 HydrophobicContact CD1-CG 4.16Å; L147-Q151 HydrophobicContact CG-CG 4.39Å; L147-Q151 WeakPolarHBondContact O-CG 3.36Å; L147-Q151 PolarHBondContact O-N 3.47Å
148	Q	91	Very high	87.9	Confident	106 Å²	106	72 Å²	72	50%	0.495	39%	0.389	S	S	.	.	H	α-helix	trans	-59.8	-44.4	179.6	-173.7	-176.7	15.2	0	0	111.8	R144 S145 H150 Q151 R152	R144-Q148 WeakPolarHBondContact O-CB 3.45Å; R144-Q148 PolarHBondContact O-N 3.32Å; S145-Q148 PolarHBondContact O-N 3.13Å; Q148-H150 VanDerWaalsContact C-N 3.28Å; Q148-H150 PolarHBondContact O-N 2.79Å; Q148-Q151 PolarHBondContact O-N 2.91Å; Q148-R152 PolarHBondContact O-N 3.48Å
149	I	89.6	Confident	88.3	Confident	52 Å²	52	73.4 Å²	73.4	27%	0.267	39%	0.39	S	S	.	.	H	α-helix	trans	-64	-36.5	175.8	-66.4	165.1	0	0	0	110.9	S145 A146 L147 R152 R171	S145-I149 WeakPolarHBondContact O-CD1 3.31Å; S145-I149 VanDerWaalsContact O-CG1 3.22Å; S145-I149 WeakPolarHBondContact O-CG1 3.5Å; S145-I149 PolarHBondContact O-N 3.49Å; A146-I149 PolarHBondContact O-N 3.15Å; L147-I149 VanDerWaalsContact C-N 3.34Å; L147-I149 PolarHBondContact O-N 2.77Å; I149-R152 WeakPolarHBondContact O-CB 3.45Å; I149-R171 HydrophobicContact CG2-CG 3.84Å; I149-R171 VanDerWaalsContact CG2-CZ 3.47Å; I149-R171 VanDerWaalsContact CG2-NH2 3.33Å
150	H	89.8	Confident	88.8	Confident	18 Å²	18	70.3 Å²	70.3	8%	0.083	38%	0.377	C	S	.	.	H	α-helix	trans	-68.1	-38.4	174.3	165.7	65.8	0	0	0	112.8	C137 F141 A146 L147 Q148 R152 T153 H154	C137-H150 PolarHBondContact SG-NE2 3.34Å; F141-H150 HydrophobicContact CD1-CB 4.47Å; F141-H150 HydrophobicContact CE1-CB 3.71Å; F141-H150 AromaticContact CE1-CG 3.9Å; F141-H150 HydrophobicContact CE2-CB 3.87Å; F141-H150 AromaticContact CE2-CD2 3.16Å; F141-H150 WeakPolarHBondContact CE2-CD2 3.16Å; F141-H150 AromaticContact CE2-CG 3.53Å; F141-H150 AromaticContact CE2-NE2 3.81Å; F141-H150 HydrophobicContact CZ-CB 3.38Å; F141-H150 AromaticContact CZ-CD2 3.23Å; F141-H150 WeakPolarHBondContact CZ-CD2 3.32Å; F141-H150 AromaticContact CZ-CG 3.09Å; F141-H150 AromaticContact CZ-ND1 3.64Å; F141-H150 AromaticContact CZ-NE2 3.8Å; A146-H150 WeakPolarHBondContact O-CB 3.3Å; A146-H150 PolarHBondContact O-N 3.33Å; L147-H150 CarbonylContact O-C 3.52Å; L147-H150 WeakPolarHBondContact O-CA 3.43Å; L147-H150 WeakPolarHBondContact O-CB 3.33Å; L147-H150 PolarHBondContact O-N 3.43Å; Q148-H150 VanDerWaalsContact C-N 3.28Å; Q148-H150 PolarHBondContact O-N 2.79Å; H150-R152 PolarHBondContact O-N 3.49Å; H150-R152 VanDerWaalsContact O-N 3.14Å; H150-T153 PolarHBondContact ND1-OG1 3.27Å; H150-T153 VanDerWaalsContact O-CB 3.29Å; H150-T153 WeakPolarHBondContact O-CB 3.37Å; H150-T153 WeakPolarHBondContact O-CG2 3.36Å; H150-T153 PolarHBondContact O-N 2.81Å; H150-T153 PolarHBondContact O-OG1 3.07Å; H150-H154 AromaticContact CE1-NE2 3.6Å; H150-H154 AromaticContact NE2-CD2 3.95Å; H150-H154 AromaticContact NE2-NE2 3.35Å; H150-H154 PolarHBondContact NE2-NE2 3.06Å
151	Q	91.2	Very high	89.3	Confident	83 Å²	83	73.7 Å²	73.7	39%	0.388	39%	0.391	S	S	.	.	H	α-helix	trans	-57.8	-29.8	178.2	-76.1	172.8	-31.2	0	0	112.3	L147 Q148 T153 H154 T155	L147-Q151 HydrophobicContact CD1-CG 4.16Å; L147-Q151 HydrophobicContact CG-CG 4.39Å; L147-Q151 WeakPolarHBondContact O-CG 3.36Å; L147-Q151 PolarHBondContact O-N 3.47Å; Q148-Q151 PolarHBondContact O-N 2.91Å; Q151-T153 PolarHBondContact O-N 3.35Å; Q151-T153 VanDerWaalsContact O-N 3.1Å; Q151-H154 PolarHBondContact O-N 2.84Å; Q151-T155 PolarHBondContact O-N 2.97Å; Q151-T155 VanDerWaalsContact O-N 3.1Å
152	R	92.8	Very high	89.8	Confident	47 Å²	47	71.9 Å²	71.9	18%	0.177	38%	0.383	C	S	.	.	H	α-helix	trans	-57.5	-22.9	171.6	-61.9	-178.8	-179.1	160.5	2.2	113.8	Q148 I149 H150 H154 T155 G156 E157 A170	Q148-R152 PolarHBondContact O-N 3.48Å; I149-R152 WeakPolarHBondContact O-CB 3.45Å; H150-R152 PolarHBondContact O-N 3.49Å; H150-R152 VanDerWaalsContact O-N 3.14Å; R152-H154 VanDerWaalsContact C-N 3.3Å; R152-T155 WeakPolarHBondContact CA-OG1 3.44Å; R152-G156 WeakPolarHBondContact O-CA 3.35Å; R152-G156 PolarHBondContact O-N 3.01Å; R152-E157 HydrophobicContact CB-CB 4.49Å; R152-E157 HydrophobicContact CG-CB 4.26Å; R152-A170 HydrophobicContact CB-CB 4.18Å; R152-A170 WeakPolarHBondContact CD-O 3.5Å; R152-A170 PolarHBondContact NH1-O 3.33Å
153	T	89.6	Confident	90.4	Very high	97 Å²	97	74.1 Å²	74.1	60%	0.595	40%	0.4	S	S	*	.	H	α-helix	trans	-73.3	-22.3	174.5	68	0	0	0	0	113.3	H150 Q151	H150-T153 PolarHBondContact ND1-OG1 3.27Å; H150-T153 VanDerWaalsContact O-CB 3.29Å; H150-T153 WeakPolarHBondContact O-CB 3.37Å; H150-T153 WeakPolarHBondContact O-CG2 3.36Å; H150-T153 PolarHBondContact O-N 2.81Å; H150-T153 PolarHBondContact O-OG1 3.07Å; Q151-T153 PolarHBondContact O-N 3.35Å; Q151-T153 VanDerWaalsContact O-N 3.1Å
154	H	90.6	Very high	90.8	Very high	75 Å²	75	77.7 Å²	77.7	35%	0.347	41%	0.411	S	S	.	.	H	α-helix	trans	-91.6	-42.5	174.8	-63.4	-55.6	0	0	0	111.8	H136 C137 H150 Q151 R152 G156	H136-H154 AromaticContact CD2-CE1 3.72Å; H136-H154 AromaticContact CD2-CG 3.68Å; H136-H154 AromaticContact CD2-ND1 3.35Å; H136-H154 PolarHBondContact CD2-ND1 2.86Å; C137-H154 PolarHBondContact SG-NE2 3.45Å; C137-H154 VanDerWaalsContact SG-NE2 3.35Å; H150-H154 AromaticContact CE1-NE2 3.6Å; H150-H154 AromaticContact NE2-CD2 3.95Å; H150-H154 AromaticContact NE2-NE2 3.35Å; H150-H154 PolarHBondContact NE2-NE2 3.06Å; Q151-H154 PolarHBondContact O-N 2.84Å; R152-H154 VanDerWaalsContact C-N 3.3Å; H154-G156 VanDerWaalsContact C-N 3.31Å
155	T	90.1	Very high	91.1	Very high	85 Å²	85	71.3 Å²	71.3	52%	0.521	40%	0.395	S	S	.	.	H	α-helix	trans	-76.7	-20.7	-179.7	61.8	0	0	0	0	112.8	Q151 R152 E157	Q151-T155 PolarHBondContact O-N 2.97Å; Q151-T155 VanDerWaalsContact O-N 3.1Å; R152-T155 WeakPolarHBondContact CA-OG1 3.44Å; T155-E157 PolarHBondContact O-N 2.87Å; T155-E157 WeakPolarHBondContact OG1-CB 3.47Å; T155-E157 WeakPolarHBondContact OG1-CG 3.34Å; T155-E157 PolarHBondContact OG1-N 3.26Å
156	G	89.1	Confident	91.3	Very high	49 Å²	49	70.7 Å²	70.7	51%	0.505	40%	0.4	S	S	.	.			trans	74.1	5.9	-173.3	0	0	0	0	0	113.7	R152 H154 K158	R152-G156 WeakPolarHBondContact O-CA 3.35Å; R152-G156 PolarHBondContact O-N 3.01Å; H154-G156 VanDerWaalsContact C-N 3.31Å; G156-K158 PolarHBondContact O-N 3.18Å
157	E	91.7	Very high	91.6	Very high	111 Å²	111	75.3 Å²	75.3	52%	0.519	42%	0.415	S	S	.	.			trans	-58.9	129.5	-180	-79.3	178.4	-169.7	0	0	112.1	R152 T155	R152-E157 HydrophobicContact CB-CB 4.49Å; R152-E157 HydrophobicContact CG-CB 4.26Å; T155-E157 PolarHBondContact O-N 2.87Å; T155-E157 WeakPolarHBondContact OG1-CB 3.47Å; T155-E157 WeakPolarHBondContact OG1-CG 3.34Å; T155-E157 PolarHBondContact OG1-N 3.26Å
158	K	94	Very high	91.9	Very high	131 Å²	131	76 Å²	76	57%	0.57	42%	0.424	S	S	*	.			trans	-131.6	79.5	-179.3	-71.9	165.3	176.4	-167.1	0	109.8	G156 F160 A168 F169	G156-K158 PolarHBondContact O-N 3.18Å; K158-F160 PolarHBondContact O-N 3.41Å; K158-A168 HydrophobicContact CB-CB 3.57Å; K158-A168 HydrophobicContact CD-CB 4.41Å; K158-A168 WeakPolarHBondContact CD-O 3.43Å; K158-A168 WeakPolarHBondContact O-CB 3.45Å; K158-F169 CarbonylContact C-O 3.3Å; K158-F169 VanDerWaalsContact C-O 3.27Å; K158-F169 VanDerWaalsContact CA-O 3.32Å; K158-F169 WeakPolarHBondContact CA-O 3.44Å
159	P	91.4	Very high	92	Very high	68 Å²	68	73 Å²	73	44%	0.442	41%	0.409	S	S	.	.			trans	-71.3	-11	-172.2	-20.6	34.4	0	0	0	115.3
160	F	95.1	Very high	92.1	Very high	63 Å²	63	71.8 Å²	71.8	28%	0.276	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	99.5	-172.6	-55.1	-79.2	0	0	0	110.3	K158 A168 F169 R171 H172 L175	K158-F160 PolarHBondContact O-N 3.41Å; F160-A168 CarbonylContact O-C 3.58Å; F160-A168 WeakPolarHBondContact O-CA 3.39Å; F160-F169 WeakPolarHBondContact CD2-O 3.44Å; F160-F169 PolarHBondContact N-O 3.1Å; F160-F169 VanDerWaalsContact N-O 3.13Å; F160-F169 PolarHBondContact O-N 2.8Å; F160-R171 VanDerWaalsContact CD2-C 3.43Å; F160-H172 HydrophobicContact CD1-CB 4.03Å; F160-H172 HydrophobicContact CE1-CB 3.89Å; F160-H172 HydrophobicContact CE2-CB 4.43Å; F160-H172 HydrophobicContact CG-CB 4.37Å; F160-H172 HydrophobicContact CZ-CB 4.1Å; F160-L175 HydrophobicContact CB-CB 4.29Å; F160-L175 HydrophobicContact CB-CD2 3.94Å
161	D	93.9	Very high	92.1	Very high	104 Å²	104	76.8 Å²	76.8	56%	0.556	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	148.5	178.2	62.5	-72.5	0	0	0	113.3	K167 A168 L175	D161-K167 CarbonylContact C-O 3.57Å; D161-A168 HydrophobicContact CB-CB 4.42Å; D161-L175 WeakPolarHBondContact O-CD2 3.46Å
162	C	94.8	Very high	92.2	Very high	1 Å²	1	77.5 Å²	77.5	1%	0.007	43%	0.428	C	S	.	.			trans	-89.1	115.4	169.7	-176.4	0	0	0	0	108.9	E164 C165 G166 K167 L175 H182	C162-E164 PolarHBondContact O-N 3.02Å; C162-E164 VanDerWaalsContact O-N 3.17Å; C162-C165 PolarHBondContact O-N 3.36Å; C162-G166 VanDerWaalsContact O-CA 3.25Å; C162-G166 WeakPolarHBondContact O-CA 3.14Å; C162-G166 PolarHBondContact O-N 3.41Å; C162-K167 WeakPolarHBondContact CB-O 3.37Å; C162-K167 PolarHBondContact N-O 3.17Å; C162-L175 HydrophobicContact CB-CD1 3.64Å; C162-H182 PolarHBondContact SG-NE2 3.43Å; C162-H182 VanDerWaalsContact SG-NE2 3.43Å
163	S	92.3	Very high	92	Very high	105 Å²	105	78.4 Å²	78.4	73%	0.734	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-25.3	179.3	52.2	0	0	0	0	113.9
164	E	89.9	Confident	92.1	Very high	125 Å²	125	77.3 Å²	77.3	58%	0.584	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-30.8	-176.5	-66.5	-177.8	-148.3	0	0	114.1	C162 H182	C162-E164 PolarHBondContact O-N 3.02Å; C162-E164 VanDerWaalsContact O-N 3.17Å; E164-H182 WeakPolarHBondContact OE2-CB 3.47Å; E164-H182 IonicContact OE2-CD2 3.47Å; E164-H182 IonicContact OE2-CG 3.75Å; E164-H182 IonicContact OE2-ND1 3.16Å; E164-H182 PolarHBondContact OE2-ND1 2.76Å
165	C	93.4	Very high	92.2	Very high	57 Å²	57	74.2 Å²	74.2	39%	0.385	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.4	3.5	-178.1	70.2	0	0	0	0	115.3	C162 K167 H178 H182	C162-C165 PolarHBondContact O-N 3.36Å; C165-K167 PolarHBondContact O-N 3.39Å; C165-K167 VanDerWaalsContact O-N 3.13Å; C165-K167 VanDerWaalsContact SG-CG 3.58Å; C165-H178 PolarHBondContact SG-NE2 3.22Å; C165-H182 PolarHBondContact SG-NE2 3.13Å; C165-H182 VanDerWaalsContact SG-NE2 3.4Å
166	G	91.2	Very high	92.3	Very high	60 Å²	60	73 Å²	73	62%	0.619	41%	0.408	S	S	*	.			trans	68.3	3.8	-179.1	0	0	0	0	0	114.8	C162 A168	C162-G166 VanDerWaalsContact O-CA 3.25Å; C162-G166 WeakPolarHBondContact O-CA 3.14Å; C162-G166 PolarHBondContact O-N 3.41Å; G166-A168 PolarHBondContact O-N 3.45Å
167	K	94	Very high	92.3	Very high	126 Å²	126	73.7 Å²	73.7	55%	0.548	40%	0.4	S	S	.	.			trans	-70.4	128.1	178.5	-73.8	-178.3	-176.1	173.6	0	110.6	D161 C162 C165 F169	D161-K167 CarbonylContact C-O 3.57Å; C162-K167 WeakPolarHBondContact CB-O 3.37Å; C162-K167 PolarHBondContact N-O 3.17Å; C165-K167 PolarHBondContact O-N 3.39Å; C165-K167 VanDerWaalsContact O-N 3.13Å; C165-K167 VanDerWaalsContact SG-CG 3.58Å; K167-F169 HydrophobicContact CB-CE2 3.91Å; K167-F169 HydrophobicContact CB-CZ 4.11Å; K167-F169 WeakPolarHBondContact O-CE2 3.38Å
168	A	93.9	Very high	92.4	Very high	34 Å²	34	69.4 Å²	69.4	28%	0.281	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	147.2	178.5	0	0	0	0	0	113.2	K158 F160 D161 G166	K158-A168 HydrophobicContact CB-CB 3.57Å; K158-A168 HydrophobicContact CD-CB 4.41Å; K158-A168 WeakPolarHBondContact CD-O 3.43Å; K158-A168 WeakPolarHBondContact O-CB 3.45Å; F160-A168 CarbonylContact O-C 3.58Å; F160-A168 WeakPolarHBondContact O-CA 3.39Å; D161-A168 HydrophobicContact CB-CB 4.42Å; G166-A168 PolarHBondContact O-N 3.45Å
169	F	92.8	Very high	92.3	Very high	42 Å²	42	67.1 Å²	67.1	18%	0.184	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	148.4	-176.6	-59.7	-91.1	0	0	0	111.3	K158 F160 K167 R171 N174 L175 H178	K158-F169 CarbonylContact C-O 3.3Å; K158-F169 VanDerWaalsContact C-O 3.27Å; K158-F169 VanDerWaalsContact CA-O 3.32Å; K158-F169 WeakPolarHBondContact CA-O 3.44Å; F160-F169 WeakPolarHBondContact CD2-O 3.44Å; F160-F169 PolarHBondContact N-O 3.1Å; F160-F169 VanDerWaalsContact N-O 3.13Å; F160-F169 PolarHBondContact O-N 2.8Å; K167-F169 HydrophobicContact CB-CE2 3.91Å; K167-F169 HydrophobicContact CB-CZ 4.11Å; K167-F169 WeakPolarHBondContact O-CE2 3.38Å; F169-R171 VanDerWaalsContact C-N 3.3Å; F169-R171 PolarHBondContact O-N 2.6Å; F169-N174 HydrophobicContact CB-CB 4.25Å; F169-N174 HydrophobicContact CD1-CB 4Å; F169-N174 HydrophobicContact CG-CB 4.39Å; F169-L175 HydrophobicContact CB-CB 4.34Å; F169-L175 HydrophobicContact CD2-CB 3.91Å; F169-L175 HydrophobicContact CD2-CD1 3.8Å; F169-L175 HydrophobicContact CD2-CG 4.47Å; F169-L175 HydrophobicContact CE2-CD1 3.96Å; F169-L175 HydrophobicContact CG-CB 4.28Å; F169-H178 HydrophobicContact CE1-CB 3.9Å; F169-H178 HydrophobicContact CE2-CB 3.86Å; F169-H178 AromaticContact CE2-CD2 3.2Å; F169-H178 WeakPolarHBondContact CE2-CD2 3.48Å; F169-H178 AromaticContact CE2-CG 3.6Å; F169-H178 AromaticContact CE2-NE2 3.95Å; F169-H178 HydrophobicContact CZ-CB 3.4Å; F169-H178 VanDerWaalsContact CZ-CB 3.4Å; F169-H178 AromaticContact CZ-CD2 3.3Å; F169-H178 WeakPolarHBondContact CZ-CD2 3.3Å; F169-H178 AromaticContact CZ-CG 3.2Å; F169-H178 AromaticContact CZ-ND1 3.88Å; F169-H178 AromaticContact CZ-NE2 3.97Å
170	A	91.8	Very high	92.3	Very high	27 Å²	27	66.7 Å²	66.7	22%	0.223	36%	0.36	C	S	.	.	S	Bend	trans	-77	-14.8	178.5	0	0	0	0	0	113.6	R152	R152-A170 HydrophobicContact CB-CB 4.18Å; R152-A170 WeakPolarHBondContact CD-O 3.5Å; R152-A170 PolarHBondContact NH1-O 3.33Å
171	R	91.4	Very high	92.1	Very high	123 Å²	123	68 Å²	68	46%	0.464	37%	0.373	S	S	.	.	S	Bend	trans	-138.6	142.1	-178.7	-62.6	-178.1	-175.9	-165.2	-6.5	109.9	I149 F160 F169 S173 N174 L175	I149-R171 HydrophobicContact CG2-CG 3.84Å; I149-R171 VanDerWaalsContact CG2-CZ 3.47Å; I149-R171 VanDerWaalsContact CG2-NH2 3.33Å; F160-R171 VanDerWaalsContact CD2-C 3.43Å; F169-R171 VanDerWaalsContact C-N 3.3Å; F169-R171 PolarHBondContact O-N 2.6Å; R171-S173 PolarHBondContact O-N 2.79Å; R171-N174 PolarHBondContact O-N 3.33Å; R171-L175 PolarHBondContact O-N 3.18Å
172	H	92.6	Very high	92	Very high	97 Å²	97	66.4 Å²	66.4	45%	0.449	36%	0.362	S	S	.	.	H	α-helix	trans	-60.3	-44.3	178.1	-172.4	-4.5	0	0	0	112.5	F160 N174 L175 D176	F160-H172 HydrophobicContact CD1-CB 4.03Å; F160-H172 HydrophobicContact CE1-CB 3.89Å; F160-H172 HydrophobicContact CE2-CB 4.43Å; F160-H172 HydrophobicContact CG-CB 4.37Å; F160-H172 HydrophobicContact CZ-CB 4.1Å; H172-N174 PolarHBondContact O-N 3.08Å; H172-N174 VanDerWaalsContact O-N 3.15Å; H172-L175 WeakPolarHBondContact O-CA 3.49Å; H172-L175 VanDerWaalsContact O-CB 3.29Å; H172-L175 WeakPolarHBondContact O-CB 3.42Å; H172-L175 PolarHBondContact O-N 2.89Å; H172-D176 IonicContact CE1-OD1 3.31Å; H172-D176 PolarHBondContact CE1-OD1 3.32Å; H172-D176 IonicContact CE1-OD2 3.43Å; H172-D176 PolarHBondContact CE1-OD2 3.45Å; H172-D176 IonicContact CG-OD2 4Å; H172-D176 IonicContact ND1-OD1 2.72Å; H172-D176 PolarHBondContact ND1-OD1 3.13Å; H172-D176 IonicContact ND1-OD2 3.45Å; H172-D176 PolarHBondContact ND1-OD2 3.22Å; H172-D176 PolarHBondContact O-N 3.48Å
173	S	89.1	Confident	91.8	Very high	67 Å²	67	70.2 Å²	70.2	47%	0.469	39%	0.385	S	S	.	.	H	α-helix	trans	-59.9	-29.7	179.1	53.2	0	0	0	0	113.8	R171 D176 I177	R171-S173 PolarHBondContact O-N 2.79Å; S173-D176 PolarHBondContact O-N 3.1Å; S173-I177 WeakPolarHBondContact O-CD1 3.45Å; S173-I177 VanDerWaalsContact O-CG1 3.3Å; S173-I177 WeakPolarHBondContact O-CG1 3.4Å; S173-I177 PolarHBondContact O-N 3.32Å; S173-I177 VanDerWaalsContact O-N 3.12Å
174	N	91.7	Very high	91.6	Very high	74 Å²	74	67.5 Å²	67.5	40%	0.396	37%	0.373	S	S	.	.	H	α-helix	trans	-73	-34.8	174.3	-69.4	-6.4	0	0	0	111.7	F169 R171 H172 H178	F169-N174 HydrophobicContact CB-CB 4.25Å; F169-N174 HydrophobicContact CD1-CB 4Å; F169-N174 HydrophobicContact CG-CB 4.39Å; R171-N174 PolarHBondContact O-N 3.33Å; H172-N174 PolarHBondContact O-N 3.08Å; H172-N174 VanDerWaalsContact O-N 3.15Å; N174-H178 VanDerWaalsContact O-CB 3.31Å; N174-H178 WeakPolarHBondContact O-CB 3.42Å; N174-H178 PolarHBondContact O-N 3.26Å
175	L	92.4	Very high	91.7	Very high	10 Å²	10	66.9 Å²	66.9	5%	0.052	37%	0.371	C	S	.	.	H	α-helix	trans	-64.2	-43.3	171.6	171.7	63.2	0	0	0	110.4	F160 D161 C162 F169 R171 H172 I177 H178 K179	F160-L175 HydrophobicContact CB-CB 4.29Å; F160-L175 HydrophobicContact CB-CD2 3.94Å; D161-L175 WeakPolarHBondContact O-CD2 3.46Å; C162-L175 HydrophobicContact CB-CD1 3.64Å; F169-L175 HydrophobicContact CB-CB 4.34Å; F169-L175 HydrophobicContact CD2-CB 3.91Å; F169-L175 HydrophobicContact CD2-CD1 3.8Å; F169-L175 HydrophobicContact CD2-CG 4.47Å; F169-L175 HydrophobicContact CE2-CD1 3.96Å; F169-L175 HydrophobicContact CG-CB 4.28Å; R171-L175 PolarHBondContact O-N 3.18Å; H172-L175 WeakPolarHBondContact O-CA 3.49Å; H172-L175 VanDerWaalsContact O-CB 3.29Å; H172-L175 WeakPolarHBondContact O-CB 3.42Å; H172-L175 PolarHBondContact O-N 2.89Å; L175-I177 PolarHBondContact O-N 2.97Å; L175-H178 CarbonylContact O-C 3.28Å; L175-H178 WeakPolarHBondContact O-CA 3.32Å; L175-H178 WeakPolarHBondContact O-CB 3.37Å; L175-H178 PolarHBondContact O-N 3.4Å; L175-K179 HydrophobicContact CD1-CG 4.27Å; L175-K179 WeakPolarHBondContact O-CG 3.41Å; L175-K179 PolarHBondContact O-N 2.83Å
176	D	91.8	Very high	91.6	Very high	59 Å²	59	70 Å²	70	32%	0.316	38%	0.378	S	S	.	.	H	α-helix	trans	-63.8	-43.6	-179.8	-59.2	-33	0	0	0	111.9	H172 S173 H178 K179 R180	H172-D176 IonicContact CE1-OD1 3.31Å; H172-D176 PolarHBondContact CE1-OD1 3.32Å; H172-D176 IonicContact CE1-OD2 3.43Å; H172-D176 PolarHBondContact CE1-OD2 3.45Å; H172-D176 IonicContact CG-OD2 4Å; H172-D176 IonicContact ND1-OD1 2.72Å; H172-D176 PolarHBondContact ND1-OD1 3.13Å; H172-D176 IonicContact ND1-OD2 3.45Å; H172-D176 PolarHBondContact ND1-OD2 3.22Å; H172-D176 PolarHBondContact O-N 3.48Å; S173-D176 PolarHBondContact O-N 3.1Å; D176-H178 PolarHBondContact O-N 3.33Å; D176-K179 PolarHBondContact O-N 3.27Å; D176-R180 PolarHBondContact O-N 3.47Å
177	I	90	Very high	91.5	Very high	64 Å²	64	70.5 Å²	70.5	33%	0.328	37%	0.37	S	S	.	.	H	α-helix	trans	-62.1	-37	172.9	-66.9	166.1	0	0	0	110.8	S173 L175 R180 T199	S173-I177 WeakPolarHBondContact O-CD1 3.45Å; S173-I177 VanDerWaalsContact O-CG1 3.3Å; S173-I177 WeakPolarHBondContact O-CG1 3.4Å; S173-I177 PolarHBondContact O-N 3.32Å; S173-I177 VanDerWaalsContact O-N 3.12Å; L175-I177 PolarHBondContact O-N 2.97Å; I177-R180 WeakPolarHBondContact O-CB 3.47Å; I177-R180 PolarHBondContact O-N 2.82Å; I177-T199 HydrophobicContact CD1-CG2 4.25Å; I177-T199 HydrophobicContact CG1-CG2 4.32Å; I177-T199 HydrophobicContact CG2-CG2 3.47Å; I177-T199 VanDerWaalsContact CG2-CG2 3.47Å
178	H	92.4	Very high	91.4	Very high	20 Å²	20	68 Å²	68	9%	0.093	36%	0.358	C	S	.	.	H	α-helix	trans	-68.8	-38.9	176.4	167.3	57.9	0	0	0	112.5	C165 F169 N174 L175 D176 R180 T181 H182	C165-H178 PolarHBondContact SG-NE2 3.22Å; F169-H178 HydrophobicContact CE1-CB 3.9Å; F169-H178 HydrophobicContact CE2-CB 3.86Å; F169-H178 AromaticContact CE2-CD2 3.2Å; F169-H178 WeakPolarHBondContact CE2-CD2 3.48Å; F169-H178 AromaticContact CE2-CG 3.6Å; F169-H178 AromaticContact CE2-NE2 3.95Å; F169-H178 HydrophobicContact CZ-CB 3.4Å; F169-H178 VanDerWaalsContact CZ-CB 3.4Å; F169-H178 AromaticContact CZ-CD2 3.3Å; F169-H178 WeakPolarHBondContact CZ-CD2 3.3Å; F169-H178 AromaticContact CZ-CG 3.2Å; F169-H178 AromaticContact CZ-ND1 3.88Å; F169-H178 AromaticContact CZ-NE2 3.97Å; N174-H178 VanDerWaalsContact O-CB 3.31Å; N174-H178 WeakPolarHBondContact O-CB 3.42Å; N174-H178 PolarHBondContact O-N 3.26Å; L175-H178 CarbonylContact O-C 3.28Å; L175-H178 WeakPolarHBondContact O-CA 3.32Å; L175-H178 WeakPolarHBondContact O-CB 3.37Å; L175-H178 PolarHBondContact O-N 3.4Å; D176-H178 PolarHBondContact O-N 3.33Å; H178-R180 PolarHBondContact O-N 3.39Å; H178-R180 VanDerWaalsContact O-N 3.16Å; H178-T181 PolarHBondContact CE1-OG1 3.46Å; H178-T181 PolarHBondContact ND1-OG1 2.98Å; H178-T181 WeakPolarHBondContact O-CA 3.43Å; H178-T181 VanDerWaalsContact O-CB 3.26Å; H178-T181 WeakPolarHBondContact O-CB 3.23Å; H178-T181 WeakPolarHBondContact O-CG2 3.43Å; H178-T181 PolarHBondContact O-N 2.95Å; H178-T181 PolarHBondContact O-OG1 3.27Å; H178-H182 AromaticContact CE1-NE2 3.4Å; H178-H182 PolarHBondContact CE1-NE2 3.19Å; H178-H182 AromaticContact NE2-CD2 3.97Å; H178-H182 AromaticContact NE2-NE2 3.27Å; H178-H182 PolarHBondContact NE2-NE2 3.22Å
179	K	91.9	Very high	91.3	Very high	83 Å²	83	70.7 Å²	70.7	36%	0.361	37%	0.367	S	S	.	.	H	α-helix	trans	-56.5	-32	176.8	-75.2	179.1	175.8	-178.6	0	112.5	L175 D176 T181 H182 T183	L175-K179 HydrophobicContact CD1-CG 4.27Å; L175-K179 WeakPolarHBondContact O-CG 3.41Å; L175-K179 PolarHBondContact O-N 2.83Å; D176-K179 PolarHBondContact O-N 3.27Å; K179-T181 PolarHBondContact O-N 3.19Å; K179-T181 VanDerWaalsContact O-N 3.1Å; K179-H182 WeakPolarHBondContact O-CB 3.32Å; K179-H182 PolarHBondContact O-N 3.11Å; K179-T183 PolarHBondContact O-N 3.05Å
180	R	92.4	Very high	91.2	Very high	60 Å²	60	68.8 Å²	68.8	23%	0.226	36%	0.359	C	S	.	.	H	α-helix	trans	-59.1	-21.2	171.7	-60.8	-179.5	-176.8	155.3	5.3	114.1	D176 I177 H178 H182 T183 G184 E185 S198	D176-R180 PolarHBondContact O-N 3.47Å; I177-R180 WeakPolarHBondContact O-CB 3.47Å; I177-R180 PolarHBondContact O-N 2.82Å; H178-R180 PolarHBondContact O-N 3.39Å; H178-R180 VanDerWaalsContact O-N 3.16Å; R180-H182 VanDerWaalsContact C-N 3.29Å; R180-T183 WeakPolarHBondContact CA-OG1 3.42Å; R180-G184 CarbonylContact O-C 3.53Å; R180-G184 WeakPolarHBondContact O-CA 3.23Å; R180-G184 PolarHBondContact O-N 2.91Å; R180-E185 HydrophobicContact CB-CB 4.36Å; R180-E185 HydrophobicContact CG-CB 4.23Å; R180-E185 PolarHBondContact O-N 3.42Å; R180-S198 PolarHBondContact NH1-O 3.47Å
181	T	91.1	Very high	91.1	Very high	91 Å²	91	74.6 Å²	74.6	56%	0.558	39%	0.386	S	S	*	.	H	α-helix	trans	-73.8	-22.2	174.3	67.7	0	0	0	0	113.2	H178 K179	H178-T181 PolarHBondContact CE1-OG1 3.46Å; H178-T181 PolarHBondContact ND1-OG1 2.98Å; H178-T181 WeakPolarHBondContact O-CA 3.43Å; H178-T181 VanDerWaalsContact O-CB 3.26Å; H178-T181 WeakPolarHBondContact O-CB 3.23Å; H178-T181 WeakPolarHBondContact O-CG2 3.43Å; H178-T181 PolarHBondContact O-N 2.95Å; H178-T181 PolarHBondContact O-OG1 3.27Å; K179-T181 PolarHBondContact O-N 3.19Å; K179-T181 VanDerWaalsContact O-N 3.1Å
182	H	91.9	Very high	90.8	Very high	69 Å²	69	75.2 Å²	75.2	32%	0.319	40%	0.395	S	S	.	.	H	α-helix	trans	-88	-46.5	174.9	-64.9	-66.3	0	0	0	111.8	C162 E164 C165 H178 K179 R180 G184	C162-H182 PolarHBondContact SG-NE2 3.43Å; C162-H182 VanDerWaalsContact SG-NE2 3.43Å; E164-H182 WeakPolarHBondContact OE2-CB 3.47Å; E164-H182 IonicContact OE2-CD2 3.47Å; E164-H182 IonicContact OE2-CG 3.75Å; E164-H182 IonicContact OE2-ND1 3.16Å; E164-H182 PolarHBondContact OE2-ND1 2.76Å; C165-H182 PolarHBondContact SG-NE2 3.13Å; C165-H182 VanDerWaalsContact SG-NE2 3.4Å; H178-H182 AromaticContact CE1-NE2 3.4Å; H178-H182 PolarHBondContact CE1-NE2 3.19Å; H178-H182 AromaticContact NE2-CD2 3.97Å; H178-H182 AromaticContact NE2-NE2 3.27Å; H178-H182 PolarHBondContact NE2-NE2 3.22Å; K179-H182 WeakPolarHBondContact O-CB 3.32Å; K179-H182 PolarHBondContact O-N 3.11Å; R180-H182 VanDerWaalsContact C-N 3.29Å; H182-G184 VanDerWaalsContact C-N 3.28Å; H182-G184 PolarHBondContact O-N 3.21Å
183	T	90.3	Very high	90.7	Very high	82 Å²	82	73.2 Å²	73.2	50%	0.503	39%	0.391	S	S	.	.	H	α-helix	trans	-73.5	-21.8	179	62.5	0	0	0	0	112.8	K179 R180 E185	K179-T183 PolarHBondContact O-N 3.05Å; R180-T183 WeakPolarHBondContact CA-OG1 3.42Å; T183-E185 PolarHBondContact O-N 3.43Å; T183-E185 WeakPolarHBondContact OG1-CB 3.45Å; T183-E185 WeakPolarHBondContact OG1-CG 3.41Å; T183-E185 PolarHBondContact OG1-N 3.47Å
184	G	88.7	Confident	90.6	Very high	47 Å²	47	72.9 Å²	72.9	49%	0.485	40%	0.398	S	S	.	.			trans	77	4.1	-173	0	0	0	0	0	113.8	R180 H182 K186	R180-G184 CarbonylContact O-C 3.53Å; R180-G184 WeakPolarHBondContact O-CA 3.23Å; R180-G184 PolarHBondContact O-N 2.91Å; H182-G184 VanDerWaalsContact C-N 3.28Å; H182-G184 PolarHBondContact O-N 3.21Å; G184-K186 PolarHBondContact O-N 3.03Å
185	E	90.5	Very high	90.6	Very high	112 Å²	112	75.1 Å²	75.1	52%	0.523	40%	0.404	S	S	.	.			trans	-58.8	129.9	-179.1	-78.9	177.2	-170.3	0	0	112.5	R180 T183	R180-E185 HydrophobicContact CB-CB 4.36Å; R180-E185 HydrophobicContact CG-CB 4.23Å; R180-E185 PolarHBondContact O-N 3.42Å; T183-E185 PolarHBondContact O-N 3.43Å; T183-E185 WeakPolarHBondContact OG1-CB 3.45Å; T183-E185 WeakPolarHBondContact OG1-CG 3.41Å; T183-E185 PolarHBondContact OG1-N 3.47Å
