A0A5K4FBN0_SCHMA Loading...

Beta-1,4-galactosyltransferase

Catalyses the transfer of galactose onto proteins or lipids.

AlphaFold DB , UniProt , Accession A0A5K4FBN0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 361 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	54.4	Low	73	Confident	178 Å²	178	143.5 Å²	143.5	88%	0.877	66%	0.662	S	S	*	*				0	-47.2	0	-127.2	169.5	97	0	0	113.2	T3 L4 F5	M1-T3 PolarHBondContact O-N 3.39Å; M1-L4 PolarHBondContact O-N 3.31Å; M1-F5 HydrophobicContact CE-CE2 4.08Å; M1-F5 HydrophobicContact CG-CE2 4.46Å
2	F	58.4	Low	74.5	Confident	196 Å²	196	137.6 Å²	137.6	86%	0.86	64%	0.638	S	S	*	*	H	α-helix	trans	-60.1	-33.1	-177.2	-88.2	-85.2	0	0	0	116.5	K6	F2-K6 PolarHBondContact O-N 3.49Å
3	T	63.1	Low	75.8	Confident	106 Å²	106	134.7 Å²	134.7	65%	0.65	63%	0.629	S	S	*	*	H	α-helix	trans	-72.3	-34.8	-179.5	43.6	0	0	0	0	113.6	M1 K6 N7	M1-T3 PolarHBondContact O-N 3.39Å; T3-K6 PolarHBondContact O-N 3.31Å; T3-N7 PolarHBondContact O-N 3.47Å
4	L	63.4	Low	76.9	Confident	134 Å²	134	132.5 Å²	132.5	70%	0.702	62%	0.623	S	S	*	*	H	α-helix	trans	-66.9	-42.1	176.8	-86.7	145.9	0	0	0	111.9	M1 K6 N7 F8	M1-L4 PolarHBondContact O-N 3.31Å; L4-K6 PolarHBondContact O-N 2.98Å; L4-N7 PolarHBondContact O-N 3.07Å; L4-F8 WeakPolarHBondContact O-CB 3.28Å; L4-F8 PolarHBondContact O-N 3.32Å
5	F	69.5	Low	77.9	Confident	136 Å²	136	128.1 Å²	128.1	60%	0.596	61%	0.612	S	S	*	*	H	α-helix	trans	-64.2	-39.4	176.4	-86.8	-81.3	0	0	0	112.7	M1 F8 Y9	M1-F5 HydrophobicContact CE-CE2 4.08Å; M1-F5 HydrophobicContact CG-CE2 4.46Å; F5-F8 PolarHBondContact O-N 3.34Å; F5-Y9 PolarHBondContact O-N 3.48Å
6	K	73.6	Confident	78.9	Confident	155 Å²	155	126.6 Å²	126.6	67%	0.674	61%	0.608	S	S	*	*	H	α-helix	trans	-64.5	-42.9	179.6	-147.8	177.8	-174.1	-178.7	0	111.7	F2 T3 L4 Y9 I10	F2-K6 PolarHBondContact O-N 3.49Å; T3-K6 PolarHBondContact O-N 3.31Å; L4-K6 PolarHBondContact O-N 2.98Å; K6-Y9 PolarHBondContact O-N 3.27Å; K6-I10 WeakPolarHBondContact O-CD1 3.5Å; K6-I10 VanDerWaalsContact O-CG1 3.28Å; K6-I10 WeakPolarHBondContact O-CG1 3.45Å; K6-I10 PolarHBondContact O-N 2.94Å
7	N	78.4	Confident	79.8	Confident	103 Å²	103	124.8 Å²	124.8	55%	0.551	60%	0.602	S	S	*	*	H	α-helix	trans	-66.4	-37.4	175.6	-82	-15.2	0	0	0	112.7	T3 L4 R11	T3-N7 PolarHBondContact O-N 3.47Å; L4-N7 PolarHBondContact O-N 3.07Å; N7-R11 WeakPolarHBondContact O-CG 3.47Å; N7-R11 PolarHBondContact O-N 3.5Å
8	F	82.9	Confident	80.6	Confident	136 Å²	136	126.1 Å²	126.1	60%	0.596	61%	0.605	S	S	*	*	H	α-helix	trans	-63.8	-44.6	175.7	-171.3	-106.5	0	0	0	111.6	L4 F5 R11 I12	L4-F8 WeakPolarHBondContact O-CB 3.28Å; L4-F8 PolarHBondContact O-N 3.32Å; F5-F8 PolarHBondContact O-N 3.34Å; F8-R11 PolarHBondContact O-N 2.94Å; F8-I12 HydrophobicContact CD1-CD1 3.65Å; F8-I12 HydrophobicContact CE1-CD1 3.31Å; F8-I12 HydrophobicContact CE1-CG1 4.41Å; F8-I12 HydrophobicContact CG-CD1 4.43Å; F8-I12 HydrophobicContact CZ-CD1 3.82Å; F8-I12 WeakPolarHBondContact O-CG1 3.4Å; F8-I12 PolarHBondContact O-N 3.46Å; F8-I12 VanDerWaalsContact O-N 3.07Å
9	Y	85.9	Confident	81.3	Confident	160 Å²	160	124.3 Å²	124.3	63%	0.627	60%	0.597	S	S	*	*	H	α-helix	trans	-63.5	-42.9	177.3	-166.3	-94	0	0	0	112.6	F5 K6 R11 I12 L13	F5-Y9 PolarHBondContact O-N 3.48Å; K6-Y9 PolarHBondContact O-N 3.27Å; Y9-R11 PolarHBondContact O-N 3.29Å; Y9-I12 PolarHBondContact O-N 3.06Å; Y9-L13 HydrophobicContact CE1-CD1 4.14Å; Y9-L13 PolarHBondContact O-N 3.42Å
10	I	85.8	Confident	82	Confident	81 Å²	81	123.4 Å²	123.4	42%	0.415	60%	0.595	S	S	.	*	H	α-helix	trans	-61.9	-42.1	176.7	-68.4	164.1	0	0	0	111.2	K6 I12 L13 L14	K6-I10 WeakPolarHBondContact O-CD1 3.5Å; K6-I10 VanDerWaalsContact O-CG1 3.28Å; K6-I10 WeakPolarHBondContact O-CG1 3.45Å; K6-I10 PolarHBondContact O-N 2.94Å; I10-I12 PolarHBondContact O-N 3.45Å; I10-L13 PolarHBondContact O-N 3.3Å; I10-L14 HydrophobicContact CG2-CD1 3.82Å; I10-L14 HydrophobicContact CG2-CG 4.43Å; I10-L14 WeakPolarHBondContact O-CB 3.39Å; I10-L14 WeakPolarHBondContact O-CG 3.48Å; I10-L14 PolarHBondContact O-N 3.25Å
11	R	87.7	Confident	82.6	Confident	193 Å²	193	122.4 Å²	122.4	73%	0.728	59%	0.593	S	S	*	*	H	α-helix	trans	-63.1	-40.9	176.9	-76.6	-178.2	177.7	-163.1	-0.7	112.3	N7 F8 Y9 S15	N7-R11 WeakPolarHBondContact O-CG 3.47Å; N7-R11 PolarHBondContact O-N 3.5Å; F8-R11 PolarHBondContact O-N 2.94Å; Y9-R11 PolarHBondContact O-N 3.29Å; R11-S15 WeakPolarHBondContact O-CB 3.43Å; R11-S15 PolarHBondContact O-N 3.48Å
12	I	91.1	Very high	84.5	Confident	73 Å²	73	119.3 Å²	119.3	37%	0.374	58%	0.576	S	S	.	*	H	α-helix	trans	-63.3	-45.8	174.9	-69.7	170	0	0	0	110.4	F8 Y9 I10 L14 S15 L16	F8-I12 HydrophobicContact CD1-CD1 3.65Å; F8-I12 HydrophobicContact CE1-CD1 3.31Å; F8-I12 HydrophobicContact CE1-CG1 4.41Å; F8-I12 HydrophobicContact CG-CD1 4.43Å; F8-I12 HydrophobicContact CZ-CD1 3.82Å; F8-I12 WeakPolarHBondContact O-CG1 3.4Å; F8-I12 PolarHBondContact O-N 3.46Å; F8-I12 VanDerWaalsContact O-N 3.07Å; Y9-I12 PolarHBondContact O-N 3.06Å; I10-I12 PolarHBondContact O-N 3.45Å; I12-L14 PolarHBondContact O-N 2.91Å; I12-S15 PolarHBondContact O-N 2.95Å; I12-L16 HydrophobicContact CG2-CD1 3.82Å; I12-L16 HydrophobicContact CG2-CG 4.38Å; I12-L16 WeakPolarHBondContact O-CG 3.43Å; I12-L16 PolarHBondContact O-N 3.42Å
13	L	91.4	Very high	86.2	Confident	100 Å²	100	114.8 Å²	114.8	52%	0.524	56%	0.559	S	S	.	*	H	α-helix	trans	-62.4	-42.8	-179.6	-154.4	92.2	0	0	0	112	Y9 I10 L16 L17	Y9-L13 HydrophobicContact CE1-CD1 4.14Å; Y9-L13 PolarHBondContact O-N 3.42Å; I10-L13 PolarHBondContact O-N 3.3Å; L13-L16 PolarHBondContact O-N 3.07Å; L13-L17 WeakPolarHBondContact O-CB 3.36Å; L13-L17 PolarHBondContact O-N 3.07Å
14	L	91.2	Very high	87.7	Confident	104 Å²	104	114.8 Å²	114.8	55%	0.545	56%	0.555	S	S	.	*	H	α-helix	trans	-65	-40.6	175.8	-75.2	165.4	0	0	0	111.9	I10 I12 L17 F18	I10-L14 HydrophobicContact CG2-CD1 3.82Å; I10-L14 HydrophobicContact CG2-CG 4.43Å; I10-L14 WeakPolarHBondContact O-CB 3.39Å; I10-L14 WeakPolarHBondContact O-CG 3.48Å; I10-L14 PolarHBondContact O-N 3.25Å; I12-L14 PolarHBondContact O-N 2.91Å; L14-L17 PolarHBondContact O-N 2.92Å; L14-F18 WeakPolarHBondContact O-CB 3.38Å; L14-F18 PolarHBondContact O-N 3.49Å
15	S	91.7	Very high	89.2	Confident	66 Å²	66	111.5 Å²	111.5	46%	0.462	54%	0.543	S	S	.	.	H	α-helix	trans	-63	-44.6	175.5	178.3	0	0	0	0	111.6	R11 I12 L17 F18 I19	R11-S15 WeakPolarHBondContact O-CB 3.43Å; R11-S15 PolarHBondContact O-N 3.48Å; I12-S15 PolarHBondContact O-N 2.95Å; S15-L17 PolarHBondContact O-N 3.07Å; S15-F18 PolarHBondContact O-N 2.99Å; S15-I19 VanDerWaalsContact O-CG1 3.28Å; S15-I19 WeakPolarHBondContact O-CG1 3.32Å; S15-I19 PolarHBondContact O-N 2.98Å
