A0A3Q0KGC1_SCHMA Loading...

Polypeptide N-acetylgalactosaminyltransferase

AlphaFold DB , UniProt , Accession A0A3Q0KGC1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 386 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	40.7	Very low	60.8	Low	216 Å²	216	88.5 Å²	88.5	100%	1.064	48%	0.476	S	S	*	.				0	144.7	0	-69.4	-153.4	-129.5	0	0	107.7
2	D	45.8	Very low	60.9	Low	84 Å²	84	81.8 Å²	81.8	45%	0.449	44%	0.44	S	S	.	.			trans	-63.5	122.3	-175.5	-170.6	-21.2	0	0	0	110.6	V4 L5 T6	D2-V4 PolarHBondContact O-N 3.24Å; D2-V4 VanDerWaalsContact O-N 3.07Å; D2-V4 WeakPolarHBondContact OD1-CB 3.26Å; D2-V4 WeakPolarHBondContact OD1-CG2 3.38Å; D2-V4 PolarHBondContact OD1-N 2.66Å; D2-L5 HydrophobicContact CB-CB 4.29Å; D2-L5 HydrophobicContact CB-CD1 4.07Å; D2-L5 HydrophobicContact CB-CG 4.09Å; D2-L5 PolarHBondContact O-N 2.76Å; D2-T6 PolarHBondContact O-N 3.25Å; D2-T6 VanDerWaalsContact O-N 3.15Å; D2-T6 PolarHBondContact O-OG1 3.28Å
3	P	54.1	Low	61.4	Low	77 Å²	77	78.2 Å²	78.2	50%	0.5	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-18.7	178	23.9	-33.2	0	0	0	113.2	T6 P7	P3-T6 CarbonylContact O-C 3.48Å; P3-P7 WeakPolarHBondContact O-CA 3.46Å
4	V	62.9	Low	61.3	Low	114 Å²	114	79.6 Å²	79.6	69%	0.691	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-37.8	172.6	-179.1	0	0	0	0	111.7	D2	D2-V4 PolarHBondContact O-N 3.24Å; D2-V4 VanDerWaalsContact O-N 3.07Å; D2-V4 WeakPolarHBondContact OD1-CB 3.26Å; D2-V4 WeakPolarHBondContact OD1-CG2 3.38Å; D2-V4 PolarHBondContact OD1-N 2.66Å
5	L	63.7	Low	60.6	Low	141 Å²	141	77.6 Å²	77.6	74%	0.738	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-26	-177.8	-64.8	176.5	0	0	0	112.6	D2	D2-L5 HydrophobicContact CB-CB 4.29Å; D2-L5 HydrophobicContact CB-CD1 4.07Å; D2-L5 HydrophobicContact CB-CG 4.09Å; D2-L5 PolarHBondContact O-N 2.76Å
6	T	65.5	Low	61.2	Low	83 Å²	83	80.7 Å²	80.7	51%	0.509	44%	0.441	S	S	.	.	S	Bend	trans	-134.6	71.9	176.9	57.9	0	0	0	0	111.1	D2 P3	D2-T6 PolarHBondContact O-N 3.25Å; D2-T6 VanDerWaalsContact O-N 3.15Å; D2-T6 PolarHBondContact O-OG1 3.28Å; P3-T6 CarbonylContact O-C 3.48Å
7	P	64.7	Low	61.7	Low	31 Å²	31	79.6 Å²	79.6	20%	0.201	43%	0.429	C	S	.	.			trans	-66	147.6	-180	25.7	-32.8	0	0	0	111.6	P3 M9 R18	P3-P7 WeakPolarHBondContact O-CA 3.46Å; P7-M9 PolarHBondContact O-N 3.47Å; P7-R18 HydrophobicContact CB-CB 4.26Å; P7-R18 HydrophobicContact CG-CB 4.02Å; P7-R18 HydrophobicContact CG-CG 3.81Å
8	E	64.2	Low	62.3	Low	112 Å²	112	85.4 Å²	85.4	52%	0.523	44%	0.444	S	S	.	.			trans	-60.2	134.7	174.4	-172.1	-176.5	172.3	0	0	109.2	K19	E8-K19 HydrophobicContact CB-CB 4.18Å; E8-K19 HydrophobicContact CB-CD 4.19Å; E8-K19 HydrophobicContact CG-CD 4.27Å; E8-K19 WeakPolarHBondContact O-CA 3.5Å; E8-K19 WeakPolarHBondContact O-CB 3.33Å; E8-K19 PolarHBondContact O-N 3.43Å; E8-K19 IonicContact OE1-NZ 3.87Å; E8-K19 VanDerWaalsContact OE2-CD 3.26Å; E8-K19 WeakPolarHBondContact OE2-CD 3.46Å; E8-K19 IonicContact OE2-NZ 3.42Å; E8-K19 PolarHBondContact OE2-NZ 2.98Å
9	M	72.6	Confident	62.5	Low	67 Å²	67	85.1 Å²	85.1	33%	0.33	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	136.4	-177.7	-63.7	-162.5	-57.6	0	0	112	P7 Y17	P7-M9 PolarHBondContact O-N 3.47Å; M9-Y17 CarbonylContact C-O 3.53Å; M9-Y17 WeakPolarHBondContact CA-O 3.47Å
10	I	67.8	Low	62.5	Low	19 Å²	19	85.8 Å²	85.8	10%	0.097	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	139.8	169.3	-59.2	168.8	0	0	0	107	I12 H16 Y17 K19	I10-I12 HydrophobicContact CG2-CG1 4.37Å; I10-H16 CarbonylContact O-C 3.6Å; I10-Y17 PolarHBondContact N-O 3.21Å; I10-Y17 PolarHBondContact O-N 2.95Å; I10-K19 HydrophobicContact CD1-CB 4.45Å
11	H	67	Low	61.7	Low	29 Å²	29	84.4 Å²	84.4	13%	0.134	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	135.3	174.9	-38.7	-130.1	0	0	0	110.1	R15 H16 S287	H11-R15 CarbonylContact C-O 3.59Å; H11-R15 WeakPolarHBondContact CA-O 3.45Å; H11-R15 WeakPolarHBondContact CB-O 3.3Å; H11-H16 AromaticContact CE1-CD2 3.07Å; H11-H16 PolarHBondContact CE1-CD2 3.17Å; H11-H16 AromaticContact CE1-NE2 3.42Å; H11-H16 PolarHBondContact CE1-NE2 3.24Å; H11-H16 AromaticContact ND1-CD2 2.88Å; H11-H16 PolarHBondContact ND1-CD2 3.41Å; H11-H16 AromaticContact ND1-CE1 3.89Å; H11-H16 AromaticContact ND1-CG 3.56Å; H11-H16 AromaticContact ND1-NE2 3.09Å; H11-H16 PolarHBondContact ND1-NE2 2.67Å; H11-S287 WeakPolarHBondContact CB-OG 3.3Å; H11-S287 PolarHBondContact O-OG 3.35Å; H11-S287 VanDerWaalsContact O-OG 3.13Å
12	I	61.7	Low	62.1	Low	9 Å²	9	76.4 Å²	76.4	5%	0.046	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	112.2	179.1	-49.2	-179.5	0	0	0	106.8	I10 R15 Y17 T136	I10-I12 HydrophobicContact CG2-CG1 4.37Å; I12-R15 PolarHBondContact N-O 3.16Å; I12-R15 PolarHBondContact O-N 3.07Å; I12-Y17 HydrophobicContact CB-CD2 4.41Å; I12-Y17 HydrophobicContact CB-CE2 3.62Å; I12-Y17 HydrophobicContact CD1-CD2 3.96Å; I12-Y17 HydrophobicContact CD1-CE2 3.44Å; I12-Y17 VanDerWaalsContact CD1-CE2 3.44Å; I12-Y17 HydrophobicContact CG1-CD2 3.8Å; I12-Y17 HydrophobicContact CG1-CE2 3.39Å; I12-T136 HydrophobicContact CD1-CG2 3.97Å; I12-T136 HydrophobicContact CG1-CG2 3.99Å
13	G	67.5	Low	61.9	Low	35 Å²	35	80.9 Å²	80.9	36%	0.361	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	-122.3	-171.7	0	0	0	0	0	111.3
14	P	60	Low	61.1	Low	98 Å²	98	83.6 Å²	83.6	64%	0.636	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-8.1	178.1	32.6	-34.4	0	0	0	114.9
15	R	51.6	Low	59.8	Low	49 Å²	49	82.3 Å²	82.3	19%	0.185	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	148.2	-171.3	-66.4	177.9	179.2	-123.2	-3.4	112.8	H11 I12 Y17 D49 D52 R129	H11-R15 CarbonylContact C-O 3.59Å; H11-R15 WeakPolarHBondContact CA-O 3.45Å; H11-R15 WeakPolarHBondContact CB-O 3.3Å; I12-R15 PolarHBondContact N-O 3.16Å; I12-R15 PolarHBondContact O-N 3.07Å; R15-Y17 HydrophobicContact CB-CE2 3.65Å; R15-Y17 VanDerWaalsContact CD-OH 3.3Å; R15-Y17 WeakPolarHBondContact CD-OH 3.34Å; R15-D49 PolarHBondContact NH2-O 3.39Å; R15-D52 IonicContact CZ-OD1 2.92Å; R15-D52 IonicContact NE-OD1 3.41Å; R15-D52 PolarHBondContact NE-OD1 3.16Å; R15-D52 IonicContact NH2-OD1 2.75Å; R15-R129 VanDerWaalsContact NH2-NH2 3.18Å
16	H	70.1	Confident	58.3	Low	127 Å²	127	85.2 Å²	85.2	59%	0.588	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	128.1	176.6	-59.6	66.3	0	0	0	108.9	I10 H11	I10-H16 CarbonylContact O-C 3.6Å; H11-H16 AromaticContact CE1-CD2 3.07Å; H11-H16 PolarHBondContact CE1-CD2 3.17Å; H11-H16 AromaticContact CE1-NE2 3.42Å; H11-H16 PolarHBondContact CE1-NE2 3.24Å; H11-H16 AromaticContact ND1-CD2 2.88Å; H11-H16 PolarHBondContact ND1-CD2 3.41Å; H11-H16 AromaticContact ND1-CE1 3.89Å; H11-H16 AromaticContact ND1-CG 3.56Å; H11-H16 AromaticContact ND1-NE2 3.09Å; H11-H16 PolarHBondContact ND1-NE2 2.67Å
17	Y	69.1	Low	56.7	Low	62 Å²	62	85.9 Å²	85.9	24%	0.243	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	138.2	-179.9	-59	-95.8	0	0	0	109.1	M9 I10 I12 R15	M9-Y17 CarbonylContact C-O 3.53Å; M9-Y17 WeakPolarHBondContact CA-O 3.47Å; I10-Y17 PolarHBondContact N-O 3.21Å; I10-Y17 PolarHBondContact O-N 2.95Å; I12-Y17 HydrophobicContact CB-CD2 4.41Å; I12-Y17 HydrophobicContact CB-CE2 3.62Å; I12-Y17 HydrophobicContact CD1-CD2 3.96Å; I12-Y17 HydrophobicContact CD1-CE2 3.44Å; I12-Y17 VanDerWaalsContact CD1-CE2 3.44Å; I12-Y17 HydrophobicContact CG1-CD2 3.8Å; I12-Y17 HydrophobicContact CG1-CE2 3.39Å; R15-Y17 HydrophobicContact CB-CE2 3.65Å; R15-Y17 VanDerWaalsContact CD-OH 3.3Å; R15-Y17 WeakPolarHBondContact CD-OH 3.34Å
18	R	71.9	Confident	55	Low	185 Å²	185	92.5 Å²	92.5	70%	0.698	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	129.6	170.1	-67.4	176.1	176	167	1.1	109.2	P7	P7-R18 HydrophobicContact CB-CB 4.26Å; P7-R18 HydrophobicContact CG-CB 4.02Å; P7-R18 HydrophobicContact CG-CG 3.81Å
19	K	66.6	Low	53.5	Low	78 Å²	78	91.3 Å²	91.3	34%	0.339	48%	0.478	S	S	.	.			trans	-85.7	115.9	170.8	-172.6	-175.1	175.9	-171.2	0	107.9	E8 I10	E8-K19 HydrophobicContact CB-CB 4.18Å; E8-K19 HydrophobicContact CB-CD 4.19Å; E8-K19 HydrophobicContact CG-CD 4.27Å; E8-K19 WeakPolarHBondContact O-CA 3.5Å; E8-K19 WeakPolarHBondContact O-CB 3.33Å; E8-K19 PolarHBondContact O-N 3.43Å; E8-K19 IonicContact OE1-NZ 3.87Å; E8-K19 VanDerWaalsContact OE2-CD 3.26Å; E8-K19 WeakPolarHBondContact OE2-CD 3.46Å; E8-K19 IonicContact OE2-NZ 3.42Å; E8-K19 PolarHBondContact OE2-NZ 2.98Å; I10-K19 HydrophobicContact CD1-CB 4.45Å
20	N	61.8	Low	51.5	Low	100 Å²	100	93 Å²	93	54%	0.535	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-72.1	140	177.4	-69.2	-27.7	0	0	0	110.3	S22	N20-S22 PolarHBondContact O-N 3.35Å
21	A	46.5	Very low	50	Low	57 Å²	57	94.7 Å²	94.7	47%	0.471	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-68.7	116.2	170.5	0	0	0	0	0	108.7
22	S	49.7	Very low	48.5	Very low	47 Å²	47	95.8 Å²	95.8	33%	0.329	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-74.6	162.1	164.5	63.9	0	0	0	0	109.3	N20 Q24 C25	N20-S22 PolarHBondContact O-N 3.35Å; S22-Q24 PolarHBondContact O-N 2.91Å; S22-C25 PolarHBondContact O-N 3.4Å
23	N	41.1	Very low	47.4	Very low	178 Å²	178	98.5 Å²	98.5	95%	0.952	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	10.4	173.1	-82.7	-17.9	0	0	0	114.4
24	Q	37.8	Very low	46.4	Very low	135 Å²	135	100.2 Å²	100.2	63%	0.631	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.9	35.8	-178.3	-68.1	-179.5	-14.6	0	0	112.6	S22 F26	S22-Q24 PolarHBondContact O-N 2.91Å; Q24-F26 PolarHBondContact O-N 3.48Å
25	C	34.2	Very low	45.5	Very low	87 Å²	87	100.1 Å²	100.1	59%	0.588	53%	0.526	S	S	*	.			trans	-62.3	21.3	171.7	-104.9	0	0	0	0	115.7	S22	S22-C25 PolarHBondContact O-N 3.4Å
26	F	32.4	Very low	44.8	Very low	202 Å²	202	103.7 Å²	103.7	89%	0.886	55%	0.545	S	S	*	.			trans	-131.8	64.8	173.8	-74.6	-83.3	0	0	0	110.9	Q24	Q24-F26 PolarHBondContact O-N 3.48Å
27	V	32	Very low	43.7	Very low	96 Å²	96	99 Å²	99	58%	0.582	52%	0.524	S	S	*	.			trans	-123.5	99.6	162.4	-168.1	0	0	0	0	108.9
28	Q	29.6	Very low	42.6	Very low	170 Å²	170	102.3 Å²	102.3	79%	0.794	54%	0.541	S	S	*	.			trans	-60.9	147.5	174.9	-72.7	174.7	-27.6	0	0	110.9	F30	Q28-F30 WeakPolarHBondContact O-CD2 3.39Å; Q28-F30 PolarHBondContact O-N 3.2Å
29	S	31.6	Very low	41.4	Very low	87 Å²	87	97.8 Å²	97.8	61%	0.608	53%	0.528	S	S	*	.			trans	-39.8	108.7	179.6	53.2	0	0	0	0	115.2
30	F	32.4	Very low	40.5	Very low	102 Å²	102	97.1 Å²	97.1	45%	0.447	53%	0.528	S	S	.	.			trans	-107.8	149.5	155.3	-72.2	-78.8	0	0	0	109.7	Q28 T32 P321	Q28-F30 WeakPolarHBondContact O-CD2 3.39Å; Q28-F30 PolarHBondContact O-N 3.2Å; F30-T32 PolarHBondContact O-N 2.93Å; F30-T32 PolarHBondContact O-OG1 2.83Å; F30-P321 HydrophobicContact CD1-CB 3.9Å; F30-P321 HydrophobicContact CD1-CG 3.62Å; F30-P321 HydrophobicContact CE1-CB 4.03Å; F30-P321 HydrophobicContact CE1-CG 3.58Å
31	P	35.6	Very low	39.3	Very low	55 Å²	55	97.4 Å²	97.4	36%	0.357	54%	0.535	S	S	.	.			trans	-69.1	84.7	161.6	28.4	-29.6	0	0	0	108.1	S33	P31-S33 PolarHBondContact O-N 2.85Å
32	T	36.1	Very low	39.3	Very low	53 Å²	53	97.7 Å²	97.7	33%	0.325	53%	0.529	S	S	.	.			trans	-68.3	114	177.8	-45.3	0	0	0	0	107.9	F30 Q36 I37	F30-T32 PolarHBondContact O-N 2.93Å; F30-T32 PolarHBondContact O-OG1 2.83Å; T32-Q36 HydrophobicContact CG2-CB 3.26Å; T32-Q36 WeakPolarHBondContact CG2-O 3.37Å; T32-I37 HydrophobicContact CG2-CG1 3.96Å; T32-I37 VanDerWaalsContact CG2-N 3.31Å
33	S	37.7	Very low	39.1	Very low	65 Å²	65	97.5 Å²	97.5	46%	0.455	53%	0.53	S	S	.	.			trans	-50.7	148.3	162.9	169.5	0	0	0	0	107.7	P31 S35 Q36	P31-S33 PolarHBondContact O-N 2.85Å; S33-S35 WeakPolarHBondContact CB-OG 3.35Å; S33-S35 PolarHBondContact O-N 2.88Å; S33-S35 PolarHBondContact OG-N 3.32Å; S33-S35 PolarHBondContact OG-OG 3.15Å; S33-Q36 PolarHBondContact O-N 3.32Å
34	I	46.4	Very low	38.9	Very low	72 Å²	72	97.9 Å²	97.9	37%	0.369	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-20.6	179.2	-39.4	178.6	0	0	0	110.8	Q36 I37 L78 K81 F82	I34-Q36 VanDerWaalsContact C-N 3.32Å; I34-I37 HydrophobicContact CG2-CD1 4.29Å; I34-L78 HydrophobicContact CD1-CD1 4.49Å; I34-K81 WeakPolarHBondContact O-CE 3.22Å; I34-K81 PolarHBondContact O-NZ 2.92Å; I34-F82 HydrophobicContact CG2-CE2 4.05Å; I34-F82 HydrophobicContact CG2-CZ 3.74Å
35	S	41.3	Very low	38.9	Very low	95 Å²	95	100.1 Å²	100.1	66%	0.664	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-11.7	174	57.6	0	0	0	0	115.7	S33	S33-S35 WeakPolarHBondContact CB-OG 3.35Å; S33-S35 PolarHBondContact O-N 2.88Å; S33-S35 PolarHBondContact OG-N 3.32Å; S33-S35 PolarHBondContact OG-OG 3.15Å
36	Q	36.7	Very low	39.5	Very low	125 Å²	125	101.9 Å²	101.9	58%	0.584	55%	0.545	S	S	*	.			trans	-117.6	4.3	-170	-70.2	175.8	-28.2	0	0	113.5	T32 S33 I34 E38	T32-Q36 HydrophobicContact CG2-CB 3.26Å; T32-Q36 WeakPolarHBondContact CG2-O 3.37Å; S33-Q36 PolarHBondContact O-N 3.32Å; I34-Q36 VanDerWaalsContact C-N 3.32Å; Q36-E38 PolarHBondContact O-N 3.39Å; Q36-E38 VanDerWaalsContact O-N 3.11Å
37	I	46.3	Very low	40.1	Very low	28 Å²	28	99.6 Å²	99.6	14%	0.144	54%	0.542	C	S	.	.			trans	-67.4	111.9	178.6	-67.7	164.4	0	0	0	108	T32 I34 F82 R141	T32-I37 HydrophobicContact CG2-CG1 3.96Å; T32-I37 VanDerWaalsContact CG2-N 3.31Å; I34-I37 HydrophobicContact CG2-CD1 4.29Å; I37-F82 HydrophobicContact CB-CE1 3.93Å; I37-F82 HydrophobicContact CD1-CE1 3.74Å; I37-F82 HydrophobicContact CD1-CZ 3.64Å; I37-F82 HydrophobicContact CG1-CE1 4.44Å; I37-F82 HydrophobicContact CG2-CE1 3.88Å; I37-R141 HydrophobicContact CD1-CB 4.38Å; I37-R141 HydrophobicContact CG2-CB 4.18Å
38	E	47.5	Very low	41	Very low	131 Å²	131	98.4 Å²	98.4	61%	0.612	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-67.7	143.1	178.4	-69.9	-178.1	159.8	0	0	111.7	Q36	Q36-E38 PolarHBondContact O-N 3.39Å; Q36-E38 VanDerWaalsContact O-N 3.11Å
39	E	45.6	Very low	42.6	Very low	90 Å²	90	93.8 Å²	93.8	42%	0.421	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-81.6	126.8	-178.2	-62.8	-178.1	-179.8	0	0	110.7	G85 V86 K90	E39-G85 WeakPolarHBondContact OE1-CA 3.03Å; E39-V86 PolarHBondContact OE1-N 3.04Å; E39-V86 VanDerWaalsContact OE1-N 3.1Å; E39-K90 HydrophobicContact CG-CD 4.5Å; E39-K90 VanDerWaalsContact CG-CE 3.49Å; E39-K90 VanDerWaalsContact OE2-CE 3.23Å; E39-K90 WeakPolarHBondContact OE2-CE 3.43Å
40	I	48.5	Very low	44	Very low	65 Å²	65	96.9 Å²	96.9	33%	0.333	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-92.3	141.1	173.6	-54.8	175.7	0	0	0	109.3
41	P	37	Very low	45.7	Very low	106 Å²	106	97.6 Å²	97.6	69%	0.688	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-68.4	149.7	173.1	-17.6	31.2	0	0	0	113.8
42	D	45.4	Very low	47.6	Very low	62 Å²	62	95.3 Å²	95.3	33%	0.332	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-66.5	146.8	-170.4	-64.7	-48	0	0	0	114.4
43	A	45.2	Very low	49.6	Very low	44 Å²	44	97 Å²	97	36%	0.364	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-87.3	150.4	173.7	0	0	0	0	0	111.8
44	E	37	Very low	51.6	Low	186 Å²	186	97.1 Å²	97.1	87%	0.869	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-70.7	158.8	-179.1	-66.6	-176.2	170.7	0	0	114.4
45	E	38.9	Very low	53.2	Low	181 Å²	181	93.9 Å²	93.9	85%	0.846	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-59.3	150.2	-171.1	-60.7	179.8	166.3	0	0	115.3
46	V	45.8	Very low	55.3	Low	125 Å²	125	92.9 Å²	92.9	76%	0.758	49%	0.485	S	S	*	.			trans	-135	146.2	175.1	-169.1	0	0	0	0	109.7
47	D	45.9	Very low	57.7	Low	154 Å²	154	90.7 Å²	90.7	82%	0.824	47%	0.474	S	S	*	.			trans	-51.4	139.1	177	-75.4	-38	0	0	0	113.6	D49	D47-D49 PolarHBondContact O-N 3.26Å
48	I	51.3	Low	59.7	Low	71 Å²	71	89.7 Å²	89.7	36%	0.364	47%	0.469	S	S	.	.			trans	-81.2	108	-174.8	-61.1	169.7	0	0	0	109.6	E50 F122	I48-E50 HydrophobicContact CG2-CG 4.04Å; I48-E50 PolarHBondContact O-N 3.47Å; I48-F122 HydrophobicContact CD1-CD2 4.45Å; I48-F122 HydrophobicContact CD1-CE2 3.35Å; I48-F122 HydrophobicContact CD1-CZ 3.78Å
49	D	62.6	Low	61.6	Low	73 Å²	73	87.3 Å²	87.3	39%	0.39	46%	0.458	S	S	.	.			trans	-81.4	104.8	159.6	175.7	24.4	0	0	0	109.9	R15 D47 N51 D52	R15-D49 PolarHBondContact NH2-O 3.39Å; D47-D49 PolarHBondContact O-N 3.26Å; D49-N51 PolarHBondContact O-N 3.03Å; D49-N51 WeakPolarHBondContact OD1-CA 3.45Å; D49-N51 VanDerWaalsContact OD1-CB 3.26Å; D49-N51 WeakPolarHBondContact OD1-CB 3.29Å; D49-N51 PolarHBondContact OD1-N 2.7Å; D49-N51 PolarHBondContact OD1-ND2 3.36Å; D49-N51 VanDerWaalsContact OD1-ND2 3.15Å; D49-D52 WeakPolarHBondContact O-CB 3.18Å; D49-D52 PolarHBondContact O-N 3.46Å
50	E	61.7	Low	63.8	Low	151 Å²	151	91 Å²	91	71%	0.706	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-14.4	175.4	-64.2	-172.5	162	0	0	113.2	I48 D52	I48-E50 HydrophobicContact CG2-CG 4.04Å; I48-E50 PolarHBondContact O-N 3.47Å; E50-D52 VanDerWaalsContact C-N 3.32Å
51	N	67	Low	65.9	Low	117 Å²	117	92.5 Å²	92.5	63%	0.626	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	1.4	179.6	-54	-68.7	0	0	0	113.7	D49	D49-N51 PolarHBondContact O-N 3.03Å; D49-N51 WeakPolarHBondContact OD1-CA 3.45Å; D49-N51 VanDerWaalsContact OD1-CB 3.26Å; D49-N51 WeakPolarHBondContact OD1-CB 3.29Å; D49-N51 PolarHBondContact OD1-N 2.7Å; D49-N51 PolarHBondContact OD1-ND2 3.36Å; D49-N51 VanDerWaalsContact OD1-ND2 3.15Å
52	D	75.5	Confident	68.6	Low	8 Å²	8	88.5 Å²	88.5	4%	0.043	45%	0.445	C	S	.	.			trans	-65.4	127.1	177	172	89.6	0	0	0	111.5	R15 D49 E50 E54 T55 M56	R15-D52 IonicContact CZ-OD1 2.92Å; R15-D52 IonicContact NE-OD1 3.41Å; R15-D52 PolarHBondContact NE-OD1 3.16Å; R15-D52 IonicContact NH2-OD1 2.75Å; D49-D52 WeakPolarHBondContact O-CB 3.18Å; D49-D52 PolarHBondContact O-N 3.46Å; E50-D52 VanDerWaalsContact C-N 3.32Å; D52-E54 VanDerWaalsContact C-N 3.29Å; D52-E54 PolarHBondContact O-N 2.55Å; D52-E54 WeakPolarHBondContact OD2-CB 3.47Å; D52-E54 PolarHBondContact OD2-N 3.2Å; D52-T55 WeakPolarHBondContact O-CB 3.43Å; D52-T55 PolarHBondContact O-N 2.79Å; D52-T55 VanDerWaalsContact O-N 3.11Å; D52-T55 WeakPolarHBondContact OD2-CB 3.3Å; D52-T55 PolarHBondContact OD2-N 3.42Å; D52-T55 PolarHBondContact OD2-OG1 3.36Å; D52-M56 PolarHBondContact O-N 3.03Å
53	P	78.1	Confident	70.9	Confident	89 Å²	89	90.9 Å²	90.9	58%	0.578	46%	0.455	S	S	*	.	H	α-helix	trans	-58.3	-36.4	-175.5	-27.9	35.2	0	0	0	114.3	E57	P53-E57 WeakPolarHBondContact O-CB 3.19Å; P53-E57 PolarHBondContact O-N 3.34Å
54	E	79.7	Confident	73.3	Confident	67 Å²	67	94.4 Å²	94.4	31%	0.313	47%	0.472	S	S	.	.	H	α-helix	trans	-69.6	-41.3	178	-175	171.5	-143.1	0	0	110.7	D52 E57 I58 L132	D52-E54 VanDerWaalsContact C-N 3.29Å; D52-E54 PolarHBondContact O-N 2.55Å; D52-E54 WeakPolarHBondContact OD2-CB 3.47Å; D52-E54 PolarHBondContact OD2-N 3.2Å; E54-E57 PolarHBondContact O-N 3.49Å; E54-I58 HydrophobicContact CG-CD1 4.35Å; E54-I58 VanDerWaalsContact O-CG1 3.31Å; E54-I58 WeakPolarHBondContact O-CG1 3.36Å; E54-I58 PolarHBondContact O-N 3Å; E54-L132 HydrophobicContact CG-CD1 4.2Å; E54-L132 WeakPolarHBondContact OE1-CD1 3.47Å
55	T	81.1	Confident	76	Confident	4 Å²	4	88.1 Å²	88.1	3%	0.025	45%	0.446	C	S	.	.	H	α-helix	trans	-62.5	-45.5	174.9	-56	0	0	0	0	111.4	D52 E57 I58 H59 L125 R129	D52-T55 WeakPolarHBondContact O-CB 3.43Å; D52-T55 PolarHBondContact O-N 2.79Å; D52-T55 VanDerWaalsContact O-N 3.11Å; D52-T55 WeakPolarHBondContact OD2-CB 3.3Å; D52-T55 PolarHBondContact OD2-N 3.42Å; D52-T55 PolarHBondContact OD2-OG1 3.36Å; T55-E57 VanDerWaalsContact C-N 3.32Å; T55-E57 PolarHBondContact O-N 3.34Å; T55-I58 PolarHBondContact O-N 3.47Å; T55-H59 VanDerWaalsContact O-CB 3.3Å; T55-H59 WeakPolarHBondContact O-CB 3.36Å; T55-H59 PolarHBondContact O-N 3.44Å; T55-L125 HydrophobicContact CG2-CD1 4.14Å; T55-L125 HydrophobicContact CG2-CD2 4.01Å; T55-L125 HydrophobicContact CG2-CG 4.4Å; T55-R129 PolarHBondContact OG1-NE 3.3Å; T55-R129 PolarHBondContact OG1-NH2 3.04Å
56	M	84.7	Confident	78.3	Confident	73 Å²	73	87.5 Å²	87.5	36%	0.36	45%	0.449	S	S	.	.	H	α-helix	trans	-61.8	-40.2	175.3	-75.2	-168.7	158.4	0	0	112.1	D52 H59 R60	D52-M56 PolarHBondContact O-N 3.03Å; M56-H59 WeakPolarHBondContact O-CB 3.3Å; M56-H59 PolarHBondContact O-N 3.34Å; M56-R60 WeakPolarHBondContact O-CG 3.36Å; M56-R60 PolarHBondContact O-N 3.44Å
57	E	87.4	Confident	80.2	Confident	79 Å²	79	88.3 Å²	88.3	37%	0.369	45%	0.449	S	S	.	.	H	α-helix	trans	-67.1	-41.9	179.6	-179.7	58.2	-165.4	0	0	112.5	P53 E54 T55 H59 R60 K61	P53-E57 WeakPolarHBondContact O-CB 3.19Å; P53-E57 PolarHBondContact O-N 3.34Å; E54-E57 PolarHBondContact O-N 3.49Å; T55-E57 VanDerWaalsContact C-N 3.32Å; T55-E57 PolarHBondContact O-N 3.34Å; E57-H59 VanDerWaalsContact C-N 3.34Å; E57-R60 PolarHBondContact O-N 2.81Å; E57-R60 IonicContact OE2-NH1 2.76Å; E57-R60 PolarHBondContact OE2-NH1 3.32Å; E57-K61 PolarHBondContact O-N 3.38Å; E57-K61 WeakPolarHBondContact OE1-CE 3.46Å; E57-K61 IonicContact OE1-NZ 3.62Å; E57-K61 PolarHBondContact OE1-NZ 2.85Å
58	I	88.3	Confident	82.5	Confident	7 Å²	7	81.6 Å²	81.6	4%	0.036	42%	0.416	C	S	.	.	H	α-helix	trans	-63.4	-45.1	172.8	-61.9	161.7	0	0	0	109.6	E54 T55 R60 K61 I62 L125 C128 R129 L132	E54-I58 HydrophobicContact CG-CD1 4.35Å; E54-I58 VanDerWaalsContact O-CG1 3.31Å; E54-I58 WeakPolarHBondContact O-CG1 3.36Å; E54-I58 PolarHBondContact O-N 3Å; T55-I58 PolarHBondContact O-N 3.47Å; I58-R60 VanDerWaalsContact C-N 3.25Å; I58-R60 PolarHBondContact O-N 2.59Å; I58-K61 WeakPolarHBondContact O-CA 3.49Å; I58-K61 WeakPolarHBondContact O-CB 3.49Å; I58-K61 PolarHBondContact O-N 2.9Å; I58-I62 WeakPolarHBondContact O-CG1 3.38Å; I58-I62 PolarHBondContact O-N 3.49Å; I58-L125 HydrophobicContact CB-CD1 3.82Å; I58-L125 HydrophobicContact CG2-CD1 3.61Å; I58-C128 HydrophobicContact CD1-CB 4.25Å; I58-C128 HydrophobicContact CG2-CB 3.73Å; I58-R129 HydrophobicContact CD1-CG 3.75Å; I58-L132 HydrophobicContact CD1-CD1 3.59Å; I58-L132 HydrophobicContact CG1-CD1 4.18Å
59	H	87.6	Confident	84.7	Confident	82 Å²	82	81.9 Å²	81.9	38%	0.38	41%	0.413	S	S	.	.	H	α-helix	trans	-57.2	-37.7	-179.2	-167.7	101.7	0	0	0	112.6	T55 M56 E57 K61 I62 K121	T55-H59 VanDerWaalsContact O-CB 3.3Å; T55-H59 WeakPolarHBondContact O-CB 3.36Å; T55-H59 PolarHBondContact O-N 3.44Å; M56-H59 WeakPolarHBondContact O-CB 3.3Å; M56-H59 PolarHBondContact O-N 3.34Å; E57-H59 VanDerWaalsContact C-N 3.34Å; H59-K61 VanDerWaalsContact C-N 3.28Å; H59-K61 PolarHBondContact O-N 2.85Å; H59-I62 PolarHBondContact O-N 3.04Å; H59-K121 WeakPolarHBondContact CE1-CE 3.37Å; H59-K121 PolarHBondContact CE1-NZ 3Å; H59-K121 WeakPolarHBondContact NE2-CE 3.26Å; H59-K121 PolarHBondContact NE2-NZ 2.97Å
60	R	91.1	Very high	86.4	Confident	168 Å²	168	79.1 Å²	79.1	63%	0.634	40%	0.399	S	S	*	.	H	α-helix	trans	-67.9	-24.4	175	-71.2	178.4	-162.8	112.4	6.7	113.7	M56 E57 I58	M56-R60 WeakPolarHBondContact O-CG 3.36Å; M56-R60 PolarHBondContact O-N 3.44Å; E57-R60 PolarHBondContact O-N 2.81Å; E57-R60 IonicContact OE2-NH1 2.76Å; E57-R60 PolarHBondContact OE2-NH1 3.32Å; I58-R60 VanDerWaalsContact C-N 3.25Å; I58-R60 PolarHBondContact O-N 2.59Å
61	K	91.9	Very high	88	Confident	96 Å²	96	72 Å²	72	42%	0.417	37%	0.365	S	S	.	.	H	α-helix	trans	-88	-5.9	178.5	-70	173.1	179.8	152	0	113.5	E57 I58 H59 M63	E57-K61 PolarHBondContact O-N 3.38Å; E57-K61 WeakPolarHBondContact OE1-CE 3.46Å; E57-K61 IonicContact OE1-NZ 3.62Å; E57-K61 PolarHBondContact OE1-NZ 2.85Å; I58-K61 WeakPolarHBondContact O-CA 3.49Å; I58-K61 WeakPolarHBondContact O-CB 3.49Å; I58-K61 PolarHBondContact O-N 2.9Å; H59-K61 VanDerWaalsContact C-N 3.28Å; H59-K61 PolarHBondContact O-N 2.85Å; K61-M63 PolarHBondContact O-N 2.9Å
62	I	93.9	Very high	89.4	Confident	22 Å²	22	68.8 Å²	68.8	11%	0.113	35%	0.352	C	S	.	.			trans	-74	121.6	178.5	-55.5	-178.4	0	0	0	109.6	I58 H59 Y69 T70 A71 K121 V124 L125	I58-I62 WeakPolarHBondContact O-CG1 3.38Å; I58-I62 PolarHBondContact O-N 3.49Å; H59-I62 PolarHBondContact O-N 3.04Å; I62-Y69 HydrophobicContact CG2-CD1 4.06Å; I62-Y69 HydrophobicContact CG2-CG 4.33Å; I62-T70 CarbonylContact C-O 3.57Å; I62-T70 WeakPolarHBondContact CA-O 3.4Å; I62-A71 HydrophobicContact CG1-CB 4.12Å; I62-K121 HydrophobicContact CD1-CD 4.46Å; I62-K121 HydrophobicContact CD1-CG 3.78Å; I62-K121 HydrophobicContact CG2-CG 4.21Å; I62-V124 HydrophobicContact CD1-CG1 4.47Å; I62-V124 HydrophobicContact CG1-CG1 4.43Å; I62-L125 HydrophobicContact CD1-CB 4.2Å; I62-L125 HydrophobicContact CD1-CD1 4.5Å
63	M	94.8	Very high	90.2	Very high	112 Å²	112	68.9 Å²	68.9	55%	0.552	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	148.4	175.4	-57.6	-175.8	-61.6	0	0	110.5	K61 Y69 T70	K61-M63 PolarHBondContact O-N 2.9Å; M63-Y69 CarbonylContact O-C 3.58Å; M63-Y69 VanDerWaalsContact O-CA 3.3Å; M63-Y69 WeakPolarHBondContact O-CA 3.41Å; M63-T70 HydrophobicContact CB-CG2 4.15Å; M63-T70 HydrophobicContact CE-CG2 3.89Å; M63-T70 PolarHBondContact N-O 2.87Å; M63-T70 PolarHBondContact O-N 3.48Å
64	V	94.5	Very high	90.9	Very high	117 Å²	117	70.7 Å²	70.7	71%	0.709	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	134.7	170.9	-176.6	0	0	0	0	108.7	Y69	V64-Y69 HydrophobicContact CG2-CD1 4.14Å; V64-Y69 HydrophobicContact CG2-CE1 3.92Å
65	V	93.9	Very high	91.5	Very high	55 Å²	55	67.7 Å²	67.7	33%	0.333	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	164.8	174.8	-66.2	0	0	0	0	109.3	N67 G68 T70 T117	V65-N67 PolarHBondContact O-N 3.45Å; V65-G68 PolarHBondContact N-O 2.84Å; V65-G68 PolarHBondContact O-N 2.94Å; V65-G68 VanDerWaalsContact O-O 3.08Å; V65-T70 HydrophobicContact CG1-CG2 3.54Å; V65-T117 HydrophobicContact CG2-CG2 4.33Å
66	D	86.9	Confident	91.9	Very high	167 Å²	167	68 Å²	68	89%	0.893	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.2	-34	-170.4	-63	-21.2	0	0	0	114.5
67	N	86.8	Confident	92.2	Very high	143 Å²	143	67.3 Å²	67.3	77%	0.765	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.4	28.2	-178	-66.8	-34.1	0	0	0	114.2	V65	V65-N67 PolarHBondContact O-N 3.45Å
68	G	94.4	Very high	92.3	Very high	12 Å²	12	66 Å²	66	12%	0.124	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	147.6	-129.9	173.7	0	0	0	0	0	113.6	V65	V65-G68 PolarHBondContact N-O 2.84Å; V65-G68 PolarHBondContact O-N 2.94Å; V65-G68 VanDerWaalsContact O-O 3.08Å
69	Y	97.1	Very high	92.5	Very high	78 Å²	78	65.7 Å²	65.7	31%	0.306	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	147.2	-172.4	-56.7	-88.4	0	0	0	109.8	I62 M63 V64 T117 A118 T119 K121 V124	I62-Y69 HydrophobicContact CG2-CD1 4.06Å; I62-Y69 HydrophobicContact CG2-CG 4.33Å; M63-Y69 CarbonylContact O-C 3.58Å; M63-Y69 VanDerWaalsContact O-CA 3.3Å; M63-Y69 WeakPolarHBondContact O-CA 3.41Å; V64-Y69 HydrophobicContact CG2-CD1 4.14Å; V64-Y69 HydrophobicContact CG2-CE1 3.92Å; Y69-T117 WeakPolarHBondContact O-CA 3.4Å; Y69-A118 PolarHBondContact N-O 3.21Å; Y69-A118 PolarHBondContact O-N 2.89Å; Y69-T119 WeakPolarHBondContact CD2-O 3.49Å; Y69-T119 WeakPolarHBondContact CE2-O 3.37Å; Y69-K121 HydrophobicContact CD1-CB 3.99Å; Y69-K121 HydrophobicContact CD1-CD 4.38Å; Y69-K121 HydrophobicContact CD1-CG 4.37Å; Y69-K121 HydrophobicContact CD2-CB 3.87Å; Y69-K121 HydrophobicContact CE1-CB 4.12Å; Y69-K121 HydrophobicContact CE1-CD 4.33Å; Y69-K121 HydrophobicContact CE2-CB 4.01Å; Y69-K121 HydrophobicContact CG-CB 3.85Å; Y69-V124 WeakPolarHBondContact O-CG2 3.47Å
70	T	97.2	Very high	92.7	Very high	15 Å²	15	62.4 Å²	62.4	9%	0.092	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	147	174.1	-166.2	0	0	0	0	111.1	I62 M63 V65 V116 T117	I62-T70 CarbonylContact C-O 3.57Å; I62-T70 WeakPolarHBondContact CA-O 3.4Å; M63-T70 HydrophobicContact CB-CG2 4.15Å; M63-T70 HydrophobicContact CE-CG2 3.89Å; M63-T70 PolarHBondContact N-O 2.87Å; M63-T70 PolarHBondContact O-N 3.48Å; V65-T70 HydrophobicContact CG1-CG2 3.54Å; T70-V116 CarbonylContact C-O 3.52Å; T70-V116 VanDerWaalsContact CA-O 3.22Å; T70-V116 WeakPolarHBondContact CA-O 3.44Å; T70-V116 PolarHBondContact OG1-O 3.2Å; T70-T117 PolarHBondContact OG1-OG1 3.4Å
71	A	96.9	Very high	92.8	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	145.9	171.1	0	0	0	0	0	110	I62 S115 V116 V124	I62-A71 HydrophobicContact CG1-CB 4.12Å; A71-S115 CarbonylContact O-C 3.58Å; A71-S115 WeakPolarHBondContact O-CA 3.38Å; A71-V116 PolarHBondContact N-O 3.21Å; A71-V116 PolarHBondContact O-N 2.91Å; A71-V124 HydrophobicContact CB-CG1 3.49Å; A71-V124 VanDerWaalsContact CB-CG1 3.49Å
72	S	95.1	Very high	92.8	Very high	50 Å²	50	55.2 Å²	55.2	35%	0.35	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	128.4	175.2	-69.8	0	0	0	0	110	I114	S72-I114 WeakPolarHBondContact CA-O 3.25Å
73	I	93.8	Very high	92.8	Very high	10 Å²	10	54.2 Å²	54.2	5%	0.051	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	143.4	176.9	56.5	172.4	0	0	0	110.2	V75 T113 I114 C128 I131 L132	I73-V75 HydrophobicContact CD1-CG2 4.1Å; I73-V75 HydrophobicContact CG1-CG2 4.21Å; I73-T113 WeakPolarHBondContact O-CA 3.29Å; I73-I114 HydrophobicContact CG1-CB 4.17Å; I73-I114 PolarHBondContact N-O 3.11Å; I73-I114 PolarHBondContact O-N 3.08Å; I73-C128 HydrophobicContact CG2-CB 4.28Å; I73-I131 HydrophobicContact CD1-CB 3.94Å; I73-I131 HydrophobicContact CD1-CD1 4.29Å; I73-I131 HydrophobicContact CD1-CG2 3.55Å; I73-L132 HydrophobicContact CD1-CD2 4.33Å; I73-L132 HydrophobicContact CD1-CG 4.31Å
74	K	91.3	Very high	92.8	Very high	127 Å²	127	50.2 Å²	50.2	55%	0.552	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	115.7	176.6	-170.4	179.8	178.6	-174.6	0	109.2	S112 S206	K74-S112 CarbonylContact C-O 3.6Å; K74-S112 VanDerWaalsContact CA-O 3.31Å; K74-S112 WeakPolarHBondContact CA-O 3.39Å; K74-S112 WeakPolarHBondContact CE-OG 3.17Å; K74-S206 PolarHBondContact NZ-OG 2.94Å
75	V	92.5	Very high	92.6	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.024	24%	0.241	C	C	.	.			trans	-130.4	122.2	175.1	-179.3	0	0	0	0	108.5	I73 F79 H80 I83 S112 I114 I131 V135	I73-V75 HydrophobicContact CD1-CG2 4.1Å; I73-V75 HydrophobicContact CG1-CG2 4.21Å; V75-F79 HydrophobicContact CG1-CB 3.92Å; V75-H80 PolarHBondContact O-NE2 2.89Å; V75-I83 HydrophobicContact CG1-CD1 3.93Å; V75-S112 CarbonylContact C-O 3.41Å; V75-S112 PolarHBondContact N-O 2.85Å; V75-S112 CarbonylContact O-C 3.54Å; V75-S112 WeakPolarHBondContact O-CA 3.49Å; V75-I114 HydrophobicContact CB-CD1 3.82Å; V75-I114 HydrophobicContact CB-CG1 4.33Å; V75-I114 HydrophobicContact CG1-CD1 4.18Å; V75-I114 HydrophobicContact CG2-CD1 3.98Å; V75-I131 HydrophobicContact CG2-CG2 4.25Å; V75-V135 HydrophobicContact CG1-CG2 3.52Å; V75-V135 HydrophobicContact CG2-CG2 4.18Å