186	K	91.9	Very high	90.6	Very high	124 Å²	124	76.2 Å²	76.2	54%	0.539	42%	0.415	S	S	.	.			trans	-135	80.4	-179.6	-72.9	164.3	169.3	-163.5	0	109.4	G184 Y188 A196 F197	G184-K186 PolarHBondContact O-N 3.03Å; K186-Y188 PolarHBondContact O-N 3.3Å; K186-Y188 VanDerWaalsContact O-N 3.13Å; K186-A196 HydrophobicContact CB-CB 3.47Å; K186-A196 VanDerWaalsContact CB-CB 3.47Å; K186-A196 HydrophobicContact CD-CB 4.24Å; K186-A196 VanDerWaalsContact CD-O 3.31Å; K186-A196 WeakPolarHBondContact CD-O 3.43Å; K186-A196 HydrophobicContact CG-CB 4.45Å; K186-A196 WeakPolarHBondContact O-CB 3.37Å; K186-F197 CarbonylContact C-O 3.51Å; K186-F197 VanDerWaalsContact C-O 3.28Å; K186-F197 VanDerWaalsContact CA-O 3.28Å; K186-F197 WeakPolarHBondContact CA-O 3.39Å
187	P	89.4	Confident	90.6	Very high	70 Å²	70	75.5 Å²	75.5	46%	0.455	41%	0.409	S	S	.	.			trans	-71	-6	-172.7	-20	33.6	0	0	0	115.1
188	Y	92.5	Very high	90.6	Very high	73 Å²	73	73.8 Å²	73.8	29%	0.286	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	93.1	-173.1	-56.6	-82.5	0	0	0	109.9	K186 A196 F197 T199 R200	K186-Y188 PolarHBondContact O-N 3.3Å; K186-Y188 VanDerWaalsContact O-N 3.13Å; Y188-A196 CarbonylContact O-C 3.56Å; Y188-A196 WeakPolarHBondContact O-CA 3.32Å; Y188-F197 WeakPolarHBondContact CD2-O 3.49Å; Y188-F197 PolarHBondContact N-O 3.37Å; Y188-F197 PolarHBondContact O-N 3.39Å; Y188-T199 VanDerWaalsContact CD2-C 3.48Å; Y188-R200 HydrophobicContact CD1-CB 3.89Å; Y188-R200 HydrophobicContact CD1-CG 4.3Å; Y188-R200 HydrophobicContact CE1-CB 3.68Å; Y188-R200 HydrophobicContact CE1-CG 4.28Å; Y188-R200 HydrophobicContact CG-CB 4.44Å
189	D	91.2	Very high	90.4	Very high	90 Å²	90	73.9 Å²	73.9	48%	0.481	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	145.3	176.9	59.7	-67.1	0	0	0	112.9	A196 L203	D189-A196 HydrophobicContact CB-CB 4.42Å; D189-L203 WeakPolarHBondContact O-CD2 3.49Å
190	C	91.3	Very high	90.3	Very high	2 Å²	2	77.4 Å²	77.4	1%	0.014	42%	0.416	C	S	.	.			trans	-88.1	116.6	170.3	177.7	0	0	0	0	109.1	E192 C193 G194 K195 F197 L203	C190-E192 PolarHBondContact O-N 3.37Å; C190-E192 VanDerWaalsContact O-N 3.15Å; C190-C193 PolarHBondContact O-N 3.3Å; C190-G194 VanDerWaalsContact O-CA 3.27Å; C190-G194 WeakPolarHBondContact O-CA 3.26Å; C190-G194 PolarHBondContact O-N 3.14Å; C190-K195 WeakPolarHBondContact CB-O 3.46Å; C190-K195 PolarHBondContact N-O 3.19Å; C190-F197 HydrophobicContact CB-CE2 4.42Å; C190-L203 HydrophobicContact CB-CD1 3.62Å
191	N	88.8	Confident	89.9	Confident	149 Å²	149	78 Å²	78	80%	0.797	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-27.5	-179.6	-67.4	-21.8	0	0	0	113.6
192	E	84.7	Confident	89.7	Confident	137 Å²	137	78.7 Å²	78.7	64%	0.64	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-33.4	-176.7	-70.1	-166.2	-156	0	0	114.5	C190 H210	C190-E192 PolarHBondContact O-N 3.37Å; C190-E192 VanDerWaalsContact O-N 3.15Å; E192-H210 WeakPolarHBondContact OE2-CB 3.33Å; E192-H210 IonicContact OE2-CE1 3.19Å; E192-H210 IonicContact OE2-CG 2.74Å; E192-H210 IonicContact OE2-ND1 3.72Å; E192-H210 PolarHBondContact OE2-ND1 3.34Å
193	C	90.2	Very high	89.6	Confident	55 Å²	55	76.2 Å²	76.2	37%	0.372	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.5	1.7	-178.4	68.8	0	0	0	0	115.3	C190 K195 H206 H210	C190-C193 PolarHBondContact O-N 3.3Å; C193-K195 PolarHBondContact O-N 2.97Å; C193-K195 VanDerWaalsContact O-N 3.16Å; C193-K195 VanDerWaalsContact SG-CB 3.59Å; C193-K195 VanDerWaalsContact SG-CG 3.56Å; C193-H206 PolarHBondContact SG-NE2 3.17Å; C193-H210 PolarHBondContact SG-NE2 2.78Å; C193-H210 VanDerWaalsContact SG-NE2 3.37Å
194	G	88.3	Confident	89.4	Confident	60 Å²	60	77 Å²	77	62%	0.619	41%	0.413	S	S	*	.			trans	67.5	7.5	-177.8	0	0	0	0	0	114.4	C190 A196	C190-G194 VanDerWaalsContact O-CA 3.27Å; C190-G194 WeakPolarHBondContact O-CA 3.26Å; C190-G194 PolarHBondContact O-N 3.14Å; G194-A196 PolarHBondContact O-N 3.29Å
195	K	91.7	Very high	89.1	Confident	121 Å²	121	77.4 Å²	77.4	53%	0.526	40%	0.403	S	S	.	.			trans	-73.1	127.2	177.4	-75.5	-179.4	-177.8	171.4	0	110.2	C190 C193 F197	C190-K195 WeakPolarHBondContact CB-O 3.46Å; C190-K195 PolarHBondContact N-O 3.19Å; C193-K195 PolarHBondContact O-N 2.97Å; C193-K195 VanDerWaalsContact O-N 3.16Å; C193-K195 VanDerWaalsContact SG-CB 3.59Å; C193-K195 VanDerWaalsContact SG-CG 3.56Å; K195-F197 HydrophobicContact CB-CE2 3.95Å; K195-F197 HydrophobicContact CB-CZ 4.08Å; K195-F197 VanDerWaalsContact O-CE2 3.3Å; K195-F197 WeakPolarHBondContact O-CE2 3.42Å
196	A	91.6	Very high	88.9	Confident	33 Å²	33	73 Å²	73	27%	0.273	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	145.4	178.1	0	0	0	0	0	113	K186 Y188 D189 G194	K186-A196 HydrophobicContact CB-CB 3.47Å; K186-A196 VanDerWaalsContact CB-CB 3.47Å; K186-A196 HydrophobicContact CD-CB 4.24Å; K186-A196 VanDerWaalsContact CD-O 3.31Å; K186-A196 WeakPolarHBondContact CD-O 3.43Å; K186-A196 HydrophobicContact CG-CB 4.45Å; K186-A196 WeakPolarHBondContact O-CB 3.37Å; Y188-A196 CarbonylContact O-C 3.56Å; Y188-A196 WeakPolarHBondContact O-CA 3.32Å; D189-A196 HydrophobicContact CB-CB 4.42Å; G194-A196 PolarHBondContact O-N 3.29Å
197	F	91	Very high	88.7	Confident	43 Å²	43	70.9 Å²	70.9	19%	0.189	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	151.4	-177.5	-59.7	-88.5	0	0	0	111.4	K186 Y188 C190 K195 T199 H202 L203 H206	K186-F197 CarbonylContact C-O 3.51Å; K186-F197 VanDerWaalsContact C-O 3.28Å; K186-F197 VanDerWaalsContact CA-O 3.28Å; K186-F197 WeakPolarHBondContact CA-O 3.39Å; Y188-F197 WeakPolarHBondContact CD2-O 3.49Å; Y188-F197 PolarHBondContact N-O 3.37Å; Y188-F197 PolarHBondContact O-N 3.39Å; C190-F197 HydrophobicContact CB-CE2 4.42Å; K195-F197 HydrophobicContact CB-CE2 3.95Å; K195-F197 HydrophobicContact CB-CZ 4.08Å; K195-F197 VanDerWaalsContact O-CE2 3.3Å; K195-F197 WeakPolarHBondContact O-CE2 3.42Å; F197-T199 VanDerWaalsContact C-N 3.33Å; F197-H202 HydrophobicContact CB-CB 4.22Å; F197-H202 HydrophobicContact CD1-CB 3.99Å; F197-H202 HydrophobicContact CG-CB 4.35Å; F197-L203 HydrophobicContact CB-CB 4.31Å; F197-L203 HydrophobicContact CD2-CB 3.89Å; F197-L203 HydrophobicContact CD2-CD1 3.75Å; F197-L203 HydrophobicContact CD2-CG 4.43Å; F197-L203 HydrophobicContact CE2-CD1 3.94Å; F197-L203 HydrophobicContact CG-CB 4.29Å; F197-H206 HydrophobicContact CE1-CB 3.92Å; F197-H206 HydrophobicContact CE2-CB 3.78Å; F197-H206 AromaticContact CE2-CD2 3.31Å; F197-H206 WeakPolarHBondContact CE2-CD2 3.47Å; F197-H206 AromaticContact CE2-CG 3.52Å; F197-H206 AromaticContact CE2-NE2 3.91Å; F197-H206 HydrophobicContact CZ-CB 3.4Å; F197-H206 AromaticContact CZ-CD2 3.42Å; F197-H206 VanDerWaalsContact CZ-CD2 3.42Å; F197-H206 WeakPolarHBondContact CZ-CD2 3.35Å; F197-H206 AromaticContact CZ-CE1 3.95Å; F197-H206 AromaticContact CZ-CG 3.14Å; F197-H206 AromaticContact CZ-ND1 3.53Å; F197-H206 AromaticContact CZ-NE2 3.87Å
198	S	90.2	Very high	88.4	Confident	29 Å²	29	68.8 Å²	68.8	20%	0.203	36%	0.359	C	S	.	.	S	Bend	trans	-79	-15.6	179	57.6	0	0	0	0	113.7	R180	R180-S198 PolarHBondContact NH1-O 3.47Å
199	T	88.6	Confident	88	Confident	21 Å²	21	70.2 Å²	70.2	13%	0.129	37%	0.371	C	S	.	.	S	Bend	trans	-139.7	145.9	178.9	65.6	0	0	0	0	111.4	I177 Y188 F197 S201 H202 L203	I177-T199 HydrophobicContact CD1-CG2 4.25Å; I177-T199 HydrophobicContact CG1-CG2 4.32Å; I177-T199 HydrophobicContact CG2-CG2 3.47Å; I177-T199 VanDerWaalsContact CG2-CG2 3.47Å; Y188-T199 VanDerWaalsContact CD2-C 3.48Å; F197-T199 VanDerWaalsContact C-N 3.33Å; T199-S201 VanDerWaalsContact C-N 3.3Å; T199-S201 PolarHBondContact O-N 3.41Å; T199-H202 PolarHBondContact O-N 3.17Å; T199-H202 PolarHBondContact OG1-N 2.87Å; T199-H202 PolarHBondContact OG1-ND1 2.78Å; T199-L203 PolarHBondContact O-N 3.36Å
200	R	89.8	Confident	87.7	Confident	157 Å²	157	68.6 Å²	68.6	59%	0.592	36%	0.36	S	S	*	.	H	α-helix	trans	-58.3	-39.9	177.4	-170.4	177	178.9	108.5	2.1	112.8	Y188 H202 L203 Q204	Y188-R200 HydrophobicContact CD1-CB 3.89Å; Y188-R200 HydrophobicContact CD1-CG 4.3Å; Y188-R200 HydrophobicContact CE1-CB 3.68Å; Y188-R200 HydrophobicContact CE1-CG 4.28Å; Y188-R200 HydrophobicContact CG-CB 4.44Å; R200-H202 VanDerWaalsContact C-N 3.29Å; R200-H202 PolarHBondContact O-N 3.05Å; R200-L203 WeakPolarHBondContact O-CB 3.34Å; R200-L203 PolarHBondContact O-N 3.35Å; R200-Q204 WeakPolarHBondContact O-CG 3.29Å; R200-Q204 PolarHBondContact O-N 2.85Å
201	S	84.6	Confident	87.3	Confident	72 Å²	72	72.2 Å²	72.2	50%	0.503	38%	0.383	S	S	.	.	H	α-helix	trans	-64.1	-33.8	179.8	-54.4	0	0	0	0	112.6	T199 I205	T199-S201 VanDerWaalsContact C-N 3.3Å; T199-S201 PolarHBondContact O-N 3.41Å; S201-I205 WeakPolarHBondContact O-CD1 3.5Å; S201-I205 VanDerWaalsContact O-CG1 3.23Å; S201-I205 WeakPolarHBondContact O-CG1 3.47Å; S201-I205 PolarHBondContact O-N 3.23Å; S201-I205 VanDerWaalsContact O-N 3.13Å
202	H	87.4	Confident	86.8	Confident	106 Å²	106	67.5 Å²	67.5	49%	0.491	37%	0.369	S	S	.	.	H	α-helix	trans	-71.7	-36.6	174.2	-69	159.2	0	0	0	112.2	F197 T199 R200 H206	F197-H202 HydrophobicContact CB-CB 4.22Å; F197-H202 HydrophobicContact CD1-CB 3.99Å; F197-H202 HydrophobicContact CG-CB 4.35Å; T199-H202 PolarHBondContact O-N 3.17Å; T199-H202 PolarHBondContact OG1-N 2.87Å; T199-H202 PolarHBondContact OG1-ND1 2.78Å; R200-H202 VanDerWaalsContact C-N 3.29Å; R200-H202 PolarHBondContact O-N 3.05Å; H202-H206 VanDerWaalsContact O-CB 3.29Å; H202-H206 WeakPolarHBondContact O-CB 3.45Å; H202-H206 PolarHBondContact O-N 3.08Å
203	L	88.6	Confident	86.6	Confident	18 Å²	18	67 Å²	67	9%	0.094	37%	0.367	C	S	.	.	H	α-helix	trans	-61.1	-49.4	171.3	172.7	62.6	0	0	0	110.9	D189 C190 F197 T199 R200 I205 H206 E207	D189-L203 WeakPolarHBondContact O-CD2 3.49Å; C190-L203 HydrophobicContact CB-CD1 3.62Å; F197-L203 HydrophobicContact CB-CB 4.31Å; F197-L203 HydrophobicContact CD2-CB 3.89Å; F197-L203 HydrophobicContact CD2-CD1 3.75Å; F197-L203 HydrophobicContact CD2-CG 4.43Å; F197-L203 HydrophobicContact CE2-CD1 3.94Å; F197-L203 HydrophobicContact CG-CB 4.29Å; T199-L203 PolarHBondContact O-N 3.36Å; R200-L203 WeakPolarHBondContact O-CB 3.34Å; R200-L203 PolarHBondContact O-N 3.35Å; L203-I205 VanDerWaalsContact C-N 3.31Å; L203-I205 PolarHBondContact O-N 3.42Å; L203-H206 CarbonylContact O-C 3.5Å; L203-H206 WeakPolarHBondContact O-CA 3.34Å; L203-H206 VanDerWaalsContact O-CB 3.27Å; L203-H206 WeakPolarHBondContact O-CB 3.3Å; L203-H206 PolarHBondContact O-N 3.19Å; L203-E207 HydrophobicContact CD1-CG 4.11Å; L203-E207 HydrophobicContact CG-CG 4.4Å; L203-E207 WeakPolarHBondContact O-CG 3.34Å; L203-E207 PolarHBondContact O-N 3.09Å
204	Q	86.1	Confident	86.4	Confident	97 Å²	97	70 Å²	70	45%	0.453	37%	0.373	S	S	.	.	H	α-helix	trans	-57.7	-43.4	179.4	-73.9	178.9	-38.2	0	0	112.5	R200 H206 E207	R200-Q204 WeakPolarHBondContact O-CG 3.29Å; R200-Q204 PolarHBondContact O-N 2.85Å; Q204-H206 VanDerWaalsContact C-N 3.27Å; Q204-H206 PolarHBondContact O-N 3.39Å; Q204-E207 PolarHBondContact O-N 3.16Å
205	I	82.3	Confident	86.1	Confident	57 Å²	57	70.6 Å²	70.6	29%	0.292	37%	0.367	S	S	.	.	H	α-helix	trans	-69.1	-30.7	176.7	-64.6	164.3	0	0	0	111.3	S201 L203 I208 Y227	S201-I205 WeakPolarHBondContact O-CD1 3.5Å; S201-I205 VanDerWaalsContact O-CG1 3.23Å; S201-I205 WeakPolarHBondContact O-CG1 3.47Å; S201-I205 PolarHBondContact O-N 3.23Å; S201-I205 VanDerWaalsContact O-N 3.13Å; L203-I205 VanDerWaalsContact C-N 3.31Å; L203-I205 PolarHBondContact O-N 3.42Å; I205-I208 WeakPolarHBondContact O-CB 3.3Å; I205-Y227 HydrophobicContact CG2-CD1 3.82Å; I205-Y227 HydrophobicContact CG2-CE1 3.16Å; I205-Y227 HydrophobicContact CG2-CE2 4.38Å; I205-Y227 VanDerWaalsContact CG2-CZ 3.45Å
206	H	86.2	Confident	86	Confident	19 Å²	19	69.2 Å²	69.2	9%	0.088	36%	0.359	C	S	.	.	H	α-helix	trans	-68.5	-41.7	172.7	170.7	72.8	0	0	0	111.8	C193 F197 H202 L203 Q204 I208 I209 H210	C193-H206 PolarHBondContact SG-NE2 3.17Å; F197-H206 HydrophobicContact CE1-CB 3.92Å; F197-H206 HydrophobicContact CE2-CB 3.78Å; F197-H206 AromaticContact CE2-CD2 3.31Å; F197-H206 WeakPolarHBondContact CE2-CD2 3.47Å; F197-H206 AromaticContact CE2-CG 3.52Å; F197-H206 AromaticContact CE2-NE2 3.91Å; F197-H206 HydrophobicContact CZ-CB 3.4Å; F197-H206 AromaticContact CZ-CD2 3.42Å; F197-H206 VanDerWaalsContact CZ-CD2 3.42Å; F197-H206 WeakPolarHBondContact CZ-CD2 3.35Å; F197-H206 AromaticContact CZ-CE1 3.95Å; F197-H206 AromaticContact CZ-CG 3.14Å; F197-H206 AromaticContact CZ-ND1 3.53Å; F197-H206 AromaticContact CZ-NE2 3.87Å; H202-H206 VanDerWaalsContact O-CB 3.29Å; H202-H206 WeakPolarHBondContact O-CB 3.45Å; H202-H206 PolarHBondContact O-N 3.08Å; L203-H206 CarbonylContact O-C 3.5Å; L203-H206 WeakPolarHBondContact O-CA 3.34Å; L203-H206 VanDerWaalsContact O-CB 3.27Å; L203-H206 WeakPolarHBondContact O-CB 3.3Å; L203-H206 PolarHBondContact O-N 3.19Å; Q204-H206 VanDerWaalsContact C-N 3.27Å; Q204-H206 PolarHBondContact O-N 3.39Å; H206-I208 PolarHBondContact O-N 3.03Å; H206-I209 VanDerWaalsContact CE1-CD1 3.48Å; H206-I209 WeakPolarHBondContact CE1-CD1 3.19Å; H206-I209 WeakPolarHBondContact O-CB 3.32Å; H206-I209 WeakPolarHBondContact O-CG1 3.46Å; H206-I209 PolarHBondContact O-N 3.07Å; H206-H210 AromaticContact CE1-NE2 3.87Å; H206-H210 AromaticContact NE2-CD2 3.83Å; H206-H210 AromaticContact NE2-NE2 3.42Å; H206-H210 PolarHBondContact NE2-NE2 3.17Å
207	E	87.2	Confident	85.9	Confident	79 Å²	79	70.9 Å²	70.9	37%	0.369	37%	0.366	S	S	.	.	H	α-helix	trans	-57.7	-26.1	178.2	-70.3	169.2	154.3	0	0	112.7	L203 Q204 I209 H210 T211	L203-E207 HydrophobicContact CD1-CG 4.11Å; L203-E207 HydrophobicContact CG-CG 4.4Å; L203-E207 WeakPolarHBondContact O-CG 3.34Å; L203-E207 PolarHBondContact O-N 3.09Å; Q204-E207 PolarHBondContact O-N 3.16Å; E207-I209 PolarHBondContact O-N 3.26Å; E207-H210 VanDerWaalsContact O-CB 3.31Å; E207-H210 WeakPolarHBondContact O-CB 3.47Å; E207-H210 PolarHBondContact O-N 3.17Å; E207-T211 PolarHBondContact O-N 3.14Å; E207-T211 VanDerWaalsContact O-N 3.14Å
208	I	85.1	Confident	85.8	Confident	27 Å²	27	68.9 Å²	68.9	14%	0.138	36%	0.357	C	S	.	.	H	α-helix	trans	-57.6	-29.6	171.5	-58.2	175.7	0	0	0	112.3	I205 H206 H210 T211 G212 E213 P215 A226	I205-I208 WeakPolarHBondContact O-CB 3.3Å; H206-I208 PolarHBondContact O-N 3.03Å; I208-H210 VanDerWaalsContact C-N 3.26Å; I208-H210 PolarHBondContact O-N 3.19Å; I208-T211 PolarHBondContact O-OG1 2.95Å; I208-G212 WeakPolarHBondContact O-CA 3.28Å; I208-G212 PolarHBondContact O-N 3.43Å; I208-E213 WeakPolarHBondContact CG2-O 3.43Å; I208-P215 HydrophobicContact CD1-CG 4.5Å; I208-A226 HydrophobicContact CG2-CB 3.9Å
209	I	83.2	Confident	85.6	Confident	102 Å²	102	74.8 Å²	74.8	52%	0.523	39%	0.386	S	S	.	.	H	α-helix	trans	-70.2	-25.1	176.8	70.7	130.2	0	0	0	112.8	H206 E207	H206-I209 VanDerWaalsContact CE1-CD1 3.48Å; H206-I209 WeakPolarHBondContact CE1-CD1 3.19Å; H206-I209 WeakPolarHBondContact O-CB 3.32Å; H206-I209 WeakPolarHBondContact O-CG1 3.46Å; H206-I209 PolarHBondContact O-N 3.07Å; E207-I209 PolarHBondContact O-N 3.26Å
210	H	83.9	Confident	85.3	Confident	56 Å²	56	80.3 Å²	80.3	26%	0.259	41%	0.411	S	S	.	.	H	α-helix	trans	-82.5	-48.6	179.7	-77.6	-77.6	0	0	0	111	E192 C193 H206 E207 I208 G212	E192-H210 WeakPolarHBondContact OE2-CB 3.33Å; E192-H210 IonicContact OE2-CE1 3.19Å; E192-H210 IonicContact OE2-CG 2.74Å; E192-H210 IonicContact OE2-ND1 3.72Å; E192-H210 PolarHBondContact OE2-ND1 3.34Å; C193-H210 PolarHBondContact SG-NE2 2.78Å; C193-H210 VanDerWaalsContact SG-NE2 3.37Å; H206-H210 AromaticContact CE1-NE2 3.87Å; H206-H210 AromaticContact NE2-CD2 3.83Å; H206-H210 AromaticContact NE2-NE2 3.42Å; H206-H210 PolarHBondContact NE2-NE2 3.17Å; E207-H210 VanDerWaalsContact O-CB 3.31Å; E207-H210 WeakPolarHBondContact O-CB 3.47Å; E207-H210 PolarHBondContact O-N 3.17Å; I208-H210 VanDerWaalsContact C-N 3.26Å; I208-H210 PolarHBondContact O-N 3.19Å; H210-G212 PolarHBondContact O-N 2.93Å
211	T	84	Confident	85.1	Confident	79 Å²	79	75.5 Å²	75.5	49%	0.485	40%	0.4	S	S	.	.	H	α-helix	trans	-69.7	-23.1	176.5	65.5	0	0	0	0	112.1	E207 I208 E213	E207-T211 PolarHBondContact O-N 3.14Å; E207-T211 VanDerWaalsContact O-N 3.14Å; I208-T211 PolarHBondContact O-OG1 2.95Å; T211-E213 PolarHBondContact O-N 3.33Å; T211-E213 WeakPolarHBondContact OG1-CB 3.46Å; T211-E213 WeakPolarHBondContact OG1-CG 3.39Å; T211-E213 PolarHBondContact OG1-N 2.97Å
212	G	78.8	Confident	85.2	Confident	50 Å²	50	74.6 Å²	74.6	52%	0.515	40%	0.402	S	S	.	.			trans	68.5	5.2	-172.7	0	0	0	0	0	113.1	I208 H210	I208-G212 WeakPolarHBondContact O-CA 3.28Å; I208-G212 PolarHBondContact O-N 3.43Å; H210-G212 PolarHBondContact O-N 2.93Å
213	E	80.7	Confident	85.1	Confident	125 Å²	125	75.6 Å²	75.6	58%	0.584	41%	0.405	S	S	*	.			trans	-60.8	147	178.4	-72.2	-177.2	171.4	0	0	110.1	I208 T211	I208-E213 WeakPolarHBondContact CG2-O 3.43Å; T211-E213 PolarHBondContact O-N 3.33Å; T211-E213 WeakPolarHBondContact OG1-CB 3.46Å; T211-E213 WeakPolarHBondContact OG1-CG 3.39Å; T211-E213 PolarHBondContact OG1-N 2.97Å
214	K	84.1	Confident	85	Confident	118 Å²	118	76.3 Å²	76.3	51%	0.513	41%	0.413	S	S	.	.			trans	-133.9	81.6	176.9	-67.3	-168.8	-166.1	172.6	0	108	Y216 A224 F225	K214-Y216 PolarHBondContact O-N 3.37Å; K214-Y216 VanDerWaalsContact O-N 3.08Å; K214-A224 HydrophobicContact CB-CB 3.35Å; K214-A224 HydrophobicContact CD-CB 4.09Å; K214-A224 WeakPolarHBondContact CD-O 3.46Å; K214-A224 HydrophobicContact CG-CB 4.36Å; K214-A224 WeakPolarHBondContact O-CB 3.49Å; K214-F225 CarbonylContact C-O 3.48Å
215	P	84	Confident	85	Confident	74 Å²	74	73.7 Å²	73.7	48%	0.481	40%	0.401	S	S	.	.			trans	-61.7	-24	-169	-24.5	34.4	0	0	0	113.7	I208 V217	I208-P215 HydrophobicContact CD1-CG 4.5Å; P215-V217 PolarHBondContact O-N 2.74Å
216	Y	88.4	Confident	85	Confident	91 Å²	91	72.1 Å²	72.1	36%	0.357	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	94	-174.6	-56.4	-73.9	0	0	0	110.6	K214 A224 F225 Y227 R228	K214-Y216 PolarHBondContact O-N 3.37Å; K214-Y216 VanDerWaalsContact O-N 3.08Å; Y216-A224 CarbonylContact O-C 3.28Å; Y216-A224 WeakPolarHBondContact O-CA 3.39Å; Y216-F225 WeakPolarHBondContact CB-O 3.39Å; Y216-F225 WeakPolarHBondContact CD2-O 3.22Å; Y216-F225 PolarHBondContact N-O 3.42Å; Y216-F225 PolarHBondContact O-N 3.22Å; Y216-Y227 VanDerWaalsContact CD2-C 3.46Å; Y216-R228 HydrophobicContact CD1-CB 3.95Å; Y216-R228 HydrophobicContact CD1-CG 4.33Å; Y216-R228 HydrophobicContact CD2-CB 4.5Å; Y216-R228 HydrophobicContact CE1-CB 3.72Å; Y216-R228 HydrophobicContact CE1-CG 4.24Å; Y216-R228 HydrophobicContact CE2-CB 4.27Å; Y216-R228 HydrophobicContact CG-CB 4.33Å
217	V	89.1	Confident	84.9	Confident	69 Å²	69	76 Å²	76	42%	0.418	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	132.8	-179.8	-173.2	0	0	0	0	110.7	P215 N219 A224	P215-V217 PolarHBondContact O-N 2.74Å; V217-N219 PolarHBondContact O-N 3.39Å; V217-A224 HydrophobicContact CG2-CB 3.95Å
218	C	88.6	Confident	84.8	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	42%	0.422	C	S	.	.			trans	-76.2	117.4	170.1	-178.8	0	0	0	0	110.1	Q220 C221 G222 K223 F225 L231 H238	C218-Q220 PolarHBondContact O-N 3.15Å; C218-C221 PolarHBondContact O-N 3.4Å; C218-G222 VanDerWaalsContact O-CA 3.26Å; C218-G222 WeakPolarHBondContact O-CA 3.39Å; C218-G222 PolarHBondContact O-N 3.09Å; C218-K223 WeakPolarHBondContact CB-O 3.33Å; C218-K223 PolarHBondContact N-O 3.4Å; C218-F225 HydrophobicContact CB-CE2 4.44Å; C218-L231 HydrophobicContact CB-CD1 3.56Å; C218-H238 VanDerWaalsContact SG-CD2 3.56Å; C218-H238 PolarHBondContact SG-NE2 2.78Å
219	N	87.7	Confident	84.6	Confident	154 Å²	154	81.8 Å²	81.8	82%	0.824	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-22.9	-178.5	-65.7	-29.9	0	0	0	113.4	V217	V217-N219 PolarHBondContact O-N 3.39Å
220	Q	81.6	Confident	84.6	Confident	137 Å²	137	80.7 Å²	80.7	64%	0.64	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-28.6	-177.2	-68.7	-178.6	-10.1	0	0	113.9	C218 H238	C218-Q220 PolarHBondContact O-N 3.15Å; Q220-H238 PolarHBondContact OE1-CD2 3.2Å; Q220-H238 VanDerWaalsContact OE1-CD2 3.3Å
221	C	85.8	Confident	84.7	Confident	55 Å²	55	78.9 Å²	78.9	37%	0.372	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133	2.5	-179.7	72.3	0	0	0	0	115.6	C218 K223 H234 H238	C218-C221 PolarHBondContact O-N 3.4Å; C221-K223 PolarHBondContact O-N 3.4Å; C221-K223 VanDerWaalsContact O-N 3.17Å; C221-K223 VanDerWaalsContact SG-CG 3.56Å; C221-H234 PolarHBondContact SG-NE2 2.8Å; C221-H238 PolarHBondContact SG-NE2 3.42Å
222	G	85.9	Confident	84.8	Confident	53 Å²	53	79.2 Å²	79.2	55%	0.546	42%	0.422	S	S	.	.			trans	71	2.4	-179.4	0	0	0	0	0	114.8	C218 A224	C218-G222 VanDerWaalsContact O-CA 3.26Å; C218-G222 WeakPolarHBondContact O-CA 3.39Å; C218-G222 PolarHBondContact O-N 3.09Å; G222-A224 PolarHBondContact O-N 2.8Å
223	K	85.5	Confident	84.8	Confident	127 Å²	127	78.3 Å²	78.3	55%	0.552	41%	0.41	S	S	*	.			trans	-68.5	127.4	177.6	-74.8	-179.8	-176.5	172.5	0	110.5	C218 C221 F225	C218-K223 WeakPolarHBondContact CB-O 3.33Å; C218-K223 PolarHBondContact N-O 3.4Å; C221-K223 PolarHBondContact O-N 3.4Å; C221-K223 VanDerWaalsContact O-N 3.17Å; C221-K223 VanDerWaalsContact SG-CG 3.56Å; K223-F225 HydrophobicContact CB-CE2 3.86Å; K223-F225 HydrophobicContact CB-CZ 3.99Å; K223-F225 VanDerWaalsContact O-CE2 3.3Å; K223-F225 WeakPolarHBondContact O-CE2 3.48Å
224	A	87.3	Confident	84.9	Confident	33 Å²	33	73.4 Å²	73.4	27%	0.273	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	145.6	179.7	0	0	0	0	0	111.9	K214 Y216 V217 G222	K214-A224 HydrophobicContact CB-CB 3.35Å; K214-A224 HydrophobicContact CD-CB 4.09Å; K214-A224 WeakPolarHBondContact CD-O 3.46Å; K214-A224 HydrophobicContact CG-CB 4.36Å; K214-A224 WeakPolarHBondContact O-CB 3.49Å; Y216-A224 CarbonylContact O-C 3.28Å; Y216-A224 WeakPolarHBondContact O-CA 3.39Å; V217-A224 HydrophobicContact CG2-CB 3.95Å; G222-A224 PolarHBondContact O-N 2.8Å
225	F	84.8	Confident	84.9	Confident	42 Å²	42	71.3 Å²	71.3	18%	0.184	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	148	-178.2	-57.5	-90.5	0	0	0	111.3	K214 Y216 C218 K223 Y227 N230 L231 H234	K214-F225 CarbonylContact C-O 3.48Å; Y216-F225 WeakPolarHBondContact CB-O 3.39Å; Y216-F225 WeakPolarHBondContact CD2-O 3.22Å; Y216-F225 PolarHBondContact N-O 3.42Å; Y216-F225 PolarHBondContact O-N 3.22Å; C218-F225 HydrophobicContact CB-CE2 4.44Å; K223-F225 HydrophobicContact CB-CE2 3.86Å; K223-F225 HydrophobicContact CB-CZ 3.99Å; K223-F225 VanDerWaalsContact O-CE2 3.3Å; K223-F225 WeakPolarHBondContact O-CE2 3.48Å; F225-Y227 VanDerWaalsContact C-N 3.34Å; F225-N230 HydrophobicContact CB-CB 4.18Å; F225-N230 HydrophobicContact CD1-CB 3.87Å; F225-N230 HydrophobicContact CG-CB 4.26Å; F225-L231 HydrophobicContact CB-CB 4.38Å; F225-L231 HydrophobicContact CD2-CB 3.89Å; F225-L231 HydrophobicContact CD2-CD1 3.83Å; F225-L231 HydrophobicContact CD2-CG 4.48Å; F225-L231 HydrophobicContact CE2-CD1 3.97Å; F225-L231 HydrophobicContact CG-CB 4.32Å; F225-H234 HydrophobicContact CE1-CB 3.99Å; F225-H234 HydrophobicContact CE2-CB 3.88Å; F225-H234 AromaticContact CE2-CD2 3.24Å; F225-H234 WeakPolarHBondContact CE2-CD2 3.38Å; F225-H234 AromaticContact CE2-CG 3.64Å; F225-H234 HydrophobicContact CZ-CB 3.44Å; F225-H234 VanDerWaalsContact CZ-CB 3.44Å; F225-H234 AromaticContact CZ-CD2 3.31Å; F225-H234 WeakPolarHBondContact CZ-CD2 3.34Å; F225-H234 AromaticContact CZ-CG 3.23Å; F225-H234 AromaticContact CZ-ND1 3.92Å; F225-H234 AromaticContact CZ-NE2 3.96Å
226	A	83.7	Confident	84.8	Confident	24 Å²	24	71 Å²	71	20%	0.198	37%	0.369	C	S	.	.	S	Bend	trans	-76.3	-21.5	174.9	0	0	0	0	0	113.1	I208	I208-A226 HydrophobicContact CG2-CB 3.9Å
227	Y	83.1	Confident	84.2	Confident	100 Å²	100	70.4 Å²	70.4	39%	0.392	38%	0.376	S	S	.	.	S	Bend	trans	-125.9	136.1	-176.8	-59	-100	0	0	0	110.4	I205 Y216 F225 S229 N230 L231	I205-Y227 HydrophobicContact CG2-CD1 3.82Å; I205-Y227 HydrophobicContact CG2-CE1 3.16Å; I205-Y227 HydrophobicContact CG2-CE2 4.38Å; I205-Y227 VanDerWaalsContact CG2-CZ 3.45Å; Y216-Y227 VanDerWaalsContact CD2-C 3.46Å; F225-Y227 VanDerWaalsContact C-N 3.34Å; Y227-S229 VanDerWaalsContact C-N 3.31Å; Y227-S229 PolarHBondContact O-N 3.17Å; Y227-N230 WeakPolarHBondContact O-CB 3.4Å; Y227-N230 PolarHBondContact O-N 3.36Å; Y227-N230 VanDerWaalsContact O-N 3.09Å; Y227-L231 PolarHBondContact O-N 3.15Å
228	R	84.8	Confident	83.8	Confident	159 Å²	159	70.6 Å²	70.6	60%	0.6	37%	0.372	S	S	*	.	H	α-helix	trans	-56.5	-42.7	175.1	-175.5	178.2	174.6	150.7	9	112.8	Y216 N230 L231 E232	Y216-R228 HydrophobicContact CD1-CB 3.95Å; Y216-R228 HydrophobicContact CD1-CG 4.33Å; Y216-R228 HydrophobicContact CD2-CB 4.5Å; Y216-R228 HydrophobicContact CE1-CB 3.72Å; Y216-R228 HydrophobicContact CE1-CG 4.24Å; Y216-R228 HydrophobicContact CE2-CB 4.27Å; Y216-R228 HydrophobicContact CG-CB 4.33Å; R228-N230 PolarHBondContact O-N 3.25Å; R228-L231 WeakPolarHBondContact O-CB 3.48Å; R228-L231 PolarHBondContact O-N 3.32Å; R228-L231 VanDerWaalsContact O-N 3.09Å; R228-E232 HydrophobicContact CG-CG 4.38Å; R228-E232 IonicContact CZ-OE1 3.37Å; R228-E232 IonicContact NE-OE1 3.03Å; R228-E232 PolarHBondContact NE-OE1 3.43Å; R228-E232 IonicContact NH2-OE1 3.19Å; R228-E232 WeakPolarHBondContact O-CG 3.41Å; R228-E232 PolarHBondContact O-N 3.36Å