16	L	94.2	Very high	90.3	Very high	105 Å²	105	109.8 Å²	109.8	55%	0.55	54%	0.539	S	S	.	.	H	α-helix	trans	-61.7	-42	175.4	-73.7	167.1	0	0	0	112.1	I12 L13 F18 I19 L20	I12-L16 HydrophobicContact CG2-CD1 3.82Å; I12-L16 HydrophobicContact CG2-CG 4.38Å; I12-L16 WeakPolarHBondContact O-CG 3.43Å; I12-L16 PolarHBondContact O-N 3.42Å; L13-L16 PolarHBondContact O-N 3.07Å; L16-F18 VanDerWaalsContact C-N 3.34Å; L16-F18 PolarHBondContact O-N 3.38Å; L16-I19 PolarHBondContact O-N 3.38Å; L16-L20 WeakPolarHBondContact O-CB 2.95Å; L16-L20 PolarHBondContact O-N 3.5Å
17	L	94	Very high	91.2	Very high	95 Å²	95	109.1 Å²	109.1	50%	0.497	54%	0.536	S	S	.	.	H	α-helix	trans	-62.4	-42	175.7	-175.2	70	0	0	0	111.6	L13 L14 S15 L20 L21	L13-L17 WeakPolarHBondContact O-CB 3.36Å; L13-L17 PolarHBondContact O-N 3.07Å; L14-L17 PolarHBondContact O-N 2.92Å; S15-L17 PolarHBondContact O-N 3.07Å; L17-L20 PolarHBondContact O-N 2.96Å; L17-L21 HydrophobicContact CG-CD1 4.12Å; L17-L21 WeakPolarHBondContact O-CB 3.3Å; L17-L21 PolarHBondContact O-N 3.42Å
18	F	93.8	Very high	91.8	Very high	149 Å²	149	108.8 Å²	108.8	65%	0.654	53%	0.534	S	S	*	.	H	α-helix	trans	-65	-41.8	178.2	-141.9	-86.5	0	0	0	111.7	L14 S15 L16 L21 H22	L14-F18 WeakPolarHBondContact O-CB 3.38Å; L14-F18 PolarHBondContact O-N 3.49Å; S15-F18 PolarHBondContact O-N 2.99Å; L16-F18 VanDerWaalsContact C-N 3.34Å; L16-F18 PolarHBondContact O-N 3.38Å; F18-L21 PolarHBondContact O-N 2.93Å; F18-H22 WeakPolarHBondContact O-CB 3.48Å; F18-H22 PolarHBondContact O-N 3.31Å
19	I	94.8	Very high	92	Very high	91 Å²	91	106.8 Å²	106.8	47%	0.467	53%	0.528	S	S	.	.	H	α-helix	trans	-62.5	-44.2	174.4	-67.7	164.6	0	0	0	110.4	S15 L16 L21 H22 I23	S15-I19 VanDerWaalsContact O-CG1 3.28Å; S15-I19 WeakPolarHBondContact O-CG1 3.32Å; S15-I19 PolarHBondContact O-N 2.98Å; L16-I19 PolarHBondContact O-N 3.38Å; I19-L21 PolarHBondContact O-N 3.31Å; I19-H22 PolarHBondContact O-N 2.97Å; I19-I23 HydrophobicContact CG2-CD1 3.81Å; I19-I23 HydrophobicContact CG2-CG1 4.44Å; I19-I23 VanDerWaalsContact O-CG1 3.3Å; I19-I23 WeakPolarHBondContact O-CG1 3.28Å; I19-I23 PolarHBondContact O-N 3.25Å
20	L	95.2	Very high	92.1	Very high	106 Å²	106	106.2 Å²	106.2	56%	0.555	53%	0.526	S	S	*	.	H	α-helix	trans	-60.9	-45.8	177.4	-173	73.7	0	0	0	111.9	L16 L17 H22 I23 L24	L16-L20 WeakPolarHBondContact O-CB 2.95Å; L16-L20 PolarHBondContact O-N 3.5Å; L17-L20 PolarHBondContact O-N 2.96Å; L20-H22 VanDerWaalsContact C-N 3.31Å; L20-H22 PolarHBondContact O-N 3.5Å; L20-I23 PolarHBondContact O-N 3.22Å; L20-L24 WeakPolarHBondContact O-CB 3.46Å; L20-L24 PolarHBondContact O-N 3.37Å
21	L	94.6	Very high	92	Very high	103 Å²	103	109.2 Å²	109.2	54%	0.539	54%	0.536	S	S	.	.	H	α-helix	trans	-60	-41.2	175.1	-83.2	156.3	0	0	0	111.7	L17 F18 I19 L24 C25	L17-L21 HydrophobicContact CG-CD1 4.12Å; L17-L21 WeakPolarHBondContact O-CB 3.3Å; L17-L21 PolarHBondContact O-N 3.42Å; F18-L21 PolarHBondContact O-N 2.93Å; I19-L21 PolarHBondContact O-N 3.31Å; L21-L24 PolarHBondContact O-N 3.3Å; L21-C25 WeakPolarHBondContact O-CB 3.5Å; L21-C25 PolarHBondContact O-N 3.45Å
22	H	93.7	Very high	91.4	Very high	114 Å²	114	105.9 Å²	105.9	53%	0.528	53%	0.529	S	S	.	.	H	α-helix	trans	-68	-39.8	178.8	-155.2	-49	0	0	0	112.2	F18 I19 L20 C25 L26	F18-H22 WeakPolarHBondContact O-CB 3.48Å; F18-H22 PolarHBondContact O-N 3.31Å; I19-H22 PolarHBondContact O-N 2.97Å; L20-H22 VanDerWaalsContact C-N 3.31Å; L20-H22 PolarHBondContact O-N 3.5Å; H22-C25 PolarHBondContact O-N 2.88Å; H22-L26 WeakPolarHBondContact O-CG 3.42Å; H22-L26 PolarHBondContact O-N 3.33Å
23	I	95.1	Very high	90.7	Very high	100 Å²	100	108 Å²	108	51%	0.513	54%	0.535	S	S	.	.	H	α-helix	trans	-63.5	-43.8	173.3	-68.6	166.8	0	0	0	110.4	I19 L20 C25 L26 F27	I19-I23 HydrophobicContact CG2-CD1 3.81Å; I19-I23 HydrophobicContact CG2-CG1 4.44Å; I19-I23 VanDerWaalsContact O-CG1 3.3Å; I19-I23 WeakPolarHBondContact O-CG1 3.28Å; I19-I23 PolarHBondContact O-N 3.25Å; L20-I23 PolarHBondContact O-N 3.22Å; I23-C25 VanDerWaalsContact C-N 3.33Å; I23-C25 PolarHBondContact O-N 2.91Å; I23-L26 PolarHBondContact O-N 2.96Å; I23-F27 WeakPolarHBondContact O-CB 3.43Å; I23-F27 PolarHBondContact O-N 2.92Å
24	L	94.8	Very high	89.7	Confident	106 Å²	106	104.9 Å²	104.9	56%	0.555	52%	0.52	S	S	*	.	H	α-helix	trans	-63.2	-40.7	178.7	-154.7	114	0	0	0	111.4	L20 L21 F27 I28	L20-L24 WeakPolarHBondContact O-CB 3.46Å; L20-L24 PolarHBondContact O-N 3.37Å; L21-L24 PolarHBondContact O-N 3.3Å; L24-F27 WeakPolarHBondContact O-CB 3.12Å; L24-F27 PolarHBondContact O-N 3.45Å; L24-I28 HydrophobicContact CD2-CD1 4.06Å; L24-I28 WeakPolarHBondContact O-CG1 3.43Å; L24-I28 PolarHBondContact O-N 2.95Å
25	C	93.7	Very high	88.7	Confident	66 Å²	66	106.9 Å²	106.9	45%	0.446	52%	0.522	S	S	.	.	H	α-helix	trans	-63.3	-46.1	175.1	-163.4	0	0	0	0	111.7	L21 H22 I23 F27 I28 I29	L21-C25 WeakPolarHBondContact O-CB 3.5Å; L21-C25 PolarHBondContact O-N 3.45Å; H22-C25 PolarHBondContact O-N 2.88Å; I23-C25 VanDerWaalsContact C-N 3.33Å; I23-C25 PolarHBondContact O-N 2.91Å; C25-F27 VanDerWaalsContact C-N 3.28Å; C25-F27 PolarHBondContact O-N 3.49Å; C25-I28 PolarHBondContact O-N 3.03Å; C25-I29 VanDerWaalsContact O-CG1 3.31Å; C25-I29 WeakPolarHBondContact O-CG1 3.39Å; C25-I29 PolarHBondContact O-N 3.39Å
26	L	93.5	Very high	87.3	Confident	99 Å²	99	109.8 Å²	109.8	52%	0.518	53%	0.528	S	S	.	.	H	α-helix	trans	-60.1	-38.1	174	-73.3	170.9	0	0	0	111.9	H22 I23 I29 Y30	H22-L26 WeakPolarHBondContact O-CG 3.42Å; H22-L26 PolarHBondContact O-N 3.33Å; I23-L26 PolarHBondContact O-N 2.96Å; L26-I29 PolarHBondContact O-N 3.43Å; L26-Y30 VanDerWaalsContact O-CB 3.24Å; L26-Y30 WeakPolarHBondContact O-CB 3.47Å; L26-Y30 PolarHBondContact O-N 3.29Å
27	F	92.5	Very high	85.7	Confident	141 Å²	141	109 Å²	109	62%	0.618	52%	0.524	S	S	*	.	H	α-helix	trans	-66.6	-40.4	177	-157.5	-93.3	0	0	0	112	I23 L24 C25 Y30 K31	I23-F27 WeakPolarHBondContact O-CB 3.43Å; I23-F27 PolarHBondContact O-N 2.92Å; L24-F27 WeakPolarHBondContact O-CB 3.12Å; L24-F27 PolarHBondContact O-N 3.45Å; C25-F27 VanDerWaalsContact C-N 3.28Å; C25-F27 PolarHBondContact O-N 3.49Å; F27-Y30 PolarHBondContact O-N 2.88Å; F27-K31 WeakPolarHBondContact O-CB 3.48Å; F27-K31 PolarHBondContact O-N 2.61Å
28	I	89.5	Confident	83.9	Confident	96 Å²	96	110.8 Å²	110.8	49%	0.492	53%	0.532	S	S	.	.	H	α-helix	trans	-63.2	-48.1	174.4	-68.2	164.6	0	0	0	110.4	L24 C25 Y30 K31 Q32	L24-I28 HydrophobicContact CD2-CD1 4.06Å; L24-I28 WeakPolarHBondContact O-CG1 3.43Å; L24-I28 PolarHBondContact O-N 2.95Å; C25-I28 PolarHBondContact O-N 3.03Å; I28-Y30 VanDerWaalsContact C-N 3.35Å; I28-Y30 PolarHBondContact O-N 3.24Å; I28-K31 PolarHBondContact O-N 3.31Å; I28-Q32 WeakPolarHBondContact O-CB 3.45Å; I28-Q32 PolarHBondContact O-N 3.37Å
29	I	88.7	Confident	81.7	Confident	95 Å²	95	110.7 Å²	110.7	49%	0.487	53%	0.529	S	S	.	.	H	α-helix	trans	-60.5	-45.5	177.9	-66.3	165.6	0	0	0	110.4	C25 L26 K31 Q32 F33	C25-I29 VanDerWaalsContact O-CG1 3.31Å; C25-I29 WeakPolarHBondContact O-CG1 3.39Å; C25-I29 PolarHBondContact O-N 3.39Å; L26-I29 PolarHBondContact O-N 3.43Å; I29-K31 PolarHBondContact O-N 3.29Å; I29-Q32 PolarHBondContact O-N 3.18Å; I29-F33 WeakPolarHBondContact O-CB 3.5Å; I29-F33 PolarHBondContact O-N 3.19Å