76	S	90.7	Very high	92.4	Very high	11 Å²	11	47.5 Å²	47.5	8%	0.077	26%	0.255	C	S	.	.			trans	-57.1	138.9	176.6	177.4	0	0	0	0	110.9	L78 F79 H80 A203	S76-L78 PolarHBondContact O-N 2.84Å; S76-F79 PolarHBondContact O-N 3.43Å; S76-H80 PolarHBondContact O-CD2 3.44Å; S76-A203 VanDerWaalsContact OG-CB 3.29Å; S76-A203 WeakPolarHBondContact OG-CB 3.39Å
77	P	90.4	Very high	92.5	Very high	59 Å²	59	47.6 Å²	47.6	38%	0.383	25%	0.25	S	C	.	.	H	α-helix	trans	-51.7	-26.2	176.4	-28.8	36.1	0	0	0	114.4	F79 H80	P77-F79 PolarHBondContact O-N 2.84Å; P77-F79 VanDerWaalsContact O-N 3.12Å; P77-H80 PolarHBondContact O-N 3.16Å
78	L	88.6	Confident	92.7	Very high	50 Å²	50	45.8 Å²	45.8	26%	0.262	24%	0.237	S	C	.	.	H	α-helix	trans	-54.1	-31.1	174.3	-171.3	143.3	0	0	0	112.7	I34 S76 A203	I34-L78 HydrophobicContact CD1-CD1 4.49Å; S76-L78 PolarHBondContact O-N 2.84Å; L78-A203 HydrophobicContact CB-CB 4.34Å; L78-A203 HydrophobicContact CD1-CB 4.49Å
79	F	92.4	Very high	92.7	Very high	1 Å²	1	47.9 Å²	47.9	0%	0.004	25%	0.249	C	C	.	.	H	α-helix	trans	-99.8	-10.3	-176.4	-55	-69.3	0	0	0	114.7	V75 S76 P77 K81 F82 V135 A138 R139 V201 A203	V75-F79 HydrophobicContact CG1-CB 3.92Å; S76-F79 PolarHBondContact O-N 3.43Å; P77-F79 PolarHBondContact O-N 2.84Å; P77-F79 VanDerWaalsContact O-N 3.12Å; F79-K81 VanDerWaalsContact C-N 3.28Å; F79-K81 PolarHBondContact O-N 3.39Å; F79-F82 HydrophobicContact CB-CD2 4.49Å; F79-F82 HydrophobicContact CD1-CD2 4.44Å; F79-F82 HydrophobicContact CD1-CE2 4.41Å; F79-F82 PolarHBondContact O-N 3.27Å; F79-V135 HydrophobicContact CB-CG1 4.19Å; F79-V135 HydrophobicContact CB-CG2 4.02Å; F79-V135 HydrophobicContact CD1-CG1 4.37Å; F79-V135 HydrophobicContact CD2-CG1 3.82Å; F79-V135 HydrophobicContact CE2-CG1 4.3Å; F79-V135 HydrophobicContact CG-CG1 3.86Å; F79-A138 HydrophobicContact CD1-CB 4.12Å; F79-R139 HydrophobicContact CE1-CB 3.87Å; F79-R139 HydrophobicContact CE1-CG 4.25Å; F79-R139 VanDerWaalsContact CE2-NH2 3.27Å; F79-R139 HydrophobicContact CZ-CB 4.08Å; F79-R139 HydrophobicContact CZ-CG 4.04Å; F79-R139 VanDerWaalsContact CZ-CZ 3.44Å; F79-V201 HydrophobicContact CZ-CG1 4.32Å; F79-A203 HydrophobicContact CE2-CB 3.86Å; F79-A203 HydrophobicContact CZ-CB 4.38Å
80	H	93.4	Very high	92.5	Very high	14 Å²	14	45.8 Å²	45.8	7%	0.065	24%	0.242	C	C	.	.	H	α-helix	trans	-56.8	-42.2	-174	-71.3	-179.2	0	0	0	112.5	V75 S76 P77 F82 I83 V84 I104	V75-H80 PolarHBondContact O-NE2 2.89Å; S76-H80 PolarHBondContact O-CD2 3.44Å; P77-H80 PolarHBondContact O-N 3.16Å; H80-F82 PolarHBondContact O-N 3.49Å; H80-I83 WeakPolarHBondContact O-CB 3.2Å; H80-I83 PolarHBondContact O-N 3.31Å; H80-V84 WeakPolarHBondContact O-CG2 3.37Å; H80-V84 PolarHBondContact O-N 2.89Å; H80-I104 HydrophobicContact CB-CG2 3.93Å
81	K	91.6	Very high	92.5	Very high	92 Å²	92	46.7 Å²	46.7	40%	0.4	25%	0.245	S	C	.	.	H	α-helix	trans	-61.2	-26.5	179.9	64.1	175.2	172.8	-179.2	0	114.7	I34 F79 I83 G85	I34-K81 WeakPolarHBondContact O-CE 3.22Å; I34-K81 PolarHBondContact O-NZ 2.92Å; F79-K81 VanDerWaalsContact C-N 3.28Å; F79-K81 PolarHBondContact O-N 3.39Å; K81-I83 VanDerWaalsContact C-N 3.33Å; K81-G85 PolarHBondContact O-N 2.9Å
82	F	92.1	Very high	92.5	Very high	21 Å²	21	52.4 Å²	52.4	9%	0.092	27%	0.269	C	S	.	.	H	α-helix	trans	-76.7	-26	177.5	-60.2	-87.6	0	0	0	111.8	I34 I37 F79 H80 K90 I134 A138	I34-F82 HydrophobicContact CG2-CE2 4.05Å; I34-F82 HydrophobicContact CG2-CZ 3.74Å; I37-F82 HydrophobicContact CB-CE1 3.93Å; I37-F82 HydrophobicContact CD1-CE1 3.74Å; I37-F82 HydrophobicContact CD1-CZ 3.64Å; I37-F82 HydrophobicContact CG1-CE1 4.44Å; I37-F82 HydrophobicContact CG2-CE1 3.88Å; F79-F82 HydrophobicContact CB-CD2 4.49Å; F79-F82 HydrophobicContact CD1-CD2 4.44Å; F79-F82 HydrophobicContact CD1-CE2 4.41Å; F79-F82 PolarHBondContact O-N 3.27Å; H80-F82 PolarHBondContact O-N 3.49Å; F82-K90 VanDerWaalsContact O-CD 3.27Å; F82-K90 WeakPolarHBondContact O-CD 3.48Å; F82-I134 HydrophobicContact CB-CG2 3.98Å; F82-A138 HydrophobicContact CB-CB 3.93Å; F82-A138 HydrophobicContact CD1-CB 3.74Å; F82-A138 HydrophobicContact CD2-CB 3.68Å; F82-A138 HydrophobicContact CE1-CB 4.06Å; F82-A138 HydrophobicContact CE2-CB 4.01Å; F82-A138 HydrophobicContact CG-CB 3.51Å; F82-A138 HydrophobicContact CZ-CB 4.17Å
83	I	94.5	Very high	92.6	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-80	-41	173.7	-55.7	161.5	0	0	0	109.5	V75 H80 K81 K90 K91 L94 I104 I114 I131 I134 V135	V75-I83 HydrophobicContact CG1-CD1 3.93Å; H80-I83 WeakPolarHBondContact O-CB 3.2Å; H80-I83 PolarHBondContact O-N 3.31Å; K81-I83 VanDerWaalsContact C-N 3.33Å; I83-K90 CarbonylContact O-C 3.58Å; I83-K90 WeakPolarHBondContact O-CB 3.5Å; I83-K91 PolarHBondContact O-N 3.25Å; I83-K91 VanDerWaalsContact O-N 3.11Å; I83-L94 HydrophobicContact CG2-CD1 4.13Å; I83-I104 HydrophobicContact CB-CD1 4.15Å; I83-I104 HydrophobicContact CG2-CD1 3.68Å; I83-I114 HydrophobicContact CD1-CD1 3.43Å; I83-I114 VanDerWaalsContact CD1-CD1 3.43Å; I83-I131 HydrophobicContact CD1-CG2 3.51Å; I83-I131 HydrophobicContact CG1-CG2 4.06Å; I83-I131 HydrophobicContact CG2-CG1 4.11Å; I83-I131 HydrophobicContact CG2-CG2 4.46Å; I83-I134 HydrophobicContact CG1-CG2 4.08Å; I83-V135 HydrophobicContact CD1-CG2 3.98Å; I83-V135 HydrophobicContact CG1-CG2 4.45Å
84	V	94	Very high	92.7	Very high	29 Å²	29	53.5 Å²	53.5	18%	0.176	27%	0.271	C	S	.	.	H	α-helix	trans	-65.3	-50	177.4	177.8	0	0	0	0	110.8	H80 H88 S89 K90 K91 I104	H80-V84 WeakPolarHBondContact O-CG2 3.37Å; H80-V84 PolarHBondContact O-N 2.89Å; V84-H88 HydrophobicContact CG1-CB 4.18Å; V84-H88 WeakPolarHBondContact CG1-CD2 3.43Å; V84-H88 CarbonylContact O-C 3.53Å; V84-H88 WeakPolarHBondContact O-CA 3.48Å; V84-S89 PolarHBondContact O-N 3Å; V84-K90 PolarHBondContact O-N 2.79Å; V84-K91 PolarHBondContact O-N 2.98Å; V84-K91 VanDerWaalsContact O-N 3.11Å; V84-I104 HydrophobicContact CG2-CD1 3.69Å; V84-I104 HydrophobicContact CG2-CG2 4.35Å
85	G	91.5	Very high	93	Very high	10 Å²	10	49 Å²	49	10%	0.103	25%	0.252	C	S	.	.			trans	72.5	170.1	-173.3	0	0	0	0	0	113.1	E39 K81 Q87 H88	E39-G85 WeakPolarHBondContact OE1-CA 3.03Å; K81-G85 PolarHBondContact O-N 2.9Å; G85-Q87 PolarHBondContact O-N 2.79Å; G85-H88 PolarHBondContact O-N 2.7Å; G85-H88 VanDerWaalsContact O-N 3.15Å
86	V	90.2	Very high	93.2	Very high	105 Å²	105	54.9 Å²	54.9	64%	0.636	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-58.8	129.1	176.5	179.7	0	0	0	0	110.2	E39 H88 S89	E39-V86 PolarHBondContact OE1-N 3.04Å; E39-V86 VanDerWaalsContact OE1-N 3.1Å; V86-H88 PolarHBondContact O-N 3.3Å; V86-H88 VanDerWaalsContact O-N 3.12Å; V86-S89 VanDerWaalsContact O-CB 3.28Å; V86-S89 WeakPolarHBondContact O-CB 3.36Å; V86-S89 PolarHBondContact O-N 2.88Å; V86-S89 PolarHBondContact O-OG 3.03Å
87	Q	88.5	Confident	93.5	Very high	168 Å²	168	58 Å²	58	79%	0.785	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	54	28.7	-177.4	-62.3	179.8	-0.8	0	0	114.7	G85 S89	G85-Q87 PolarHBondContact O-N 2.79Å; Q87-S89 PolarHBondContact O-N 3.32Å
88	H	90.9	Very high	93.7	Very high	106 Å²	106	56.2 Å²	56.2	49%	0.491	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	64.1	19.6	-176.9	-48.7	77.3	0	0	0	114	V84 G85 V86 K91 K92	V84-H88 HydrophobicContact CG1-CB 4.18Å; V84-H88 WeakPolarHBondContact CG1-CD2 3.43Å; V84-H88 CarbonylContact O-C 3.53Å; V84-H88 WeakPolarHBondContact O-CA 3.48Å; G85-H88 PolarHBondContact O-N 2.7Å; G85-H88 VanDerWaalsContact O-N 3.15Å; V86-H88 PolarHBondContact O-N 3.3Å; V86-H88 VanDerWaalsContact O-N 3.12Å; H88-K91 PolarHBondContact O-N 3.01Å; H88-K92 WeakPolarHBondContact O-CG 3.39Å; H88-K92 PolarHBondContact O-N 2.84Å
89	S	94.2	Very high	94.1	Very high	55 Å²	55	63.4 Å²	63.4	39%	0.385	31%	0.306	S	S	.	.	H	α-helix	trans	-59.4	-48.2	-176.4	59.3	0	0	0	0	112.4	V84 V86 Q87 K92 L93	V84-S89 PolarHBondContact O-N 3Å; V86-S89 VanDerWaalsContact O-CB 3.28Å; V86-S89 WeakPolarHBondContact O-CB 3.36Å; V86-S89 PolarHBondContact O-N 2.88Å; V86-S89 PolarHBondContact O-OG 3.03Å; Q87-S89 PolarHBondContact O-N 3.32Å; S89-K92 PolarHBondContact O-N 2.98Å; S89-L93 WeakPolarHBondContact O-CB 3.33Å; S89-L93 PolarHBondContact O-N 3.36Å
90	K	93.7	Very high	94.3	Very high	35 Å²	35	64 Å²	64	15%	0.152	31%	0.311	C	S	.	.	H	α-helix	trans	-66.4	-44.1	-179.7	-75.7	-177.3	173.5	-81.3	0	111.7	E39 F82 I83 V84 K92 L93 L94	E39-K90 HydrophobicContact CG-CD 4.5Å; E39-K90 VanDerWaalsContact CG-CE 3.49Å; E39-K90 VanDerWaalsContact OE2-CE 3.23Å; E39-K90 WeakPolarHBondContact OE2-CE 3.43Å; F82-K90 VanDerWaalsContact O-CD 3.27Å; F82-K90 WeakPolarHBondContact O-CD 3.48Å; I83-K90 CarbonylContact O-C 3.58Å; I83-K90 WeakPolarHBondContact O-CB 3.5Å; V84-K90 PolarHBondContact O-N 2.79Å; K90-K92 VanDerWaalsContact C-N 3.34Å; K90-K92 PolarHBondContact O-N 2.85Å; K90-L93 PolarHBondContact O-N 3.3Å; K90-L94 VanDerWaalsContact O-CG 3.3Å; K90-L94 WeakPolarHBondContact O-CG 3.33Å; K90-L94 PolarHBondContact O-N 3.18Å
91	K	96.6	Very high	94.5	Very high	34 Å²	34	69.4 Å²	69.4	15%	0.148	33%	0.331	C	S	.	.	H	α-helix	trans	-56.3	-50	174.9	177	-174.6	167.3	176.8	0	110.9	I83 V84 H88 L93 L94 E95 I102 I104	I83-K91 PolarHBondContact O-N 3.25Å; I83-K91 VanDerWaalsContact O-N 3.11Å; V84-K91 PolarHBondContact O-N 2.98Å; V84-K91 VanDerWaalsContact O-N 3.11Å; H88-K91 PolarHBondContact O-N 3.01Å; K91-L93 VanDerWaalsContact C-N 3.33Å; K91-L93 PolarHBondContact O-N 2.88Å; K91-L94 PolarHBondContact O-N 3.44Å; K91-E95 WeakPolarHBondContact CE-OE1 3.4Å; K91-E95 WeakPolarHBondContact CE-OE2 3.46Å; K91-E95 HydrophobicContact CG-CG 4.38Å; K91-E95 IonicContact NZ-OE1 3.47Å; K91-E95 WeakPolarHBondContact O-CG 3.39Å; K91-E95 PolarHBondContact O-N 3.11Å; K91-I102 WeakPolarHBondContact CE-O 2.89Å; K91-I102 PolarHBondContact NZ-O 2.96Å; K91-I104 HydrophobicContact CD-CD1 4.34Å
92	K	96.5	Very high	94.8	Very high	120 Å²	120	65 Å²	65	52%	0.522	31%	0.312	S	S	.	.	H	α-helix	trans	-60	-43.7	179	-73.5	173.3	-179.8	174.7	0	111.9	H88 S89 K90 L94 E95 D96	H88-K92 WeakPolarHBondContact O-CG 3.39Å; H88-K92 PolarHBondContact O-N 2.84Å; S89-K92 PolarHBondContact O-N 2.98Å; K90-K92 VanDerWaalsContact C-N 3.34Å; K90-K92 PolarHBondContact O-N 2.85Å; K92-L94 VanDerWaalsContact C-N 3.33Å; K92-L94 PolarHBondContact O-N 2.8Å; K92-E95 PolarHBondContact O-N 3.49Å; K92-D96 WeakPolarHBondContact O-CB 3.18Å; K92-D96 VanDerWaalsContact O-CG 3.26Å; K92-D96 PolarHBondContact O-N 2.78Å
93	L	96.7	Very high	94.9	Very high	79 Å²	79	67.4 Å²	67.4	41%	0.414	33%	0.326	S	S	.	.	H	α-helix	trans	-58.2	-45.1	176.7	-174.6	153.8	0	0	0	111.6	S89 K90 K91 D96 E97	S89-L93 WeakPolarHBondContact O-CB 3.33Å; S89-L93 PolarHBondContact O-N 3.36Å; K90-L93 PolarHBondContact O-N 3.3Å; K91-L93 VanDerWaalsContact C-N 3.33Å; K91-L93 PolarHBondContact O-N 2.88Å; L93-D96 PolarHBondContact O-N 3.35Å; L93-E97 WeakPolarHBondContact O-CB 3.43Å; L93-E97 PolarHBondContact O-N 3.21Å
94	L	97	Very high	94.9	Very high	3 Å²	3	68.3 Å²	68.3	2%	0.016	33%	0.331	C	S	.	.	H	α-helix	trans	-65.2	-41.8	176.6	-65.1	170.8	0	0	0	112.4	I83 K90 K91 K92 D96 F98 I102 R130 I131 I134	I83-L94 HydrophobicContact CG2-CD1 4.13Å; K90-L94 VanDerWaalsContact O-CG 3.3Å; K90-L94 WeakPolarHBondContact O-CG 3.33Å; K90-L94 PolarHBondContact O-N 3.18Å; K91-L94 PolarHBondContact O-N 3.44Å; K92-L94 VanDerWaalsContact C-N 3.33Å; K92-L94 PolarHBondContact O-N 2.8Å; L94-D96 VanDerWaalsContact C-N 3.33Å; L94-F98 HydrophobicContact CD2-CD2 4.44Å; L94-F98 HydrophobicContact CD2-CE2 3.96Å; L94-F98 WeakPolarHBondContact O-CD2 3.06Å; L94-F98 PolarHBondContact O-N 3.18Å; L94-I102 HydrophobicContact CB-CD1 3.58Å; L94-I102 HydrophobicContact CD1-CD1 4.16Å; L94-R130 HydrophobicContact CD2-CB 4.12Å; L94-R130 HydrophobicContact CD2-CG 3.3Å; L94-I131 HydrophobicContact CD1-CG1 4.3Å; L94-I134 HydrophobicContact CD1-CD1 3.83Å; L94-I134 HydrophobicContact CD2-CD1 4.28Å
95	E	98	Very high	94.7	Very high	34 Å²	34	68 Å²	68	16%	0.159	33%	0.329	C	S	.	.	H	α-helix	trans	-62.4	-41.1	176.6	-73.4	-178.8	148.7	0	0	111.4	K91 K92 R99 C100 I102	K91-E95 WeakPolarHBondContact CE-OE1 3.4Å; K91-E95 WeakPolarHBondContact CE-OE2 3.46Å; K91-E95 HydrophobicContact CG-CG 4.38Å; K91-E95 IonicContact NZ-OE1 3.47Å; K91-E95 WeakPolarHBondContact O-CG 3.39Å; K91-E95 PolarHBondContact O-N 3.11Å; K92-E95 PolarHBondContact O-N 3.49Å; E95-R99 CarbonylContact O-C 3.48Å; E95-R99 WeakPolarHBondContact O-CA 3.32Å; E95-R99 PolarHBondContact O-N 3.34Å; E95-C100 WeakPolarHBondContact CA-O 3.15Å; E95-C100 VanDerWaalsContact CB-O 3.27Å; E95-C100 WeakPolarHBondContact CB-O 3.34Å; E95-C100 WeakPolarHBondContact CG-O 3.16Å; E95-C100 PolarHBondContact O-N 3.23Å; E95-I102 HydrophobicContact CG-CB 4.2Å; E95-I102 HydrophobicContact CG-CD1 3.96Å; E95-I102 HydrophobicContact CG-CG1 3.85Å; E95-I102 PolarHBondContact OE1-N 3.08Å
96	D	96.6	Very high	94.4	Very high	126 Å²	126	74 Å²	74	67%	0.674	36%	0.359	S	S	*	.	H	α-helix	trans	-70.9	-48.4	177.3	-70.8	-22.9	0	0	0	111.9	K92 L93 L94 F98 R99	K92-D96 WeakPolarHBondContact O-CB 3.18Å; K92-D96 VanDerWaalsContact O-CG 3.26Å; K92-D96 PolarHBondContact O-N 2.78Å; L93-D96 PolarHBondContact O-N 3.35Å; L94-D96 VanDerWaalsContact C-N 3.33Å; D96-F98 PolarHBondContact O-N 2.89Å; D96-R99 PolarHBondContact O-N 3.43Å
97	E	96	Very high	93.5	Very high	78 Å²	78	75.5 Å²	75.5	36%	0.364	37%	0.374	S	S	.	.	H	α-helix	trans	-58.3	-49.3	-179.8	-176.7	-179.2	174.1	0	0	110.9	L93 R130	L93-E97 WeakPolarHBondContact O-CB 3.43Å; L93-E97 PolarHBondContact O-N 3.21Å; E97-R130 IonicContact OE1-CZ 3.15Å; E97-R130 IonicContact OE1-NH1 3.6Å; E97-R130 PolarHBondContact OE1-NH1 3.06Å; E97-R130 IonicContact OE1-NH2 2.78Å; E97-R130 PolarHBondContact OE1-NH2 3.04Å; E97-R130 IonicContact OE2-CZ 2.6Å; E97-R130 IonicContact OE2-NH1 3.56Å; E97-R130 PolarHBondContact OE2-NH1 3.41Å; E97-R130 IonicContact OE2-NH2 2.7Å
98	F	95.6	Very high	92.7	Very high	20 Å²	20	71.1 Å²	71.1	9%	0.088	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	6.4	-177.1	-57.2	-64	0	0	0	113.6	L94 D96 C100 N123 N126 A127 R130	L94-F98 HydrophobicContact CD2-CD2 4.44Å; L94-F98 HydrophobicContact CD2-CE2 3.96Å; L94-F98 WeakPolarHBondContact O-CD2 3.06Å; L94-F98 PolarHBondContact O-N 3.18Å; D96-F98 PolarHBondContact O-N 2.89Å; F98-C100 HydrophobicContact CB-CB 4.45Å; F98-C100 PolarHBondContact O-N 3.28Å; F98-N123 WeakPolarHBondContact O-CB 3.48Å; F98-N123 PolarHBondContact O-ND2 3.29Å; F98-N126 HydrophobicContact CD1-CB 3.81Å; F98-N126 HydrophobicContact CE1-CB 3.65Å; F98-N126 HydrophobicContact CZ-CB 4.41Å; F98-A127 HydrophobicContact CB-CB 3.9Å; F98-A127 HydrophobicContact CD2-CB 3.76Å; F98-A127 HydrophobicContact CG-CB 3.91Å; F98-R130 HydrophobicContact CE2-CB 3.8Å; F98-R130 HydrophobicContact CE2-CG 4.05Å; F98-R130 HydrophobicContact CZ-CB 4.08Å; F98-R130 HydrophobicContact CZ-CG 4.43Å
99	R	96.2	Very high	92	Very high	201 Å²	201	68.6 Å²	68.6	76%	0.758	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	45	52.6	-178.5	-54.5	179.6	-173.6	169.9	2	111.6	E95 D96	E95-R99 CarbonylContact O-C 3.48Å; E95-R99 WeakPolarHBondContact O-CA 3.32Å; E95-R99 PolarHBondContact O-N 3.34Å; D96-R99 PolarHBondContact O-N 3.43Å
100	C	97.2	Very high	90.9	Very high	15 Å²	15	73.6 Å²	73.6	10%	0.101	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	167.4	-174	73.9	0	0	0	0	110.7	E95 F98 V116 T117 A118	E95-C100 WeakPolarHBondContact CA-O 3.15Å; E95-C100 VanDerWaalsContact CB-O 3.27Å; E95-C100 WeakPolarHBondContact CB-O 3.34Å; E95-C100 WeakPolarHBondContact CG-O 3.16Å; E95-C100 PolarHBondContact O-N 3.23Å; F98-C100 HydrophobicContact CB-CB 4.45Å; F98-C100 PolarHBondContact O-N 3.28Å; C100-V116 HydrophobicContact CB-CG1 4.13Å; C100-T117 CarbonylContact C-O 3.57Å; C100-T117 WeakPolarHBondContact CA-O 3.4Å; C100-A118 HydrophobicContact CB-CB 3.7Å
101	Y	97.2	Very high	90.4	Very high	126 Å²	126	74.1 Å²	74.1	49%	0.494	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	127.4	168.3	176.4	-102.1	0	0	0	108.7	D103 V116 T117	Y101-D103 HydrophobicContact CE1-CB 3.83Å; Y101-D103 PolarHBondContact OH-OD1 3.16Å; Y101-V116 WeakPolarHBondContact O-CA 3.38Å; Y101-T117 PolarHBondContact N-O 3.07Å; Y101-T117 PolarHBondContact O-N 3.5Å
102	I	97.3	Very high	90	Very high	0 Å²	0	73.7 Å²	73.7	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	112.2	-179.5	-55.9	172	0	0	0	108.4	K91 L94 E95 I104 I114 S115 V116 I131	K91-I102 WeakPolarHBondContact CE-O 2.89Å; K91-I102 PolarHBondContact NZ-O 2.96Å; L94-I102 HydrophobicContact CB-CD1 3.58Å; L94-I102 HydrophobicContact CD1-CD1 4.16Å; E95-I102 HydrophobicContact CG-CB 4.2Å; E95-I102 HydrophobicContact CG-CD1 3.96Å; E95-I102 HydrophobicContact CG-CG1 3.85Å; E95-I102 PolarHBondContact OE1-N 3.08Å; I102-I104 HydrophobicContact CG2-CD1 4.09Å; I102-I104 HydrophobicContact CG2-CG1 3.79Å; I102-I114 HydrophobicContact CG2-CG2 3.78Å; I102-S115 WeakPolarHBondContact CA-O 3.16Å; I102-V116 HydrophobicContact CG1-CG2 4.39Å; I102-I131 HydrophobicContact CD1-CD1 4.19Å; I102-I131 HydrophobicContact CG2-CD1 4.04Å
103	D	95.7	Very high	89.8	Confident	72 Å²	72	70.9 Å²	70.9	39%	0.385	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	115.3	174.6	-166.5	47.2	0	0	0	110.2	Y101 I114 S115	Y101-D103 HydrophobicContact CE1-CB 3.83Å; Y101-D103 PolarHBondContact OH-OD1 3.16Å; D103-I114 WeakPolarHBondContact O-CA 3.43Å; D103-I114 WeakPolarHBondContact O-CG2 3.29Å; D103-S115 VanDerWaalsContact CB-OG 3.29Å; D103-S115 WeakPolarHBondContact CB-OG 3.38Å; D103-S115 PolarHBondContact N-O 3.48Å; D103-S115 PolarHBondContact O-N 3.36Å
104	I	94	Very high	89.7	Confident	19 Å²	19	67.1 Å²	67.1	10%	0.097	37%	0.373	C	S	.	.			trans	-115.7	126.7	179.4	-54.9	179.1	0	0	0	107.3	H80 I83 V84 K91 I102 I114	H80-I104 HydrophobicContact CB-CG2 3.93Å; I83-I104 HydrophobicContact CB-CD1 4.15Å; I83-I104 HydrophobicContact CG2-CD1 3.68Å; V84-I104 HydrophobicContact CG2-CD1 3.69Å; V84-I104 HydrophobicContact CG2-CG2 4.35Å; K91-I104 HydrophobicContact CD-CD1 4.34Å; I102-I104 HydrophobicContact CG2-CD1 4.09Å; I102-I104 HydrophobicContact CG2-CG1 3.79Å; I104-I114 HydrophobicContact CG1-CD1 4.19Å; I104-I114 HydrophobicContact CG1-CG1 4.31Å; I104-I114 HydrophobicContact CG1-CG2 4.18Å; I104-I114 HydrophobicContact CG2-CD1 4.22Å; I104-I114 HydrophobicContact CG2-CG1 4.3Å
105	P	90.2	Very high	89.7	Confident	22 Å²	22	68.1 Å²	68.1	14%	0.143	38%	0.381	C	S	.	.			trans	-54.4	141.5	176.5	-26.9	35.6	0	0	0	112.4	S111 T113	P105-S111 WeakPolarHBondContact CG-O 3.23Å; P105-T113 VanDerWaalsContact CD-O 3.23Å; P105-T113 WeakPolarHBondContact CD-O 3.19Å; P105-T113 WeakPolarHBondContact CG-O 2.9Å
106	N	84	Confident	89.7	Confident	136 Å²	136	66.5 Å²	66.5	73%	0.727	37%	0.373	S	S	*	.			trans	-59.9	150.2	175.9	-71	-29.8	0	0	0	111.3	G108 S109	N106-G108 PolarHBondContact O-N 2.84Å; N106-S109 WeakPolarHBondContact O-CB 3.49Å; N106-S109 PolarHBondContact O-N 3.45Å
107	S	72.6	Confident	89.7	Confident	136 Å²	136	62.9 Å²	62.9	95%	0.951	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-10.9	-175	-171.7	0	0	0	0	116.2
108	G	70.8	Confident	89.8	Confident	77 Å²	77	59.5 Å²	59.5	79%	0.794	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-2.6	174	0	0	0	0	0	114.7	N106	N106-G108 PolarHBondContact O-N 2.84Å
109	S	75.7	Confident	89.8	Confident	53 Å²	53	63.7 Å²	63.7	37%	0.371	37%	0.368	S	S	.	.			trans	-84.8	134.1	175.3	-178.2	0	0	0	0	109.8	N106 S111	N106-S109 WeakPolarHBondContact O-CB 3.49Å; N106-S109 PolarHBondContact O-N 3.45Å; S109-S111 PolarHBondContact O-N 3.05Å; S109-S111 VanDerWaalsContact OG-CB 3.27Å; S109-S111 WeakPolarHBondContact OG-CB 3.36Å; S109-S111 PolarHBondContact OG-N 2.8Å; S109-S111 VanDerWaalsContact OG-N 3.14Å
110	N	71.7	Confident	89.6	Confident	160 Å²	160	56 Å²	56	86%	0.856	35%	0.346	S	S	*	.			trans	-76.4	3.8	169.9	-68.6	-14.3	0	0	0	112.4	S112	N110-S112 PolarHBondContact O-N 3.5Å
111	S	83.9	Confident	89.5	Confident	45 Å²	45	58.8 Å²	58.8	32%	0.315	36%	0.356	S	S	.	.			trans	-67.8	124.7	177.3	-178.7	0	0	0	0	110.5	P105 S109 T113	P105-S111 WeakPolarHBondContact CG-O 3.23Å; S109-S111 PolarHBondContact O-N 3.05Å; S109-S111 VanDerWaalsContact OG-CB 3.27Å; S109-S111 WeakPolarHBondContact OG-CB 3.36Å; S109-S111 PolarHBondContact OG-N 2.8Å; S109-S111 VanDerWaalsContact OG-N 3.14Å; S111-T113 PolarHBondContact OG-N 3.27Å
112	S	87.1	Confident	89.2	Confident	25 Å²	25	58.2 Å²	58.2	18%	0.175	36%	0.356	C	S	.	.			trans	-96.3	14.3	174.3	63.1	0	0	0	0	112.5	K74 V75 N110	K74-S112 CarbonylContact C-O 3.6Å; K74-S112 VanDerWaalsContact CA-O 3.31Å; K74-S112 WeakPolarHBondContact CA-O 3.39Å; K74-S112 WeakPolarHBondContact CE-OG 3.17Å; V75-S112 CarbonylContact C-O 3.41Å; V75-S112 PolarHBondContact N-O 2.85Å; V75-S112 CarbonylContact O-C 3.54Å; V75-S112 WeakPolarHBondContact O-CA 3.49Å; N110-S112 PolarHBondContact O-N 3.5Å
113	T	92.6	Very high	89.1	Confident	61 Å²	61	59.6 Å²	59.6	37%	0.374	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121.1	-173	-56.9	0	0	0	0	110.3	I73 P105 S111	I73-T113 WeakPolarHBondContact O-CA 3.29Å; P105-T113 VanDerWaalsContact CD-O 3.23Å; P105-T113 WeakPolarHBondContact CD-O 3.19Å; P105-T113 WeakPolarHBondContact CG-O 2.9Å; S111-T113 PolarHBondContact OG-N 3.27Å
114	I	95.1	Very high	89.1	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	132.8	170.4	-65.1	178.9	0	0	0	107.4	S72 I73 V75 I83 I102 D103 I104 I131	S72-I114 WeakPolarHBondContact CA-O 3.25Å; I73-I114 HydrophobicContact CG1-CB 4.17Å; I73-I114 PolarHBondContact N-O 3.11Å; I73-I114 PolarHBondContact O-N 3.08Å; V75-I114 HydrophobicContact CB-CD1 3.82Å; V75-I114 HydrophobicContact CB-CG1 4.33Å; V75-I114 HydrophobicContact CG1-CD1 4.18Å; V75-I114 HydrophobicContact CG2-CD1 3.98Å; I83-I114 HydrophobicContact CD1-CD1 3.43Å; I83-I114 VanDerWaalsContact CD1-CD1 3.43Å; I102-I114 HydrophobicContact CG2-CG2 3.78Å; D103-I114 WeakPolarHBondContact O-CA 3.43Å; D103-I114 WeakPolarHBondContact O-CG2 3.29Å; I104-I114 HydrophobicContact CG1-CD1 4.19Å; I104-I114 HydrophobicContact CG1-CG1 4.31Å; I104-I114 HydrophobicContact CG1-CG2 4.18Å; I104-I114 HydrophobicContact CG2-CD1 4.22Å; I104-I114 HydrophobicContact CG2-CG1 4.3Å; I114-I131 HydrophobicContact CG2-CD1 4.29Å
115	S	95.9	Very high	89.1	Confident	25 Å²	25	56.1 Å²	56.1	18%	0.175	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	141.7	174.4	76.3	0	0	0	0	111.3	A71 I102 D103	A71-S115 CarbonylContact O-C 3.58Å; A71-S115 WeakPolarHBondContact O-CA 3.38Å; I102-S115 WeakPolarHBondContact CA-O 3.16Å; D103-S115 VanDerWaalsContact CB-OG 3.29Å; D103-S115 WeakPolarHBondContact CB-OG 3.38Å; D103-S115 PolarHBondContact N-O 3.48Å; D103-S115 PolarHBondContact O-N 3.36Å
116	V	97.6	Very high	89.3	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	123.6	178.4	179.3	0	0	0	0	107.6	T70 A71 C100 Y101 I102 V124 A127 I131	T70-V116 CarbonylContact C-O 3.52Å; T70-V116 VanDerWaalsContact CA-O 3.22Å; T70-V116 WeakPolarHBondContact CA-O 3.44Å; T70-V116 PolarHBondContact OG1-O 3.2Å; A71-V116 PolarHBondContact N-O 3.21Å; A71-V116 PolarHBondContact O-N 2.91Å; C100-V116 HydrophobicContact CB-CG1 4.13Å; Y101-V116 WeakPolarHBondContact O-CA 3.38Å; I102-V116 HydrophobicContact CG1-CG2 4.39Å; V116-V124 HydrophobicContact CB-CG1 4.42Å; V116-V124 HydrophobicContact CG1-CG1 4.34Å; V116-A127 HydrophobicContact CG1-CB 3.71Å; V116-I131 HydrophobicContact CG2-CD1 3.68Å
117	T	97.6	Very high	89.8	Confident	49 Å²	49	49.8 Å²	49.8	30%	0.301	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	130.2	-179.3	-56.4	0	0	0	0	110.3	V65 Y69 T70 C100 Y101	V65-T117 HydrophobicContact CG2-CG2 4.33Å; Y69-T117 WeakPolarHBondContact O-CA 3.4Å; T70-T117 PolarHBondContact OG1-OG1 3.4Å; C100-T117 CarbonylContact C-O 3.57Å; C100-T117 WeakPolarHBondContact CA-O 3.4Å; Y101-T117 PolarHBondContact N-O 3.07Å; Y101-T117 PolarHBondContact O-N 3.5Å
118	A	97.2	Very high	90.9	Very high	7 Å²	7	43.3 Å²	43.3	6%	0.058	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	161.9	176.9	0	0	0	0	0	111.1	Y69 C100 S120 N123 V124	Y69-A118 PolarHBondContact N-O 3.21Å; Y69-A118 PolarHBondContact O-N 2.89Å; C100-A118 HydrophobicContact CB-CB 3.7Å; A118-S120 PolarHBondContact O-N 2.84Å; A118-N123 HydrophobicContact CB-CB 3.97Å; A118-V124 HydrophobicContact CB-CG2 3.69Å
119	T	95.8	Very high	91.9	Very high	108 Å²	108	41.8 Å²	41.8	66%	0.663	24%	0.235	S	C	*	.	S	Bend	trans	-68.7	-24.8	175.5	54.2	0	0	0	0	112.7	Y69	Y69-T119 WeakPolarHBondContact CD2-O 3.49Å; Y69-T119 WeakPolarHBondContact CE2-O 3.37Å
120	S	93.4	Very high	92.8	Very high	41 Å²	41	41.4 Å²	41.4	29%	0.287	23%	0.226	S	C	.	.	S	Bend	trans	-109.3	128.8	-179.2	173.5	0	0	0	0	111.6	A118 F122 N123 V124	A118-S120 PolarHBondContact O-N 2.84Å; S120-F122 PolarHBondContact O-N 2.93Å; S120-F122 WeakPolarHBondContact OG-CB 3.23Å; S120-F122 PolarHBondContact OG-N 2.8Å; S120-N123 PolarHBondContact O-N 2.88Å; S120-N123 VanDerWaalsContact O-N 3.13Å; S120-V124 PolarHBondContact O-N 3.15Å
121	K	93.4	Very high	93.9	Very high	73 Å²	73	33.8 Å²	33.8	32%	0.317	19%	0.185	S	C	.	.	H	α-helix	trans	-57.6	-36.5	173.3	-178.3	167.2	-174.6	-175.7	0	112.3	H59 I62 Y69 L125	H59-K121 WeakPolarHBondContact CE1-CE 3.37Å; H59-K121 PolarHBondContact CE1-NZ 3Å; H59-K121 WeakPolarHBondContact NE2-CE 3.26Å; H59-K121 PolarHBondContact NE2-NZ 2.97Å; I62-K121 HydrophobicContact CD1-CD 4.46Å; I62-K121 HydrophobicContact CD1-CG 3.78Å; I62-K121 HydrophobicContact CG2-CG 4.21Å; Y69-K121 HydrophobicContact CD1-CB 3.99Å; Y69-K121 HydrophobicContact CD1-CD 4.38Å; Y69-K121 HydrophobicContact CD1-CG 4.37Å; Y69-K121 HydrophobicContact CD2-CB 3.87Å; Y69-K121 HydrophobicContact CE1-CB 4.12Å; Y69-K121 HydrophobicContact CE1-CD 4.33Å; Y69-K121 HydrophobicContact CE2-CB 4.01Å; Y69-K121 HydrophobicContact CG-CB 3.85Å; K121-L125 WeakPolarHBondContact O-CB 3.36Å; K121-L125 PolarHBondContact O-N 3.07Å; K121-L125 VanDerWaalsContact O-N 3.1Å
122	F	92.2	Very high	94.4	Very high	113 Å²	113	33 Å²	33	50%	0.496	18%	0.177	S	C	.	.	H	α-helix	trans	-61.8	-43.5	176.7	178	-97.7	0	0	0	111.6	I48 S120 L125 N126	I48-F122 HydrophobicContact CD1-CD2 4.45Å; I48-F122 HydrophobicContact CD1-CE2 3.35Å; I48-F122 HydrophobicContact CD1-CZ 3.78Å; S120-F122 PolarHBondContact O-N 2.93Å; S120-F122 WeakPolarHBondContact OG-CB 3.23Å; S120-F122 PolarHBondContact OG-N 2.8Å; F122-L125 PolarHBondContact O-N 3.36Å; F122-N126 WeakPolarHBondContact CD1-ND2 3.16Å; F122-N126 WeakPolarHBondContact CE1-ND2 3.23Å; F122-N126 WeakPolarHBondContact CE2-ND2 2.98Å; F122-N126 WeakPolarHBondContact CZ-ND2 2.93Å; F122-N126 PolarHBondContact O-N 3.34Å; F122-N126 PolarHBondContact O-ND2 2.99Å
123	N	94.9	Very high	94.6	Very high	30 Å²	30	34.7 Å²	34.7	16%	0.16	18%	0.18	C	C	.	.	H	α-helix	trans	-67.6	-42.1	-179.7	-75.3	11.6	0	0	0	112.3	F98 A118 S120 L125 N126 A127	F98-N123 WeakPolarHBondContact O-CB 3.48Å; F98-N123 PolarHBondContact O-ND2 3.29Å; A118-N123 HydrophobicContact CB-CB 3.97Å; S120-N123 PolarHBondContact O-N 2.88Å; S120-N123 VanDerWaalsContact O-N 3.13Å; N123-L125 VanDerWaalsContact C-N 3.32Å; N123-L125 PolarHBondContact O-N 2.96Å; N123-N126 PolarHBondContact O-N 2.87Å; N123-A127 VanDerWaalsContact O-CB 3.26Å; N123-A127 WeakPolarHBondContact O-CB 3.29Å; N123-A127 PolarHBondContact O-N 2.98Å
124	V	95.7	Very high	94.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-57.4	-48.1	173.4	176.6	0	0	0	0	110.5	I62 Y69 A71 V116 A118 S120 C128	I62-V124 HydrophobicContact CD1-CG1 4.47Å; I62-V124 HydrophobicContact CG1-CG1 4.43Å; Y69-V124 WeakPolarHBondContact O-CG2 3.47Å; A71-V124 HydrophobicContact CB-CG1 3.49Å; A71-V124 VanDerWaalsContact CB-CG1 3.49Å; V116-V124 HydrophobicContact CB-CG1 4.42Å; V116-V124 HydrophobicContact CG1-CG1 4.34Å; A118-V124 HydrophobicContact CB-CG2 3.69Å; S120-V124 PolarHBondContact O-N 3.15Å; V124-C128 WeakPolarHBondContact O-CB 3Å; V124-C128 PolarHBondContact O-N 2.66Å; V124-C128 PolarHBondContact O-SG 3.36Å; V124-C128 VanDerWaalsContact O-SG 3.4Å
125	L	93.8	Very high	94.5	Very high	18 Å²	18	32.8 Å²	32.8	9%	0.094	17%	0.168	C	C	.	.	H	α-helix	trans	-59.8	-49.3	-179.7	-176.6	62.8	0	0	0	111.7	T55 I58 I62 K121 F122 N123 C128 R129	T55-L125 HydrophobicContact CG2-CD1 4.14Å; T55-L125 HydrophobicContact CG2-CD2 4.01Å; T55-L125 HydrophobicContact CG2-CG 4.4Å; I58-L125 HydrophobicContact CB-CD1 3.82Å; I58-L125 HydrophobicContact CG2-CD1 3.61Å; I62-L125 HydrophobicContact CD1-CB 4.2Å; I62-L125 HydrophobicContact CD1-CD1 4.5Å; K121-L125 WeakPolarHBondContact O-CB 3.36Å; K121-L125 PolarHBondContact O-N 3.07Å; K121-L125 VanDerWaalsContact O-N 3.1Å; F122-L125 PolarHBondContact O-N 3.36Å; N123-L125 VanDerWaalsContact C-N 3.32Å; N123-L125 PolarHBondContact O-N 2.96Å; L125-C128 PolarHBondContact O-N 2.96Å; L125-R129 VanDerWaalsContact O-CG 3.28Å; L125-R129 WeakPolarHBondContact O-CG 3.33Å; L125-R129 PolarHBondContact O-N 2.76Å
126	N	93.5	Very high	94.2	Very high	24 Å²	24	32.1 Å²	32.1	13%	0.128	16%	0.163	C	C	.	.	H	α-helix	trans	-69.4	-39.2	-177.8	-71.4	-27.2	0	0	0	113.1	F98 F122 N123 R129 R130	F98-N126 HydrophobicContact CD1-CB 3.81Å; F98-N126 HydrophobicContact CE1-CB 3.65Å; F98-N126 HydrophobicContact CZ-CB 4.41Å; F122-N126 WeakPolarHBondContact CD1-ND2 3.16Å; F122-N126 WeakPolarHBondContact CE1-ND2 3.23Å; F122-N126 WeakPolarHBondContact CE2-ND2 2.98Å; F122-N126 WeakPolarHBondContact CZ-ND2 2.93Å; F122-N126 PolarHBondContact O-N 3.34Å; F122-N126 PolarHBondContact O-ND2 2.99Å; N123-N126 PolarHBondContact O-N 2.87Å; N126-R129 PolarHBondContact O-N 3.4Å; N126-R130 PolarHBondContact O-N 3.25Å