229	S	81.8	Confident	83.4	Confident	70 Å²	70	74.5 Å²	74.5	49%	0.49	40%	0.396	S	S	.	.	H	α-helix	trans	-60.6	-31.2	178.3	53.9	0	0	0	0	113	Y227 A233	Y227-S229 VanDerWaalsContact C-N 3.31Å; Y227-S229 PolarHBondContact O-N 3.17Å; S229-A233 VanDerWaalsContact O-CB 3.29Å; S229-A233 WeakPolarHBondContact O-CB 3.43Å; S229-A233 PolarHBondContact O-N 3.06Å
230	N	83.9	Confident	82.6	Confident	79 Å²	79	69.5 Å²	69.5	42%	0.422	38%	0.381	S	S	.	.	H	α-helix	trans	-74.8	-37.1	176.4	-69.9	-4.2	0	0	0	111.3	F225 Y227 R228 H234	F225-N230 HydrophobicContact CB-CB 4.18Å; F225-N230 HydrophobicContact CD1-CB 3.87Å; F225-N230 HydrophobicContact CG-CB 4.26Å; Y227-N230 WeakPolarHBondContact O-CB 3.4Å; Y227-N230 PolarHBondContact O-N 3.36Å; Y227-N230 VanDerWaalsContact O-N 3.09Å; R228-N230 PolarHBondContact O-N 3.25Å; N230-H234 WeakPolarHBondContact O-CB 3.19Å; N230-H234 PolarHBondContact O-N 3.41Å
231	L	85.7	Confident	82.3	Confident	18 Å²	18	68.6 Å²	68.6	9%	0.094	38%	0.376	C	S	.	.	H	α-helix	trans	-62	-50.7	170.7	173	63.1	0	0	0	110.5	C218 F225 Y227 R228 A233 H234 E235	C218-L231 HydrophobicContact CB-CD1 3.56Å; F225-L231 HydrophobicContact CB-CB 4.38Å; F225-L231 HydrophobicContact CD2-CB 3.89Å; F225-L231 HydrophobicContact CD2-CD1 3.83Å; F225-L231 HydrophobicContact CD2-CG 4.48Å; F225-L231 HydrophobicContact CE2-CD1 3.97Å; F225-L231 HydrophobicContact CG-CB 4.32Å; Y227-L231 PolarHBondContact O-N 3.15Å; R228-L231 WeakPolarHBondContact O-CB 3.48Å; R228-L231 PolarHBondContact O-N 3.32Å; R228-L231 VanDerWaalsContact O-N 3.09Å; L231-A233 VanDerWaalsContact C-N 3.32Å; L231-A233 PolarHBondContact O-N 3.17Å; L231-H234 CarbonylContact O-C 3.56Å; L231-H234 WeakPolarHBondContact O-CA 3.27Å; L231-H234 WeakPolarHBondContact O-CB 3.39Å; L231-H234 PolarHBondContact O-N 3.25Å; L231-E235 HydrophobicContact CD1-CG 3.92Å; L231-E235 HydrophobicContact CG-CG 4.28Å; L231-E235 WeakPolarHBondContact O-CG 3.44Å; L231-E235 PolarHBondContact O-N 3.48Å
232	E	84.8	Confident	81.9	Confident	85 Å²	85	71.1 Å²	71.1	40%	0.397	38%	0.381	S	S	.	.	H	α-helix	trans	-59.6	-41.5	179.5	-70.9	171.6	-180	0	0	112	R228 H234 K236	R228-E232 HydrophobicContact CG-CG 4.38Å; R228-E232 IonicContact CZ-OE1 3.37Å; R228-E232 IonicContact NE-OE1 3.03Å; R228-E232 PolarHBondContact NE-OE1 3.43Å; R228-E232 IonicContact NH2-OE1 3.19Å; R228-E232 WeakPolarHBondContact O-CG 3.41Å; R228-E232 PolarHBondContact O-N 3.36Å; E232-H234 VanDerWaalsContact C-N 3.28Å; E232-H234 PolarHBondContact O-N 2.82Å; E232-K236 WeakPolarHBondContact O-CG 2.82Å; E232-K236 PolarHBondContact O-N 3.32Å
233	A	79.7	Confident	81.6	Confident	32 Å²	32	72.4 Å²	72.4	26%	0.264	38%	0.38	S	S	.	.	H	α-helix	trans	-66.8	-30.4	174.1	0	0	0	0	0	112.6	S229 L231	S229-A233 VanDerWaalsContact O-CB 3.29Å; S229-A233 WeakPolarHBondContact O-CB 3.43Å; S229-A233 PolarHBondContact O-N 3.06Å; L231-A233 VanDerWaalsContact C-N 3.32Å; L231-A233 PolarHBondContact O-N 3.17Å
234	H	82.2	Confident	81.5	Confident	22 Å²	22	70 Å²	70	10%	0.102	37%	0.368	C	S	.	.	H	α-helix	trans	-76.4	-39.7	175.8	168.1	59.8	0	0	0	112.6	C221 F225 N230 L231 E232 K236 T237 H238	C221-H234 PolarHBondContact SG-NE2 2.8Å; F225-H234 HydrophobicContact CE1-CB 3.99Å; F225-H234 HydrophobicContact CE2-CB 3.88Å; F225-H234 AromaticContact CE2-CD2 3.24Å; F225-H234 WeakPolarHBondContact CE2-CD2 3.38Å; F225-H234 AromaticContact CE2-CG 3.64Å; F225-H234 HydrophobicContact CZ-CB 3.44Å; F225-H234 VanDerWaalsContact CZ-CB 3.44Å; F225-H234 AromaticContact CZ-CD2 3.31Å; F225-H234 WeakPolarHBondContact CZ-CD2 3.34Å; F225-H234 AromaticContact CZ-CG 3.23Å; F225-H234 AromaticContact CZ-ND1 3.92Å; F225-H234 AromaticContact CZ-NE2 3.96Å; N230-H234 WeakPolarHBondContact O-CB 3.19Å; N230-H234 PolarHBondContact O-N 3.41Å; L231-H234 CarbonylContact O-C 3.56Å; L231-H234 WeakPolarHBondContact O-CA 3.27Å; L231-H234 WeakPolarHBondContact O-CB 3.39Å; L231-H234 PolarHBondContact O-N 3.25Å; E232-H234 VanDerWaalsContact C-N 3.28Å; E232-H234 PolarHBondContact O-N 2.82Å; H234-K236 PolarHBondContact O-N 3.12Å; H234-T237 PolarHBondContact ND1-OG1 2.78Å; H234-T237 WeakPolarHBondContact O-CA 3.46Å; H234-T237 VanDerWaalsContact O-CB 3.23Å; H234-T237 WeakPolarHBondContact O-CB 3.2Å; H234-T237 WeakPolarHBondContact O-CG2 3.5Å; H234-T237 PolarHBondContact O-N 3.34Å; H234-T237 PolarHBondContact O-OG1 2.7Å; H234-H238 AromaticContact CE1-NE2 3.55Å; H234-H238 AromaticContact NE2-NE2 3.29Å; H234-H238 PolarHBondContact NE2-NE2 3.29Å
235	E	83.5	Confident	81.3	Confident	73 Å²	73	73.6 Å²	73.6	34%	0.341	38%	0.379	S	S	.	.	H	α-helix	trans	-60.4	-33.5	178.2	-73.4	178	149	0	0	111.8	L231 T237 H238 T239	L231-E235 HydrophobicContact CD1-CG 3.92Å; L231-E235 HydrophobicContact CG-CG 4.28Å; L231-E235 WeakPolarHBondContact O-CG 3.44Å; L231-E235 PolarHBondContact O-N 3.48Å; E235-T237 PolarHBondContact O-N 3.18Å; E235-T237 VanDerWaalsContact O-N 3.12Å; E235-H238 WeakPolarHBondContact O-CB 3.43Å; E235-H238 PolarHBondContact O-N 2.82Å; E235-T239 PolarHBondContact O-N 2.56Å
236	K	82.5	Confident	81.4	Confident	67 Å²	67	71.6 Å²	71.6	29%	0.291	37%	0.37	S	S	.	.	H	α-helix	trans	-57.3	-24.8	169.8	-68.7	175.2	-175.9	-177.3	0	113.7	E232 H234 H238 T239 G240 E241 A254	E232-K236 WeakPolarHBondContact O-CG 2.82Å; E232-K236 PolarHBondContact O-N 3.32Å; H234-K236 PolarHBondContact O-N 3.12Å; K236-H238 VanDerWaalsContact C-N 3.3Å; K236-T239 PolarHBondContact O-OG1 3.42Å; K236-G240 PolarHBondContact O-N 3.31Å; K236-E241 PolarHBondContact O-N 2.91Å; K236-A254 HydrophobicContact CB-CB 4.49Å
237	T	76.9	Confident	81.5	Confident	79 Å²	79	77.7 Å²	77.7	49%	0.485	40%	0.4	S	S	.	.	H	α-helix	trans	-73.8	-22	175.3	72.2	0	0	0	0	113.1	H234 E235 A254	H234-T237 PolarHBondContact ND1-OG1 2.78Å; H234-T237 WeakPolarHBondContact O-CA 3.46Å; H234-T237 VanDerWaalsContact O-CB 3.23Å; H234-T237 WeakPolarHBondContact O-CB 3.2Å; H234-T237 WeakPolarHBondContact O-CG2 3.5Å; H234-T237 PolarHBondContact O-N 3.34Å; H234-T237 PolarHBondContact O-OG1 2.7Å; E235-T237 PolarHBondContact O-N 3.18Å; E235-T237 VanDerWaalsContact O-N 3.12Å; T237-A254 HydrophobicContact CG2-CB 4.12Å
238	H	79.6	Confident	81.4	Confident	73 Å²	73	79.4 Å²	79.4	34%	0.338	41%	0.411	S	S	.	.	H	α-helix	trans	-84.3	-40.3	175.3	-67.7	-58.8	0	0	0	112.9	C218 Q220 C221 H234 E235 K236 G240	C218-H238 VanDerWaalsContact SG-CD2 3.56Å; C218-H238 PolarHBondContact SG-NE2 2.78Å; Q220-H238 PolarHBondContact OE1-CD2 3.2Å; Q220-H238 VanDerWaalsContact OE1-CD2 3.3Å; C221-H238 PolarHBondContact SG-NE2 3.42Å; H234-H238 AromaticContact CE1-NE2 3.55Å; H234-H238 AromaticContact NE2-NE2 3.29Å; H234-H238 PolarHBondContact NE2-NE2 3.29Å; E235-H238 WeakPolarHBondContact O-CB 3.43Å; E235-H238 PolarHBondContact O-N 2.82Å; K236-H238 VanDerWaalsContact C-N 3.3Å; H238-G240 PolarHBondContact O-N 3.34Å
239	T	80.7	Confident	81.5	Confident	82 Å²	82	74.5 Å²	74.5	50%	0.503	40%	0.4	S	S	.	.	H	α-helix	trans	-68.9	-15.3	174.4	60	0	0	0	0	111.9	E235 K236 E241	E235-T239 PolarHBondContact O-N 2.56Å; K236-T239 PolarHBondContact O-OG1 3.42Å; T239-E241 PolarHBondContact O-N 2.94Å; T239-E241 WeakPolarHBondContact OG1-CB 3.5Å; T239-E241 WeakPolarHBondContact OG1-CG 3.44Å; T239-E241 PolarHBondContact OG1-N 3.46Å
240	G	71.6	Confident	81.5	Confident	49 Å²	49	72.9 Å²	72.9	51%	0.505	40%	0.395	S	S	.	.			trans	72.4	-0	-171.8	0	0	0	0	0	112.7	K236 H238 K242	K236-G240 PolarHBondContact O-N 3.31Å; H238-G240 PolarHBondContact O-N 3.34Å; G240-K242 PolarHBondContact O-N 2.94Å; G240-K242 VanDerWaalsContact O-N 3.08Å
241	E	73.7	Confident	81.5	Confident	118 Å²	118	73 Å²	73	55%	0.551	40%	0.396	S	S	*	.			trans	-64	113.1	176.8	-70.7	-178.6	-179.9	0	0	109.2	K236 T239 P243	K236-E241 PolarHBondContact O-N 2.91Å; T239-E241 PolarHBondContact O-N 2.94Å; T239-E241 WeakPolarHBondContact OG1-CB 3.5Å; T239-E241 WeakPolarHBondContact OG1-CG 3.44Å; T239-E241 PolarHBondContact OG1-N 3.46Å; E241-P243 VanDerWaalsContact C-CD 3.5Å; E241-P243 WeakPolarHBondContact O-CD 3.36Å
242	K	78.3	Confident	81.3	Confident	108 Å²	108	75 Å²	75	47%	0.47	41%	0.408	S	S	.	.			trans	-121.4	76	174.6	-69.4	174.3	175.6	-175.8	0	108	G240 Y244 V252 Y253	G240-K242 PolarHBondContact O-N 2.94Å; G240-K242 VanDerWaalsContact O-N 3.08Å; K242-Y244 PolarHBondContact O-N 3.03Å; K242-V252 HydrophobicContact CB-CB 3.53Å; K242-V252 HydrophobicContact CB-CG2 3.74Å; K242-V252 HydrophobicContact CD-CB 4.13Å; K242-V252 HydrophobicContact CD-CG2 3.52Å; K242-V252 WeakPolarHBondContact CD-O 3.31Å; K242-V252 HydrophobicContact CG-CG2 4.33Å; K242-V252 WeakPolarHBondContact O-CB 3.44Å; K242-Y253 CarbonylContact C-O 3.28Å; K242-Y253 VanDerWaalsContact C-O 3.28Å; K242-Y253 VanDerWaalsContact CA-O 3.29Å; K242-Y253 WeakPolarHBondContact CA-O 3.39Å
243	P	79	Confident	81.2	Confident	81 Å²	81	73.3 Å²	73.3	53%	0.526	40%	0.399	S	S	.	.			trans	-66.3	-13.3	-169	-20	33.3	0	0	0	113.9	E241	E241-P243 VanDerWaalsContact C-CD 3.5Å; E241-P243 WeakPolarHBondContact O-CD 3.36Å
244	Y	83.3	Confident	81.2	Confident	76 Å²	76	72.8 Å²	72.8	30%	0.298	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	90.4	-175.2	-56.2	-74.4	0	0	0	109.7	K242 V252 Y253 R256	K242-Y244 PolarHBondContact O-N 3.03Å; Y244-V252 CarbonylContact O-C 3.5Å; Y244-V252 WeakPolarHBondContact O-CA 3.49Å; Y244-Y253 WeakPolarHBondContact CB-O 3.36Å; Y244-Y253 WeakPolarHBondContact CD2-O 3.17Å; Y244-Y253 PolarHBondContact N-O 3.23Å; Y244-Y253 PolarHBondContact O-N 3.46Å; Y244-R256 HydrophobicContact CD1-CB 4.07Å; Y244-R256 HydrophobicContact CD1-CG 4.45Å; Y244-R256 HydrophobicContact CE1-CB 3.83Å; Y244-R256 HydrophobicContact CE1-CG 4.37Å; Y244-R256 HydrophobicContact CE2-CB 4.49Å
245	E	83.5	Confident	81.1	Confident	108 Å²	108	73.3 Å²	73.3	51%	0.505	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	139.5	175.1	-170.7	175.2	169.2	0	0	111.6	V252	E245-V252 HydrophobicContact CB-CG1 3.88Å; E245-V252 HydrophobicContact CG-CG1 3.91Å
246	C	86.9	Confident	81.1	Confident	1 Å²	1	78.8 Å²	78.8	1%	0.007	42%	0.418	C	S	.	.			trans	-83.5	113.1	167.4	-177.1	0	0	0	0	110.4	Q248 C249 G250 N251 Y253 L259 H262 H266	C246-Q248 PolarHBondContact O-N 2.82Å; C246-C249 PolarHBondContact O-N 3.48Å; C246-G250 WeakPolarHBondContact O-CA 2.85Å; C246-G250 PolarHBondContact O-N 2.79Å; C246-N251 WeakPolarHBondContact CB-O 3.11Å; C246-N251 PolarHBondContact N-O 3.08Å; C246-Y253 HydrophobicContact CB-CE2 4.44Å; C246-L259 HydrophobicContact CB-CD1 3.63Å; C246-H262 WeakPolarHBondContact CB-NE2 3.31Å; C246-H262 PolarHBondContact SG-NE2 3.22Å; C246-H262 VanDerWaalsContact SG-NE2 3.44Å; C246-H266 PolarHBondContact SG-CD2 3.26Å; C246-H266 PolarHBondContact SG-NE2 3.06Å; C246-H266 VanDerWaalsContact SG-NE2 3.44Å
247	N	85.5	Confident	81.1	Confident	152 Å²	152	78.9 Å²	78.9	81%	0.813	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-18.9	-180	-63.6	-21.5	0	0	0	114.6
248	Q	82.3	Confident	81.4	Confident	136 Å²	136	77.7 Å²	77.7	64%	0.636	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-21.6	-178.1	-64.1	-165.7	11.7	0	0	114.5	C246 H266	C246-Q248 PolarHBondContact O-N 2.82Å; Q248-H266 PolarHBondContact OE1-ND1 3.48Å
249	C	85.5	Confident	81.7	Confident	55 Å²	55	75 Å²	75	37%	0.372	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.9	1.4	-178.8	64.8	0	0	0	0	115.1	C246 N251 H262 H266	C246-C249 PolarHBondContact O-N 3.48Å; C249-N251 PolarHBondContact O-N 3.36Å; C249-N251 VanDerWaalsContact O-N 3.16Å; C249-N251 PolarHBondContact SG-ND2 3.41Å; C249-H262 VanDerWaalsContact SG-CE1 3.56Å; C249-H262 PolarHBondContact SG-NE2 2.76Å; C249-H266 PolarHBondContact SG-NE2 3.17Å
250	G	82.1	Confident	81.9	Confident	36 Å²	36	78.4 Å²	78.4	37%	0.371	41%	0.414	S	S	.	.			trans	70.2	3.8	-178.3	0	0	0	0	0	114.6	C246 V252	C246-G250 WeakPolarHBondContact O-CA 2.85Å; C246-G250 PolarHBondContact O-N 2.79Å; G250-V252 PolarHBondContact O-N 2.79Å
251	N	84.3	Confident	82.4	Confident	83 Å²	83	78.7 Å²	78.7	44%	0.444	40%	0.404	S	S	.	.			trans	-69.1	126.2	177.9	-77.8	-47.9	0	0	0	110.4	C246 C249 Y253	C246-N251 WeakPolarHBondContact CB-O 3.11Å; C246-N251 PolarHBondContact N-O 3.08Å; C249-N251 PolarHBondContact O-N 3.36Å; C249-N251 VanDerWaalsContact O-N 3.16Å; C249-N251 PolarHBondContact SG-ND2 3.41Å; N251-Y253 HydrophobicContact CB-CE2 3.9Å; N251-Y253 WeakPolarHBondContact O-CD2 3.4Å; N251-Y253 VanDerWaalsContact O-CE2 3.27Å; N251-Y253 WeakPolarHBondContact O-CE2 3.28Å
252	V	82.1	Confident	82.9	Confident	59 Å²	59	74.3 Å²	74.3	36%	0.358	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	143.9	-178.4	-71.6	0	0	0	0	112	K242 Y244 E245 G250	K242-V252 HydrophobicContact CB-CB 3.53Å; K242-V252 HydrophobicContact CB-CG2 3.74Å; K242-V252 HydrophobicContact CD-CB 4.13Å; K242-V252 HydrophobicContact CD-CG2 3.52Å; K242-V252 WeakPolarHBondContact CD-O 3.31Å; K242-V252 HydrophobicContact CG-CG2 4.33Å; K242-V252 WeakPolarHBondContact O-CB 3.44Å; Y244-V252 CarbonylContact O-C 3.5Å; Y244-V252 WeakPolarHBondContact O-CA 3.49Å; E245-V252 HydrophobicContact CB-CG1 3.88Å; E245-V252 HydrophobicContact CG-CG1 3.91Å; G250-V252 PolarHBondContact O-N 2.79Å
253	Y	81.1	Confident	83.1	Confident	50 Å²	50	72.9 Å²	72.9	20%	0.196	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	147	-178	-60.8	-85.3	0	0	0	112.4	K242 Y244 C246 N251 S255 L259 H262	K242-Y253 CarbonylContact C-O 3.28Å; K242-Y253 VanDerWaalsContact C-O 3.28Å; K242-Y253 VanDerWaalsContact CA-O 3.29Å; K242-Y253 WeakPolarHBondContact CA-O 3.39Å; Y244-Y253 WeakPolarHBondContact CB-O 3.36Å; Y244-Y253 WeakPolarHBondContact CD2-O 3.17Å; Y244-Y253 PolarHBondContact N-O 3.23Å; Y244-Y253 PolarHBondContact O-N 3.46Å; C246-Y253 HydrophobicContact CB-CE2 4.44Å; N251-Y253 HydrophobicContact CB-CE2 3.9Å; N251-Y253 WeakPolarHBondContact O-CD2 3.4Å; N251-Y253 VanDerWaalsContact O-CE2 3.27Å; N251-Y253 WeakPolarHBondContact O-CE2 3.28Å; Y253-S255 VanDerWaalsContact C-N 3.32Å; Y253-L259 HydrophobicContact CD2-CB 3.85Å; Y253-L259 HydrophobicContact CD2-CD1 3.71Å; Y253-L259 HydrophobicContact CD2-CG 4.39Å; Y253-L259 HydrophobicContact CE2-CD1 3.94Å; Y253-L259 HydrophobicContact CG-CB 4.21Å; Y253-H262 HydrophobicContact CE1-CB 4.01Å; Y253-H262 HydrophobicContact CE2-CB 3.85Å; Y253-H262 AromaticContact CE2-CD2 3.39Å; Y253-H262 WeakPolarHBondContact CE2-CD2 3.49Å; Y253-H262 AromaticContact CE2-CG 3.67Å; Y253-H262 AromaticContact CE2-NE2 4Å; Y253-H262 VanDerWaalsContact CZ-CB 3.45Å; Y253-H262 AromaticContact CZ-CD2 3.59Å; Y253-H262 AromaticContact CZ-CG 3.37Å; Y253-H262 AromaticContact CZ-ND1 3.87Å; Y253-H262 WeakPolarHBondContact OH-CB 3.11Å; Y253-H262 PolarHBondContact OH-CD2 2.79Å; Y253-H262 PolarHBondContact OH-CE1 3.15Å; Y253-H262 VanDerWaalsContact OH-CE1 3.23Å; Y253-H262 PolarHBondContact OH-ND1 3.46Å; Y253-H262 PolarHBondContact OH-NE2 3.29Å
254	A	80	Confident	83.3	Confident	21 Å²	21	71.3 Å²	71.3	17%	0.174	36%	0.363	C	S	.	.	S	Bend	trans	-75.5	-19	177.4	0	0	0	0	0	113.5	K236 T237	K236-A254 HydrophobicContact CB-CB 4.49Å; T237-A254 HydrophobicContact CG2-CB 4.12Å
255	S	80.2	Confident	83.1	Confident	32 Å²	32	74.8 Å²	74.8	22%	0.224	38%	0.382	C	S	.	.	S	Bend	trans	-136.1	147.3	-180	87.3	0	0	0	0	112.4	Y253 S257 S258 L259	Y253-S255 VanDerWaalsContact C-N 3.32Å; S255-S257 VanDerWaalsContact C-N 3.27Å; S255-S257 PolarHBondContact O-N 3.31Å; S255-S258 WeakPolarHBondContact O-CB 3.36Å; S255-S258 PolarHBondContact O-N 3.33Å; S255-S258 VanDerWaalsContact O-N 3.16Å; S255-S258 WeakPolarHBondContact OG-CB 3.44Å; S255-S258 PolarHBondContact OG-N 2.57Å; S255-S258 VanDerWaalsContact OG-N 3.14Å; S255-S258 PolarHBondContact OG-OG 3.15Å; S255-L259 PolarHBondContact O-N 3.32Å; S255-L259 VanDerWaalsContact O-N 3.16Å
256	R	84	Confident	82.9	Confident	188 Å²	188	72.3 Å²	72.3	71%	0.709	37%	0.37	S	S	*	.	H	α-helix	trans	-61	-35.4	176	-170.6	172.6	-175.8	159.9	2.3	112.6	Y244 S258 L259 R260	Y244-R256 HydrophobicContact CD1-CB 4.07Å; Y244-R256 HydrophobicContact CD1-CG 4.45Å; Y244-R256 HydrophobicContact CE1-CB 3.83Å; Y244-R256 HydrophobicContact CE1-CG 4.37Å; Y244-R256 HydrophobicContact CE2-CB 4.49Å; R256-S258 VanDerWaalsContact C-N 3.32Å; R256-S258 PolarHBondContact O-N 2.95Å; R256-L259 PolarHBondContact O-N 3.08Å; R256-R260 WeakPolarHBondContact O-CB 3.39Å; R256-R260 PolarHBondContact O-N 3.18Å
257	S	83	Confident	82.5	Confident	69 Å²	69	75.9 Å²	75.9	48%	0.483	39%	0.392	S	S	.	.	H	α-helix	trans	-65.4	-36.1	177.2	-55.9	0	0	0	0	112	S255 N261	S255-S257 VanDerWaalsContact C-N 3.27Å; S255-S257 PolarHBondContact O-N 3.31Å; S257-N261 WeakPolarHBondContact O-CB 3.38Å; S257-N261 VanDerWaalsContact O-CG 3.24Å; S257-N261 PolarHBondContact O-N 2.77Å; S257-N261 PolarHBondContact O-ND2 3.09Å
258	S	83.5	Confident	81.8	Confident	54 Å²	54	70.8 Å²	70.8	38%	0.378	38%	0.375	S	S	.	.	H	α-helix	trans	-67.6	-45.1	174.9	-58.9	0	0	0	0	111.7	S255 R256 N261 H262	S255-S258 WeakPolarHBondContact O-CB 3.36Å; S255-S258 PolarHBondContact O-N 3.33Å; S255-S258 VanDerWaalsContact O-N 3.16Å; S255-S258 WeakPolarHBondContact OG-CB 3.44Å; S255-S258 PolarHBondContact OG-N 2.57Å; S255-S258 VanDerWaalsContact OG-N 3.14Å; S255-S258 PolarHBondContact OG-OG 3.15Å; R256-S258 VanDerWaalsContact C-N 3.32Å; R256-S258 PolarHBondContact O-N 2.95Å; S258-N261 PolarHBondContact O-N 2.91Å; S258-H262 PolarHBondContact O-N 2.85Å
259	L	85.2	Confident	81.5	Confident	18 Å²	18	69.1 Å²	69.1	9%	0.094	37%	0.368	C	S	.	.	H	α-helix	trans	-58.1	-52	174.1	172.7	61.6	0	0	0	111	C246 Y253 S255 R256 N261 H262 E263	C246-L259 HydrophobicContact CB-CD1 3.63Å; Y253-L259 HydrophobicContact CD2-CB 3.85Å; Y253-L259 HydrophobicContact CD2-CD1 3.71Å; Y253-L259 HydrophobicContact CD2-CG 4.39Å; Y253-L259 HydrophobicContact CE2-CD1 3.94Å; Y253-L259 HydrophobicContact CG-CB 4.21Å; S255-L259 PolarHBondContact O-N 3.32Å; S255-L259 VanDerWaalsContact O-N 3.16Å; R256-L259 PolarHBondContact O-N 3.08Å; L259-N261 PolarHBondContact O-N 3.08Å; L259-H262 CarbonylContact O-C 3.49Å; L259-H262 WeakPolarHBondContact O-CA 3.35Å; L259-H262 VanDerWaalsContact O-CB 3.32Å; L259-H262 WeakPolarHBondContact O-CB 3.11Å; L259-H262 PolarHBondContact O-N 3.14Å; L259-E263 HydrophobicContact CD1-CG 3.98Å; L259-E263 HydrophobicContact CG-CG 4.26Å; L259-E263 WeakPolarHBondContact O-CG 3.27Å; L259-E263 PolarHBondContact O-N 3.38Å
260	R	85	Confident	81.2	Confident	152 Å²	152	72.9 Å²	72.9	57%	0.574	38%	0.378	S	S	*	.	H	α-helix	trans	-56.1	-40.1	178	-173.8	-179.6	68.9	-174.5	1.9	112.5	R256 H262 E263 K264	R256-R260 WeakPolarHBondContact O-CB 3.39Å; R256-R260 PolarHBondContact O-N 3.18Å; R260-H262 PolarHBondContact O-N 3.38Å; R260-E263 PolarHBondContact O-N 3.2Å; R260-K264 PolarHBondContact O-N 3.36Å
261	N	82	Confident	81.1	Confident	56 Å²	56	76.6 Å²	76.6	30%	0.299	39%	0.388	S	S	.	.	H	α-helix	trans	-71.3	-19.9	177.2	-79.1	-22.4	0	0	0	113.7	S257 S258 L259 R283	S257-N261 WeakPolarHBondContact O-CB 3.38Å; S257-N261 VanDerWaalsContact O-CG 3.24Å; S257-N261 PolarHBondContact O-N 2.77Å; S257-N261 PolarHBondContact O-ND2 3.09Å; S258-N261 PolarHBondContact O-N 2.91Å; L259-N261 PolarHBondContact O-N 3.08Å; N261-R283 PolarHBondContact O-NH2 3.34Å
262	H	84.1	Confident	81.3	Confident	26 Å²	26	76.5 Å²	76.5	12%	0.12	38%	0.382	C	S	.	.	H	α-helix	trans	-85.7	-40.6	172.3	161.6	75.3	0	0	0	111.6	C246 C249 Y253 S258 L259 R260 K264 H265 H266	C246-H262 WeakPolarHBondContact CB-NE2 3.31Å; C246-H262 PolarHBondContact SG-NE2 3.22Å; C246-H262 VanDerWaalsContact SG-NE2 3.44Å; C249-H262 VanDerWaalsContact SG-CE1 3.56Å; C249-H262 PolarHBondContact SG-NE2 2.76Å; Y253-H262 HydrophobicContact CE1-CB 4.01Å; Y253-H262 HydrophobicContact CE2-CB 3.85Å; Y253-H262 AromaticContact CE2-CD2 3.39Å; Y253-H262 WeakPolarHBondContact CE2-CD2 3.49Å; Y253-H262 AromaticContact CE2-CG 3.67Å; Y253-H262 AromaticContact CE2-NE2 4Å; Y253-H262 VanDerWaalsContact CZ-CB 3.45Å; Y253-H262 AromaticContact CZ-CD2 3.59Å; Y253-H262 AromaticContact CZ-CG 3.37Å; Y253-H262 AromaticContact CZ-ND1 3.87Å; Y253-H262 WeakPolarHBondContact OH-CB 3.11Å; Y253-H262 PolarHBondContact OH-CD2 2.79Å; Y253-H262 PolarHBondContact OH-CE1 3.15Å; Y253-H262 VanDerWaalsContact OH-CE1 3.23Å; Y253-H262 PolarHBondContact OH-ND1 3.46Å; Y253-H262 PolarHBondContact OH-NE2 3.29Å; S258-H262 PolarHBondContact O-N 2.85Å; L259-H262 CarbonylContact O-C 3.49Å; L259-H262 WeakPolarHBondContact O-CA 3.35Å; L259-H262 VanDerWaalsContact O-CB 3.32Å; L259-H262 WeakPolarHBondContact O-CB 3.11Å; L259-H262 PolarHBondContact O-N 3.14Å; R260-H262 PolarHBondContact O-N 3.38Å; H262-K264 PolarHBondContact O-N 3.23Å; H262-K264 VanDerWaalsContact O-N 3.12Å; H262-H265 WeakPolarHBondContact O-CA 3.39Å; H262-H265 WeakPolarHBondContact O-CB 3.29Å; H262-H265 PolarHBondContact O-N 2.88Å; H262-H266 AromaticContact CE1-CD2 3.95Å; H262-H266 AromaticContact CE1-NE2 3.51Å; H262-H266 AromaticContact NE2-CD2 3.6Å; H262-H266 AromaticContact NE2-NE2 3.24Å; H262-H266 PolarHBondContact NE2-NE2 3.12Å
263	E	83.6	Confident	81.5	Confident	78 Å²	78	75.5 Å²	75.5	36%	0.364	38%	0.384	S	S	.	.	H	α-helix	trans	-57	-29.3	176.4	-71.1	172.8	149.5	0	0	112.4	L259 R260 H265 H266 T267	L259-E263 HydrophobicContact CD1-CG 3.98Å; L259-E263 HydrophobicContact CG-CG 4.26Å; L259-E263 WeakPolarHBondContact O-CG 3.27Å; L259-E263 PolarHBondContact O-N 3.38Å; R260-E263 PolarHBondContact O-N 3.2Å; E263-H265 PolarHBondContact O-N 2.99Å; E263-H265 VanDerWaalsContact O-N 3.12Å; E263-H266 WeakPolarHBondContact O-CA 3.42Å; E263-H266 VanDerWaalsContact O-CB 3.29Å; E263-H266 WeakPolarHBondContact O-CB 3.3Å; E263-H266 PolarHBondContact O-N 3.13Å; E263-T267 PolarHBondContact O-N 2.98Å
264	K	82.6	Confident	82.1	Confident	47 Å²	47	73.2 Å²	73.2	20%	0.204	38%	0.375	C	S	.	.	H	α-helix	trans	-57.8	-23.2	170.1	-69.2	-177.2	176.4	-167.8	0	114.5	R260 H262 A282	R260-K264 PolarHBondContact O-N 3.36Å; H262-K264 PolarHBondContact O-N 3.23Å; H262-K264 VanDerWaalsContact O-N 3.12Å; K264-A282 HydrophobicContact CB-CB 4.38Å
265	H	78.2	Confident	82.5	Confident	149 Å²	149	79.8 Å²	79.8	69%	0.69	41%	0.407	S	S	*	.	H	α-helix	trans	-73	-37.3	172.7	-178.6	-86.7	0	0	0	111.3	H262 E263 G268	H262-H265 WeakPolarHBondContact O-CA 3.39Å; H262-H265 WeakPolarHBondContact O-CB 3.29Å; H262-H265 PolarHBondContact O-N 2.88Å; E263-H265 PolarHBondContact O-N 2.99Å; E263-H265 VanDerWaalsContact O-N 3.12Å; H265-G268 PolarHBondContact O-N 3.16Å
266	H	80.1	Confident	82.7	Confident	56 Å²	56	84.8 Å²	84.8	26%	0.259	43%	0.427	S	S	.	.	H	α-helix	trans	-71.2	-45.8	179.7	-80.7	-62.3	0	0	0	112.9	C246 Q248 C249 H262 E263 G268	C246-H266 PolarHBondContact SG-CD2 3.26Å; C246-H266 PolarHBondContact SG-NE2 3.06Å; C246-H266 VanDerWaalsContact SG-NE2 3.44Å; Q248-H266 PolarHBondContact OE1-ND1 3.48Å; C249-H266 PolarHBondContact SG-NE2 3.17Å; H262-H266 AromaticContact CE1-CD2 3.95Å; H262-H266 AromaticContact CE1-NE2 3.51Å; H262-H266 AromaticContact NE2-CD2 3.6Å; H262-H266 AromaticContact NE2-NE2 3.24Å; H262-H266 PolarHBondContact NE2-NE2 3.12Å; E263-H266 WeakPolarHBondContact O-CA 3.42Å; E263-H266 VanDerWaalsContact O-CB 3.29Å; E263-H266 WeakPolarHBondContact O-CB 3.3Å; E263-H266 PolarHBondContact O-N 3.13Å; H266-G268 PolarHBondContact O-N 2.91Å
267	T	78.6	Confident	83	Confident	76 Å²	76	78.5 Å²	78.5	47%	0.466	41%	0.411	S	S	.	.	S	Bend	trans	-67.6	-16.8	177.8	61.6	0	0	0	0	112.2	E263 E269	E263-T267 PolarHBondContact O-N 2.98Å; T267-E269 PolarHBondContact O-N 2.87Å; T267-E269 VanDerWaalsContact O-N 3.08Å; T267-E269 WeakPolarHBondContact OG1-CB 3.45Å; T267-E269 WeakPolarHBondContact OG1-CG 3.36Å; T267-E269 PolarHBondContact OG1-N 3.02Å
268	G	70.6	Confident	83.2	Confident	45 Å²	45	78.2 Å²	78.2	46%	0.464	42%	0.419	S	S	.	.			trans	63.3	9.8	-172.9	0	0	0	0	0	113.1	H265 H266 K270	H265-G268 PolarHBondContact O-N 3.16Å; H266-G268 PolarHBondContact O-N 2.91Å; G268-K270 VanDerWaalsContact C-N 3.32Å; G268-K270 PolarHBondContact O-N 3.43Å
269	E	75	Confident	83.5	Confident	102 Å²	102	81.5 Å²	81.5	48%	0.477	43%	0.427	S	S	.	.			trans	-65.9	90.5	-176.9	-78.1	179.2	173.7	0	0	110.4	T267 L271	T267-E269 PolarHBondContact O-N 2.87Å; T267-E269 VanDerWaalsContact O-N 3.08Å; T267-E269 WeakPolarHBondContact OG1-CB 3.45Å; T267-E269 WeakPolarHBondContact OG1-CG 3.36Å; T267-E269 PolarHBondContact OG1-N 3.02Å; E269-L271 VanDerWaalsContact C-N 3.29Å; E269-L271 HydrophobicContact CB-CD2 4.42Å; E269-L271 HydrophobicContact CB-CG 4.3Å; E269-L271 PolarHBondContact O-N 3.21Å; E269-L271 VanDerWaalsContact O-N 3.17Å
270	K	80	Confident	83.6	Confident	134 Å²	134	82.2 Å²	82.2	58%	0.583	44%	0.435	S	S	*	.			trans	-88	72.1	173.8	-72	167	170	-178.4	0	109	G268 Y272 A280 F281	G268-K270 VanDerWaalsContact C-N 3.32Å; G268-K270 PolarHBondContact O-N 3.43Å; K270-Y272 PolarHBondContact O-N 2.82Å; K270-A280 HydrophobicContact CB-CB 3.42Å; K270-A280 VanDerWaalsContact CB-CB 3.42Å; K270-A280 HydrophobicContact CD-CB 4.21Å; K270-A280 WeakPolarHBondContact CD-O 3.31Å; K270-A280 HydrophobicContact CG-CB 4.35Å; K270-A280 WeakPolarHBondContact CG-O 3.38Å; K270-A280 WeakPolarHBondContact O-CB 3.3Å; K270-F281 CarbonylContact C-O 3.56Å; K270-F281 WeakPolarHBondContact CA-O 3.24Å