30	Y	88.1	Confident	78.8	Confident	148 Å²	148	113.5 Å²	113.5	58%	0.58	54%	0.537	S	S	*	.	H	α-helix	trans	-62.4	-41.6	177.1	-179.8	-101.5	0	0	0	112	L26 F27 I28 Q32 F33 T34	L26-Y30 VanDerWaalsContact O-CB 3.24Å; L26-Y30 WeakPolarHBondContact O-CB 3.47Å; L26-Y30 PolarHBondContact O-N 3.29Å; F27-Y30 PolarHBondContact O-N 2.88Å; I28-Y30 VanDerWaalsContact C-N 3.35Å; I28-Y30 PolarHBondContact O-N 3.24Å; Y30-Q32 VanDerWaalsContact C-N 3.32Å; Y30-Q32 PolarHBondContact O-N 2.82Å; Y30-F33 PolarHBondContact O-N 3.44Å; Y30-T34 HydrophobicContact CD1-CG2 4.05Å; Y30-T34 HydrophobicContact CD2-CG2 4.21Å; Y30-T34 HydrophobicContact CE1-CG2 3.56Å; Y30-T34 HydrophobicContact CE2-CG2 3.75Å; Y30-T34 HydrophobicContact CG-CG2 4.35Å; Y30-T34 WeakPolarHBondContact O-CB 3.46Å; Y30-T34 WeakPolarHBondContact O-CG2 3.46Å; Y30-T34 PolarHBondContact O-N 3.26Å; Y30-T34 PolarHBondContact O-OG1 2.97Å
31	K	82.3	Confident	76.2	Confident	143 Å²	143	111.4 Å²	111.4	62%	0.622	53%	0.53	S	S	*	.	H	α-helix	trans	-64.8	-38.1	176.4	-153.1	-173.7	-171.9	-173.3	0	111.4	F27 I28 I29 T34 Y35	F27-K31 WeakPolarHBondContact O-CB 3.48Å; F27-K31 PolarHBondContact O-N 2.61Å; I28-K31 PolarHBondContact O-N 3.31Å; I29-K31 PolarHBondContact O-N 3.29Å; K31-T34 WeakPolarHBondContact CA-OG1 3.23Å; K31-T34 PolarHBondContact O-OG1 3.45Å; K31-T34 VanDerWaalsContact O-OG1 3.14Å; K31-Y35 WeakPolarHBondContact O-CB 3.47Å; K31-Y35 PolarHBondContact O-N 3.23Å
32	Q	75.8	Confident	73.3	Confident	124 Å²	124	111.6 Å²	111.6	58%	0.579	54%	0.536	S	S	*	.	H	α-helix	trans	-69.4	-39.1	177	-153.9	171.8	4.4	0	0	111.5	I28 I29 Y30 Q36	I28-Q32 WeakPolarHBondContact O-CB 3.45Å; I28-Q32 PolarHBondContact O-N 3.37Å; I29-Q32 PolarHBondContact O-N 3.18Å; Y30-Q32 VanDerWaalsContact C-N 3.32Å; Y30-Q32 PolarHBondContact O-N 2.82Å; Q32-Q36 WeakPolarHBondContact O-CG 3.44Å; Q32-Q36 PolarHBondContact O-N 2.87Å
33	F	76.4	Confident	70.6	Confident	117 Å²	117	113.1 Å²	113.1	51%	0.513	55%	0.546	S	S	.	.	H	α-helix	trans	-70.1	-43.4	175.8	-170.5	-106.7	0	0	0	112.6	I29 Y30 Y35 Q36 I37	I29-F33 WeakPolarHBondContact O-CB 3.5Å; I29-F33 PolarHBondContact O-N 3.19Å; Y30-F33 PolarHBondContact O-N 3.44Å; F33-Y35 VanDerWaalsContact C-N 3.35Å; F33-Q36 CarbonylContact O-C 3.6Å; F33-Q36 WeakPolarHBondContact O-CB 3.32Å; F33-Q36 PolarHBondContact O-N 3.42Å; F33-Q36 VanDerWaalsContact O-N 3.13Å; F33-I37 HydrophobicContact CD1-CD1 3.59Å; F33-I37 HydrophobicContact CD1-CG1 4.43Å; F33-I37 HydrophobicContact CE1-CD1 3.22Å; F33-I37 HydrophobicContact CE1-CG1 4.22Å; F33-I37 HydrophobicContact CG-CD1 4.48Å; F33-I37 HydrophobicContact CZ-CD1 3.84Å; F33-I37 WeakPolarHBondContact O-CG1 3.32Å; F33-I37 PolarHBondContact O-N 3.3Å
34	T	70.8	Confident	67.8	Low	34 Å²	34	115 Å²	115	21%	0.209	55%	0.552	C	S	.	*	H	α-helix	trans	-67	-36.1	174.7	50.7	0	0	0	0	111.6	Y30 K31 Q36 I37 I38	Y30-T34 HydrophobicContact CD1-CG2 4.05Å; Y30-T34 HydrophobicContact CD2-CG2 4.21Å; Y30-T34 HydrophobicContact CE1-CG2 3.56Å; Y30-T34 HydrophobicContact CE2-CG2 3.75Å; Y30-T34 HydrophobicContact CG-CG2 4.35Å; Y30-T34 WeakPolarHBondContact O-CB 3.46Å; Y30-T34 WeakPolarHBondContact O-CG2 3.46Å; Y30-T34 PolarHBondContact O-N 3.26Å; Y30-T34 PolarHBondContact O-OG1 2.97Å; K31-T34 WeakPolarHBondContact CA-OG1 3.23Å; K31-T34 PolarHBondContact O-OG1 3.45Å; K31-T34 VanDerWaalsContact O-OG1 3.14Å; T34-Q36 VanDerWaalsContact C-N 3.32Å; T34-Q36 PolarHBondContact O-N 3.07Å; T34-I37 PolarHBondContact O-N 3.24Å; T34-I38 WeakPolarHBondContact O-CB 3.38Å; T34-I38 VanDerWaalsContact O-CG1 3.25Å; T34-I38 WeakPolarHBondContact O-CG1 3.35Å; T34-I38 PolarHBondContact O-N 3.14Å
35	Y	69.6	Low	65	Low	146 Å²	146	117.3 Å²	117.3	57%	0.573	57%	0.566	S	S	*	*	H	α-helix	trans	-58.2	-44.6	168.6	-170.3	-92.4	0	0	0	110.8	K31 F33 I37 Y39	K31-Y35 WeakPolarHBondContact O-CB 3.47Å; K31-Y35 PolarHBondContact O-N 3.23Å; F33-Y35 VanDerWaalsContact C-N 3.35Å; Y35-I37 PolarHBondContact O-N 3.44Å; Y35-Y39 HydrophobicContact CD1-CD2 4.04Å; Y35-Y39 AromaticContact CD2-CD2 3.86Å; Y35-Y39 HydrophobicContact CD2-CD2 3.86Å; Y35-Y39 AromaticContact CD2-CE2 3.67Å; Y35-Y39 HydrophobicContact CD2-CE2 3.67Å; Y35-Y39 AromaticContact CE1-CD2 3.93Å; Y35-Y39 HydrophobicContact CE1-CD2 3.93Å; Y35-Y39 HydrophobicContact CE1-CE2 4.27Å; Y35-Y39 AromaticContact CE2-CD2 3.75Å; Y35-Y39 HydrophobicContact CE2-CD2 3.75Å; Y35-Y39 AromaticContact CE2-CE2 3.31Å; Y35-Y39 HydrophobicContact CE2-CE2 3.31Å; Y35-Y39 HydrophobicContact CG-CD2 4Å; Y35-Y39 HydrophobicContact CG-CE2 4.3Å; Y35-Y39 AromaticContact CZ-CD2 3.78Å; Y35-Y39 AromaticContact CZ-CE2 3.63Å; Y35-Y39 WeakPolarHBondContact O-CB 3.43Å; Y35-Y39 VanDerWaalsContact O-CD2 3.24Å; Y35-Y39 WeakPolarHBondContact O-CD2 3.2Å; Y35-Y39 PolarHBondContact O-N 3.1Å
36	Q	63.2	Low	62.5	Low	127 Å²	127	119.8 Å²	119.8	59%	0.593	57%	0.571	S	S	*	*	H	α-helix	trans	-65.5	-32	174.8	-75.4	-176.9	-9.4	0	0	114.2	Q32 F33 T34 Y39 K40	Q32-Q36 WeakPolarHBondContact O-CG 3.44Å; Q32-Q36 PolarHBondContact O-N 2.87Å; F33-Q36 CarbonylContact O-C 3.6Å; F33-Q36 WeakPolarHBondContact O-CB 3.32Å; F33-Q36 PolarHBondContact O-N 3.42Å; F33-Q36 VanDerWaalsContact O-N 3.13Å; T34-Q36 VanDerWaalsContact C-N 3.32Å; T34-Q36 PolarHBondContact O-N 3.07Å; Q36-Y39 CarbonylContact O-C 3.52Å; Q36-K40 WeakPolarHBondContact O-CA 3.31Å; Q36-K40 PolarHBondContact O-N 3.28Å
37	I	59.5	Low	59.9	Low	89 Å²	89	125.4 Å²	125.4	46%	0.456	59%	0.585	S	S	.	*	H	α-helix	trans	-76.9	-44.8	177	-70.3	171.9	0	0	0	111.8	F33 T34 Y35 Y39 K40	F33-I37 HydrophobicContact CD1-CD1 3.59Å; F33-I37 HydrophobicContact CD1-CG1 4.43Å; F33-I37 HydrophobicContact CE1-CD1 3.22Å; F33-I37 HydrophobicContact CE1-CG1 4.22Å; F33-I37 HydrophobicContact CG-CD1 4.48Å; F33-I37 HydrophobicContact CZ-CD1 3.84Å; F33-I37 WeakPolarHBondContact O-CG1 3.32Å; F33-I37 PolarHBondContact O-N 3.3Å; T34-I37 PolarHBondContact O-N 3.24Å; Y35-I37 PolarHBondContact O-N 3.44Å; I37-Y39 PolarHBondContact O-N 3.2Å; I37-K40 WeakPolarHBondContact O-CB 3.37Å; I37-K40 PolarHBondContact O-N 2.98Å
38	I	55.5	Low	57.7	Low	133 Å²	133	129.5 Å²	129.5	68%	0.682	60%	0.598	S	S	*	*	H	α-helix	trans	-63.1	-36.9	177.5	-67.4	165.9	0	0	0	109.8	T34	T34-I38 WeakPolarHBondContact O-CB 3.38Å; T34-I38 VanDerWaalsContact O-CG1 3.25Å; T34-I38 WeakPolarHBondContact O-CG1 3.35Å; T34-I38 PolarHBondContact O-N 3.14Å