127	A	95.7	Very high	93.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.9	-45.7	173.6	0	0	0	0	0	111.6	F98 V116 N123 R129 R130 I131	F98-A127 HydrophobicContact CB-CB 3.9Å; F98-A127 HydrophobicContact CD2-CB 3.76Å; F98-A127 HydrophobicContact CG-CB 3.91Å; V116-A127 HydrophobicContact CG1-CB 3.71Å; N123-A127 VanDerWaalsContact O-CB 3.26Å; N123-A127 WeakPolarHBondContact O-CB 3.29Å; N123-A127 PolarHBondContact O-N 2.98Å; A127-R129 VanDerWaalsContact C-N 3.32Å; A127-R129 PolarHBondContact O-N 3.24Å; A127-R130 PolarHBondContact O-N 2.79Å; A127-I131 VanDerWaalsContact O-CG1 3.27Å; A127-I131 WeakPolarHBondContact O-CG1 3.17Å; A127-I131 PolarHBondContact O-N 3.2Å
128	C	95.8	Very high	93.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-57.1	-44.5	173.5	-78.8	0	0	0	0	112.2	I58 I73 V124 L125 I131 L132	I58-C128 HydrophobicContact CD1-CB 4.25Å; I58-C128 HydrophobicContact CG2-CB 3.73Å; I73-C128 HydrophobicContact CG2-CB 4.28Å; V124-C128 WeakPolarHBondContact O-CB 3Å; V124-C128 PolarHBondContact O-N 2.66Å; V124-C128 PolarHBondContact O-SG 3.36Å; V124-C128 VanDerWaalsContact O-SG 3.4Å; L125-C128 PolarHBondContact O-N 2.96Å; C128-I131 PolarHBondContact O-N 3.25Å; C128-L132 WeakPolarHBondContact O-CG 3.25Å; C128-L132 PolarHBondContact O-N 3.47Å
129	R	92.2	Very high	93.1	Very high	45 Å²	45	31.1 Å²	31.1	17%	0.17	15%	0.153	C	C	.	.	H	α-helix	trans	-64.3	-43.9	177.9	-70.6	174.3	75.7	173.7	14.2	112.2	R15 T55 I58 L125 N126 A127 I131 L132 W133	R15-R129 VanDerWaalsContact NH2-NH2 3.18Å; T55-R129 PolarHBondContact OG1-NE 3.3Å; T55-R129 PolarHBondContact OG1-NH2 3.04Å; I58-R129 HydrophobicContact CD1-CG 3.75Å; L125-R129 VanDerWaalsContact O-CG 3.28Å; L125-R129 WeakPolarHBondContact O-CG 3.33Å; L125-R129 PolarHBondContact O-N 2.76Å; N126-R129 PolarHBondContact O-N 3.4Å; A127-R129 VanDerWaalsContact C-N 3.32Å; A127-R129 PolarHBondContact O-N 3.24Å; R129-I131 VanDerWaalsContact C-N 3.3Å; R129-I131 PolarHBondContact O-N 3.37Å; R129-L132 PolarHBondContact O-N 3.43Å; R129-W133 WeakPolarHBondContact O-CB 3.34Å; R129-W133 PolarHBondContact O-N 3.15Å
130	R	94.2	Very high	92.7	Very high	46 Å²	46	27.9 Å²	27.9	17%	0.174	13%	0.132	C	C	.	.	H	α-helix	trans	-62.9	-39	177	-175.7	64.3	71.6	72.1	10.2	111.2	L94 E97 F98 N126 A127 W133 I134	L94-R130 HydrophobicContact CD2-CB 4.12Å; L94-R130 HydrophobicContact CD2-CG 3.3Å; E97-R130 IonicContact OE1-CZ 3.15Å; E97-R130 IonicContact OE1-NH1 3.6Å; E97-R130 PolarHBondContact OE1-NH1 3.06Å; E97-R130 IonicContact OE1-NH2 2.78Å; E97-R130 PolarHBondContact OE1-NH2 3.04Å; E97-R130 IonicContact OE2-CZ 2.6Å; E97-R130 IonicContact OE2-NH1 3.56Å; E97-R130 PolarHBondContact OE2-NH1 3.41Å; E97-R130 IonicContact OE2-NH2 2.7Å; F98-R130 HydrophobicContact CE2-CB 3.8Å; F98-R130 HydrophobicContact CE2-CG 4.05Å; F98-R130 HydrophobicContact CZ-CB 4.08Å; F98-R130 HydrophobicContact CZ-CG 4.43Å; N126-R130 PolarHBondContact O-N 3.25Å; A127-R130 PolarHBondContact O-N 2.79Å; R130-W133 PolarHBondContact O-N 2.89Å; R130-I134 HydrophobicContact CG-CD1 4.31Å; R130-I134 VanDerWaalsContact O-CG1 3.3Å; R130-I134 WeakPolarHBondContact O-CG1 3.48Å; R130-I134 PolarHBondContact O-N 2.82Å
131	I	95.5	Very high	92.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.1	-48.5	173.5	-69.2	164.8	0	0	0	111.2	I73 V75 I83 L94 I102 I114 V116 A127 C128 R129 W133 I134 V135	I73-I131 HydrophobicContact CD1-CB 3.94Å; I73-I131 HydrophobicContact CD1-CD1 4.29Å; I73-I131 HydrophobicContact CD1-CG2 3.55Å; V75-I131 HydrophobicContact CG2-CG2 4.25Å; I83-I131 HydrophobicContact CD1-CG2 3.51Å; I83-I131 HydrophobicContact CG1-CG2 4.06Å; I83-I131 HydrophobicContact CG2-CG1 4.11Å; I83-I131 HydrophobicContact CG2-CG2 4.46Å; L94-I131 HydrophobicContact CD1-CG1 4.3Å; I102-I131 HydrophobicContact CD1-CD1 4.19Å; I102-I131 HydrophobicContact CG2-CD1 4.04Å; I114-I131 HydrophobicContact CG2-CD1 4.29Å; V116-I131 HydrophobicContact CG2-CD1 3.68Å; A127-I131 VanDerWaalsContact O-CG1 3.27Å; A127-I131 WeakPolarHBondContact O-CG1 3.17Å; A127-I131 PolarHBondContact O-N 3.2Å; C128-I131 PolarHBondContact O-N 3.25Å; R129-I131 VanDerWaalsContact C-N 3.3Å; R129-I131 PolarHBondContact O-N 3.37Å; I131-W133 VanDerWaalsContact C-N 3.29Å; I131-W133 PolarHBondContact O-N 3.4Å; I131-I134 WeakPolarHBondContact O-CB 3.32Å; I131-I134 PolarHBondContact O-N 3.19Å; I131-V135 WeakPolarHBondContact O-CG2 3.46Å; I131-V135 PolarHBondContact O-N 3.28Å
132	L	93.2	Very high	92	Very high	28 Å²	28	26.5 Å²	26.5	15%	0.147	12%	0.12	C	C	.	.	H	α-helix	trans	-63.5	-36.7	179	-67.7	171.4	0	0	0	112	E54 I58 I73 C128 R129 V135 T136	E54-L132 HydrophobicContact CG-CD1 4.2Å; E54-L132 WeakPolarHBondContact OE1-CD1 3.47Å; I58-L132 HydrophobicContact CD1-CD1 3.59Å; I58-L132 HydrophobicContact CG1-CD1 4.18Å; I73-L132 HydrophobicContact CD1-CD2 4.33Å; I73-L132 HydrophobicContact CD1-CG 4.31Å; C128-L132 WeakPolarHBondContact O-CG 3.25Å; C128-L132 PolarHBondContact O-N 3.47Å; R129-L132 PolarHBondContact O-N 3.43Å; L132-V135 PolarHBondContact O-N 2.86Å; L132-T136 PolarHBondContact O-N 3.44Å; L132-T136 PolarHBondContact O-OG1 2.97Å
133	W	91.2	Very high	91.7	Very high	60 Å²	60	25.5 Å²	25.5	23%	0.227	12%	0.117	C	C	.	.	H	α-helix	trans	-61	-47.7	172.2	-178.4	89.7	0	0	0	111.8	R129 R130 I131 V135 T136 D137	R129-W133 WeakPolarHBondContact O-CB 3.34Å; R129-W133 PolarHBondContact O-N 3.15Å; R130-W133 PolarHBondContact O-N 2.89Å; I131-W133 VanDerWaalsContact C-N 3.29Å; I131-W133 PolarHBondContact O-N 3.4Å; W133-V135 VanDerWaalsContact C-N 3.26Å; W133-V135 PolarHBondContact O-N 3.19Å; W133-T136 PolarHBondContact O-N 2.96Å; W133-D137 VanDerWaalsContact O-CB 3.29Å; W133-D137 WeakPolarHBondContact O-CB 3.47Å; W133-D137 PolarHBondContact O-N 3.28Å
134	I	93.1	Very high	91.6	Very high	9 Å²	9	25.3 Å²	25.3	5%	0.046	12%	0.117	C	C	.	.	H	α-helix	trans	-57.3	-41.2	175.6	-70	165.8	0	0	0	110.8	F82 I83 L94 R130 I131 A138	F82-I134 HydrophobicContact CB-CG2 3.98Å; I83-I134 HydrophobicContact CG1-CG2 4.08Å; L94-I134 HydrophobicContact CD1-CD1 3.83Å; L94-I134 HydrophobicContact CD2-CD1 4.28Å; R130-I134 HydrophobicContact CG-CD1 4.31Å; R130-I134 VanDerWaalsContact O-CG1 3.3Å; R130-I134 WeakPolarHBondContact O-CG1 3.48Å; R130-I134 PolarHBondContact O-N 2.82Å; I131-I134 WeakPolarHBondContact O-CB 3.32Å; I131-I134 PolarHBondContact O-N 3.19Å; I134-A138 WeakPolarHBondContact O-CB 3.24Å; I134-A138 PolarHBondContact O-N 2.86Å
135	V	92.4	Very high	91.6	Very high	13 Å²	13	26.8 Å²	26.8	8%	0.079	13%	0.127	C	C	.	.	H	α-helix	trans	-63.9	-47.5	178.1	170.9	0	0	0	0	111.1	V75 F79 I83 I131 L132 W133 A138 R139	V75-V135 HydrophobicContact CG1-CG2 3.52Å; V75-V135 HydrophobicContact CG2-CG2 4.18Å; F79-V135 HydrophobicContact CB-CG1 4.19Å; F79-V135 HydrophobicContact CB-CG2 4.02Å; F79-V135 HydrophobicContact CD1-CG1 4.37Å; F79-V135 HydrophobicContact CD2-CG1 3.82Å; F79-V135 HydrophobicContact CE2-CG1 4.3Å; F79-V135 HydrophobicContact CG-CG1 3.86Å; I83-V135 HydrophobicContact CD1-CG2 3.98Å; I83-V135 HydrophobicContact CG1-CG2 4.45Å; I131-V135 WeakPolarHBondContact O-CG2 3.46Å; I131-V135 PolarHBondContact O-N 3.28Å; L132-V135 PolarHBondContact O-N 2.86Å; W133-V135 VanDerWaalsContact C-N 3.26Å; W133-V135 PolarHBondContact O-N 3.19Å; V135-A138 PolarHBondContact O-N 3.37Å; V135-R139 WeakPolarHBondContact O-CB 3.3Å; V135-R139 PolarHBondContact O-N 3.46Å
136	T	89	Confident	91.8	Very high	11 Å²	11	26.8 Å²	26.8	7%	0.067	13%	0.126	C	C	.	.	H	α-helix	trans	-63	-45	178.7	-64.4	0	0	0	0	111.5	I12 L132 W133 R139 N140	I12-T136 HydrophobicContact CD1-CG2 3.97Å; I12-T136 HydrophobicContact CG1-CG2 3.99Å; L132-T136 PolarHBondContact O-N 3.44Å; L132-T136 PolarHBondContact O-OG1 2.97Å; W133-T136 PolarHBondContact O-N 2.96Å; T136-R139 WeakPolarHBondContact O-CB 3.13Å; T136-R139 PolarHBondContact O-N 2.77Å; T136-N140 PolarHBondContact O-N 2.96Å; T136-N140 PolarHBondContact O-ND2 2.94Å
137	D	88.3	Confident	92	Very high	22 Å²	22	26.1 Å²	26.1	12%	0.118	12%	0.122	C	C	.	.	H	α-helix	trans	-63.1	-43.9	175.9	172	57.3	0	0	0	111.9	W133 R139 N140 R141	W133-D137 VanDerWaalsContact O-CB 3.29Å; W133-D137 WeakPolarHBondContact O-CB 3.47Å; W133-D137 PolarHBondContact O-N 3.28Å; D137-R139 VanDerWaalsContact C-N 3.33Å; D137-R139 PolarHBondContact O-N 3.26Å; D137-N140 PolarHBondContact O-N 2.79Å; D137-R141 PolarHBondContact O-N 3.07Å; D137-R141 IonicContact OD1-CZ 3.46Å; D137-R141 IonicContact OD1-NH1 3.81Å; D137-R141 PolarHBondContact OD1-NH1 2.87Å; D137-R141 VanDerWaalsContact OD1-NH1 3.15Å; D137-R141 IonicContact OD2-CZ 3.56Å; D137-R141 IonicContact OD2-NH1 3.02Å; D137-R141 PolarHBondContact OD2-NH1 2.91Å; D137-R141 IonicContact OD2-NH2 2.7Å; D137-R141 PolarHBondContact OD2-NH2 2.78Å
138	A	90.8	Very high	92.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.6	-40	173	0	0	0	0	0	112.5	F79 F82 I134 V135 N140 R141 C142	F79-A138 HydrophobicContact CD1-CB 4.12Å; F82-A138 HydrophobicContact CB-CB 3.93Å; F82-A138 HydrophobicContact CD1-CB 3.74Å; F82-A138 HydrophobicContact CD2-CB 3.68Å; F82-A138 HydrophobicContact CE1-CB 4.06Å; F82-A138 HydrophobicContact CE2-CB 4.01Å; F82-A138 HydrophobicContact CG-CB 3.51Å; F82-A138 HydrophobicContact CZ-CB 4.17Å; I134-A138 WeakPolarHBondContact O-CB 3.24Å; I134-A138 PolarHBondContact O-N 2.86Å; V135-A138 PolarHBondContact O-N 3.37Å; A138-N140 PolarHBondContact O-N 3.47Å; A138-R141 PolarHBondContact O-N 3.49Å; A138-R141 VanDerWaalsContact O-N 3.15Å; A138-C142 PolarHBondContact O-N 3.27Å; A138-C142 VanDerWaalsContact O-N 3.15Å; A138-C142 PolarHBondContact O-SG 3.11Å
139	R	91.5	Very high	92.3	Very high	13 Å²	13	26.1 Å²	26.1	5%	0.049	12%	0.122	C	C	.	.	H	α-helix	trans	-61.7	-42.4	176.9	-167.9	-179.6	-63.6	-100.9	10	111.8	F79 V135 T136 D137 R141 C142 V201 E207 N281	F79-R139 HydrophobicContact CE1-CB 3.87Å; F79-R139 HydrophobicContact CE1-CG 4.25Å; F79-R139 VanDerWaalsContact CE2-NH2 3.27Å; F79-R139 HydrophobicContact CZ-CB 4.08Å; F79-R139 HydrophobicContact CZ-CG 4.04Å; F79-R139 VanDerWaalsContact CZ-CZ 3.44Å; V135-R139 WeakPolarHBondContact O-CB 3.3Å; V135-R139 PolarHBondContact O-N 3.46Å; T136-R139 WeakPolarHBondContact O-CB 3.13Å; T136-R139 PolarHBondContact O-N 2.77Å; D137-R139 VanDerWaalsContact C-N 3.33Å; D137-R139 PolarHBondContact O-N 3.26Å; R139-R141 PolarHBondContact O-N 3.15Å; R139-C142 WeakPolarHBondContact O-CB 3.32Å; R139-C142 PolarHBondContact O-N 2.79Å; R139-V201 HydrophobicContact CG-CB 3.58Å; R139-V201 HydrophobicContact CG-CG1 4.05Å; R139-V201 HydrophobicContact CG-CG2 3.9Å; R139-V201 PolarHBondContact NH1-O 3.27Å; R139-E207 IonicContact CZ-OE1 2.72Å; R139-E207 IonicContact CZ-OE2 2.89Å; R139-E207 IonicContact NH1-OE1 2.9Å; R139-E207 IonicContact NH1-OE2 3.19Å; R139-E207 PolarHBondContact NH1-OE2 2.94Å; R139-E207 IonicContact NH2-OE1 2.67Å; R139-E207 PolarHBondContact NH2-OE1 3.48Å; R139-E207 IonicContact NH2-OE2 3.26Å; R139-E207 PolarHBondContact NH2-OE2 2.91Å; R139-N281 WeakPolarHBondContact CD-O 3.5Å; R139-N281 PolarHBondContact NE-O 3.38Å
140	N	86.9	Confident	92.5	Very high	40 Å²	40	24 Å²	24	21%	0.214	11%	0.114	C	C	.	.	H	α-helix	trans	-65.1	-19.8	176.6	-69.8	-29	0	0	0	113.6	T136 D137 A138 S284	T136-N140 PolarHBondContact O-N 2.96Å; T136-N140 PolarHBondContact O-ND2 2.94Å; D137-N140 PolarHBondContact O-N 2.79Å; A138-N140 PolarHBondContact O-N 3.47Å; N140-S284 WeakPolarHBondContact CA-O 3.39Å
141	R	85.1	Confident	92.7	Very high	73 Å²	73	22.5 Å²	22.5	28%	0.275	11%	0.11	S	C	.	.	H	α-helix	trans	-93.2	-10.5	173.3	-65.9	-172.2	-66.9	-107.9	-9.6	113.6	I37 D137 A138 R139	I37-R141 HydrophobicContact CD1-CB 4.38Å; I37-R141 HydrophobicContact CG2-CB 4.18Å; D137-R141 PolarHBondContact O-N 3.07Å; D137-R141 IonicContact OD1-CZ 3.46Å; D137-R141 IonicContact OD1-NH1 3.81Å; D137-R141 PolarHBondContact OD1-NH1 2.87Å; D137-R141 VanDerWaalsContact OD1-NH1 3.15Å; D137-R141 IonicContact OD2-CZ 3.56Å; D137-R141 IonicContact OD2-NH1 3.02Å; D137-R141 PolarHBondContact OD2-NH1 2.91Å; D137-R141 IonicContact OD2-NH2 2.7Å; D137-R141 PolarHBondContact OD2-NH2 2.78Å; A138-R141 PolarHBondContact O-N 3.49Å; A138-R141 VanDerWaalsContact O-N 3.15Å; R139-R141 PolarHBondContact O-N 3.15Å
142	C	87.1	Confident	92.8	Very high	12 Å²	12	22.5 Å²	22.5	8%	0.081	11%	0.11	C	C	.	.	S	Bend	trans	-79.5	150.7	179.1	-72.5	0	0	0	0	110.8	A138 R139 V201	A138-C142 PolarHBondContact O-N 3.27Å; A138-C142 VanDerWaalsContact O-N 3.15Å; A138-C142 PolarHBondContact O-SG 3.11Å; R139-C142 WeakPolarHBondContact O-CB 3.32Å; R139-C142 PolarHBondContact O-N 2.79Å; C142-V201 HydrophobicContact CB-CG1 4.24Å; C142-V201 HydrophobicContact CB-CG2 3.92Å
143	Q	86.5	Confident	92.7	Very high	91 Å²	91	24 Å²	24	43%	0.425	12%	0.121	S	C	.	.	P	Polyproline II helix	trans	-67	139	170.7	-69.3	-69.4	4.8	0	0	110	T145	Q143-T145 PolarHBondContact O-N 3.3Å
144	P	93.2	Very high	92.8	Very high	26 Å²	26	22.6 Å²	22.6	17%	0.169	12%	0.12	C	C	.	.	P	Polyproline II helix	trans	-56.3	130.6	173.7	-10	7.5	0	0	0	111.1	T199 L200 S284 R355	P144-T199 HydrophobicContact CG-CG2 4.46Å; P144-L200 CarbonylContact C-O 3.51Å; P144-L200 WeakPolarHBondContact CA-O 3.45Å; P144-S284 WeakPolarHBondContact CG-OG 3.37Å; P144-R355 VanDerWaalsContact CD-NH1 3.3Å; P144-R355 WeakPolarHBondContact O-CD 3.13Å; P144-R355 PolarHBondContact O-NH1 3.24Å
145	T	95.2	Very high	92.9	Very high	32 Å²	32	26 Å²	26	20%	0.196	14%	0.144	C	C	.	.	S	Bend	trans	-95	-28.5	175.6	61.8	0	0	0	0	111.4	Q143 L200 V201 L202 R355	Q143-T145 PolarHBondContact O-N 3.3Å; T145-L200 PolarHBondContact N-O 2.88Å; T145-V201 HydrophobicContact CG2-CG1 4.38Å; T145-L202 PolarHBondContact OG1-N 3.01Å; T145-L202 PolarHBondContact OG1-O 3.42Å; T145-R355 WeakPolarHBondContact O-CB 3.31Å; T145-R355 PolarHBondContact O-N 3.11Å
146	H	97.3	Very high	93.2	Very high	17 Å²	17	28.1 Å²	28.1	8%	0.079	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	166	179.9	-65	74.5	0	0	0	110.1	L200 L202 L352 C353	H146-L200 HydrophobicContact CB-CB 4.13Å; H146-L200 HydrophobicContact CB-CD1 4.44Å; H146-L200 PolarHBondContact N-O 3.43Å; H146-L200 VanDerWaalsContact N-O 3.1Å; H146-L200 PolarHBondContact O-N 2.84Å; H146-L200 VanDerWaalsContact O-O 3.08Å; H146-L202 HydrophobicContact CB-CD1 3.76Å; H146-L202 HydrophobicContact CB-CG 4.1Å; H146-L352 HydrophobicContact CB-CD1 4.15Å; H146-C353 CarbonylContact C-O 3.59Å; H146-C353 WeakPolarHBondContact CA-O 3.46Å; H146-C353 WeakPolarHBondContact CB-O 3.39Å
147	F	97.9	Very high	93.6	Very high	10 Å²	10	27.6 Å²	27.6	4%	0.044	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	152.1	174.3	64.2	-73.7	0	0	0	110.6	C149 H194 T196 V198 C353 R355 Y365	F147-C149 HydrophobicContact CD2-CB 3.75Å; F147-C149 HydrophobicContact CE2-CB 3.61Å; F147-C149 VanDerWaalsContact CE2-SG 3.57Å; F147-H194 AromaticContact CE2-CD2 3.65Å; F147-H194 AromaticContact CE2-NE2 3.53Å; F147-T196 HydrophobicContact CB-CG2 4.24Å; F147-T196 HydrophobicContact CD2-CG2 4.33Å; F147-V198 CarbonylContact C-O 3.57Å; F147-V198 WeakPolarHBondContact CA-O 3.38Å; F147-V198 VanDerWaalsContact CB-O 3.31Å; F147-V198 WeakPolarHBondContact CB-O 3.44Å; F147-C353 HydrophobicContact CD1-CB 4.26Å; F147-C353 HydrophobicContact CE1-CB 3.71Å; F147-C353 HydrophobicContact CE2-CB 4.32Å; F147-C353 HydrophobicContact CZ-CB 3.74Å; F147-C353 PolarHBondContact N-O 3.1Å; F147-C353 PolarHBondContact O-N 2.78Å; F147-R355 HydrophobicContact CD1-CB 4.08Å; F147-R355 HydrophobicContact CD1-CG 4.41Å; F147-R355 HydrophobicContact CE1-CB 4.2Å; F147-R355 HydrophobicContact CE1-CG 4.44Å; F147-Y365 AromaticContact CE1-CD1 3.99Å; F147-Y365 HydrophobicContact CE1-CD1 3.99Å; F147-Y365 HydrophobicContact CE1-CD2 4.13Å; F147-Y365 HydrophobicContact CE1-CE1 4.3Å; F147-Y365 HydrophobicContact CE1-CE2 4.39Å; F147-Y365 AromaticContact CE1-CG 3.89Å; F147-Y365 HydrophobicContact CE1-CG 3.89Å; F147-Y365 HydrophobicContact CE2-CD2 4.46Å; F147-Y365 HydrophobicContact CZ-CD1 4.16Å; F147-Y365 AromaticContact CZ-CD2 3.45Å; F147-Y365 HydrophobicContact CZ-CD2 3.45Å; F147-Y365 VanDerWaalsContact CZ-CD2 3.45Å; F147-Y365 HydrophobicContact CZ-CE1 4.43Å; F147-Y365 AromaticContact CZ-CE2 3.73Å; F147-Y365 HydrophobicContact CZ-CE2 3.73Å; F147-Y365 AromaticContact CZ-CG 3.64Å; F147-Y365 HydrophobicContact CZ-CG 3.64Å
148	I	98.3	Very high	94	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	133.1	170	-61	171.4	0	0	0	107.6	L197 V198 L200 L215 L273 L277 I350 C351 L352	I148-L197 HydrophobicContact CG2-CB 4.26Å; I148-L197 HydrophobicContact CG2-CD1 4.32Å; I148-L197 HydrophobicContact CG2-CG 4.5Å; I148-L197 PolarHBondContact O-N 2.6Å; I148-V198 HydrophobicContact CB-CB 4.2Å; I148-V198 HydrophobicContact CB-CG2 4.47Å; I148-V198 HydrophobicContact CD1-CB 4.22Å; I148-V198 HydrophobicContact CD1-CG2 4.27Å; I148-V198 HydrophobicContact CG1-CB 4.45Å; I148-V198 PolarHBondContact N-O 3.02Å; I148-V198 PolarHBondContact O-N 3.15Å; I148-L200 HydrophobicContact CD1-CD1 4.44Å; I148-L200 HydrophobicContact CG1-CD1 4.25Å; I148-L215 HydrophobicContact CD1-CD1 3.58Å; I148-L215 HydrophobicContact CD1-CD2 4.04Å; I148-L215 HydrophobicContact CD1-CG 4.28Å; I148-L215 HydrophobicContact CG1-CD2 4.41Å; I148-L273 HydrophobicContact CG2-CD1 4.21Å; I148-L277 HydrophobicContact CD1-CD1 3.24Å; I148-I350 HydrophobicContact CG2-CG2 3.48Å; I148-I350 VanDerWaalsContact CG2-CG2 3.48Å; I148-C351 CarbonylContact C-O 3.53Å; I148-C351 VanDerWaalsContact CA-O 3.24Å; I148-C351 WeakPolarHBondContact CA-O 3.33Å; I148-L352 HydrophobicContact CG1-CB 4.33Å; I148-L352 HydrophobicContact CG1-CD1 3.87Å
149	C	98.4	Very high	94.4	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	161.9	-179.6	67	0	0	0	0	113.7	F147 P151 H194 F195 I350 C351	F147-C149 HydrophobicContact CD2-CB 3.75Å; F147-C149 HydrophobicContact CE2-CB 3.61Å; F147-C149 VanDerWaalsContact CE2-SG 3.57Å; C149-P151 WeakPolarHBondContact O-CD 3.35Å; C149-H194 HydrophobicContact CB-CB 4.02Å; C149-F195 CarbonylContact C-O 3.56Å; C149-F195 WeakPolarHBondContact CA-O 3.32Å; C149-F195 WeakPolarHBondContact CB-O 3.4Å; C149-I350 CarbonylContact O-C 3.53Å; C149-I350 WeakPolarHBondContact O-CA 3.22Å; C149-C351 PolarHBondContact N-O 2.95Å; C149-C351 PolarHBondContact O-N 3.19Å
150	L	98.3	Very high	94.7	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	108.4	156.5	-179.5	72.7	0	0	0	107.7	H194 F195 L233 L235 L266 F347 Q349 I350	L150-H194 VanDerWaalsContact O-CA 3.31Å; L150-H194 WeakPolarHBondContact O-CA 3.45Å; L150-H194 WeakPolarHBondContact O-CB 3.15Å; L150-F195 HydrophobicContact CB-CB 4.25Å; L150-F195 HydrophobicContact CD2-CD2 4.2Å; L150-F195 PolarHBondContact N-O 3.36Å; L150-F195 PolarHBondContact O-N 2.89Å; L150-L233 HydrophobicContact CD1-CD1 4.32Å; L150-L235 HydrophobicContact CD2-CD1 3.45Å; L150-L235 VanDerWaalsContact CD2-CD1 3.45Å; L150-L266 HydrophobicContact CD2-CD2 3.83Å; L150-F347 HydrophobicContact CD1-CB 3.66Å; L150-F347 HydrophobicContact CD1-CG 4.32Å; L150-F347 HydrophobicContact CD2-CB 4.21Å; L150-F347 HydrophobicContact CD2-CD1 4.43Å; L150-F347 HydrophobicContact CD2-CD2 4.48Å; L150-F347 HydrophobicContact CD2-CG 4.12Å; L150-F347 HydrophobicContact CG-CB 4.27Å; L150-F347 HydrophobicContact CG-CD1 4.44Å; L150-F347 HydrophobicContact CG-CG 4.42Å; L150-Q349 WeakPolarHBondContact CD1-O 3.42Å; L150-I350 HydrophobicContact CD1-CG1 4.45Å
151	P	97.8	Very high	95.3	Very high	15 Å²	15	34.1 Å²	34.1	10%	0.097	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	134.4	176.1	-19.3	32.7	0	0	0	111.2	C149 T153 Q349 C351 F364	C149-P151 WeakPolarHBondContact O-CD 3.35Å; P151-T153 HydrophobicContact CB-CG2 4.04Å; P151-Q349 WeakPolarHBondContact CD-O 3.4Å; P151-C351 HydrophobicContact CG-CB 4.18Å; P151-F364 HydrophobicContact CB-CE1 4.1Å; P151-F364 HydrophobicContact CB-CE2 4.09Å; P151-F364 HydrophobicContact CB-CZ 3.73Å; P151-F364 HydrophobicContact CG-CE1 4.06Å; P151-F364 HydrophobicContact CG-CZ 4.07Å
152	V	97.8	Very high	95.9	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.19	C	C	.	.			trans	-111.6	71.1	176.6	-173.9	0	0	0	0	108.5	V157 L193 F195 I237 M298 F347	V152-V157 HydrophobicContact CG1-CB 3.81Å; V152-V157 HydrophobicContact CG1-CG1 3.55Å; V152-V157 HydrophobicContact CG1-CG2 3.8Å; V152-L193 HydrophobicContact CB-CB 4.18Å; V152-L193 PolarHBondContact N-O 3.37Å; V152-F195 HydrophobicContact CG2-CD2 3.62Å; V152-F195 HydrophobicContact CG2-CE2 3.75Å; V152-I237 HydrophobicContact CG1-CD1 3.98Å; V152-I237 HydrophobicContact CG2-CD1 4.39Å; V152-M298 HydrophobicContact CB-SD 3.98Å; V152-M298 HydrophobicContact CG1-SD 3.81Å; V152-M298 HydrophobicContact CG2-SD 4.05Å; V152-F347 HydrophobicContact CB-CE1 4.25Å; V152-F347 HydrophobicContact CG1-CE1 3.91Å; V152-F347 HydrophobicContact CG1-CZ 4.17Å; V152-F347 HydrophobicContact CG2-CE1 4.09Å
153	T	89.7	Confident	96.4	Very high	60 Å²	60	36.1 Å²	36.1	37%	0.368	21%	0.208	S	C	.	.			trans	-107.3	2	-169.5	55.1	0	0	0	0	114.2	P151 K158 F364	P151-T153 HydrophobicContact CB-CG2 4.04Å; T153-K158 WeakPolarHBondContact O-CE 3.28Å; T153-K158 PolarHBondContact O-NZ 3.32Å; T153-K158 VanDerWaalsContact O-NZ 3.15Å; T153-F364 HydrophobicContact CG2-CD2 3.68Å; T153-F364 HydrophobicContact CG2-CE2 4Å; T153-F364 HydrophobicContact CG2-CG 4.38Å
154	C	94.6	Very high	97	Very high	30 Å²	30	31.8 Å²	31.8	20%	0.203	19%	0.187	C	C	.	.			trans	-63.4	147	177.4	58.3	0	0	0	0	111.8	T156 V157 K158	C154-T156 VanDerWaalsContact C-N 3.34Å; C154-T156 PolarHBondContact O-N 2.97Å; C154-V157 PolarHBondContact O-N 2.94Å; C154-V157 VanDerWaalsContact SG-CG2 3.51Å; C154-K158 WeakPolarHBondContact O-CG 3.43Å; C154-K158 PolarHBondContact O-N 3.11Å
155	S	95.7	Very high	97.2	Very high	80 Å²	80	33.4 Å²	33.4	56%	0.559	19%	0.19	S	C	*	.	H	α-helix	trans	-59.1	-43.6	-177.2	49.5	0	0	0	0	112.2	V157 K158 D159	S155-V157 VanDerWaalsContact C-N 3.32Å; S155-V157 PolarHBondContact O-N 2.9Å; S155-K158 WeakPolarHBondContact O-CB 3.32Å; S155-K158 PolarHBondContact O-N 2.99Å; S155-D159 WeakPolarHBondContact O-CB 3.37Å; S155-D159 VanDerWaalsContact O-CG 3.23Å; S155-D159 PolarHBondContact O-N 3.49Å
156	T	97.4	Very high	97.3	Very high	58 Å²	58	36.6 Å²	36.6	36%	0.356	20%	0.203	S	C	.	.	H	α-helix	trans	-50.5	-49.8	179.1	-49.7	0	0	0	0	112.3	C154 N160	C154-T156 VanDerWaalsContact C-N 3.34Å; C154-T156 PolarHBondContact O-N 2.97Å; T156-N160 VanDerWaalsContact O-CB 3.29Å; T156-N160 WeakPolarHBondContact O-CB 3.43Å; T156-N160 PolarHBondContact O-N 3.25Å; T156-N160 PolarHBondContact O-ND2 3.49Å
157	V	97.9	Very high	97.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-72	-37.2	-179.6	177.6	0	0	0	0	111.3	V152 C154 S155 N160 F161 L193 I237 M298 F341 T342	V152-V157 HydrophobicContact CG1-CB 3.81Å; V152-V157 HydrophobicContact CG1-CG1 3.55Å; V152-V157 HydrophobicContact CG1-CG2 3.8Å; C154-V157 PolarHBondContact O-N 2.94Å; C154-V157 VanDerWaalsContact SG-CG2 3.51Å; S155-V157 VanDerWaalsContact C-N 3.32Å; S155-V157 PolarHBondContact O-N 2.9Å; V157-N160 PolarHBondContact O-N 3.07Å; V157-F161 WeakPolarHBondContact O-CB 3.27Å; V157-F161 PolarHBondContact O-N 3.22Å; V157-L193 HydrophobicContact CG1-CD1 4.06Å; V157-I237 HydrophobicContact CG2-CD1 4.45Å; V157-M298 HydrophobicContact CG1-CE 4.11Å; V157-M298 HydrophobicContact CG1-SD 4.33Å; V157-F341 HydrophobicContact CG1-CB 4.4Å; V157-T342 HydrophobicContact CG2-CG2 3.64Å
158	K	97.5	Very high	97.3	Very high	55 Å²	55	38.4 Å²	38.4	24%	0.239	22%	0.219	C	C	.	.	H	α-helix	trans	-61.2	-46.8	177	-72.6	179.3	171.4	169.9	0	111.7	T153 C154 S155 F161 Q162 V190	T153-K158 WeakPolarHBondContact O-CE 3.28Å; T153-K158 PolarHBondContact O-NZ 3.32Å; T153-K158 VanDerWaalsContact O-NZ 3.15Å; C154-K158 WeakPolarHBondContact O-CG 3.43Å; C154-K158 PolarHBondContact O-N 3.11Å; S155-K158 WeakPolarHBondContact O-CB 3.32Å; S155-K158 PolarHBondContact O-N 2.99Å; K158-F161 PolarHBondContact O-N 2.73Å; K158-Q162 WeakPolarHBondContact O-CB 3.42Å; K158-Q162 PolarHBondContact O-N 3.48Å; K158-V190 HydrophobicContact CB-CG1 3.71Å; K158-V190 HydrophobicContact CD-CG1 4.35Å; K158-V190 HydrophobicContact CG-CG1 3.77Å
159	D	98.3	Very high	97.3	Very high	104 Å²	104	40.4 Å²	40.4	56%	0.556	23%	0.229	S	C	*	.	H	α-helix	trans	-65.7	-46.1	-179.8	-63.1	-22.9	0	0	0	110.4	S155 F161 Q162 A163	S155-D159 WeakPolarHBondContact O-CB 3.37Å; S155-D159 VanDerWaalsContact O-CG 3.23Å; S155-D159 PolarHBondContact O-N 3.49Å; D159-F161 PolarHBondContact O-N 2.85Å; D159-Q162 PolarHBondContact O-N 2.85Å; D159-A163 PolarHBondContact O-N 3.24Å
160	N	98.4	Very high	97.2	Very high	53 Å²	53	45.4 Å²	45.4	28%	0.283	25%	0.253	S	S	.	.	H	α-helix	trans	-66	-38.3	177.7	-71.8	-17	0	0	0	112.4	T156 V157 A163 F164 F339 F341	T156-N160 VanDerWaalsContact O-CB 3.29Å; T156-N160 WeakPolarHBondContact O-CB 3.43Å; T156-N160 PolarHBondContact O-N 3.25Å; T156-N160 PolarHBondContact O-ND2 3.49Å; V157-N160 PolarHBondContact O-N 3.07Å; N160-A163 PolarHBondContact O-N 3.12Å; N160-F164 WeakPolarHBondContact O-CB 2.98Å; N160-F164 PolarHBondContact O-N 2.93Å; N160-F339 HydrophobicContact CB-CE1 4.2Å; N160-F339 WeakPolarHBondContact O-CE1 3.45Å; N160-F339 WeakPolarHBondContact O-CZ 3.31Å; N160-F341 PolarHBondContact ND2-O 3.28Å
161	F	98.3	Very high	97.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-67.4	-38	174.6	177.2	-118.9	0	0	0	112	V157 K158 D159 F164 R165 F187 H188 V190 L193 L300 F341	V157-F161 WeakPolarHBondContact O-CB 3.27Å; V157-F161 PolarHBondContact O-N 3.22Å; K158-F161 PolarHBondContact O-N 2.73Å; D159-F161 PolarHBondContact O-N 2.85Å; F161-F164 HydrophobicContact CD2-CD1 4.13Å; F161-F164 HydrophobicContact CE2-CD1 4.22Å; F161-F164 WeakPolarHBondContact O-CB 3.09Å; F161-F164 PolarHBondContact O-N 2.84Å; F161-R165 WeakPolarHBondContact O-CB 3.02Å; F161-R165 PolarHBondContact O-N 3.26Å; F161-F187 HydrophobicContact CZ-CD1 4.35Å; F161-H188 WeakPolarHBondContact CE1-O 3.46Å; F161-H188 HydrophobicContact CZ-CB 4.38Å; F161-V190 HydrophobicContact CD1-CB 4.36Å; F161-V190 HydrophobicContact CD1-CG2 3.87Å; F161-V190 HydrophobicContact CE1-CG2 4.01Å; F161-L193 HydrophobicContact CB-CD1 3.95Å; F161-L193 HydrophobicContact CD1-CD1 3.71Å; F161-L193 HydrophobicContact CD1-CD2 4.11Å; F161-L193 HydrophobicContact CD1-CG 4.28Å; F161-L193 HydrophobicContact CE1-CD1 4.42Å; F161-L193 HydrophobicContact CE1-CD2 4.06Å; F161-L193 HydrophobicContact CG-CD1 3.91Å; F161-L193 HydrophobicContact CG-CD2 4.37Å; F161-L193 HydrophobicContact CZ-CD2 4.29Å; F161-L300 HydrophobicContact CD2-CD2 3.72Å; F161-L300 HydrophobicContact CE2-CB 4.03Å; F161-L300 HydrophobicContact CE2-CD2 3.68Å; F161-L300 HydrophobicContact CE2-CG 4.42Å; F161-F341 HydrophobicContact CB-CD1 4.36Å; F161-F341 HydrophobicContact CB-CE1 4.31Å; F161-F341 HydrophobicContact CD2-CE1 4.08Å
162	Q	98	Very high	97	Very high	73 Å²	73	46.2 Å²	46.2	34%	0.341	26%	0.26	S	S	.	.	H	α-helix	trans	-65	-42.4	174	-174.8	69.3	-4.6	0	0	111.1	K158 D159 R165 Q166	K158-Q162 WeakPolarHBondContact O-CB 3.42Å; K158-Q162 PolarHBondContact O-N 3.48Å; D159-Q162 PolarHBondContact O-N 2.85Å; Q162-R165 PolarHBondContact O-N 3.17Å; Q162-Q166 WeakPolarHBondContact O-CG 3.35Å; Q162-Q166 PolarHBondContact O-N 2.99Å
163	A	98.1	Very high	96.8	Very high	54 Å²	54	50.3 Å²	50.3	45%	0.446	29%	0.289	S	S	.	.	H	α-helix	trans	-61.8	-45.7	174.5	0	0	0	0	0	112.1	D159 N160 R165 Q166 S167	D159-A163 PolarHBondContact O-N 3.24Å; N160-A163 PolarHBondContact O-N 3.12Å; A163-R165 VanDerWaalsContact C-N 3.34Å; A163-R165 PolarHBondContact O-N 3.17Å; A163-Q166 PolarHBondContact O-N 2.91Å; A163-S167 WeakPolarHBondContact O-CB 3.46Å; A163-S167 PolarHBondContact O-N 2.81Å
164	F	98.5	Very high	96.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-54.2	-50.2	172.4	170.6	-99.3	0	0	0	111.4	N160 F161 Q166 S167 V168 F187 L240 L300 L301 I332 A336 F339 F341	N160-F164 WeakPolarHBondContact O-CB 2.98Å; N160-F164 PolarHBondContact O-N 2.93Å; F161-F164 HydrophobicContact CD2-CD1 4.13Å; F161-F164 HydrophobicContact CE2-CD1 4.22Å; F161-F164 WeakPolarHBondContact O-CB 3.09Å; F161-F164 PolarHBondContact O-N 2.84Å; F164-Q166 PolarHBondContact O-N 3.2Å; F164-S167 PolarHBondContact O-N 3.49Å; F164-V168 HydrophobicContact CD2-CG2 4.19Å; F164-V168 HydrophobicContact CE1-CG2 4.19Å; F164-V168 HydrophobicContact CE2-CG2 3.77Å; F164-V168 HydrophobicContact CZ-CG2 3.79Å; F164-V168 WeakPolarHBondContact O-CG2 3.38Å; F164-V168 PolarHBondContact O-N 2.69Å; F164-F187 HydrophobicContact CE1-CE1 4.28Å; F164-L240 HydrophobicContact CE2-CD1 3.76Å; F164-L240 HydrophobicContact CZ-CD1 3.95Å; F164-L300 HydrophobicContact CE1-CD1 4.09Å; F164-L300 HydrophobicContact CZ-CD1 4.24Å; F164-L301 HydrophobicContact CE1-CD1 3.99Å; F164-I332 HydrophobicContact CE2-CG2 4Å; F164-I332 HydrophobicContact CZ-CG2 3.75Å; F164-A336 HydrophobicContact CD2-CB 3.96Å; F164-A336 HydrophobicContact CE2-CB 3.64Å; F164-F339 HydrophobicContact CB-CD1 4.27Å; F164-F339 HydrophobicContact CB-CD2 4.39Å; F164-F339 HydrophobicContact CB-CE1 3.86Å; F164-F339 HydrophobicContact CB-CE2 3.97Å; F164-F339 HydrophobicContact CB-CZ 3.7Å; F164-F339 HydrophobicContact CD2-CB 4.3Å; F164-F339 HydrophobicContact CD2-CD1 4.27Å; F164-F339 AromaticContact CD2-CD2 3.92Å; F164-F339 HydrophobicContact CD2-CD2 3.92Å; F164-F339 HydrophobicContact CD2-CE2 4.31Å; F164-F339 AromaticContact CD2-CG 3.9Å; F164-F339 HydrophobicContact CD2-CG 3.9Å; F164-F341 HydrophobicContact CB-CE1 4.15Å; F164-F341 HydrophobicContact CD1-CE1 4.47Å; F164-F341 HydrophobicContact CD1-CZ 4.41Å; F164-F341 HydrophobicContact CD2-CZ 4.33Å; F164-F341 HydrophobicContact CG-CE1 4.22Å; F164-F341 HydrophobicContact CG-CZ 4.17Å