271	L	80.9	Confident	83.7	Confident	114 Å²	114	77.2 Å²	77.2	60%	0.597	42%	0.418	S	S	*	.			trans	-66	-18.9	-176.2	-60.7	174.4	0	0	0	113.8	E269 F281	E269-L271 VanDerWaalsContact C-N 3.29Å; E269-L271 HydrophobicContact CB-CD2 4.42Å; E269-L271 HydrophobicContact CB-CG 4.3Å; E269-L271 PolarHBondContact O-N 3.21Å; E269-L271 VanDerWaalsContact O-N 3.17Å; L271-F281 PolarHBondContact N-O 3.12Å
272	Y	86.7	Confident	83.8	Confident	81 Å²	81	76 Å²	76	32%	0.318	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	94.3	-174.4	-56.4	-79.3	0	0	0	110.4	K270 A280 F281 R283 R284	K270-Y272 PolarHBondContact O-N 2.82Å; Y272-A280 CarbonylContact O-C 3.48Å; Y272-A280 WeakPolarHBondContact O-CA 3.31Å; Y272-F281 WeakPolarHBondContact CB-O 3.23Å; Y272-F281 WeakPolarHBondContact CD2-O 3.47Å; Y272-F281 PolarHBondContact N-O 3.44Å; Y272-F281 VanDerWaalsContact N-O 3.09Å; Y272-F281 PolarHBondContact O-N 3.28Å; Y272-R283 VanDerWaalsContact CD2-C 3.46Å; Y272-R284 HydrophobicContact CD1-CB 3.97Å; Y272-R284 HydrophobicContact CD1-CG 4.33Å; Y272-R284 HydrophobicContact CE1-CB 3.81Å; Y272-R284 HydrophobicContact CE1-CG 4.32Å; Y272-R284 HydrophobicContact CE2-CB 4.37Å; Y272-R284 HydrophobicContact CG-CB 4.33Å
273	G	88.1	Confident	83.8	Confident	37 Å²	37	80.2 Å²	80.2	38%	0.381	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	139.7	176.6	0	0	0	0	0	113.1	L287	G273-L287 WeakPolarHBondContact O-CD2 3.45Å
274	C	91.9	Very high	84.1	Confident	3 Å²	3	84.4 Å²	84.4	2%	0.02	44%	0.442	C	S	.	.			trans	-83.2	119.9	166.6	-179.6	0	0	0	0	109.8	Q276 G278 K279 L287 H294	C274-Q276 PolarHBondContact O-N 3.44Å; C274-G278 VanDerWaalsContact O-CA 3.28Å; C274-G278 WeakPolarHBondContact O-CA 3.26Å; C274-G278 PolarHBondContact O-N 3.44Å; C274-K279 WeakPolarHBondContact CB-O 3.39Å; C274-K279 PolarHBondContact N-O 3.24Å; C274-L287 HydrophobicContact CB-CD1 3.58Å; C274-H294 VanDerWaalsContact SG-CD2 3.6Å; C274-H294 PolarHBondContact SG-NE2 3.45Å; C274-H294 VanDerWaalsContact SG-NE2 3.42Å
275	N	88.4	Confident	84.3	Confident	158 Å²	158	85.1 Å²	85.1	85%	0.845	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.6	-178.6	-65.4	-25	0	0	0	113.4
276	Q	85.6	Confident	84.9	Confident	138 Å²	138	80.4 Å²	80.4	65%	0.645	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-27.4	-174.9	-63.7	-171.4	6.1	0	0	114.3	C274	C274-Q276 PolarHBondContact O-N 3.44Å
277	C	90.5	Very high	85.4	Confident	55 Å²	55	78.6 Å²	78.6	37%	0.372	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.6	3.7	179.9	71.5	0	0	0	0	115.1	K279 H290 H294	C277-K279 PolarHBondContact O-N 3.49Å; C277-K279 VanDerWaalsContact O-N 3.08Å; C277-K279 VanDerWaalsContact SG-CG 3.57Å; C277-H290 PolarHBondContact SG-NE2 3.05Å; C277-H294 PolarHBondContact SG-NE2 3.32Å
278	G	86.8	Confident	86	Confident	63 Å²	63	78.9 Å²	78.9	65%	0.649	43%	0.425	S	S	*	.			trans	70	-1.1	-179.8	0	0	0	0	0	114.9	C274 A280	C274-G278 VanDerWaalsContact O-CA 3.28Å; C274-G278 WeakPolarHBondContact O-CA 3.26Å; C274-G278 PolarHBondContact O-N 3.44Å; G278-A280 PolarHBondContact O-N 2.8Å
279	K	89.3	Confident	87	Confident	124 Å²	124	79.3 Å²	79.3	54%	0.539	42%	0.417	S	S	.	.			trans	-66.4	128.6	177.5	-73	-179.4	-176	173.3	0	110.1	C274 C277 F281	C274-K279 WeakPolarHBondContact CB-O 3.39Å; C274-K279 PolarHBondContact N-O 3.24Å; C277-K279 PolarHBondContact O-N 3.49Å; C277-K279 VanDerWaalsContact O-N 3.08Å; C277-K279 VanDerWaalsContact SG-CG 3.57Å; K279-F281 HydrophobicContact CB-CE2 3.91Å; K279-F281 HydrophobicContact CB-CZ 4.09Å; K279-F281 WeakPolarHBondContact O-CE2 3.45Å
280	A	87.6	Confident	87.9	Confident	33 Å²	33	75.3 Å²	75.3	27%	0.273	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	145.9	-179.4	0	0	0	0	0	112	K270 Y272 G278	K270-A280 HydrophobicContact CB-CB 3.42Å; K270-A280 VanDerWaalsContact CB-CB 3.42Å; K270-A280 HydrophobicContact CD-CB 4.21Å; K270-A280 WeakPolarHBondContact CD-O 3.31Å; K270-A280 HydrophobicContact CG-CB 4.35Å; K270-A280 WeakPolarHBondContact CG-O 3.38Å; K270-A280 WeakPolarHBondContact O-CB 3.3Å; Y272-A280 CarbonylContact O-C 3.48Å; Y272-A280 WeakPolarHBondContact O-CA 3.31Å; G278-A280 PolarHBondContact O-N 2.8Å
281	F	87.1	Confident	88.4	Confident	47 Å²	47	72.4 Å²	72.4	21%	0.206	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	147	-174.7	-59.2	-91.7	0	0	0	111.1	K270 L271 Y272 K279 R283 L287 H290	K270-F281 CarbonylContact C-O 3.56Å; K270-F281 WeakPolarHBondContact CA-O 3.24Å; L271-F281 PolarHBondContact N-O 3.12Å; Y272-F281 WeakPolarHBondContact CB-O 3.23Å; Y272-F281 WeakPolarHBondContact CD2-O 3.47Å; Y272-F281 PolarHBondContact N-O 3.44Å; Y272-F281 VanDerWaalsContact N-O 3.09Å; Y272-F281 PolarHBondContact O-N 3.28Å; K279-F281 HydrophobicContact CB-CE2 3.91Å; K279-F281 HydrophobicContact CB-CZ 4.09Å; K279-F281 WeakPolarHBondContact O-CE2 3.45Å; F281-R283 VanDerWaalsContact C-N 3.26Å; F281-R283 PolarHBondContact O-N 3.06Å; F281-L287 HydrophobicContact CB-CB 4.35Å; F281-L287 HydrophobicContact CD2-CB 3.9Å; F281-L287 HydrophobicContact CD2-CD1 3.81Å; F281-L287 HydrophobicContact CD2-CG 4.48Å; F281-L287 HydrophobicContact CE2-CD1 3.98Å; F281-L287 HydrophobicContact CG-CB 4.31Å; F281-H290 HydrophobicContact CE1-CB 3.95Å; F281-H290 HydrophobicContact CE2-CB 3.82Å; F281-H290 AromaticContact CE2-CD2 3.19Å; F281-H290 WeakPolarHBondContact CE2-CD2 3.45Å; F281-H290 AromaticContact CE2-CG 3.56Å; F281-H290 AromaticContact CE2-NE2 3.92Å; F281-H290 HydrophobicContact CZ-CB 3.4Å; F281-H290 AromaticContact CZ-CD2 3.33Å; F281-H290 WeakPolarHBondContact CZ-CD2 3.2Å; F281-H290 AromaticContact CZ-CG 3.2Å; F281-H290 AromaticContact CZ-ND1 3.85Å; F281-H290 AromaticContact CZ-NE2 3.96Å
282	A	85.1	Confident	89	Confident	29 Å²	29	69.5 Å²	69.5	24%	0.24	37%	0.367	C	S	.	.	S	Bend	trans	-73.4	-16	177.3	0	0	0	0	0	113.7	K264	K264-A282 HydrophobicContact CB-CB 4.38Å
283	R	84.1	Confident	89.2	Confident	115 Å²	115	70 Å²	70	43%	0.434	38%	0.379	S	S	.	.	S	Bend	trans	-136.2	138.5	-177.2	-60.4	-176.9	-174.2	170.9	4.3	110.7	N261 Y272 F281 S285 S286 L287	N261-R283 PolarHBondContact O-NH2 3.34Å; Y272-R283 VanDerWaalsContact CD2-C 3.46Å; F281-R283 VanDerWaalsContact C-N 3.26Å; F281-R283 PolarHBondContact O-N 3.06Å; R283-S285 VanDerWaalsContact C-N 3.35Å; R283-S285 PolarHBondContact O-N 2.86Å; R283-S286 WeakPolarHBondContact O-CB 3.46Å; R283-S286 PolarHBondContact O-N 3.46Å; R283-L287 PolarHBondContact O-N 3.28Å
284	R	88	Confident	89.3	Confident	166 Å²	166	71.5 Å²	71.5	63%	0.626	38%	0.376	S	S	*	.	H	α-helix	trans	-55.6	-45.6	176.5	-171.8	-178.8	178.8	152.7	9.2	112.7	Y272 S286 L287 E288	Y272-R284 HydrophobicContact CD1-CB 3.97Å; Y272-R284 HydrophobicContact CD1-CG 4.33Å; Y272-R284 HydrophobicContact CE1-CB 3.81Å; Y272-R284 HydrophobicContact CE1-CG 4.32Å; Y272-R284 HydrophobicContact CE2-CB 4.37Å; Y272-R284 HydrophobicContact CG-CB 4.33Å; R284-S286 PolarHBondContact O-N 2.86Å; R284-L287 WeakPolarHBondContact O-CA 3.34Å; R284-L287 WeakPolarHBondContact O-CB 3.37Å; R284-L287 PolarHBondContact O-N 3.18Å; R284-E288 WeakPolarHBondContact CG-OE1 3.44Å; R284-E288 IonicContact NE-OE1 3.93Å; R284-E288 PolarHBondContact NE-OE1 3.06Å; R284-E288 PolarHBondContact O-N 3.25Å
285	S	88.4	Confident	89.2	Confident	63 Å²	63	75.1 Å²	75.1	44%	0.441	40%	0.398	S	S	.	.	H	α-helix	trans	-58.8	-31.4	177.8	61.2	0	0	0	0	113.3	R283 I289	R283-S285 VanDerWaalsContact C-N 3.35Å; R283-S285 PolarHBondContact O-N 2.86Å; S285-I289 WeakPolarHBondContact O-CD1 3.47Å; S285-I289 VanDerWaalsContact O-CG1 3.22Å; S285-I289 WeakPolarHBondContact O-CG1 3.34Å; S285-I289 PolarHBondContact O-N 3.48Å; S285-I289 VanDerWaalsContact O-N 3.17Å
286	S	90.2	Very high	89.2	Confident	50 Å²	50	69.8 Å²	69.8	35%	0.35	38%	0.381	S	S	.	.	H	α-helix	trans	-74.2	-36.8	177.1	-59.9	0	0	0	0	111.6	R283 R284 H290	R283-S286 WeakPolarHBondContact O-CB 3.46Å; R283-S286 PolarHBondContact O-N 3.46Å; R284-S286 PolarHBondContact O-N 2.86Å; S286-H290 WeakPolarHBondContact O-CB 2.87Å; S286-H290 PolarHBondContact O-N 2.92Å
287	L	91.2	Very high	89.3	Confident	17 Å²	17	68.5 Å²	68.5	9%	0.089	38%	0.375	C	S	.	.	H	α-helix	trans	-63.1	-50.2	171.5	172.1	62.9	0	0	0	110.5	G273 C274 F281 R283 R284 I289 H290 E291	G273-L287 WeakPolarHBondContact O-CD2 3.45Å; C274-L287 HydrophobicContact CB-CD1 3.58Å; F281-L287 HydrophobicContact CB-CB 4.35Å; F281-L287 HydrophobicContact CD2-CB 3.9Å; F281-L287 HydrophobicContact CD2-CD1 3.81Å; F281-L287 HydrophobicContact CD2-CG 4.48Å; F281-L287 HydrophobicContact CE2-CD1 3.98Å; F281-L287 HydrophobicContact CG-CB 4.31Å; R283-L287 PolarHBondContact O-N 3.28Å; R284-L287 WeakPolarHBondContact O-CA 3.34Å; R284-L287 WeakPolarHBondContact O-CB 3.37Å; R284-L287 PolarHBondContact O-N 3.18Å; L287-I289 VanDerWaalsContact C-N 3.31Å; L287-I289 PolarHBondContact O-N 3.42Å; L287-H290 CarbonylContact O-C 3.51Å; L287-H290 VanDerWaalsContact O-CA 3.32Å; L287-H290 WeakPolarHBondContact O-CA 3.14Å; L287-H290 VanDerWaalsContact O-CB 3.3Å; L287-H290 WeakPolarHBondContact O-CB 3.34Å; L287-H290 PolarHBondContact O-N 3.12Å; L287-E291 HydrophobicContact CD1-CG 3.9Å; L287-E291 HydrophobicContact CG-CG 4.22Å; L287-E291 WeakPolarHBondContact O-CG 3.23Å; L287-E291 PolarHBondContact O-N 3.2Å
288	E	91.3	Very high	89.2	Confident	83 Å²	83	71.7 Å²	71.7	39%	0.388	38%	0.382	S	S	.	.	H	α-helix	trans	-57.3	-43.3	179.8	-71.2	167.4	-175.3	0	0	112.1	R284 H290 E291 R292	R284-E288 WeakPolarHBondContact CG-OE1 3.44Å; R284-E288 IonicContact NE-OE1 3.93Å; R284-E288 PolarHBondContact NE-OE1 3.06Å; R284-E288 PolarHBondContact O-N 3.25Å; E288-H290 VanDerWaalsContact C-N 3.26Å; E288-H290 PolarHBondContact O-N 3.38Å; E288-E291 PolarHBondContact O-N 3.36Å; E288-R292 PolarHBondContact O-N 3.2Å
289	I	91.8	Very high	89.3	Confident	54 Å²	54	72 Å²	72	28%	0.277	37%	0.373	S	S	.	.	H	α-helix	trans	-65.8	-32.6	175	-68.6	167.1	0	0	0	111.4	S285 L287 R311	S285-I289 WeakPolarHBondContact O-CD1 3.47Å; S285-I289 VanDerWaalsContact O-CG1 3.22Å; S285-I289 WeakPolarHBondContact O-CG1 3.34Å; S285-I289 PolarHBondContact O-N 3.48Å; S285-I289 VanDerWaalsContact O-N 3.17Å; L287-I289 VanDerWaalsContact C-N 3.31Å; L287-I289 PolarHBondContact O-N 3.42Å; I289-R311 HydrophobicContact CG2-CG 3.92Å
290	H	92.1	Very high	89.3	Confident	17 Å²	17	69.9 Å²	69.9	8%	0.079	36%	0.362	C	S	.	.	H	α-helix	trans	-73.8	-38.8	176.3	165.2	61.8	0	0	0	112.2	C277 F281 S286 L287 E288 R292 T293 H294	C277-H290 PolarHBondContact SG-NE2 3.05Å; F281-H290 HydrophobicContact CE1-CB 3.95Å; F281-H290 HydrophobicContact CE2-CB 3.82Å; F281-H290 AromaticContact CE2-CD2 3.19Å; F281-H290 WeakPolarHBondContact CE2-CD2 3.45Å; F281-H290 AromaticContact CE2-CG 3.56Å; F281-H290 AromaticContact CE2-NE2 3.92Å; F281-H290 HydrophobicContact CZ-CB 3.4Å; F281-H290 AromaticContact CZ-CD2 3.33Å; F281-H290 WeakPolarHBondContact CZ-CD2 3.2Å; F281-H290 AromaticContact CZ-CG 3.2Å; F281-H290 AromaticContact CZ-ND1 3.85Å; F281-H290 AromaticContact CZ-NE2 3.96Å; S286-H290 WeakPolarHBondContact O-CB 2.87Å; S286-H290 PolarHBondContact O-N 2.92Å; L287-H290 CarbonylContact O-C 3.51Å; L287-H290 VanDerWaalsContact O-CA 3.32Å; L287-H290 WeakPolarHBondContact O-CA 3.14Å; L287-H290 VanDerWaalsContact O-CB 3.3Å; L287-H290 WeakPolarHBondContact O-CB 3.34Å; L287-H290 PolarHBondContact O-N 3.12Å; E288-H290 VanDerWaalsContact C-N 3.26Å; E288-H290 PolarHBondContact O-N 3.38Å; H290-R292 PolarHBondContact O-N 3.13Å; H290-T293 PolarHBondContact ND1-OG1 3.32Å; H290-T293 WeakPolarHBondContact O-CA 3.34Å; H290-T293 VanDerWaalsContact O-CB 3.23Å; H290-T293 WeakPolarHBondContact O-CB 3.32Å; H290-T293 WeakPolarHBondContact O-CG2 3.36Å; H290-T293 PolarHBondContact O-N 3.2Å; H290-T293 PolarHBondContact O-OG1 3.31Å; H290-H294 AromaticContact CE1-NE2 3.53Å; H290-H294 AromaticContact NE2-NE2 3.36Å; H290-H294 PolarHBondContact NE2-NE2 3.42Å
291	E	91.6	Very high	89	Confident	73 Å²	73	71.5 Å²	71.5	34%	0.341	37%	0.368	S	S	.	.	H	α-helix	trans	-59.4	-29.9	178.4	-73	176.1	147.8	0	0	112.1	L287 E288 T293 H294 T295	L287-E291 HydrophobicContact CD1-CG 3.9Å; L287-E291 HydrophobicContact CG-CG 4.22Å; L287-E291 WeakPolarHBondContact O-CG 3.23Å; L287-E291 PolarHBondContact O-N 3.2Å; E288-E291 PolarHBondContact O-N 3.36Å; E291-T293 PolarHBondContact O-N 2.93Å; E291-T293 VanDerWaalsContact O-N 3.1Å; E291-H294 WeakPolarHBondContact O-CB 3.48Å; E291-H294 PolarHBondContact O-N 3.15Å; E291-T295 PolarHBondContact O-N 3.4Å; E291-T295 VanDerWaalsContact O-N 3.08Å
292	R	93	Very high	88.6	Confident	53 Å²	53	69.3 Å²	69.3	20%	0.2	36%	0.359	C	S	.	.	H	α-helix	trans	-58	-22	169.7	-63.7	-178.1	-172.9	151.2	9	114.3	E288 H290 H294 T295 G296 E297 A310	E288-R292 PolarHBondContact O-N 3.2Å; H290-R292 PolarHBondContact O-N 3.13Å; R292-H294 VanDerWaalsContact C-N 3.26Å; R292-T295 WeakPolarHBondContact CA-OG1 3.39Å; R292-G296 WeakPolarHBondContact O-CA 3.48Å; R292-G296 PolarHBondContact O-N 3.44Å; R292-E297 HydrophobicContact CB-CB 4.47Å; R292-E297 HydrophobicContact CG-CB 4.21Å; R292-E297 PolarHBondContact O-N 3.2Å; R292-A310 HydrophobicContact CB-CB 4.43Å; R292-A310 PolarHBondContact NH1-O 3.34Å
293	T	91	Very high	88.3	Confident	91 Å²	91	75.1 Å²	75.1	56%	0.558	39%	0.386	S	S	*	.	H	α-helix	trans	-72.5	-23.1	174.4	68.3	0	0	0	0	112.4	H290 E291	H290-T293 PolarHBondContact ND1-OG1 3.32Å; H290-T293 WeakPolarHBondContact O-CA 3.34Å; H290-T293 VanDerWaalsContact O-CB 3.23Å; H290-T293 WeakPolarHBondContact O-CB 3.32Å; H290-T293 WeakPolarHBondContact O-CG2 3.36Å; H290-T293 PolarHBondContact O-N 3.2Å; H290-T293 PolarHBondContact O-OG1 3.31Å; E291-T293 PolarHBondContact O-N 2.93Å; E291-T293 VanDerWaalsContact O-N 3.1Å
294	H	90.7	Very high	87.7	Confident	70 Å²	70	76.2 Å²	76.2	32%	0.324	40%	0.396	S	S	.	.	H	α-helix	trans	-90.8	-45.1	174.7	-61.7	-62.9	0	0	0	112.6	C274 C277 H290 E291 R292 G296	C274-H294 VanDerWaalsContact SG-CD2 3.6Å; C274-H294 PolarHBondContact SG-NE2 3.45Å; C274-H294 VanDerWaalsContact SG-NE2 3.42Å; C277-H294 PolarHBondContact SG-NE2 3.32Å; H290-H294 AromaticContact CE1-NE2 3.53Å; H290-H294 AromaticContact NE2-NE2 3.36Å; H290-H294 PolarHBondContact NE2-NE2 3.42Å; E291-H294 WeakPolarHBondContact O-CB 3.48Å; E291-H294 PolarHBondContact O-N 3.15Å; R292-H294 VanDerWaalsContact C-N 3.26Å; H294-G296 PolarHBondContact O-N 2.94Å
295	T	89.4	Confident	87.3	Confident	78 Å²	78	70.5 Å²	70.5	48%	0.479	38%	0.381	S	S	.	.	H	α-helix	trans	-72.3	-19.8	178.8	63.5	0	0	0	0	112.4	E291 R292 E297	E291-T295 PolarHBondContact O-N 3.4Å; E291-T295 VanDerWaalsContact O-N 3.08Å; R292-T295 WeakPolarHBondContact CA-OG1 3.39Å; T295-E297 PolarHBondContact O-N 3.46Å; T295-E297 WeakPolarHBondContact OG1-CB 3.46Å; T295-E297 VanDerWaalsContact OG1-CG 3.32Å; T295-E297 WeakPolarHBondContact OG1-CG 3.39Å; T295-E297 PolarHBondContact OG1-N 3.3Å
296	G	87.8	Confident	86.9	Confident	47 Å²	47	72.2 Å²	72.2	49%	0.485	39%	0.392	S	S	.	.			trans	72.6	6.9	-173.7	0	0	0	0	0	113.4	R292 H294 K298	R292-G296 WeakPolarHBondContact O-CA 3.48Å; R292-G296 PolarHBondContact O-N 3.44Å; H294-G296 PolarHBondContact O-N 2.94Å; G296-K298 WeakPolarHBondContact O-CG 3.44Å; G296-K298 PolarHBondContact O-N 3.25Å
297	E	88.5	Confident	86.5	Confident	111 Å²	111	75.8 Å²	75.8	52%	0.519	40%	0.401	S	S	.	.			trans	-59.7	131.8	-178.7	-80.1	178.8	-169.2	0	0	112.3	R292 T295	R292-E297 HydrophobicContact CB-CB 4.47Å; R292-E297 HydrophobicContact CG-CB 4.21Å; R292-E297 PolarHBondContact O-N 3.2Å; T295-E297 PolarHBondContact O-N 3.46Å; T295-E297 WeakPolarHBondContact OG1-CB 3.46Å; T295-E297 VanDerWaalsContact OG1-CG 3.32Å; T295-E297 WeakPolarHBondContact OG1-CG 3.39Å; T295-E297 PolarHBondContact OG1-N 3.3Å
298	K	89.1	Confident	86.1	Confident	121 Å²	121	76.7 Å²	76.7	53%	0.526	41%	0.411	S	S	.	.			trans	-131.8	75.6	180	-69.2	171.4	-176.2	-176.2	0	110.3	G296 Y300 A308 F309 A310	G296-K298 WeakPolarHBondContact O-CG 3.44Å; G296-K298 PolarHBondContact O-N 3.25Å; K298-Y300 PolarHBondContact O-N 2.93Å; K298-A308 HydrophobicContact CB-CB 3.5Å; K298-A308 HydrophobicContact CD-CB 4.2Å; K298-A308 WeakPolarHBondContact CD-O 3.37Å; K298-A308 HydrophobicContact CG-CB 4.49Å; K298-F309 CarbonylContact C-O 3.57Å; K298-F309 VanDerWaalsContact C-O 3.3Å; K298-F309 VanDerWaalsContact CA-O 3.31Å; K298-F309 WeakPolarHBondContact CA-O 3.45Å; K298-A310 HydrophobicContact CG-CB 4.49Å
299	P	88.1	Confident	86	Confident	71 Å²	71	74.8 Å²	74.8	46%	0.461	40%	0.401	S	S	.	.			trans	-67.4	-18.9	-172.9	-21.1	33.9	0	0	0	114.2
300	Y	90	Very high	86	Confident	78 Å²	78	73.6 Å²	73.6	31%	0.306	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	99.8	-174.2	-57.1	-79.4	0	0	0	110.1	K298 A308 F309 R311 R312	K298-Y300 PolarHBondContact O-N 2.93Å; Y300-A308 CarbonylContact O-C 3.53Å; Y300-A308 WeakPolarHBondContact O-CA 3.27Å; Y300-F309 WeakPolarHBondContact CB-O 3.47Å; Y300-F309 WeakPolarHBondContact CD2-O 3.47Å; Y300-F309 PolarHBondContact N-O 3.12Å; Y300-F309 VanDerWaalsContact N-O 3.17Å; Y300-F309 PolarHBondContact O-N 3.08Å; Y300-R311 VanDerWaalsContact CD2-C 3.46Å; Y300-R312 HydrophobicContact CD1-CB 3.86Å; Y300-R312 HydrophobicContact CD1-CG 4.19Å; Y300-R312 HydrophobicContact CE1-CB 3.67Å; Y300-R312 HydrophobicContact CE1-CG 4.17Å; Y300-R312 HydrophobicContact CE2-CB 4.43Å; Y300-R312 HydrophobicContact CG-CB 4.31Å
301	V	80.5	Confident	86.1	Confident	67 Å²	67	79 Å²	79	41%	0.406	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	134.4	-177.8	-174.5	0	0	0	0	110.2	A308	V301-A308 HydrophobicContact CG2-CB 4.07Å
302	C	79.3	Confident	86.2	Confident	1 Å²	1	84.6 Å²	84.6	1%	0.007	44%	0.438	C	S	.	.			trans	-76.7	122.4	169.8	-180	0	0	0	0	109.8	Q304 C306 K307 L315 H322	C302-Q304 VanDerWaalsContact C-N 3.25Å; C302-Q304 PolarHBondContact O-N 3.32Å; C302-C306 WeakPolarHBondContact O-CA 3.47Å; C302-C306 PolarHBondContact O-N 3.26Å; C302-K307 WeakPolarHBondContact CB-O 3.29Å; C302-K307 PolarHBondContact N-O 2.81Å; C302-L315 HydrophobicContact CB-CD1 3.55Å; C302-H322 PolarHBondContact SG-NE2 2.98Å; C302-H322 VanDerWaalsContact SG-NE2 3.4Å
303	N	79.1	Confident	86.1	Confident	152 Å²	152	85.2 Å²	85.2	81%	0.813	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-19.7	-178.7	-66.2	-21.7	0	0	0	113.7
304	Q	70.7	Confident	86.2	Confident	138 Å²	138	83.2 Å²	83.2	65%	0.645	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-30.6	-177.3	-62.9	-172.8	10	0	0	113.7	C302	C302-Q304 VanDerWaalsContact C-N 3.25Å; C302-Q304 PolarHBondContact O-N 3.32Å
305	C	80.5	Confident	86.2	Confident	46 Å²	46	80.7 Å²	80.7	31%	0.311	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.1	7.7	179.6	71.1	0	0	0	0	114.6	K307 H318 H322	C305-K307 PolarHBondContact O-N 3.25Å; C305-K307 VanDerWaalsContact SG-CG 3.56Å; C305-H318 PolarHBondContact SG-NE2 3.24Å; C305-H322 PolarHBondContact SG-NE2 3.37Å; C305-H322 VanDerWaalsContact SG-NE2 3.36Å
306	C	79.2	Confident	86.4	Confident	99 Å²	99	82.1 Å²	82.1	67%	0.669	43%	0.43	S	S	*	.			trans	58.9	12.9	179.5	-53.6	0	0	0	0	114.8	C302 A308	C302-C306 WeakPolarHBondContact O-CA 3.47Å; C302-C306 PolarHBondContact O-N 3.26Å; C306-A308 PolarHBondContact O-N 3.21Å
307	K	80.7	Confident	86.6	Confident	124 Å²	124	83.2 Å²	83.2	54%	0.539	42%	0.424	S	S	.	.			trans	-69.7	130	174.2	-73.7	-178.8	-173.6	172.8	0	110.4	C302 C305 F309	C302-K307 WeakPolarHBondContact CB-O 3.29Å; C302-K307 PolarHBondContact N-O 2.81Å; C305-K307 PolarHBondContact O-N 3.25Å; C305-K307 VanDerWaalsContact SG-CG 3.56Å; K307-F309 HydrophobicContact CB-CE2 3.88Å; K307-F309 HydrophobicContact CB-CZ 4.11Å; K307-F309 WeakPolarHBondContact O-CE2 3.28Å
308	A	83.2	Confident	86.7	Confident	36 Å²	36	79.1 Å²	79.1	30%	0.298	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	145.8	-179.8	0	0	0	0	0	112.1	K298 Y300 V301 C306	K298-A308 HydrophobicContact CB-CB 3.5Å; K298-A308 HydrophobicContact CD-CB 4.2Å; K298-A308 WeakPolarHBondContact CD-O 3.37Å; K298-A308 HydrophobicContact CG-CB 4.49Å; Y300-A308 CarbonylContact O-C 3.53Å; Y300-A308 WeakPolarHBondContact O-CA 3.27Å; V301-A308 HydrophobicContact CG2-CB 4.07Å; C306-A308 PolarHBondContact O-N 3.21Å
309	F	90.5	Very high	86.6	Confident	43 Å²	43	77.1 Å²	77.1	19%	0.189	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	147	179.9	-59.4	-91.5	0	0	0	111.4	K298 Y300 K307 R311 L315 H318	K298-F309 CarbonylContact C-O 3.57Å; K298-F309 VanDerWaalsContact C-O 3.3Å; K298-F309 VanDerWaalsContact CA-O 3.31Å; K298-F309 WeakPolarHBondContact CA-O 3.45Å; Y300-F309 WeakPolarHBondContact CB-O 3.47Å; Y300-F309 WeakPolarHBondContact CD2-O 3.47Å; Y300-F309 PolarHBondContact N-O 3.12Å; Y300-F309 VanDerWaalsContact N-O 3.17Å; Y300-F309 PolarHBondContact O-N 3.08Å; K307-F309 HydrophobicContact CB-CE2 3.88Å; K307-F309 HydrophobicContact CB-CZ 4.11Å; K307-F309 WeakPolarHBondContact O-CE2 3.28Å; F309-R311 VanDerWaalsContact C-N 3.28Å; F309-R311 PolarHBondContact O-N 3Å; F309-L315 HydrophobicContact CB-CB 4.32Å; F309-L315 HydrophobicContact CD2-CB 3.88Å; F309-L315 HydrophobicContact CD2-CD1 3.82Å; F309-L315 HydrophobicContact CD2-CG 4.47Å; F309-L315 HydrophobicContact CE2-CD1 3.98Å; F309-L315 HydrophobicContact CG-CB 4.25Å; F309-H318 HydrophobicContact CE1-CB 3.91Å; F309-H318 HydrophobicContact CE2-CB 3.87Å; F309-H318 AromaticContact CE2-CD2 3.21Å; F309-H318 WeakPolarHBondContact CE2-CD2 3.42Å; F309-H318 AromaticContact CE2-CG 3.6Å; F309-H318 AromaticContact CE2-NE2 3.94Å; F309-H318 HydrophobicContact CZ-CB 3.38Å; F309-H318 AromaticContact CZ-CD2 3.32Å; F309-H318 WeakPolarHBondContact CZ-CD2 3.43Å; F309-H318 AromaticContact CZ-CG 3.19Å; F309-H318 AromaticContact CZ-ND1 3.86Å; F309-H318 AromaticContact CZ-NE2 3.97Å
310	A	91.9	Very high	86.9	Confident	30 Å²	30	75.6 Å²	75.6	25%	0.248	38%	0.382	C	S	.	.	S	Bend	trans	-74.6	-18.6	177.5	0	0	0	0	0	113.3	R292 K298	R292-A310 HydrophobicContact CB-CB 4.43Å; R292-A310 PolarHBondContact NH1-O 3.34Å; K298-A310 HydrophobicContact CG-CB 4.49Å
311	R	93.1	Very high	86.8	Confident	130 Å²	130	75.7 Å²	75.7	49%	0.491	39%	0.394	S	S	.	.	S	Bend	trans	-134.7	140.8	-176.4	-60.9	-178.5	-176.9	-176	-1.9	110.9	I289 Y300 F309 S313 S314 L315	I289-R311 HydrophobicContact CG2-CG 3.92Å; Y300-R311 VanDerWaalsContact CD2-C 3.46Å; F309-R311 VanDerWaalsContact C-N 3.28Å; F309-R311 PolarHBondContact O-N 3Å; R311-S313 VanDerWaalsContact C-N 3.35Å; R311-S313 PolarHBondContact O-N 2.9Å; R311-S314 WeakPolarHBondContact O-CB 3.42Å; R311-S314 PolarHBondContact O-N 2.78Å; R311-L315 PolarHBondContact O-N 3.24Å
312	R	93	Very high	87	Confident	190 Å²	190	75.8 Å²	75.8	72%	0.717	39%	0.39	S	S	*	.	H	α-helix	trans	-60.2	-39.7	177.5	-170.1	174.2	-178.4	160.8	1.6	113.4	Y300 S314 L315 Q316	Y300-R312 HydrophobicContact CD1-CB 3.86Å; Y300-R312 HydrophobicContact CD1-CG 4.19Å; Y300-R312 HydrophobicContact CE1-CB 3.67Å; Y300-R312 HydrophobicContact CE1-CG 4.17Å; Y300-R312 HydrophobicContact CE2-CB 4.43Å; Y300-R312 HydrophobicContact CG-CB 4.31Å; R312-S314 VanDerWaalsContact C-N 3.27Å; R312-S314 PolarHBondContact O-N 2.94Å; R312-L315 WeakPolarHBondContact O-CB 3.49Å; R312-L315 PolarHBondContact O-N 3.09Å; R312-Q316 PolarHBondContact O-N 3.45Å
313	S	91.8	Very high	87.5	Confident	66 Å²	66	79.7 Å²	79.7	46%	0.462	41%	0.414	S	S	.	.	H	α-helix	trans	-63.1	-34.2	178	53.4	0	0	0	0	112.6	R311 Q316 I317	R311-S313 VanDerWaalsContact C-N 3.35Å; R311-S313 PolarHBondContact O-N 2.9Å; S313-Q316 PolarHBondContact O-N 3.24Å; S313-I317 WeakPolarHBondContact O-CD1 3.44Å; S313-I317 VanDerWaalsContact O-CG1 3.29Å; S313-I317 WeakPolarHBondContact O-CG1 3.35Å; S313-I317 PolarHBondContact O-N 3.16Å
314	S	93.7	Very high	88	Confident	49 Å²	49	74.8 Å²	74.8	34%	0.343	40%	0.399	S	S	.	.	H	α-helix	trans	-67.9	-40.7	174.5	-59.1	0	0	0	0	111.8	R311 R312 H318	R311-S314 WeakPolarHBondContact O-CB 3.42Å; R311-S314 PolarHBondContact O-N 2.78Å; R312-S314 VanDerWaalsContact C-N 3.27Å; R312-S314 PolarHBondContact O-N 2.94Å; S314-H318 VanDerWaalsContact O-CB 3.31Å; S314-H318 WeakPolarHBondContact O-CB 3.32Å; S314-H318 PolarHBondContact O-N 3.28Å
315	L	90.3	Very high	89	Confident	17 Å²	17	73.5 Å²	73.5	9%	0.089	39%	0.393	C	S	.	.	H	α-helix	trans	-60.9	-49	171.9	172.2	61.8	0	0	0	110.9	C302 F309 R311 R312 I317 H318 E319	C302-L315 HydrophobicContact CB-CD1 3.55Å; F309-L315 HydrophobicContact CB-CB 4.32Å; F309-L315 HydrophobicContact CD2-CB 3.88Å; F309-L315 HydrophobicContact CD2-CD1 3.82Å; F309-L315 HydrophobicContact CD2-CG 4.47Å; F309-L315 HydrophobicContact CE2-CD1 3.98Å; F309-L315 HydrophobicContact CG-CB 4.25Å; R311-L315 PolarHBondContact O-N 3.24Å; R312-L315 WeakPolarHBondContact O-CB 3.49Å; R312-L315 PolarHBondContact O-N 3.09Å; L315-I317 VanDerWaalsContact C-N 3.35Å; L315-I317 PolarHBondContact O-N 3.16Å; L315-H318 CarbonylContact O-C 3.4Å; L315-H318 WeakPolarHBondContact O-CA 3.46Å; L315-H318 WeakPolarHBondContact O-CB 3.45Å; L315-H318 PolarHBondContact O-N 3.43Å; L315-E319 HydrophobicContact CD1-CG 3.91Å; L315-E319 HydrophobicContact CG-CG 4.28Å; L315-E319 WeakPolarHBondContact O-CG 3.45Å; L315-E319 PolarHBondContact O-N 2.82Å