39	Y	47.6	Very low	55.8	Low	146 Å²	146	131 Å²	131	57%	0.573	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	17.9	173.6	-68.4	-79.9	0	0	0	113.6	Y35 Q36 I37 P41	Y35-Y39 HydrophobicContact CD1-CD2 4.04Å; Y35-Y39 AromaticContact CD2-CD2 3.86Å; Y35-Y39 HydrophobicContact CD2-CD2 3.86Å; Y35-Y39 AromaticContact CD2-CE2 3.67Å; Y35-Y39 HydrophobicContact CD2-CE2 3.67Å; Y35-Y39 AromaticContact CE1-CD2 3.93Å; Y35-Y39 HydrophobicContact CE1-CD2 3.93Å; Y35-Y39 HydrophobicContact CE1-CE2 4.27Å; Y35-Y39 AromaticContact CE2-CD2 3.75Å; Y35-Y39 HydrophobicContact CE2-CD2 3.75Å; Y35-Y39 AromaticContact CE2-CE2 3.31Å; Y35-Y39 HydrophobicContact CE2-CE2 3.31Å; Y35-Y39 HydrophobicContact CG-CD2 4Å; Y35-Y39 HydrophobicContact CG-CE2 4.3Å; Y35-Y39 AromaticContact CZ-CD2 3.78Å; Y35-Y39 AromaticContact CZ-CE2 3.63Å; Y35-Y39 WeakPolarHBondContact O-CB 3.43Å; Y35-Y39 VanDerWaalsContact O-CD2 3.24Å; Y35-Y39 WeakPolarHBondContact O-CD2 3.2Å; Y35-Y39 PolarHBondContact O-N 3.1Å; Q36-Y39 CarbonylContact O-C 3.52Å; I37-Y39 PolarHBondContact O-N 3.2Å; Y39-P41 WeakPolarHBondContact O-CD 3.24Å; Y39-P41 VanDerWaalsContact O-N 3.12Å
40	K	34.8	Very low	54.3	Low	150 Å²	150	132.6 Å²	132.6	65%	0.652	62%	0.621	S	S	*	*	S	Bend	trans	-62.7	118.5	168.9	-152.3	178.8	-164.8	-178.3	0	105.1	Q36 I37 T42	Q36-K40 WeakPolarHBondContact O-CA 3.31Å; Q36-K40 PolarHBondContact O-N 3.28Å; I37-K40 WeakPolarHBondContact O-CB 3.37Å; I37-K40 PolarHBondContact O-N 2.98Å; K40-T42 PolarHBondContact O-N 3.44Å
41	P	39.4	Very low	53.7	Low	62 Å²	62	131.9 Å²	131.9	40%	0.403	62%	0.617	S	S	.	*			trans	-59.1	112.1	-177.1	23.3	-32.5	0	0	0	107	Y39 I43 I343	Y39-P41 WeakPolarHBondContact O-CD 3.24Å; Y39-P41 VanDerWaalsContact O-N 3.12Å; P41-I43 PolarHBondContact O-N 2.94Å; P41-I343 HydrophobicContact CG-CG2 4.03Å
42	T	35.1	Very low	54	Low	108 Å²	108	131.9 Å²	131.9	66%	0.663	62%	0.622	S	S	*	*			trans	-56.4	112.9	163.5	33	0	0	0	0	105.2	K40 H44	K40-T42 PolarHBondContact O-N 3.44Å; T42-H44 PolarHBondContact O-N 3.44Å; T42-H44 PolarHBondContact OG1-CD2 2.93Å
43	I	36.1	Very low	54.8	Low	146 Å²	146	127.7 Å²	127.7	75%	0.749	61%	0.606	S	S	*	*			trans	-68.6	79.2	164.9	-59.9	167.5	0	0	0	104.1	P41 N45	P41-I43 PolarHBondContact O-N 2.94Å; I43-N45 PolarHBondContact O-N 2.96Å; I43-N45 VanDerWaalsContact O-N 3.11Å
44	H	35.8	Very low	55.7	Low	138 Å²	138	124 Å²	124	64%	0.639	59%	0.59	S	S	*	*			trans	-61.5	114.4	157	-79.1	-75.9	0	0	0	104.4	T42 E46	T42-H44 PolarHBondContact O-N 3.44Å; T42-H44 PolarHBondContact OG1-CD2 2.93Å; H44-E46 HydrophobicContact CB-CG 4.08Å; H44-E46 PolarHBondContact O-N 3.21Å
45	N	37	Very low	56.9	Low	155 Å²	155	123 Å²	123	83%	0.829	58%	0.584	S	S	*	*			trans	-57.7	73.3	145.4	-82.7	-16.4	0	0	0	105.9	I43 R47	I43-N45 PolarHBondContact O-N 2.96Å; I43-N45 VanDerWaalsContact O-N 3.11Å; N45-R47 VanDerWaalsContact C-N 3.29Å; N45-R47 PolarHBondContact O-N 2.88Å
46	E	41.6	Very low	58.3	Low	118 Å²	118	116 Å²	116	55%	0.551	56%	0.557	S	S	*	*			trans	-55.7	108.5	160.4	-78.9	-170.4	-178	0	0	102.7	H44 Y48 R51	H44-E46 HydrophobicContact CB-CG 4.08Å; H44-E46 PolarHBondContact O-N 3.21Å; E46-Y48 PolarHBondContact O-N 3.48Å; E46-Y48 VanDerWaalsContact O-N 3.12Å; E46-R51 IonicContact OE1-NH2 3.94Å; E46-R51 PolarHBondContact OE1-NH2 3.24Å; E46-R51 IonicContact OE2-CZ 2.94Å; E46-R51 IonicContact OE2-NH2 3.38Å; E46-R51 PolarHBondContact OE2-NH2 3.47Å
47	R	39.3	Very low	59.8	Low	217 Å²	217	113.6 Å²	113.6	82%	0.819	54%	0.543	S	S	*	.			trans	-35.8	127.2	154.6	-80.4	178.7	179.2	168.7	-0.1	105.3	N45 N49	N45-R47 VanDerWaalsContact C-N 3.29Å; N45-R47 PolarHBondContact O-N 2.88Å; R47-N49 PolarHBondContact O-N 3.37Å
48	Y	44.9	Very low	61.5	Low	228 Å²	228	112.1 Å²	112.1	89%	0.894	54%	0.536	S	S	*	.			trans	-56.8	77.4	176.3	-104.3	-97.4	0	0	0	108.5	E46 V50	E46-Y48 PolarHBondContact O-N 3.48Å; E46-Y48 VanDerWaalsContact O-N 3.12Å; Y48-V50 VanDerWaalsContact C-N 3.29Å; Y48-V50 PolarHBondContact O-N 2.91Å
49	N	49.7	Very low	63.4	Low	126 Å²	126	105.8 Å²	105.8	67%	0.674	50%	0.503	S	S	*	.			trans	-71.5	101.1	166.4	-77.8	-15.4	0	0	0	102	R47 R51	R47-N49 PolarHBondContact O-N 3.37Å; N49-R51 VanDerWaalsContact C-N 3.28Å; N49-R51 PolarHBondContact O-N 3.28Å
50	V	57.9	Low	65.6	Low	130 Å²	130	98.9 Å²	98.9	79%	0.788	48%	0.476	S	S	*	.			trans	-52	101.4	170.8	176.5	0	0	0	0	105.9	Y48 I52	Y48-V50 VanDerWaalsContact C-N 3.29Å; Y48-V50 PolarHBondContact O-N 2.91Å; V50-I52 PolarHBondContact O-N 3.24Å
51	R	75.5	Confident	68.4	Low	132 Å²	132	94 Å²	94	50%	0.498	46%	0.456	S	S	.	.			trans	-76.8	114.9	178.1	-69.2	-171.9	-168.1	-164	4.4	105.9	E46 N49 P53	E46-R51 IonicContact OE1-NH2 3.94Å; E46-R51 PolarHBondContact OE1-NH2 3.24Å; E46-R51 IonicContact OE2-CZ 2.94Å; E46-R51 IonicContact OE2-NH2 3.38Å; E46-R51 PolarHBondContact OE2-NH2 3.47Å; N49-R51 VanDerWaalsContact C-N 3.28Å; N49-R51 PolarHBondContact O-N 3.28Å; R51-P53 WeakPolarHBondContact O-CD 3.36Å
52	I	87.8	Confident	70.9	Confident	143 Å²	143	93.3 Å²	93.3	73%	0.733	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-66.9	122.3	172.5	-59.8	172.8	0	0	0	106.8	V50 Q54	V50-I52 PolarHBondContact O-N 3.24Å; I52-Q54 PolarHBondContact O-N 3.47Å
53	P	93.7	Very high	73.4	Confident	36 Å²	36	88.3 Å²	88.3	23%	0.234	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-60.1	131.5	177.1	-23.9	34.5	0	0	0	110.4	R51 Q200	R51-P53 WeakPolarHBondContact O-CD 3.36Å; P53-Q200 HydrophobicContact CB-CG 3.9Å
54	Q	94.9	Very high	75.6	Confident	40 Å²	40	85 Å²	85	19%	0.187	40%	0.403	C	S	.	.	B	Isolated β-bridge	trans	-60.9	143.1	179	-171	-179.1	32	0	0	110.4	I52 D58 I59 S106 L198 F199 Q200	I52-Q54 PolarHBondContact O-N 3.47Å; Q54-D58 HydrophobicContact CG-CB 3.75Å; Q54-I59 HydrophobicContact CG-CG1 3.83Å; Q54-I59 VanDerWaalsContact NE2-CG1 3.27Å; Q54-S106 PolarHBondContact OE1-OG 3.37Å; Q54-L198 WeakPolarHBondContact CB-O 3.29Å; Q54-L198 PolarHBondContact N-O 2.84Å; Q54-F199 HydrophobicContact CB-CD2 4.18Å; Q54-F199 CarbonylContact O-C 3.59Å; Q54-F199 WeakPolarHBondContact O-CA 3.43Å; Q54-F199 WeakPolarHBondContact O-CD2 3.32Å; Q54-Q200 PolarHBondContact O-N 3.46Å
55	T	97.1	Very high	78	Confident	12 Å²	12	86.3 Å²	86.3	7%	0.074	41%	0.407	C	S	.	.			trans	-104.6	166.4	171.2	63.1	0	0	0	0	110.8	Y57 D58 I59 Q135 Q200	T55-Y57 PolarHBondContact O-N 3.14Å; T55-Y57 WeakPolarHBondContact OG1-CB 3.18Å; T55-Y57 PolarHBondContact OG1-N 3.19Å; T55-D58 WeakPolarHBondContact CB-OD2 3.38Å; T55-D58 PolarHBondContact N-OD2 2.91Å; T55-D58 PolarHBondContact O-N 3.46Å; T55-D58 PolarHBondContact OG1-N 2.8Å; T55-D58 VanDerWaalsContact OG1-N 3.08Å; T55-D58 PolarHBondContact OG1-OD2 2.83Å; T55-I59 WeakPolarHBondContact O-CG1 2.96Å; T55-I59 PolarHBondContact O-N 3.45Å; T55-I59 VanDerWaalsContact O-N 3.08Å; T55-Q135 WeakPolarHBondContact CA-O 3.25Å; T55-Q135 WeakPolarHBondContact CB-O 3.46Å; T55-Q135 PolarHBondContact OG1-OE1 2.9Å; T55-Q200 HydrophobicContact CG2-CG 4.17Å