165	R	98	Very high	96.5	Very high	60 Å²	60	55 Å²	55	23%	0.226	31%	0.308	C	S	.	.	H	α-helix	trans	-57.9	-47.6	179.3	173.7	177.7	178.1	-168.5	0.6	112.3	F161 Q162 A163 V168 L169 F187	F161-R165 WeakPolarHBondContact O-CB 3.02Å; F161-R165 PolarHBondContact O-N 3.26Å; Q162-R165 PolarHBondContact O-N 3.17Å; A163-R165 VanDerWaalsContact C-N 3.34Å; A163-R165 PolarHBondContact O-N 3.17Å; R165-V168 PolarHBondContact O-N 2.63Å; R165-L169 HydrophobicContact CG-CD1 3.9Å; R165-L169 WeakPolarHBondContact O-CB 3.29Å; R165-L169 VanDerWaalsContact O-CG 3.3Å; R165-L169 WeakPolarHBondContact O-CG 3.41Å; R165-L169 PolarHBondContact O-N 2.91Å; R165-F187 HydrophobicContact CB-CD1 3.89Å; R165-F187 HydrophobicContact CB-CE1 3.83Å; R165-F187 HydrophobicContact CG-CD1 3.62Å; R165-F187 HydrophobicContact CG-CD2 4.48Å; R165-F187 HydrophobicContact CG-CE1 3.74Å; R165-F187 HydrophobicContact CG-CG 4.01Å; R165-F187 HydrophobicContact CG-CZ 4.21Å
166	Q	97.7	Very high	96	Very high	100 Å²	100	55.5 Å²	55.5	47%	0.467	31%	0.312	S	S	.	.	H	α-helix	trans	-65.3	-43.5	-179.7	-65.1	-57	-23.5	0	0	111.7	Q162 A163 F164 V168 L169 Q170	Q162-Q166 WeakPolarHBondContact O-CG 3.35Å; Q162-Q166 PolarHBondContact O-N 2.99Å; A163-Q166 PolarHBondContact O-N 2.91Å; F164-Q166 PolarHBondContact O-N 3.2Å; Q166-V168 PolarHBondContact O-N 2.83Å; Q166-L169 PolarHBondContact O-N 2.91Å; Q166-Q170 WeakPolarHBondContact O-CB 3.06Å; Q166-Q170 PolarHBondContact O-N 2.75Å
167	S	97.1	Very high	95.6	Very high	65 Å²	65	58.8 Å²	58.8	46%	0.455	32%	0.323	S	S	.	.	H	α-helix	trans	-59.5	-46	177.2	-179.1	0	0	0	0	112.1	A163 F164 Q170 A171	A163-S167 WeakPolarHBondContact O-CB 3.46Å; A163-S167 PolarHBondContact O-N 2.81Å; F164-S167 PolarHBondContact O-N 3.49Å; S167-Q170 PolarHBondContact O-N 3.31Å; S167-A171 WeakPolarHBondContact O-CB 3.48Å; S167-A171 PolarHBondContact O-N 2.86Å
168	V	97.7	Very high	95.3	Very high	0 Å²	0	60 Å²	60	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-64.3	-43.8	178.1	169.8	0	0	0	0	111.9	F164 R165 Q166 Q170 A171 A172 F179 V182 F187 I332 I335	F164-V168 HydrophobicContact CD2-CG2 4.19Å; F164-V168 HydrophobicContact CE1-CG2 4.19Å; F164-V168 HydrophobicContact CE2-CG2 3.77Å; F164-V168 HydrophobicContact CZ-CG2 3.79Å; F164-V168 WeakPolarHBondContact O-CG2 3.38Å; F164-V168 PolarHBondContact O-N 2.69Å; R165-V168 PolarHBondContact O-N 2.63Å; Q166-V168 PolarHBondContact O-N 2.83Å; V168-Q170 VanDerWaalsContact C-N 3.35Å; V168-A171 PolarHBondContact O-N 3.1Å; V168-A172 WeakPolarHBondContact O-CB 3.43Å; V168-A172 PolarHBondContact O-N 3.02Å; V168-F179 HydrophobicContact CG1-CD1 4.33Å; V168-F179 HydrophobicContact CG1-CE1 4.27Å; V168-V182 HydrophobicContact CG1-CG1 3.76Å; V168-F187 HydrophobicContact CB-CZ 4.17Å; V168-F187 HydrophobicContact CG1-CZ 3.84Å; V168-I332 HydrophobicContact CG1-CD1 3.87Å; V168-I332 HydrophobicContact CG1-CG1 3.8Å; V168-I332 HydrophobicContact CG2-CG1 4.4Å; V168-I332 HydrophobicContact CG2-CG2 3.99Å; V168-I335 HydrophobicContact CG2-CD1 4.41Å
169	L	97.5	Very high	95.3	Very high	41 Å²	41	58 Å²	58	22%	0.215	32%	0.321	C	S	.	.	H	α-helix	trans	-66.4	-37.8	179	-71.8	172.9	0	0	0	112.1	R165 Q166 A172 S173 F187	R165-L169 HydrophobicContact CG-CD1 3.9Å; R165-L169 WeakPolarHBondContact O-CB 3.29Å; R165-L169 VanDerWaalsContact O-CG 3.3Å; R165-L169 WeakPolarHBondContact O-CG 3.41Å; R165-L169 PolarHBondContact O-N 2.91Å; Q166-L169 PolarHBondContact O-N 2.91Å; L169-A172 PolarHBondContact O-N 3.19Å; L169-S173 PolarHBondContact O-N 2.83Å; L169-S173 VanDerWaalsContact O-N 3.16Å; L169-F187 HydrophobicContact CD1-CE2 4.48Å; L169-F187 HydrophobicContact CD2-CE2 3.71Å; L169-F187 HydrophobicContact CD2-CZ 4.3Å; L169-F187 HydrophobicContact CG-CE2 4Å; L169-F187 HydrophobicContact CG-CZ 4.19Å
170	Q	96.7	Very high	95.1	Very high	105 Å²	105	59 Å²	59	49%	0.491	32%	0.324	S	S	.	.	H	α-helix	trans	-62.3	-51	174.1	-177.2	58.9	38.5	0	0	110.8	Q166 S167 V168 A172 S173 E174	Q166-Q170 WeakPolarHBondContact O-CB 3.06Å; Q166-Q170 PolarHBondContact O-N 2.75Å; S167-Q170 PolarHBondContact O-N 3.31Å; V168-Q170 VanDerWaalsContact C-N 3.35Å; Q170-A172 VanDerWaalsContact C-N 3.31Å; Q170-A172 PolarHBondContact O-N 2.82Å; Q170-S173 WeakPolarHBondContact O-CB 3.26Å; Q170-S173 PolarHBondContact O-N 2.86Å; Q170-S173 PolarHBondContact O-OG 2.94Å; Q170-E174 PolarHBondContact NE2-OE1 3.15Å; Q170-E174 PolarHBondContact O-N 2.93Å
171	A	96.3	Very high	94.9	Very high	17 Å²	17	58.2 Å²	58.2	14%	0.14	33%	0.328	C	S	.	.	H	α-helix	trans	-61.2	-37.8	178.6	0	0	0	0	0	112.8	S167 V168 S173 E174 C175 F179 I335	S167-A171 WeakPolarHBondContact O-CB 3.48Å; S167-A171 PolarHBondContact O-N 2.86Å; V168-A171 PolarHBondContact O-N 3.1Å; A171-S173 VanDerWaalsContact C-N 3.27Å; A171-S173 PolarHBondContact O-N 2.85Å; A171-E174 PolarHBondContact O-N 2.81Å; A171-C175 PolarHBondContact O-N 3.15Å; A171-F179 HydrophobicContact CB-CE1 4.06Å; A171-F179 HydrophobicContact CB-CE2 4.06Å; A171-F179 HydrophobicContact CB-CZ 3.57Å; A171-I335 HydrophobicContact CB-CD1 3.64Å
172	A	95.2	Very high	94.8	Very high	15 Å²	15	58.9 Å²	58.9	12%	0.124	33%	0.332	C	S	.	.	H	α-helix	trans	-63.3	-33.1	175.6	0	0	0	0	0	112.7	V168 L169 Q170 F179	V168-A172 WeakPolarHBondContact O-CB 3.43Å; V168-A172 PolarHBondContact O-N 3.02Å; L169-A172 PolarHBondContact O-N 3.19Å; Q170-A172 VanDerWaalsContact C-N 3.31Å; Q170-A172 PolarHBondContact O-N 2.82Å; A172-F179 HydrophobicContact CB-CB 3.6Å; A172-F179 HydrophobicContact CB-CD1 3.95Å; A172-F179 HydrophobicContact CB-CG 3.84Å
173	S	93.8	Very high	94.6	Very high	87 Å²	87	58.1 Å²	58.1	61%	0.608	33%	0.33	S	S	*	.	H	α-helix	trans	-72.2	-30	176.8	78.1	0	0	0	0	113.2	L169 Q170 A171	L169-S173 PolarHBondContact O-N 2.83Å; L169-S173 VanDerWaalsContact O-N 3.16Å; Q170-S173 WeakPolarHBondContact O-CB 3.26Å; Q170-S173 PolarHBondContact O-N 2.86Å; Q170-S173 PolarHBondContact O-OG 2.94Å; A171-S173 VanDerWaalsContact C-N 3.27Å; A171-S173 PolarHBondContact O-N 2.85Å
174	E	92.7	Very high	94.4	Very high	145 Å²	145	58.4 Å²	58.4	68%	0.678	33%	0.329	S	S	*	.	H	α-helix	trans	-85.1	-33.3	179.7	-67.1	170.8	-171.3	0	0	112.3	Q170 A171	Q170-E174 PolarHBondContact NE2-OE1 3.15Å; Q170-E174 PolarHBondContact O-N 2.93Å; A171-E174 PolarHBondContact O-N 2.81Å
175	C	86.6	Confident	94.3	Very high	43 Å²	43	59.5 Å²	59.5	29%	0.291	34%	0.336	S	S	.	.			trans	-137	79.3	-171.1	-169.1	0	0	0	0	112	A171 H177 F179	A171-C175 PolarHBondContact O-N 3.15Å; C175-H177 VanDerWaalsContact C-N 3.34Å; C175-H177 PolarHBondContact O-N 3.01Å; C175-H177 PolarHBondContact SG-CE1 3.28Å; C175-H177 PolarHBondContact SG-ND1 2.82Å; C175-F179 VanDerWaalsContact O-CD2 3.26Å; C175-F179 WeakPolarHBondContact O-CD2 3.47Å
176	S	84	Confident	94.2	Very high	90 Å²	90	56.6 Å²	56.6	63%	0.629	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-25.5	-169.8	-179.3	0	0	0	0	115.9	F179 M180	S176-F179 CarbonylContact O-C 3.57Å; S176-F179 PolarHBondContact O-N 3.3Å; S176-M180 PolarHBondContact O-N 2.86Å
177	H	89.3	Confident	94.2	Very high	127 Å²	127	52.3 Å²	52.3	59%	0.588	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-42.4	-170.7	70.8	-84.8	0	0	0	113	C175 F179	C175-H177 VanDerWaalsContact C-N 3.34Å; C175-H177 PolarHBondContact O-N 3.01Å; C175-H177 PolarHBondContact SG-CE1 3.28Å; C175-H177 PolarHBondContact SG-ND1 2.82Å; H177-F179 PolarHBondContact O-N 2.99Å
178	D	92.4	Very high	94.1	Very high	26 Å²	26	49.8 Å²	49.8	14%	0.139	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-10.8	-179.6	-91.6	-16.6	0	0	0	113.1	S328 G331 K334	D178-S328 PolarHBondContact O-OG 2.77Å; D178-G331 PolarHBondContact O-N 3.46Å; D178-K334 VanDerWaalsContact CG-NZ 3.32Å; D178-K334 IonicContact OD1-NZ 2.67Å; D178-K334 PolarHBondContact OD1-NZ 3.34Å; D178-K334 IonicContact OD2-NZ 3.82Å; D178-K334 PolarHBondContact OD2-NZ 3.08Å
179	F	96	Very high	94	Very high	12 Å²	12	52.8 Å²	52.8	5%	0.053	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.7	26.6	-175.3	-65.6	-97.4	0	0	0	111.5	V168 A171 A172 C175 S176 H177 G181 V182 G331 I332 I335	V168-F179 HydrophobicContact CG1-CD1 4.33Å; V168-F179 HydrophobicContact CG1-CE1 4.27Å; A171-F179 HydrophobicContact CB-CE1 4.06Å; A171-F179 HydrophobicContact CB-CE2 4.06Å; A171-F179 HydrophobicContact CB-CZ 3.57Å; A172-F179 HydrophobicContact CB-CB 3.6Å; A172-F179 HydrophobicContact CB-CD1 3.95Å; A172-F179 HydrophobicContact CB-CG 3.84Å; C175-F179 VanDerWaalsContact O-CD2 3.26Å; C175-F179 WeakPolarHBondContact O-CD2 3.47Å; S176-F179 CarbonylContact O-C 3.57Å; S176-F179 PolarHBondContact O-N 3.3Å; H177-F179 PolarHBondContact O-N 2.99Å; F179-G181 PolarHBondContact O-N 2.78Å; F179-V182 HydrophobicContact CB-CB 4.19Å; F179-V182 HydrophobicContact CB-CG2 4.28Å; F179-V182 VanDerWaalsContact O-CB 3.3Å; F179-V182 WeakPolarHBondContact O-CB 3.46Å; F179-V182 WeakPolarHBondContact O-CG2 3.46Å; F179-V182 PolarHBondContact O-N 3.06Å; F179-G331 VanDerWaalsContact CZ-CA 3.45Å; F179-G331 WeakPolarHBondContact CZ-O 3.43Å; F179-I332 HydrophobicContact CD1-CG1 3.86Å; F179-I332 HydrophobicContact CE1-CG1 3.76Å; F179-I335 HydrophobicContact CE1-CD1 4.11Å; F179-I335 HydrophobicContact CZ-CD1 3.89Å; F179-I335 HydrophobicContact CZ-CG1 4.43Å
180	M	95.1	Very high	93.9	Very high	127 Å²	127	52.2 Å²	52.2	63%	0.626	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	125.1	-176.6	-167.2	-177.1	-49.2	0	0	111.5	S176 V182 F327 S328	S176-M180 PolarHBondContact O-N 2.86Å; M180-V182 VanDerWaalsContact C-N 3.25Å; M180-V182 PolarHBondContact O-N 3.1Å; M180-F327 CarbonylContact O-C 3.55Å; M180-F327 WeakPolarHBondContact O-CA 3.44Å; M180-S328 PolarHBondContact O-N 2.7Å
181	G	94.6	Very high	93.8	Very high	36 Å²	36	49.1 Å²	49.1	37%	0.371	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	-0.2	-176.5	0	0	0	0	0	114.9	F179 D183 R306	F179-G181 PolarHBondContact O-N 2.78Å; G181-D183 PolarHBondContact O-N 3.43Å; G181-R306 PolarHBondContact O-NH2 2.81Å
182	V	96.1	Very high	93.8	Very high	13 Å²	13	48.6 Å²	48.6	8%	0.079	29%	0.29	C	S	.	.			trans	-80.5	113	176.5	-179.4	0	0	0	0	109.8	V168 F179 M180 F187 L301 F327 S328 I332	V168-V182 HydrophobicContact CG1-CG1 3.76Å; F179-V182 HydrophobicContact CB-CB 4.19Å; F179-V182 HydrophobicContact CB-CG2 4.28Å; F179-V182 VanDerWaalsContact O-CB 3.3Å; F179-V182 WeakPolarHBondContact O-CB 3.46Å; F179-V182 WeakPolarHBondContact O-CG2 3.46Å; F179-V182 PolarHBondContact O-N 3.06Å; M180-V182 VanDerWaalsContact C-N 3.25Å; M180-V182 PolarHBondContact O-N 3.1Å; V182-F187 HydrophobicContact CG1-CE2 4.28Å; V182-F187 HydrophobicContact CG1-CZ 4.44Å; V182-L301 HydrophobicContact CG1-CD2 4.43Å; V182-F327 HydrophobicContact CG2-CB 4.26Å; V182-F327 HydrophobicContact CG2-CD2 4.27Å; V182-S328 WeakPolarHBondContact CG2-O 3.3Å; V182-I332 HydrophobicContact CG1-CD1 4.22Å; V182-I332 HydrophobicContact CG2-CD1 3.97Å
183	D	93.5	Very high	94	Very high	58 Å²	58	47.9 Å²	47.9	31%	0.31	28%	0.284	S	S	.	.			trans	-145.7	169.3	178.4	77	85.4	0	0	0	110.5	G181 S185 I186 F187 R306	G181-D183 PolarHBondContact O-N 3.43Å; D183-S185 VanDerWaalsContact CG-OG 3.24Å; D183-S185 PolarHBondContact O-N 2.74Å; D183-S185 WeakPolarHBondContact OD1-CA 3.2Å; D183-S185 WeakPolarHBondContact OD1-CB 3.33Å; D183-S185 PolarHBondContact OD1-N 3.32Å; D183-S185 PolarHBondContact OD1-OG 3.22Å; D183-S185 PolarHBondContact OD2-OG 3.5Å; D183-I186 WeakPolarHBondContact O-CG1 3.46Å; D183-I186 PolarHBondContact O-N 3.15Å; D183-F187 VanDerWaalsContact O-CD2 3.29Å; D183-F187 WeakPolarHBondContact O-CD2 3.46Å; D183-F187 WeakPolarHBondContact O-CE2 3.12Å; D183-R306 IonicContact OD2-NE 3.72Å; D183-R306 PolarHBondContact OD2-NE 3.43Å; D183-R306 IonicContact OD2-NH2 3.4Å
184	S	94.6	Very high	94.2	Very high	59 Å²	59	44.8 Å²	44.8	41%	0.413	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-61.2	-19.7	-174.7	75.7	0	0	0	0	114.5	I186	S184-I186 VanDerWaalsContact C-N 3.32Å; S184-I186 PolarHBondContact O-N 3.31Å
185	S	94.8	Very high	94.4	Very high	23 Å²	23	37.9 Å²	37.9	16%	0.161	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-69.2	-27.9	-175.7	71.3	0	0	0	0	113.4	D183 Y305 R306 K309	D183-S185 VanDerWaalsContact CG-OG 3.24Å; D183-S185 PolarHBondContact O-N 2.74Å; D183-S185 WeakPolarHBondContact OD1-CA 3.2Å; D183-S185 WeakPolarHBondContact OD1-CB 3.33Å; D183-S185 PolarHBondContact OD1-N 3.32Å; D183-S185 PolarHBondContact OD1-OG 3.22Å; D183-S185 PolarHBondContact OD2-OG 3.5Å; S185-Y305 WeakPolarHBondContact O-CB 3.31Å; S185-R306 WeakPolarHBondContact OG-CG 3.17Å; S185-K309 PolarHBondContact O-NZ 2.89Å; S185-K309 VanDerWaalsContact O-NZ 3.16Å
186	I	95.6	Very high	94.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-92.7	-4.5	-176.6	59.1	166.1	0	0	0	114.7	D183 S184 L301 N302 Y305 R306 F327	D183-I186 WeakPolarHBondContact O-CG1 3.46Å; D183-I186 PolarHBondContact O-N 3.15Å; S184-I186 VanDerWaalsContact C-N 3.32Å; S184-I186 PolarHBondContact O-N 3.31Å; I186-L301 HydrophobicContact CD1-CB 4.42Å; I186-L301 HydrophobicContact CD1-CD2 3.81Å; I186-L301 HydrophobicContact CD1-CG 4.4Å; I186-L301 HydrophobicContact CG1-CD2 4.29Å; I186-L301 HydrophobicContact CG1-CG 4.46Å; I186-L301 CarbonylContact O-C 3.57Å; I186-L301 WeakPolarHBondContact O-CA 3.13Å; I186-N302 PolarHBondContact O-N 3.03Å; I186-Y305 WeakPolarHBondContact O-CD2 3.37Å; I186-R306 HydrophobicContact CG2-CG 3.52Å; I186-R306 VanDerWaalsContact CG2-NE 3.28Å; I186-F327 HydrophobicContact CD1-CB 4.03Å; I186-F327 HydrophobicContact CD1-CD1 3.64Å; I186-F327 HydrophobicContact CD1-CD2 3.95Å; I186-F327 HydrophobicContact CD1-CE1 4.04Å; I186-F327 HydrophobicContact CD1-CE2 4.3Å; I186-F327 HydrophobicContact CD1-CG 3.6Å; I186-F327 HydrophobicContact CD1-CZ 4.35Å
187	F	97.5	Very high	95.6	Very high	9 Å²	9	33.2 Å²	33.2	4%	0.039	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-74.6	138.5	175.8	-75.4	-98.5	0	0	0	110.8	F161 F164 R165 V168 L169 V182 D183 L301	F161-F187 HydrophobicContact CZ-CD1 4.35Å; F164-F187 HydrophobicContact CE1-CE1 4.28Å; R165-F187 HydrophobicContact CB-CD1 3.89Å; R165-F187 HydrophobicContact CB-CE1 3.83Å; R165-F187 HydrophobicContact CG-CD1 3.62Å; R165-F187 HydrophobicContact CG-CD2 4.48Å; R165-F187 HydrophobicContact CG-CE1 3.74Å; R165-F187 HydrophobicContact CG-CG 4.01Å; R165-F187 HydrophobicContact CG-CZ 4.21Å; V168-F187 HydrophobicContact CB-CZ 4.17Å; V168-F187 HydrophobicContact CG1-CZ 3.84Å; L169-F187 HydrophobicContact CD1-CE2 4.48Å; L169-F187 HydrophobicContact CD2-CE2 3.71Å; L169-F187 HydrophobicContact CD2-CZ 4.3Å; L169-F187 HydrophobicContact CG-CE2 4Å; L169-F187 HydrophobicContact CG-CZ 4.19Å; V182-F187 HydrophobicContact CG1-CE2 4.28Å; V182-F187 HydrophobicContact CG1-CZ 4.44Å; D183-F187 VanDerWaalsContact O-CD2 3.29Å; D183-F187 WeakPolarHBondContact O-CD2 3.46Å; D183-F187 WeakPolarHBondContact O-CE2 3.12Å; F187-L301 HydrophobicContact CD1-CD1 3.74Å; F187-L301 HydrophobicContact CD1-CG 4.07Å; F187-L301 HydrophobicContact CD2-CG 4.48Å; F187-L301 HydrophobicContact CE1-CD1 3.62Å; F187-L301 HydrophobicContact CE1-CD2 4.34Å; F187-L301 HydrophobicContact CE1-CG 4.07Å; F187-L301 HydrophobicContact CE2-CD2 4.34Å; F187-L301 HydrophobicContact CE2-CG 4.48Å; F187-L301 HydrophobicContact CG-CD1 4.44Å; F187-L301 HydrophobicContact CG-CG 4.29Å; F187-L301 HydrophobicContact CZ-CD1 4.24Å; F187-L301 HydrophobicContact CZ-CD2 4.13Å; F187-L301 HydrophobicContact CZ-CG 4.29Å
188	H	95.9	Very high	95.9	Very high	13 Å²	13	27.3 Å²	27.3	6%	0.06	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-63.5	154.3	171.1	-157.6	67	0	0	0	110.7	F161 T192 L300 Y305	F161-H188 WeakPolarHBondContact CE1-O 3.46Å; F161-H188 HydrophobicContact CZ-CB 4.38Å; H188-T192 PolarHBondContact NE2-O 3.42Å; H188-T192 PolarHBondContact NE2-OG1 3.01Å; H188-L300 WeakPolarHBondContact CB-O 3.46Å; H188-L300 PolarHBondContact N-O 2.86Å; H188-Y305 HydrophobicContact CB-CE2 3.97Å; H188-Y305 AromaticContact CE1-CZ 4Å; H188-Y305 PolarHBondContact CE1-OH 3.46Å; H188-Y305 AromaticContact ND1-CE2 3.44Å; H188-Y305 WeakPolarHBondContact ND1-CE2 3.44Å; H188-Y305 AromaticContact ND1-CZ 3.17Å; H188-Y305 PolarHBondContact ND1-OH 3.23Å
189	S	95	Very high	96.1	Very high	62 Å²	62	27.7 Å²	27.7	43%	0.434	17%	0.171	S	C	.	.	P	Polyproline II helix	trans	-72.4	132.2	175.9	168.1	0	0	0	0	110.8	S191 T192	S189-S191 PolarHBondContact O-N 3.39Å; S189-S191 PolarHBondContact OG-N 3.34Å; S189-T192 VanDerWaalsContact CB-OG1 3.3Å; S189-T192 WeakPolarHBondContact CB-OG1 3.1Å; S189-T192 PolarHBondContact O-N 3.36Å; S189-T192 PolarHBondContact O-OG1 3.36Å
190	V	96	Very high	96.1	Very high	30 Å²	30	27.1 Å²	27.1	18%	0.182	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-56.3	-36	178	-177.6	0	0	0	0	111.2	K158 F161 T192	K158-V190 HydrophobicContact CB-CG1 3.71Å; K158-V190 HydrophobicContact CD-CG1 4.35Å; K158-V190 HydrophobicContact CG-CG1 3.77Å; F161-V190 HydrophobicContact CD1-CB 4.36Å; F161-V190 HydrophobicContact CD1-CG2 3.87Å; F161-V190 HydrophobicContact CE1-CG2 4.01Å; V190-T192 VanDerWaalsContact C-N 3.28Å; V190-T192 PolarHBondContact O-N 3.22Å
191	S	94.9	Very high	96.1	Very high	39 Å²	39	21.1 Å²	21.1	27%	0.273	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-76.4	-13.8	-178.1	-59.3	0	0	0	0	113.5	S189 F364	S189-S191 PolarHBondContact O-N 3.39Å; S189-S191 PolarHBondContact OG-N 3.34Å; S191-F364 VanDerWaalsContact O-CD2 3.28Å; S191-F364 WeakPolarHBondContact O-CD2 3.16Å
192	T	96.6	Very high	96.2	Very high	6 Å²	6	19.8 Å²	19.8	4%	0.037	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-123	21.9	-170.9	61.3	0	0	0	0	113.4	H188 S189 V190 H194 F358 Q363 Y365	H188-T192 PolarHBondContact NE2-O 3.42Å; H188-T192 PolarHBondContact NE2-OG1 3.01Å; S189-T192 VanDerWaalsContact CB-OG1 3.3Å; S189-T192 WeakPolarHBondContact CB-OG1 3.1Å; S189-T192 PolarHBondContact O-N 3.36Å; S189-T192 PolarHBondContact O-OG1 3.36Å; V190-T192 VanDerWaalsContact C-N 3.28Å; V190-T192 PolarHBondContact O-N 3.22Å; T192-H194 PolarHBondContact O-ND1 2.92Å; T192-F358 HydrophobicContact CG2-CD1 4.38Å; T192-F358 HydrophobicContact CG2-CE1 4.01Å; T192-Q363 WeakPolarHBondContact CG2-O 3.03Å; T192-Y365 HydrophobicContact CG2-CD2 4.34Å; T192-Y365 HydrophobicContact CG2-CE2 4.07Å
193	L	98.1	Very high	96	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	13%	0.128	C	C	.	.			trans	-63.6	134.1	173.4	-67.3	168.8	0	0	0	110.3	V152 V157 F161 M298	V152-L193 HydrophobicContact CB-CB 4.18Å; V152-L193 PolarHBondContact N-O 3.37Å; V157-L193 HydrophobicContact CG1-CD1 4.06Å; F161-L193 HydrophobicContact CB-CD1 3.95Å; F161-L193 HydrophobicContact CD1-CD1 3.71Å; F161-L193 HydrophobicContact CD1-CD2 4.11Å; F161-L193 HydrophobicContact CD1-CG 4.28Å; F161-L193 HydrophobicContact CE1-CD1 4.42Å; F161-L193 HydrophobicContact CE1-CD2 4.06Å; F161-L193 HydrophobicContact CG-CD1 3.91Å; F161-L193 HydrophobicContact CG-CD2 4.37Å; F161-L193 HydrophobicContact CZ-CD2 4.29Å; L193-M298 HydrophobicContact CB-SD 4.09Å; L193-M298 HydrophobicContact CD2-CG 4.33Å; L193-M298 HydrophobicContact CD2-SD 4.29Å
194	H	98.3	Very high	95.8	Very high	23 Å²	23	19.9 Å²	19.9	11%	0.106	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	164	-178.2	62.6	-86.4	0	0	0	111.6	F147 C149 L150 T192 T196 F364 Y365	F147-H194 AromaticContact CE2-CD2 3.65Å; F147-H194 AromaticContact CE2-NE2 3.53Å; C149-H194 HydrophobicContact CB-CB 4.02Å; L150-H194 VanDerWaalsContact O-CA 3.31Å; L150-H194 WeakPolarHBondContact O-CA 3.45Å; L150-H194 WeakPolarHBondContact O-CB 3.15Å; T192-H194 PolarHBondContact O-ND1 2.92Å; H194-T196 PolarHBondContact CD2-OG1 2.9Å; H194-T196 PolarHBondContact NE2-OG1 3.2Å; H194-F364 HydrophobicContact CB-CE2 4.36Å; H194-F364 HydrophobicContact CB-CZ 4.08Å; H194-Y365 AromaticContact CE1-CE2 3.84Å; H194-Y365 AromaticContact ND1-CE2 3.97Å
195	F	98.4	Very high	95.6	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	120.7	160.7	-69	-96.1	0	0	0	109.3	C149 L150 V152 L197 I237 L257 L296 H297 M298	C149-F195 CarbonylContact C-O 3.56Å; C149-F195 WeakPolarHBondContact CA-O 3.32Å; C149-F195 WeakPolarHBondContact CB-O 3.4Å; L150-F195 HydrophobicContact CB-CB 4.25Å; L150-F195 HydrophobicContact CD2-CD2 4.2Å; L150-F195 PolarHBondContact N-O 3.36Å; L150-F195 PolarHBondContact O-N 2.89Å; V152-F195 HydrophobicContact CG2-CD2 3.62Å; V152-F195 HydrophobicContact CG2-CE2 3.75Å; F195-L197 HydrophobicContact CB-CD2 4.4Å; F195-I237 HydrophobicContact CE2-CD1 3.66Å; F195-I237 HydrophobicContact CE2-CG1 4.09Å; F195-I237 HydrophobicContact CZ-CD1 4.03Å; F195-I237 HydrophobicContact CZ-CG1 4Å; F195-I237 HydrophobicContact CZ-CG2 4.3Å; F195-L257 HydrophobicContact CE1-CB 3.9Å; F195-L257 HydrophobicContact CZ-CB 4.24Å; F195-L257 HydrophobicContact CZ-CD1 4.23Å; F195-L296 HydrophobicContact CD1-CB 4.38Å; F195-H297 VanDerWaalsContact CD1-O 3.32Å; F195-H297 WeakPolarHBondContact CD1-O 3.19Å; F195-H297 VanDerWaalsContact CE1-C 3.45Å; F195-M298 HydrophobicContact CD1-CB 4.35Å; F195-M298 HydrophobicContact CD2-CB 4.38Å; F195-M298 HydrophobicContact CE1-CB 3.91Å; F195-M298 HydrophobicContact CE2-CB 3.96Å; F195-M298 HydrophobicContact CZ-CB 3.7Å
196	T	97.3	Very high	95.5	Very high	32 Å²	32	25.8 Å²	25.8	20%	0.196	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	125.8	174	-48.9	0	0	0	0	109.7	F147 H194 T199	F147-T196 HydrophobicContact CB-CG2 4.24Å; F147-T196 HydrophobicContact CD2-CG2 4.33Å; H194-T196 PolarHBondContact CD2-OG1 2.9Å; H194-T196 PolarHBondContact NE2-OG1 3.2Å; T196-T199 HydrophobicContact CG2-CG2 3.61Å
197	L	97.4	Very high	95.5	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.01	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-42.9	177.2	-49	-165.6	0	0	0	111.1	I148 F195 L266 A270 V294 L296 I350	I148-L197 HydrophobicContact CG2-CB 4.26Å; I148-L197 HydrophobicContact CG2-CD1 4.32Å; I148-L197 HydrophobicContact CG2-CG 4.5Å; I148-L197 PolarHBondContact O-N 2.6Å; F195-L197 HydrophobicContact CB-CD2 4.4Å; L197-L266 HydrophobicContact CD1-CD1 3.93Å; L197-L266 HydrophobicContact CD2-CD1 4.03Å; L197-A270 HydrophobicContact CB-CB 3.93Å; L197-A270 HydrophobicContact CD1-CB 4.34Å; L197-A270 HydrophobicContact CD2-CB 4.13Å; L197-A270 HydrophobicContact CG-CB 4.34Å; L197-V294 VanDerWaalsContact O-CG1 3.29Å; L197-V294 WeakPolarHBondContact O-CG1 3.3Å; L197-V294 WeakPolarHBondContact O-CG2 3.44Å; L197-L296 HydrophobicContact CD2-CD2 3.54Å; L197-I350 HydrophobicContact CD1-CD1 4.07Å; L197-I350 HydrophobicContact CD1-CG1 4.34Å; L197-I350 HydrophobicContact CD1-CG2 4Å
198	V	96.8	Very high	95.5	Very high	3 Å²	3	28 Å²	28	2%	0.018	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	136.6	179.8	-170.8	0	0	0	0	109	F147 I148 L200 L273 F274 L277 T283	F147-V198 CarbonylContact C-O 3.57Å; F147-V198 WeakPolarHBondContact CA-O 3.38Å; F147-V198 VanDerWaalsContact CB-O 3.31Å; F147-V198 WeakPolarHBondContact CB-O 3.44Å; I148-V198 HydrophobicContact CB-CB 4.2Å; I148-V198 HydrophobicContact CB-CG2 4.47Å; I148-V198 HydrophobicContact CD1-CB 4.22Å; I148-V198 HydrophobicContact CD1-CG2 4.27Å; I148-V198 HydrophobicContact CG1-CB 4.45Å; I148-V198 PolarHBondContact N-O 3.02Å; I148-V198 PolarHBondContact O-N 3.15Å; V198-L200 HydrophobicContact CG1-CD2 3.7Å; V198-L200 HydrophobicContact CG1-CG 4.21Å; V198-L273 HydrophobicContact CG2-CB 4.08Å; V198-F274 HydrophobicContact CG1-CD2 4.14Å; V198-F274 HydrophobicContact CG2-CB 4.03Å; V198-L277 HydrophobicContact CB-CD1 4.29Å; V198-L277 HydrophobicContact CG1-CD1 3.96Å; V198-L277 HydrophobicContact CG2-CD1 4.21Å; V198-T283 HydrophobicContact CG1-CG2 3.87Å
199	T	96	Very high	95.5	Very high	35 Å²	35	31.2 Å²	31.2	22%	0.215	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	136.2	171.5	53.8	0	0	0	0	109.5	P144 T196 T283 S284	P144-T199 HydrophobicContact CG-CG2 4.46Å; T196-T199 HydrophobicContact CG2-CG2 3.61Å; T199-T283 WeakPolarHBondContact O-CA 3.46Å; T199-S284 VanDerWaalsContact C-OG 3.24Å; T199-S284 WeakPolarHBondContact CB-OG 3.37Å; T199-S284 PolarHBondContact O-N 2.88Å; T199-S284 PolarHBondContact O-OG 2.96Å; T199-S284 PolarHBondContact OG1-OG 3.24Å
200	L	96.4	Very high	95.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	145.3	-168.2	-58.5	170.7	0	0	0	110.9	P144 T145 H146 I148 V198 L202 L277 L282 T283 L352	P144-L200 CarbonylContact C-O 3.51Å; P144-L200 WeakPolarHBondContact CA-O 3.45Å; T145-L200 PolarHBondContact N-O 2.88Å; H146-L200 HydrophobicContact CB-CB 4.13Å; H146-L200 HydrophobicContact CB-CD1 4.44Å; H146-L200 PolarHBondContact N-O 3.43Å; H146-L200 VanDerWaalsContact N-O 3.1Å; H146-L200 PolarHBondContact O-N 2.84Å; H146-L200 VanDerWaalsContact O-O 3.08Å; I148-L200 HydrophobicContact CD1-CD1 4.44Å; I148-L200 HydrophobicContact CG1-CD1 4.25Å; V198-L200 HydrophobicContact CG1-CD2 3.7Å; V198-L200 HydrophobicContact CG1-CG 4.21Å; L200-L202 HydrophobicContact CB-CD2 4.08Å; L200-L202 HydrophobicContact CB-CG 4.03Å; L200-L202 HydrophobicContact CD1-CD1 4.17Å; L200-L202 HydrophobicContact CD1-CD2 4.38Å; L200-L202 HydrophobicContact CD1-CG 4.46Å; L200-L277 HydrophobicContact CD2-CB 4.07Å; L200-L277 HydrophobicContact CD2-CD1 4.07Å; L200-L277 HydrophobicContact CD2-CD2 4.28Å; L200-L277 HydrophobicContact CD2-CG 4.36Å; L200-L282 VanDerWaalsContact CA-O 3.28Å; L200-L282 WeakPolarHBondContact CA-O 3.33Å; L200-L282 WeakPolarHBondContact CB-O 3.36Å; L200-L282 HydrophobicContact CD2-CB 4.18Å; L200-L282 WeakPolarHBondContact CD2-O 3.01Å; L200-T283 HydrophobicContact CD2-CG2 4.15Å; L200-L352 HydrophobicContact CD1-CD1 3.54Å
201	V	95.2	Very high	95.7	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.006	17%	0.166	C	C	.	.			trans	-107.9	110.9	157.9	-177.4	0	0	0	0	105.1	F79 R139 C142 T145 L282	F79-V201 HydrophobicContact CZ-CG1 4.32Å; R139-V201 HydrophobicContact CG-CB 3.58Å; R139-V201 HydrophobicContact CG-CG1 4.05Å; R139-V201 HydrophobicContact CG-CG2 3.9Å; R139-V201 PolarHBondContact NH1-O 3.27Å; C142-V201 HydrophobicContact CB-CG1 4.24Å; C142-V201 HydrophobicContact CB-CG2 3.92Å; T145-V201 HydrophobicContact CG2-CG1 4.38Å; V201-L282 PolarHBondContact N-O 3.26Å
202	L	95.5	Very high	95.8	Very high	7 Å²	7	29.2 Å²	29.2	4%	0.037	16%	0.155	C	C	.	.			trans	-110.4	117.9	170.9	-48.9	178.9	0	0	0	106.4	T145 H146 L200 E207 V208 A211 L282 L352	T145-L202 PolarHBondContact OG1-N 3.01Å; T145-L202 PolarHBondContact OG1-O 3.42Å; H146-L202 HydrophobicContact CB-CD1 3.76Å; H146-L202 HydrophobicContact CB-CG 4.1Å; L200-L202 HydrophobicContact CB-CD2 4.08Å; L200-L202 HydrophobicContact CB-CG 4.03Å; L200-L202 HydrophobicContact CD1-CD1 4.17Å; L200-L202 HydrophobicContact CD1-CD2 4.38Å; L200-L202 HydrophobicContact CD1-CG 4.46Å; L202-E207 WeakPolarHBondContact CA-OE2 3.47Å; L202-E207 HydrophobicContact CB-CB 4.14Å; L202-E207 HydrophobicContact CD2-CB 4.33Å; L202-V208 HydrophobicContact CB-CG2 4.03Å; L202-V208 HydrophobicContact CD1-CB 4.46Å; L202-V208 HydrophobicContact CD1-CG2 3.98Å; L202-A211 HydrophobicContact CD1-CB 3.96Å; L202-A211 HydrophobicContact CD2-CB 4.29Å; L202-L282 HydrophobicContact CD2-CB 3.95Å; L202-L282 HydrophobicContact CD2-CD1 4.2Å; L202-L282 HydrophobicContact CD2-CD2 3.95Å; L202-L282 HydrophobicContact CD2-CG 4.25Å; L202-L352 HydrophobicContact CD1-CD1 4.48Å
203	A	91.7	Very high	95.9	Very high	24 Å²	24	33.6 Å²	33.6	20%	0.198	18%	0.175	C	C	.	.			trans	-87	-24.1	-166.7	0	0	0	0	0	113.2	S76 L78 F79 E207	S76-A203 VanDerWaalsContact OG-CB 3.29Å; S76-A203 WeakPolarHBondContact OG-CB 3.39Å; L78-A203 HydrophobicContact CB-CB 4.34Å; L78-A203 HydrophobicContact CD1-CB 4.49Å; F79-A203 HydrophobicContact CE2-CB 3.86Å; F79-A203 HydrophobicContact CZ-CB 4.38Å; A203-E207 WeakPolarHBondContact CB-OE2 3.24Å; A203-E207 PolarHBondContact N-OE2 3.28Å
204	D	89.6	Confident	95.8	Very high	50 Å²	50	34.6 Å²	34.6	27%	0.267	18%	0.18	S	C	.	.	S	Bend	trans	-152.2	174.8	179.3	58.6	47.2	0	0	0	111.4	S206 E207 V208	D204-S206 PolarHBondContact O-N 2.97Å; D204-S206 WeakPolarHBondContact OD1-CA 3.28Å; D204-S206 VanDerWaalsContact OD1-CB 3.25Å; D204-S206 WeakPolarHBondContact OD1-CB 3.2Å; D204-S206 PolarHBondContact OD1-N 3.48Å; D204-E207 PolarHBondContact O-N 3.34Å; D204-E207 PolarHBondContact OD1-N 2.91Å; D204-V208 PolarHBondContact O-N 2.72Å; D204-V208 VanDerWaalsContact O-N 3.17Å
205	E	91.7	Very high	95.8	Very high	147 Å²	147	33.5 Å²	33.5	69%	0.687	18%	0.175	S	C	*	.	H	α-helix	trans	-60.8	-32.1	179.7	-173	172.7	-168.4	0	0	112.6	E207 V208 E209	E205-E207 VanDerWaalsContact C-N 3.35Å; E205-E207 PolarHBondContact O-N 3.07Å; E205-V208 WeakPolarHBondContact O-CB 3.39Å; E205-V208 PolarHBondContact O-N 2.88Å; E205-E209 WeakPolarHBondContact O-CG 3.5Å; E205-E209 PolarHBondContact O-N 2.81Å
206	S	92.5	Very high	95.6	Very high	58 Å²	58	35.8 Å²	35.8	41%	0.406	19%	0.185	S	C	.	.	H	α-helix	trans	-66	-37.8	177.7	-179.6	0	0	0	0	111.5	K74 D204 E209 K210	K74-S206 PolarHBondContact NZ-OG 2.94Å; D204-S206 PolarHBondContact O-N 2.97Å; D204-S206 WeakPolarHBondContact OD1-CA 3.28Å; D204-S206 VanDerWaalsContact OD1-CB 3.25Å; D204-S206 WeakPolarHBondContact OD1-CB 3.2Å; D204-S206 PolarHBondContact OD1-N 3.48Å; S206-E209 PolarHBondContact O-N 2.83Å; S206-K210 WeakPolarHBondContact O-CB 3.09Å; S206-K210 PolarHBondContact O-N 2.7Å
207	E	95.3	Very high	95.5	Very high	31 Å²	31	38.8 Å²	38.8	15%	0.145	20%	0.203	C	C	.	.	H	α-helix	trans	-69.9	-34.3	172.6	-70.8	-170.3	171.1	0	0	112.5	R139 L202 A203 D204 E205 K210 A211 L282	R139-E207 IonicContact CZ-OE1 2.72Å; R139-E207 IonicContact CZ-OE2 2.89Å; R139-E207 IonicContact NH1-OE1 2.9Å; R139-E207 IonicContact NH1-OE2 3.19Å; R139-E207 PolarHBondContact NH1-OE2 2.94Å; R139-E207 IonicContact NH2-OE1 2.67Å; R139-E207 PolarHBondContact NH2-OE1 3.48Å; R139-E207 IonicContact NH2-OE2 3.26Å; R139-E207 PolarHBondContact NH2-OE2 2.91Å; L202-E207 WeakPolarHBondContact CA-OE2 3.47Å; L202-E207 HydrophobicContact CB-CB 4.14Å; L202-E207 HydrophobicContact CD2-CB 4.33Å; A203-E207 WeakPolarHBondContact CB-OE2 3.24Å; A203-E207 PolarHBondContact N-OE2 3.28Å; D204-E207 PolarHBondContact O-N 3.34Å; D204-E207 PolarHBondContact OD1-N 2.91Å; E205-E207 VanDerWaalsContact C-N 3.35Å; E205-E207 PolarHBondContact O-N 3.07Å; E207-K210 PolarHBondContact O-N 3.42Å; E207-A211 WeakPolarHBondContact O-CB 3.36Å; E207-A211 PolarHBondContact O-N 3.07Å; E207-L282 HydrophobicContact CB-CD2 4.23Å; E207-L282 HydrophobicContact CG-CD2 4.15Å