316	Q	93.4	Very high	89.6	Confident	109 Å²	109	77.4 Å²	77.4	51%	0.509	41%	0.405	S	S	.	.	H	α-helix	trans	-59.5	-42.7	-178.9	-173.3	-178.9	33.4	0	0	112.8	R312 S313 H318 E319 R320	R312-Q316 PolarHBondContact O-N 3.45Å; S313-Q316 PolarHBondContact O-N 3.24Å; Q316-H318 VanDerWaalsContact C-N 3.28Å; Q316-H318 PolarHBondContact O-N 3.36Å; Q316-E319 PolarHBondContact O-N 3.16Å; Q316-R320 PolarHBondContact O-N 2.81Å
317	I	92.4	Very high	90.2	Very high	70 Å²	70	76.4 Å²	76.4	36%	0.359	40%	0.397	S	S	.	.	H	α-helix	trans	-66.1	-35.9	175.1	-66.5	164.5	0	0	0	110.5	S313 L315 R320	S313-I317 WeakPolarHBondContact O-CD1 3.44Å; S313-I317 VanDerWaalsContact O-CG1 3.29Å; S313-I317 WeakPolarHBondContact O-CG1 3.35Å; S313-I317 PolarHBondContact O-N 3.16Å; L315-I317 VanDerWaalsContact C-N 3.35Å; L315-I317 PolarHBondContact O-N 3.16Å; I317-R320 WeakPolarHBondContact O-CB 3.41Å
318	H	89.4	Confident	90.9	Very high	25 Å²	25	74.3 Å²	74.3	12%	0.116	39%	0.386	C	S	.	.	H	α-helix	trans	-68.5	-39.5	176.1	165.5	61.7	0	0	0	112.7	C305 F309 S314 L315 Q316 R320 S321 H322	C305-H318 PolarHBondContact SG-NE2 3.24Å; F309-H318 HydrophobicContact CE1-CB 3.91Å; F309-H318 HydrophobicContact CE2-CB 3.87Å; F309-H318 AromaticContact CE2-CD2 3.21Å; F309-H318 WeakPolarHBondContact CE2-CD2 3.42Å; F309-H318 AromaticContact CE2-CG 3.6Å; F309-H318 AromaticContact CE2-NE2 3.94Å; F309-H318 HydrophobicContact CZ-CB 3.38Å; F309-H318 AromaticContact CZ-CD2 3.32Å; F309-H318 WeakPolarHBondContact CZ-CD2 3.43Å; F309-H318 AromaticContact CZ-CG 3.19Å; F309-H318 AromaticContact CZ-ND1 3.86Å; F309-H318 AromaticContact CZ-NE2 3.97Å; S314-H318 VanDerWaalsContact O-CB 3.31Å; S314-H318 WeakPolarHBondContact O-CB 3.32Å; S314-H318 PolarHBondContact O-N 3.28Å; L315-H318 CarbonylContact O-C 3.4Å; L315-H318 WeakPolarHBondContact O-CA 3.46Å; L315-H318 WeakPolarHBondContact O-CB 3.45Å; L315-H318 PolarHBondContact O-N 3.43Å; Q316-H318 VanDerWaalsContact C-N 3.28Å; Q316-H318 PolarHBondContact O-N 3.36Å; H318-R320 PolarHBondContact O-N 2.79Å; H318-S321 PolarHBondContact ND1-OG 3.19Å; H318-S321 WeakPolarHBondContact O-CA 3.43Å; H318-S321 WeakPolarHBondContact O-CB 3.47Å; H318-S321 PolarHBondContact O-N 2.94Å; H318-S321 PolarHBondContact O-OG 3.31Å; H318-H322 AromaticContact CE1-NE2 3.61Å; H318-H322 AromaticContact NE2-NE2 3.41Å; H318-H322 PolarHBondContact NE2-NE2 3.09Å
319	E	88.3	Confident	91.4	Very high	79 Å²	79	78 Å²	78	37%	0.369	40%	0.398	S	S	.	.	H	α-helix	trans	-59.7	-30.9	178.2	-73.6	171.8	152.7	0	0	112	L315 Q316 S321 H322 T323	L315-E319 HydrophobicContact CD1-CG 3.91Å; L315-E319 HydrophobicContact CG-CG 4.28Å; L315-E319 WeakPolarHBondContact O-CG 3.45Å; L315-E319 PolarHBondContact O-N 2.82Å; Q316-E319 PolarHBondContact O-N 3.16Å; E319-S321 PolarHBondContact O-N 3.4Å; E319-S321 VanDerWaalsContact O-N 3.16Å; E319-H322 WeakPolarHBondContact O-CB 3.46Å; E319-H322 PolarHBondContact O-N 2.99Å; E319-T323 PolarHBondContact O-N 3.12Å
320	R	93.5	Very high	91.4	Very high	39 Å²	39	76 Å²	76	15%	0.147	39%	0.389	C	S	.	.	H	α-helix	trans	-61.1	-21.1	170.9	-64.3	176	-175.4	158.9	1.7	114	Q316 I317 H318 H322 T323 G324 E325 A338	Q316-R320 PolarHBondContact O-N 2.81Å; I317-R320 WeakPolarHBondContact O-CB 3.41Å; H318-R320 PolarHBondContact O-N 2.79Å; R320-H322 PolarHBondContact O-N 3.22Å; R320-T323 WeakPolarHBondContact CA-OG1 3.29Å; R320-G324 CarbonylContact O-C 3.56Å; R320-G324 WeakPolarHBondContact O-CA 3.29Å; R320-G324 PolarHBondContact O-N 3.08Å; R320-E325 HydrophobicContact CB-CB 4.38Å; R320-E325 HydrophobicContact CG-CB 4.26Å; R320-E325 PolarHBondContact O-N 3.12Å; R320-A338 HydrophobicContact CB-CB 4.11Å; R320-A338 WeakPolarHBondContact CD-O 3.44Å; R320-A338 PolarHBondContact NH1-O 3.03Å
321	S	88.3	Confident	91.4	Very high	79 Å²	79	81.9 Å²	81.9	55%	0.552	42%	0.416	S	S	*	.	H	α-helix	trans	-72.5	-19.9	172.9	73.3	0	0	0	0	113.1	H318 E319	H318-S321 PolarHBondContact ND1-OG 3.19Å; H318-S321 WeakPolarHBondContact O-CA 3.43Å; H318-S321 WeakPolarHBondContact O-CB 3.47Å; H318-S321 PolarHBondContact O-N 2.94Å; H318-S321 PolarHBondContact O-OG 3.31Å; E319-S321 PolarHBondContact O-N 3.4Å; E319-S321 VanDerWaalsContact O-N 3.16Å
322	H	84.9	Confident	91	Very high	70 Å²	70	82.2 Å²	82.2	32%	0.324	42%	0.423	S	S	.	.	H	α-helix	trans	-86.7	-42.2	173.1	-63.9	-59.8	0	0	0	112.3	C302 C305 H318 E319 R320 G324	C302-H322 PolarHBondContact SG-NE2 2.98Å; C302-H322 VanDerWaalsContact SG-NE2 3.4Å; C305-H322 PolarHBondContact SG-NE2 3.37Å; C305-H322 VanDerWaalsContact SG-NE2 3.36Å; H318-H322 AromaticContact CE1-NE2 3.61Å; H318-H322 AromaticContact NE2-NE2 3.41Å; H318-H322 PolarHBondContact NE2-NE2 3.09Å; E319-H322 WeakPolarHBondContact O-CB 3.46Å; E319-H322 PolarHBondContact O-N 2.99Å; R320-H322 PolarHBondContact O-N 3.22Å; H322-G324 VanDerWaalsContact C-N 3.3Å
323	T	90.3	Very high	90.9	Very high	82 Å²	82	75.8 Å²	75.8	50%	0.503	41%	0.407	S	S	.	.	H	α-helix	trans	-77.1	-20	178.6	63	0	0	0	0	112.5	E319 R320 E325	E319-T323 PolarHBondContact O-N 3.12Å; R320-T323 WeakPolarHBondContact CA-OG1 3.29Å; T323-E325 PolarHBondContact O-N 3.46Å; T323-E325 WeakPolarHBondContact OG1-CB 3.41Å; T323-E325 WeakPolarHBondContact OG1-CG 3.48Å; T323-E325 PolarHBondContact OG1-N 3.23Å
324	G	88.8	Confident	90.8	Very high	49 Å²	49	74.6 Å²	74.6	51%	0.505	41%	0.405	S	S	.	.			trans	76.6	2.3	-172.7	0	0	0	0	0	113.7	R320 H322 K326	R320-G324 CarbonylContact O-C 3.56Å; R320-G324 WeakPolarHBondContact O-CA 3.29Å; R320-G324 PolarHBondContact O-N 3.08Å; H322-G324 VanDerWaalsContact C-N 3.3Å; G324-K326 PolarHBondContact O-N 3.24Å
325	E	91.8	Very high	90.8	Very high	112 Å²	112	78.1 Å²	78.1	52%	0.523	42%	0.415	S	S	.	.			trans	-59.9	128.1	-179.2	-77.1	179.3	-172.1	0	0	112	R320 T323	R320-E325 HydrophobicContact CB-CB 4.38Å; R320-E325 HydrophobicContact CG-CB 4.26Å; R320-E325 PolarHBondContact O-N 3.12Å; T323-E325 PolarHBondContact O-N 3.46Å; T323-E325 WeakPolarHBondContact OG1-CB 3.41Å; T323-E325 WeakPolarHBondContact OG1-CG 3.48Å; T323-E325 PolarHBondContact OG1-N 3.23Å
326	K	93.3	Very high	90.9	Very high	128 Å²	128	79 Å²	79	56%	0.557	42%	0.424	S	S	*	.			trans	-132	77	178.6	-71.2	167.1	174.5	-172.1	0	110.1	G324 Y328 A336 F337	G324-K326 PolarHBondContact O-N 3.24Å; K326-Y328 PolarHBondContact O-N 3.43Å; K326-A336 HydrophobicContact CB-CB 3.52Å; K326-A336 HydrophobicContact CD-CB 4.24Å; K326-A336 WeakPolarHBondContact CD-O 3.45Å; K326-A336 HydrophobicContact CG-CB 4.48Å; K326-A336 WeakPolarHBondContact O-CB 3.34Å; K326-F337 CarbonylContact C-O 3.4Å; K326-F337 WeakPolarHBondContact CA-O 3.39Å
327	P	92	Very high	90.9	Very high	78 Å²	78	75.9 Å²	75.9	51%	0.506	41%	0.409	S	S	.	.			trans	-70.1	-13.5	-172.4	-19.9	33.6	0	0	0	114.7
328	Y	94.8	Very high	90.9	Very high	79 Å²	79	74 Å²	74	31%	0.31	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	97.2	-174.6	-55.6	-76.8	0	0	0	110	K326 A336 F337 R340	K326-Y328 PolarHBondContact O-N 3.43Å; Y328-A336 CarbonylContact O-C 3.48Å; Y328-A336 WeakPolarHBondContact O-CA 3.42Å; Y328-F337 WeakPolarHBondContact CD2-O 3.27Å; Y328-F337 PolarHBondContact N-O 2.89Å; Y328-F337 PolarHBondContact O-N 3.49Å; Y328-R340 HydrophobicContact CD1-CB 4.08Å; Y328-R340 HydrophobicContact CD1-CG 4.49Å; Y328-R340 HydrophobicContact CE1-CB 3.91Å; Y328-R340 HydrophobicContact CE1-CG 4.49Å; Y328-R340 HydrophobicContact CG-CB 4.49Å
329	E	93	Very high	91	Very high	115 Å²	115	73.4 Å²	73.4	54%	0.537	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	138.8	179.4	-168.9	174.9	170	0	0	111.9	G334	E329-G334 WeakPolarHBondContact OE1-CA 3.48Å
330	C	92.4	Very high	91.3	Very high	1 Å²	1	77.6 Å²	77.6	1%	0.007	42%	0.415	C	S	.	.			trans	-81.8	115.4	170.5	-178.7	0	0	0	0	110.2	Q332 C333 G334 K335 F337 L343 H350	C330-Q332 PolarHBondContact O-N 3.45Å; C330-Q332 VanDerWaalsContact O-N 3.1Å; C330-C333 PolarHBondContact O-N 3.33Å; C330-G334 WeakPolarHBondContact O-CA 3.44Å; C330-G334 PolarHBondContact O-N 2.97Å; C330-K335 WeakPolarHBondContact CB-O 3.48Å; C330-K335 PolarHBondContact N-O 2.78Å; C330-F337 HydrophobicContact CB-CE2 4.46Å; C330-L343 HydrophobicContact CB-CD1 3.57Å; C330-H350 PolarHBondContact SG-NE2 2.88Å
331	N	90.8	Very high	91	Very high	152 Å²	152	79.9 Å²	79.9	81%	0.813	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.8	179.9	-63.9	-25.3	0	0	0	113.8
332	Q	85.9	Confident	91.1	Very high	138 Å²	138	78.8 Å²	78.8	65%	0.645	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-25.7	-176.8	-62.5	-171.8	10.4	0	0	114	C330	C330-Q332 PolarHBondContact O-N 3.45Å; C330-Q332 VanDerWaalsContact O-N 3.1Å
333	C	90.4	Very high	91.4	Very high	54 Å²	54	76.3 Å²	76.3	37%	0.365	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.3	4.4	-179.7	72.6	0	0	0	0	115.6	C330 K335 H346 H350	C330-C333 PolarHBondContact O-N 3.33Å; C333-K335 PolarHBondContact O-N 3.41Å; C333-K335 VanDerWaalsContact O-N 3.15Å; C333-K335 VanDerWaalsContact SG-CG 3.56Å; C333-H346 PolarHBondContact SG-NE2 3.03Å; C333-H350 PolarHBondContact SG-NE2 2.97Å
334	G	89.8	Confident	91.3	Very high	42 Å²	42	77 Å²	77	43%	0.433	41%	0.412	S	S	.	.			trans	69	5	-179.4	0	0	0	0	0	114.7	E329 C330 A336	E329-G334 WeakPolarHBondContact OE1-CA 3.48Å; C330-G334 WeakPolarHBondContact O-CA 3.44Å; C330-G334 PolarHBondContact O-N 2.97Å; G334-A336 PolarHBondContact O-N 2.85Å
335	K	92.1	Very high	91.2	Very high	123 Å²	123	77.8 Å²	77.8	54%	0.535	41%	0.405	S	S	.	.			trans	-71.2	125.1	178.1	-74.9	179.4	-175.9	168.7	0	110.2	C330 C333 F337	C330-K335 WeakPolarHBondContact CB-O 3.48Å; C330-K335 PolarHBondContact N-O 2.78Å; C333-K335 PolarHBondContact O-N 3.41Å; C333-K335 VanDerWaalsContact O-N 3.15Å; C333-K335 VanDerWaalsContact SG-CG 3.56Å; K335-F337 HydrophobicContact CB-CE2 3.85Å; K335-F337 HydrophobicContact CB-CZ 3.99Å; K335-F337 WeakPolarHBondContact O-CD2 3.42Å; K335-F337 VanDerWaalsContact O-CE2 3.23Å; K335-F337 WeakPolarHBondContact O-CE2 3.46Å
336	A	93.7	Very high	90.9	Very high	35 Å²	35	73.6 Å²	73.6	29%	0.289	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	145.3	178.5	0	0	0	0	0	112.9	K326 Y328 G334	K326-A336 HydrophobicContact CB-CB 3.52Å; K326-A336 HydrophobicContact CD-CB 4.24Å; K326-A336 WeakPolarHBondContact CD-O 3.45Å; K326-A336 HydrophobicContact CG-CB 4.48Å; K326-A336 WeakPolarHBondContact O-CB 3.34Å; Y328-A336 CarbonylContact O-C 3.48Å; Y328-A336 WeakPolarHBondContact O-CA 3.42Å; G334-A336 PolarHBondContact O-N 2.85Å
337	F	92.6	Very high	90.6	Very high	44 Å²	44	71 Å²	71	19%	0.193	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	150	-176.6	-59.2	-89.7	0	0	0	112	K326 Y328 C330 K335 S339 L343 H346	K326-F337 CarbonylContact C-O 3.4Å; K326-F337 WeakPolarHBondContact CA-O 3.39Å; Y328-F337 WeakPolarHBondContact CD2-O 3.27Å; Y328-F337 PolarHBondContact N-O 2.89Å; Y328-F337 PolarHBondContact O-N 3.49Å; C330-F337 HydrophobicContact CB-CE2 4.46Å; K335-F337 HydrophobicContact CB-CE2 3.85Å; K335-F337 HydrophobicContact CB-CZ 3.99Å; K335-F337 WeakPolarHBondContact O-CD2 3.42Å; K335-F337 VanDerWaalsContact O-CE2 3.23Å; K335-F337 WeakPolarHBondContact O-CE2 3.46Å; F337-S339 VanDerWaalsContact C-N 3.28Å; F337-S339 PolarHBondContact O-N 3.21Å; F337-L343 HydrophobicContact CB-CB 4.44Å; F337-L343 HydrophobicContact CD2-CB 3.96Å; F337-L343 HydrophobicContact CD2-CD1 3.88Å; F337-L343 HydrophobicContact CE2-CD1 4.03Å; F337-L343 HydrophobicContact CG-CB 4.39Å; F337-H346 HydrophobicContact CE1-CB 3.96Å; F337-H346 HydrophobicContact CE2-CB 3.85Å; F337-H346 AromaticContact CE2-CD2 3.26Å; F337-H346 WeakPolarHBondContact CE2-CD2 3.35Å; F337-H346 AromaticContact CE2-CG 3.6Å; F337-H346 AromaticContact CE2-NE2 3.99Å; F337-H346 HydrophobicContact CZ-CB 3.4Å; F337-H346 AromaticContact CZ-CD2 3.37Å; F337-H346 WeakPolarHBondContact CZ-CD2 3.48Å; F337-H346 AromaticContact CZ-CG 3.21Å; F337-H346 AromaticContact CZ-ND1 3.85Å
338	A	92.5	Very high	90.3	Very high	29 Å²	29	70.2 Å²	70.2	24%	0.24	36%	0.364	C	S	.	.	S	Bend	trans	-75.4	-14.8	176.7	0	0	0	0	0	113.4	R320	R320-A338 HydrophobicContact CB-CB 4.11Å; R320-A338 WeakPolarHBondContact CD-O 3.44Å; R320-A338 PolarHBondContact NH1-O 3.03Å
339	S	93	Very high	89.6	Confident	13 Å²	13	71.6 Å²	71.6	9%	0.091	37%	0.373	C	S	.	.	S	Bend	trans	-140.5	147.8	-179.3	90.2	0	0	0	0	112.4	F337 T341 S342 L343	F337-S339 VanDerWaalsContact C-N 3.28Å; F337-S339 PolarHBondContact O-N 3.21Å; S339-T341 VanDerWaalsContact C-N 3.32Å; S339-T341 PolarHBondContact O-N 3.1Å; S339-S342 WeakPolarHBondContact O-CB 3.47Å; S339-S342 PolarHBondContact O-N 3.41Å; S339-S342 WeakPolarHBondContact OG-CB 3.2Å; S339-S342 PolarHBondContact OG-N 3.33Å; S339-S342 VanDerWaalsContact OG-N 3.13Å; S339-S342 PolarHBondContact OG-OG 2.76Å; S339-L343 PolarHBondContact O-N 3.43Å
340	R	92.7	Very high	89.1	Confident	168 Å²	168	69.2 Å²	69.2	63%	0.634	36%	0.361	S	S	*	.	H	α-helix	trans	-61.5	-39.2	177.1	-170.7	176.3	-164.4	171.1	5.7	112.5	Y328 S342 L343 Q344	Y328-R340 HydrophobicContact CD1-CB 4.08Å; Y328-R340 HydrophobicContact CD1-CG 4.49Å; Y328-R340 HydrophobicContact CE1-CB 3.91Å; Y328-R340 HydrophobicContact CE1-CG 4.49Å; Y328-R340 HydrophobicContact CG-CB 4.49Å; R340-S342 VanDerWaalsContact C-N 3.29Å; R340-S342 PolarHBondContact O-N 3.48Å; R340-L343 WeakPolarHBondContact O-CB 3.04Å; R340-L343 PolarHBondContact O-N 2.68Å; R340-Q344 WeakPolarHBondContact O-CG 3.35Å; R340-Q344 PolarHBondContact O-N 3.27Å
341	T	89.1	Confident	88.6	Confident	87 Å²	87	72.8 Å²	72.8	53%	0.534	38%	0.383	S	S	.	.	H	α-helix	trans	-64.8	-35.2	178.4	-51.4	0	0	0	0	111.7	S339 N345	S339-T341 VanDerWaalsContact C-N 3.32Å; S339-T341 PolarHBondContact O-N 3.1Å; T341-N345 WeakPolarHBondContact O-CB 3.31Å; T341-N345 PolarHBondContact O-N 3.4Å; T341-N345 PolarHBondContact O-ND2 2.81Å
342	S	90.2	Very high	87.8	Confident	56 Å²	56	67.7 Å²	67.7	39%	0.392	37%	0.366	S	S	.	.	H	α-helix	trans	-66	-41.3	173.6	-58.3	0	0	0	0	111.9	S339 R340 H346	S339-S342 WeakPolarHBondContact O-CB 3.47Å; S339-S342 PolarHBondContact O-N 3.41Å; S339-S342 WeakPolarHBondContact OG-CB 3.2Å; S339-S342 PolarHBondContact OG-N 3.33Å; S339-S342 VanDerWaalsContact OG-N 3.13Å; S339-S342 PolarHBondContact OG-OG 2.76Å; R340-S342 VanDerWaalsContact C-N 3.29Å; R340-S342 PolarHBondContact O-N 3.48Å; S342-H346 WeakPolarHBondContact O-CB 3.43Å; S342-H346 PolarHBondContact O-N 3.27Å
343	L	91.5	Very high	87.3	Confident	18 Å²	18	66.8 Å²	66.8	9%	0.094	36%	0.362	C	S	.	.	H	α-helix	trans	-61.5	-49.9	173.6	172.5	62.2	0	0	0	111.2	C330 F337 S339 R340 N345 H346 E347	C330-L343 HydrophobicContact CB-CD1 3.57Å; F337-L343 HydrophobicContact CB-CB 4.44Å; F337-L343 HydrophobicContact CD2-CB 3.96Å; F337-L343 HydrophobicContact CD2-CD1 3.88Å; F337-L343 HydrophobicContact CE2-CD1 4.03Å; F337-L343 HydrophobicContact CG-CB 4.39Å; S339-L343 PolarHBondContact O-N 3.43Å; R340-L343 WeakPolarHBondContact O-CB 3.04Å; R340-L343 PolarHBondContact O-N 2.68Å; L343-N345 VanDerWaalsContact C-N 3.32Å; L343-N345 PolarHBondContact O-N 2.93Å; L343-H346 CarbonylContact O-C 3.37Å; L343-H346 WeakPolarHBondContact O-CA 3.45Å; L343-H346 VanDerWaalsContact O-CB 3.32Å; L343-H346 WeakPolarHBondContact O-CB 3.26Å; L343-H346 PolarHBondContact O-N 3.16Å; L343-E347 HydrophobicContact CD1-CG 3.97Å; L343-E347 HydrophobicContact CG-CG 4.31Å; L343-E347 WeakPolarHBondContact O-CG 3.41Å; L343-E347 PolarHBondContact O-N 2.59Å
344	Q	88.2	Confident	86.8	Confident	95 Å²	95	69.7 Å²	69.7	44%	0.444	37%	0.369	S	S	.	.	H	α-helix	trans	-58.7	-41.8	179.5	-73.1	176.5	-42	0	0	112.8	R340 H346 E347 K348	R340-Q344 WeakPolarHBondContact O-CG 3.35Å; R340-Q344 PolarHBondContact O-N 3.27Å; Q344-H346 VanDerWaalsContact C-N 3.27Å; Q344-H346 PolarHBondContact O-N 3.4Å; Q344-E347 PolarHBondContact O-N 3.47Å; Q344-K348 PolarHBondContact O-N 3.22Å
345	N	84.8	Confident	86.3	Confident	67 Å²	67	71.6 Å²	71.6	36%	0.358	37%	0.373	S	S	.	.	H	α-helix	trans	-67.2	-31.9	175.4	-75	-21.4	0	0	0	112.1	T341 L343 L367	T341-N345 WeakPolarHBondContact O-CB 3.31Å; T341-N345 PolarHBondContact O-N 3.4Å; T341-N345 PolarHBondContact O-ND2 2.81Å; L343-N345 VanDerWaalsContact C-N 3.32Å; L343-N345 PolarHBondContact O-N 2.93Å; N345-L367 HydrophobicContact CB-CD2 4.11Å
346	H	87.3	Confident	85.8	Confident	24 Å²	24	69.3 Å²	69.3	11%	0.111	36%	0.362	C	S	.	.	H	α-helix	trans	-71.7	-39.1	174.3	165.8	61.8	0	0	0	112.3	C333 F337 S342 L343 Q344 K348 H349 H350	C333-H346 PolarHBondContact SG-NE2 3.03Å; F337-H346 HydrophobicContact CE1-CB 3.96Å; F337-H346 HydrophobicContact CE2-CB 3.85Å; F337-H346 AromaticContact CE2-CD2 3.26Å; F337-H346 WeakPolarHBondContact CE2-CD2 3.35Å; F337-H346 AromaticContact CE2-CG 3.6Å; F337-H346 AromaticContact CE2-NE2 3.99Å; F337-H346 HydrophobicContact CZ-CB 3.4Å; F337-H346 AromaticContact CZ-CD2 3.37Å; F337-H346 WeakPolarHBondContact CZ-CD2 3.48Å; F337-H346 AromaticContact CZ-CG 3.21Å; F337-H346 AromaticContact CZ-ND1 3.85Å; S342-H346 WeakPolarHBondContact O-CB 3.43Å; S342-H346 PolarHBondContact O-N 3.27Å; L343-H346 CarbonylContact O-C 3.37Å; L343-H346 WeakPolarHBondContact O-CA 3.45Å; L343-H346 VanDerWaalsContact O-CB 3.32Å; L343-H346 WeakPolarHBondContact O-CB 3.26Å; L343-H346 PolarHBondContact O-N 3.16Å; Q344-H346 VanDerWaalsContact C-N 3.27Å; Q344-H346 PolarHBondContact O-N 3.4Å; H346-K348 PolarHBondContact O-N 3.5Å; H346-H349 WeakPolarHBondContact O-CB 3.46Å; H346-H349 PolarHBondContact O-N 3.43Å; H346-H350 AromaticContact CE1-NE2 3.47Å; H346-H350 PolarHBondContact CE1-NE2 3.12Å; H346-H350 AromaticContact NE2-CD2 3.9Å; H346-H350 AromaticContact NE2-NE2 3.27Å; H346-H350 PolarHBondContact NE2-NE2 2.75Å
347	E	86.8	Confident	85.5	Confident	74 Å²	74	69.4 Å²	69.4	35%	0.346	37%	0.366	S	S	.	.	H	α-helix	trans	-61.6	-30.3	178.7	-73	172.6	151	0	0	112.6	L343 Q344 H349 H350 T351	L343-E347 HydrophobicContact CD1-CG 3.97Å; L343-E347 HydrophobicContact CG-CG 4.31Å; L343-E347 WeakPolarHBondContact O-CG 3.41Å; L343-E347 PolarHBondContact O-N 2.59Å; Q344-E347 PolarHBondContact O-N 3.47Å; E347-H349 PolarHBondContact O-N 3.45Å; E347-H350 WeakPolarHBondContact O-CB 3.48Å; E347-H350 PolarHBondContact O-N 3.27Å; E347-T351 PolarHBondContact O-N 3.29Å
348	K	84.4	Confident	85.2	Confident	61 Å²	61	68 Å²	68	27%	0.265	36%	0.362	S	S	.	.	H	α-helix	trans	-59.2	-28	171.6	-66.1	-179.5	-179.2	-175.4	0	113.5	Q344 H346 H350 T351 G352	Q344-K348 PolarHBondContact O-N 3.22Å; H346-K348 PolarHBondContact O-N 3.5Å; K348-H350 VanDerWaalsContact C-N 3.26Å; K348-H350 PolarHBondContact O-N 2.74Å; K348-T351 PolarHBondContact O-OG1 2.9Å; K348-T351 VanDerWaalsContact O-OG1 3.11Å; K348-G352 PolarHBondContact O-N 3.45Å
349	H	80.7	Confident	84.9	Confident	108 Å²	108	74.1 Å²	74.1	50%	0.5	39%	0.39	S	S	.	.	H	α-helix	trans	-67	-32.5	175.1	-175.7	59.4	0	0	0	111.7	H346 E347 E366	H346-H349 WeakPolarHBondContact O-CB 3.46Å; H346-H349 PolarHBondContact O-N 3.43Å; E347-H349 PolarHBondContact O-N 3.45Å; H349-E366 IonicContact CE1-OE1 3.99Å; H349-E366 IonicContact CG-OE2 4Å; H349-E366 IonicContact ND1-OE1 3.13Å; H349-E366 PolarHBondContact ND1-OE1 3.02Å; H349-E366 VanDerWaalsContact ND1-OE1 3.13Å; H349-E366 IonicContact ND1-OE2 3.51Å
350	H	82.6	Confident	84.3	Confident	64 Å²	64	80 Å²	80	30%	0.296	42%	0.416	S	S	.	.	H	α-helix	trans	-76	-38.5	178.3	-70.3	-59.7	0	0	0	113	C330 C333 H346 E347 K348 G352	C330-H350 PolarHBondContact SG-NE2 2.88Å; C333-H350 PolarHBondContact SG-NE2 2.97Å; H346-H350 AromaticContact CE1-NE2 3.47Å; H346-H350 PolarHBondContact CE1-NE2 3.12Å; H346-H350 AromaticContact NE2-CD2 3.9Å; H346-H350 AromaticContact NE2-NE2 3.27Å; H346-H350 PolarHBondContact NE2-NE2 2.75Å; E347-H350 WeakPolarHBondContact O-CB 3.48Å; E347-H350 PolarHBondContact O-N 3.27Å; K348-H350 VanDerWaalsContact C-N 3.26Å; K348-H350 PolarHBondContact O-N 2.74Å; H350-G352 PolarHBondContact O-N 3.38Å
351	T	82	Confident	84.1	Confident	77 Å²	77	73.8 Å²	73.8	47%	0.472	40%	0.399	S	S	.	.	H	α-helix	trans	-69.1	-20.2	175.9	63.3	0	0	0	0	111.6	E347 K348 E353	E347-T351 PolarHBondContact O-N 3.29Å; K348-T351 PolarHBondContact O-OG1 2.9Å; K348-T351 VanDerWaalsContact O-OG1 3.11Å; T351-E353 PolarHBondContact O-N 3.01Å; T351-E353 VanDerWaalsContact O-N 3.09Å; T351-E353 WeakPolarHBondContact OG1-CB 3.42Å; T351-E353 PolarHBondContact OG1-N 3.37Å
352	G	73.2	Confident	83.8	Confident	44 Å²	44	78 Å²	78	45%	0.454	42%	0.418	S	S	.	.			trans	65.3	6.4	-174	0	0	0	0	0	112.7	K348 H350 K354	K348-G352 PolarHBondContact O-N 3.45Å; H350-G352 PolarHBondContact O-N 3.38Å; G352-K354 PolarHBondContact O-N 3.4Å
353	E	75.6	Confident	83.7	Confident	120 Å²	120	80.9 Å²	80.9	56%	0.561	42%	0.423	S	S	*	.			trans	-64.4	126	179.2	-73.4	177.3	-169.9	0	0	108.8	T351 P355	T351-E353 PolarHBondContact O-N 3.01Å; T351-E353 VanDerWaalsContact O-N 3.09Å; T351-E353 WeakPolarHBondContact OG1-CB 3.42Å; T351-E353 PolarHBondContact OG1-N 3.37Å; E353-P355 VanDerWaalsContact C-CD 3.46Å; E353-P355 HydrophobicContact CB-CG 4.5Å; E353-P355 WeakPolarHBondContact O-CD 3.05Å
354	K	80.3	Confident	83.4	Confident	115 Å²	115	81.7 Å²	81.7	50%	0.5	43%	0.432	S	S	.	.			trans	-119	75.2	176.5	-71.7	167.8	169.7	-170.3	0	108.9	G352 Y356 A364 F365 E366	G352-K354 PolarHBondContact O-N 3.4Å; K354-Y356 PolarHBondContact O-N 3.45Å; K354-Y356 VanDerWaalsContact O-N 3.14Å; K354-A364 HydrophobicContact CB-CB 3.54Å; K354-A364 HydrophobicContact CD-CB 4.33Å; K354-A364 WeakPolarHBondContact CD-O 3.39Å; K354-F365 CarbonylContact C-O 3.53Å; K354-F365 VanDerWaalsContact CA-O 3.3Å; K354-F365 WeakPolarHBondContact CA-O 3.47Å; K354-E366 HydrophobicContact CG-CG 4.03Å
355	P	80.4	Confident	83	Confident	82 Å²	82	79.1 Å²	79.1	53%	0.532	42%	0.42	S	S	.	.			trans	-67.7	-16.4	-172.8	-18.3	32.8	0	0	0	113.2	E353	E353-P355 VanDerWaalsContact C-CD 3.46Å; E353-P355 HydrophobicContact CB-CG 4.5Å; E353-P355 WeakPolarHBondContact O-CD 3.05Å
356	Y	81	Confident	82.7	Confident	75 Å²	75	78.2 Å²	78.2	29%	0.294	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	86.3	-173.6	-53.8	-70.4	0	0	0	110.2	K354 A364 F365 E366 L367 K368	K354-Y356 PolarHBondContact O-N 3.45Å; K354-Y356 VanDerWaalsContact O-N 3.14Å; Y356-A364 CarbonylContact O-C 3.51Å; Y356-A364 WeakPolarHBondContact O-CA 3.34Å; Y356-F365 WeakPolarHBondContact CD2-O 3.49Å; Y356-F365 PolarHBondContact N-O 3.48Å; Y356-F365 PolarHBondContact O-N 3.01Å; Y356-E366 WeakPolarHBondContact CE2-O 3.17Å; Y356-L367 VanDerWaalsContact CD2-C 3.46Å; Y356-K368 HydrophobicContact CD1-CB 4.03Å; Y356-K368 HydrophobicContact CD1-CG 4.3Å; Y356-K368 HydrophobicContact CD2-CB 4.32Å; Y356-K368 VanDerWaalsContact CD2-N 3.33Å; Y356-K368 HydrophobicContact CE1-CB 3.85Å; Y356-K368 HydrophobicContact CE1-CD 4.41Å; Y356-K368 HydrophobicContact CE1-CG 4.28Å; Y356-K368 HydrophobicContact CE2-CB 4.14Å; Y356-K368 HydrophobicContact CG-CB 4.26Å
357	G	86.1	Confident	82.2	Confident	37 Å²	37	79.3 Å²	79.3	38%	0.381	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	145.6	172.7	0	0	0	0	0	112.6	L371	G357-L371 WeakPolarHBondContact O-CD2 3.47Å
358	C	86.6	Confident	81.9	Confident	14 Å²	14	81.7 Å²	81.7	10%	0.095	43%	0.429	C	S	.	.			trans	-80.7	135	166.8	-176.8	0	0	0	0	110.1	Q360 K363 L371 H374	C358-Q360 PolarHBondContact O-N 2.07Å; C358-Q360 PolarHBondContact SG-N 3.07Å; C358-Q360 VanDerWaalsContact SG-N 3.39Å; C358-K363 WeakPolarHBondContact CB-O 3.21Å; C358-K363 PolarHBondContact N-O 3.18Å; C358-L371 HydrophobicContact CB-CD1 3.86Å; C358-H374 WeakPolarHBondContact CB-NE2 3.31Å; C358-H374 PolarHBondContact SG-NE2 3.37Å; C358-H374 VanDerWaalsContact SG-NE2 3.39Å
359	N	86	Confident	81.5	Confident	158 Å²	158	81.8 Å²	81.8	85%	0.845	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-9.7	178	-63.8	-18.8	0	0	0	113.4
360	Q	81.9	Confident	81.5	Confident	135 Å²	135	79.8 Å²	79.8	63%	0.631	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.2	-4.9	-176.9	-59.6	-168.9	23.8	0	0	113.7	C358 H378	C358-Q360 PolarHBondContact O-N 2.07Å; C358-Q360 PolarHBondContact SG-N 3.07Å; C358-Q360 VanDerWaalsContact SG-N 3.39Å; Q360-H378 VanDerWaalsContact OE1-CG 3.28Å; Q360-H378 PolarHBondContact OE1-ND1 2.8Å
361	C	86.9	Confident	81.4	Confident	39 Å²	39	77.6 Å²	77.6	26%	0.264	42%	0.42	S	S	.	.	S	Bend	trans	-160.7	166.3	172.3	72.1	0	0	0	0	111.4	K363 H374	C361-K363 PolarHBondContact O-N 3.04Å; C361-H374 VanDerWaalsContact SG-CE1 3.52Å; C361-H374 PolarHBondContact SG-NE2 3.19Å
362	D	84.4	Confident	81.3	Confident	176 Å²	176	78.7 Å²	78.7	94%	0.941	42%	0.42	S	S	*	.	S	Bend	trans	-73	15.3	-175.6	-51.1	-49.2	0	0	0	114.9