56	C	97.2	Very high	80.1	Confident	0 Å²	0	81.3 Å²	81.3	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-60.1	-31.8	169.1	-68.2	0	0	0	0	112.9	I59 C60 I108 I133 S134 Q135 K136 G137 C168	C56-I59 PolarHBondContact O-N 2.84Å; C56-C60 VanDerWaalsContact O-CB 3.29Å; C56-C60 WeakPolarHBondContact O-CB 3Å; C56-C60 PolarHBondContact O-N 3.11Å; C56-I108 HydrophobicContact CB-CD1 4.08Å; C56-I133 HydrophobicContact CB-CD1 4.09Å; C56-I133 VanDerWaalsContact O-CD1 3.31Å; C56-I133 WeakPolarHBondContact O-CD1 3.39Å; C56-S134 WeakPolarHBondContact CB-O 3.49Å; C56-Q135 PolarHBondContact N-O 3.35Å; C56-K136 VanDerWaalsContact SG-C 3.56Å; C56-G137 VanDerWaalsContact SG-CA 3.52Å; C56-G137 PolarHBondContact SG-N 2.79Å; C56-G137 VanDerWaalsContact SG-N 3.4Å; C56-C168 WeakPolarHBondContact CA-SG 3.36Å; C56-C168 HydrophobicContact CB-CB 3.85Å; C56-C168 WeakPolarHBondContact CB-SG 2.97Å; C56-C168 WeakPolarHBondContact SG-CB 3.43Å; C56-C168 CovalentContact SG-SG 2.02Å; C56-C168 PolarHBondContact SG-SG 3.34Å
57	Y	95.6	Very high	81.8	Confident	76 Å²	76	80.2 Å²	80.2	30%	0.298	38%	0.383	S	S	.	.	H	α-helix	trans	-58.9	-50.3	170.9	174.3	-93.7	0	0	0	111.5	T55 I59 C60 Q61 C130 N131 Q135	T55-Y57 PolarHBondContact O-N 3.14Å; T55-Y57 WeakPolarHBondContact OG1-CB 3.18Å; T55-Y57 PolarHBondContact OG1-N 3.19Å; Y57-I59 VanDerWaalsContact C-N 3.31Å; Y57-I59 PolarHBondContact O-N 3.06Å; Y57-C60 WeakPolarHBondContact O-CB 3.29Å; Y57-C60 PolarHBondContact O-N 3.41Å; Y57-C60 VanDerWaalsContact O-N 3.13Å; Y57-Q61 HydrophobicContact CD1-CG 4.2Å; Y57-Q61 HydrophobicContact CD2-CG 4.46Å; Y57-Q61 HydrophobicContact CE1-CG 3.78Å; Y57-Q61 HydrophobicContact CE2-CG 4.04Å; Y57-Q61 WeakPolarHBondContact O-CG 3.17Å; Y57-Q61 PolarHBondContact O-N 3.06Å; Y57-Q61 PolarHBondContact OH-NE2 2.93Å; Y57-C130 HydrophobicContact CD2-CB 4.26Å; Y57-C130 VanDerWaalsContact CD2-O 3.23Å; Y57-C130 WeakPolarHBondContact CD2-O 3.23Å; Y57-C130 HydrophobicContact CE2-CB 4.29Å; Y57-N131 WeakPolarHBondContact CE2-OD1 3.39Å; Y57-Q135 VanDerWaalsContact CB-OE1 3.28Å
58	D	95	Very high	83.1	Confident	59 Å²	59	77.2 Å²	77.2	32%	0.316	38%	0.376	S	S	.	.	H	α-helix	trans	-62.3	-39.3	179.6	-57.3	-43.7	0	0	0	111.9	Q54 T55 S62	Q54-D58 HydrophobicContact CG-CB 3.75Å; T55-D58 WeakPolarHBondContact CB-OD2 3.38Å; T55-D58 PolarHBondContact N-OD2 2.91Å; T55-D58 PolarHBondContact O-N 3.46Å; T55-D58 PolarHBondContact OG1-N 2.8Å; T55-D58 VanDerWaalsContact OG1-N 3.08Å; T55-D58 PolarHBondContact OG1-OD2 2.83Å; D58-S62 WeakPolarHBondContact O-CB 3.14Å; D58-S62 PolarHBondContact O-N 3.49Å; D58-S62 PolarHBondContact O-OG 3.48Å
59	I	95.2	Very high	84	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-61.2	-49.4	173.9	-62.4	170.4	0	0	0	109.6	Q54 T55 C56 Y57 Q61 S62 I63 L102 I108 F199	Q54-I59 HydrophobicContact CG-CG1 3.83Å; Q54-I59 VanDerWaalsContact NE2-CG1 3.27Å; T55-I59 WeakPolarHBondContact O-CG1 2.96Å; T55-I59 PolarHBondContact O-N 3.45Å; T55-I59 VanDerWaalsContact O-N 3.08Å; C56-I59 PolarHBondContact O-N 2.84Å; Y57-I59 VanDerWaalsContact C-N 3.31Å; Y57-I59 PolarHBondContact O-N 3.06Å; I59-Q61 PolarHBondContact O-N 3.19Å; I59-S62 PolarHBondContact O-N 3.33Å; I59-I63 HydrophobicContact CG2-CD1 3.84Å; I59-I63 HydrophobicContact CG2-CG1 4.31Å; I59-I63 WeakPolarHBondContact O-CB 3.01Å; I59-I63 WeakPolarHBondContact O-CG1 3.31Å; I59-I63 PolarHBondContact O-N 3.11Å; I59-L102 HydrophobicContact CB-CD1 4.28Å; I59-L102 HydrophobicContact CG1-CD1 4.45Å; I59-L102 HydrophobicContact CG2-CD1 3.84Å; I59-I108 HydrophobicContact CB-CG2 4.3Å; I59-I108 HydrophobicContact CG2-CB 4.16Å; I59-I108 HydrophobicContact CG2-CG2 3.73Å; I59-F199 HydrophobicContact CD1-CD2 4.15Å; I59-F199 HydrophobicContact CD1-CE2 3.43Å; I59-F199 VanDerWaalsContact CD1-CE2 3.43Å; I59-F199 HydrophobicContact CD1-CZ 4.02Å
60	C	94.5	Very high	84.1	Confident	0 Å²	0	76.4 Å²	76.4	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-58.7	-48.5	-178.5	-172.4	0	0	0	0	111.8	C56 Y57 S62 I63 E64 I108 C130 I133	C56-C60 VanDerWaalsContact O-CB 3.29Å; C56-C60 WeakPolarHBondContact O-CB 3Å; C56-C60 PolarHBondContact O-N 3.11Å; Y57-C60 WeakPolarHBondContact O-CB 3.29Å; Y57-C60 PolarHBondContact O-N 3.41Å; Y57-C60 VanDerWaalsContact O-N 3.13Å; C60-S62 VanDerWaalsContact C-N 3.3Å; C60-S62 PolarHBondContact O-N 3.37Å; C60-I63 PolarHBondContact O-N 2.74Å; C60-E64 PolarHBondContact O-N 3.42Å; C60-I108 HydrophobicContact CB-CG2 3.94Å; C60-C130 HydrophobicContact CB-CB 3.71Å; C60-C130 WeakPolarHBondContact CB-SG 3.37Å; C60-C130 WeakPolarHBondContact SG-CA 3.35Å; C60-C130 WeakPolarHBondContact SG-CB 3.49Å; C60-C130 CovalentContact SG-SG 2.04Å; C60-C130 PolarHBondContact SG-SG 3.46Å; C60-I133 HydrophobicContact CB-CD1 3.59Å
61	Q	92.6	Very high	84	Confident	49 Å²	49	75.5 Å²	75.5	23%	0.229	36%	0.36	C	S	.	.	H	α-helix	trans	-61.3	-36.9	176.9	-70.2	-66.3	-21.7	0	0	112.7	Y57 I59 K65 C130	Y57-Q61 HydrophobicContact CD1-CG 4.2Å; Y57-Q61 HydrophobicContact CD2-CG 4.46Å; Y57-Q61 HydrophobicContact CE1-CG 3.78Å; Y57-Q61 HydrophobicContact CE2-CG 4.04Å; Y57-Q61 WeakPolarHBondContact O-CG 3.17Å; Y57-Q61 PolarHBondContact O-N 3.06Å; Y57-Q61 PolarHBondContact OH-NE2 2.93Å; I59-Q61 PolarHBondContact O-N 3.19Å; Q61-K65 WeakPolarHBondContact O-CG 3.1Å; Q61-C130 HydrophobicContact CG-CB 4.41Å
62	S	91.5	Very high	82.9	Confident	47 Å²	47	74.4 Å²	74.4	33%	0.329	36%	0.364	S	S	.	.	H	α-helix	trans	-72.3	-40.7	178.7	-59.6	0	0	0	0	111.5	D58 I59 C60 K65	D58-S62 WeakPolarHBondContact O-CB 3.14Å; D58-S62 PolarHBondContact O-N 3.49Å; D58-S62 PolarHBondContact O-OG 3.48Å; I59-S62 PolarHBondContact O-N 3.33Å; C60-S62 VanDerWaalsContact C-N 3.3Å; C60-S62 PolarHBondContact O-N 3.37Å; S62-K65 PolarHBondContact O-N 3.37Å
63	I	88.1	Confident	81.4	Confident	3 Å²	3	70.1 Å²	70.1	2%	0.015	34%	0.339	C	S	.	.	H	α-helix	trans	-64.4	-39.3	177.7	-76.7	-175.2	0	0	0	111.3	I59 C60 K65 L66 L102 I108 H110 I113	I59-I63 HydrophobicContact CG2-CD1 3.84Å; I59-I63 HydrophobicContact CG2-CG1 4.31Å; I59-I63 WeakPolarHBondContact O-CB 3.01Å; I59-I63 WeakPolarHBondContact O-CG1 3.31Å; I59-I63 PolarHBondContact O-N 3.11Å; C60-I63 PolarHBondContact O-N 2.74Å; I63-K65 PolarHBondContact O-N 3.15Å; I63-L66 HydrophobicContact CG1-CD1 4.32Å; I63-L66 WeakPolarHBondContact O-CB 3.38Å; I63-L66 PolarHBondContact O-N 3.38Å; I63-L66 VanDerWaalsContact O-N 3.1Å; I63-L102 HydrophobicContact CG1-CD1 4.25Å; I63-L102 HydrophobicContact CG1-CD2 4.09Å; I63-L102 HydrophobicContact CG1-CG 3.9Å; I63-I108 HydrophobicContact CD1-CG2 4.07Å; I63-H110 HydrophobicContact CG2-CB 4.12Å; I63-I113 HydrophobicContact CG2-CD1 3.12Å
64	E	83.7	Confident	79.5	Confident	76 Å²	76	71.6 Å²	71.6	36%	0.355	35%	0.35	S	S	.	.	H	α-helix	trans	-58.8	-30.3	177.5	-174	170.4	-164.5	0	0	113	C60 L66	C60-E64 PolarHBondContact O-N 3.42Å; E64-L66 VanDerWaalsContact C-N 3.35Å