208	V	96.8	Very high	95.5	Very high	25 Å²	25	39.1 Å²	39.1	15%	0.152	21%	0.205	C	C	.	.	H	α-helix	trans	-61.3	-47.2	171.6	178.9	0	0	0	0	110.6	L202 D204 E205 K210 A211 C212 C368	L202-V208 HydrophobicContact CB-CG2 4.03Å; L202-V208 HydrophobicContact CD1-CB 4.46Å; L202-V208 HydrophobicContact CD1-CG2 3.98Å; D204-V208 PolarHBondContact O-N 2.72Å; D204-V208 VanDerWaalsContact O-N 3.17Å; E205-V208 WeakPolarHBondContact O-CB 3.39Å; E205-V208 PolarHBondContact O-N 2.88Å; V208-K210 PolarHBondContact O-N 2.95Å; V208-A211 PolarHBondContact O-N 2.73Å; V208-C212 PolarHBondContact O-N 2.87Å; V208-C212 PolarHBondContact O-SG 3.31Å; V208-C368 HydrophobicContact CG1-CB 4.04Å
209	E	96.8	Very high	95.3	Very high	80 Å²	80	40.4 Å²	40.4	37%	0.374	21%	0.21	S	C	.	.	H	α-helix	trans	-61.8	-43.9	176.5	-70.2	-173.3	150	0	0	111.9	E205 S206 A211 C212 E213 K385	E205-E209 WeakPolarHBondContact O-CG 3.5Å; E205-E209 PolarHBondContact O-N 2.81Å; S206-E209 PolarHBondContact O-N 2.83Å; E209-A211 VanDerWaalsContact C-N 3.34Å; E209-A211 PolarHBondContact O-N 3.39Å; E209-C212 WeakPolarHBondContact O-CB 3.33Å; E209-C212 PolarHBondContact O-N 2.81Å; E209-C212 VanDerWaalsContact O-N 3.13Å; E209-E213 WeakPolarHBondContact O-CG 3.44Å; E209-E213 PolarHBondContact O-N 3.15Å; E209-K385 IonicContact OE1-NZ 3.71Å; E209-K385 PolarHBondContact OE1-NZ 3.36Å
210	K	96.5	Very high	95.2	Very high	84 Å²	84	45.8 Å²	45.8	37%	0.365	23%	0.23	S	C	.	.	H	α-helix	trans	-58.1	-45.5	175.5	-171.9	-179.1	179.5	-170.8	0	111.8	S206 E207 V208 C212 E213 I214 L282	S206-K210 WeakPolarHBondContact O-CB 3.09Å; S206-K210 PolarHBondContact O-N 2.7Å; E207-K210 PolarHBondContact O-N 3.42Å; V208-K210 PolarHBondContact O-N 2.95Å; K210-C212 VanDerWaalsContact C-N 3.33Å; K210-C212 PolarHBondContact O-N 2.89Å; K210-E213 PolarHBondContact O-N 3.12Å; K210-I214 HydrophobicContact CG-CD1 4.28Å; K210-I214 WeakPolarHBondContact O-CG1 3.34Å; K210-I214 PolarHBondContact O-N 2.87Å; K210-L282 HydrophobicContact CD-CD1 4.43Å; K210-L282 HydrophobicContact CG-CD1 4.47Å
211	A	97.8	Very high	95.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.5	-42.7	175.5	0	0	0	0	0	111.6	L202 E207 V208 E209 E213 I214 L215 L277 L282 L352	L202-A211 HydrophobicContact CD1-CB 3.96Å; L202-A211 HydrophobicContact CD2-CB 4.29Å; E207-A211 WeakPolarHBondContact O-CB 3.36Å; E207-A211 PolarHBondContact O-N 3.07Å; V208-A211 PolarHBondContact O-N 2.73Å; E209-A211 VanDerWaalsContact C-N 3.34Å; E209-A211 PolarHBondContact O-N 3.39Å; A211-E213 PolarHBondContact O-N 3.19Å; A211-I214 PolarHBondContact O-N 2.79Å; A211-L215 WeakPolarHBondContact O-CD1 3.23Å; A211-L215 PolarHBondContact O-N 3.03Å; A211-L215 VanDerWaalsContact O-N 3.12Å; A211-L277 HydrophobicContact CB-CD2 4.21Å; A211-L282 HydrophobicContact CB-CD1 4.21Å; A211-L352 HydrophobicContact CB-CD2 3.89Å
212	C	97.9	Very high	95.2	Very high	6 Å²	6	54 Å²	54	4%	0.041	27%	0.273	C	S	.	.	H	α-helix	trans	-59.9	-43.5	174.5	-60.9	0	0	0	0	112.3	V208 E209 K210 L215 K216 C369	V208-C212 PolarHBondContact O-N 2.87Å; V208-C212 PolarHBondContact O-SG 3.31Å; E209-C212 WeakPolarHBondContact O-CB 3.33Å; E209-C212 PolarHBondContact O-N 2.81Å; E209-C212 VanDerWaalsContact O-N 3.13Å; K210-C212 VanDerWaalsContact C-N 3.33Å; K210-C212 PolarHBondContact O-N 2.89Å; C212-L215 PolarHBondContact O-N 2.79Å; C212-K216 WeakPolarHBondContact O-CG 3.37Å; C212-K216 PolarHBondContact O-N 2.89Å; C212-C369 HydrophobicContact CB-CB 4.14Å; C212-C369 WeakPolarHBondContact SG-CB 3.35Å; C212-C369 VanDerWaalsContact SG-SG 3.63Å
213	E	97.3	Very high	95.1	Very high	97 Å²	97	59 Å²	59	45%	0.453	29%	0.291	S	S	.	.	H	α-helix	trans	-66.3	-35.2	178.6	-68.5	-50.5	126.3	0	0	112.6	E209 K210 A211 K216 T217	E209-E213 WeakPolarHBondContact O-CG 3.44Å; E209-E213 PolarHBondContact O-N 3.15Å; K210-E213 PolarHBondContact O-N 3.12Å; A211-E213 PolarHBondContact O-N 3.19Å; E213-K216 WeakPolarHBondContact O-CB 3.39Å; E213-K216 PolarHBondContact O-N 2.63Å; E213-K216 WeakPolarHBondContact OE1-CD 3.43Å; E213-K216 WeakPolarHBondContact OE1-CE 3.45Å; E213-K216 IonicContact OE1-NZ 3.7Å; E213-K216 PolarHBondContact OE1-NZ 3.06Å; E213-T217 WeakPolarHBondContact O-CB 3.48Å; E213-T217 PolarHBondContact O-N 3.02Å; E213-T217 PolarHBondContact O-OG1 2.83Å
214	I	97.5	Very high	95.2	Very high	22 Å²	22	57.9 Å²	57.9	11%	0.113	28%	0.282	C	S	.	.	H	α-helix	trans	-62.3	-45.9	173.2	-68.4	161.7	0	0	0	110.1	K210 A211 K216 T217 F218 L276 L277 Q280 L282	K210-I214 HydrophobicContact CG-CD1 4.28Å; K210-I214 WeakPolarHBondContact O-CG1 3.34Å; K210-I214 PolarHBondContact O-N 2.87Å; A211-I214 PolarHBondContact O-N 2.79Å; I214-K216 VanDerWaalsContact C-N 3.34Å; I214-K216 PolarHBondContact O-N 2.78Å; I214-T217 PolarHBondContact O-N 3.02Å; I214-F218 WeakPolarHBondContact O-CB 3.49Å; I214-F218 PolarHBondContact O-N 3.23Å; I214-L276 HydrophobicContact CG2-CB 3.77Å; I214-L276 HydrophobicContact CG2-CD1 4.49Å; I214-L277 HydrophobicContact CB-CD2 4.39Å; I214-L277 HydrophobicContact CD1-CD2 3.87Å; I214-L277 HydrophobicContact CG2-CD2 4.19Å; I214-L277 HydrophobicContact CG2-CG 4.31Å; I214-Q280 HydrophobicContact CD1-CB 3.95Å; I214-Q280 HydrophobicContact CD1-CG 3.68Å; I214-L282 HydrophobicContact CD1-CD1 3.91Å
215	L	97.3	Very high	95.4	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.9	-42.3	178.1	-92.1	65.4	0	0	0	111.4	I148 A211 C212 Y219 L273 L277 L352 L371	I148-L215 HydrophobicContact CD1-CD1 3.58Å; I148-L215 HydrophobicContact CD1-CD2 4.04Å; I148-L215 HydrophobicContact CD1-CG 4.28Å; I148-L215 HydrophobicContact CG1-CD2 4.41Å; A211-L215 WeakPolarHBondContact O-CD1 3.23Å; A211-L215 PolarHBondContact O-N 3.03Å; A211-L215 VanDerWaalsContact O-N 3.12Å; C212-L215 PolarHBondContact O-N 2.79Å; L215-Y219 VanDerWaalsContact O-CB 3.32Å; L215-Y219 WeakPolarHBondContact O-CB 3.5Å; L215-Y219 PolarHBondContact O-N 2.9Å; L215-L273 HydrophobicContact CD1-CD2 4.13Å; L215-L273 HydrophobicContact CG-CD2 4.11Å; L215-L277 HydrophobicContact CD1-CD1 4.27Å; L215-L352 HydrophobicContact CD2-CB 4.19Å; L215-L371 HydrophobicContact CB-CD1 4.36Å; L215-L371 HydrophobicContact CB-CD2 4.28Å; L215-L371 HydrophobicContact CD2-CD1 4.49Å; L215-L371 HydrophobicContact CD2-CG 4.5Å; L215-L371 HydrophobicContact CG-CD1 4.32Å
216	K	94.1	Very high	95.4	Very high	48 Å²	48	57.3 Å²	57.3	21%	0.209	28%	0.28	C	S	.	.	H	α-helix	trans	-58.6	-49	173.6	-74.2	171	-170.4	173.7	0	112.1	C212 E213 I214 Y219 K220 M383	C212-K216 WeakPolarHBondContact O-CG 3.37Å; C212-K216 PolarHBondContact O-N 2.89Å; E213-K216 WeakPolarHBondContact O-CB 3.39Å; E213-K216 PolarHBondContact O-N 2.63Å; E213-K216 WeakPolarHBondContact OE1-CD 3.43Å; E213-K216 WeakPolarHBondContact OE1-CE 3.45Å; E213-K216 IonicContact OE1-NZ 3.7Å; E213-K216 PolarHBondContact OE1-NZ 3.06Å; I214-K216 VanDerWaalsContact C-N 3.34Å; I214-K216 PolarHBondContact O-N 2.78Å; K216-Y219 PolarHBondContact O-N 2.94Å; K216-K220 WeakPolarHBondContact O-CB 3.19Å; K216-K220 WeakPolarHBondContact O-CG 3.5Å; K216-K220 PolarHBondContact O-N 3.31Å; K216-M383 HydrophobicContact CB-SD 4.29Å; K216-M383 HydrophobicContact CD-SD 3.77Å; K216-M383 WeakPolarHBondContact CE-SD 3.5Å; K216-M383 HydrophobicContact CG-CE 4.29Å; K216-M383 HydrophobicContact CG-CG 4.34Å; K216-M383 HydrophobicContact CG-SD 3.03Å; K216-M383 WeakPolarHBondContact CG-SD 3.25Å
217	T	96	Very high	95.5	Very high	94 Å²	94	55.2 Å²	55.2	58%	0.577	26%	0.264	S	S	*	.	H	α-helix	trans	-64.5	-44.6	-176.8	-58.4	0	0	0	0	110.3	E213 I214 K220 S221	E213-T217 WeakPolarHBondContact O-CB 3.48Å; E213-T217 PolarHBondContact O-N 3.02Å; E213-T217 PolarHBondContact O-OG1 2.83Å; I214-T217 PolarHBondContact O-N 3.02Å; T217-K220 PolarHBondContact O-N 3.06Å; T217-S221 PolarHBondContact O-N 3.29Å
218	F	96.2	Very high	95.4	Very high	9 Å²	9	54 Å²	54	4%	0.039	26%	0.258	C	S	.	.	H	α-helix	trans	-58.4	-51.5	173.6	173.6	-114.4	0	0	0	111.6	I214 K220 S221 G224 L227 F228 I269 E272 L273 L276	I214-F218 WeakPolarHBondContact O-CB 3.49Å; I214-F218 PolarHBondContact O-N 3.23Å; F218-K220 PolarHBondContact O-N 3.32Å; F218-S221 VanDerWaalsContact O-CB 3.31Å; F218-S221 WeakPolarHBondContact O-CB 3.16Å; F218-S221 PolarHBondContact O-N 2.98Å; F218-S221 PolarHBondContact O-OG 3.49Å; F218-G224 WeakPolarHBondContact O-CA 3.41Å; F218-L227 HydrophobicContact CE2-CD1 4.42Å; F218-L227 HydrophobicContact CZ-CD1 3.84Å; F218-F228 HydrophobicContact CD1-CE2 4.45Å; F218-F228 AromaticContact CE1-CE2 3.84Å; F218-F228 HydrophobicContact CE1-CE2 3.84Å; F218-I269 HydrophobicContact CE1-CG2 4.12Å; F218-E272 HydrophobicContact CD2-CB 4.46Å; F218-E272 HydrophobicContact CE2-CB 3.65Å; F218-E272 HydrophobicContact CE2-CG 4.21Å; F218-E272 HydrophobicContact CZ-CB 3.9Å; F218-E272 HydrophobicContact CZ-CG 4.47Å; F218-L273 HydrophobicContact CB-CD2 4.19Å; F218-L273 HydrophobicContact CD1-CD2 3.45Å; F218-L273 VanDerWaalsContact CD1-CD2 3.45Å; F218-L273 HydrophobicContact CD1-CG 4.06Å; F218-L273 HydrophobicContact CE1-CD2 3.97Å; F218-L273 HydrophobicContact CE1-CG 4.05Å; F218-L273 HydrophobicContact CG-CD2 3.92Å; F218-L276 HydrophobicContact CB-CD1 3.75Å; F218-L276 HydrophobicContact CD2-CD1 3.74Å; F218-L276 HydrophobicContact CG-CD1 3.98Å
219	Y	93.8	Very high	95.1	Very high	30 Å²	30	56 Å²	56	12%	0.118	28%	0.277	C	S	.	.	H	α-helix	trans	-57.3	-37.6	-179.6	-179	-86.1	0	0	0	112.6	L215 K216 F228 L371	L215-Y219 VanDerWaalsContact O-CB 3.32Å; L215-Y219 WeakPolarHBondContact O-CB 3.5Å; L215-Y219 PolarHBondContact O-N 2.9Å; K216-Y219 PolarHBondContact O-N 2.94Å; Y219-F228 HydrophobicContact CD2-CB 4.48Å; Y219-F228 AromaticContact CD2-CD1 3.86Å; Y219-F228 HydrophobicContact CD2-CD1 3.86Å; Y219-F228 HydrophobicContact CD2-CD2 4.07Å; Y219-F228 HydrophobicContact CD2-CE1 4.04Å; Y219-F228 HydrophobicContact CD2-CE2 4.24Å; Y219-F228 AromaticContact CD2-CG 3.88Å; Y219-F228 HydrophobicContact CD2-CG 3.88Å; Y219-F228 HydrophobicContact CD2-CZ 4.22Å; Y219-F228 HydrophobicContact CE2-CB 3.96Å; Y219-F228 AromaticContact CE2-CD1 3.59Å; Y219-F228 HydrophobicContact CE2-CD1 3.59Å; Y219-F228 HydrophobicContact CE2-CD2 4.37Å; Y219-F228 HydrophobicContact CE2-CE1 4.15Å; Y219-F228 AromaticContact CE2-CG 3.71Å; Y219-F228 HydrophobicContact CE2-CG 3.71Å; Y219-L371 HydrophobicContact CD2-CB 4.25Å; Y219-L371 HydrophobicContact CD2-CD1 4.47Å; Y219-L371 HydrophobicContact CD2-CD2 4.07Å; Y219-L371 HydrophobicContact CD2-CG 4.5Å; Y219-L371 HydrophobicContact CG-CD2 4.1Å
220	K	94	Very high	94.7	Very high	149 Å²	149	56.3 Å²	56.3	65%	0.648	29%	0.288	S	S	*	.	H	α-helix	trans	-82.6	-13.3	178.2	-69	176.9	-179.1	179.4	0	114.3	K216 T217 F218	K216-K220 WeakPolarHBondContact O-CB 3.19Å; K216-K220 WeakPolarHBondContact O-CG 3.5Å; K216-K220 PolarHBondContact O-N 3.31Å; T217-K220 PolarHBondContact O-N 3.06Å; F218-K220 PolarHBondContact O-N 3.32Å
221	S	95.7	Very high	94.4	Very high	41 Å²	41	52.7 Å²	52.7	29%	0.287	28%	0.275	S	S	.	.	S	Bend	trans	-66.2	157.5	177.7	75.5	0	0	0	0	111.1	T217 F218 R223 G224 I225	T217-S221 PolarHBondContact O-N 3.29Å; F218-S221 VanDerWaalsContact O-CB 3.31Å; F218-S221 WeakPolarHBondContact O-CB 3.16Å; F218-S221 PolarHBondContact O-N 2.98Å; F218-S221 PolarHBondContact O-OG 3.49Å; S221-R223 PolarHBondContact O-N 3.04Å; S221-G224 PolarHBondContact O-N 3.02Å; S221-G224 VanDerWaalsContact O-N 3.12Å; S221-G224 PolarHBondContact OG-N 3.48Å; S221-I225 WeakPolarHBondContact O-CG1 3.5Å; S221-I225 PolarHBondContact O-N 3.11Å
222	Q	94.9	Very high	94.3	Very high	132 Å²	132	53.7 Å²	53.7	62%	0.617	28%	0.281	S	S	*	.	H	α-helix	trans	-53.4	-39.7	175.5	-177.1	59.4	38.7	0	0	112.2	Q226	Q222-Q226 WeakPolarHBondContact O-CG 3.29Å; Q222-Q226 PolarHBondContact O-N 2.82Å
223	R	94	Very high	94.3	Very high	113 Å²	113	53.4 Å²	53.4	43%	0.426	28%	0.279	S	S	.	.	H	α-helix	trans	-68.6	-45.2	178.2	-174.5	60.8	168.5	170.6	0.2	111.9	S221 Q226 L227 E272	S221-R223 PolarHBondContact O-N 3.04Å; R223-Q226 PolarHBondContact O-N 3.26Å; R223-L227 HydrophobicContact CG-CD1 4.13Å; R223-L227 WeakPolarHBondContact O-CG 3.29Å; R223-L227 PolarHBondContact O-N 3.38Å; R223-L227 VanDerWaalsContact O-N 3.09Å; R223-E272 IonicContact NE-OE1 3.59Å
224	G	94.1	Very high	94.3	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.7	-47.2	175.2	0	0	0	0	0	111.8	F218 S221 Q226 L227 F228	F218-G224 WeakPolarHBondContact O-CA 3.41Å; S221-G224 PolarHBondContact O-N 3.02Å; S221-G224 VanDerWaalsContact O-N 3.12Å; S221-G224 PolarHBondContact OG-N 3.48Å; G224-Q226 VanDerWaalsContact C-N 3.29Å; G224-Q226 PolarHBondContact O-N 2.85Å; G224-L227 PolarHBondContact O-N 3.3Å; G224-L227 VanDerWaalsContact O-N 3.09Å; G224-F228 VanDerWaalsContact O-CD2 3.28Å; G224-F228 WeakPolarHBondContact O-CD2 3.28Å; G224-F228 PolarHBondContact O-N 3.21Å
225	I	92.4	Very high	94.3	Very high	85 Å²	85	53.3 Å²	53.3	44%	0.436	28%	0.277	S	S	.	.	H	α-helix	trans	-55	-46.1	176.5	-68	167.2	0	0	0	110.8	S221 L227 F228 A229	S221-I225 WeakPolarHBondContact O-CG1 3.5Å; S221-I225 PolarHBondContact O-N 3.11Å; I225-L227 PolarHBondContact O-N 2.96Å; I225-F228 PolarHBondContact O-N 3.34Å; I225-A229 WeakPolarHBondContact O-CB 3.43Å; I225-A229 PolarHBondContact O-N 3.22Å
226	Q	93	Very high	94.4	Very high	100 Å²	100	54.3 Å²	54.3	47%	0.467	28%	0.283	S	S	.	.	H	α-helix	trans	-60.3	-43.7	177.4	-72.2	169.3	-8.9	0	0	112.7	Q222 R223 G224	Q222-Q226 WeakPolarHBondContact O-CG 3.29Å; Q222-Q226 PolarHBondContact O-N 2.82Å; R223-Q226 PolarHBondContact O-N 3.26Å; G224-Q226 VanDerWaalsContact C-N 3.29Å; G224-Q226 PolarHBondContact O-N 2.85Å
227	L	94.9	Very high	94.6	Very high	14 Å²	14	52 Å²	52	7%	0.073	27%	0.273	C	S	.	.	H	α-helix	trans	-71.5	-35	-177.3	-69	166.9	0	0	0	112.8	F218 R223 G224 I225 R265 T268 I269	F218-L227 HydrophobicContact CE2-CD1 4.42Å; F218-L227 HydrophobicContact CZ-CD1 3.84Å; R223-L227 HydrophobicContact CG-CD1 4.13Å; R223-L227 WeakPolarHBondContact O-CG 3.29Å; R223-L227 PolarHBondContact O-N 3.38Å; R223-L227 VanDerWaalsContact O-N 3.09Å; G224-L227 PolarHBondContact O-N 3.3Å; G224-L227 VanDerWaalsContact O-N 3.09Å; I225-L227 PolarHBondContact O-N 2.96Å; L227-R265 HydrophobicContact CD2-CG 4.03Å; L227-R265 VanDerWaalsContact O-CD 3.29Å; L227-R265 WeakPolarHBondContact O-CD 3.24Å; L227-R265 PolarHBondContact O-NH1 3.49Å; L227-T268 HydrophobicContact CD1-CG2 3.99Å; L227-T268 HydrophobicContact CD2-CG2 3.87Å; L227-I269 HydrophobicContact CB-CD1 4.21Å; L227-I269 HydrophobicContact CB-CG1 3.96Å; L227-I269 HydrophobicContact CD1-CG1 3.91Å; L227-I269 HydrophobicContact CG-CG1 4.35Å
228	F	93.3	Very high	94.7	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.018	26%	0.258	C	S	.	.	H	α-helix	trans	-91.1	-22.3	-178	-74.7	-100.6	0	0	0	113.4	F218 Y219 G224 I225 S230 G231 I269 I350 L371 F373	F218-F228 HydrophobicContact CD1-CE2 4.45Å; F218-F228 AromaticContact CE1-CE2 3.84Å; F218-F228 HydrophobicContact CE1-CE2 3.84Å; Y219-F228 HydrophobicContact CD2-CB 4.48Å; Y219-F228 AromaticContact CD2-CD1 3.86Å; Y219-F228 HydrophobicContact CD2-CD1 3.86Å; Y219-F228 HydrophobicContact CD2-CD2 4.07Å; Y219-F228 HydrophobicContact CD2-CE1 4.04Å; Y219-F228 HydrophobicContact CD2-CE2 4.24Å; Y219-F228 AromaticContact CD2-CG 3.88Å; Y219-F228 HydrophobicContact CD2-CG 3.88Å; Y219-F228 HydrophobicContact CD2-CZ 4.22Å; Y219-F228 HydrophobicContact CE2-CB 3.96Å; Y219-F228 AromaticContact CE2-CD1 3.59Å; Y219-F228 HydrophobicContact CE2-CD1 3.59Å; Y219-F228 HydrophobicContact CE2-CD2 4.37Å; Y219-F228 HydrophobicContact CE2-CE1 4.15Å; Y219-F228 AromaticContact CE2-CG 3.71Å; Y219-F228 HydrophobicContact CE2-CG 3.71Å; G224-F228 VanDerWaalsContact O-CD2 3.28Å; G224-F228 WeakPolarHBondContact O-CD2 3.28Å; G224-F228 PolarHBondContact O-N 3.21Å; I225-F228 PolarHBondContact O-N 3.34Å; F228-S230 VanDerWaalsContact C-N 3.31Å; F228-S230 PolarHBondContact O-N 2.83Å; F228-G231 PolarHBondContact O-N 3.3Å; F228-I269 HydrophobicContact CD2-CD1 4.46Å; F228-I269 HydrophobicContact CE2-CD1 4Å; F228-I269 HydrophobicContact CE2-CG1 4.19Å; F228-I269 HydrophobicContact CE2-CG2 4.47Å; F228-I269 HydrophobicContact CZ-CD1 4.15Å; F228-I269 HydrophobicContact CZ-CG2 4.35Å; F228-I350 HydrophobicContact CE1-CD1 4.36Å; F228-I350 HydrophobicContact CZ-CD1 4.1Å; F228-L371 HydrophobicContact CE1-CB 3.88Å; F228-L371 HydrophobicContact CE1-CD1 4.37Å; F228-L371 HydrophobicContact CZ-CB 4.16Å; F228-L371 HydrophobicContact CZ-CD1 3.78Å; F228-F373 HydrophobicContact CB-CD1 4.29Å; F228-F373 AromaticContact CD1-CD1 3.55Å; F228-F373 HydrophobicContact CD1-CD1 3.55Å; F228-F373 HydrophobicContact CD1-CD2 4.41Å; F228-F373 AromaticContact CD1-CE1 3.47Å; F228-F373 HydrophobicContact CD1-CE1 3.47Å; F228-F373 VanDerWaalsContact CD1-CE1 3.47Å; F228-F373 HydrophobicContact CD1-CE2 4.36Å; F228-F373 HydrophobicContact CD1-CG 4.04Å; F228-F373 AromaticContact CD1-CZ 3.89Å; F228-F373 HydrophobicContact CD1-CZ 3.89Å; F228-F373 HydrophobicContact CE1-CD1 4.21Å; F228-F373 HydrophobicContact CE1-CD2 4.47Å; F228-F373 AromaticContact CE1-CE1 3.78Å; F228-F373 HydrophobicContact CE1-CE1 3.78Å; F228-F373 HydrophobicContact CE1-CE2 4.07Å; F228-F373 AromaticContact CE1-CZ 3.69Å; F228-F373 HydrophobicContact CE1-CZ 3.69Å; F228-F373 HydrophobicContact CG-CD1 4.15Å; F228-F373 HydrophobicContact CG-CE1 4Å; F228-F373 HydrophobicContact CZ-CZ 4.37Å
229	A	88.9	Confident	94.8	Very high	67 Å²	67	51.7 Å²	51.7	55%	0.554	27%	0.265	S	S	*	.	H	α-helix	trans	-67.9	-23.7	-177.4	0	0	0	0	0	114.5	I225 G231	I225-A229 WeakPolarHBondContact O-CB 3.43Å; I225-A229 PolarHBondContact O-N 3.22Å; A229-G231 PolarHBondContact O-N 3.05Å
230	S	88.5	Confident	95	Very high	87 Å²	87	51 Å²	51	61%	0.608	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	7.5	177.3	-40.3	0	0	0	0	113.6	F228	F228-S230 VanDerWaalsContact C-N 3.31Å; F228-S230 PolarHBondContact O-N 2.83Å
231	G	91.8	Very high	95.1	Very high	9 Å²	9	47.6 Å²	47.6	9%	0.093	25%	0.25	C	C	.	.			trans	84	-169.2	176	0	0	0	0	0	113.4	F228 A229 R265 F373	F228-G231 PolarHBondContact O-N 3.3Å; A229-G231 PolarHBondContact O-N 3.05Å; G231-R265 PolarHBondContact O-NH1 3.21Å; G231-R265 PolarHBondContact O-NH2 3.49Å; G231-F373 VanDerWaalsContact O-CD1 3.22Å; G231-F373 WeakPolarHBondContact O-CD1 3.44Å
232	P	95.6	Very high	95.1	Very high	20 Å²	20	48.6 Å²	48.6	13%	0.13	25%	0.248	C	C	.	.	S	Bend	trans	-54.3	151.8	-179.3	-24.2	34.2	0	0	0	112.4	K234 R265 F347 H348 F373 T375	P232-K234 PolarHBondContact O-N 3.49Å; P232-R265 PolarHBondContact O-NH2 2.93Å; P232-R265 VanDerWaalsContact O-NH2 3.08Å; P232-F347 WeakPolarHBondContact CA-O 2.99Å; P232-F347 WeakPolarHBondContact CB-O 3.39Å; P232-H348 WeakPolarHBondContact CG-CE1 3.43Å; P232-H348 VanDerWaalsContact CG-ND1 3.28Å; P232-H348 WeakPolarHBondContact CG-ND1 3.49Å; P232-F373 HydrophobicContact CG-CB 4.49Å; P232-T375 HydrophobicContact CG-CG2 3.56Å
233	L	96.9	Very high	94.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	115.5	176.3	-64.7	166.9	0	0	0	109	L150 L235 D262 R265 L266 S346 F347 F373	L150-L233 HydrophobicContact CD1-CD1 4.32Å; L233-L235 HydrophobicContact CB-CD1 4.07Å; L233-L235 HydrophobicContact CB-CD2 4.17Å; L233-L235 HydrophobicContact CB-CG 3.92Å; L233-D262 HydrophobicContact CD2-CB 4.21Å; L233-D262 WeakPolarHBondContact CD2-O 3.35Å; L233-R265 HydrophobicContact CD2-CB 4.21Å; L233-R265 HydrophobicContact CD2-CG 4.24Å; L233-L266 HydrophobicContact CD1-CB 4.02Å; L233-L266 HydrophobicContact CD1-CD1 3.79Å; L233-L266 HydrophobicContact CD1-CG 4.31Å; L233-L266 HydrophobicContact CD2-CB 4.34Å; L233-S346 CarbonylContact O-C 3.6Å; L233-S346 WeakPolarHBondContact O-CA 3.04Å; L233-F347 HydrophobicContact CB-CB 4.48Å; L233-F347 PolarHBondContact N-O 2.98Å; L233-F347 PolarHBondContact O-N 3.41Å; L233-F373 HydrophobicContact CD1-CE1 4.33Å; L233-F373 HydrophobicContact CD1-CE2 3.76Å; L233-F373 HydrophobicContact CD1-CZ 3.48Å; L233-F373 VanDerWaalsContact CD1-CZ 3.48Å; L233-F373 HydrophobicContact CD2-CE1 4.28Å; L233-F373 HydrophobicContact CD2-CZ 4.21Å; L233-F373 HydrophobicContact CG-CE1 3.97Å; L233-F373 HydrophobicContact CG-CE2 3.97Å; L233-F373 HydrophobicContact CG-CZ 3.58Å
234	K	97.2	Very high	94	Very high	118 Å²	118	43.6 Å²	43.6	51%	0.513	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	103.8	172.2	-66	-178.4	-179.5	179.5	0	109.2	P232 D262 Q345	P232-K234 PolarHBondContact O-N 3.49Å; K234-D262 WeakPolarHBondContact CB-OD2 3.38Å; K234-D262 PolarHBondContact N-OD2 2.99Å; K234-D262 WeakPolarHBondContact O-CB 3.35Å; K234-Q345 WeakPolarHBondContact CA-O 3.47Å
235	L	98.4	Very high	93.5	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	143.5	-171.5	-55.7	177.2	0	0	0	111.4	L150 L233 L257 D262 L266 N344 Q345 F347	L150-L235 HydrophobicContact CD2-CD1 3.45Å; L150-L235 VanDerWaalsContact CD2-CD1 3.45Å; L233-L235 HydrophobicContact CB-CD1 4.07Å; L233-L235 HydrophobicContact CB-CD2 4.17Å; L233-L235 HydrophobicContact CB-CG 3.92Å; L235-L257 HydrophobicContact CB-CD1 3.83Å; L235-L257 HydrophobicContact CD1-CD1 4.05Å; L235-L257 HydrophobicContact CD2-CD1 4.17Å; L235-L257 HydrophobicContact CG-CD1 4.23Å; L235-D262 HydrophobicContact CD2-CB 3.83Å; L235-L266 HydrophobicContact CD1-CD2 3.82Å; L235-N344 PolarHBondContact O-N 2.78Å; L235-Q345 PolarHBondContact N-O 3.46Å; L235-Q345 PolarHBondContact O-N 3.42Å; L235-F347 HydrophobicContact CB-CD2 3.92Å; L235-F347 HydrophobicContact CB-CE2 3.84Å; L235-F347 HydrophobicContact CD1-CD2 3.88Å; L235-F347 HydrophobicContact CD1-CE2 4.35Å; L235-F347 HydrophobicContact CG-CD2 4.02Å; L235-F347 HydrophobicContact CG-CE2 4.44Å
236	T	98.6	Very high	93.5	Very high	20 Å²	20	50.7 Å²	50.7	12%	0.123	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127.2	172.1	-67	0	0	0	0	108.7	K238 M258 Y340 T342 N344	T236-K238 HydrophobicContact CG2-CB 4.38Å; T236-M258 HydrophobicContact CG2-CB 4.04Å; T236-M258 HydrophobicContact CG2-CG 3.74Å; T236-M258 PolarHBondContact O-N 3.49Å; T236-Y340 HydrophobicContact CG2-CE2 4.28Å; T236-Y340 VanDerWaalsContact CG2-OH 3.23Å; T236-Y340 WeakPolarHBondContact CG2-OH 3.27Å; T236-T342 WeakPolarHBondContact CA-O 3.28Å; T236-N344 PolarHBondContact OG1-N 3.18Å
237	I	98.6	Very high	93.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	112.9	179.9	-51	170.7	0	0	0	107.2	V152 V157 F195 A255 K256 M298 F341 T342 F347	V152-I237 HydrophobicContact CG1-CD1 3.98Å; V152-I237 HydrophobicContact CG2-CD1 4.39Å; V157-I237 HydrophobicContact CG2-CD1 4.45Å; F195-I237 HydrophobicContact CE2-CD1 3.66Å; F195-I237 HydrophobicContact CE2-CG1 4.09Å; F195-I237 HydrophobicContact CZ-CD1 4.03Å; F195-I237 HydrophobicContact CZ-CG1 4Å; F195-I237 HydrophobicContact CZ-CG2 4.3Å; I237-A255 HydrophobicContact CG2-CB 3.66Å; I237-K256 WeakPolarHBondContact CA-O 3.49Å; I237-M298 HydrophobicContact CD1-SD 4.36Å; I237-M298 HydrophobicContact CG2-CE 3.83Å; I237-F341 HydrophobicContact CB-CB 4.13Å; I237-F341 HydrophobicContact CG2-CB 4.03Å; I237-F341 HydrophobicContact CG2-CD2 4.12Å; I237-F341 HydrophobicContact CG2-CG 4.37Å; I237-F341 WeakPolarHBondContact O-CB 3.44Å; I237-F341 PolarHBondContact O-N 2.99Å; I237-T342 HydrophobicContact CB-CG2 4.07Å; I237-T342 HydrophobicContact CD1-CG2 3.85Å; I237-T342 HydrophobicContact CG1-CG2 3.86Å; I237-T342 PolarHBondContact N-O 2.95Å; I237-T342 PolarHBondContact O-N 3Å; I237-F347 HydrophobicContact CD1-CZ 4.07Å
238	K	98.1	Very high	93.5	Very high	61 Å²	61	51 Å²	51	27%	0.265	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	159.8	-171.4	-166.9	-158.9	171.6	-171.5	0	109.3	T236 K256 M258 F339 Y340	T236-K238 HydrophobicContact CG2-CB 4.38Å; K238-K256 PolarHBondContact N-O 3.43Å; K238-K256 VanDerWaalsContact N-O 3.15Å; K238-K256 VanDerWaalsContact O-CB 3.32Å; K238-K256 WeakPolarHBondContact O-CB 3.3Å; K238-K256 PolarHBondContact O-N 2.99Å; K238-K256 VanDerWaalsContact O-O 3.14Å; K238-M258 HydrophobicContact CB-CG 3.75Å; K238-M258 HydrophobicContact CB-SD 3.93Å; K238-F339 WeakPolarHBondContact CA-O 3.1Å; K238-Y340 HydrophobicContact CB-CD2 4.2Å; K238-Y340 HydrophobicContact CB-CE2 4.36Å; K238-Y340 HydrophobicContact CD-CD2 3.6Å; K238-Y340 HydrophobicContact CD-CE2 3.79Å; K238-Y340 HydrophobicContact CG-CD2 3.5Å; K238-Y340 HydrophobicContact CG-CE2 4Å; K238-Y340 HydrophobicContact CG-CG 4.13Å
239	D	98	Very high	93.5	Very high	36 Å²	36	53 Å²	53	19%	0.193	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	66.4	152.8	175.3	-55.6	-23.8	0	0	0	112.1	A255 K256 G337 N338 F339	D239-A255 WeakPolarHBondContact O-CA 3.28Å; D239-K256 HydrophobicContact CB-CD 3.99Å; D239-K256 PolarHBondContact O-N 2.93Å; D239-G337 CarbonylContact C-O 3.53Å; D239-G337 VanDerWaalsContact CA-O 3.29Å; D239-G337 WeakPolarHBondContact CA-O 3.27Å; D239-N338 VanDerWaalsContact OD1-CA 3.23Å; D239-N338 WeakPolarHBondContact OD1-CA 3.45Å; D239-F339 PolarHBondContact N-O 3.4Å
240	L	98.1	Very high	93.8	Very high	15 Å²	15	49.9 Å²	49.9	8%	0.079	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	144.9	-177.8	-54.9	-174.5	0	0	0	110.8	F164 L253 Y254 L300 I332 L333 A336 G337 F341	F164-L240 HydrophobicContact CE2-CD1 3.76Å; F164-L240 HydrophobicContact CZ-CD1 3.95Å; L240-L253 HydrophobicContact CB-CD1 4.24Å; L240-L253 HydrophobicContact CD1-CD2 4.35Å; L240-Y254 WeakPolarHBondContact CA-O 3.1Å; L240-L300 HydrophobicContact CD2-CD1 3.45Å; L240-L300 VanDerWaalsContact CD2-CD1 3.45Å; L240-I332 HydrophobicContact CD1-CG2 3.75Å; L240-L333 HydrophobicContact CB-CD2 3.87Å; L240-A336 HydrophobicContact CD1-CB 4.42Å; L240-A336 WeakPolarHBondContact CD1-O 3.36Å; L240-A336 WeakPolarHBondContact CG-O 3.31Å; L240-G337 PolarHBondContact N-O 3.21Å; L240-F341 HydrophobicContact CD2-CE2 3.84Å; L240-F341 HydrophobicContact CD2-CZ 4.14Å
241	E	96.1	Very high	94.1	Very high	78 Å²	78	47.8 Å²	47.8	36%	0.364	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	164.7	174.1	-167.5	178.7	-142.2	0	0	109.6	L253 Y254 K256	E241-L253 WeakPolarHBondContact O-CD1 3.35Å; E241-Y254 HydrophobicContact CB-CD2 4.26Å; E241-Y254 HydrophobicContact CB-CE1 4.42Å; E241-Y254 HydrophobicContact CB-CE2 3.58Å; E241-Y254 HydrophobicContact CG-CE2 4.12Å; E241-Y254 VanDerWaalsContact CG-OH 3.25Å; E241-Y254 WeakPolarHBondContact CG-OH 3.49Å; E241-Y254 PolarHBondContact N-O 3.47Å; E241-Y254 WeakPolarHBondContact O-CD1 3.38Å; E241-Y254 PolarHBondContact O-N 2.7Å; E241-Y254 VanDerWaalsContact O-O 3.13Å; E241-Y254 WeakPolarHBondContact OE2-CE2 3.22Å; E241-Y254 PolarHBondContact OE2-OH 3.36Å; E241-K256 HydrophobicContact CB-CD 3.99Å; E241-K256 HydrophobicContact CB-CG 3.83Å
242	Y	94.7	Very high	94.3	Very high	61 Å²	61	48.3 Å²	48.3	24%	0.239	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	161.2	-174.8	52.9	-75.4	0	0	0	110.1	N244 P247 V250 V252 V329 L333	Y242-N244 WeakPolarHBondContact CD2-O 3.22Å; Y242-N244 WeakPolarHBondContact CE2-O 3.36Å; Y242-P247 HydrophobicContact CE2-CB 4.23Å; Y242-V250 HydrophobicContact CD2-CG2 3.53Å; Y242-V250 HydrophobicContact CE2-CG2 4.19Å; Y242-V250 HydrophobicContact CG-CG1 4.5Å; Y242-V250 HydrophobicContact CG-CG2 4.01Å; Y242-V252 WeakPolarHBondContact CA-O 3.28Å; Y242-V252 WeakPolarHBondContact CB-O 3.24Å; Y242-V329 HydrophobicContact CD1-CG2 4.24Å; Y242-V329 HydrophobicContact CG-CG2 4.38Å; Y242-L333 HydrophobicContact CD1-CD1 4.25Å; Y242-L333 HydrophobicContact CE1-CD1 3.78Å
243	M	84	Confident	94.4	Very high	68 Å²	68	47.3 Å²	47.3	34%	0.335	25%	0.245	S	C	.	.	S	Bend	trans	-84.6	-18.7	-168.6	-72.5	-70.1	-176.5	0	0	115.1	V252 Y254 K295 H297	M243-V252 HydrophobicContact CG-CB 4.04Å; M243-V252 HydrophobicContact CG-CG1 4.27Å; M243-Y254 HydrophobicContact CE-CD1 4Å; M243-Y254 HydrophobicContact CE-CE1 3.77Å; M243-Y254 HydrophobicContact CG-CD1 4.19Å; M243-Y254 HydrophobicContact CG-CE1 3.85Å; M243-Y254 HydrophobicContact SD-CD1 4.48Å; M243-Y254 HydrophobicContact SD-CE1 3.81Å; M243-K295 HydrophobicContact CE-CD 3.94Å; M243-K295 HydrophobicContact CE-CG 4.47Å; M243-K295 HydrophobicContact SD-CD 3.79Å; M243-K295 VanDerWaalsContact SD-CE 3.59Å; M243-K295 PolarHBondContact SD-NZ 3.4Å; M243-H297 VanDerWaalsContact CE-CE1 3.46Å; M243-H297 WeakPolarHBondContact CE-CE1 3.3Å; M243-H297 WeakPolarHBondContact CE-NE2 3.27Å
244	N	82.3	Confident	94.5	Very high	73 Å²	73	47.5 Å²	47.5	39%	0.39	25%	0.246	S	C	.	.	S	Bend	trans	-116.2	171.4	-175.6	-59.9	-12.4	0	0	0	110	Y242	Y242-N244 WeakPolarHBondContact CD2-O 3.22Å; Y242-N244 WeakPolarHBondContact CE2-O 3.36Å
245	D	84.7	Confident	94.5	Very high	162 Å²	162	41.9 Å²	41.9	87%	0.866	22%	0.221	S	C	*	.	S	Bend	trans	-86.8	-17	-174.7	-59.7	-41.8	0	0	0	115	P247	D245-P247 WeakPolarHBondContact O-CD 3.33Å
246	D	92.7	Very high	94.5	Very high	72 Å²	72	45.3 Å²	45.3	39%	0.385	24%	0.236	S	C	.	.			trans	-100.8	109.4	-177.5	177.3	10.5	0	0	0	111.7	T248 S249 V250	D246-T248 VanDerWaalsContact CG-OG1 3.23Å; D246-T248 PolarHBondContact O-N 2.98Å; D246-T248 WeakPolarHBondContact OD1-CB 3.16Å; D246-T248 PolarHBondContact OD1-N 3.45Å; D246-T248 PolarHBondContact OD1-OG1 3.46Å; D246-T248 PolarHBondContact OD2-OG1 2.96Å; D246-S249 CarbonylContact O-C 3.52Å; D246-S249 PolarHBondContact O-N 2.88Å; D246-S249 WeakPolarHBondContact OD2-CB 3.27Å; D246-V250 WeakPolarHBondContact O-CG2 3.28Å
247	P	93.6	Very high	94.5	Very high	38 Å²	38	45.6 Å²	45.6	25%	0.247	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-15.1	178.8	28.6	-35.2	0	0	0	113.5	Y242 D245 S328 V329 L333	Y242-P247 HydrophobicContact CE2-CB 4.23Å; D245-P247 WeakPolarHBondContact O-CD 3.33Å; P247-S328 WeakPolarHBondContact O-CA 3.45Å; P247-V329 HydrophobicContact CB-CG2 3.92Å; P247-V329 WeakPolarHBondContact O-CG2 3.48Å; P247-V329 PolarHBondContact O-N 3.43Å; P247-L333 HydrophobicContact CB-CD1 4.46Å