363	K	86.4	Confident	81.5	Confident	115 Å²	115	79.7 Å²	79.7	50%	0.5	41%	0.414	S	S	.	.			trans	-85	125.3	180	-69.1	-180	-177.8	170.4	0	110.4	C358 C361 F365	C358-K363 WeakPolarHBondContact CB-O 3.21Å; C358-K363 PolarHBondContact N-O 3.18Å; C361-K363 PolarHBondContact O-N 3.04Å; K363-F365 HydrophobicContact CB-CE2 3.84Å; K363-F365 HydrophobicContact CB-CZ 3.91Å; K363-F365 HydrophobicContact CD-CZ 4.47Å
364	A	85.8	Confident	81.8	Confident	35 Å²	35	74.7 Å²	74.7	29%	0.289	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	149.6	170.2	0	0	0	0	0	111.3	K354 Y356	K354-A364 HydrophobicContact CB-CB 3.54Å; K354-A364 HydrophobicContact CD-CB 4.33Å; K354-A364 WeakPolarHBondContact CD-O 3.39Å; Y356-A364 CarbonylContact O-C 3.51Å; Y356-A364 WeakPolarHBondContact O-CA 3.34Å
365	F	79.7	Confident	81.9	Confident	42 Å²	42	72.7 Å²	72.7	18%	0.184	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	147.3	-173.5	-58.9	-90.3	0	0	0	111.6	K354 Y356 K363 L367 D370 L371 H374	K354-F365 CarbonylContact C-O 3.53Å; K354-F365 VanDerWaalsContact CA-O 3.3Å; K354-F365 WeakPolarHBondContact CA-O 3.47Å; Y356-F365 WeakPolarHBondContact CD2-O 3.49Å; Y356-F365 PolarHBondContact N-O 3.48Å; Y356-F365 PolarHBondContact O-N 3.01Å; K363-F365 HydrophobicContact CB-CE2 3.84Å; K363-F365 HydrophobicContact CB-CZ 3.91Å; K363-F365 HydrophobicContact CD-CZ 4.47Å; F365-L367 VanDerWaalsContact C-N 3.34Å; F365-D370 HydrophobicContact CB-CB 4.08Å; F365-D370 HydrophobicContact CD1-CB 3.73Å; F365-D370 HydrophobicContact CG-CB 4.14Å; F365-L371 HydrophobicContact CB-CB 4.38Å; F365-L371 HydrophobicContact CD2-CB 3.87Å; F365-L371 HydrophobicContact CD2-CD1 3.84Å; F365-L371 HydrophobicContact CD2-CG 4.48Å; F365-L371 HydrophobicContact CE2-CD1 4.01Å; F365-L371 HydrophobicContact CG-CB 4.31Å; F365-H374 HydrophobicContact CE1-CB 3.95Å; F365-H374 HydrophobicContact CE2-CB 3.72Å; F365-H374 AromaticContact CE2-CD2 3.3Å; F365-H374 WeakPolarHBondContact CE2-CD2 3.06Å; F365-H374 AromaticContact CE2-CG 3.48Å; F365-H374 VanDerWaalsContact CE2-CG 3.48Å; F365-H374 AromaticContact CE2-NE2 3.97Å; F365-H374 HydrophobicContact CZ-CB 3.33Å; F365-H374 AromaticContact CZ-CD2 3.53Å; F365-H374 AromaticContact CZ-CG 3.19Å; F365-H374 AromaticContact CZ-ND1 3.68Å
366	E	78	Confident	82.1	Confident	48 Å²	48	71.5 Å²	71.5	22%	0.224	37%	0.368	C	S	.	.	S	Bend	trans	-69.9	-33.6	176.5	-61.5	173.3	-165.1	0	0	111.1	H349 K354 Y356	H349-E366 IonicContact CE1-OE1 3.99Å; H349-E366 IonicContact CG-OE2 4Å; H349-E366 IonicContact ND1-OE1 3.13Å; H349-E366 PolarHBondContact ND1-OE1 3.02Å; H349-E366 VanDerWaalsContact ND1-OE1 3.13Å; H349-E366 IonicContact ND1-OE2 3.51Å; K354-E366 HydrophobicContact CG-CG 4.03Å; Y356-E366 WeakPolarHBondContact CE2-O 3.17Å
367	L	77.3	Confident	82.2	Confident	47 Å²	47	72.1 Å²	72.1	25%	0.246	38%	0.376	C	S	.	.	S	Bend	trans	-121.8	139.6	-177	-55.2	176.6	0	0	0	111.9	N345 Y356 F365 C369 D370 L371	N345-L367 HydrophobicContact CB-CD2 4.11Å; Y356-L367 VanDerWaalsContact CD2-C 3.46Å; F365-L367 VanDerWaalsContact C-N 3.34Å; L367-C369 VanDerWaalsContact C-N 3.28Å; L367-C369 PolarHBondContact O-N 2.89Å; L367-D370 WeakPolarHBondContact O-CB 3.3Å; L367-D370 PolarHBondContact O-N 3.18Å; L367-L371 PolarHBondContact O-N 3.42Å
368	K	80.1	Confident	82.2	Confident	124 Å²	124	73.5 Å²	73.5	54%	0.539	37%	0.372	S	S	.	.	H	α-helix	trans	-59.1	-35.5	178.5	-173.5	174.2	-179.1	173.6	0	113.4	Y356 D370 L371 Q372	Y356-K368 HydrophobicContact CD1-CB 4.03Å; Y356-K368 HydrophobicContact CD1-CG 4.3Å; Y356-K368 HydrophobicContact CD2-CB 4.32Å; Y356-K368 VanDerWaalsContact CD2-N 3.33Å; Y356-K368 HydrophobicContact CE1-CB 3.85Å; Y356-K368 HydrophobicContact CE1-CD 4.41Å; Y356-K368 HydrophobicContact CE1-CG 4.28Å; Y356-K368 HydrophobicContact CE2-CB 4.14Å; Y356-K368 HydrophobicContact CG-CB 4.26Å; K368-D370 VanDerWaalsContact C-N 3.26Å; K368-D370 PolarHBondContact O-N 3.48Å; K368-L371 PolarHBondContact O-N 2.86Å; K368-Q372 WeakPolarHBondContact O-CG 3.49Å; K368-Q372 PolarHBondContact O-N 2.84Å
369	C	76.8	Confident	82.1	Confident	62 Å²	62	76.7 Å²	76.7	42%	0.419	39%	0.391	S	S	.	.	H	α-helix	trans	-66	-30.5	178.2	57.6	0	0	0	0	112.6	L367 Q372 I373	L367-C369 VanDerWaalsContact C-N 3.28Å; L367-C369 PolarHBondContact O-N 2.89Å; C369-Q372 PolarHBondContact O-N 3.48Å; C369-I373 VanDerWaalsContact O-CG1 3.31Å; C369-I373 WeakPolarHBondContact O-CG1 3.29Å; C369-I373 PolarHBondContact O-N 2.96Å
370	D	80.4	Confident	82	Confident	66 Å²	66	71.4 Å²	71.4	35%	0.353	37%	0.374	S	S	.	.	H	α-helix	trans	-73.1	-39	177.9	-63.6	-29.8	0	0	0	110.6	F365 L367 K368 I373 H374	F365-D370 HydrophobicContact CB-CB 4.08Å; F365-D370 HydrophobicContact CD1-CB 3.73Å; F365-D370 HydrophobicContact CG-CB 4.14Å; L367-D370 WeakPolarHBondContact O-CB 3.3Å; L367-D370 PolarHBondContact O-N 3.18Å; K368-D370 VanDerWaalsContact C-N 3.26Å; K368-D370 PolarHBondContact O-N 3.48Å; D370-I373 PolarHBondContact O-N 3.42Å; D370-H374 VanDerWaalsContact O-CB 3.23Å; D370-H374 WeakPolarHBondContact O-CB 3.37Å; D370-H374 PolarHBondContact O-N 3.34Å
371	L	81.6	Confident	82.1	Confident	18 Å²	18	70.1 Å²	70.1	9%	0.094	37%	0.368	C	S	.	.	H	α-helix	trans	-57.9	-49.1	169.1	175.3	63.3	0	0	0	111	G357 C358 F365 L367 K368 I373 H374 E375	G357-L371 WeakPolarHBondContact O-CD2 3.47Å; C358-L371 HydrophobicContact CB-CD1 3.86Å; F365-L371 HydrophobicContact CB-CB 4.38Å; F365-L371 HydrophobicContact CD2-CB 3.87Å; F365-L371 HydrophobicContact CD2-CD1 3.84Å; F365-L371 HydrophobicContact CD2-CG 4.48Å; F365-L371 HydrophobicContact CE2-CD1 4.01Å; F365-L371 HydrophobicContact CG-CB 4.31Å; L367-L371 PolarHBondContact O-N 3.42Å; K368-L371 PolarHBondContact O-N 2.86Å; L371-I373 VanDerWaalsContact C-N 3.34Å; L371-I373 PolarHBondContact O-N 3.49Å; L371-H374 CarbonylContact O-C 3.49Å; L371-H374 WeakPolarHBondContact O-CA 3.32Å; L371-H374 WeakPolarHBondContact O-CB 3.26Å; L371-H374 PolarHBondContact O-N 2.94Å; L371-E375 HydrophobicContact CD1-CG 4.01Å; L371-E375 HydrophobicContact CG-CG 4.26Å; L371-E375 WeakPolarHBondContact O-CG 3.48Å; L371-E375 PolarHBondContact O-N 3.46Å
372	Q	80	Confident	82.1	Confident	101 Å²	101	73.8 Å²	73.8	47%	0.472	38%	0.379	S	S	.	.	H	α-helix	trans	-61.1	-39.5	-179.9	-74.1	179.2	-19.9	0	0	113.3	K368 C369 H374	K368-Q372 WeakPolarHBondContact O-CG 3.49Å; K368-Q372 PolarHBondContact O-N 2.84Å; C369-Q372 PolarHBondContact O-N 3.48Å; Q372-H374 VanDerWaalsContact C-N 3.3Å
373	I	76.9	Confident	82	Confident	64 Å²	64	68.9 Å²	68.9	33%	0.328	36%	0.357	S	S	.	.	H	α-helix	trans	-68.8	-36	174.9	-67.2	165.8	0	0	0	110.2	C369 D370 L371 R376	C369-I373 VanDerWaalsContact O-CG1 3.31Å; C369-I373 WeakPolarHBondContact O-CG1 3.29Å; C369-I373 PolarHBondContact O-N 2.96Å; D370-I373 PolarHBondContact O-N 3.42Å; L371-I373 VanDerWaalsContact C-N 3.34Å; L371-I373 PolarHBondContact O-N 3.49Å; I373-R376 WeakPolarHBondContact O-CB 3.46Å
374	H	80.7	Confident	81.9	Confident	16 Å²	16	67.1 Å²	67.1	7%	0.074	35%	0.348	C	S	.	.	H	α-helix	trans	-66.9	-44	176.1	165.1	69.5	0	0	0	112.3	C358 C361 F365 D370 L371 Q372 R376 I377 H378	C358-H374 WeakPolarHBondContact CB-NE2 3.31Å; C358-H374 PolarHBondContact SG-NE2 3.37Å; C358-H374 VanDerWaalsContact SG-NE2 3.39Å; C361-H374 VanDerWaalsContact SG-CE1 3.52Å; C361-H374 PolarHBondContact SG-NE2 3.19Å; F365-H374 HydrophobicContact CE1-CB 3.95Å; F365-H374 HydrophobicContact CE2-CB 3.72Å; F365-H374 AromaticContact CE2-CD2 3.3Å; F365-H374 WeakPolarHBondContact CE2-CD2 3.06Å; F365-H374 AromaticContact CE2-CG 3.48Å; F365-H374 VanDerWaalsContact CE2-CG 3.48Å; F365-H374 AromaticContact CE2-NE2 3.97Å; F365-H374 HydrophobicContact CZ-CB 3.33Å; F365-H374 AromaticContact CZ-CD2 3.53Å; F365-H374 AromaticContact CZ-CG 3.19Å; F365-H374 AromaticContact CZ-ND1 3.68Å; D370-H374 VanDerWaalsContact O-CB 3.23Å; D370-H374 WeakPolarHBondContact O-CB 3.37Å; D370-H374 PolarHBondContact O-N 3.34Å; L371-H374 CarbonylContact O-C 3.49Å; L371-H374 WeakPolarHBondContact O-CA 3.32Å; L371-H374 WeakPolarHBondContact O-CB 3.26Å; L371-H374 PolarHBondContact O-N 2.94Å; Q372-H374 VanDerWaalsContact C-N 3.3Å; H374-R376 PolarHBondContact O-N 3.12Å; H374-I377 WeakPolarHBondContact CE1-CD1 3.26Å; H374-I377 WeakPolarHBondContact ND1-CD1 3.2Å; H374-I377 WeakPolarHBondContact O-CB 3.3Å; H374-I377 WeakPolarHBondContact O-CG1 3.38Å; H374-I377 WeakPolarHBondContact O-CG2 3.32Å; H374-I377 PolarHBondContact O-N 3.47Å; H374-H378 AromaticContact CE1-NE2 3.63Å; H374-H378 AromaticContact NE2-CD2 3.95Å; H374-H378 AromaticContact NE2-NE2 3.45Å; H374-H378 PolarHBondContact NE2-NE2 3.18Å
375	E	82	Confident	82	Confident	73 Å²	73	68.8 Å²	68.8	34%	0.341	35%	0.354	S	S	.	.	H	α-helix	trans	-56	-27.4	178.7	-74.3	174.2	148.3	0	0	112.6	L371 I377 H378 T379	L371-E375 HydrophobicContact CD1-CG 4.01Å; L371-E375 HydrophobicContact CG-CG 4.26Å; L371-E375 WeakPolarHBondContact O-CG 3.48Å; L371-E375 PolarHBondContact O-N 3.46Å; E375-I377 PolarHBondContact O-N 3.05Å; E375-H378 WeakPolarHBondContact O-CB 3.43Å; E375-H378 PolarHBondContact O-N 3.26Å; E375-T379 PolarHBondContact O-N 3.38Å; E375-T379 VanDerWaalsContact O-N 3.12Å
376	R	84.6	Confident	82.4	Confident	57 Å²	57	66.9 Å²	66.9	22%	0.215	35%	0.346	C	S	.	.	H	α-helix	trans	-62.9	-19.9	173.6	-63.5	174.6	-173.4	-166.8	-7.5	114.4	I373 H374 H378 T379 G380 E381 Y384 V394	I373-R376 WeakPolarHBondContact O-CB 3.46Å; H374-R376 PolarHBondContact O-N 3.12Å; R376-H378 VanDerWaalsContact C-N 3.25Å; R376-T379 WeakPolarHBondContact CA-OG1 3.46Å; R376-G380 CarbonylContact O-C 3.49Å; R376-G380 WeakPolarHBondContact O-CA 3.39Å; R376-G380 PolarHBondContact O-N 3.48Å; R376-E381 HydrophobicContact CB-CB 4.4Å; R376-E381 HydrophobicContact CG-CB 4.29Å; R376-E381 PolarHBondContact O-N 2.97Å; R376-Y384 VanDerWaalsContact NH1-CE2 3.3Å; R376-V394 HydrophobicContact CB-CB 4.33Å; R376-V394 HydrophobicContact CB-CG1 4.42Å; R376-V394 PolarHBondContact NH1-O 3.2Å
377	I	83.9	Confident	82.8	Confident	88 Å²	88	72 Å²	72	45%	0.451	38%	0.375	S	S	.	.	H	α-helix	trans	-70.1	-29.9	172.5	82.5	-178.9	0	0	0	111.2	H374 E375	H374-I377 WeakPolarHBondContact CE1-CD1 3.26Å; H374-I377 WeakPolarHBondContact ND1-CD1 3.2Å; H374-I377 WeakPolarHBondContact O-CB 3.3Å; H374-I377 WeakPolarHBondContact O-CG1 3.38Å; H374-I377 WeakPolarHBondContact O-CG2 3.32Å; H374-I377 PolarHBondContact O-N 3.47Å; E375-I377 PolarHBondContact O-N 3.05Å
378	H	85.4	Confident	83	Confident	65 Å²	65	76.4 Å²	76.4	30%	0.301	39%	0.394	S	S	.	.	H	α-helix	trans	-81.8	-43.2	179.5	-68.8	-73.1	0	0	0	111.2	Q360 H374 E375 R376 G380	Q360-H378 VanDerWaalsContact OE1-CG 3.28Å; Q360-H378 PolarHBondContact OE1-ND1 2.8Å; H374-H378 AromaticContact CE1-NE2 3.63Å; H374-H378 AromaticContact NE2-CD2 3.95Å; H374-H378 AromaticContact NE2-NE2 3.45Å; H374-H378 PolarHBondContact NE2-NE2 3.18Å; E375-H378 WeakPolarHBondContact O-CB 3.43Å; E375-H378 PolarHBondContact O-N 3.26Å; R376-H378 VanDerWaalsContact C-N 3.25Å; H378-G380 VanDerWaalsContact C-N 3.26Å; H378-G380 PolarHBondContact O-N 2.99Å
379	T	86	Confident	83.4	Confident	82 Å²	82	73 Å²	73	50%	0.503	39%	0.386	S	S	.	.	H	α-helix	trans	-75.8	-17.6	176.7	65.7	0	0	0	0	112.8	E375 R376 E381	E375-T379 PolarHBondContact O-N 3.38Å; E375-T379 VanDerWaalsContact O-N 3.12Å; R376-T379 WeakPolarHBondContact CA-OG1 3.46Å; T379-E381 PolarHBondContact O-N 3.33Å; T379-E381 WeakPolarHBondContact OG1-CB 3.13Å; T379-E381 WeakPolarHBondContact OG1-CG 3.12Å; T379-E381 PolarHBondContact OG1-N 2.91Å
380	G	83.8	Confident	83.9	Confident	46 Å²	46	72.4 Å²	72.4	47%	0.474	39%	0.39	S	S	.	.			trans	74.6	2.5	-174.1	0	0	0	0	0	114.1	R376 H378 K382	R376-G380 CarbonylContact O-C 3.49Å; R376-G380 WeakPolarHBondContact O-CA 3.39Å; R376-G380 PolarHBondContact O-N 3.48Å; H378-G380 VanDerWaalsContact C-N 3.26Å; H378-G380 PolarHBondContact O-N 2.99Å; G380-K382 PolarHBondContact O-N 3.24Å
381	E	83.4	Confident	84.2	Confident	108 Å²	108	75.3 Å²	75.3	51%	0.505	40%	0.399	S	S	.	.			trans	-61.9	127	-178.2	-76.4	179.8	-164.8	0	0	112.3	R376 T379	R376-E381 HydrophobicContact CB-CB 4.4Å; R376-E381 HydrophobicContact CG-CB 4.29Å; R376-E381 PolarHBondContact O-N 2.97Å; T379-E381 PolarHBondContact O-N 3.33Å; T379-E381 WeakPolarHBondContact OG1-CB 3.13Å; T379-E381 WeakPolarHBondContact OG1-CG 3.12Å; T379-E381 PolarHBondContact OG1-N 2.91Å
382	K	87.4	Confident	84.6	Confident	116 Å²	116	76.2 Å²	76.2	50%	0.504	41%	0.409	S	S	.	.			trans	-128.2	75.3	178.3	-68.1	172.6	-173.1	178.3	0	110.9	G380 Y384 A392 F393 V394	G380-K382 PolarHBondContact O-N 3.24Å; K382-Y384 PolarHBondContact O-N 3.41Å; K382-Y384 VanDerWaalsContact O-N 3.17Å; K382-A392 HydrophobicContact CB-CB 3.52Å; K382-A392 HydrophobicContact CD-CB 4.25Å; K382-A392 WeakPolarHBondContact CD-O 3.47Å; K382-A392 WeakPolarHBondContact O-CB 3.22Å; K382-F393 CarbonylContact C-O 3.52Å; K382-F393 WeakPolarHBondContact CA-O 3.46Å; K382-V394 HydrophobicContact CG-CG1 3.87Å
383	P	82.1	Confident	84.8	Confident	73 Å²	73	73.4 Å²	73.4	47%	0.474	40%	0.396	S	S	.	.			trans	-69.1	-16.6	-172	-21.3	34.8	0	0	0	114.5
384	Y	84.2	Confident	85.1	Confident	78 Å²	78	71.6 Å²	71.6	31%	0.306	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	96.7	-173.8	-58	-78	0	0	0	110.3	R376 K382 A392 F393 S395 R396	R376-Y384 VanDerWaalsContact NH1-CE2 3.3Å; K382-Y384 PolarHBondContact O-N 3.41Å; K382-Y384 VanDerWaalsContact O-N 3.17Å; Y384-A392 CarbonylContact O-C 3.38Å; Y384-A392 WeakPolarHBondContact O-CA 3.25Å; Y384-F393 WeakPolarHBondContact CB-O 3.41Å; Y384-F393 WeakPolarHBondContact CD2-O 3.44Å; Y384-F393 PolarHBondContact N-O 3.03Å; Y384-F393 PolarHBondContact O-N 3.13Å; Y384-S395 VanDerWaalsContact CD2-CA 3.44Å; Y384-R396 HydrophobicContact CD1-CB 3.99Å; Y384-R396 HydrophobicContact CD1-CG 4.39Å; Y384-R396 HydrophobicContact CE1-CB 3.82Å; Y384-R396 HydrophobicContact CE1-CG 4.4Å; Y384-R396 HydrophobicContact CG-CB 4.42Å
385	V	88.2	Confident	85	Confident	71 Å²	71	71.3 Å²	71.3	43%	0.43	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	134.5	-179.3	-175.3	0	0	0	0	110.3	A392	V385-A392 HydrophobicContact CG2-CB 4.12Å
386	C	87.7	Confident	85.1	Confident	1 Å²	1	76.2 Å²	76.2	1%	0.007	40%	0.403	C	S	.	.			trans	-76.1	119.5	169.4	-178.2	0	0	0	0	109.8	Q388 C389 G390 K391 F393 L399 H406	C386-Q388 PolarHBondContact O-N 2.87Å; C386-C389 PolarHBondContact O-N 3.27Å; C386-G390 WeakPolarHBondContact O-CA 3.38Å; C386-G390 PolarHBondContact O-N 3.3Å; C386-K391 WeakPolarHBondContact CB-O 3.48Å; C386-K391 PolarHBondContact N-O 3.48Å; C386-F393 HydrophobicContact CB-CE2 4.34Å; C386-L399 VanDerWaalsContact CA-CD1 3.49Å; C386-L399 HydrophobicContact CB-CD1 3.53Å; C386-H406 VanDerWaalsContact SG-CD2 3.58Å; C386-H406 PolarHBondContact SG-NE2 2.87Å; C386-H406 VanDerWaalsContact SG-NE2 3.41Å
387	N	87.3	Confident	84.9	Confident	156 Å²	156	83 Å²	83	83%	0.834	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-21.3	-179.5	-65.3	-16.2	0	0	0	113.4
388	Q	81.3	Confident	84.8	Confident	139 Å²	139	85.3 Å²	85.3	65%	0.65	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-23.7	-175.4	-65.1	178.9	-14.2	0	0	113.7	C386 H406	C386-Q388 PolarHBondContact O-N 2.87Å; Q388-H406 PolarHBondContact OE1-CD2 3.28Å
389	C	86.9	Confident	84.7	Confident	54 Å²	54	82.9 Å²	82.9	37%	0.365	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.4	4.9	176.8	69.8	0	0	0	0	115.5	C386 K391 H402 H406	C386-C389 PolarHBondContact O-N 3.27Å; C389-K391 PolarHBondContact O-N 2.92Å; C389-K391 VanDerWaalsContact O-N 3.08Å; C389-K391 VanDerWaalsContact SG-CG 3.55Å; C389-H402 VanDerWaalsContact SG-CE1 3.58Å; C389-H402 PolarHBondContact SG-NE2 3.38Å; C389-H406 PolarHBondContact SG-NE2 2.75Å
390	G	87	Confident	84.4	Confident	49 Å²	49	86.8 Å²	86.8	51%	0.505	43%	0.427	S	S	.	.			trans	70.5	-1.3	-179.3	0	0	0	0	0	115.1	C386 A392	C386-G390 WeakPolarHBondContact O-CA 3.38Å; C386-G390 PolarHBondContact O-N 3.3Å; G390-A392 PolarHBondContact O-N 3.19Å
391	K	88.4	Confident	84.1	Confident	126 Å²	126	87.4 Å²	87.4	55%	0.548	42%	0.419	S	S	.	.			trans	-64.8	126.1	179.4	-73.5	-179.2	-176.8	176.3	0	110.6	C386 C389 F393	C386-K391 WeakPolarHBondContact CB-O 3.48Å; C386-K391 PolarHBondContact N-O 3.48Å; C389-K391 PolarHBondContact O-N 2.92Å; C389-K391 VanDerWaalsContact O-N 3.08Å; C389-K391 VanDerWaalsContact SG-CG 3.55Å; K391-F393 HydrophobicContact CB-CE2 3.73Å; K391-F393 HydrophobicContact CB-CZ 3.86Å; K391-F393 WeakPolarHBondContact O-CD2 3.43Å; K391-F393 WeakPolarHBondContact O-CE2 3.44Å
392	A	88.5	Confident	84	Confident	37 Å²	37	83.4 Å²	83.4	31%	0.306	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	143.2	179.5	0	0	0	0	0	111.6	K382 Y384 V385 G390	K382-A392 HydrophobicContact CB-CB 3.52Å; K382-A392 HydrophobicContact CD-CB 4.25Å; K382-A392 WeakPolarHBondContact CD-O 3.47Å; K382-A392 WeakPolarHBondContact O-CB 3.22Å; Y384-A392 CarbonylContact O-C 3.38Å; Y384-A392 WeakPolarHBondContact O-CA 3.25Å; V385-A392 HydrophobicContact CG2-CB 4.12Å; G390-A392 PolarHBondContact O-N 3.19Å
393	F	85.6	Confident	83.8	Confident	42 Å²	42	81.4 Å²	81.4	18%	0.184	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	147.8	-178.3	-60.5	-87	0	0	0	111.7	K382 Y384 C386 K391 S395 L399 H402	K382-F393 CarbonylContact C-O 3.52Å; K382-F393 WeakPolarHBondContact CA-O 3.46Å; Y384-F393 WeakPolarHBondContact CB-O 3.41Å; Y384-F393 WeakPolarHBondContact CD2-O 3.44Å; Y384-F393 PolarHBondContact N-O 3.03Å; Y384-F393 PolarHBondContact O-N 3.13Å; C386-F393 HydrophobicContact CB-CE2 4.34Å; K391-F393 HydrophobicContact CB-CE2 3.73Å; K391-F393 HydrophobicContact CB-CZ 3.86Å; K391-F393 WeakPolarHBondContact O-CD2 3.43Å; K391-F393 WeakPolarHBondContact O-CE2 3.44Å; F393-S395 VanDerWaalsContact C-N 3.28Å; F393-S395 PolarHBondContact O-N 3.21Å; F393-L399 HydrophobicContact CB-CB 4.28Å; F393-L399 HydrophobicContact CD2-CB 3.93Å; F393-L399 HydrophobicContact CD2-CD1 3.8Å; F393-L399 HydrophobicContact CD2-CG 4.48Å; F393-L399 HydrophobicContact CE2-CD1 4.01Å; F393-L399 HydrophobicContact CG-CB 4.29Å; F393-H402 HydrophobicContact CE1-CB 3.83Å; F393-H402 HydrophobicContact CE2-CB 3.76Å; F393-H402 AromaticContact CE2-CD2 3.27Å; F393-H402 WeakPolarHBondContact CE2-CD2 3.28Å; F393-H402 AromaticContact CE2-CG 3.51Å; F393-H402 AromaticContact CE2-NE2 3.97Å; F393-H402 HydrophobicContact CZ-CB 3.32Å; F393-H402 AromaticContact CZ-CD2 3.39Å; F393-H402 WeakPolarHBondContact CZ-CD2 3.42Å; F393-H402 AromaticContact CZ-CG 3.13Å; F393-H402 AromaticContact CZ-ND1 3.67Å; F393-H402 AromaticContact CZ-NE2 3.99Å
394	V	82.3	Confident	83.6	Confident	26 Å²	26	82 Å²	82	16%	0.158	39%	0.388	C	S	.	.	S	Bend	trans	-67.8	-27.4	178.6	-60.5	0	0	0	0	112.8	R376 K382 Y398	R376-V394 HydrophobicContact CB-CB 4.33Å; R376-V394 HydrophobicContact CB-CG1 4.42Å; R376-V394 PolarHBondContact NH1-O 3.2Å; K382-V394 HydrophobicContact CG-CG1 3.87Å; V394-Y398 HydrophobicContact CG2-CD2 3.73Å; V394-Y398 HydrophobicContact CG2-CE2 3.95Å
395	S	79.9	Confident	83.1	Confident	11 Å²	11	82.6 Å²	82.6	8%	0.077	39%	0.394	C	S	.	.	S	Bend	trans	-138.5	149.8	-178.7	88	0	0	0	0	112.9	Y384 F393 R397 Y398 L399	Y384-S395 VanDerWaalsContact CD2-CA 3.44Å; F393-S395 VanDerWaalsContact C-N 3.28Å; F393-S395 PolarHBondContact O-N 3.21Å; S395-R397 PolarHBondContact O-N 2.77Å; S395-R397 PolarHBondContact OG-N 3.39Å; S395-Y398 PolarHBondContact O-N 3.11Å; S395-Y398 VanDerWaalsContact O-N 3.07Å; S395-Y398 WeakPolarHBondContact OG-CD2 3.15Å; S395-Y398 PolarHBondContact OG-N 2.74Å; S395-L399 PolarHBondContact O-N 3.03Å; S395-L399 VanDerWaalsContact O-N 3.12Å
396	R	83.7	Confident	82.6	Confident	176 Å²	176	82 Å²	82	66%	0.664	39%	0.386	S	S	*	.	H	α-helix	trans	-59.3	-29.8	175.6	-164.9	173.5	-142.3	-86.2	-4.8	112.8	Y384 L399 R400	Y384-R396 HydrophobicContact CD1-CB 3.99Å; Y384-R396 HydrophobicContact CD1-CG 4.39Å; Y384-R396 HydrophobicContact CE1-CB 3.82Å; Y384-R396 HydrophobicContact CE1-CG 4.4Å; Y384-R396 HydrophobicContact CG-CB 4.42Å; R396-L399 PolarHBondContact O-N 3.29Å; R396-R400 WeakPolarHBondContact O-CB 3.13Å; R396-R400 PolarHBondContact O-N 3.32Å
397	R	79.5	Confident	81.8	Confident	199 Å²	199	85.5 Å²	85.5	75%	0.751	41%	0.407	S	S	*	.	H	α-helix	trans	-65.4	-40.8	176	-177.3	178.4	-179.6	179.6	0.7	111.4	S395 N401	S395-R397 PolarHBondContact O-N 2.77Å; S395-R397 PolarHBondContact OG-N 3.39Å; R397-N401 WeakPolarHBondContact O-CB 3.3Å; R397-N401 PolarHBondContact O-N 3.11Å; R397-N401 VanDerWaalsContact O-N 3.1Å; R397-N401 PolarHBondContact O-ND2 3.17Å
398	Y	82.4	Confident	80.4	Confident	137 Å²	137	85.8 Å²	85.8	54%	0.537	41%	0.408	S	S	.	.	H	α-helix	trans	-69.3	-42.1	175.7	-70.3	-60.9	0	0	0	111.5	V394 S395 N401 H402	V394-Y398 HydrophobicContact CG2-CD2 3.73Å; V394-Y398 HydrophobicContact CG2-CE2 3.95Å; S395-Y398 PolarHBondContact O-N 3.11Å; S395-Y398 VanDerWaalsContact O-N 3.07Å; S395-Y398 WeakPolarHBondContact OG-CD2 3.15Å; S395-Y398 PolarHBondContact OG-N 2.74Å; Y398-N401 PolarHBondContact O-N 3.42Å; Y398-H402 WeakPolarHBondContact O-CB 3.26Å; Y398-H402 PolarHBondContact O-N 3.17Å
399	L	82.4	Confident	79.3	Confident	13 Å²	13	85.7 Å²	85.7	7%	0.068	41%	0.408	C	S	.	.	H	α-helix	trans	-57.7	-51.8	173.1	173.7	60.1	0	0	0	111.4	C386 F393 S395 R396 N401 H402 E403	C386-L399 VanDerWaalsContact CA-CD1 3.49Å; C386-L399 HydrophobicContact CB-CD1 3.53Å; F393-L399 HydrophobicContact CB-CB 4.28Å; F393-L399 HydrophobicContact CD2-CB 3.93Å; F393-L399 HydrophobicContact CD2-CD1 3.8Å; F393-L399 HydrophobicContact CD2-CG 4.48Å; F393-L399 HydrophobicContact CE2-CD1 4.01Å; F393-L399 HydrophobicContact CG-CB 4.29Å; S395-L399 PolarHBondContact O-N 3.03Å; S395-L399 VanDerWaalsContact O-N 3.12Å; R396-L399 PolarHBondContact O-N 3.29Å; L399-N401 VanDerWaalsContact C-N 3.3Å; L399-N401 PolarHBondContact O-N 3.17Å; L399-H402 CarbonylContact O-C 3.35Å; L399-H402 WeakPolarHBondContact O-CA 3.5Å; L399-H402 WeakPolarHBondContact O-CB 3.32Å; L399-H402 PolarHBondContact O-N 2.75Å; L399-E403 HydrophobicContact CD1-CG 3.89Å; L399-E403 HydrophobicContact CG-CG 4.25Å; L399-E403 WeakPolarHBondContact O-CG 3.27Å; L399-E403 PolarHBondContact O-N 3.22Å
400	R	80.4	Confident	77.9	Confident	165 Å²	165	90.9 Å²	90.9	62%	0.623	42%	0.424	S	S	*	.	H	α-helix	trans	-58.7	-39.7	179	-174.5	-178.6	179.6	-170.7	0.9	112.7	R396 H402 K404	R396-R400 WeakPolarHBondContact O-CB 3.13Å; R396-R400 PolarHBondContact O-N 3.32Å; R400-H402 VanDerWaalsContact C-N 3.29Å; R400-K404 WeakPolarHBondContact O-CG 3.49Å; R400-K404 PolarHBondContact O-N 3.35Å
401	N	77.7	Confident	77.1	Confident	58 Å²	58	92.9 Å²	92.9	31%	0.31	42%	0.423	S	S	.	.	H	α-helix	trans	-68.1	-32.8	175.4	-77.1	-23.4	0	0	0	112.1	R397 Y398 L399	R397-N401 WeakPolarHBondContact O-CB 3.3Å; R397-N401 PolarHBondContact O-N 3.11Å; R397-N401 VanDerWaalsContact O-N 3.1Å; R397-N401 PolarHBondContact O-ND2 3.17Å; Y398-N401 PolarHBondContact O-N 3.42Å; L399-N401 VanDerWaalsContact C-N 3.3Å; L399-N401 PolarHBondContact O-N 3.17Å
402	H	81.9	Confident	76.6	Confident	24 Å²	24	91 Å²	91	11%	0.111	41%	0.413	C	S	.	.	H	α-helix	trans	-71.4	-42.2	174.5	166.4	68	0	0	0	112.2	C389 F393 Y398 L399 R400 K404 H405 H406	C389-H402 VanDerWaalsContact SG-CE1 3.58Å; C389-H402 PolarHBondContact SG-NE2 3.38Å; F393-H402 HydrophobicContact CE1-CB 3.83Å; F393-H402 HydrophobicContact CE2-CB 3.76Å; F393-H402 AromaticContact CE2-CD2 3.27Å; F393-H402 WeakPolarHBondContact CE2-CD2 3.28Å; F393-H402 AromaticContact CE2-CG 3.51Å; F393-H402 AromaticContact CE2-NE2 3.97Å; F393-H402 HydrophobicContact CZ-CB 3.32Å; F393-H402 AromaticContact CZ-CD2 3.39Å; F393-H402 WeakPolarHBondContact CZ-CD2 3.42Å; F393-H402 AromaticContact CZ-CG 3.13Å; F393-H402 AromaticContact CZ-ND1 3.67Å; F393-H402 AromaticContact CZ-NE2 3.99Å; Y398-H402 WeakPolarHBondContact O-CB 3.26Å; Y398-H402 PolarHBondContact O-N 3.17Å; L399-H402 CarbonylContact O-C 3.35Å; L399-H402 WeakPolarHBondContact O-CA 3.5Å; L399-H402 WeakPolarHBondContact O-CB 3.32Å; L399-H402 PolarHBondContact O-N 2.75Å; R400-H402 VanDerWaalsContact C-N 3.29Å; H402-K404 PolarHBondContact O-N 3.41Å; H402-H405 VanDerWaalsContact O-CB 3.23Å; H402-H405 WeakPolarHBondContact O-CB 3.27Å; H402-H405 PolarHBondContact O-N 3.17Å; H402-H406 AromaticContact CE1-NE2 3.64Å; H402-H406 AromaticContact NE2-CD2 3.84Å; H402-H406 AromaticContact NE2-NE2 3.24Å; H402-H406 PolarHBondContact NE2-NE2 3.17Å
403	E	82.1	Confident	76.2	Confident	74 Å²	74	93.9 Å²	93.9	35%	0.346	42%	0.423	S	S	.	.	H	α-helix	trans	-58.7	-29.3	177.3	-72.8	170.4	158.2	0	0	112.4	L399 H405 H406 T407	L399-E403 HydrophobicContact CD1-CG 3.89Å; L399-E403 HydrophobicContact CG-CG 4.25Å; L399-E403 WeakPolarHBondContact O-CG 3.27Å; L399-E403 PolarHBondContact O-N 3.22Å; E403-H405 PolarHBondContact O-N 3.18Å; E403-H405 VanDerWaalsContact O-N 3.14Å; E403-H406 WeakPolarHBondContact O-CB 3.19Å; E403-H406 PolarHBondContact O-N 2.77Å; E403-T407 PolarHBondContact O-N 2.52Å