65	K	85	Confident	77.7	Confident	166 Å²	166	76.5 Å²	76.5	72%	0.722	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-8.2	-179.6	-65.4	172.7	-174.9	177.9	0	114	Q61 S62 I63	Q61-K65 WeakPolarHBondContact O-CG 3.1Å; S62-K65 PolarHBondContact O-N 3.37Å; I63-K65 PolarHBondContact O-N 3.15Å
66	L	81.4	Confident	75.9	Confident	49 Å²	49	76.9 Å²	76.9	26%	0.257	37%	0.372	S	S	.	.	S	Bend	trans	-74	147.7	-176.3	-64.3	172.5	0	0	0	111.9	I63 E64 K68 L100 L102	I63-L66 HydrophobicContact CG1-CD1 4.32Å; I63-L66 WeakPolarHBondContact O-CB 3.38Å; I63-L66 PolarHBondContact O-N 3.38Å; I63-L66 VanDerWaalsContact O-N 3.1Å; E64-L66 VanDerWaalsContact C-N 3.35Å; L66-K68 PolarHBondContact O-N 2.91Å; L66-L100 HydrophobicContact CB-CD2 3.4Å; L66-L100 HydrophobicContact CB-CG 4.32Å; L66-L100 HydrophobicContact CD1-CD1 4.11Å; L66-L100 HydrophobicContact CD1-CD2 3.43Å; L66-L100 VanDerWaalsContact CD1-CD2 3.43Å; L66-L100 HydrophobicContact CD1-CG 3.47Å; L66-L100 VanDerWaalsContact CD1-CG 3.47Å; L66-L100 HydrophobicContact CG-CD2 4.05Å; L66-L102 HydrophobicContact CD1-CD2 3.95Å; L66-L102 HydrophobicContact CD2-CD2 4.46Å; L66-L102 HydrophobicContact CG-CD2 4.49Å
67	P	76.4	Confident	74	Confident	96 Å²	96	81 Å²	81	62%	0.623	39%	0.394	S	S	*	.			trans	-60.1	127.2	178.8	-21.6	32	0	0	0	112.3	N69	P67-N69 PolarHBondContact O-N 3.16Å
68	K	68.3	Low	72.5	Confident	153 Å²	153	84.6 Å²	84.6	67%	0.665	41%	0.411	S	S	*	.			trans	-81.2	58.5	176	-60.6	177.7	-175.6	174	0	111	L66 K70	L66-K68 PolarHBondContact O-N 2.91Å; K68-K70 PolarHBondContact O-N 2.97Å
69	N	62.3	Low	71	Confident	121 Å²	121	83 Å²	83	65%	0.647	40%	0.403	S	S	*	.			trans	-67.3	137.1	166.9	-78.6	-2.3	0	0	0	108.6	P67 Y71	P67-N69 PolarHBondContact O-N 3.16Å; N69-Y71 WeakPolarHBondContact O-CD2 2.94Å; N69-Y71 VanDerWaalsContact O-CE2 3.32Å; N69-Y71 WeakPolarHBondContact O-CE2 2.99Å; N69-Y71 PolarHBondContact O-N 2.77Å; N69-Y71 VanDerWaalsContact O-N 3.07Å
70	K	51.9	Low	69.3	Low	217 Å²	217	83.5 Å²	83.5	94%	0.943	41%	0.407	S	S	*	.			trans	-66.8	101.7	-165.6	-161.6	177.5	-174.1	-179.6	0	111	K68	K68-K70 PolarHBondContact O-N 2.97Å
71	Y	55.9	Low	67.7	Low	110 Å²	110	88.7 Å²	88.7	43%	0.431	43%	0.431	S	S	.	.			trans	-92.6	148.6	177.3	-70.7	-79.4	0	0	0	112.5	N69	N69-Y71 WeakPolarHBondContact O-CD2 2.94Å; N69-Y71 VanDerWaalsContact O-CE2 3.32Å; N69-Y71 WeakPolarHBondContact O-CE2 2.99Å; N69-Y71 PolarHBondContact O-N 2.77Å; N69-Y71 VanDerWaalsContact O-N 3.07Å
72	N	52.7	Low	66.4	Low	110 Å²	110	93 Å²	93	59%	0.588	45%	0.451	S	S	*	.			trans	-108.2	94.4	-178.3	-170.9	-11.2	0	0	0	111.6	S74 K75	N72-S74 PolarHBondContact O-N 3.41Å; N72-S74 PolarHBondContact OD1-OG 3.2Å; N72-K75 WeakPolarHBondContact O-CB 3.36Å; N72-K75 PolarHBondContact O-N 3.24Å
73	Y	55.8	Low	64.9	Low	53 Å²	53	92 Å²	92	21%	0.208	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-30	-174	-58.5	-71.5	0	0	0	115.1	K75 L76 Y99 I113	Y73-K75 PolarHBondContact O-N 3.1Å; Y73-L76 WeakPolarHBondContact O-CB 3.29Å; Y73-L76 PolarHBondContact O-N 3.16Å; Y73-Y99 AromaticContact CD1-CD1 3.85Å; Y73-Y99 HydrophobicContact CD1-CD1 3.85Å; Y73-Y99 AromaticContact CD1-CE1 3.2Å; Y73-Y99 HydrophobicContact CD1-CE1 3.2Å; Y73-Y99 AromaticContact CD1-CZ 3.8Å; Y73-Y99 AromaticContact CE1-CD1 3.36Å; Y73-Y99 HydrophobicContact CE1-CD1 3.36Å; Y73-Y99 AromaticContact CE1-CE1 3.11Å; Y73-Y99 HydrophobicContact CE1-CE1 3.11Å; Y73-Y99 HydrophobicContact CG-CE1 4.3Å; Y73-I113 PolarHBondContact OH-O 3.34Å
74	S	54.2	Low	63.2	Low	67 Å²	67	96.7 Å²	96.7	47%	0.469	46%	0.459	S	S	.	.	H	α-helix	trans	-63.9	-26.7	179.5	70.1	0	0	0	0	113.2	N72 L76	N72-S74 PolarHBondContact O-N 3.41Å; N72-S74 PolarHBondContact OD1-OG 3.2Å; S74-L76 VanDerWaalsContact C-N 3.27Å; S74-L76 PolarHBondContact O-N 3.45Å
75	K	58.1	Low	61.9	Low	143 Å²	143	96.9 Å²	96.9	62%	0.622	47%	0.467	S	S	*	.	H	α-helix	trans	-71	-25.2	176.2	-166.5	171.2	176.6	178.1	0	111.6	N72 Y73 T79	N72-K75 WeakPolarHBondContact O-CB 3.36Å; N72-K75 PolarHBondContact O-N 3.24Å; Y73-K75 PolarHBondContact O-N 3.1Å; K75-T79 WeakPolarHBondContact O-CB 3.31Å; K75-T79 PolarHBondContact O-N 3.29Å; K75-T79 PolarHBondContact O-OG1 3.19Å
76	L	58.2	Low	61	Low	19 Å²	19	94.2 Å²	94.2	10%	0.099	46%	0.461	C	S	.	.	H	α-helix	trans	-67.1	-56	-172	-158.3	148.6	0	0	0	112.2	Y73 S74 K78 T79 S80 I97 Y99	Y73-L76 WeakPolarHBondContact O-CB 3.29Å; Y73-L76 PolarHBondContact O-N 3.16Å; S74-L76 VanDerWaalsContact C-N 3.27Å; S74-L76 PolarHBondContact O-N 3.45Å; L76-K78 VanDerWaalsContact C-N 3.3Å; L76-K78 PolarHBondContact O-N 3.49Å; L76-T79 PolarHBondContact O-N 3.05Å; L76-T79 VanDerWaalsContact O-N 3.16Å; L76-S80 PolarHBondContact O-N 3.31Å; L76-S80 PolarHBondContact O-OG 3.39Å; L76-I97 WeakPolarHBondContact CD1-O 3.45Å; L76-I97 WeakPolarHBondContact CD2-O 3.48Å; L76-I97 WeakPolarHBondContact CG-O 3.25Å; L76-Y99 HydrophobicContact CD1-CE2 4.47Å
77	I	58.7	Low	60.3	Low	88 Å²	88	95.2 Å²	95.2	45%	0.451	46%	0.463	S	S	.	.	H	α-helix	trans	-59.2	-42.9	178.3	-63.5	170.7	0	0	0	110.6	T79 S80 H81	I77-T79 PolarHBondContact O-N 2.83Å; I77-S80 PolarHBondContact O-N 3Å; I77-S80 PolarHBondContact O-OG 3.01Å; I77-H81 PolarHBondContact O-CD2 2.75Å; I77-H81 PolarHBondContact O-N 3.32Å; I77-H81 VanDerWaalsContact O-N 3.11Å
78	K	63.3	Low	60	Low	151 Å²	151	96.9 Å²	96.9	66%	0.657	47%	0.467	S	S	*	.	H	α-helix	trans	-63.2	-42.3	177.8	-69	-176.5	179.3	-177.6	0	112	L76 Q82	L76-K78 VanDerWaalsContact C-N 3.3Å; L76-K78 PolarHBondContact O-N 3.49Å; K78-Q82 WeakPolarHBondContact O-CG 3.47Å; K78-Q82 PolarHBondContact O-N 3.08Å
79	T	62.8	Low	60.5	Low	24 Å²	24	90.4 Å²	90.4	15%	0.147	44%	0.441	C	S	.	.	H	α-helix	trans	-71.3	-39.9	-179.4	-45.2	0	0	0	0	111.3	K75 L76 I77 H81 Q82 L83 I97	K75-T79 WeakPolarHBondContact O-CB 3.31Å; K75-T79 PolarHBondContact O-N 3.29Å; K75-T79 PolarHBondContact O-OG1 3.19Å; L76-T79 PolarHBondContact O-N 3.05Å; L76-T79 VanDerWaalsContact O-N 3.16Å; I77-T79 PolarHBondContact O-N 2.83Å; T79-H81 VanDerWaalsContact C-N 3.31Å; T79-H81 PolarHBondContact O-N 3.08Å; T79-Q82 WeakPolarHBondContact O-CB 3.05Å; T79-Q82 PolarHBondContact O-N 3.26Å; T79-L83 PolarHBondContact O-N 2.89Å; T79-L83 VanDerWaalsContact O-N 3.15Å; T79-I97 HydrophobicContact CG2-CG2 3.42Å; T79-I97 VanDerWaalsContact CG2-CG2 3.42Å
80	S	59.4	Low	61.4	Low	12 Å²	12	88.8 Å²	88.8	8%	0.084	43%	0.433	C	S	.	.	H	α-helix	trans	-62.2	-38.8	176.1	60.6	0	0	0	0	112.1	L76 I77 Q82 L83	L76-S80 PolarHBondContact O-N 3.31Å; L76-S80 PolarHBondContact O-OG 3.39Å; I77-S80 PolarHBondContact O-N 3Å; I77-S80 PolarHBondContact O-OG 3.01Å; S80-Q82 VanDerWaalsContact C-N 3.31Å; S80-Q82 PolarHBondContact O-N 3.02Å; S80-L83 PolarHBondContact O-N 3.28Å
81	H	61.4	Low	62.7	Low	108 Å²	108	81 Å²	81	50%	0.5	40%	0.401	S	S	.	.	H	α-helix	trans	-67.3	-27.1	173.1	-77.1	-63.1	0	0	0	113.5	I77 T79 W84	I77-H81 PolarHBondContact O-CD2 2.75Å; I77-H81 PolarHBondContact O-N 3.32Å; I77-H81 VanDerWaalsContact O-N 3.11Å; T79-H81 VanDerWaalsContact C-N 3.31Å; T79-H81 PolarHBondContact O-N 3.08Å; H81-W84 WeakPolarHBondContact O-CB 3.39Å; H81-W84 PolarHBondContact O-N 3.45Å; H81-W84 VanDerWaalsContact O-O 3.06Å