248	T	93.7	Very high	94.4	Very high	83 Å²	83	48.1 Å²	48.1	51%	0.509	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-20.5	176.7	72.8	0	0	0	0	112.9	D246	D246-T248 VanDerWaalsContact CG-OG1 3.23Å; D246-T248 PolarHBondContact O-N 2.98Å; D246-T248 WeakPolarHBondContact OD1-CB 3.16Å; D246-T248 PolarHBondContact OD1-N 3.45Å; D246-T248 PolarHBondContact OD1-OG1 3.46Å; D246-T248 PolarHBondContact OD2-OG1 2.96Å
249	S	93.5	Very high	94.4	Very high	46 Å²	46	51.8 Å²	51.8	32%	0.322	27%	0.268	S	S	.	.	S	Bend	trans	-132.2	71.2	-179.1	-171.7	0	0	0	0	111.5	D246 S326	D246-S249 CarbonylContact O-C 3.52Å; D246-S249 PolarHBondContact O-N 2.88Å; D246-S249 WeakPolarHBondContact OD2-CB 3.27Å; S249-S326 VanDerWaalsContact OG-CB 3.3Å; S249-S326 WeakPolarHBondContact OG-CB 3.43Å; S249-S326 PolarHBondContact OG-OG 3.39Å
250	V	94.7	Very high	94.4	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-100.6	147.2	-179.3	175.6	0	0	0	0	111.5	Y242 D246 V252 S326 F327 V329	Y242-V250 HydrophobicContact CD2-CG2 3.53Å; Y242-V250 HydrophobicContact CE2-CG2 4.19Å; Y242-V250 HydrophobicContact CG-CG1 4.5Å; Y242-V250 HydrophobicContact CG-CG2 4.01Å; D246-V250 WeakPolarHBondContact O-CG2 3.28Å; V250-V252 WeakPolarHBondContact CG1-O 3.16Å; V250-S326 CarbonylContact O-C 3.45Å; V250-S326 WeakPolarHBondContact O-CA 3.23Å; V250-S326 WeakPolarHBondContact O-CB 3.36Å; V250-F327 HydrophobicContact CB-CE2 4.4Å; V250-F327 WeakPolarHBondContact CB-O 3.31Å; V250-F327 HydrophobicContact CG1-CE2 4.13Å; V250-F327 HydrophobicContact CG1-CZ 4.11Å; V250-F327 PolarHBondContact N-O 3.26Å; V250-F327 VanDerWaalsContact O-CD1 3.32Å; V250-F327 WeakPolarHBondContact O-CD1 3.33Å; V250-F327 PolarHBondContact O-N 3.02Å; V250-V329 HydrophobicContact CB-CG1 3.88Å; V250-V329 HydrophobicContact CB-CG2 4.39Å; V250-V329 HydrophobicContact CG1-CG1 3.96Å; V250-V329 HydrophobicContact CG2-CG1 4.11Å; V250-V329 HydrophobicContact CG2-CG2 3.68Å
251	H	94.7	Very high	94.4	Very high	43 Å²	43	55.3 Å²	55.3	20%	0.199	30%	0.296	C	S	.	.	S	Bend	trans	-109.3	-27.2	176	-85.9	-45.8	0	0	0	114	N302 S303 R324 F327	H251-N302 WeakPolarHBondContact O-CA 3.33Å; H251-N302 PolarHBondContact O-OD1 3.39Å; H251-S303 WeakPolarHBondContact CA-OG 3.25Å; H251-S303 PolarHBondContact ND1-OG 3.47Å; H251-S303 PolarHBondContact O-N 3.45Å; H251-S303 PolarHBondContact O-OG 3.37Å; H251-R324 WeakPolarHBondContact ND1-CD 3.44Å; H251-R324 PolarHBondContact ND1-NE 3.13Å; H251-R324 PolarHBondContact O-NH2 3.02Å; H251-F327 WeakPolarHBondContact O-CE1 3.35Å
252	V	95.9	Very high	94.4	Very high	20 Å²	20	52.6 Å²	52.6	12%	0.121	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	124.6	-179.1	-177.3	0	0	0	0	109	Y242 M243 V250 Y254 T299 L301	Y242-V252 WeakPolarHBondContact CA-O 3.28Å; Y242-V252 WeakPolarHBondContact CB-O 3.24Å; M243-V252 HydrophobicContact CG-CB 4.04Å; M243-V252 HydrophobicContact CG-CG1 4.27Å; V250-V252 WeakPolarHBondContact CG1-O 3.16Å; V252-Y254 HydrophobicContact CG1-CD1 4.39Å; V252-T299 HydrophobicContact CG1-CG2 4.05Å; V252-L301 WeakPolarHBondContact CA-O 3.46Å
253	L	97.7	Very high	94.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	134.6	167.7	-178.1	72.9	0	0	0	108.2	L240 E241 L300 L301 F327 V329 I332	L240-L253 HydrophobicContact CB-CD1 4.24Å; L240-L253 HydrophobicContact CD1-CD2 4.35Å; E241-L253 WeakPolarHBondContact O-CD1 3.35Å; L253-L300 PolarHBondContact O-N 2.89Å; L253-L301 HydrophobicContact CB-CB 4.2Å; L253-L301 HydrophobicContact CD2-CD1 4.23Å; L253-L301 HydrophobicContact CD2-CD2 4.44Å; L253-L301 PolarHBondContact N-O 3.31Å; L253-L301 PolarHBondContact O-N 3.18Å; L253-L301 VanDerWaalsContact O-N 3.07Å; L253-F327 HydrophobicContact CB-CE2 4.18Å; L253-F327 HydrophobicContact CB-CZ 4.36Å; L253-V329 HydrophobicContact CB-CG1 4.16Å; L253-V329 HydrophobicContact CD1-CB 4.23Å; L253-V329 HydrophobicContact CD1-CG1 3.99Å; L253-V329 HydrophobicContact CD2-CG1 4.14Å; L253-V329 HydrophobicContact CG-CG1 4.34Å; L253-I332 HydrophobicContact CD2-CB 4.42Å; L253-I332 HydrophobicContact CD2-CD1 3.96Å; L253-I332 HydrophobicContact CD2-CG2 3.78Å
254	Y	98.2	Very high	95.2	Very high	3 Å²	3	51.6 Å²	51.6	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	158.1	-175.3	62.1	-98.5	0	0	0	112.1	L240 E241 M243 V252 K256 K295 H297 M298	L240-Y254 WeakPolarHBondContact CA-O 3.1Å; E241-Y254 HydrophobicContact CB-CD2 4.26Å; E241-Y254 HydrophobicContact CB-CE1 4.42Å; E241-Y254 HydrophobicContact CB-CE2 3.58Å; E241-Y254 HydrophobicContact CG-CE2 4.12Å; E241-Y254 VanDerWaalsContact CG-OH 3.25Å; E241-Y254 WeakPolarHBondContact CG-OH 3.49Å; E241-Y254 PolarHBondContact N-O 3.47Å; E241-Y254 WeakPolarHBondContact O-CD1 3.38Å; E241-Y254 PolarHBondContact O-N 2.7Å; E241-Y254 VanDerWaalsContact O-O 3.13Å; E241-Y254 WeakPolarHBondContact OE2-CE2 3.22Å; E241-Y254 PolarHBondContact OE2-OH 3.36Å; M243-Y254 HydrophobicContact CE-CD1 4Å; M243-Y254 HydrophobicContact CE-CE1 3.77Å; M243-Y254 HydrophobicContact CG-CD1 4.19Å; M243-Y254 HydrophobicContact CG-CE1 3.85Å; M243-Y254 HydrophobicContact SD-CD1 4.48Å; M243-Y254 HydrophobicContact SD-CE1 3.81Å; V252-Y254 HydrophobicContact CG1-CD1 4.39Å; Y254-K256 HydrophobicContact CE2-CG 4.48Å; Y254-K295 WeakPolarHBondContact OH-CE 3.29Å; Y254-K295 PolarHBondContact OH-NZ 2.98Å; Y254-H297 HydrophobicContact CD1-CB 4.31Å; Y254-H297 HydrophobicContact CD2-CB 3.39Å; Y254-H297 HydrophobicContact CE2-CB 3.84Å; Y254-H297 HydrophobicContact CG-CB 3.65Å; Y254-M298 CarbonylContact C-O 3.43Å; Y254-M298 VanDerWaalsContact CA-O 3.23Å; Y254-M298 WeakPolarHBondContact CA-O 3.32Å; Y254-M298 VanDerWaalsContact CB-O 3.26Å; Y254-M298 WeakPolarHBondContact CB-O 3.39Å
255	A	98.3	Very high	95.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	141.8	170.5	0	0	0	0	0	110.4	I237 D239 M298 L300 F341	I237-A255 HydrophobicContact CG2-CB 3.66Å; D239-A255 WeakPolarHBondContact O-CA 3.28Å; A255-M298 HydrophobicContact CB-CB 4.47Å; A255-M298 HydrophobicContact CB-CE 3.94Å; A255-M298 PolarHBondContact N-O 3.34Å; A255-M298 PolarHBondContact O-N 3.39Å; A255-L300 HydrophobicContact CB-CD1 4.11Å; A255-L300 HydrophobicContact CB-CD2 4.24Å; A255-L300 HydrophobicContact CB-CG 4.29Å; A255-F341 HydrophobicContact CB-CD2 3.69Å; A255-F341 HydrophobicContact CB-CE2 3.53Å; A255-F341 HydrophobicContact CB-CZ 4.37Å
256	K	98	Very high	96.6	Very high	72 Å²	72	41.4 Å²	41.4	31%	0.313	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	148.3	179.1	-54.7	173.5	65.7	178.4	0	111.2	I237 K238 D239 E241 Y254	I237-K256 WeakPolarHBondContact CA-O 3.49Å; K238-K256 PolarHBondContact N-O 3.43Å; K238-K256 VanDerWaalsContact N-O 3.15Å; K238-K256 VanDerWaalsContact O-CB 3.32Å; K238-K256 WeakPolarHBondContact O-CB 3.3Å; K238-K256 PolarHBondContact O-N 2.99Å; K238-K256 VanDerWaalsContact O-O 3.14Å; D239-K256 HydrophobicContact CB-CD 3.99Å; D239-K256 PolarHBondContact O-N 2.93Å; E241-K256 HydrophobicContact CB-CD 3.99Å; E241-K256 HydrophobicContact CB-CG 3.83Å; Y254-K256 HydrophobicContact CE2-CG 4.48Å
257	L	98.1	Very high	96.8	Very high	26 Å²	26	40 Å²	40	14%	0.136	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	120	163.9	-176.5	63.2	0	0	0	107.8	F195 L235 L266 L296	F195-L257 HydrophobicContact CE1-CB 3.9Å; F195-L257 HydrophobicContact CZ-CB 4.24Å; F195-L257 HydrophobicContact CZ-CD1 4.23Å; L235-L257 HydrophobicContact CB-CD1 3.83Å; L235-L257 HydrophobicContact CD1-CD1 4.05Å; L235-L257 HydrophobicContact CD2-CD1 4.17Å; L235-L257 HydrophobicContact CG-CD1 4.23Å; L257-L266 HydrophobicContact CD2-CD2 3.93Å; L257-L296 HydrophobicContact CD2-CB 4.35Å; L257-L296 HydrophobicContact CD2-CD1 3.87Å
258	M	98	Very high	97	Very high	53 Å²	53	40 Å²	40	26%	0.261	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-76.8	146.9	-179.1	-57.6	-53	-68.8	0	0	111	T236 K238 S260 S263	T236-M258 HydrophobicContact CG2-CB 4.04Å; T236-M258 HydrophobicContact CG2-CG 3.74Å; T236-M258 PolarHBondContact O-N 3.49Å; K238-M258 HydrophobicContact CB-CG 3.75Å; K238-M258 HydrophobicContact CB-SD 3.93Å; M258-S260 PolarHBondContact O-N 2.71Å; M258-S263 WeakPolarHBondContact O-CB 3.38Å; M258-S263 PolarHBondContact O-OG 3.09Å
259	E	97.9	Very high	97.2	Very high	139 Å²	139	36 Å²	36	65%	0.65	19%	0.191	S	C	*	.	P	Polyproline II helix	trans	-68.9	128.9	-175.5	-170.7	63.5	-174.9	0	0	112.3	S263 Q264	E259-S263 WeakPolarHBondContact CA-OG 3.4Å; E259-S263 PolarHBondContact OE2-OG 2.78Å; E259-Q264 VanDerWaalsContact OE1-CD 3.31Å; E259-Q264 WeakPolarHBondContact OE1-CG 3.43Å; E259-Q264 PolarHBondContact OE1-NE2 2.88Å
260	S	97.7	Very high	97.4	Very high	35 Å²	35	33.9 Å²	33.9	25%	0.245	18%	0.176	C	C	.	.	S	Bend	trans	-158.8	171.2	175.9	77.1	0	0	0	0	110.2	M258 D262 S263 Q264	M258-S260 PolarHBondContact O-N 2.71Å; S260-D262 PolarHBondContact O-N 2.85Å; S260-D262 PolarHBondContact OG-N 3.36Å; S260-S263 PolarHBondContact N-OG 3.4Å; S260-S263 PolarHBondContact O-N 3.21Å; S260-S263 PolarHBondContact O-OG 2.93Å; S260-S263 PolarHBondContact OG-N 3.12Å; S260-S263 VanDerWaalsContact OG-N 3.07Å; S260-Q264 WeakPolarHBondContact O-CG 3.3Å; S260-Q264 PolarHBondContact O-N 3.11Å; S260-Q264 VanDerWaalsContact O-N 3.12Å
261	S	97.1	Very high	97.4	Very high	90 Å²	90	35 Å²	35	63%	0.629	18%	0.182	S	C	*	.	H	α-helix	trans	-56.6	-33.6	172	57	0	0	0	0	112.5	R265	S261-R265 WeakPolarHBondContact O-CB 3.29Å; S261-R265 PolarHBondContact O-N 3.13Å
262	D	97.7	Very high	97.5	Very high	20 Å²	20	35.8 Å²	35.8	11%	0.107	19%	0.186	C	C	.	.	H	α-helix	trans	-82.1	-30.4	-179.6	-79.2	-15.2	0	0	0	113	L233 K234 L235 S260 Q264 R265 L266	L233-D262 HydrophobicContact CD2-CB 4.21Å; L233-D262 WeakPolarHBondContact CD2-O 3.35Å; K234-D262 WeakPolarHBondContact CB-OD2 3.38Å; K234-D262 PolarHBondContact N-OD2 2.99Å; K234-D262 WeakPolarHBondContact O-CB 3.35Å; L235-D262 HydrophobicContact CD2-CB 3.83Å; S260-D262 PolarHBondContact O-N 2.85Å; S260-D262 PolarHBondContact OG-N 3.36Å; D262-Q264 VanDerWaalsContact C-N 3.35Å; D262-R265 VanDerWaalsContact CG-NH2 3.3Å; D262-R265 PolarHBondContact O-N 3.49Å; D262-R265 IonicContact OD1-CZ 3.81Å; D262-R265 IonicContact OD1-NE 2.74Å; D262-R265 PolarHBondContact OD1-NE 3.38Å; D262-R265 IonicContact OD1-NH2 2.73Å; D262-R265 PolarHBondContact OD1-NH2 3.03Å; D262-R265 IonicContact OD2-NH2 3.47Å; D262-R265 PolarHBondContact OD2-NH2 3.41Å; D262-L266 WeakPolarHBondContact O-CB 3.18Å; D262-L266 PolarHBondContact O-N 3.47Å
263	S	97.9	Very high	97.5	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-64.7	-41.6	170.1	72.5	0	0	0	0	110.8	M258 E259 S260 R265 L266 Q267	M258-S263 WeakPolarHBondContact O-CB 3.38Å; M258-S263 PolarHBondContact O-OG 3.09Å; E259-S263 WeakPolarHBondContact CA-OG 3.4Å; E259-S263 PolarHBondContact OE2-OG 2.78Å; S260-S263 PolarHBondContact N-OG 3.4Å; S260-S263 PolarHBondContact O-N 3.21Å; S260-S263 PolarHBondContact O-OG 2.93Å; S260-S263 PolarHBondContact OG-N 3.12Å; S260-S263 VanDerWaalsContact OG-N 3.07Å; S263-R265 VanDerWaalsContact C-N 3.34Å; S263-R265 PolarHBondContact O-N 3.32Å; S263-L266 PolarHBondContact O-N 3.2Å; S263-Q267 WeakPolarHBondContact O-CB 3.29Å; S263-Q267 PolarHBondContact O-N 3.17Å
264	Q	97.6	Very high	97.4	Very high	106 Å²	106	35.2 Å²	35.2	50%	0.495	18%	0.182	S	C	.	.	H	α-helix	trans	-64.1	-38.7	174.7	-67.7	177.7	1.7	0	0	112.2	E259 S260 D262 Q267 T268	E259-Q264 VanDerWaalsContact OE1-CD 3.31Å; E259-Q264 WeakPolarHBondContact OE1-CG 3.43Å; E259-Q264 PolarHBondContact OE1-NE2 2.88Å; S260-Q264 WeakPolarHBondContact O-CG 3.3Å; S260-Q264 PolarHBondContact O-N 3.11Å; S260-Q264 VanDerWaalsContact O-N 3.12Å; D262-Q264 VanDerWaalsContact C-N 3.35Å; Q264-Q267 WeakPolarHBondContact O-CB 3.5Å; Q264-Q267 PolarHBondContact O-N 3.12Å; Q264-T268 PolarHBondContact O-N 2.94Å; Q264-T268 PolarHBondContact O-OG1 2.99Å
265	R	97.2	Very high	97.2	Very high	21 Å²	21	37.9 Å²	37.9	8%	0.079	20%	0.196	C	C	.	.	H	α-helix	trans	-63.3	-45.3	175	-170.5	160.4	63.6	118.9	-7.1	111.3	L227 G231 P232 L233 S261 D262 S263 T268 I269	L227-R265 HydrophobicContact CD2-CG 4.03Å; L227-R265 VanDerWaalsContact O-CD 3.29Å; L227-R265 WeakPolarHBondContact O-CD 3.24Å; L227-R265 PolarHBondContact O-NH1 3.49Å; G231-R265 PolarHBondContact O-NH1 3.21Å; G231-R265 PolarHBondContact O-NH2 3.49Å; P232-R265 PolarHBondContact O-NH2 2.93Å; P232-R265 VanDerWaalsContact O-NH2 3.08Å; L233-R265 HydrophobicContact CD2-CB 4.21Å; L233-R265 HydrophobicContact CD2-CG 4.24Å; S261-R265 WeakPolarHBondContact O-CB 3.29Å; S261-R265 PolarHBondContact O-N 3.13Å; D262-R265 VanDerWaalsContact CG-NH2 3.3Å; D262-R265 PolarHBondContact O-N 3.49Å; D262-R265 IonicContact OD1-CZ 3.81Å; D262-R265 IonicContact OD1-NE 2.74Å; D262-R265 PolarHBondContact OD1-NE 3.38Å; D262-R265 IonicContact OD1-NH2 2.73Å; D262-R265 PolarHBondContact OD1-NH2 3.03Å; D262-R265 IonicContact OD2-NH2 3.47Å; D262-R265 PolarHBondContact OD2-NH2 3.41Å; S263-R265 VanDerWaalsContact C-N 3.34Å; S263-R265 PolarHBondContact O-N 3.32Å; R265-T268 PolarHBondContact O-N 3.46Å; R265-I269 HydrophobicContact CG-CD1 4.49Å; R265-I269 WeakPolarHBondContact O-CG1 3.41Å; R265-I269 PolarHBondContact O-N 3.29Å
266	L	98.1	Very high	97.1	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.4	-43.5	173.5	178.5	61.5	0	0	0	112	L150 L197 L233 L235 L257 D262 S263 T268 I269 A270 L296 I350	L150-L266 HydrophobicContact CD2-CD2 3.83Å; L197-L266 HydrophobicContact CD1-CD1 3.93Å; L197-L266 HydrophobicContact CD2-CD1 4.03Å; L233-L266 HydrophobicContact CD1-CB 4.02Å; L233-L266 HydrophobicContact CD1-CD1 3.79Å; L233-L266 HydrophobicContact CD1-CG 4.31Å; L233-L266 HydrophobicContact CD2-CB 4.34Å; L235-L266 HydrophobicContact CD1-CD2 3.82Å; L257-L266 HydrophobicContact CD2-CD2 3.93Å; D262-L266 WeakPolarHBondContact O-CB 3.18Å; D262-L266 PolarHBondContact O-N 3.47Å; S263-L266 PolarHBondContact O-N 3.2Å; L266-T268 VanDerWaalsContact C-N 3.3Å; L266-T268 PolarHBondContact O-N 2.76Å; L266-I269 PolarHBondContact O-N 3.32Å; L266-A270 WeakPolarHBondContact O-CB 3.15Å; L266-A270 PolarHBondContact O-N 3.43Å; L266-L296 HydrophobicContact CB-CD1 4.48Å; L266-L296 HydrophobicContact CD2-CD1 4.05Å; L266-L296 HydrophobicContact CG-CD1 3.93Å; L266-I350 HydrophobicContact CD1-CD1 4.37Å
267	Q	97.8	Very high	97	Very high	41 Å²	41	37 Å²	37	19%	0.192	20%	0.195	C	C	.	.	H	α-helix	trans	-57.9	-44.8	176.5	-174.2	65.2	64.1	0	0	111.3	S263 Q264 A270 N271 V294 L296	S263-Q267 WeakPolarHBondContact O-CB 3.29Å; S263-Q267 PolarHBondContact O-N 3.17Å; Q264-Q267 WeakPolarHBondContact O-CB 3.5Å; Q264-Q267 PolarHBondContact O-N 3.12Å; Q267-A270 PolarHBondContact O-N 3.39Å; Q267-N271 PolarHBondContact NE2-OD1 3.38Å; Q267-N271 WeakPolarHBondContact O-CB 3.4Å; Q267-N271 PolarHBondContact O-N 2.97Å; Q267-N271 PolarHBondContact O-ND2 3.32Å; Q267-N271 PolarHBondContact O-OD1 3.41Å; Q267-V294 PolarHBondContact NE2-O 2.89Å; Q267-V294 PolarHBondContact OE1-O 3.26Å; Q267-L296 HydrophobicContact CB-CD1 4.15Å
268	T	97.3	Very high	96.7	Very high	39 Å²	39	36.3 Å²	36.3	24%	0.239	19%	0.193	C	C	.	.	H	α-helix	trans	-60.9	-48.8	175.9	-56.1	0	0	0	0	110.8	L227 Q264 R265 L266 A270 N271 E272	L227-T268 HydrophobicContact CD1-CG2 3.99Å; L227-T268 HydrophobicContact CD2-CG2 3.87Å; Q264-T268 PolarHBondContact O-N 2.94Å; Q264-T268 PolarHBondContact O-OG1 2.99Å; R265-T268 PolarHBondContact O-N 3.46Å; L266-T268 VanDerWaalsContact C-N 3.3Å; L266-T268 PolarHBondContact O-N 2.76Å; T268-A270 VanDerWaalsContact C-N 3.33Å; T268-A270 PolarHBondContact O-N 3.11Å; T268-N271 PolarHBondContact O-N 3.28Å; T268-E272 HydrophobicContact CG2-CG 4.23Å; T268-E272 WeakPolarHBondContact O-CB 3.45Å; T268-E272 WeakPolarHBondContact O-CG 3.29Å; T268-E272 PolarHBondContact O-N 3.05Å
269	I	97.6	Very high	96.3	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-57.4	-46.3	177	-68.1	164.1	0	0	0	111.2	F218 L227 F228 R265 L266 N271 E272 L273 I350 F373	F218-I269 HydrophobicContact CE1-CG2 4.12Å; L227-I269 HydrophobicContact CB-CD1 4.21Å; L227-I269 HydrophobicContact CB-CG1 3.96Å; L227-I269 HydrophobicContact CD1-CG1 3.91Å; L227-I269 HydrophobicContact CG-CG1 4.35Å; F228-I269 HydrophobicContact CD2-CD1 4.46Å; F228-I269 HydrophobicContact CE2-CD1 4Å; F228-I269 HydrophobicContact CE2-CG1 4.19Å; F228-I269 HydrophobicContact CE2-CG2 4.47Å; F228-I269 HydrophobicContact CZ-CD1 4.15Å; F228-I269 HydrophobicContact CZ-CG2 4.35Å; R265-I269 HydrophobicContact CG-CD1 4.49Å; R265-I269 WeakPolarHBondContact O-CG1 3.41Å; R265-I269 PolarHBondContact O-N 3.29Å; L266-I269 PolarHBondContact O-N 3.32Å; I269-N271 PolarHBondContact O-N 2.89Å; I269-E272 PolarHBondContact O-N 3.33Å; I269-L273 HydrophobicContact CG2-CD1 3.73Å; I269-L273 HydrophobicContact CG2-CG 4.26Å; I269-L273 WeakPolarHBondContact O-CB 3.48Å; I269-L273 VanDerWaalsContact O-CG 3.3Å; I269-L273 WeakPolarHBondContact O-CG 3.36Å; I269-L273 PolarHBondContact O-N 3.23Å; I269-I350 HydrophobicContact CD1-CD1 4.32Å; I269-I350 HydrophobicContact CG2-CD1 3.59Å; I269-F373 HydrophobicContact CD1-CE1 4.1Å; I269-F373 HydrophobicContact CD1-CZ 3.97Å
270	A	97.3	Very high	95.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-44.2	-179.9	0	0	0	0	0	111.9	L197 L266 Q267 T268 F274 V294 L296	L197-A270 HydrophobicContact CB-CB 3.93Å; L197-A270 HydrophobicContact CD1-CB 4.34Å; L197-A270 HydrophobicContact CD2-CB 4.13Å; L197-A270 HydrophobicContact CG-CB 4.34Å; L266-A270 WeakPolarHBondContact O-CB 3.15Å; L266-A270 PolarHBondContact O-N 3.43Å; Q267-A270 PolarHBondContact O-N 3.39Å; T268-A270 VanDerWaalsContact C-N 3.33Å; T268-A270 PolarHBondContact O-N 3.11Å; A270-F274 VanDerWaalsContact O-CB 3.29Å; A270-F274 WeakPolarHBondContact O-CB 3.48Å; A270-F274 PolarHBondContact O-N 3.23Å; A270-V294 HydrophobicContact CB-CB 4.09Å; A270-V294 HydrophobicContact CB-CG1 4.44Å; A270-V294 HydrophobicContact CB-CG2 4.13Å; A270-L296 HydrophobicContact CB-CD2 4.07Å
271	N	96.1	Very high	95.6	Very high	24 Å²	24	36.2 Å²	36.2	13%	0.128	19%	0.189	C	C	.	.	H	α-helix	trans	-66.5	-43.6	179.9	-66.7	-14.4	0	0	0	112.6	Q267 T268 I269 F274 N275 N293 V294	Q267-N271 PolarHBondContact NE2-OD1 3.38Å; Q267-N271 WeakPolarHBondContact O-CB 3.4Å; Q267-N271 PolarHBondContact O-N 2.97Å; Q267-N271 PolarHBondContact O-ND2 3.32Å; Q267-N271 PolarHBondContact O-OD1 3.41Å; T268-N271 PolarHBondContact O-N 3.28Å; I269-N271 PolarHBondContact O-N 2.89Å; N271-F274 WeakPolarHBondContact O-CB 3.38Å; N271-F274 PolarHBondContact O-N 2.93Å; N271-N275 PolarHBondContact O-N 3.09Å; N271-N275 PolarHBondContact O-ND2 3.45Å; N271-N275 PolarHBondContact O-OD1 3.28Å; N271-N293 PolarHBondContact ND2-OD1 3.2Å; N271-N293 WeakPolarHBondContact OD1-CA 3.49Å; N271-V294 PolarHBondContact OD1-N 2.74Å
272	E	96	Very high	95.4	Very high	59 Å²	59	32 Å²	32	28%	0.276	16%	0.16	S	C	.	.	H	α-helix	trans	-65.3	-46.9	179.2	-66	-75.2	-171.8	0	0	111	F218 R223 T268 I269 F274 N275 L276	F218-E272 HydrophobicContact CD2-CB 4.46Å; F218-E272 HydrophobicContact CE2-CB 3.65Å; F218-E272 HydrophobicContact CE2-CG 4.21Å; F218-E272 HydrophobicContact CZ-CB 3.9Å; F218-E272 HydrophobicContact CZ-CG 4.47Å; R223-E272 IonicContact NE-OE1 3.59Å; T268-E272 HydrophobicContact CG2-CG 4.23Å; T268-E272 WeakPolarHBondContact O-CB 3.45Å; T268-E272 WeakPolarHBondContact O-CG 3.29Å; T268-E272 PolarHBondContact O-N 3.05Å; I269-E272 PolarHBondContact O-N 3.33Å; E272-F274 VanDerWaalsContact C-N 3.32Å; E272-F274 PolarHBondContact O-N 3.48Å; E272-N275 PolarHBondContact O-N 3.33Å; E272-L276 WeakPolarHBondContact O-CG 3.32Å; E272-L276 PolarHBondContact O-N 2.95Å
273	L	96.5	Very high	95.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61	-42.6	175.7	-72.2	177.1	0	0	0	111.4	I148 V198 L215 F218 I269 N275 L276 L277	I148-L273 HydrophobicContact CG2-CD1 4.21Å; V198-L273 HydrophobicContact CG2-CB 4.08Å; L215-L273 HydrophobicContact CD1-CD2 4.13Å; L215-L273 HydrophobicContact CG-CD2 4.11Å; F218-L273 HydrophobicContact CB-CD2 4.19Å; F218-L273 HydrophobicContact CD1-CD2 3.45Å; F218-L273 VanDerWaalsContact CD1-CD2 3.45Å; F218-L273 HydrophobicContact CD1-CG 4.06Å; F218-L273 HydrophobicContact CE1-CD2 3.97Å; F218-L273 HydrophobicContact CE1-CG 4.05Å; F218-L273 HydrophobicContact CG-CD2 3.92Å; I269-L273 HydrophobicContact CG2-CD1 3.73Å; I269-L273 HydrophobicContact CG2-CG 4.26Å; I269-L273 WeakPolarHBondContact O-CB 3.48Å; I269-L273 VanDerWaalsContact O-CG 3.3Å; I269-L273 WeakPolarHBondContact O-CG 3.36Å; I269-L273 PolarHBondContact O-N 3.23Å; L273-N275 PolarHBondContact O-N 3.12Å; L273-L276 PolarHBondContact O-N 3.26Å; L273-L277 WeakPolarHBondContact O-CB 3.28Å; L273-L277 VanDerWaalsContact O-CD1 3.24Å; L273-L277 WeakPolarHBondContact O-CD1 3.33Å; L273-L277 VanDerWaalsContact O-CG 3.28Å; L273-L277 WeakPolarHBondContact O-CG 3.5Å; L273-L277 PolarHBondContact O-N 2.97Å
274	F	95.7	Very high	94.7	Very high	9 Å²	9	31.6 Å²	31.6	4%	0.039	16%	0.158	C	C	.	.	H	α-helix	trans	-57	-50.1	175	-179	-84.9	0	0	0	111.1	V198 A270 N271 E272 L277 A278 T283 V294	V198-F274 HydrophobicContact CG1-CD2 4.14Å; V198-F274 HydrophobicContact CG2-CB 4.03Å; A270-F274 VanDerWaalsContact O-CB 3.29Å; A270-F274 WeakPolarHBondContact O-CB 3.48Å; A270-F274 PolarHBondContact O-N 3.23Å; N271-F274 WeakPolarHBondContact O-CB 3.38Å; N271-F274 PolarHBondContact O-N 2.93Å; E272-F274 VanDerWaalsContact C-N 3.32Å; E272-F274 PolarHBondContact O-N 3.48Å; F274-L277 PolarHBondContact O-N 3.09Å; F274-A278 HydrophobicContact CD1-CB 4.38Å; F274-A278 HydrophobicContact CE1-CB 4.13Å; F274-A278 WeakPolarHBondContact O-CB 3.45Å; F274-A278 PolarHBondContact O-N 3.19Å; F274-T283 HydrophobicContact CD2-CG2 4.41Å; F274-T283 HydrophobicContact CE2-CG2 4.25Å; F274-V294 HydrophobicContact CB-CG2 4.14Å; F274-V294 HydrophobicContact CD2-CG2 4.48Å; F274-V294 HydrophobicContact CG-CG2 4.45Å
275	N	93.7	Very high	93.5	Very high	59 Å²	59	29.6 Å²	29.6	32%	0.316	15%	0.153	S	C	.	.	H	α-helix	trans	-59.9	-50.3	-179	-67.2	-14.5	0	0	0	111.4	N271 E272 L273 L277 A278 E279 R289	N271-N275 PolarHBondContact O-N 3.09Å; N271-N275 PolarHBondContact O-ND2 3.45Å; N271-N275 PolarHBondContact O-OD1 3.28Å; E272-N275 PolarHBondContact O-N 3.33Å; L273-N275 PolarHBondContact O-N 3.12Å; N275-L277 VanDerWaalsContact C-N 3.26Å; N275-L277 PolarHBondContact O-N 3.29Å; N275-A278 PolarHBondContact O-N 3.12Å; N275-E279 WeakPolarHBondContact O-CB 3.48Å; N275-E279 VanDerWaalsContact O-CG 3.3Å; N275-E279 WeakPolarHBondContact O-CG 3.29Å; N275-E279 PolarHBondContact O-N 3.02Å; N275-R289 PolarHBondContact OD1-NH2 3.37Å
276	L	95.5	Very high	92	Very high	54 Å²	54	29.8 Å²	29.8	28%	0.283	16%	0.161	S	C	.	.	H	α-helix	trans	-60	-35.5	180	-69.4	171	0	0	0	112.8	I214 F218 E272 L273 Q280	I214-L276 HydrophobicContact CG2-CB 3.77Å; I214-L276 HydrophobicContact CG2-CD1 4.49Å; F218-L276 HydrophobicContact CB-CD1 3.75Å; F218-L276 HydrophobicContact CD2-CD1 3.74Å; F218-L276 HydrophobicContact CG-CD1 3.98Å; E272-L276 WeakPolarHBondContact O-CG 3.32Å; E272-L276 PolarHBondContact O-N 2.95Å; L273-L276 PolarHBondContact O-N 3.26Å; L276-Q280 VanDerWaalsContact O-CG 3.29Å; L276-Q280 WeakPolarHBondContact O-CG 3.21Å
277	L	95.2	Very high	90.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-81.2	-34.4	179	-69.7	158.1	0	0	0	112.3	I148 V198 L200 A211 I214 L215 L273 F274 N275 Q280 N281 L282 T283	I148-L277 HydrophobicContact CD1-CD1 3.24Å; V198-L277 HydrophobicContact CB-CD1 4.29Å; V198-L277 HydrophobicContact CG1-CD1 3.96Å; V198-L277 HydrophobicContact CG2-CD1 4.21Å; L200-L277 HydrophobicContact CD2-CB 4.07Å; L200-L277 HydrophobicContact CD2-CD1 4.07Å; L200-L277 HydrophobicContact CD2-CD2 4.28Å; L200-L277 HydrophobicContact CD2-CG 4.36Å; A211-L277 HydrophobicContact CB-CD2 4.21Å; I214-L277 HydrophobicContact CB-CD2 4.39Å; I214-L277 HydrophobicContact CD1-CD2 3.87Å; I214-L277 HydrophobicContact CG2-CD2 4.19Å; I214-L277 HydrophobicContact CG2-CG 4.31Å; L215-L277 HydrophobicContact CD1-CD1 4.27Å; L273-L277 WeakPolarHBondContact O-CB 3.28Å; L273-L277 VanDerWaalsContact O-CD1 3.24Å; L273-L277 WeakPolarHBondContact O-CD1 3.33Å; L273-L277 VanDerWaalsContact O-CG 3.28Å; L273-L277 WeakPolarHBondContact O-CG 3.5Å; L273-L277 PolarHBondContact O-N 2.97Å; F274-L277 PolarHBondContact O-N 3.09Å; N275-L277 VanDerWaalsContact C-N 3.26Å; N275-L277 PolarHBondContact O-N 3.29Å; L277-Q280 CarbonylContact O-C 3.57Å; L277-Q280 PolarHBondContact O-N 2.85Å; L277-N281 PolarHBondContact O-N 3.41Å; L277-L282 HydrophobicContact CD2-CB 4.48Å; L277-L282 HydrophobicContact CD2-CD1 4Å; L277-L282 PolarHBondContact O-N 2.97Å; L277-T283 HydrophobicContact CB-CG2 4.07Å
278	A	91.9	Very high	88.7	Confident	11 Å²	11	35.3 Å²	35.3	9%	0.091	19%	0.185	C	C	.	.	H	α-helix	trans	-67.5	-41.1	175	0	0	0	0	0	111.2	F274 N275 Q280 N281 T283	F274-A278 HydrophobicContact CD1-CB 4.38Å; F274-A278 HydrophobicContact CE1-CB 4.13Å; F274-A278 WeakPolarHBondContact O-CB 3.45Å; F274-A278 PolarHBondContact O-N 3.19Å; N275-A278 PolarHBondContact O-N 3.12Å; A278-Q280 PolarHBondContact O-N 3.23Å; A278-Q280 VanDerWaalsContact O-N 3.12Å; A278-N281 PolarHBondContact O-N 3.23Å; A278-T283 HydrophobicContact CB-CG2 4.06Å
279	E	90	Very high	87.7	Confident	109 Å²	109	34.9 Å²	34.9	51%	0.509	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-24.6	172.2	-76.3	171.5	-165.6	0	0	112.9	N275	N275-E279 WeakPolarHBondContact O-CB 3.48Å; N275-E279 VanDerWaalsContact O-CG 3.3Å; N275-E279 WeakPolarHBondContact O-CG 3.29Å; N275-E279 PolarHBondContact O-N 3.02Å
280	Q	90.9	Very high	86.5	Confident	80 Å²	80	39.6 Å²	39.6	37%	0.374	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	8.2	178.7	-62.4	-62.2	-41.3	0	0	113.2	I214 L276 L277 A278 L282	I214-Q280 HydrophobicContact CD1-CB 3.95Å; I214-Q280 HydrophobicContact CD1-CG 3.68Å; L276-Q280 VanDerWaalsContact O-CG 3.29Å; L276-Q280 WeakPolarHBondContact O-CG 3.21Å; L277-Q280 CarbonylContact O-C 3.57Å; L277-Q280 PolarHBondContact O-N 2.85Å; A278-Q280 PolarHBondContact O-N 3.23Å; A278-Q280 VanDerWaalsContact O-N 3.12Å; Q280-L282 VanDerWaalsContact C-N 3.3Å; Q280-L282 HydrophobicContact CB-CD1 4.26Å; Q280-L282 HydrophobicContact CB-CG 4.15Å; Q280-L282 PolarHBondContact O-N 3.44Å
281	N	90.4	Very high	85.8	Confident	35 Å²	35	45.8 Å²	45.8	19%	0.187	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	38.9	-178.6	-63.5	-43.4	0	0	0	113.5	R139 L277 A278	R139-N281 WeakPolarHBondContact CD-O 3.5Å; R139-N281 PolarHBondContact NE-O 3.38Å; L277-N281 PolarHBondContact O-N 3.41Å; A278-N281 PolarHBondContact O-N 3.23Å
282	L	93.9	Very high	85.3	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.016	26%	0.264	C	S	.	.			trans	-103.1	-11.9	-179.2	-62.6	-178.6	0	0	0	114.1	L200 V201 L202 E207 K210 A211 I214 L277 Q280	L200-L282 VanDerWaalsContact CA-O 3.28Å; L200-L282 WeakPolarHBondContact CA-O 3.33Å; L200-L282 WeakPolarHBondContact CB-O 3.36Å; L200-L282 HydrophobicContact CD2-CB 4.18Å; L200-L282 WeakPolarHBondContact CD2-O 3.01Å; V201-L282 PolarHBondContact N-O 3.26Å; L202-L282 HydrophobicContact CD2-CB 3.95Å; L202-L282 HydrophobicContact CD2-CD1 4.2Å; L202-L282 HydrophobicContact CD2-CD2 3.95Å; L202-L282 HydrophobicContact CD2-CG 4.25Å; E207-L282 HydrophobicContact CB-CD2 4.23Å; E207-L282 HydrophobicContact CG-CD2 4.15Å; K210-L282 HydrophobicContact CD-CD1 4.43Å; K210-L282 HydrophobicContact CG-CD1 4.47Å; A211-L282 HydrophobicContact CB-CD1 4.21Å; I214-L282 HydrophobicContact CD1-CD1 3.91Å; L277-L282 HydrophobicContact CD2-CB 4.48Å; L277-L282 HydrophobicContact CD2-CD1 4Å; L277-L282 PolarHBondContact O-N 2.97Å; Q280-L282 VanDerWaalsContact C-N 3.3Å; Q280-L282 HydrophobicContact CB-CD1 4.26Å; Q280-L282 HydrophobicContact CB-CG 4.15Å; Q280-L282 PolarHBondContact O-N 3.44Å
283	T	93.2	Very high	85.1	Confident	7 Å²	7	50.7 Å²	50.7	4%	0.043	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-75.8	151.7	-178	54.8	0	0	0	0	112.4	V198 T199 L200 F274 L277 A278 T285	V198-T283 HydrophobicContact CG1-CG2 3.87Å; T199-T283 WeakPolarHBondContact O-CA 3.46Å; L200-T283 HydrophobicContact CD2-CG2 4.15Å; F274-T283 HydrophobicContact CD2-CG2 4.41Å; F274-T283 HydrophobicContact CE2-CG2 4.25Å; L277-T283 HydrophobicContact CB-CG2 4.07Å; A278-T283 HydrophobicContact CB-CG2 4.06Å; T283-T285 PolarHBondContact OG1-O 2.93Å
284	S	85.8	Confident	85	Confident	6 Å²	6	51.6 Å²	51.6	4%	0.042	28%	0.276	C	S	.	.	S	Bend	trans	-91.4	-17.9	174.2	54.8	0	0	0	0	113.7	N140 P144 T199	N140-S284 WeakPolarHBondContact CA-O 3.39Å; P144-S284 WeakPolarHBondContact CG-OG 3.37Å; T199-S284 VanDerWaalsContact C-OG 3.24Å; T199-S284 WeakPolarHBondContact CB-OG 3.37Å; T199-S284 PolarHBondContact O-N 2.88Å; T199-S284 PolarHBondContact O-OG 2.96Å; T199-S284 PolarHBondContact OG1-OG 3.24Å
285	T	73.3	Confident	84.8	Confident	64 Å²	64	56.1 Å²	56.1	39%	0.393	30%	0.295	S	S	.	.	S	Bend	trans	-105	140.8	176.9	52.9	0	0	0	0	109.1	T283	T283-T285 PolarHBondContact OG1-O 2.93Å
286	G	65.9	Low	84.9	Confident	25 Å²	25	54.3 Å²	54.3	26%	0.258	29%	0.286	S	S	.	.			trans	-57.2	158.4	167.4	0	0	0	0	0	111	Y288	G286-Y288 PolarHBondContact O-N 3Å
287	S	62.1	Low	85	Confident	22 Å²	22	53.3 Å²	53.3	15%	0.154	28%	0.279	C	S	.	.	S	Bend	trans	-75	8.1	-173.8	-30.6	0	0	0	0	114.5	H11 R289	H11-S287 WeakPolarHBondContact CB-OG 3.3Å; H11-S287 PolarHBondContact O-OG 3.35Å; H11-S287 VanDerWaalsContact O-OG 3.13Å; S287-R289 PolarHBondContact O-N 3.44Å
288	Y	65.2	Low	85.1	Confident	135 Å²	135	53.3 Å²	53.3	53%	0.529	28%	0.279	S	S	.	.			trans	-66.9	100.8	176	-173.6	-102.7	0	0	0	110.3	G286 P290	G286-Y288 PolarHBondContact O-N 3Å; Y288-P290 HydrophobicContact CE1-CG 4.5Å
289	R	75.2	Confident	85.4	Confident	31 Å²	31	53.8 Å²	53.8	12%	0.117	28%	0.282	C	S	.	.			trans	-126.6	108.4	168	-65.2	178.4	-59.5	177.8	-1.4	105.9	N275 S287 D291 N292	N275-R289 PolarHBondContact OD1-NH2 3.37Å; S287-R289 PolarHBondContact O-N 3.44Å; R289-D291 PolarHBondContact O-N 3.17Å; R289-N292 PolarHBondContact NH1-O 2.94Å; R289-N292 PolarHBondContact NH2-O 2.89Å; R289-N292 PolarHBondContact O-N 3.36Å; R289-N292 PolarHBondContact O-OD1 2.87Å