404	K	78.6	Confident	76.2	Confident	85 Å²	85	91.9 Å²	91.9	37%	0.37	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-19.2	170.6	-68	179.3	178.7	-172.9	0	114.2	R400 H402 T407	R400-K404 WeakPolarHBondContact O-CG 3.49Å; R400-K404 PolarHBondContact O-N 3.35Å; H402-K404 PolarHBondContact O-N 3.41Å; K404-T407 WeakPolarHBondContact CA-OG1 3.36Å; K404-T407 PolarHBondContact O-OG1 3.48Å
405	H	73.4	Confident	76.4	Confident	92 Å²	92	95.4 Å²	95.4	43%	0.426	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-21.4	173	-73.3	-87.4	0	0	0	112.7	H402 E403 Y426	H402-H405 VanDerWaalsContact O-CB 3.23Å; H402-H405 WeakPolarHBondContact O-CB 3.27Å; H402-H405 PolarHBondContact O-N 3.17Å; E403-H405 PolarHBondContact O-N 3.18Å; E403-H405 VanDerWaalsContact O-N 3.14Å; H405-Y426 AromaticContact NE2-CE2 3.9Å
406	H	77.1	Confident	76.6	Confident	58 Å²	58	100.9 Å²	100.9	27%	0.269	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-27.3	175.1	-69	-63.3	0	0	0	113.3	C386 Q388 C389 H402 E403 L408	C386-H406 VanDerWaalsContact SG-CD2 3.58Å; C386-H406 PolarHBondContact SG-NE2 2.87Å; C386-H406 VanDerWaalsContact SG-NE2 3.41Å; Q388-H406 PolarHBondContact OE1-CD2 3.28Å; C389-H406 PolarHBondContact SG-NE2 2.75Å; H402-H406 AromaticContact CE1-NE2 3.64Å; H402-H406 AromaticContact NE2-CD2 3.84Å; H402-H406 AromaticContact NE2-NE2 3.24Å; H402-H406 PolarHBondContact NE2-NE2 3.17Å; E403-H406 WeakPolarHBondContact O-CB 3.19Å; E403-H406 PolarHBondContact O-N 2.77Å; H406-L408 VanDerWaalsContact C-N 3.27Å; H406-L408 PolarHBondContact O-N 2.92Å
407	T	71.4	Confident	76.7	Confident	74 Å²	74	95.2 Å²	95.2	45%	0.454	45%	0.451	S	S	.	.	S	Bend	trans	-65.1	95.1	164.7	55.6	0	0	0	0	107.2	E403 K404 E409	E403-T407 PolarHBondContact O-N 2.52Å; K404-T407 WeakPolarHBondContact CA-OG1 3.36Å; K404-T407 PolarHBondContact O-OG1 3.48Å; T407-E409 PolarHBondContact O-N 3.15Å
408	L	58.9	Low	76.9	Confident	163 Å²	163	88.3 Å²	88.3	85%	0.853	44%	0.442	S	S	*	.			trans	-64.9	8.2	179.1	-75	170.2	0	0	0	113.3	H406 K410	H406-L408 VanDerWaalsContact C-N 3.27Å; H406-L408 PolarHBondContact O-N 2.92Å; L408-K410 PolarHBondContact O-N 3.36Å
409	E	57.5	Low	77	Confident	136 Å²	136	87.7 Å²	87.7	64%	0.636	44%	0.442	S	S	*	.			trans	-66.4	97.5	164.8	-67.4	-177.2	178.7	0	0	108.6	T407 L411	T407-E409 PolarHBondContact O-N 3.15Å; E409-L411 HydrophobicContact CB-CD2 4.03Å; E409-L411 HydrophobicContact CB-CG 4.08Å; E409-L411 WeakPolarHBondContact O-CG 3.29Å; E409-L411 PolarHBondContact O-N 3.24Å
410	K	57.6	Low	76.8	Confident	163 Å²	163	89.6 Å²	89.6	71%	0.709	46%	0.457	S	S	*	.			trans	-62.8	78.8	166.7	-74.7	176.8	177.1	176.4	0	109	L408 Y412	L408-K410 PolarHBondContact O-N 3.36Å; K410-Y412 PolarHBondContact O-N 2.75Å
411	L	69.7	Low	76.7	Confident	92 Å²	92	83.9 Å²	83.9	48%	0.482	44%	0.436	S	S	.	.			trans	-73.5	-23.7	-170.2	-70.9	172.1	0	0	0	115	E409	E409-L411 HydrophobicContact CB-CD2 4.03Å; E409-L411 HydrophobicContact CB-CG 4.08Å; E409-L411 WeakPolarHBondContact O-CG 3.29Å; E409-L411 PolarHBondContact O-N 3.24Å
412	Y	77.1	Confident	76.6	Confident	87 Å²	87	82.3 Å²	82.3	34%	0.341	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	96.3	-169.1	-56.4	-76.6	0	0	0	111.7	K410 S420 F421 F424	K410-Y412 PolarHBondContact O-N 2.75Å; Y412-S420 CarbonylContact O-C 3.58Å; Y412-S420 WeakPolarHBondContact O-CA 3.36Å; Y412-F421 PolarHBondContact N-O 3.05Å; Y412-F421 PolarHBondContact O-N 3.39Å; Y412-F424 HydrophobicContact CD1-CB 4.09Å; Y412-F424 AromaticContact CD1-CD2 3.68Å; Y412-F424 HydrophobicContact CD1-CD2 3.68Å; Y412-F424 HydrophobicContact CD1-CG 4.38Å; Y412-F424 HydrophobicContact CD2-CB 4.2Å; Y412-F424 HydrophobicContact CE1-CB 3.86Å; Y412-F424 AromaticContact CE1-CD2 3.78Å; Y412-F424 HydrophobicContact CE1-CD2 3.78Å; Y412-F424 HydrophobicContact CE1-CG 4.23Å; Y412-F424 HydrophobicContact CE2-CB 4.02Å; Y412-F424 HydrophobicContact CG-CB 4.24Å; Y412-F424 HydrophobicContact CG-CD2 4.38Å
413	D	81.7	Confident	76.3	Confident	97 Å²	97	82.2 Å²	82.2	52%	0.519	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	146.4	172	61.2	-77.5	0	0	0	112.2	L427	D413-L427 WeakPolarHBondContact O-CD2 3.35Å
414	C	85.8	Confident	76.2	Confident	0 Å²	0	83.7 Å²	83.7	0%	0	44%	0.437	C	S	.	.			trans	-86.3	111.4	164.3	-175.9	0	0	0	0	109.3	Q416 C417 G418 K419 F421 L427 H430 H434	C414-Q416 PolarHBondContact O-N 3.13Å; C414-C417 PolarHBondContact O-N 3.44Å; C414-G418 WeakPolarHBondContact O-CA 3.48Å; C414-G418 PolarHBondContact O-N 3.5Å; C414-K419 WeakPolarHBondContact CB-O 3.34Å; C414-K419 PolarHBondContact N-O 3.02Å; C414-F421 HydrophobicContact CB-CE2 4.5Å; C414-L427 HydrophobicContact CB-CD1 3.66Å; C414-H430 WeakPolarHBondContact CB-NE2 3.44Å; C414-H430 PolarHBondContact SG-NE2 3.41Å; C414-H430 VanDerWaalsContact SG-NE2 3.43Å; C414-H434 PolarHBondContact SG-NE2 2.8Å
415	S	85.1	Confident	76.3	Confident	99 Å²	99	88 Å²	88	69%	0.692	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-20.9	175.9	57.9	0	0	0	0	114.7
416	Q	84.1	Confident	76.8	Confident	126 Å²	126	87.9 Å²	87.9	59%	0.589	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-19.7	-177.5	-69.2	174.4	-15.1	0	0	114.3	C414 H434	C414-Q416 PolarHBondContact O-N 3.13Å; Q416-H434 PolarHBondContact OE1-CD2 3.48Å
417	C	87.1	Confident	77.1	Confident	57 Å²	57	85.5 Å²	85.5	39%	0.385	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.3	6.2	178.1	69.2	0	0	0	0	116	C414 K419 H430 H434	C414-C417 PolarHBondContact O-N 3.44Å; C417-K419 PolarHBondContact O-N 2.81Å; C417-K419 VanDerWaalsContact O-N 3.12Å; C417-H430 PolarHBondContact SG-CE1 3.49Å; C417-H430 PolarHBondContact SG-NE2 3.4Å; C417-H434 PolarHBondContact SG-NE2 3.41Å
418	G	83.4	Confident	77.7	Confident	55 Å²	55	85.7 Å²	85.7	57%	0.567	43%	0.432	S	S	*	.			trans	72	-1	177.9	0	0	0	0	0	115.5	C414 S420	C414-G418 WeakPolarHBondContact O-CA 3.48Å; C414-G418 PolarHBondContact O-N 3.5Å; G418-S420 PolarHBondContact O-N 3.22Å
419	K	83.9	Confident	78.9	Confident	124 Å²	124	83.4 Å²	83.4	54%	0.539	42%	0.416	S	S	.	.			trans	-65.3	127.1	177.2	-70.9	-179.2	-175.1	177.4	0	110.5	C414 C417 F421	C414-K419 WeakPolarHBondContact CB-O 3.34Å; C414-K419 PolarHBondContact N-O 3.02Å; C417-K419 PolarHBondContact O-N 2.81Å; C417-K419 VanDerWaalsContact O-N 3.12Å; K419-F421 HydrophobicContact CB-CE2 3.75Å; K419-F421 HydrophobicContact CB-CZ 3.97Å; K419-F421 WeakPolarHBondContact O-CE2 3.41Å
420	S	77.8	Confident	80.1	Confident	53 Å²	53	77.9 Å²	77.9	37%	0.371	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	142.7	177.5	-40.2	0	0	0	0	112	Y412 G418	Y412-S420 CarbonylContact O-C 3.58Å; Y412-S420 WeakPolarHBondContact O-CA 3.36Å; G418-S420 PolarHBondContact O-N 3.22Å
421	F	79.5	Confident	81.3	Confident	44 Å²	44	73.6 Å²	73.6	19%	0.193	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	136.8	179.9	-59.7	-92.7	0	0	0	110.5	Y412 C414 K419 I423 L427 H430	Y412-F421 PolarHBondContact N-O 3.05Å; Y412-F421 PolarHBondContact O-N 3.39Å; C414-F421 HydrophobicContact CB-CE2 4.5Å; K419-F421 HydrophobicContact CB-CE2 3.75Å; K419-F421 HydrophobicContact CB-CZ 3.97Å; K419-F421 WeakPolarHBondContact O-CE2 3.41Å; F421-I423 PolarHBondContact O-N 3.08Å; F421-L427 HydrophobicContact CB-CB 4.21Å; F421-L427 HydrophobicContact CD2-CB 3.87Å; F421-L427 HydrophobicContact CD2-CD1 3.79Å; F421-L427 HydrophobicContact CD2-CG 4.45Å; F421-L427 HydrophobicContact CE2-CD1 4Å; F421-L427 HydrophobicContact CG-CB 4.18Å; F421-H430 HydrophobicContact CE1-CB 3.85Å; F421-H430 HydrophobicContact CE2-CB 3.87Å; F421-H430 AromaticContact CE2-CD2 3.15Å; F421-H430 WeakPolarHBondContact CE2-CD2 3.38Å; F421-H430 AromaticContact CE2-CG 3.61Å; F421-H430 AromaticContact CE2-NE2 3.91Å; F421-H430 HydrophobicContact CZ-CB 3.36Å; F421-H430 AromaticContact CZ-CD2 3.27Å; F421-H430 WeakPolarHBondContact CZ-CD2 3.47Å; F421-H430 AromaticContact CZ-CG 3.21Å; F421-H430 AromaticContact CZ-ND1 3.96Å; F421-H430 AromaticContact CZ-NE2 3.98Å
422	A	75.5	Confident	81.9	Confident	26 Å²	26	74.9 Å²	74.9	22%	0.215	37%	0.373	C	S	.	.	S	Bend	trans	-68.1	-19.3	175.8	0	0	0	0	0	113.4
423	I	74.1	Confident	82	Confident	22 Å²	22	74.4 Å²	74.4	11%	0.113	38%	0.379	C	S	.	.	S	Bend	trans	-133.5	126.8	-176.9	-51.6	-175.1	0	0	0	109.7	F421 R425 Y426 L427	F421-I423 PolarHBondContact O-N 3.08Å; I423-R425 HydrophobicContact CG2-CB 4.2Å; I423-R425 PolarHBondContact O-N 2.87Å; I423-R425 VanDerWaalsContact O-N 3.12Å; I423-Y426 HydrophobicContact CB-CD2 3.68Å; I423-Y426 HydrophobicContact CB-CE2 3.97Å; I423-Y426 HydrophobicContact CB-CG 4.3Å; I423-Y426 HydrophobicContact CD1-CD2 4.21Å; I423-Y426 HydrophobicContact CD1-CE2 3.57Å; I423-Y426 HydrophobicContact CG1-CD2 4.05Å; I423-Y426 HydrophobicContact CG1-CE2 3.91Å; I423-Y426 WeakPolarHBondContact O-CB 3.45Å; I423-Y426 PolarHBondContact O-N 3.25Å; I423-L427 PolarHBondContact O-N 3.3Å
424	F	80	Confident	82	Confident	104 Å²	104	73.2 Å²	73.2	46%	0.456	37%	0.37	S	S	.	.	H	α-helix	trans	-49.6	-39.8	178.3	-178.8	-106.6	0	0	0	113.9	Y412 Y426 L427 Q428	Y412-F424 HydrophobicContact CD1-CB 4.09Å; Y412-F424 AromaticContact CD1-CD2 3.68Å; Y412-F424 HydrophobicContact CD1-CD2 3.68Å; Y412-F424 HydrophobicContact CD1-CG 4.38Å; Y412-F424 HydrophobicContact CD2-CB 4.2Å; Y412-F424 HydrophobicContact CE1-CB 3.86Å; Y412-F424 AromaticContact CE1-CD2 3.78Å; Y412-F424 HydrophobicContact CE1-CD2 3.78Å; Y412-F424 HydrophobicContact CE1-CG 4.23Å; Y412-F424 HydrophobicContact CE2-CB 4.02Å; Y412-F424 HydrophobicContact CG-CB 4.24Å; Y412-F424 HydrophobicContact CG-CD2 4.38Å; F424-Y426 PolarHBondContact O-N 3.34Å; F424-L427 WeakPolarHBondContact O-CB 3.5Å; F424-L427 PolarHBondContact O-N 3.31Å; F424-L427 VanDerWaalsContact O-N 3.14Å; F424-Q428 HydrophobicContact CD1-CG 3.92Å; F424-Q428 HydrophobicContact CE1-CG 3.55Å; F424-Q428 HydrophobicContact CE2-CG 4.28Å; F424-Q428 HydrophobicContact CG-CG 4.44Å; F424-Q428 HydrophobicContact CZ-CG 3.78Å; F424-Q428 WeakPolarHBondContact O-CG 3.31Å; F424-Q428 PolarHBondContact O-N 3.48Å
425	R	81.6	Confident	81.8	Confident	177 Å²	177	76.7 Å²	76.7	67%	0.668	39%	0.392	S	S	*	.	H	α-helix	trans	-58.6	-33.8	176.7	-168.9	-179.6	72.8	146.5	0.3	112.8	I423 K429	I423-R425 HydrophobicContact CG2-CB 4.2Å; I423-R425 PolarHBondContact O-N 2.87Å; I423-R425 VanDerWaalsContact O-N 3.12Å; R425-K429 PolarHBondContact O-N 3.19Å
426	Y	83.9	Confident	81.3	Confident	89 Å²	89	74.3 Å²	74.3	35%	0.349	38%	0.383	S	S	.	.	H	α-helix	trans	-75	-39.1	176.5	-60.1	-34.1	0	0	0	111.7	H405 I423 F424 Q428 K429 H430	H405-Y426 AromaticContact NE2-CE2 3.9Å; I423-Y426 HydrophobicContact CB-CD2 3.68Å; I423-Y426 HydrophobicContact CB-CE2 3.97Å; I423-Y426 HydrophobicContact CB-CG 4.3Å; I423-Y426 HydrophobicContact CD1-CD2 4.21Å; I423-Y426 HydrophobicContact CD1-CE2 3.57Å; I423-Y426 HydrophobicContact CG1-CD2 4.05Å; I423-Y426 HydrophobicContact CG1-CE2 3.91Å; I423-Y426 WeakPolarHBondContact O-CB 3.45Å; I423-Y426 PolarHBondContact O-N 3.25Å; F424-Y426 PolarHBondContact O-N 3.34Å; Y426-Q428 VanDerWaalsContact C-N 3.33Å; Y426-Q428 PolarHBondContact O-N 2.87Å; Y426-K429 PolarHBondContact O-N 2.99Å; Y426-H430 VanDerWaalsContact O-CB 3.31Å; Y426-H430 WeakPolarHBondContact O-CB 3.37Å; Y426-H430 PolarHBondContact O-N 2.84Å
427	L	82.9	Confident	81.1	Confident	7 Å²	7	74.4 Å²	74.4	4%	0.037	38%	0.383	C	S	.	.	H	α-helix	trans	-57.4	-47.2	169.2	173.6	63.5	0	0	0	110.6	D413 C414 F421 I423 F424 K429 H430 K431	D413-L427 WeakPolarHBondContact O-CD2 3.35Å; C414-L427 HydrophobicContact CB-CD1 3.66Å; F421-L427 HydrophobicContact CB-CB 4.21Å; F421-L427 HydrophobicContact CD2-CB 3.87Å; F421-L427 HydrophobicContact CD2-CD1 3.79Å; F421-L427 HydrophobicContact CD2-CG 4.45Å; F421-L427 HydrophobicContact CE2-CD1 4Å; F421-L427 HydrophobicContact CG-CB 4.18Å; I423-L427 PolarHBondContact O-N 3.3Å; F424-L427 WeakPolarHBondContact O-CB 3.5Å; F424-L427 PolarHBondContact O-N 3.31Å; F424-L427 VanDerWaalsContact O-N 3.14Å; L427-K429 PolarHBondContact O-N 3.28Å; L427-H430 CarbonylContact O-C 3.5Å; L427-H430 WeakPolarHBondContact O-CA 3.45Å; L427-H430 WeakPolarHBondContact O-CB 3.37Å; L427-H430 PolarHBondContact O-N 3.46Å; L427-H430 VanDerWaalsContact O-N 3.1Å; L427-K431 HydrophobicContact CD1-CG 4.11Å; L427-K431 HydrophobicContact CG-CD 4.4Å; L427-K431 HydrophobicContact CG-CG 4.36Å; L427-K431 WeakPolarHBondContact O-CG 3.26Å; L427-K431 PolarHBondContact O-N 2.97Å
428	Q	85.2	Confident	81.1	Confident	78 Å²	78	77.7 Å²	77.7	36%	0.364	39%	0.391	S	S	.	.	H	α-helix	trans	-60.8	-43.4	178.3	-70.7	-61.1	-32.7	0	0	112.3	F424 Y426 H430 K431 K432	F424-Q428 HydrophobicContact CD1-CG 3.92Å; F424-Q428 HydrophobicContact CE1-CG 3.55Å; F424-Q428 HydrophobicContact CE2-CG 4.28Å; F424-Q428 HydrophobicContact CG-CG 4.44Å; F424-Q428 HydrophobicContact CZ-CG 3.78Å; F424-Q428 WeakPolarHBondContact O-CG 3.31Å; F424-Q428 PolarHBondContact O-N 3.48Å; Y426-Q428 VanDerWaalsContact C-N 3.33Å; Y426-Q428 PolarHBondContact O-N 2.87Å; Q428-H430 VanDerWaalsContact C-N 3.27Å; Q428-H430 PolarHBondContact O-N 3.14Å; Q428-K431 PolarHBondContact O-N 3.41Å; Q428-K432 PolarHBondContact O-N 2.96Å
429	K	82.8	Confident	81.1	Confident	116 Å²	116	79.1 Å²	79.1	50%	0.504	39%	0.39	S	S	.	.	H	α-helix	trans	-62.4	-37.9	174.5	-172.6	178.5	176.9	-175.8	0	111.6	R425 Y426 L427 K432 Y451	R425-K429 PolarHBondContact O-N 3.19Å; Y426-K429 PolarHBondContact O-N 2.99Å; L427-K429 PolarHBondContact O-N 3.28Å; K429-K432 WeakPolarHBondContact O-CB 3.46Å; K429-Y451 HydrophobicContact CD-CE1 4.4Å; K429-Y451 HydrophobicContact CG-CE1 3.72Å; K429-Y451 PolarHBondContact O-OH 3.43Å
430	H	83.7	Confident	81.3	Confident	19 Å²	19	77.5 Å²	77.5	9%	0.088	38%	0.381	C	S	.	.	H	α-helix	trans	-72.2	-37.5	177	166.2	58.3	0	0	0	113.1	C414 C417 F421 Y426 L427 Q428 K432 T433 H434	C414-H430 WeakPolarHBondContact CB-NE2 3.44Å; C414-H430 PolarHBondContact SG-NE2 3.41Å; C414-H430 VanDerWaalsContact SG-NE2 3.43Å; C417-H430 PolarHBondContact SG-CE1 3.49Å; C417-H430 PolarHBondContact SG-NE2 3.4Å; F421-H430 HydrophobicContact CE1-CB 3.85Å; F421-H430 HydrophobicContact CE2-CB 3.87Å; F421-H430 AromaticContact CE2-CD2 3.15Å; F421-H430 WeakPolarHBondContact CE2-CD2 3.38Å; F421-H430 AromaticContact CE2-CG 3.61Å; F421-H430 AromaticContact CE2-NE2 3.91Å; F421-H430 HydrophobicContact CZ-CB 3.36Å; F421-H430 AromaticContact CZ-CD2 3.27Å; F421-H430 WeakPolarHBondContact CZ-CD2 3.47Å; F421-H430 AromaticContact CZ-CG 3.21Å; F421-H430 AromaticContact CZ-ND1 3.96Å; F421-H430 AromaticContact CZ-NE2 3.98Å; Y426-H430 VanDerWaalsContact O-CB 3.31Å; Y426-H430 WeakPolarHBondContact O-CB 3.37Å; Y426-H430 PolarHBondContact O-N 2.84Å; L427-H430 CarbonylContact O-C 3.5Å; L427-H430 WeakPolarHBondContact O-CA 3.45Å; L427-H430 WeakPolarHBondContact O-CB 3.37Å; L427-H430 PolarHBondContact O-N 3.46Å; L427-H430 VanDerWaalsContact O-N 3.1Å; Q428-H430 VanDerWaalsContact C-N 3.27Å; Q428-H430 PolarHBondContact O-N 3.14Å; H430-K432 PolarHBondContact O-N 2.88Å; H430-K432 VanDerWaalsContact O-N 3.12Å; H430-T433 PolarHBondContact ND1-OG1 3.46Å; H430-T433 WeakPolarHBondContact O-CA 3.28Å; H430-T433 WeakPolarHBondContact O-CB 3.49Å; H430-T433 PolarHBondContact O-N 2.94Å; H430-T433 PolarHBondContact O-OG1 3.4Å; H430-H434 AromaticContact CE1-NE2 3.42Å; H430-H434 PolarHBondContact CE1-NE2 2.77Å; H430-H434 AromaticContact NE2-NE2 3.34Å; H430-H434 PolarHBondContact NE2-NE2 3.13Å
431	K	83.3	Confident	81.8	Confident	74 Å²	74	82 Å²	82	32%	0.322	39%	0.394	S	S	.	.	H	α-helix	trans	-55.8	-33.1	174.9	-77.1	-174.2	173.5	-171.2	0	111.8	L427 Q428 T433 H434	L427-K431 HydrophobicContact CD1-CG 4.11Å; L427-K431 HydrophobicContact CG-CD 4.4Å; L427-K431 HydrophobicContact CG-CG 4.36Å; L427-K431 WeakPolarHBondContact O-CG 3.26Å; L427-K431 PolarHBondContact O-N 2.97Å; Q428-K431 PolarHBondContact O-N 3.41Å; K431-T433 PolarHBondContact O-N 3.49Å; K431-H434 WeakPolarHBondContact O-CB 3.42Å; K431-H434 PolarHBondContact O-N 2.93Å
432	K	80.7	Confident	82.3	Confident	119 Å²	119	80.1 Å²	80.1	52%	0.517	39%	0.386	S	S	.	.	H	α-helix	trans	-62	-18.7	171.9	-59.8	-171.3	176.3	-162.3	0	114.6	Q428 K429 H430 H434 T435 Y451	Q428-K432 PolarHBondContact O-N 2.96Å; K429-K432 WeakPolarHBondContact O-CB 3.46Å; H430-K432 PolarHBondContact O-N 2.88Å; H430-K432 VanDerWaalsContact O-N 3.12Å; K432-H434 VanDerWaalsContact C-N 3.32Å; K432-T435 PolarHBondContact O-OG1 3.4Å; K432-T435 VanDerWaalsContact O-OG1 3.13Å; K432-Y451 HydrophobicContact CD-CE1 4.44Å
433	T	79.3	Confident	82.9	Confident	77 Å²	77	84.8 Å²	84.8	47%	0.472	41%	0.412	S	S	.	.	H	α-helix	trans	-75.8	-23.6	174.4	67.2	0	0	0	0	112.3	H430 K431	H430-T433 PolarHBondContact ND1-OG1 3.46Å; H430-T433 WeakPolarHBondContact O-CA 3.28Å; H430-T433 WeakPolarHBondContact O-CB 3.49Å; H430-T433 PolarHBondContact O-N 2.94Å; H430-T433 PolarHBondContact O-OG1 3.4Å; K431-T433 PolarHBondContact O-N 3.49Å
434	H	82.4	Confident	83.4	Confident	72 Å²	72	90.1 Å²	90.1	33%	0.333	44%	0.436	S	S	.	.	H	α-helix	trans	-81.1	-33.1	176.1	-68.3	-63.5	0	0	0	113.1	C414 Q416 C417 H430 K431 K432 G436	C414-H434 PolarHBondContact SG-NE2 2.8Å; Q416-H434 PolarHBondContact OE1-CD2 3.48Å; C417-H434 PolarHBondContact SG-NE2 3.41Å; H430-H434 AromaticContact CE1-NE2 3.42Å; H430-H434 PolarHBondContact CE1-NE2 2.77Å; H430-H434 AromaticContact NE2-NE2 3.34Å; H430-H434 PolarHBondContact NE2-NE2 3.13Å; K431-H434 WeakPolarHBondContact O-CB 3.42Å; K431-H434 PolarHBondContact O-N 2.93Å; K432-H434 VanDerWaalsContact C-N 3.32Å; H434-G436 PolarHBondContact O-N 2.94Å
435	T	82	Confident	83.9	Confident	73 Å²	73	87.9 Å²	87.9	45%	0.448	43%	0.433	S	S	.	.	S	Bend	trans	-67.6	-19.6	178.2	63.5	0	0	0	0	112.1	K432 E437	K432-T435 PolarHBondContact O-OG1 3.4Å; K432-T435 VanDerWaalsContact O-OG1 3.13Å; T435-E437 PolarHBondContact O-N 3.18Å
436	G	74	Confident	84.2	Confident	49 Å²	49	81.8 Å²	81.8	51%	0.505	43%	0.426	S	S	.	.			trans	63.8	3	-177.3	0	0	0	0	0	113.9	H434 K438	H434-G436 PolarHBondContact O-N 2.94Å; G436-K438 PolarHBondContact O-N 3.22Å
437	E	80.8	Confident	84.4	Confident	128 Å²	128	83.8 Å²	83.8	60%	0.598	44%	0.436	S	S	*	.			trans	-63.7	125.2	-175.1	-74.2	172.4	-160.3	0	0	110.4	T435 P439 A450	T435-E437 PolarHBondContact O-N 3.18Å; E437-P439 VanDerWaalsContact O-CD 3.23Å; E437-P439 WeakPolarHBondContact O-CD 3.29Å; E437-A450 WeakPolarHBondContact O-CA 3.46Å; E437-A450 WeakPolarHBondContact O-CB 3.29Å
438	K	85.5	Confident	84.7	Confident	125 Å²	125	85 Å²	85	54%	0.543	45%	0.447	S	S	.	.			trans	-118.1	69.3	178.9	-71.5	168.7	175.3	-176.2	0	110	G436 Y440 A448 F449	G436-K438 PolarHBondContact O-N 3.22Å; K438-Y440 PolarHBondContact O-N 2.92Å; K438-A448 HydrophobicContact CB-CB 3.62Å; K438-A448 HydrophobicContact CD-CB 4.4Å; K438-A448 WeakPolarHBondContact CD-O 3.45Å; K438-F449 CarbonylContact C-O 3.5Å; K438-F449 VanDerWaalsContact CA-O 3.31Å; K438-F449 WeakPolarHBondContact CA-O 3.48Å
439	P	84	Confident	84.7	Confident	85 Å²	85	83.2 Å²	83.2	55%	0.552	44%	0.438	S	S	*	.			trans	-70.4	-18.5	-173.8	27.2	-33.5	0	0	0	113.2	E437 K441	E437-P439 VanDerWaalsContact O-CD 3.23Å; E437-P439 WeakPolarHBondContact O-CD 3.29Å; P439-K441 PolarHBondContact O-N 3.22Å
440	Y	88.9	Confident	84.8	Confident	90 Å²	90	79 Å²	79	35%	0.353	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	98	-176	-55.9	-74.9	0	0	0	110.6	K438 A448 F449 R452	K438-Y440 PolarHBondContact O-N 2.92Å; Y440-A448 CarbonylContact O-C 3.51Å; Y440-A448 WeakPolarHBondContact O-CA 3.27Å; Y440-F449 WeakPolarHBondContact CB-O 3.43Å; Y440-F449 WeakPolarHBondContact CD2-O 3.37Å; Y440-F449 PolarHBondContact N-O 3.14Å; Y440-F449 VanDerWaalsContact N-O 3.15Å; Y440-F449 PolarHBondContact O-N 2.81Å; Y440-R452 HydrophobicContact CD1-CB 3.94Å; Y440-R452 HydrophobicContact CD1-CG 4.24Å; Y440-R452 HydrophobicContact CD2-CB 4.44Å; Y440-R452 VanDerWaalsContact CD2-N 3.27Å; Y440-R452 HydrophobicContact CE1-CB 3.81Å; Y440-R452 HydrophobicContact CE1-CG 4.28Å; Y440-R452 HydrophobicContact CE2-CB 4.31Å; Y440-R452 HydrophobicContact CG-CB 4.25Å
441	K	88.4	Confident	84.8	Confident	149 Å²	149	80.4 Å²	80.4	65%	0.648	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.9	134.9	178.6	-65.9	-178.5	178.6	-179.6	0	111.1	P439 A448	P439-K441 PolarHBondContact O-N 3.22Å; K441-A448 HydrophobicContact CG-CB 3.9Å
442	C	89.5	Confident	84.9	Confident	4 Å²	4	85.8 Å²	85.8	3%	0.027	45%	0.448	C	S	.	.			trans	-71.2	128.1	169.6	-177.7	0	0	0	0	110	H444 G446 K447 L455	C442-H444 VanDerWaalsContact C-N 3.31Å; C442-H444 PolarHBondContact SG-N 2.85Å; C442-H444 VanDerWaalsContact SG-N 3.45Å; C442-G446 WeakPolarHBondContact O-CA 3.46Å; C442-G446 PolarHBondContact O-N 3.43Å; C442-K447 WeakPolarHBondContact CB-O 3.43Å; C442-K447 PolarHBondContact N-O 2.96Å; C442-L455 VanDerWaalsContact CA-CD1 3.42Å; C442-L455 HydrophobicContact CB-CD1 3.54Å
443	T	87.6	Confident	85	Confident	123 Å²	123	83.6 Å²	83.6	76%	0.755	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-26.9	177.9	51	0	0	0	0	112.7
444	H	85.2	Confident	85.4	Confident	134 Å²	134	82.1 Å²	82.1	62%	0.62	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-35.3	-177.4	-65.5	-73	0	0	0	114.3	C442	C442-H444 VanDerWaalsContact C-N 3.31Å; C442-H444 PolarHBondContact SG-N 2.85Å; C442-H444 VanDerWaalsContact SG-N 3.45Å
445	C	90.1	Very high	85.5	Confident	57 Å²	57	79.5 Å²	79.5	39%	0.385	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.9	4.4	-178.5	73.9	0	0	0	0	115.3	K447 H458 H462	C445-K447 PolarHBondContact O-N 3.31Å; C445-K447 VanDerWaalsContact O-N 3.09Å; C445-K447 VanDerWaalsContact SG-CG 3.57Å; C445-H458 VanDerWaalsContact SG-CE1 3.5Å; C445-H458 PolarHBondContact SG-NE2 3.33Å; C445-H462 PolarHBondContact SG-NE2 3.48Å; C445-H462 VanDerWaalsContact SG-NE2 3.36Å
446	G	87.2	Confident	85.6	Confident	50 Å²	50	81.9 Å²	81.9	52%	0.515	43%	0.427	S	S	.	.			trans	74.2	-6.8	177.6	0	0	0	0	0	115.6	C442 A448	C442-G446 WeakPolarHBondContact O-CA 3.46Å; C442-G446 PolarHBondContact O-N 3.43Å; G446-A448 PolarHBondContact O-N 2.86Å
447	K	89.2	Confident	86.1	Confident	131 Å²	131	86.1 Å²	86.1	57%	0.57	43%	0.428	S	S	*	.			trans	-58.3	130.6	178.2	-73.6	-179.2	-175	176.2	0	110.8	C442 C445 F449	C442-K447 WeakPolarHBondContact CB-O 3.43Å; C442-K447 PolarHBondContact N-O 2.96Å; C445-K447 PolarHBondContact O-N 3.31Å; C445-K447 VanDerWaalsContact O-N 3.09Å; C445-K447 VanDerWaalsContact SG-CG 3.57Å; K447-F449 HydrophobicContact CB-CE2 3.77Å; K447-F449 HydrophobicContact CB-CZ 3.88Å; K447-F449 WeakPolarHBondContact O-CD2 3.44Å; K447-F449 VanDerWaalsContact O-CE2 3.29Å; K447-F449 WeakPolarHBondContact O-CE2 3.32Å
448	A	88.3	Confident	86.3	Confident	31 Å²	31	81.1 Å²	81.1	26%	0.256	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	141.3	-176.5	0	0	0	0	0	111.6	K438 Y440 K441 G446	K438-A448 HydrophobicContact CB-CB 3.62Å; K438-A448 HydrophobicContact CD-CB 4.4Å; K438-A448 WeakPolarHBondContact CD-O 3.45Å; Y440-A448 CarbonylContact O-C 3.51Å; Y440-A448 WeakPolarHBondContact O-CA 3.27Å; K441-A448 HydrophobicContact CG-CB 3.9Å; G446-A448 PolarHBondContact O-N 2.86Å
449	F	86.3	Confident	86.2	Confident	42 Å²	42	77.7 Å²	77.7	18%	0.184	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	146.5	-176.2	-58.2	-88.8	0	0	0	111.5	K438 Y440 K447 Y451 N454 L455 H458	K438-F449 CarbonylContact C-O 3.5Å; K438-F449 VanDerWaalsContact CA-O 3.31Å; K438-F449 WeakPolarHBondContact CA-O 3.48Å; Y440-F449 WeakPolarHBondContact CB-O 3.43Å; Y440-F449 WeakPolarHBondContact CD2-O 3.37Å; Y440-F449 PolarHBondContact N-O 3.14Å; Y440-F449 VanDerWaalsContact N-O 3.15Å; Y440-F449 PolarHBondContact O-N 2.81Å; K447-F449 HydrophobicContact CB-CE2 3.77Å; K447-F449 HydrophobicContact CB-CZ 3.88Å; K447-F449 WeakPolarHBondContact O-CD2 3.44Å; K447-F449 VanDerWaalsContact O-CE2 3.29Å; K447-F449 WeakPolarHBondContact O-CE2 3.32Å; F449-Y451 VanDerWaalsContact C-N 3.3Å; F449-Y451 PolarHBondContact O-N 3.09Å; F449-N454 HydrophobicContact CB-CB 3.96Å; F449-N454 HydrophobicContact CD1-CB 3.81Å; F449-N454 HydrophobicContact CG-CB 4.12Å; F449-L455 HydrophobicContact CB-CB 4.37Å; F449-L455 HydrophobicContact CD2-CB 3.91Å; F449-L455 HydrophobicContact CD2-CD1 3.9Å; F449-L455 HydrophobicContact CE2-CD1 4.06Å; F449-L455 HydrophobicContact CG-CB 4.36Å; F449-H458 HydrophobicContact CE1-CB 3.97Å; F449-H458 HydrophobicContact CE2-CB 3.84Å; F449-H458 AromaticContact CE2-CD2 3.25Å; F449-H458 WeakPolarHBondContact CE2-CD2 3.46Å; F449-H458 AromaticContact CE2-CG 3.64Å; F449-H458 HydrophobicContact CZ-CB 3.39Å; F449-H458 AromaticContact CZ-CD2 3.36Å; F449-H458 WeakPolarHBondContact CZ-CD2 3.5Å; F449-H458 AromaticContact CZ-CG 3.26Å; F449-H458 AromaticContact CZ-ND1 3.99Å
450	A	83.9	Confident	86.2	Confident	27 Å²	27	75 Å²	75	22%	0.223	37%	0.369	C	S	.	.	S	Bend	trans	-71	-24.2	178	0	0	0	0	0	113.4	E437	E437-A450 WeakPolarHBondContact O-CA 3.46Å; E437-A450 WeakPolarHBondContact O-CB 3.29Å