82	Q	64.6	Low	63.8	Low	140 Å²	140	81.8 Å²	81.8	65%	0.654	41%	0.41	S	S	*	.	H	α-helix	trans	-76.9	-28.2	176.4	-78.3	179.1	-30.3	0	0	113.6	K78 T79 S80 W84	K78-Q82 WeakPolarHBondContact O-CG 3.47Å; K78-Q82 PolarHBondContact O-N 3.08Å; T79-Q82 WeakPolarHBondContact O-CB 3.05Å; T79-Q82 PolarHBondContact O-N 3.26Å; S80-Q82 VanDerWaalsContact C-N 3.31Å; S80-Q82 PolarHBondContact O-N 3.02Å; Q82-W84 PolarHBondContact O-N 3.04Å
83	L	60.7	Low	64.9	Low	25 Å²	25	78.5 Å²	78.5	13%	0.131	39%	0.393	C	S	.	.	S	Bend	trans	-70.2	-14.7	170.4	-61.4	178.8	0	0	0	112	T79 S80 P85 N86 L93 I97	T79-L83 PolarHBondContact O-N 2.89Å; T79-L83 VanDerWaalsContact O-N 3.15Å; S80-L83 PolarHBondContact O-N 3.28Å; L83-P85 CarbonylContact O-C 3.58Å; L83-N86 CarbonylContact O-C 3.59Å; L83-N86 WeakPolarHBondContact O-CA 3.4Å; L83-N86 PolarHBondContact O-N 3.03Å; L83-L93 HydrophobicContact CD1-CD2 3.94Å; L83-L93 HydrophobicContact CD1-CG 4.16Å; L83-L93 HydrophobicContact CD2-CD1 4.38Å; L83-L93 HydrophobicContact CD2-CD2 3.31Å; L83-L93 HydrophobicContact CD2-CG 4.18Å; L83-L93 HydrophobicContact CG-CD2 4.27Å; L83-I97 HydrophobicContact CD1-CD1 3.63Å
84	W	53	Low	65.9	Low	102 Å²	102	76 Å²	76	39%	0.386	38%	0.383	S	S	.	.	S	Bend	trans	-91.2	124.3	172.1	-174.5	-74.7	0	0	0	110.6	H81 Q82 I214 L304	H81-W84 WeakPolarHBondContact O-CB 3.39Å; H81-W84 PolarHBondContact O-N 3.45Å; H81-W84 VanDerWaalsContact O-O 3.06Å; Q82-W84 PolarHBondContact O-N 3.04Å; W84-I214 HydrophobicContact CH2-CB 3.17Å; W84-I214 HydrophobicContact CH2-CD1 3.64Å; W84-I214 HydrophobicContact CH2-CG1 3.95Å; W84-I214 HydrophobicContact CH2-CG2 3.19Å; W84-I214 HydrophobicContact CZ2-CB 4.26Å; W84-I214 HydrophobicContact CZ2-CD1 4.11Å; W84-I214 HydrophobicContact CZ2-CG2 4.47Å; W84-I214 HydrophobicContact CZ3-CB 3.36Å; W84-I214 HydrophobicContact CZ3-CG2 3.32Å; W84-L304 HydrophobicContact CD2-CD1 4.48Å; W84-L304 HydrophobicContact CE3-CD1 4.25Å; W84-L304 HydrophobicContact CH2-CD1 3.12Å; W84-L304 HydrophobicContact CH2-CD2 4.33Å; W84-L304 HydrophobicContact CH2-CG 3.49Å; W84-L304 VanDerWaalsContact CH2-CG 3.49Å; W84-L304 HydrophobicContact CZ2-CD1 3.48Å; W84-L304 VanDerWaalsContact CZ2-CD1 3.48Å; W84-L304 HydrophobicContact CZ2-CG 4.07Å; W84-L304 HydrophobicContact CZ3-CD1 3.58Å; W84-L304 HydrophobicContact CZ3-CG 4.16Å
85	P	56.8	Low	67.1	Low	81 Å²	81	78 Å²	78	53%	0.526	38%	0.381	S	S	.	.	S	Bend	cis	-93.8	16.5	-6.6	37.2	-33.2	0	0	0	113.4	L83 F87	L83-P85 CarbonylContact O-C 3.58Å; P85-F87 WeakPolarHBondContact O-CD2 3.45Å; P85-F87 PolarHBondContact O-N 2.76Å
86	N	64.6	Low	67.8	Low	109 Å²	109	76.4 Å²	76.4	58%	0.583	38%	0.379	S	S	*	.			trans	-69	93	177.5	-72.9	-25.7	0	0	0	111.8	L83 N88	L83-N86 CarbonylContact O-C 3.59Å; L83-N86 WeakPolarHBondContact O-CA 3.4Å; L83-N86 PolarHBondContact O-N 3.03Å; N86-N88 PolarHBondContact O-N 3.37Å
87	F	67	Low	68.4	Low	71 Å²	71	75.6 Å²	75.6	31%	0.311	38%	0.375	S	S	.	.			trans	-66.3	36.7	178.2	-57.6	-59.6	0	0	0	115.5	P85 I153 L304 I306	P85-F87 WeakPolarHBondContact O-CD2 3.45Å; P85-F87 PolarHBondContact O-N 2.76Å; F87-I153 HydrophobicContact CB-CD1 3.8Å; F87-I153 HydrophobicContact CB-CG1 4.13Å; F87-I153 HydrophobicContact CB-CG2 4.12Å; F87-I153 HydrophobicContact CD1-CG2 3.53Å; F87-I153 HydrophobicContact CE1-CG2 4.39Å; F87-I153 HydrophobicContact CG-CG2 4.26Å; F87-I153 WeakPolarHBondContact O-CD1 3.29Å; F87-I153 WeakPolarHBondContact O-CG1 3.49Å; F87-L304 HydrophobicContact CE1-CB 4.41Å; F87-L304 HydrophobicContact CE1-CD1 3.91Å; F87-L304 HydrophobicContact CZ-CB 4.43Å; F87-L304 HydrophobicContact CZ-CD1 3.87Å; F87-I306 HydrophobicContact CD1-CG1 4.47Å; F87-I306 HydrophobicContact CE1-CG1 4.35Å
88	N	70.8	Confident	69.3	Low	131 Å²	131	72 Å²	72	70%	0.701	36%	0.358	S	S	*	.			trans	-108.1	82.8	177.1	-73.6	-14	0	0	0	109.4	N86 L93	N86-N88 PolarHBondContact O-N 3.37Å; N88-L93 VanDerWaalsContact O-CD2 3.29Å; N88-L93 WeakPolarHBondContact O-CD2 3.41Å
89	A	78.7	Confident	69.9	Low	16 Å²	16	66.1 Å²	66.1	13%	0.132	33%	0.331	C	S	.	.			trans	-113.3	137.5	174	0	0	0	0	0	111.2	L93 Y152 I153	A89-L93 HydrophobicContact CB-CD2 4.42Å; A89-Y152 WeakPolarHBondContact CB-O 3.35Å; A89-Y152 VanDerWaalsContact O-CB 3.29Å; A89-Y152 WeakPolarHBondContact O-CB 3.46Å; A89-I153 HydrophobicContact CB-CG1 4.48Å
90	N	81.4	Confident	70.7	Confident	87 Å²	87	66.7 Å²	66.7	47%	0.465	33%	0.333	S	S	.	.			trans	-130.3	171.1	170.7	68.6	36.7	0	0	0	110	M92 L93 L94	N90-M92 VanDerWaalsContact C-N 3.27Å; N90-M92 PolarHBondContact O-N 3.48Å; N90-M92 WeakPolarHBondContact OD1-CB 3.35Å; N90-M92 PolarHBondContact OD1-N 2.75Å; N90-L93 PolarHBondContact O-N 2.99Å; N90-L93 WeakPolarHBondContact OD1-CB 3.36Å; N90-L93 PolarHBondContact OD1-N 3.02Å; N90-L94 WeakPolarHBondContact O-CG 3.24Å; N90-L94 PolarHBondContact O-N 3.21Å
91	L	78.9	Confident	71.8	Confident	53 Å²	53	67 Å²	67	28%	0.277	33%	0.334	S	S	.	.	H	α-helix	trans	-58.8	-36	-176	-163.5	71.7	0	0	0	113.5	L94 Y95 Y152 P349 F350	L91-L94 PolarHBondContact O-N 3.43Å; L91-Y95 WeakPolarHBondContact O-CB 3.44Å; L91-Y95 PolarHBondContact O-N 3.04Å; L91-Y152 HydrophobicContact CD1-CE1 4.1Å; L91-P349 HydrophobicContact CD1-CG 4.32Å; L91-P349 HydrophobicContact CD2-CG 3.89Å; L91-P349 HydrophobicContact CG-CG 4.33Å; L91-F350 HydrophobicContact CD1-CD2 3.49Å; L91-F350 VanDerWaalsContact CD1-CD2 3.49Å; L91-F350 HydrophobicContact CD1-CE2 3.57Å; L91-F350 HydrophobicContact CG-CE2 4.19Å
92	M	79.2	Confident	73.2	Confident	127 Å²	127	62.8 Å²	62.8	63%	0.626	31%	0.314	S	S	*	.	H	α-helix	trans	-69.1	-41.6	179.5	-169.9	66.5	179.8	0	0	111.5	N90 Y95 N96	N90-M92 VanDerWaalsContact C-N 3.27Å; N90-M92 PolarHBondContact O-N 3.48Å; N90-M92 WeakPolarHBondContact OD1-CB 3.35Å; N90-M92 PolarHBondContact OD1-N 2.75Å; M92-Y95 PolarHBondContact O-N 3.05Å; M92-N96 VanDerWaalsContact O-CG 3.31Å; M92-N96 PolarHBondContact O-N 2.95Å; M92-N96 VanDerWaalsContact O-N 3.14Å; M92-N96 PolarHBondContact O-ND2 2.99Å
93	L	75.5	Confident	74.4	Confident	42 Å²	42	60.3 Å²	60.3	22%	0.22	31%	0.311	C	S	.	.	H	α-helix	trans	-63.5	-45.4	175.5	-177.3	61.3	0	0	0	111	L83 N88 A89 N90 Y95 N96 I97	L83-L93 HydrophobicContact CD1-CD2 3.94Å; L83-L93 HydrophobicContact CD1-CG 4.16Å; L83-L93 HydrophobicContact CD2-CD1 4.38Å; L83-L93 HydrophobicContact CD2-CD2 3.31Å; L83-L93 HydrophobicContact CD2-CG 4.18Å; L83-L93 HydrophobicContact CG-CD2 4.27Å; N88-L93 VanDerWaalsContact O-CD2 3.29Å; N88-L93 WeakPolarHBondContact O-CD2 3.41Å; A89-L93 HydrophobicContact CB-CD2 4.42Å; N90-L93 PolarHBondContact O-N 2.99Å; N90-L93 WeakPolarHBondContact OD1-CB 3.36Å; N90-L93 PolarHBondContact OD1-N 3.02Å; L93-Y95 VanDerWaalsContact C-N 3.28Å; L93-Y95 PolarHBondContact O-N 2.85Å; L93-N96 PolarHBondContact O-N 2.9Å; L93-I97 WeakPolarHBondContact O-CG1 3.44Å; L93-I97 PolarHBondContact O-N 2.86Å