290	P	73.1	Confident	85.7	Confident	99 Å²	99	48.6 Å²	48.6	64%	0.643	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-36.1	-173.7	18.4	-29.4	0	0	0	112.6	Y288	Y288-P290 HydrophobicContact CE1-CG 4.5Å
291	D	82	Confident	86.1	Confident	129 Å²	129	44.8 Å²	44.8	69%	0.69	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.9	10.7	177.8	-54.4	-37	0	0	0	113.2	R289 N293	R289-D291 PolarHBondContact O-N 3.17Å; D291-N293 HydrophobicContact CB-CB 4.36Å; D291-N293 PolarHBondContact O-N 2.84Å
292	N	85.2	Confident	86.3	Confident	109 Å²	109	44.2 Å²	44.2	58%	0.583	24%	0.236	S	C	*	.	S	Bend	trans	53.6	13.7	-168	-73.2	-30.7	0	0	0	115.1	R289	R289-N292 PolarHBondContact NH1-O 2.94Å; R289-N292 PolarHBondContact NH2-O 2.89Å; R289-N292 PolarHBondContact O-N 3.36Å; R289-N292 PolarHBondContact O-OD1 2.87Å
293	N	92.8	Very high	86.3	Confident	78 Å²	78	44.1 Å²	44.1	42%	0.417	24%	0.236	S	C	.	.	S	Bend	trans	-106.3	139.1	-178.5	-74.2	-31.5	0	0	0	111.6	N271 D291 K295	N271-N293 PolarHBondContact ND2-OD1 3.2Å; N271-N293 WeakPolarHBondContact OD1-CA 3.49Å; D291-N293 HydrophobicContact CB-CB 4.36Å; D291-N293 PolarHBondContact O-N 2.84Å; N293-K295 PolarHBondContact O-N 2.91Å
294	V	93.3	Very high	86.2	Confident	18 Å²	18	45.9 Å²	45.9	11%	0.109	24%	0.243	C	C	.	.			trans	-66.6	126.7	162.7	176.5	0	0	0	0	108.4	L197 Q267 A270 N271 F274 L296	L197-V294 VanDerWaalsContact O-CG1 3.29Å; L197-V294 WeakPolarHBondContact O-CG1 3.3Å; L197-V294 WeakPolarHBondContact O-CG2 3.44Å; Q267-V294 PolarHBondContact NE2-O 2.89Å; Q267-V294 PolarHBondContact OE1-O 3.26Å; A270-V294 HydrophobicContact CB-CB 4.09Å; A270-V294 HydrophobicContact CB-CG1 4.44Å; A270-V294 HydrophobicContact CB-CG2 4.13Å; N271-V294 PolarHBondContact OD1-N 2.74Å; F274-V294 HydrophobicContact CB-CG2 4.14Å; F274-V294 HydrophobicContact CD2-CG2 4.48Å; F274-V294 HydrophobicContact CG-CG2 4.45Å; V294-L296 HydrophobicContact CG1-CD2 4.1Å; V294-L296 PolarHBondContact O-N 3.14Å
295	K	92.6	Very high	86.4	Confident	104 Å²	104	47.1 Å²	47.1	45%	0.452	25%	0.247	S	C	.	.			trans	-72.3	94.6	174.4	-175	168.7	-178.4	176.1	0	110.2	M243 Y254 N293 H297	M243-K295 HydrophobicContact CE-CD 3.94Å; M243-K295 HydrophobicContact CE-CG 4.47Å; M243-K295 HydrophobicContact SD-CD 3.79Å; M243-K295 VanDerWaalsContact SD-CE 3.59Å; M243-K295 PolarHBondContact SD-NZ 3.4Å; Y254-K295 WeakPolarHBondContact OH-CE 3.29Å; Y254-K295 PolarHBondContact OH-NZ 2.98Å; N293-K295 PolarHBondContact O-N 2.91Å; K295-H297 PolarHBondContact O-N 2.81Å; K295-H297 PolarHBondContact O-ND1 3.26Å
296	L	96.3	Very high	87.1	Confident	21 Å²	21	45.9 Å²	45.9	11%	0.11	24%	0.235	C	C	.	.			trans	-71.6	119	178	-62.4	-179.8	0	0	0	110.8	F195 L197 L257 L266 Q267 A270 V294	F195-L296 HydrophobicContact CD1-CB 4.38Å; L197-L296 HydrophobicContact CD2-CD2 3.54Å; L257-L296 HydrophobicContact CD2-CB 4.35Å; L257-L296 HydrophobicContact CD2-CD1 3.87Å; L266-L296 HydrophobicContact CB-CD1 4.48Å; L266-L296 HydrophobicContact CD2-CD1 4.05Å; L266-L296 HydrophobicContact CG-CD1 3.93Å; Q267-L296 HydrophobicContact CB-CD1 4.15Å; A270-L296 HydrophobicContact CB-CD2 4.07Å; V294-L296 HydrophobicContact CG1-CD2 4.1Å; V294-L296 PolarHBondContact O-N 3.14Å
297	H	95.6	Very high	87.5	Confident	33 Å²	33	46.1 Å²	46.1	15%	0.153	23%	0.23	C	C	.	.			trans	-151	151.6	177.6	61.6	-75.1	0	0	0	111	F195 M243 Y254 K295 T299	F195-H297 VanDerWaalsContact CD1-O 3.32Å; F195-H297 WeakPolarHBondContact CD1-O 3.19Å; F195-H297 VanDerWaalsContact CE1-C 3.45Å; M243-H297 VanDerWaalsContact CE-CE1 3.46Å; M243-H297 WeakPolarHBondContact CE-CE1 3.3Å; M243-H297 WeakPolarHBondContact CE-NE2 3.27Å; Y254-H297 HydrophobicContact CD1-CB 4.31Å; Y254-H297 HydrophobicContact CD2-CB 3.39Å; Y254-H297 HydrophobicContact CE2-CB 3.84Å; Y254-H297 HydrophobicContact CG-CB 3.65Å; K295-H297 PolarHBondContact O-N 2.81Å; K295-H297 PolarHBondContact O-ND1 3.26Å; H297-T299 PolarHBondContact CD2-OG1 2.72Å
298	M	98	Very high	88	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	106.3	170	-178.5	176.9	74.9	0	0	109.1	V152 V157 L193 F195 I237 Y254 A255 L300 F341	V152-M298 HydrophobicContact CB-SD 3.98Å; V152-M298 HydrophobicContact CG1-SD 3.81Å; V152-M298 HydrophobicContact CG2-SD 4.05Å; V157-M298 HydrophobicContact CG1-CE 4.11Å; V157-M298 HydrophobicContact CG1-SD 4.33Å; L193-M298 HydrophobicContact CB-SD 4.09Å; L193-M298 HydrophobicContact CD2-CG 4.33Å; L193-M298 HydrophobicContact CD2-SD 4.29Å; F195-M298 HydrophobicContact CD1-CB 4.35Å; F195-M298 HydrophobicContact CD2-CB 4.38Å; F195-M298 HydrophobicContact CE1-CB 3.91Å; F195-M298 HydrophobicContact CE2-CB 3.96Å; F195-M298 HydrophobicContact CZ-CB 3.7Å; I237-M298 HydrophobicContact CD1-SD 4.36Å; I237-M298 HydrophobicContact CG2-CE 3.83Å; Y254-M298 CarbonylContact C-O 3.43Å; Y254-M298 VanDerWaalsContact CA-O 3.23Å; Y254-M298 WeakPolarHBondContact CA-O 3.32Å; Y254-M298 VanDerWaalsContact CB-O 3.26Å; Y254-M298 WeakPolarHBondContact CB-O 3.39Å; A255-M298 HydrophobicContact CB-CB 4.47Å; A255-M298 HydrophobicContact CB-CE 3.94Å; A255-M298 PolarHBondContact N-O 3.34Å; A255-M298 PolarHBondContact O-N 3.39Å; M298-L300 HydrophobicContact CE-CD2 3.89Å; M298-L300 PolarHBondContact O-N 3.46Å; M298-F341 HydrophobicContact CE-CD1 4.37Å; M298-F341 HydrophobicContact CE-CG 4.24Å
299	T	97.5	Very high	87.9	Confident	22 Å²	22	47.1 Å²	47.1	14%	0.135	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	129.2	-178.8	-65.2	0	0	0	0	111	V252 H297 N302	V252-T299 HydrophobicContact CG1-CG2 4.05Å; H297-T299 PolarHBondContact CD2-OG1 2.72Å; T299-N302 HydrophobicContact CG2-CB 4.19Å
300	L	98.3	Very high	87.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-46.6	178.3	-58.1	176.7	0	0	0	111.1	F161 F164 H188 L240 L253 A255 M298 F341	F161-L300 HydrophobicContact CD2-CD2 3.72Å; F161-L300 HydrophobicContact CE2-CB 4.03Å; F161-L300 HydrophobicContact CE2-CD2 3.68Å; F161-L300 HydrophobicContact CE2-CG 4.42Å; F164-L300 HydrophobicContact CE1-CD1 4.09Å; F164-L300 HydrophobicContact CZ-CD1 4.24Å; H188-L300 WeakPolarHBondContact CB-O 3.46Å; H188-L300 PolarHBondContact N-O 2.86Å; L240-L300 HydrophobicContact CD2-CD1 3.45Å; L240-L300 VanDerWaalsContact CD2-CD1 3.45Å; L253-L300 PolarHBondContact O-N 2.89Å; A255-L300 HydrophobicContact CB-CD1 4.11Å; A255-L300 HydrophobicContact CB-CD2 4.24Å; A255-L300 HydrophobicContact CB-CG 4.29Å; M298-L300 HydrophobicContact CE-CD2 3.89Å; M298-L300 PolarHBondContact O-N 3.46Å; L300-F341 HydrophobicContact CD1-CE1 4.48Å; L300-F341 HydrophobicContact CD1-CE2 4.03Å; L300-F341 HydrophobicContact CD1-CZ 3.57Å; L300-F341 HydrophobicContact CD2-CE1 4.04Å; L300-F341 HydrophobicContact CD2-CE2 4.49Å; L300-F341 HydrophobicContact CD2-CZ 3.87Å; L300-F341 HydrophobicContact CG-CZ 4.38Å
301	L	97.6	Very high	86.2	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	138.6	178.5	-70.9	64.9	0	0	0	110.1	F164 V182 I186 F187 V252 L253 F327 I332	F164-L301 HydrophobicContact CE1-CD1 3.99Å; V182-L301 HydrophobicContact CG1-CD2 4.43Å; I186-L301 HydrophobicContact CD1-CB 4.42Å; I186-L301 HydrophobicContact CD1-CD2 3.81Å; I186-L301 HydrophobicContact CD1-CG 4.4Å; I186-L301 HydrophobicContact CG1-CD2 4.29Å; I186-L301 HydrophobicContact CG1-CG 4.46Å; I186-L301 CarbonylContact O-C 3.57Å; I186-L301 WeakPolarHBondContact O-CA 3.13Å; F187-L301 HydrophobicContact CD1-CD1 3.74Å; F187-L301 HydrophobicContact CD1-CG 4.07Å; F187-L301 HydrophobicContact CD2-CG 4.48Å; F187-L301 HydrophobicContact CE1-CD1 3.62Å; F187-L301 HydrophobicContact CE1-CD2 4.34Å; F187-L301 HydrophobicContact CE1-CG 4.07Å; F187-L301 HydrophobicContact CE2-CD2 4.34Å; F187-L301 HydrophobicContact CE2-CG 4.48Å; F187-L301 HydrophobicContact CG-CD1 4.44Å; F187-L301 HydrophobicContact CG-CG 4.29Å; F187-L301 HydrophobicContact CZ-CD1 4.24Å; F187-L301 HydrophobicContact CZ-CD2 4.13Å; F187-L301 HydrophobicContact CZ-CG 4.29Å; V252-L301 WeakPolarHBondContact CA-O 3.46Å; L253-L301 HydrophobicContact CB-CB 4.2Å; L253-L301 HydrophobicContact CD2-CD1 4.23Å; L253-L301 HydrophobicContact CD2-CD2 4.44Å; L253-L301 PolarHBondContact N-O 3.31Å; L253-L301 PolarHBondContact O-N 3.18Å; L253-L301 VanDerWaalsContact O-N 3.07Å; L301-F327 HydrophobicContact CB-CE2 4.04Å; L301-F327 HydrophobicContact CB-CZ 3.74Å; L301-F327 HydrophobicContact CD2-CD2 4.45Å; L301-F327 HydrophobicContact CD2-CE2 4Å; L301-F327 HydrophobicContact CD2-CZ 4.5Å; L301-I332 HydrophobicContact CD2-CD1 3.83Å
302	N	95.9	Very high	84.7	Confident	23 Å²	23	51.6 Å²	51.6	12%	0.123	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	124.4	172.8	-165.5	-30.5	0	0	0	110.9	I186 H251 T299 K304 Y305 R324	I186-N302 PolarHBondContact O-N 3.03Å; H251-N302 WeakPolarHBondContact O-CA 3.33Å; H251-N302 PolarHBondContact O-OD1 3.39Å; T299-N302 HydrophobicContact CG2-CB 4.19Å; N302-K304 PolarHBondContact O-N 2.95Å; N302-K304 VanDerWaalsContact O-N 3.11Å; N302-K304 VanDerWaalsContact OD1-CB 3.25Å; N302-K304 WeakPolarHBondContact OD1-CB 3.42Å; N302-K304 PolarHBondContact OD1-N 3.48Å; N302-Y305 HydrophobicContact CB-CD1 4.33Å; N302-Y305 HydrophobicContact CB-CD2 3.79Å; N302-Y305 HydrophobicContact CB-CE1 3.95Å; N302-Y305 HydrophobicContact CB-CE2 3.35Å; N302-Y305 HydrophobicContact CB-CG 4.23Å; N302-Y305 WeakPolarHBondContact O-CB 3.38Å; N302-Y305 WeakPolarHBondContact O-CD2 3.49Å; N302-Y305 PolarHBondContact O-N 2.89Å; N302-Y305 VanDerWaalsContact O-N 3.08Å; N302-R324 PolarHBondContact OD1-NH2 3.29Å
303	S	93.9	Very high	82.8	Confident	1 Å²	1	53 Å²	53	1%	0.007	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.2	176.3	44.8	0	0	0	0	113.8	H251 Y305 R306 R324 T325	H251-S303 WeakPolarHBondContact CA-OG 3.25Å; H251-S303 PolarHBondContact ND1-OG 3.47Å; H251-S303 PolarHBondContact O-N 3.45Å; H251-S303 PolarHBondContact O-OG 3.37Å; S303-Y305 PolarHBondContact O-N 3.14Å; S303-R306 PolarHBondContact O-N 3.41Å; S303-R324 PolarHBondContact OG-NE 3Å; S303-R324 PolarHBondContact OG-NH2 2.95Å; S303-T325 WeakPolarHBondContact CB-O 3.46Å
304	K	90.6	Very high	80.6	Confident	44 Å²	44	51.3 Å²	51.3	19%	0.191	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-28.9	175.5	-171.9	-178.5	178.1	-170.6	0	112.3	N302 R306 Q307 E308	N302-K304 PolarHBondContact O-N 2.95Å; N302-K304 VanDerWaalsContact O-N 3.11Å; N302-K304 VanDerWaalsContact OD1-CB 3.25Å; N302-K304 WeakPolarHBondContact OD1-CB 3.42Å; N302-K304 PolarHBondContact OD1-N 3.48Å; K304-R306 PolarHBondContact O-N 3Å; K304-R306 VanDerWaalsContact O-N 3.16Å; K304-Q307 PolarHBondContact O-N 3.07Å; K304-Q307 VanDerWaalsContact O-N 3.08Å; K304-E308 WeakPolarHBondContact CD-OE1 3.41Å; K304-E308 WeakPolarHBondContact CE-OE1 3.49Å; K304-E308 HydrophobicContact CG-CG 4.42Å; K304-E308 IonicContact NZ-OE1 3.24Å; K304-E308 PolarHBondContact NZ-OE1 2.67Å; K304-E308 PolarHBondContact O-N 2.74Å
305	Y	90.7	Very high	78.2	Confident	32 Å²	32	57.4 Å²	57.4	13%	0.125	28%	0.283	C	S	.	.	H	α-helix	trans	-65.3	-20.9	-177.3	-56.3	-30.1	0	0	0	113.3	S185 I186 H188 N302 S303 Q307 E308 K309	S185-Y305 WeakPolarHBondContact O-CB 3.31Å; I186-Y305 WeakPolarHBondContact O-CD2 3.37Å; H188-Y305 HydrophobicContact CB-CE2 3.97Å; H188-Y305 AromaticContact CE1-CZ 4Å; H188-Y305 PolarHBondContact CE1-OH 3.46Å; H188-Y305 AromaticContact ND1-CE2 3.44Å; H188-Y305 WeakPolarHBondContact ND1-CE2 3.44Å; H188-Y305 AromaticContact ND1-CZ 3.17Å; H188-Y305 PolarHBondContact ND1-OH 3.23Å; N302-Y305 HydrophobicContact CB-CD1 4.33Å; N302-Y305 HydrophobicContact CB-CD2 3.79Å; N302-Y305 HydrophobicContact CB-CE1 3.95Å; N302-Y305 HydrophobicContact CB-CE2 3.35Å; N302-Y305 HydrophobicContact CB-CG 4.23Å; N302-Y305 WeakPolarHBondContact O-CB 3.38Å; N302-Y305 WeakPolarHBondContact O-CD2 3.49Å; N302-Y305 PolarHBondContact O-N 2.89Å; N302-Y305 VanDerWaalsContact O-N 3.08Å; S303-Y305 PolarHBondContact O-N 3.14Å; Y305-Q307 VanDerWaalsContact C-N 3.33Å; Y305-Q307 PolarHBondContact O-N 2.93Å; Y305-E308 WeakPolarHBondContact CD1-OE2 3.03Å; Y305-E308 PolarHBondContact O-N 2.89Å; Y305-K309 PolarHBondContact O-N 2.99Å
306	R	88.1	Confident	75.8	Confident	37 Å²	37	61.9 Å²	61.9	14%	0.14	30%	0.302	C	S	.	.	H	α-helix	trans	-59.8	-44.1	171.8	-56.9	-159.9	-177.2	100.8	1.2	111.9	G181 D183 S185 I186 S303 K304 S310 T325	G181-R306 PolarHBondContact O-NH2 2.81Å; D183-R306 IonicContact OD2-NE 3.72Å; D183-R306 PolarHBondContact OD2-NE 3.43Å; D183-R306 IonicContact OD2-NH2 3.4Å; S185-R306 WeakPolarHBondContact OG-CG 3.17Å; I186-R306 HydrophobicContact CG2-CG 3.52Å; I186-R306 VanDerWaalsContact CG2-NE 3.28Å; S303-R306 PolarHBondContact O-N 3.41Å; K304-R306 PolarHBondContact O-N 3Å; K304-R306 VanDerWaalsContact O-N 3.16Å; R306-S310 PolarHBondContact O-N 3.44Å; R306-S310 PolarHBondContact O-OG 2.88Å; R306-T325 PolarHBondContact NH1-O 3.3Å; R306-T325 PolarHBondContact NH1-OG1 2.86Å
307	Q	73.8	Confident	72.8	Confident	31 Å²	31	67.3 Å²	67.3	15%	0.145	33%	0.327	C	S	.	.	H	α-helix	trans	-76.2	-36.2	-177.9	-65.4	171.6	-6.8	0	0	111.6	K304 Y305 K309 S310 N311 N322	K304-Q307 PolarHBondContact O-N 3.07Å; K304-Q307 VanDerWaalsContact O-N 3.08Å; Y305-Q307 VanDerWaalsContact C-N 3.33Å; Y305-Q307 PolarHBondContact O-N 2.93Å; Q307-K309 VanDerWaalsContact C-N 3.31Å; Q307-K309 PolarHBondContact O-N 2.78Å; Q307-S310 PolarHBondContact O-N 3.37Å; Q307-N311 WeakPolarHBondContact O-CB 3.33Å; Q307-N311 PolarHBondContact O-N 3.01Å; Q307-N322 PolarHBondContact NE2-O 3.4Å
308	E	72.1	Confident	69.9	Low	78 Å²	78	70.3 Å²	70.3	36%	0.364	37%	0.367	S	S	.	.	H	α-helix	trans	-66.1	-32.9	178.6	-68.5	179.2	178.2	0	0	112.4	K304 Y305	K304-E308 WeakPolarHBondContact CD-OE1 3.41Å; K304-E308 WeakPolarHBondContact CE-OE1 3.49Å; K304-E308 HydrophobicContact CG-CG 4.42Å; K304-E308 IonicContact NZ-OE1 3.24Å; K304-E308 PolarHBondContact NZ-OE1 2.67Å; K304-E308 PolarHBondContact O-N 2.74Å; Y305-E308 WeakPolarHBondContact CD1-OE2 3.03Å; Y305-E308 PolarHBondContact O-N 2.89Å
309	K	64.2	Low	66.9	Low	100 Å²	100	77.7 Å²	77.7	44%	0.435	40%	0.399	S	S	.	.	H	α-helix	trans	-71.9	-48.2	171.8	-71.7	177.1	179.9	164.5	0	111.5	S185 Y305 Q307 N311 R312	S185-K309 PolarHBondContact O-NZ 2.89Å; S185-K309 VanDerWaalsContact O-NZ 3.16Å; Y305-K309 PolarHBondContact O-N 2.99Å; Q307-K309 VanDerWaalsContact C-N 3.31Å; Q307-K309 PolarHBondContact O-N 2.78Å; K309-N311 VanDerWaalsContact C-N 3.34Å; K309-N311 PolarHBondContact O-N 3.25Å; K309-R312 PolarHBondContact O-N 3.24Å
310	S	57.7	Low	64.4	Low	63 Å²	63	81.6 Å²	81.6	44%	0.441	43%	0.427	S	S	.	.	H	α-helix	trans	-61.4	-38.4	-179.4	-53.8	0	0	0	0	112.9	R306 Q307 R312 D313 A314	R306-S310 PolarHBondContact O-N 3.44Å; R306-S310 PolarHBondContact O-OG 2.88Å; Q307-S310 PolarHBondContact O-N 3.37Å; S310-R312 VanDerWaalsContact C-N 3.33Å; S310-R312 PolarHBondContact O-N 3.33Å; S310-D313 PolarHBondContact O-N 3.37Å; S310-A314 WeakPolarHBondContact O-CB 3.37Å; S310-A314 PolarHBondContact O-N 2.84Å
311	N	54.1	Low	62	Low	105 Å²	105	85 Å²	85	56%	0.561	45%	0.45	S	S	*	.	H	α-helix	trans	-71.8	-22.1	179.3	-75.8	-5.9	0	0	0	113.9	Q307 K309 D313	Q307-N311 WeakPolarHBondContact O-CB 3.33Å; Q307-N311 PolarHBondContact O-N 3.01Å; K309-N311 VanDerWaalsContact C-N 3.34Å; K309-N311 PolarHBondContact O-N 3.25Å; N311-D313 VanDerWaalsContact C-N 3.3Å
312	R	51	Low	60	Low	184 Å²	184	91.3 Å²	91.3	69%	0.694	48%	0.484	S	S	*	.	H	α-helix	trans	-69.4	-32.4	170.3	-73.7	-178.7	-178.2	-169	-0.1	111.4	K309 S310	K309-R312 PolarHBondContact O-N 3.24Å; S310-R312 VanDerWaalsContact C-N 3.33Å; S310-R312 PolarHBondContact O-N 3.33Å
313	D	45.8	Very low	58.6	Low	138 Å²	138	93.7 Å²	93.7	74%	0.738	51%	0.506	S	S	*	.	H	α-helix	trans	-88.5	-27.7	179.7	-59.8	-31.9	0	0	0	112.6	S310 N311 L315	S310-D313 PolarHBondContact O-N 3.37Å; N311-D313 VanDerWaalsContact C-N 3.3Å; D313-L315 PolarHBondContact O-N 2.82Å
314	A	45.4	Very low	58.1	Low	43 Å²	43	97.2 Å²	97.2	36%	0.355	52%	0.519	S	S	.	.			trans	-93.8	17.4	-171	0	0	0	0	0	115.9	S310 F316 Q317	S310-A314 WeakPolarHBondContact O-CB 3.37Å; S310-A314 PolarHBondContact O-N 2.84Å; A314-F316 PolarHBondContact O-N 2.63Å; A314-Q317 PolarHBondContact O-N 3.03Å
315	L	43.7	Very low	58	Low	147 Å²	147	99.1 Å²	99.1	77%	0.77	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-0.8	174.2	-92.3	157.9	0	0	0	114.8	D313	D313-L315 PolarHBondContact O-N 2.82Å
316	F	42.1	Very low	58.2	Low	197 Å²	197	99.5 Å²	99.5	86%	0.864	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	-7.9	-178.7	-79.2	-79.8	0	0	0	117	A314	A314-F316 PolarHBondContact O-N 2.63Å
317	Q	32.1	Very low	58.5	Low	136 Å²	136	97.9 Å²	97.9	64%	0.636	54%	0.536	S	S	*	.	S	Bend	trans	-143.7	126.8	179.1	-72.3	-177.1	-4.3	0	0	112.2	A314 F319	A314-Q317 PolarHBondContact O-N 3.03Å; Q317-F319 HydrophobicContact CB-CD2 3.69Å; Q317-F319 HydrophobicContact CB-CE2 3.5Å; Q317-F319 HydrophobicContact CG-CE2 4.41Å; Q317-F319 PolarHBondContact O-N 2.98Å; Q317-F319 VanDerWaalsContact OE1-CE2 3.25Å
318	G	36.1	Very low	59.6	Low	95 Å²	95	96.7 Å²	96.7	98%	0.979	53%	0.531	S	S	*	.			trans	-68.6	62.6	-177.2	0	0	0	0	0	114.3
319	F	34.1	Very low	60.7	Low	155 Å²	155	93 Å²	93	68%	0.68	51%	0.514	S	S	*	.			trans	-76.6	131.9	175.2	-77.1	-78.2	0	0	0	111.6	Q317	Q317-F319 HydrophobicContact CB-CD2 3.69Å; Q317-F319 HydrophobicContact CB-CE2 3.5Å; Q317-F319 HydrophobicContact CG-CE2 4.41Å; Q317-F319 PolarHBondContact O-N 2.98Å; Q317-F319 VanDerWaalsContact OE1-CE2 3.25Å
320	S	45.2	Very low	62.2	Low	104 Å²	104	89.8 Å²	89.8	73%	0.727	50%	0.503	S	S	*	.			trans	-47.3	138.7	167.3	-178.7	0	0	0	0	110.9	N322	S320-N322 PolarHBondContact O-N 2.89Å
321	P	48	Very low	64.1	Low	72 Å²	72	86.8 Å²	86.8	47%	0.468	48%	0.482	S	S	.	.			trans	-64.8	113	-176.8	25.3	-32.6	0	0	0	109.8	F30 A323	F30-P321 HydrophobicContact CD1-CB 3.9Å; F30-P321 HydrophobicContact CD1-CG 3.62Å; F30-P321 HydrophobicContact CE1-CB 4.03Å; F30-P321 HydrophobicContact CE1-CG 3.58Å; P321-A323 PolarHBondContact O-N 3.19Å
322	N	54.9	Low	66.1	Low	133 Å²	133	81.8 Å²	81.8	71%	0.711	46%	0.456	S	S	*	.			trans	-49.2	114.1	167.6	-89.6	-20.2	0	0	0	108.2	Q307 S320 R324	Q307-N322 PolarHBondContact NE2-O 3.4Å; S320-N322 PolarHBondContact O-N 2.89Å; N322-R324 PolarHBondContact O-N 2.99Å
323	A	67.6	Low	68.3	Low	72 Å²	72	75.4 Å²	75.4	60%	0.595	44%	0.435	S	S	*	.			trans	-47.7	133.8	174.6	0	0	0	0	0	109.1	P321 T325	P321-A323 PolarHBondContact O-N 3.19Å; A323-T325 PolarHBondContact O-N 2.87Å
324	R	82.1	Confident	70.7	Confident	75 Å²	75	75.4 Å²	75.4	28%	0.283	43%	0.428	S	S	.	.			trans	-57.8	113.3	-176.7	-174.9	-173.5	-176.3	-172.5	4.6	108.9	H251 N302 S303 N322	H251-R324 WeakPolarHBondContact ND1-CD 3.44Å; H251-R324 PolarHBondContact ND1-NE 3.13Å; H251-R324 PolarHBondContact O-NH2 3.02Å; N302-R324 PolarHBondContact OD1-NH2 3.29Å; S303-R324 PolarHBondContact OG-NE 3Å; S303-R324 PolarHBondContact OG-NH2 2.95Å; N322-R324 PolarHBondContact O-N 2.99Å
325	T	89.8	Confident	73.1	Confident	84 Å²	84	77.2 Å²	77.2	52%	0.515	43%	0.431	S	S	.	.			trans	-80.1	131.5	177.4	45.4	0	0	0	0	109.9	S303 R306 A323	S303-T325 WeakPolarHBondContact CB-O 3.46Å; R306-T325 PolarHBondContact NH1-O 3.3Å; R306-T325 PolarHBondContact NH1-OG1 2.86Å; A323-T325 PolarHBondContact O-N 2.87Å
326	S	94.2	Very high	75.6	Confident	41 Å²	41	70.4 Å²	70.4	29%	0.287	40%	0.396	S	S	.	.			trans	-74.2	178.7	172.8	53.9	0	0	0	0	111.1	S249 V250	S249-S326 VanDerWaalsContact OG-CB 3.3Å; S249-S326 WeakPolarHBondContact OG-CB 3.43Å; S249-S326 PolarHBondContact OG-OG 3.39Å; V250-S326 CarbonylContact O-C 3.45Å; V250-S326 WeakPolarHBondContact O-CA 3.23Å; V250-S326 WeakPolarHBondContact O-CB 3.36Å
327	F	95	Very high	78.2	Confident	2 Å²	2	62 Å²	62	1%	0.009	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-141.5	152.6	171.1	56.1	-88.2	0	0	0	109.9	M180 V182 I186 V250 H251 L253 L301 V329	M180-F327 CarbonylContact O-C 3.55Å; M180-F327 WeakPolarHBondContact O-CA 3.44Å; V182-F327 HydrophobicContact CG2-CB 4.26Å; V182-F327 HydrophobicContact CG2-CD2 4.27Å; I186-F327 HydrophobicContact CD1-CB 4.03Å; I186-F327 HydrophobicContact CD1-CD1 3.64Å; I186-F327 HydrophobicContact CD1-CD2 3.95Å; I186-F327 HydrophobicContact CD1-CE1 4.04Å; I186-F327 HydrophobicContact CD1-CE2 4.3Å; I186-F327 HydrophobicContact CD1-CG 3.6Å; I186-F327 HydrophobicContact CD1-CZ 4.35Å; V250-F327 HydrophobicContact CB-CE2 4.4Å; V250-F327 WeakPolarHBondContact CB-O 3.31Å; V250-F327 HydrophobicContact CG1-CE2 4.13Å; V250-F327 HydrophobicContact CG1-CZ 4.11Å; V250-F327 PolarHBondContact N-O 3.26Å; V250-F327 VanDerWaalsContact O-CD1 3.32Å; V250-F327 WeakPolarHBondContact O-CD1 3.33Å; V250-F327 PolarHBondContact O-N 3.02Å; H251-F327 WeakPolarHBondContact O-CE1 3.35Å; L253-F327 HydrophobicContact CB-CE2 4.18Å; L253-F327 HydrophobicContact CB-CZ 4.36Å; L301-F327 HydrophobicContact CB-CE2 4.04Å; L301-F327 HydrophobicContact CB-CZ 3.74Å; L301-F327 HydrophobicContact CD2-CD2 4.45Å; L301-F327 HydrophobicContact CD2-CE2 4Å; L301-F327 HydrophobicContact CD2-CZ 4.5Å; F327-V329 HydrophobicContact CD2-CG1 3.73Å; F327-V329 HydrophobicContact CE2-CG1 3.45Å; F327-V329 VanDerWaalsContact CE2-CG1 3.45Å
328	S	95.7	Very high	81.3	Confident	7 Å²	7	60.8 Å²	60.8	5%	0.049	36%	0.363	C	S	.	.			trans	-83.7	132.3	174.8	-175.8	0	0	0	0	110.5	D178 M180 V182 P247 T330	D178-S328 PolarHBondContact O-OG 2.77Å; M180-S328 PolarHBondContact O-N 2.7Å; V182-S328 WeakPolarHBondContact CG2-O 3.3Å; P247-S328 WeakPolarHBondContact O-CA 3.45Å; S328-T330 PolarHBondContact OG-N 2.99Å; S328-T330 PolarHBondContact OG-OG1 3.48Å
329	V	95.8	Very high	84.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	33%	0.326	C	S	.	.			trans	-104.6	0.2	173.9	-59.5	0	0	0	0	112.3	Y242 P247 V250 L253 F327 G331 I332 L333	Y242-V329 HydrophobicContact CD1-CG2 4.24Å; Y242-V329 HydrophobicContact CG-CG2 4.38Å; P247-V329 HydrophobicContact CB-CG2 3.92Å; P247-V329 WeakPolarHBondContact O-CG2 3.48Å; P247-V329 PolarHBondContact O-N 3.43Å; V250-V329 HydrophobicContact CB-CG1 3.88Å; V250-V329 HydrophobicContact CB-CG2 4.39Å; V250-V329 HydrophobicContact CG1-CG1 3.96Å; V250-V329 HydrophobicContact CG2-CG1 4.11Å; V250-V329 HydrophobicContact CG2-CG2 3.68Å; L253-V329 HydrophobicContact CB-CG1 4.16Å; L253-V329 HydrophobicContact CD1-CB 4.23Å; L253-V329 HydrophobicContact CD1-CG1 3.99Å; L253-V329 HydrophobicContact CD2-CG1 4.14Å; L253-V329 HydrophobicContact CG-CG1 4.34Å; F327-V329 HydrophobicContact CD2-CG1 3.73Å; F327-V329 HydrophobicContact CE2-CG1 3.45Å; F327-V329 VanDerWaalsContact CE2-CG1 3.45Å; V329-G331 VanDerWaalsContact C-N 3.34Å; V329-G331 PolarHBondContact O-N 2.93Å; V329-I332 HydrophobicContact CG1-CD1 4.45Å; V329-I332 WeakPolarHBondContact O-CB 2.99Å; V329-I332 PolarHBondContact O-N 2.76Å; V329-L333 HydrophobicContact CB-CG 4.44Å; V329-L333 HydrophobicContact CG2-CD1 3.86Å; V329-L333 HydrophobicContact CG2-CG 4.19Å; V329-L333 WeakPolarHBondContact O-CG 3.37Å; V329-L333 PolarHBondContact O-N 3.26Å
330	T	96	Very high	87.3	Confident	32 Å²	32	54.6 Å²	54.6	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-53.2	-49.6	-176.6	-58.3	0	0	0	0	111.9	S328 L333 K334	S328-T330 PolarHBondContact OG-N 2.99Å; S328-T330 PolarHBondContact OG-OG1 3.48Å; T330-L333 PolarHBondContact O-N 2.92Å; T330-K334 WeakPolarHBondContact O-CG 3.42Å; T330-K334 PolarHBondContact O-N 3.4Å; T330-K334 VanDerWaalsContact O-N 3.16Å
331	G	96.7	Very high	89.8	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-64	-41.6	176.4	0	0	0	0	0	112.9	D178 F179 V329 L333 K334 I335	D178-G331 PolarHBondContact O-N 3.46Å; F179-G331 VanDerWaalsContact CZ-CA 3.45Å; F179-G331 WeakPolarHBondContact CZ-O 3.43Å; V329-G331 VanDerWaalsContact C-N 3.34Å; V329-G331 PolarHBondContact O-N 2.93Å; G331-L333 PolarHBondContact O-N 3.34Å; G331-K334 PolarHBondContact O-N 3.22Å; G331-I335 WeakPolarHBondContact O-CG1 3.49Å; G331-I335 PolarHBondContact O-N 3.27Å; G331-I335 VanDerWaalsContact O-N 3.15Å
332	I	97.6	Very high	92.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-45	179.5	-54.7	178.9	0	0	0	110.7	F164 V168 F179 V182 L240 L253 L301 V329 K334 I335 A336 G337	F164-I332 HydrophobicContact CE2-CG2 4Å; F164-I332 HydrophobicContact CZ-CG2 3.75Å; V168-I332 HydrophobicContact CG1-CD1 3.87Å; V168-I332 HydrophobicContact CG1-CG1 3.8Å; V168-I332 HydrophobicContact CG2-CG1 4.4Å; V168-I332 HydrophobicContact CG2-CG2 3.99Å; F179-I332 HydrophobicContact CD1-CG1 3.86Å; F179-I332 HydrophobicContact CE1-CG1 3.76Å; V182-I332 HydrophobicContact CG1-CD1 4.22Å; V182-I332 HydrophobicContact CG2-CD1 3.97Å; L240-I332 HydrophobicContact CD1-CG2 3.75Å; L253-I332 HydrophobicContact CD2-CB 4.42Å; L253-I332 HydrophobicContact CD2-CD1 3.96Å; L253-I332 HydrophobicContact CD2-CG2 3.78Å; L301-I332 HydrophobicContact CD2-CD1 3.83Å; V329-I332 HydrophobicContact CG1-CD1 4.45Å; V329-I332 WeakPolarHBondContact O-CB 2.99Å; V329-I332 PolarHBondContact O-N 2.76Å; I332-K334 VanDerWaalsContact C-N 3.35Å; I332-K334 PolarHBondContact O-N 2.83Å; I332-I335 PolarHBondContact O-N 3.5Å; I332-A336 CarbonylContact O-C 3.5Å; I332-A336 WeakPolarHBondContact O-CA 2.92Å; I332-A336 PolarHBondContact O-N 2.89Å; I332-G337 PolarHBondContact O-N 2.75Å
333	L	96.7	Very high	94.2	Very high	50 Å²	50	46.2 Å²	46.2	26%	0.262	25%	0.246	S	C	.	.	H	α-helix	trans	-65.3	-37.2	178.5	-66.4	176.5	0	0	0	112	L240 Y242 P247 V329 T330 G331 G337	L240-L333 HydrophobicContact CB-CD2 3.87Å; Y242-L333 HydrophobicContact CD1-CD1 4.25Å; Y242-L333 HydrophobicContact CE1-CD1 3.78Å; P247-L333 HydrophobicContact CB-CD1 4.46Å; V329-L333 HydrophobicContact CB-CG 4.44Å; V329-L333 HydrophobicContact CG2-CD1 3.86Å; V329-L333 HydrophobicContact CG2-CG 4.19Å; V329-L333 WeakPolarHBondContact O-CG 3.37Å; V329-L333 PolarHBondContact O-N 3.26Å; T330-L333 PolarHBondContact O-N 2.92Å; G331-L333 PolarHBondContact O-N 3.34Å; L333-G337 WeakPolarHBondContact O-CA 3.33Å; L333-G337 PolarHBondContact O-N 2.8Å
334	K	95.8	Very high	95.6	Very high	137 Å²	137	47.1 Å²	47.1	60%	0.596	24%	0.241	S	C	*	.	H	α-helix	trans	-62.2	-43.5	176.1	-73.3	172	-174.5	173.3	0	112.4	D178 T330 G331 I332	D178-K334 VanDerWaalsContact CG-NZ 3.32Å; D178-K334 IonicContact OD1-NZ 2.67Å; D178-K334 PolarHBondContact OD1-NZ 3.34Å; D178-K334 IonicContact OD2-NZ 3.82Å; D178-K334 PolarHBondContact OD2-NZ 3.08Å; T330-K334 WeakPolarHBondContact O-CG 3.42Å; T330-K334 PolarHBondContact O-N 3.4Å; T330-K334 VanDerWaalsContact O-N 3.16Å; G331-K334 PolarHBondContact O-N 3.22Å; I332-K334 VanDerWaalsContact C-N 3.35Å; I332-K334 PolarHBondContact O-N 2.83Å
335	I	96	Very high	96.3	Very high	81 Å²	81	46 Å²	46	42%	0.415	24%	0.239	S	C	.	.	H	α-helix	trans	-92.3	-26.1	-173.4	69.8	171.6	0	0	0	113.8	V168 A171 F179 G331 I332	V168-I335 HydrophobicContact CG2-CD1 4.41Å; A171-I335 HydrophobicContact CB-CD1 3.64Å; F179-I335 HydrophobicContact CE1-CD1 4.11Å; F179-I335 HydrophobicContact CZ-CD1 3.89Å; F179-I335 HydrophobicContact CZ-CG1 4.43Å; G331-I335 WeakPolarHBondContact O-CG1 3.49Å; G331-I335 PolarHBondContact O-N 3.27Å; G331-I335 VanDerWaalsContact O-N 3.15Å; I332-I335 PolarHBondContact O-N 3.5Å
336	A	96.8	Very high	96.6	Very high	4 Å²	4	43.9 Å²	43.9	3%	0.033	23%	0.228	C	C	.	.	H	α-helix	trans	-144.5	15.4	-167.9	0	0	0	0	0	113.1	F164 L240 I332 N338 F339	F164-A336 HydrophobicContact CD2-CB 3.96Å; F164-A336 HydrophobicContact CE2-CB 3.64Å; L240-A336 HydrophobicContact CD1-CB 4.42Å; L240-A336 WeakPolarHBondContact CD1-O 3.36Å; L240-A336 WeakPolarHBondContact CG-O 3.31Å; I332-A336 CarbonylContact O-C 3.5Å; I332-A336 WeakPolarHBondContact O-CA 2.92Å; I332-A336 PolarHBondContact O-N 2.89Å; A336-N338 PolarHBondContact O-N 2.88Å; A336-N338 VanDerWaalsContact O-N 3.11Å; A336-F339 HydrophobicContact CB-CB 4.17Å; A336-F339 HydrophobicContact CB-CD2 4.28Å; A336-F339 WeakPolarHBondContact O-CB 3.33Å; A336-F339 PolarHBondContact O-N 2.89Å
337	G	96.4	Very high	96.7	Very high	20 Å²	20	42.4 Å²	42.4	21%	0.206	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-27.4	-179	0	0	0	0	0	114.3	D239 L240 I332 L333	D239-G337 CarbonylContact C-O 3.53Å; D239-G337 VanDerWaalsContact CA-O 3.29Å; D239-G337 WeakPolarHBondContact CA-O 3.27Å; L240-G337 PolarHBondContact N-O 3.21Å; I332-G337 PolarHBondContact O-N 2.75Å; L333-G337 WeakPolarHBondContact O-CA 3.33Å; L333-G337 PolarHBondContact O-N 2.8Å
338	N	97	Very high	96.7	Very high	111 Å²	111	46.4 Å²	46.4	59%	0.594	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.1	22.7	176.1	66.9	-19.3	0	0	0	113.5	D239 A336	D239-N338 VanDerWaalsContact OD1-CA 3.23Å; D239-N338 WeakPolarHBondContact OD1-CA 3.45Å; A336-N338 PolarHBondContact O-N 2.88Å; A336-N338 VanDerWaalsContact O-N 3.11Å
339	F	98.2	Very high	96.7	Very high	48 Å²	48	49.6 Å²	49.6	21%	0.211	25%	0.249	C	C	.	.			trans	-58.5	141.6	-175.8	-167.3	-84.8	0	0	0	111.6	N160 F164 K238 D239 A336 F341	N160-F339 HydrophobicContact CB-CE1 4.2Å; N160-F339 WeakPolarHBondContact O-CE1 3.45Å; N160-F339 WeakPolarHBondContact O-CZ 3.31Å; F164-F339 HydrophobicContact CB-CD1 4.27Å; F164-F339 HydrophobicContact CB-CD2 4.39Å; F164-F339 HydrophobicContact CB-CE1 3.86Å; F164-F339 HydrophobicContact CB-CE2 3.97Å; F164-F339 HydrophobicContact CB-CZ 3.7Å; F164-F339 HydrophobicContact CD2-CB 4.3Å; F164-F339 HydrophobicContact CD2-CD1 4.27Å; F164-F339 AromaticContact CD2-CD2 3.92Å; F164-F339 HydrophobicContact CD2-CD2 3.92Å; F164-F339 HydrophobicContact CD2-CE2 4.31Å; F164-F339 AromaticContact CD2-CG 3.9Å; F164-F339 HydrophobicContact CD2-CG 3.9Å; K238-F339 WeakPolarHBondContact CA-O 3.1Å; D239-F339 PolarHBondContact N-O 3.4Å; A336-F339 HydrophobicContact CB-CB 4.17Å; A336-F339 HydrophobicContact CB-CD2 4.28Å; A336-F339 WeakPolarHBondContact O-CB 3.33Å; A336-F339 PolarHBondContact O-N 2.89Å; F339-F341 HydrophobicContact CB-CE2 4.43Å; F339-F341 AromaticContact CD1-CD1 3.94Å; F339-F341 HydrophobicContact CD1-CD1 3.94Å; F339-F341 HydrophobicContact CD1-CD2 4.02Å; F339-F341 AromaticContact CD1-CE1 3.69Å; F339-F341 HydrophobicContact CD1-CE1 3.69Å; F339-F341 AromaticContact CD1-CE2 3.78Å; F339-F341 HydrophobicContact CD1-CE2 3.78Å; F339-F341 HydrophobicContact CD1-CG 4.1Å; F339-F341 AromaticContact CD1-CZ 3.6Å; F339-F341 HydrophobicContact CD1-CZ 3.6Å; F339-F341 AromaticContact CE1-CD1 3.89Å; F339-F341 HydrophobicContact CE1-CD1 3.89Å; F339-F341 AromaticContact CE1-CE1 3.8Å; F339-F341 HydrophobicContact CE1-CE1 3.8Å; F339-F341 HydrophobicContact CE1-CG 4.35Å; F339-F341 HydrophobicContact CE1-CZ 4.2Å; F339-F341 HydrophobicContact CG-CZ 4.39Å