451	Y	84.1	Confident	85.8	Confident	48 Å²	48	74 Å²	74	19%	0.188	37%	0.374	C	S	.	.	S	Bend	trans	-132.2	140.1	-178.3	-54.3	-69.1	0	0	0	111.2	K429 K432 F449 S453 N454 L455	K429-Y451 HydrophobicContact CD-CE1 4.4Å; K429-Y451 HydrophobicContact CG-CE1 3.72Å; K429-Y451 PolarHBondContact O-OH 3.43Å; K432-Y451 HydrophobicContact CD-CE1 4.44Å; F449-Y451 VanDerWaalsContact C-N 3.3Å; F449-Y451 PolarHBondContact O-N 3.09Å; Y451-S453 PolarHBondContact O-N 3.23Å; Y451-N454 WeakPolarHBondContact O-CB 3.23Å; Y451-N454 PolarHBondContact O-N 3.01Å; Y451-L455 PolarHBondContact O-N 3.41Å
452	R	85.8	Confident	85.5	Confident	187 Å²	187	70.7 Å²	70.7	71%	0.706	36%	0.361	S	S	*	.	H	α-helix	trans	-55.8	-34.6	176.7	-167.7	174.3	-177.8	168.6	1.3	113.2	Y440 N454 L455 Y456	Y440-R452 HydrophobicContact CD1-CB 3.94Å; Y440-R452 HydrophobicContact CD1-CG 4.24Å; Y440-R452 HydrophobicContact CD2-CB 4.44Å; Y440-R452 VanDerWaalsContact CD2-N 3.27Å; Y440-R452 HydrophobicContact CE1-CB 3.81Å; Y440-R452 HydrophobicContact CE1-CG 4.28Å; Y440-R452 HydrophobicContact CE2-CB 4.31Å; Y440-R452 HydrophobicContact CG-CB 4.25Å; R452-N454 VanDerWaalsContact C-N 3.28Å; R452-N454 PolarHBondContact O-N 3.25Å; R452-L455 PolarHBondContact O-N 3.35Å; R452-Y456 PolarHBondContact O-N 3.35Å
453	S	82.9	Confident	85.2	Confident	73 Å²	73	74.8 Å²	74.8	51%	0.51	39%	0.386	S	S	.	.	H	α-helix	trans	-63.2	-33.4	175.5	57.1	0	0	0	0	113.2	Y451 R457	Y451-S453 PolarHBondContact O-N 3.23Å; S453-R457 VanDerWaalsContact O-CB 3.31Å; S453-R457 WeakPolarHBondContact O-CB 3.36Å; S453-R457 PolarHBondContact O-N 3.24Å
454	N	86.4	Confident	84.5	Confident	47 Å²	47	71.4 Å²	71.4	25%	0.251	38%	0.376	S	S	.	.	H	α-helix	trans	-75.2	-37.3	178.4	-68.6	-0.4	0	0	0	110.9	F449 Y451 R452 H458	F449-N454 HydrophobicContact CB-CB 3.96Å; F449-N454 HydrophobicContact CD1-CB 3.81Å; F449-N454 HydrophobicContact CG-CB 4.12Å; Y451-N454 WeakPolarHBondContact O-CB 3.23Å; Y451-N454 PolarHBondContact O-N 3.01Å; R452-N454 VanDerWaalsContact C-N 3.28Å; R452-N454 PolarHBondContact O-N 3.25Å; N454-H458 WeakPolarHBondContact O-CB 3.38Å; N454-H458 PolarHBondContact O-N 3.29Å
455	L	86.3	Confident	84.2	Confident	17 Å²	17	69.3 Å²	69.3	9%	0.089	37%	0.366	C	S	.	.	H	α-helix	trans	-60.4	-53.9	171.3	171.9	60.4	0	0	0	110.5	C442 F449 Y451 R452 R457 H458 E459	C442-L455 VanDerWaalsContact CA-CD1 3.42Å; C442-L455 HydrophobicContact CB-CD1 3.54Å; F449-L455 HydrophobicContact CB-CB 4.37Å; F449-L455 HydrophobicContact CD2-CB 3.91Å; F449-L455 HydrophobicContact CD2-CD1 3.9Å; F449-L455 HydrophobicContact CE2-CD1 4.06Å; F449-L455 HydrophobicContact CG-CB 4.36Å; Y451-L455 PolarHBondContact O-N 3.41Å; R452-L455 PolarHBondContact O-N 3.35Å; L455-R457 VanDerWaalsContact C-N 3.29Å; L455-R457 PolarHBondContact O-N 3.45Å; L455-H458 CarbonylContact O-C 3.53Å; L455-H458 WeakPolarHBondContact O-CA 3.18Å; L455-H458 WeakPolarHBondContact O-CB 3.45Å; L455-H458 PolarHBondContact O-N 3.31Å; L455-E459 HydrophobicContact CD1-CG 3.87Å; L455-E459 WeakPolarHBondContact CD1-OE1 3.39Å; L455-E459 HydrophobicContact CG-CG 4.26Å; L455-E459 WeakPolarHBondContact O-CG 3.16Å; L455-E459 PolarHBondContact O-N 2.72Å
456	Y	83.8	Confident	83.7	Confident	123 Å²	123	73.3 Å²	73.3	48%	0.482	38%	0.377	S	S	.	.	H	α-helix	trans	-59.2	-40	179.5	178.8	-109.6	0	0	0	112.4	R452 H458 E459 R460	R452-Y456 PolarHBondContact O-N 3.35Å; Y456-H458 VanDerWaalsContact C-N 3.29Å; Y456-H458 PolarHBondContact O-N 3.08Å; Y456-E459 PolarHBondContact O-N 3.2Å; Y456-R460 PolarHBondContact O-N 3.29Å; Y456-R460 PolarHBondContact OH-NH2 2.91Å; Y456-R460 VanDerWaalsContact OH-NH2 3.12Å
457	R	83.4	Confident	83.4	Confident	138 Å²	138	74.9 Å²	74.9	52%	0.521	37%	0.374	S	S	.	.	H	α-helix	trans	-61.7	-37.7	172.7	-175.9	177.6	63.5	-176.5	0.5	112.1	S453 L455 Y479	S453-R457 VanDerWaalsContact O-CB 3.31Å; S453-R457 WeakPolarHBondContact O-CB 3.36Å; S453-R457 PolarHBondContact O-N 3.24Å; L455-R457 VanDerWaalsContact C-N 3.29Å; L455-R457 PolarHBondContact O-N 3.45Å; R457-Y479 HydrophobicContact CG-CD1 3.8Å; R457-Y479 HydrophobicContact CG-CE1 3.41Å; R457-Y479 VanDerWaalsContact CG-CE1 3.41Å; R457-Y479 WeakPolarHBondContact O-CE1 3.44Å; R457-Y479 PolarHBondContact O-OH 3.03Å
458	H	84.8	Confident	83	Confident	22 Å²	22	72.1 Å²	72.1	10%	0.102	36%	0.36	C	S	.	.	H	α-helix	trans	-74.2	-37.9	177.5	163.4	61.2	0	0	0	112.5	C445 F449 N454 L455 Y456 R460 S461 H462	C445-H458 VanDerWaalsContact SG-CE1 3.5Å; C445-H458 PolarHBondContact SG-NE2 3.33Å; F449-H458 HydrophobicContact CE1-CB 3.97Å; F449-H458 HydrophobicContact CE2-CB 3.84Å; F449-H458 AromaticContact CE2-CD2 3.25Å; F449-H458 WeakPolarHBondContact CE2-CD2 3.46Å; F449-H458 AromaticContact CE2-CG 3.64Å; F449-H458 HydrophobicContact CZ-CB 3.39Å; F449-H458 AromaticContact CZ-CD2 3.36Å; F449-H458 WeakPolarHBondContact CZ-CD2 3.5Å; F449-H458 AromaticContact CZ-CG 3.26Å; F449-H458 AromaticContact CZ-ND1 3.99Å; N454-H458 WeakPolarHBondContact O-CB 3.38Å; N454-H458 PolarHBondContact O-N 3.29Å; L455-H458 CarbonylContact O-C 3.53Å; L455-H458 WeakPolarHBondContact O-CA 3.18Å; L455-H458 WeakPolarHBondContact O-CB 3.45Å; L455-H458 PolarHBondContact O-N 3.31Å; Y456-H458 VanDerWaalsContact C-N 3.29Å; Y456-H458 PolarHBondContact O-N 3.08Å; H458-R460 PolarHBondContact O-N 3.06Å; H458-S461 PolarHBondContact ND1-OG 3.47Å; H458-S461 VanDerWaalsContact O-CB 3.29Å; H458-S461 WeakPolarHBondContact O-CB 3.4Å; H458-S461 PolarHBondContact O-N 3.41Å; H458-S461 PolarHBondContact O-OG 2.84Å; H458-H462 AromaticContact CE1-NE2 3.46Å; H458-H462 PolarHBondContact CE1-NE2 2.97Å; H458-H462 AromaticContact NE2-CD2 3.98Å; H458-H462 AromaticContact NE2-NE2 3.36Å; H458-H462 PolarHBondContact NE2-NE2 3.46Å
459	E	84.4	Confident	82.9	Confident	54 Å²	54	76.3 Å²	76.3	25%	0.252	37%	0.374	S	S	.	.	H	α-helix	trans	-59.4	-30.6	176.5	-73.8	170.1	161	0	0	111.9	L455 Y456 S461 H462 T463	L455-E459 HydrophobicContact CD1-CG 3.87Å; L455-E459 WeakPolarHBondContact CD1-OE1 3.39Å; L455-E459 HydrophobicContact CG-CG 4.26Å; L455-E459 WeakPolarHBondContact O-CG 3.16Å; L455-E459 PolarHBondContact O-N 2.72Å; Y456-E459 PolarHBondContact O-N 3.2Å; E459-S461 PolarHBondContact O-N 2.63Å; E459-H462 WeakPolarHBondContact O-CB 3.2Å; E459-H462 PolarHBondContact O-N 2.81Å; E459-T463 PolarHBondContact O-N 3.26Å
460	R	82.5	Confident	82.9	Confident	29 Å²	29	74.3 Å²	74.3	11%	0.109	37%	0.366	C	S	.	.	H	α-helix	trans	-59	-25.6	170.8	-67.7	176.7	179	-157.3	-8.1	114.2	Y456 H458 H462 T463 G464 Y468	Y456-R460 PolarHBondContact O-N 3.29Å; Y456-R460 PolarHBondContact OH-NH2 2.91Å; Y456-R460 VanDerWaalsContact OH-NH2 3.12Å; H458-R460 PolarHBondContact O-N 3.06Å; R460-H462 VanDerWaalsContact C-N 3.26Å; R460-H462 PolarHBondContact O-N 3.14Å; R460-T463 PolarHBondContact O-OG1 3.42Å; R460-G464 PolarHBondContact O-N 3.01Å; R460-Y468 PolarHBondContact NH1-OH 3.41Å
461	S	80.8	Confident	82.9	Confident	67 Å²	67	80 Å²	80	47%	0.469	39%	0.392	S	S	.	.	H	α-helix	trans	-72.5	-20.2	173.6	71.9	0	0	0	0	113.2	H458 E459	H458-S461 PolarHBondContact ND1-OG 3.47Å; H458-S461 VanDerWaalsContact O-CB 3.29Å; H458-S461 WeakPolarHBondContact O-CB 3.4Å; H458-S461 PolarHBondContact O-N 3.41Å; H458-S461 PolarHBondContact O-OG 2.84Å; E459-S461 PolarHBondContact O-N 2.63Å
462	H	83.6	Confident	82.8	Confident	81 Å²	81	83.7 Å²	83.7	38%	0.375	41%	0.411	S	S	.	.	H	α-helix	trans	-84.7	-39.2	173.8	-68.2	-58.9	0	0	0	111.8	C445 H458 E459 R460 G464	C445-H462 PolarHBondContact SG-NE2 3.48Å; C445-H462 VanDerWaalsContact SG-NE2 3.36Å; H458-H462 AromaticContact CE1-NE2 3.46Å; H458-H462 PolarHBondContact CE1-NE2 2.97Å; H458-H462 AromaticContact NE2-CD2 3.98Å; H458-H462 AromaticContact NE2-NE2 3.36Å; H458-H462 PolarHBondContact NE2-NE2 3.46Å; E459-H462 WeakPolarHBondContact O-CB 3.2Å; E459-H462 PolarHBondContact O-N 2.81Å; R460-H462 VanDerWaalsContact C-N 3.26Å; R460-H462 PolarHBondContact O-N 3.14Å; H462-G464 VanDerWaalsContact C-N 3.35Å
463	T	81.8	Confident	82.9	Confident	89 Å²	89	77.6 Å²	77.6	55%	0.546	40%	0.396	S	S	.	.	H	α-helix	trans	-78.3	-20.2	179.8	60.6	0	0	0	0	113.1	E459 R460 E465	E459-T463 PolarHBondContact O-N 3.26Å; R460-T463 PolarHBondContact O-OG1 3.42Å; T463-E465 PolarHBondContact O-N 3.35Å; T463-E465 WeakPolarHBondContact OG1-CB 3.22Å; T463-E465 PolarHBondContact OG1-N 3.41Å
464	G	73.7	Confident	83.1	Confident	52 Å²	52	75.9 Å²	75.9	54%	0.536	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	12.7	-174.1	0	0	0	0	0	113.5	R460 H462 K466	R460-G464 PolarHBondContact O-N 3.01Å; H462-G464 VanDerWaalsContact C-N 3.35Å; G464-K466 PolarHBondContact O-N 3.49Å
465	E	78.6	Confident	83	Confident	90 Å²	90	78.2 Å²	78.2	42%	0.421	40%	0.399	S	S	.	.			trans	-69.3	115.9	-171.6	-163.1	-177.5	-168.2	0	0	111.4	T463 L467	T463-E465 PolarHBondContact O-N 3.35Å; T463-E465 WeakPolarHBondContact OG1-CB 3.22Å; T463-E465 PolarHBondContact OG1-N 3.41Å; E465-L467 HydrophobicContact CG-CD2 3.95Å; E465-L467 HydrophobicContact CG-CG 4.01Å
466	K	80.9	Confident	83	Confident	141 Å²	141	79 Å²	79	61%	0.613	41%	0.407	S	S	*	.			trans	-103.7	87.1	-178.6	-69.7	171.4	171.5	-172.7	0	110.4	G464 A476 F477	G464-K466 PolarHBondContact O-N 3.49Å; K466-A476 HydrophobicContact CB-CB 3.7Å; K466-A476 HydrophobicContact CD-CB 4.24Å; K466-A476 WeakPolarHBondContact CD-O 3.46Å; K466-F477 CarbonylContact C-O 3.59Å
467	L	79	Confident	83	Confident	84 Å²	84	75.2 Å²	75.2	44%	0.44	39%	0.394	S	S	.	.			trans	-83.3	-13.2	-174.6	-65.9	172	0	0	0	114.8	E465 F477	E465-L467 HydrophobicContact CG-CD2 3.95Å; E465-L467 HydrophobicContact CG-CG 4.01Å; L467-F477 PolarHBondContact N-O 3.1Å
468	Y	82.5	Confident	82.9	Confident	73 Å²	73	69.8 Å²	69.8	29%	0.286	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	97.8	-171.6	-58	-76.1	0	0	0	110.6	R460 A476 F477 A478 H480	R460-Y468 PolarHBondContact NH1-OH 3.41Å; Y468-A476 CarbonylContact O-C 3.45Å; Y468-A476 WeakPolarHBondContact O-CA 3.38Å; Y468-F477 PolarHBondContact N-O 2.98Å; Y468-F477 PolarHBondContact O-N 3.34Å; Y468-A478 WeakPolarHBondContact CE2-O 3.41Å; Y468-H480 HydrophobicContact CD1-CB 4.25Å; Y468-H480 HydrophobicContact CE1-CB 4.09Å; Y468-H480 HydrophobicContact CE2-CB 4.36Å; Y468-H480 HydrophobicContact CG-CB 4.48Å
469	E	85.3	Confident	82.7	Confident	119 Å²	119	72.2 Å²	72.2	56%	0.556	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	140.3	178.6	-163.6	176.6	161.3	0	0	111.8	N471 G474	E469-N471 PolarHBondContact O-N 3.15Å; E469-G474 WeakPolarHBondContact CG-O 3.37Å; E469-G474 WeakPolarHBondContact OE1-CA 3.46Å
470	C	85.5	Confident	82.6	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	40%	0.4	C	S	.	.			trans	-80.8	112.4	169.2	-171.8	0	0	0	0	109.8	E472 C473 G474 K475 L483 H486 H490	C470-E472 PolarHBondContact O-N 3.44Å; C470-C473 PolarHBondContact O-N 2.95Å; C470-G474 VanDerWaalsContact O-CA 3.29Å; C470-G474 WeakPolarHBondContact O-CA 3.46Å; C470-G474 PolarHBondContact O-N 3.43Å; C470-K475 PolarHBondContact N-O 3.01Å; C470-L483 HydrophobicContact CB-CD1 3.6Å; C470-H486 PolarHBondContact SG-NE2 3Å; C470-H486 VanDerWaalsContact SG-NE2 3.42Å; C470-H490 PolarHBondContact SG-NE2 3.34Å; C470-H490 VanDerWaalsContact SG-NE2 3.42Å
471	N	85.6	Confident	82.6	Confident	147 Å²	147	78.2 Å²	78.2	79%	0.786	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.4	178.1	-61.2	-1	0	0	0	114	E469	E469-N471 PolarHBondContact O-N 3.15Å
472	E	81.5	Confident	82.7	Confident	124 Å²	124	77 Å²	77	58%	0.579	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-26.2	-177.4	-67.3	172.3	-152	0	0	113	C470 H490	C470-E472 PolarHBondContact O-N 3.44Å; E472-H490 WeakPolarHBondContact OE2-CB 3.34Å; E472-H490 IonicContact OE2-CD2 3.2Å; E472-H490 PolarHBondContact OE2-CD2 3.13Å; E472-H490 IonicContact OE2-CG 2.94Å; E472-H490 IonicContact OE2-ND1 3.51Å; E472-H490 IonicContact OE2-NE2 3.92Å
473	C	88.4	Confident	82.8	Confident	59 Å²	59	73.8 Å²	73.8	40%	0.399	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.5	3	-178.6	70.3	0	0	0	0	115.8	C470 K475 H486	C470-C473 PolarHBondContact O-N 2.95Å; C473-K475 PolarHBondContact O-N 3.34Å; C473-K475 VanDerWaalsContact O-N 3.15Å; C473-H486 VanDerWaalsContact SG-CE1 3.57Å; C473-H486 PolarHBondContact SG-NE2 3.44Å
474	G	85.5	Confident	82.8	Confident	38 Å²	38	74 Å²	74	39%	0.392	39%	0.394	S	S	.	.			trans	71.3	-0.8	-179.1	0	0	0	0	0	115.4	E469 C470 A476	E469-G474 WeakPolarHBondContact CG-O 3.37Å; E469-G474 WeakPolarHBondContact OE1-CA 3.46Å; C470-G474 VanDerWaalsContact O-CA 3.29Å; C470-G474 WeakPolarHBondContact O-CA 3.46Å; C470-G474 PolarHBondContact O-N 3.43Å; G474-A476 PolarHBondContact O-N 3.46Å
475	K	86	Confident	83.2	Confident	96 Å²	96	75.7 Å²	75.7	42%	0.417	39%	0.391	S	S	.	.			trans	-64.1	121.9	179	-75.1	-178.4	177.9	178.8	0	110.3	C470 C473 F477	C470-K475 PolarHBondContact N-O 3.01Å; C473-K475 PolarHBondContact O-N 3.34Å; C473-K475 VanDerWaalsContact O-N 3.15Å; K475-F477 HydrophobicContact CB-CE2 3.71Å; K475-F477 HydrophobicContact CB-CZ 3.89Å; K475-F477 WeakPolarHBondContact O-CD2 3.38Å; K475-F477 VanDerWaalsContact O-CE2 3.23Å; K475-F477 WeakPolarHBondContact O-CE2 3.33Å
476	A	85.4	Confident	83.4	Confident	33 Å²	33	72.7 Å²	72.7	27%	0.273	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	136.6	178.9	0	0	0	0	0	112.1	K466 Y468 G474	K466-A476 HydrophobicContact CB-CB 3.7Å; K466-A476 HydrophobicContact CD-CB 4.24Å; K466-A476 WeakPolarHBondContact CD-O 3.46Å; Y468-A476 CarbonylContact O-C 3.45Å; Y468-A476 WeakPolarHBondContact O-CA 3.38Å; G474-A476 PolarHBondContact O-N 3.46Å
477	F	83.7	Confident	83.6	Confident	44 Å²	44	69.3 Å²	69.3	19%	0.193	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	146.1	-177.2	-59	-90.5	0	0	0	110.8	K466 L467 Y468 K475 Y479 L483 H486	K466-F477 CarbonylContact C-O 3.59Å; L467-F477 PolarHBondContact N-O 3.1Å; Y468-F477 PolarHBondContact N-O 2.98Å; Y468-F477 PolarHBondContact O-N 3.34Å; K475-F477 HydrophobicContact CB-CE2 3.71Å; K475-F477 HydrophobicContact CB-CZ 3.89Å; K475-F477 WeakPolarHBondContact O-CD2 3.38Å; K475-F477 VanDerWaalsContact O-CE2 3.23Å; K475-F477 WeakPolarHBondContact O-CE2 3.33Å; F477-Y479 VanDerWaalsContact C-N 3.26Å; F477-Y479 PolarHBondContact O-N 3.1Å; F477-L483 HydrophobicContact CB-CB 4.37Å; F477-L483 HydrophobicContact CD2-CB 3.91Å; F477-L483 HydrophobicContact CD2-CD1 3.85Å; F477-L483 HydrophobicContact CD2-CG 4.49Å; F477-L483 HydrophobicContact CE2-CD1 3.98Å; F477-L483 HydrophobicContact CG-CB 4.32Å; F477-H486 HydrophobicContact CE1-CB 4.03Å; F477-H486 HydrophobicContact CE2-CB 3.87Å; F477-H486 AromaticContact CE2-CD2 3.4Å; F477-H486 WeakPolarHBondContact CE2-CD2 3.38Å; F477-H486 AromaticContact CE2-CG 3.6Å; F477-H486 HydrophobicContact CZ-CB 3.44Å; F477-H486 VanDerWaalsContact CZ-CB 3.44Å; F477-H486 AromaticContact CZ-CD2 3.56Å; F477-H486 AromaticContact CZ-CG 3.26Å; F477-H486 AromaticContact CZ-ND1 3.77Å
478	A	81.5	Confident	83.7	Confident	23 Å²	23	68.8 Å²	68.8	19%	0.19	36%	0.356	C	S	.	.	S	Bend	trans	-69.6	-25	174.6	0	0	0	0	0	112.8	Y468	Y468-A478 WeakPolarHBondContact CE2-O 3.41Å
479	Y	81	Confident	83.6	Confident	73 Å²	73	68.1 Å²	68.1	29%	0.286	36%	0.362	S	S	.	.	S	Bend	trans	-129.3	137.7	-173.6	-49.7	-62.2	0	0	0	112.4	R457 F477 T481 S482 L483	R457-Y479 HydrophobicContact CG-CD1 3.8Å; R457-Y479 HydrophobicContact CG-CE1 3.41Å; R457-Y479 VanDerWaalsContact CG-CE1 3.41Å; R457-Y479 WeakPolarHBondContact O-CE1 3.44Å; R457-Y479 PolarHBondContact O-OH 3.03Å; F477-Y479 VanDerWaalsContact C-N 3.26Å; F477-Y479 PolarHBondContact O-N 3.1Å; Y479-T481 PolarHBondContact O-N 3.24Å; Y479-S482 WeakPolarHBondContact O-CB 3.42Å; Y479-S482 PolarHBondContact O-N 3.41Å; Y479-L483 PolarHBondContact O-N 3.35Å; Y479-L483 VanDerWaalsContact O-N 3.14Å
480	H	82.2	Confident	83.4	Confident	115 Å²	115	66.2 Å²	66.2	53%	0.532	35%	0.352	S	S	.	.	H	α-helix	trans	-57.4	-34.8	174.5	179.2	-82.1	0	0	0	112.8	Y468 S482 L483 H484	Y468-H480 HydrophobicContact CD1-CB 4.25Å; Y468-H480 HydrophobicContact CE1-CB 4.09Å; Y468-H480 HydrophobicContact CE2-CB 4.36Å; Y468-H480 HydrophobicContact CG-CB 4.48Å; H480-S482 VanDerWaalsContact C-N 3.33Å; H480-S482 PolarHBondContact O-N 3.18Å; H480-L483 PolarHBondContact O-N 2.93Å; H480-H484 WeakPolarHBondContact O-CB 3.38Å; H480-H484 PolarHBondContact O-N 3.28Å
481	T	81.7	Confident	83	Confident	94 Å²	94	71.5 Å²	71.5	58%	0.577	38%	0.38	S	S	*	.	H	α-helix	trans	-64.7	-37.4	176.5	46.6	0	0	0	0	112.3	Y479 H484 N485	Y479-T481 PolarHBondContact O-N 3.24Å; T481-H484 PolarHBondContact O-N 3.03Å; T481-N485 PolarHBondContact O-N 3.18Å
482	S	84.2	Confident	82.1	Confident	43 Å²	43	67.7 Å²	67.7	30%	0.301	38%	0.376	S	S	.	.	H	α-helix	trans	-67.6	-43.4	175.8	-56.4	0	0	0	0	110.8	Y479 H480 N485 H486	Y479-S482 WeakPolarHBondContact O-CB 3.42Å; Y479-S482 PolarHBondContact O-N 3.41Å; H480-S482 VanDerWaalsContact C-N 3.33Å; H480-S482 PolarHBondContact O-N 3.18Å; S482-N485 PolarHBondContact O-N 3.22Å; S482-H486 VanDerWaalsContact O-CB 3.24Å; S482-H486 WeakPolarHBondContact O-CB 3.46Å; S482-H486 PolarHBondContact O-N 3.41Å
483	L	84.2	Confident	80.9	Confident	13 Å²	13	68.8 Å²	68.8	7%	0.068	38%	0.381	C	S	.	.	H	α-helix	trans	-61.2	-44	172.1	175.3	62.3	0	0	0	111.7	C470 F477 Y479 H480 H486 K487	C470-L483 HydrophobicContact CB-CD1 3.6Å; F477-L483 HydrophobicContact CB-CB 4.37Å; F477-L483 HydrophobicContact CD2-CB 3.91Å; F477-L483 HydrophobicContact CD2-CD1 3.85Å; F477-L483 HydrophobicContact CD2-CG 4.49Å; F477-L483 HydrophobicContact CE2-CD1 3.98Å; F477-L483 HydrophobicContact CG-CB 4.32Å; Y479-L483 PolarHBondContact O-N 3.35Å; Y479-L483 VanDerWaalsContact O-N 3.14Å; H480-L483 PolarHBondContact O-N 2.93Å; L483-H486 CarbonylContact O-C 3.34Å; L483-H486 WeakPolarHBondContact O-CB 3.48Å; L483-H486 PolarHBondContact O-N 2.87Å; L483-K487 HydrophobicContact CD1-CD 4.44Å; L483-K487 HydrophobicContact CD1-CG 4.11Å; L483-K487 HydrophobicContact CG-CD 4.38Å; L483-K487 HydrophobicContact CG-CG 4.41Å; L483-K487 WeakPolarHBondContact O-CG 3.3Å; L483-K487 PolarHBondContact O-N 2.79Å
484	H	82	Confident	79	Confident	94 Å²	94	68.6 Å²	68.6	44%	0.435	38%	0.376	S	S	.	.	H	α-helix	trans	-61.9	-46.4	179.4	178.1	68.7	0	0	0	111.8	H480 T481 H486 K487 K488	H480-H484 WeakPolarHBondContact O-CB 3.38Å; H480-H484 PolarHBondContact O-N 3.28Å; T481-H484 PolarHBondContact O-N 3.03Å; H484-H486 VanDerWaalsContact C-N 3.3Å; H484-H486 PolarHBondContact O-N 3.4Å; H484-K487 PolarHBondContact O-N 2.8Å; H484-K488 VanDerWaalsContact NE2-CE 3.31Å; H484-K488 WeakPolarHBondContact NE2-CE 3.25Å; H484-K488 PolarHBondContact O-N 2.8Å
485	N	82	Confident	77.5	Confident	86 Å²	86	72.3 Å²	72.3	46%	0.46	39%	0.393	S	S	.	.	H	α-helix	trans	-63.9	-37.8	175.1	-71.8	-12.9	0	0	0	111.8	T481 S482 K488	T481-N485 PolarHBondContact O-N 3.18Å; S482-N485 PolarHBondContact O-N 3.22Å; N485-K488 WeakPolarHBondContact O-CB 3.43Å; N485-K488 PolarHBondContact O-N 3Å
486	H	83.9	Confident	75.8	Confident	27 Å²	27	76.2 Å²	76.2	13%	0.125	41%	0.406	C	S	.	.	H	α-helix	trans	-64.4	-41.6	174.2	167.8	67	0	0	0	112.3	C470 C473 F477 S482 L483 H484 K488 C489 H490	C470-H486 PolarHBondContact SG-NE2 3Å; C470-H486 VanDerWaalsContact SG-NE2 3.42Å; C473-H486 VanDerWaalsContact SG-CE1 3.57Å; C473-H486 PolarHBondContact SG-NE2 3.44Å; F477-H486 HydrophobicContact CE1-CB 4.03Å; F477-H486 HydrophobicContact CE2-CB 3.87Å; F477-H486 AromaticContact CE2-CD2 3.4Å; F477-H486 WeakPolarHBondContact CE2-CD2 3.38Å; F477-H486 AromaticContact CE2-CG 3.6Å; F477-H486 HydrophobicContact CZ-CB 3.44Å; F477-H486 VanDerWaalsContact CZ-CB 3.44Å; F477-H486 AromaticContact CZ-CD2 3.56Å; F477-H486 AromaticContact CZ-CG 3.26Å; F477-H486 AromaticContact CZ-ND1 3.77Å; S482-H486 VanDerWaalsContact O-CB 3.24Å; S482-H486 WeakPolarHBondContact O-CB 3.46Å; S482-H486 PolarHBondContact O-N 3.41Å; L483-H486 CarbonylContact O-C 3.34Å; L483-H486 WeakPolarHBondContact O-CB 3.48Å; L483-H486 PolarHBondContact O-N 2.87Å; H484-H486 VanDerWaalsContact C-N 3.3Å; H484-H486 PolarHBondContact O-N 3.4Å; H486-K488 PolarHBondContact O-N 3.33Å; H486-C489 WeakPolarHBondContact O-CB 3.3Å; H486-C489 PolarHBondContact O-N 3.5Å; H486-H490 AromaticContact CE1-NE2 3.68Å; H486-H490 AromaticContact NE2-CD2 3.97Å; H486-H490 AromaticContact NE2-NE2 3.3Å; H486-H490 PolarHBondContact NE2-NE2 3.25Å
487	K	83.9	Confident	73.8	Confident	71 Å²	71	84 Å²	84	31%	0.309	44%	0.437	S	S	.	.	H	α-helix	trans	-60.6	-29.6	175.6	-76.6	-174.4	175.7	-165.9	0	112.7	L483 H484 C489 H490 I491	L483-K487 HydrophobicContact CD1-CD 4.44Å; L483-K487 HydrophobicContact CD1-CG 4.11Å; L483-K487 HydrophobicContact CG-CD 4.38Å; L483-K487 HydrophobicContact CG-CG 4.41Å; L483-K487 WeakPolarHBondContact O-CG 3.3Å; L483-K487 PolarHBondContact O-N 2.79Å; H484-K487 PolarHBondContact O-N 2.8Å; K487-C489 PolarHBondContact O-N 3.13Å; K487-H490 WeakPolarHBondContact O-CB 3.36Å; K487-H490 PolarHBondContact O-N 3.41Å; K487-I491 PolarHBondContact O-N 2.63Å
488	K	82.5	Confident	72.1	Confident	72 Å²	72	86.4 Å²	86.4	31%	0.313	46%	0.458	S	S	.	.	H	α-helix	trans	-63.4	-26	172.8	-62.5	-175.8	178.1	-171.1	0	113	H484 N485 H486 H490 I491 G492 E493 N494	H484-K488 VanDerWaalsContact NE2-CE 3.31Å; H484-K488 WeakPolarHBondContact NE2-CE 3.25Å; H484-K488 PolarHBondContact O-N 2.8Å; N485-K488 WeakPolarHBondContact O-CB 3.43Å; N485-K488 PolarHBondContact O-N 3Å; H486-K488 PolarHBondContact O-N 3.33Å; K488-H490 VanDerWaalsContact C-N 3.29Å; K488-H490 PolarHBondContact O-N 3.3Å; K488-I491 PolarHBondContact O-N 3.11Å; K488-G492 PolarHBondContact O-N 3.19Å; K488-E493 PolarHBondContact O-N 3.34Å; K488-N494 HydrophobicContact CB-CB 4.02Å
489	C	80.9	Confident	70	Confident	60 Å²	60	96.3 Å²	96.3	41%	0.405	51%	0.508	S	S	.	.	H	α-helix	trans	-67.8	-28.7	173.4	-59.4	0	0	0	0	112.2	H486 K487	H486-C489 WeakPolarHBondContact O-CB 3.3Å; H486-C489 PolarHBondContact O-N 3.5Å; K487-C489 PolarHBondContact O-N 3.13Å
490	H	80.5	Confident	69.5	Low	78 Å²	78	97.5 Å²	97.5	36%	0.361	52%	0.519	S	S	.	.	H	α-helix	trans	-76.4	-30.8	175.2	-67.9	-65.2	0	0	0	113.1	C470 E472 H486 K487 K488 G492	C470-H490 PolarHBondContact SG-NE2 3.34Å; C470-H490 VanDerWaalsContact SG-NE2 3.42Å; E472-H490 WeakPolarHBondContact OE2-CB 3.34Å; E472-H490 IonicContact OE2-CD2 3.2Å; E472-H490 PolarHBondContact OE2-CD2 3.13Å; E472-H490 IonicContact OE2-CG 2.94Å; E472-H490 IonicContact OE2-ND1 3.51Å; E472-H490 IonicContact OE2-NE2 3.92Å; H486-H490 AromaticContact CE1-NE2 3.68Å; H486-H490 AromaticContact NE2-CD2 3.97Å; H486-H490 AromaticContact NE2-NE2 3.3Å; H486-H490 PolarHBondContact NE2-NE2 3.25Å; K487-H490 WeakPolarHBondContact O-CB 3.36Å; K487-H490 PolarHBondContact O-N 3.41Å; K488-H490 VanDerWaalsContact C-N 3.29Å; K488-H490 PolarHBondContact O-N 3.3Å; H490-G492 PolarHBondContact O-N 3.3Å
491	I	77.2	Confident	68.8	Low	111 Å²	111	96.5 Å²	96.5	57%	0.569	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-5.2	-178.9	-53.6	164.1	0	0	0	111.2	K487 K488 E493	K487-I491 PolarHBondContact O-N 2.63Å; K488-I491 PolarHBondContact O-N 3.11Å; I491-E493 HydrophobicContact CG2-CG 4.13Å; I491-E493 PolarHBondContact O-N 3.05Å
492	G	65.3	Low	68.1	Low	68 Å²	68	96.7 Å²	96.7	70%	0.701	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	9.7	-177.1	0	0	0	0	0	114.2	K488 H490 N494	K488-G492 PolarHBondContact O-N 3.19Å; H490-G492 PolarHBondContact O-N 3.3Å; G492-N494 VanDerWaalsContact C-N 3.35Å
493	E	57.4	Low	67.1	Low	147 Å²	147	99.8 Å²	99.8	69%	0.687	53%	0.527	S	S	*	.			trans	-90.7	9.4	-179.5	-75.7	-172.6	173.2	0	0	113.5	K488 I491	K488-E493 PolarHBondContact O-N 3.34Å; I491-E493 HydrophobicContact CG2-CG 4.13Å; I491-E493 PolarHBondContact O-N 3.05Å
494	N	48.3	Very low	66.1	Low	55 Å²	55	105.3 Å²	105.3	29%	0.294	56%	0.556	S	S	.	*			trans	-128	119.8	178.8	-148.5	25	0	0	0	111.9	K488 G492 Y496	K488-N494 HydrophobicContact CB-CB 4.02Å; G492-N494 VanDerWaalsContact C-N 3.35Å; N494-Y496 PolarHBondContact O-N 3.01Å
495	P	54.1	Low	65	Low	115 Å²	115	106 Å²	106	75%	0.747	56%	0.564	S	S	*	*			trans	-80.2	22.3	-171.9	32	-35.8	0	0	0	114.9
496	Y	49.3	Very low	63.8	Low	179 Å²	179	107.4 Å²	107.4	70%	0.702	57%	0.572	S	S	*	*			trans	-109.6	103.1	175.5	-62.2	-75.6	0	0	0	108.6	N494	N494-Y496 PolarHBondContact O-N 3.01Å
497	E	44.7	Very low	62.3	Low	195 Å²	195	113.6 Å²	113.6	91%	0.911	61%	0.606	S	S	*	*			trans	-56.9	142.7	173.7	-72.9	-174.9	157.1	0	0	111.1	N499	E497-N499 PolarHBondContact O-N 2.73Å
498	C	46.9	Very low	60.5	Low	95 Å²	95	117.2 Å²	117.2	64%	0.642	63%	0.631	S	S	*	*			trans	-72.1	118.1	-179.3	-174.4	0	0	0	0	110
499	N	38.4	Very low	58.5	Low	231 Å²	231	121.3 Å²	121.3	100%	1.235	66%	0.66	S	S	*	*			trans	-110.5	0	148.6	-83	-32	0	0	0	108.5	E497	E497-N499 PolarHBondContact O-N 2.73Å

Retrieved 499 of 499 residues in 210.9 ms (Link to these results)

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