340	Y	97.3	Very high	96.8	Very high	73 Å²	73	49.6 Å²	49.6	29%	0.286	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	109.9	-172.7	-155.7	-74.4	0	0	0	110	T236 K238 T342 E343	T236-Y340 HydrophobicContact CG2-CE2 4.28Å; T236-Y340 VanDerWaalsContact CG2-OH 3.23Å; T236-Y340 WeakPolarHBondContact CG2-OH 3.27Å; K238-Y340 HydrophobicContact CB-CD2 4.2Å; K238-Y340 HydrophobicContact CB-CE2 4.36Å; K238-Y340 HydrophobicContact CD-CD2 3.6Å; K238-Y340 HydrophobicContact CD-CE2 3.79Å; K238-Y340 HydrophobicContact CG-CD2 3.5Å; K238-Y340 HydrophobicContact CG-CE2 4Å; K238-Y340 HydrophobicContact CG-CG 4.13Å; Y340-T342 VanDerWaalsContact CE1-O 3.29Å; Y340-T342 WeakPolarHBondContact CE1-O 3.33Å; Y340-E343 HydrophobicContact CE1-CB 3.56Å; Y340-E343 HydrophobicContact CE1-CG 4.48Å; Y340-E343 VanDerWaalsContact CE1-N 3.35Å; Y340-E343 WeakPolarHBondContact OH-CA 3.26Å; Y340-E343 WeakPolarHBondContact OH-CB 3.36Å; Y340-E343 WeakPolarHBondContact OH-CG 3.49Å; Y340-E343 PolarHBondContact OH-OE1 3.44Å; Y340-E343 VanDerWaalsContact OH-OE1 3.07Å
341	F	98.3	Very high	96.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-40.2	-178.6	-66	-83.9	0	0	0	112	V157 N160 F161 F164 I237 L240 A255 M298 L300 F339	V157-F341 HydrophobicContact CG1-CB 4.4Å; N160-F341 PolarHBondContact ND2-O 3.28Å; F161-F341 HydrophobicContact CB-CD1 4.36Å; F161-F341 HydrophobicContact CB-CE1 4.31Å; F161-F341 HydrophobicContact CD2-CE1 4.08Å; F164-F341 HydrophobicContact CB-CE1 4.15Å; F164-F341 HydrophobicContact CD1-CE1 4.47Å; F164-F341 HydrophobicContact CD1-CZ 4.41Å; F164-F341 HydrophobicContact CD2-CZ 4.33Å; F164-F341 HydrophobicContact CG-CE1 4.22Å; F164-F341 HydrophobicContact CG-CZ 4.17Å; I237-F341 HydrophobicContact CB-CB 4.13Å; I237-F341 HydrophobicContact CG2-CB 4.03Å; I237-F341 HydrophobicContact CG2-CD2 4.12Å; I237-F341 HydrophobicContact CG2-CG 4.37Å; I237-F341 WeakPolarHBondContact O-CB 3.44Å; I237-F341 PolarHBondContact O-N 2.99Å; L240-F341 HydrophobicContact CD2-CE2 3.84Å; L240-F341 HydrophobicContact CD2-CZ 4.14Å; A255-F341 HydrophobicContact CB-CD2 3.69Å; A255-F341 HydrophobicContact CB-CE2 3.53Å; A255-F341 HydrophobicContact CB-CZ 4.37Å; M298-F341 HydrophobicContact CE-CD1 4.37Å; M298-F341 HydrophobicContact CE-CG 4.24Å; L300-F341 HydrophobicContact CD1-CE1 4.48Å; L300-F341 HydrophobicContact CD1-CE2 4.03Å; L300-F341 HydrophobicContact CD1-CZ 3.57Å; L300-F341 HydrophobicContact CD2-CE1 4.04Å; L300-F341 HydrophobicContact CD2-CE2 4.49Å; L300-F341 HydrophobicContact CD2-CZ 3.87Å; L300-F341 HydrophobicContact CG-CZ 4.38Å; F339-F341 HydrophobicContact CB-CE2 4.43Å; F339-F341 AromaticContact CD1-CD1 3.94Å; F339-F341 HydrophobicContact CD1-CD1 3.94Å; F339-F341 HydrophobicContact CD1-CD2 4.02Å; F339-F341 AromaticContact CD1-CE1 3.69Å; F339-F341 HydrophobicContact CD1-CE1 3.69Å; F339-F341 AromaticContact CD1-CE2 3.78Å; F339-F341 HydrophobicContact CD1-CE2 3.78Å; F339-F341 HydrophobicContact CD1-CG 4.1Å; F339-F341 AromaticContact CD1-CZ 3.6Å; F339-F341 HydrophobicContact CD1-CZ 3.6Å; F339-F341 AromaticContact CE1-CD1 3.89Å; F339-F341 HydrophobicContact CE1-CD1 3.89Å; F339-F341 AromaticContact CE1-CE1 3.8Å; F339-F341 HydrophobicContact CE1-CE1 3.8Å; F339-F341 HydrophobicContact CE1-CG 4.35Å; F339-F341 HydrophobicContact CE1-CZ 4.2Å; F339-F341 HydrophobicContact CG-CZ 4.39Å
342	T	98.2	Very high	96.9	Very high	5 Å²	5	48.4 Å²	48.4	3%	0.031	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	152.9	174.9	-162.3	0	0	0	0	113.1	V157 T236 I237 Y340 Q345 F347	V157-T342 HydrophobicContact CG2-CG2 3.64Å; T236-T342 WeakPolarHBondContact CA-O 3.28Å; I237-T342 HydrophobicContact CB-CG2 4.07Å; I237-T342 HydrophobicContact CD1-CG2 3.85Å; I237-T342 HydrophobicContact CG1-CG2 3.86Å; I237-T342 PolarHBondContact N-O 2.95Å; I237-T342 PolarHBondContact O-N 3Å; Y340-T342 VanDerWaalsContact CE1-O 3.29Å; Y340-T342 WeakPolarHBondContact CE1-O 3.33Å; T342-Q345 HydrophobicContact CG2-CB 3.68Å; T342-Q345 HydrophobicContact CG2-CG 4.36Å; T342-Q345 VanDerWaalsContact OG1-CB 3.24Å; T342-Q345 WeakPolarHBondContact OG1-CB 3.43Å; T342-F347 HydrophobicContact CG2-CZ 4.41Å
343	E	97.7	Very high	97	Very high	127 Å²	127	48.4 Å²	48.4	59%	0.593	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.7	-179	-172.2	141.3	-138.2	0	0	109.7	Y340 Q345	Y340-E343 HydrophobicContact CE1-CB 3.56Å; Y340-E343 HydrophobicContact CE1-CG 4.48Å; Y340-E343 VanDerWaalsContact CE1-N 3.35Å; Y340-E343 WeakPolarHBondContact OH-CA 3.26Å; Y340-E343 WeakPolarHBondContact OH-CB 3.36Å; Y340-E343 WeakPolarHBondContact OH-CG 3.49Å; Y340-E343 PolarHBondContact OH-OE1 3.44Å; Y340-E343 VanDerWaalsContact OH-OE1 3.07Å; E343-Q345 PolarHBondContact O-N 3.45Å
344	N	96.6	Very high	97	Very high	92 Å²	92	47.9 Å²	47.9	49%	0.492	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	44.8	35.8	171.3	-70.1	-45.8	0	0	0	113.5	L235 T236	L235-N344 PolarHBondContact O-N 2.78Å; T236-N344 PolarHBondContact OG1-N 3.18Å
345	Q	97.4	Very high	96.9	Very high	50 Å²	50	44.5 Å²	44.5	23%	0.234	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	131.1	-175.6	173.6	63.4	59.1	0	0	108.8	K234 L235 T342 E343 F347	K234-Q345 WeakPolarHBondContact CA-O 3.47Å; L235-Q345 PolarHBondContact N-O 3.46Å; L235-Q345 PolarHBondContact O-N 3.42Å; T342-Q345 HydrophobicContact CG2-CB 3.68Å; T342-Q345 HydrophobicContact CG2-CG 4.36Å; T342-Q345 VanDerWaalsContact OG1-CB 3.24Å; T342-Q345 WeakPolarHBondContact OG1-CB 3.43Å; E343-Q345 PolarHBondContact O-N 3.45Å; Q345-F347 HydrophobicContact CB-CE2 3.75Å; Q345-F347 HydrophobicContact CB-CZ 4.07Å; Q345-F347 HydrophobicContact CG-CD2 4.38Å; Q345-F347 HydrophobicContact CG-CE1 4.26Å; Q345-F347 HydrophobicContact CG-CE2 3.7Å; Q345-F347 HydrophobicContact CG-CZ 3.64Å; Q345-F347 WeakPolarHBondContact O-CD2 3.44Å; Q345-F347 VanDerWaalsContact O-CE2 3.27Å; Q345-F347 WeakPolarHBondContact O-CE2 3.29Å; Q345-F347 PolarHBondContact O-N 3.13Å
346	S	96.3	Very high	96.6	Very high	40 Å²	40	47.1 Å²	47.1	28%	0.28	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	125	176.6	-59.5	0	0	0	0	110.5	L233 H348	L233-S346 CarbonylContact O-C 3.6Å; L233-S346 WeakPolarHBondContact O-CA 3.04Å; S346-H348 WeakPolarHBondContact CB-NE2 3.33Å
347	F	96.4	Very high	96.4	Very high	11 Å²	11	48.2 Å²	48.2	5%	0.048	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130.3	171.2	-61.8	-87.7	0	0	0	109.8	L150 V152 P232 L233 L235 I237 T342 Q345	L150-F347 HydrophobicContact CD1-CB 3.66Å; L150-F347 HydrophobicContact CD1-CG 4.32Å; L150-F347 HydrophobicContact CD2-CB 4.21Å; L150-F347 HydrophobicContact CD2-CD1 4.43Å; L150-F347 HydrophobicContact CD2-CD2 4.48Å; L150-F347 HydrophobicContact CD2-CG 4.12Å; L150-F347 HydrophobicContact CG-CB 4.27Å; L150-F347 HydrophobicContact CG-CD1 4.44Å; L150-F347 HydrophobicContact CG-CG 4.42Å; V152-F347 HydrophobicContact CB-CE1 4.25Å; V152-F347 HydrophobicContact CG1-CE1 3.91Å; V152-F347 HydrophobicContact CG1-CZ 4.17Å; V152-F347 HydrophobicContact CG2-CE1 4.09Å; P232-F347 WeakPolarHBondContact CA-O 2.99Å; P232-F347 WeakPolarHBondContact CB-O 3.39Å; L233-F347 HydrophobicContact CB-CB 4.48Å; L233-F347 PolarHBondContact N-O 2.98Å; L233-F347 PolarHBondContact O-N 3.41Å; L235-F347 HydrophobicContact CB-CD2 3.92Å; L235-F347 HydrophobicContact CB-CE2 3.84Å; L235-F347 HydrophobicContact CD1-CD2 3.88Å; L235-F347 HydrophobicContact CD1-CE2 4.35Å; L235-F347 HydrophobicContact CG-CD2 4.02Å; L235-F347 HydrophobicContact CG-CE2 4.44Å; I237-F347 HydrophobicContact CD1-CZ 4.07Å; T342-F347 HydrophobicContact CG2-CZ 4.41Å; Q345-F347 HydrophobicContact CB-CE2 3.75Å; Q345-F347 HydrophobicContact CB-CZ 4.07Å; Q345-F347 HydrophobicContact CG-CD2 4.38Å; Q345-F347 HydrophobicContact CG-CE1 4.26Å; Q345-F347 HydrophobicContact CG-CE2 3.7Å; Q345-F347 HydrophobicContact CG-CZ 3.64Å; Q345-F347 WeakPolarHBondContact O-CD2 3.44Å; Q345-F347 VanDerWaalsContact O-CE2 3.27Å; Q345-F347 WeakPolarHBondContact O-CE2 3.29Å; Q345-F347 PolarHBondContact O-N 3.13Å
348	H	94.7	Very high	96.3	Very high	86 Å²	86	51.6 Å²	51.6	40%	0.398	26%	0.255	S	S	.	.			trans	-112	-5.8	-164.4	-67.2	-100.9	0	0	0	114.1	P232 S346 E372 F373	P232-H348 WeakPolarHBondContact CG-CE1 3.43Å; P232-H348 VanDerWaalsContact CG-ND1 3.28Å; P232-H348 WeakPolarHBondContact CG-ND1 3.49Å; S346-H348 WeakPolarHBondContact CB-NE2 3.33Å; H348-E372 CarbonylContact O-C 3.47Å; H348-E372 WeakPolarHBondContact O-CA 3.44Å; H348-F373 WeakPolarHBondContact O-CD2 3.41Å; H348-F373 PolarHBondContact O-N 2.93Å
349	Q	94.8	Very high	96.1	Very high	74 Å²	74	48.8 Å²	48.8	35%	0.346	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	142.3	-167.5	-62.3	176.3	-18.6	0	0	112.3	L150 P151 L371 E372	L150-Q349 WeakPolarHBondContact CD1-O 3.42Å; P151-Q349 WeakPolarHBondContact CD-O 3.4Å; Q349-L371 CarbonylContact C-O 3.38Å; Q349-L371 VanDerWaalsContact CA-O 3.29Å; Q349-L371 WeakPolarHBondContact CA-O 3.37Å; Q349-E372 HydrophobicContact CG-CG 4.11Å; Q349-E372 PolarHBondContact NE2-OE1 3.04Å
350	I	97.7	Very high	95.8	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	129.8	164.9	-68.1	172.7	0	0	0	107.1	I148 C149 L150 L197 F228 L266 I269 K370 L371 F373	I148-I350 HydrophobicContact CG2-CG2 3.48Å; I148-I350 VanDerWaalsContact CG2-CG2 3.48Å; C149-I350 CarbonylContact O-C 3.53Å; C149-I350 WeakPolarHBondContact O-CA 3.22Å; L150-I350 HydrophobicContact CD1-CG1 4.45Å; L197-I350 HydrophobicContact CD1-CD1 4.07Å; L197-I350 HydrophobicContact CD1-CG1 4.34Å; L197-I350 HydrophobicContact CD1-CG2 4Å; F228-I350 HydrophobicContact CE1-CD1 4.36Å; F228-I350 HydrophobicContact CZ-CD1 4.1Å; L266-I350 HydrophobicContact CD1-CD1 4.37Å; I269-I350 HydrophobicContact CD1-CD1 4.32Å; I269-I350 HydrophobicContact CG2-CD1 3.59Å; I350-K370 CarbonylContact O-C 3.55Å; I350-K370 VanDerWaalsContact O-CA 3.28Å; I350-K370 WeakPolarHBondContact O-CA 3.39Å; I350-L371 HydrophobicContact CB-CB 4.44Å; I350-L371 PolarHBondContact N-O 3.45Å; I350-L371 PolarHBondContact O-N 3.25Å; I350-F373 HydrophobicContact CD1-CE2 4.18Å; I350-F373 HydrophobicContact CD1-CZ 4Å; I350-F373 HydrophobicContact CG1-CE2 4.15Å; I350-F373 HydrophobicContact CG1-CZ 4.48Å
351	C	97.7	Very high	95.5	Very high	8 Å²	8	52.7 Å²	52.7	5%	0.054	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	135.6	-171.7	-60.7	0	0	0	0	111.4	I148 C149 P151 C369	I148-C351 CarbonylContact C-O 3.53Å; I148-C351 VanDerWaalsContact CA-O 3.24Å; I148-C351 WeakPolarHBondContact CA-O 3.33Å; C149-C351 PolarHBondContact N-O 2.95Å; C149-C351 PolarHBondContact O-N 3.19Å; P151-C351 HydrophobicContact CG-CB 4.18Å; C351-C369 WeakPolarHBondContact CA-O 3.3Å
352	L	98.4	Very high	95.2	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	120	158.1	174.3	62	0	0	0	108.2	H146 I148 L200 L202 A211 L215 C368 C369	H146-L352 HydrophobicContact CB-CD1 4.15Å; I148-L352 HydrophobicContact CG1-CB 4.33Å; I148-L352 HydrophobicContact CG1-CD1 3.87Å; L200-L352 HydrophobicContact CD1-CD1 3.54Å; L202-L352 HydrophobicContact CD1-CD1 4.48Å; A211-L352 HydrophobicContact CB-CD2 3.89Å; L215-L352 HydrophobicContact CD2-CB 4.19Å; L352-C368 HydrophobicContact CD2-CB 4.27Å; L352-C368 HydrophobicContact CG-CB 4.2Å; L352-C368 PolarHBondContact O-N 3.45Å; L352-C369 VanDerWaalsContact CB-SG 3.52Å; L352-C369 PolarHBondContact N-O 2.92Å; L352-C369 PolarHBondContact O-N 3.33Å
353	C	98.1	Very high	95	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	143.9	-175.2	-67.2	0	0	0	0	111.7	H146 F147 K366	H146-C353 CarbonylContact C-O 3.59Å; H146-C353 WeakPolarHBondContact CA-O 3.46Å; H146-C353 WeakPolarHBondContact CB-O 3.39Å; F147-C353 HydrophobicContact CD1-CB 4.26Å; F147-C353 HydrophobicContact CE1-CB 3.71Å; F147-C353 HydrophobicContact CE2-CB 4.32Å; F147-C353 HydrophobicContact CZ-CB 3.74Å; F147-C353 PolarHBondContact N-O 3.1Å; F147-C353 PolarHBondContact O-N 2.78Å; C353-K366 CarbonylContact C-O 3.17Å; C353-K366 VanDerWaalsContact CA-O 3.3Å; C353-K366 WeakPolarHBondContact CA-O 3.22Å
354	D	96.6	Very high	94.9	Very high	38 Å²	38	56 Å²	56	20%	0.203	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	124.5	162.2	-177.9	-24.2	0	0	0	108.4	L356 A357 K366	D354-L356 VanDerWaalsContact C-N 3.32Å; D354-L356 PolarHBondContact O-N 3.39Å; D354-L356 PolarHBondContact OD1-N 3.42Å; D354-A357 HydrophobicContact CB-CB 4.09Å; D354-A357 PolarHBondContact OD1-N 3.33Å; D354-A357 WeakPolarHBondContact OD2-CB 3.49Å; D354-K366 HydrophobicContact CB-CB 4.38Å; D354-K366 PolarHBondContact N-O 2.88Å
355	R	93.6	Very high	94.9	Very high	67 Å²	67	53.2 Å²	53.2	25%	0.253	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	-26.9	-177.2	-171.2	-168.9	173.2	166.7	5.7	112.9	P144 T145 F147 Y365	P144-R355 VanDerWaalsContact CD-NH1 3.3Å; P144-R355 WeakPolarHBondContact O-CD 3.13Å; P144-R355 PolarHBondContact O-NH1 3.24Å; T145-R355 WeakPolarHBondContact O-CB 3.31Å; T145-R355 PolarHBondContact O-N 3.11Å; F147-R355 HydrophobicContact CD1-CB 4.08Å; F147-R355 HydrophobicContact CD1-CG 4.41Å; F147-R355 HydrophobicContact CE1-CB 4.2Å; F147-R355 HydrophobicContact CE1-CG 4.44Å; R355-Y365 WeakPolarHBondContact O-CE1 3.35Å
356	L	90.1	Very high	94.8	Very high	135 Å²	135	56.1 Å²	56.1	71%	0.707	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	-20.7	-172.2	-59.2	-179.7	0	0	0	112.4	D354	D354-L356 VanDerWaalsContact C-N 3.32Å; D354-L356 PolarHBondContact O-N 3.39Å; D354-L356 PolarHBondContact OD1-N 3.42Å
357	A	93.2	Very high	94.8	Very high	27 Å²	27	55.4 Å²	55.4	22%	0.223	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	144.3	177.4	0	0	0	0	0	112.2	D354 Y365 K366	D354-A357 HydrophobicContact CB-CB 4.09Å; D354-A357 PolarHBondContact OD1-N 3.33Å; D354-A357 WeakPolarHBondContact OD2-CB 3.49Å; A357-Y365 CarbonylContact O-C 3.54Å; A357-Y365 WeakPolarHBondContact O-CA 3.3Å; A357-K366 HydrophobicContact CB-CB 3.68Å; A357-K366 HydrophobicContact CB-CD 4.02Å; A357-K366 HydrophobicContact CB-CG 4.49Å; A357-K366 PolarHBondContact O-N 3.37Å
358	F	93.6	Very high	94.8	Very high	91 Å²	91	55.9 Å²	55.9	40%	0.399	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	144.3	175.8	-62.8	-90.7	0	0	0	110.1	T192 F364 Y365	T192-F358 HydrophobicContact CG2-CD1 4.38Å; T192-F358 HydrophobicContact CG2-CE1 4.01Å; F358-F364 CarbonylContact C-O 3.54Å; F358-F364 VanDerWaalsContact CA-O 3.32Å; F358-F364 WeakPolarHBondContact CA-O 3.46Å; F358-Y365 HydrophobicContact CD1-CD1 4.29Å; F358-Y365 AromaticContact CE1-CD1 3.77Å; F358-Y365 HydrophobicContact CE1-CD1 3.77Å; F358-Y365 AromaticContact CE1-CE1 3.67Å; F358-Y365 HydrophobicContact CE1-CE1 3.67Å; F358-Y365 HydrophobicContact CE1-CG 4.38Å; F358-Y365 HydrophobicContact CZ-CD1 4.15Å; F358-Y365 AromaticContact CZ-CE1 3.82Å; F358-Y365 HydrophobicContact CZ-CE1 3.82Å
359	D	92.8	Very high	94.9	Very high	53 Å²	53	51.8 Å²	51.8	28%	0.283	28%	0.279	S	S	.	.			trans	-74.7	127.6	170.1	176.6	-95.1	0	0	0	110	S361 T362 Q363 F364	D359-S361 PolarHBondContact O-N 2.89Å; D359-S361 WeakPolarHBondContact OD1-CA 3.47Å; D359-S361 WeakPolarHBondContact OD1-CB 3.26Å; D359-S361 PolarHBondContact OD1-N 2.92Å; D359-S361 PolarHBondContact OD1-OG 2.95Å; D359-T362 WeakPolarHBondContact CB-OG1 3.49Å; D359-T362 PolarHBondContact OD1-N 3.24Å; D359-T362 PolarHBondContact OD1-OG1 3.15Å; D359-Q363 VanDerWaalsContact O-CA 3.22Å; D359-Q363 WeakPolarHBondContact O-CA 3.42Å; D359-Q363 PolarHBondContact O-N 3.39Å; D359-F364 PolarHBondContact N-O 2.9Å
360	S	91.5	Very high	94.9	Very high	105 Å²	105	49.3 Å²	49.3	73%	0.734	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-25.4	-174.6	53.4	0	0	0	0	113.6	Q363	S360-Q363 PolarHBondContact O-NE2 3.39Å
361	S	92.2	Very high	94.7	Very high	98 Å²	98	49.5 Å²	49.5	69%	0.685	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-47	-175.6	73.3	0	0	0	0	112.6	D359	D359-S361 PolarHBondContact O-N 2.89Å; D359-S361 WeakPolarHBondContact OD1-CA 3.47Å; D359-S361 WeakPolarHBondContact OD1-CB 3.26Å; D359-S361 PolarHBondContact OD1-N 2.92Å; D359-S361 PolarHBondContact OD1-OG 2.95Å
362	T	91.8	Very high	94.5	Very high	78 Å²	78	52 Å²	52	48%	0.479	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-18.3	-175.8	61	0	0	0	0	112.8	D359 F364	D359-T362 WeakPolarHBondContact CB-OG1 3.49Å; D359-T362 PolarHBondContact OD1-N 3.24Å; D359-T362 PolarHBondContact OD1-OG1 3.15Å; T362-F364 PolarHBondContact O-N 2.83Å; T362-F364 VanDerWaalsContact O-N 3.11Å; T362-F364 PolarHBondContact OG1-N 2.97Å
363	Q	93.6	Very high	94	Very high	107 Å²	107	52.4 Å²	52.4	50%	0.5	28%	0.281	S	S	.	.			trans	59.2	12.4	-170.6	-56.4	-69.3	-49	0	0	113.4	T192 D359 S360	T192-Q363 WeakPolarHBondContact CG2-O 3.03Å; D359-Q363 VanDerWaalsContact O-CA 3.22Å; D359-Q363 WeakPolarHBondContact O-CA 3.42Å; D359-Q363 PolarHBondContact O-N 3.39Å; S360-Q363 PolarHBondContact O-NE2 3.39Å
364	F	96.3	Very high	92.8	Very high	16 Å²	16	54.3 Å²	54.3	7%	0.07	29%	0.293	C	S	.	.	S	Bend	trans	-81.8	168.8	169.6	-162.5	-100.6	0	0	0	109.6	P151 T153 S191 H194 F358 D359 T362	P151-F364 HydrophobicContact CB-CE1 4.1Å; P151-F364 HydrophobicContact CB-CE2 4.09Å; P151-F364 HydrophobicContact CB-CZ 3.73Å; P151-F364 HydrophobicContact CG-CE1 4.06Å; P151-F364 HydrophobicContact CG-CZ 4.07Å; T153-F364 HydrophobicContact CG2-CD2 3.68Å; T153-F364 HydrophobicContact CG2-CE2 4Å; T153-F364 HydrophobicContact CG2-CG 4.38Å; S191-F364 VanDerWaalsContact O-CD2 3.28Å; S191-F364 WeakPolarHBondContact O-CD2 3.16Å; H194-F364 HydrophobicContact CB-CE2 4.36Å; H194-F364 HydrophobicContact CB-CZ 4.08Å; F358-F364 CarbonylContact C-O 3.54Å; F358-F364 VanDerWaalsContact CA-O 3.32Å; F358-F364 WeakPolarHBondContact CA-O 3.46Å; D359-F364 PolarHBondContact N-O 2.9Å; T362-F364 PolarHBondContact O-N 2.83Å; T362-F364 VanDerWaalsContact O-N 3.11Å; T362-F364 PolarHBondContact OG1-N 2.97Å
365	Y	96.2	Very high	91.1	Very high	34 Å²	34	57.9 Å²	57.9	13%	0.133	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	143.2	172.4	-62.4	-82.9	0	0	0	111.5	F147 T192 H194 R355 A357 F358 C367	F147-Y365 AromaticContact CE1-CD1 3.99Å; F147-Y365 HydrophobicContact CE1-CD1 3.99Å; F147-Y365 HydrophobicContact CE1-CD2 4.13Å; F147-Y365 HydrophobicContact CE1-CE1 4.3Å; F147-Y365 HydrophobicContact CE1-CE2 4.39Å; F147-Y365 AromaticContact CE1-CG 3.89Å; F147-Y365 HydrophobicContact CE1-CG 3.89Å; F147-Y365 HydrophobicContact CE2-CD2 4.46Å; F147-Y365 HydrophobicContact CZ-CD1 4.16Å; F147-Y365 AromaticContact CZ-CD2 3.45Å; F147-Y365 HydrophobicContact CZ-CD2 3.45Å; F147-Y365 VanDerWaalsContact CZ-CD2 3.45Å; F147-Y365 HydrophobicContact CZ-CE1 4.43Å; F147-Y365 AromaticContact CZ-CE2 3.73Å; F147-Y365 HydrophobicContact CZ-CE2 3.73Å; F147-Y365 AromaticContact CZ-CG 3.64Å; F147-Y365 HydrophobicContact CZ-CG 3.64Å; T192-Y365 HydrophobicContact CG2-CD2 4.34Å; T192-Y365 HydrophobicContact CG2-CE2 4.07Å; H194-Y365 AromaticContact CE1-CE2 3.84Å; H194-Y365 AromaticContact ND1-CE2 3.97Å; R355-Y365 WeakPolarHBondContact O-CE1 3.35Å; A357-Y365 CarbonylContact O-C 3.54Å; A357-Y365 WeakPolarHBondContact O-CA 3.3Å; F358-Y365 HydrophobicContact CD1-CD1 4.29Å; F358-Y365 AromaticContact CE1-CD1 3.77Å; F358-Y365 HydrophobicContact CE1-CD1 3.77Å; F358-Y365 AromaticContact CE1-CE1 3.67Å; F358-Y365 HydrophobicContact CE1-CE1 3.67Å; F358-Y365 HydrophobicContact CE1-CG 4.38Å; F358-Y365 HydrophobicContact CZ-CD1 4.15Å; F358-Y365 AromaticContact CZ-CE1 3.82Å; F358-Y365 HydrophobicContact CZ-CE1 3.82Å; Y365-C367 PolarHBondContact O-N 2.81Å
366	K	96.2	Very high	89.1	Confident	110 Å²	110	57.1 Å²	57.1	48%	0.478	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	122.8	178.5	-176.8	-177.5	177.4	-174.8	0	108.9	C353 D354 A357	C353-K366 CarbonylContact C-O 3.17Å; C353-K366 VanDerWaalsContact CA-O 3.3Å; C353-K366 WeakPolarHBondContact CA-O 3.22Å; D354-K366 HydrophobicContact CB-CB 4.38Å; D354-K366 PolarHBondContact N-O 2.88Å; A357-K366 HydrophobicContact CB-CB 3.68Å; A357-K366 HydrophobicContact CB-CD 4.02Å; A357-K366 HydrophobicContact CB-CG 4.49Å; A357-K366 PolarHBondContact O-N 3.37Å
367	C	96.1	Very high	86.5	Confident	26 Å²	26	54.1 Å²	54.1	18%	0.176	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	115.9	-179.4	179	0	0	0	0	109.9	Y365 C369	Y365-C367 PolarHBondContact O-N 2.81Å; C367-C369 PolarHBondContact SG-O 3.32Å; C367-C369 VanDerWaalsContact SG-O 3.36Å
368	C	96.3	Very high	83.7	Confident	20 Å²	20	60.1 Å²	60.1	14%	0.135	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	-38.7	173.8	-54.8	0	0	0	0	110.7	V208 L352	V208-C368 HydrophobicContact CG1-CB 4.04Å; L352-C368 HydrophobicContact CD2-CB 4.27Å; L352-C368 HydrophobicContact CG-CB 4.2Å; L352-C368 PolarHBondContact O-N 3.45Å
369	C	95.8	Very high	80.8	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	153.6	-179.2	93.3	0	0	0	0	111	C212 C351 L352 C367 M383	C212-C369 HydrophobicContact CB-CB 4.14Å; C212-C369 WeakPolarHBondContact SG-CB 3.35Å; C212-C369 VanDerWaalsContact SG-SG 3.63Å; C351-C369 WeakPolarHBondContact CA-O 3.3Å; L352-C369 VanDerWaalsContact CB-SG 3.52Å; L352-C369 PolarHBondContact N-O 2.92Å; L352-C369 PolarHBondContact O-N 3.33Å; C367-C369 PolarHBondContact SG-O 3.32Å; C367-C369 VanDerWaalsContact SG-O 3.36Å; C369-M383 HydrophobicContact CB-CE 3.3Å
370	K	95.1	Very high	78.1	Confident	23 Å²	23	65.5 Å²	65.5	10%	0.1	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	148.1	-178.8	59.4	174.1	179.1	164.5	0	112.7	I350 E372 M383	I350-K370 CarbonylContact O-C 3.55Å; I350-K370 VanDerWaalsContact O-CA 3.28Å; I350-K370 WeakPolarHBondContact O-CA 3.39Å; K370-E372 HydrophobicContact CD-CG 4.35Å; K370-E372 VanDerWaalsContact CE-OE1 3.29Å; K370-E372 WeakPolarHBondContact CE-OE1 3.47Å; K370-E372 IonicContact NZ-OE1 2.74Å; K370-E372 PolarHBondContact NZ-OE1 3.45Å; K370-M383 WeakPolarHBondContact O-CG 3.44Å
371	L	94.6	Very high	75.5	Confident	3 Å²	3	63.3 Å²	63.3	2%	0.016	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	132.4	168.5	-56	-179.2	0	0	0	108.1	L215 Y219 F228 Q349 I350 M383	L215-L371 HydrophobicContact CB-CD1 4.36Å; L215-L371 HydrophobicContact CB-CD2 4.28Å; L215-L371 HydrophobicContact CD2-CD1 4.49Å; L215-L371 HydrophobicContact CD2-CG 4.5Å; L215-L371 HydrophobicContact CG-CD1 4.32Å; Y219-L371 HydrophobicContact CD2-CB 4.25Å; Y219-L371 HydrophobicContact CD2-CD1 4.47Å; Y219-L371 HydrophobicContact CD2-CD2 4.07Å; Y219-L371 HydrophobicContact CD2-CG 4.5Å; Y219-L371 HydrophobicContact CG-CD2 4.1Å; F228-L371 HydrophobicContact CE1-CB 3.88Å; F228-L371 HydrophobicContact CE1-CD1 4.37Å; F228-L371 HydrophobicContact CZ-CB 4.16Å; F228-L371 HydrophobicContact CZ-CD1 3.78Å; Q349-L371 CarbonylContact C-O 3.38Å; Q349-L371 VanDerWaalsContact CA-O 3.29Å; Q349-L371 WeakPolarHBondContact CA-O 3.37Å; I350-L371 HydrophobicContact CB-CB 4.44Å; I350-L371 PolarHBondContact N-O 3.45Å; I350-L371 PolarHBondContact O-N 3.25Å; L371-M383 HydrophobicContact CD2-SD 4.28Å
372	E	92.4	Very high	73.1	Confident	60 Å²	60	64.2 Å²	64.2	28%	0.28	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	139	-179.5	-53.2	-161.1	142.5	0	0	111	H348 Q349 K370	H348-E372 CarbonylContact O-C 3.47Å; H348-E372 WeakPolarHBondContact O-CA 3.44Å; Q349-E372 HydrophobicContact CG-CG 4.11Å; Q349-E372 PolarHBondContact NE2-OE1 3.04Å; K370-E372 HydrophobicContact CD-CG 4.35Å; K370-E372 VanDerWaalsContact CE-OE1 3.29Å; K370-E372 WeakPolarHBondContact CE-OE1 3.47Å; K370-E372 IonicContact NZ-OE1 2.74Å; K370-E372 PolarHBondContact NZ-OE1 3.45Å
373	F	88.9	Confident	70.6	Confident	9 Å²	9	62.9 Å²	62.9	4%	0.039	36%	0.357	C	S	.	.			trans	-81	122.7	171.2	-64.6	-91	0	0	0	109.3	F228 G231 P232 L233 I269 H348 I350	F228-F373 HydrophobicContact CB-CD1 4.29Å; F228-F373 AromaticContact CD1-CD1 3.55Å; F228-F373 HydrophobicContact CD1-CD1 3.55Å; F228-F373 HydrophobicContact CD1-CD2 4.41Å; F228-F373 AromaticContact CD1-CE1 3.47Å; F228-F373 HydrophobicContact CD1-CE1 3.47Å; F228-F373 VanDerWaalsContact CD1-CE1 3.47Å; F228-F373 HydrophobicContact CD1-CE2 4.36Å; F228-F373 HydrophobicContact CD1-CG 4.04Å; F228-F373 AromaticContact CD1-CZ 3.89Å; F228-F373 HydrophobicContact CD1-CZ 3.89Å; F228-F373 HydrophobicContact CE1-CD1 4.21Å; F228-F373 HydrophobicContact CE1-CD2 4.47Å; F228-F373 AromaticContact CE1-CE1 3.78Å; F228-F373 HydrophobicContact CE1-CE1 3.78Å; F228-F373 HydrophobicContact CE1-CE2 4.07Å; F228-F373 AromaticContact CE1-CZ 3.69Å; F228-F373 HydrophobicContact CE1-CZ 3.69Å; F228-F373 HydrophobicContact CG-CD1 4.15Å; F228-F373 HydrophobicContact CG-CE1 4Å; F228-F373 HydrophobicContact CZ-CZ 4.37Å; G231-F373 VanDerWaalsContact O-CD1 3.22Å; G231-F373 WeakPolarHBondContact O-CD1 3.44Å; P232-F373 HydrophobicContact CG-CB 4.49Å; L233-F373 HydrophobicContact CD1-CE1 4.33Å; L233-F373 HydrophobicContact CD1-CE2 3.76Å; L233-F373 HydrophobicContact CD1-CZ 3.48Å; L233-F373 VanDerWaalsContact CD1-CZ 3.48Å; L233-F373 HydrophobicContact CD2-CE1 4.28Å; L233-F373 HydrophobicContact CD2-CZ 4.21Å; L233-F373 HydrophobicContact CG-CE1 3.97Å; L233-F373 HydrophobicContact CG-CE2 3.97Å; L233-F373 HydrophobicContact CG-CZ 3.58Å; I269-F373 HydrophobicContact CD1-CE1 4.1Å; I269-F373 HydrophobicContact CD1-CZ 3.97Å; H348-F373 WeakPolarHBondContact O-CD2 3.41Å; H348-F373 PolarHBondContact O-N 2.93Å; I350-F373 HydrophobicContact CD1-CE2 4.18Å; I350-F373 HydrophobicContact CD1-CZ 4Å; I350-F373 HydrophobicContact CG1-CE2 4.15Å; I350-F373 HydrophobicContact CG1-CZ 4.48Å
374	T	72.1	Confident	68.2	Low	41 Å²	41	61.1 Å²	61.1	25%	0.252	35%	0.35	S	S	.	.			trans	-80.3	126.9	179.2	52.6	0	0	0	0	111.1	G376	T374-G376 PolarHBondContact O-N 3.33Å
375	T	61.2	Low	65.7	Low	113 Å²	113	66.2 Å²	66.2	69%	0.693	37%	0.373	S	S	*	.	S	Bend	trans	-84.8	80	167.8	50.9	0	0	0	0	109.3	P232	P232-T375 HydrophobicContact CG-CG2 3.56Å
376	G	50.7	Low	63.3	Low	50 Å²	50	72.6 Å²	72.6	52%	0.515	41%	0.405	S	S	.	.	S	Bend	trans	136.5	122.4	179.3	0	0	0	0	0	111.1	T374 I378	T374-G376 PolarHBondContact O-N 3.33Å; G376-I378 PolarHBondContact O-N 3.41Å
377	G	35.1	Very low	61.7	Low	72 Å²	72	70.7 Å²	70.7	74%	0.742	40%	0.402	S	S	*	.	S	Bend	trans	-54.3	139.5	176.3	0	0	0	0	0	111.3
378	I	34.5	Very low	59.9	Low	153 Å²	153	73.1 Å²	73.1	79%	0.785	41%	0.414	S	S	*	.	S	Bend	trans	66.2	79.8	165.7	-41.3	172.6	0	0	0	114.3	G376	G376-I378 PolarHBondContact O-N 3.41Å
379	H	33.8	Very low	57.8	Low	168 Å²	168	76 Å²	76	78%	0.778	43%	0.429	S	S	*	.	S	Bend		163.8	136.9	127	-98.8	-74.9	0	0	0	112.4
380	C	34.8	Very low	55.6	Low	89 Å²	89	80.5 Å²	80.5	60%	0.601	45%	0.454	S	S	*	.			trans	69.7	80	158.4	-126.7	0	0	0	0	118.2	H382	C380-H382 PolarHBondContact O-N 3.31Å; C380-H382 VanDerWaalsContact O-N 3.14Å; C380-H382 PolarHBondContact O-ND1 3.32Å; C380-H382 PolarHBondContact SG-CE1 2.82Å
381	S	38.4	Very low	53.1	Low	59 Å²	59	84.1 Å²	84.1	41%	0.413	48%	0.476	S	S	.	.			trans	-64.1	104.6	156	37.9	0	0	0	0	110.9	M383	S381-M383 PolarHBondContact O-N 3.19Å
382	H	40.6	Very low	50.4	Low	117 Å²	117	89.5 Å²	89.5	54%	0.542	51%	0.507	S	S	.	.			trans	-84.2	99.1	166.3	-77.2	65.5	0	0	0	108.5	C380 I384	C380-H382 PolarHBondContact O-N 3.31Å; C380-H382 VanDerWaalsContact O-N 3.14Å; C380-H382 PolarHBondContact O-ND1 3.32Å; C380-H382 PolarHBondContact SG-CE1 2.82Å; H382-I384 PolarHBondContact O-N 2.99Å
383	M	40.3	Very low	47.4	Very low	51 Å²	51	91.6 Å²	91.6	25%	0.251	52%	0.523	S	S	.	.			trans	-74.8	112.7	152.8	-87.7	-150.5	68.9	0	0	108.3	K216 C369 K370 L371 S381 K385	K216-M383 HydrophobicContact CB-SD 4.29Å; K216-M383 HydrophobicContact CD-SD 3.77Å; K216-M383 WeakPolarHBondContact CE-SD 3.5Å; K216-M383 HydrophobicContact CG-CE 4.29Å; K216-M383 HydrophobicContact CG-CG 4.34Å; K216-M383 HydrophobicContact CG-SD 3.03Å; K216-M383 WeakPolarHBondContact CG-SD 3.25Å; C369-M383 HydrophobicContact CB-CE 3.3Å; K370-M383 WeakPolarHBondContact O-CG 3.44Å; L371-M383 HydrophobicContact CD2-SD 4.28Å; S381-M383 PolarHBondContact O-N 3.19Å; M383-K385 PolarHBondContact O-N 2.89Å
384	I	43.6	Very low	44.2	Very low	70 Å²	70	97.9 Å²	97.9	36%	0.359	56%	0.561	S	S	.	*			trans	-88	103.2	165	-49.1	-179.2	0	0	0	105.8	H382 M386	H382-I384 PolarHBondContact O-N 2.99Å; I384-M386 HydrophobicContact CB-CG 4.37Å; I384-M386 HydrophobicContact CD1-CE 4.47Å; I384-M386 HydrophobicContact CG2-CE 4.17Å; I384-M386 HydrophobicContact CG2-CG 3.53Å; I384-M386 PolarHBondContact O-N 2.92Å
385	K	42.3	Very low	41.8	Very low	123 Å²	123	102.7 Å²	102.7	54%	0.535	59%	0.586	S	S	.	*			trans	-70.3	111.7	154.5	-169	179.9	-177.1	-176.6	0	103.8	E209 M383	E209-K385 IonicContact OE1-NZ 3.71Å; E209-K385 PolarHBondContact OE1-NZ 3.36Å; M383-K385 PolarHBondContact O-N 2.89Å
386	M	46.6	Very low	40.1	Very low	167 Å²	167	101.7 Å²	101.7	82%	0.823	58%	0.577	S	S	*	*			trans	-87.3	0	179.9	-77.8	-166.9	177.5	0	0	111.1	I384	I384-M386 HydrophobicContact CB-CG 4.37Å; I384-M386 HydrophobicContact CD1-CE 4.47Å; I384-M386 HydrophobicContact CG2-CE 4.17Å; I384-M386 HydrophobicContact CG2-CG 3.53Å; I384-M386 PolarHBondContact O-N 2.92Å

Retrieved 386 of 386 residues in 142.6 ms (Link to these results)

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