94	L	77.3	Confident	76	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-56.1	-42.5	173.7	-69	175	0	0	0	112	N90 L91 N96 I97 T98 Y152 L155 S156 F350	N90-L94 WeakPolarHBondContact O-CG 3.24Å; N90-L94 PolarHBondContact O-N 3.21Å; L91-L94 PolarHBondContact O-N 3.43Å; L94-N96 VanDerWaalsContact C-N 3.31Å; L94-N96 PolarHBondContact O-N 3.4Å; L94-I97 WeakPolarHBondContact O-CG1 3.4Å; L94-I97 PolarHBondContact O-N 3.41Å; L94-T98 WeakPolarHBondContact O-CB 3.48Å; L94-T98 VanDerWaalsContact O-CG2 3.25Å; L94-T98 WeakPolarHBondContact O-CG2 3.12Å; L94-T98 PolarHBondContact O-N 2.87Å; L94-T98 PolarHBondContact O-OG1 3.13Å; L94-Y152 HydrophobicContact CD1-CD1 3.92Å; L94-L155 HydrophobicContact CD1-CB 4.06Å; L94-L155 HydrophobicContact CD2-CB 4.36Å; L94-S156 VanDerWaalsContact CD2-CB 3.44Å; L94-F350 HydrophobicContact CB-CD2 4.17Å; L94-F350 HydrophobicContact CB-CE2 3.48Å; L94-F350 VanDerWaalsContact CB-CE2 3.48Å; L94-F350 HydrophobicContact CB-CZ 3.71Å; L94-F350 HydrophobicContact CD1-CD2 4.22Å; L94-F350 HydrophobicContact CD1-CE2 4.28Å
95	Y	78.7	Confident	78	Confident	107 Å²	107	54.4 Å²	54.4	42%	0.42	29%	0.287	S	S	.	.	H	α-helix	trans	-63.7	-36.3	178.9	-166.4	-94.2	0	0	0	113	L91 M92 L93 I97 H101 F350	L91-Y95 WeakPolarHBondContact O-CB 3.44Å; L91-Y95 PolarHBondContact O-N 3.04Å; M92-Y95 PolarHBondContact O-N 3.05Å; L93-Y95 VanDerWaalsContact C-N 3.28Å; L93-Y95 PolarHBondContact O-N 2.85Å; Y95-I97 VanDerWaalsContact C-N 3.32Å; Y95-I97 PolarHBondContact O-N 2.96Å; Y95-H101 AromaticContact CD2-CE1 3.81Å; Y95-H101 AromaticContact CE2-CE1 3.93Å; Y95-F350 HydrophobicContact CD2-CZ 4.25Å
96	N	72.8	Confident	79.9	Confident	110 Å²	110	50.6 Å²	50.6	59%	0.588	26%	0.262	S	S	*	.	H	α-helix	trans	-76	-18.1	-180	-68.1	-28.1	0	0	0	114	M92 L93 L94	M92-N96 VanDerWaalsContact O-CG 3.31Å; M92-N96 PolarHBondContact O-N 2.95Å; M92-N96 VanDerWaalsContact O-N 3.14Å; M92-N96 PolarHBondContact O-ND2 2.99Å; L93-N96 PolarHBondContact O-N 2.9Å; L94-N96 VanDerWaalsContact C-N 3.31Å; L94-N96 PolarHBondContact O-N 3.4Å
97	I	71.7	Confident	81.3	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.3	14.3	-174.8	70.4	170.4	0	0	0	113.7	L76 T79 L83 L93 L94 Y95	L76-I97 WeakPolarHBondContact CD1-O 3.45Å; L76-I97 WeakPolarHBondContact CD2-O 3.48Å; L76-I97 WeakPolarHBondContact CG-O 3.25Å; T79-I97 HydrophobicContact CG2-CG2 3.42Å; T79-I97 VanDerWaalsContact CG2-CG2 3.42Å; L83-I97 HydrophobicContact CD1-CD1 3.63Å; L93-I97 WeakPolarHBondContact O-CG1 3.44Å; L93-I97 PolarHBondContact O-N 2.86Å; L94-I97 WeakPolarHBondContact O-CG1 3.4Å; L94-I97 PolarHBondContact O-N 3.41Å; Y95-I97 VanDerWaalsContact C-N 3.32Å; Y95-I97 PolarHBondContact O-N 2.96Å
98	T	75.8	Confident	82.6	Confident	14 Å²	14	42.7 Å²	42.7	9%	0.086	22%	0.223	C	C	.	.	S	Bend	trans	-125.7	154.2	-175.7	48.8	0	0	0	0	111.6	L94 I159 F350	L94-T98 WeakPolarHBondContact O-CB 3.48Å; L94-T98 VanDerWaalsContact O-CG2 3.25Å; L94-T98 WeakPolarHBondContact O-CG2 3.12Å; L94-T98 PolarHBondContact O-N 2.87Å; L94-T98 PolarHBondContact O-OG1 3.13Å; T98-I159 HydrophobicContact CG2-CB 4.15Å; T98-I159 HydrophobicContact CG2-CG2 3.45Å; T98-I159 VanDerWaalsContact CG2-CG2 3.45Å; T98-F350 HydrophobicContact CG2-CE1 4.28Å; T98-F350 VanDerWaalsContact OG1-CE1 3.31Å; T98-F350 WeakPolarHBondContact OG1-CE1 3.43Å
99	Y	77.4	Confident	83.5	Confident	27 Å²	27	38 Å²	38	11%	0.106	20%	0.196	C	C	.	.			trans	-63.8	157.8	168.6	-70.1	-87.8	0	0	0	110.3	Y73 L76 H101 W107 N114 Q163	Y73-Y99 AromaticContact CD1-CD1 3.85Å; Y73-Y99 HydrophobicContact CD1-CD1 3.85Å; Y73-Y99 AromaticContact CD1-CE1 3.2Å; Y73-Y99 HydrophobicContact CD1-CE1 3.2Å; Y73-Y99 AromaticContact CD1-CZ 3.8Å; Y73-Y99 AromaticContact CE1-CD1 3.36Å; Y73-Y99 HydrophobicContact CE1-CD1 3.36Å; Y73-Y99 AromaticContact CE1-CE1 3.11Å; Y73-Y99 HydrophobicContact CE1-CE1 3.11Å; Y73-Y99 HydrophobicContact CG-CE1 4.3Å; L76-Y99 HydrophobicContact CD1-CE2 4.47Å; Y99-H101 PolarHBondContact O-N 2.7Å; Y99-H101 PolarHBondContact O-ND1 3.29Å; Y99-W107 HydrophobicContact CG-CZ2 4.49Å; Y99-N114 WeakPolarHBondContact CD1-OD1 3.27Å; Y99-N114 HydrophobicContact CE1-CB 4.35Å; Y99-N114 WeakPolarHBondContact CE1-OD1 3.38Å; Y99-Q163 HydrophobicContact CD2-CB 3.85Å; Y99-Q163 HydrophobicContact CD2-CG 4.37Å; Y99-Q163 VanDerWaalsContact CD2-OE1 3.29Å; Y99-Q163 HydrophobicContact CE2-CB 4.37Å
100	L	78.6	Confident	83.8	Confident	35 Å²	35	37.3 Å²	37.3	18%	0.183	19%	0.189	C	C	.	.			trans	-54.8	128.6	174.4	-170.9	66.1	0	0	0	110.4	L66 W107	L66-L100 HydrophobicContact CB-CD2 3.4Å; L66-L100 HydrophobicContact CB-CG 4.32Å; L66-L100 HydrophobicContact CD1-CD1 4.11Å; L66-L100 HydrophobicContact CD1-CD2 3.43Å; L66-L100 VanDerWaalsContact CD1-CD2 3.43Å; L66-L100 HydrophobicContact CD1-CG 3.47Å; L66-L100 VanDerWaalsContact CD1-CG 3.47Å; L66-L100 HydrophobicContact CG-CD2 4.05Å; L100-W107 PolarHBondContact O-NE1 3.46Å
101	H	83.5	Confident	83.7	Confident	20 Å²	20	33.2 Å²	33.2	9%	0.093	17%	0.168	C	C	.	.			trans	-134.2	157.3	-174	52.7	-85.6	0	0	0	109.7	Y95 Y99 P349 F350	Y95-H101 AromaticContact CD2-CE1 3.81Å; Y95-H101 AromaticContact CE2-CE1 3.93Å; Y99-H101 PolarHBondContact O-N 2.7Å; Y99-H101 PolarHBondContact O-ND1 3.29Å; H101-P349 PolarHBondContact CD2-O 3.16Å; H101-F350 AromaticContact CD2-CD1 3.99Å; H101-F350 AromaticContact CE1-CD1 3.74Å; H101-F350 AromaticContact CE1-CE1 3.05Å; H101-F350 WeakPolarHBondContact CE1-CE1 3.18Å; H101-F350 AromaticContact CE1-CZ 3.67Å; H101-F350 AromaticContact ND1-CE1 3.55Å; H101-F350 AromaticContact NE2-CD1 3.71Å; H101-F350 AromaticContact NE2-CE1 3.39Å; H101-F350 WeakPolarHBondContact NE2-CE1 2.84Å; H101-F350 AromaticContact NE2-CZ 3.9Å
102	L	90.7	Very high	83.3	Confident	18 Å²	18	32.3 Å²	32.3	9%	0.094	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-84.6	141.1	174	-60.1	174.6	0	0	0	109.6	I59 I63 L66 G104 G105 S106	I59-L102 HydrophobicContact CB-CD1 4.28Å; I59-L102 HydrophobicContact CG1-CD1 4.45Å; I59-L102 HydrophobicContact CG2-CD1 3.84Å; I63-L102 HydrophobicContact CG1-CD1 4.25Å; I63-L102 HydrophobicContact CG1-CD2 4.09Å; I63-L102 HydrophobicContact CG1-CG 3.9Å; L66-L102 HydrophobicContact CD1-CD2 3.95Å; L66-L102 HydrophobicContact CD2-CD2 4.46Å; L66-L102 HydrophobicContact CG-CD2 4.49Å; L102-G104 PolarHBondContact O-N 3.41Å; L102-G105 PolarHBondContact O-N 3.04Å; L102-S106 PolarHBondContact N-O 2.61Å
103	P	90.1	Very high	82.9	Confident	89 Å²	89	27.6 Å²	27.6	58%	0.578	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.9	141.5	168.4	-25.3	34	0	0	0	111.5	N347	P103-N347 HydrophobicContact CB-CB 4.45Å
104	G	93.7	Very high	82.5	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.7	5.6	-170.8	0	0	0	0	0	113.6	L102 R170 Q348 F351 T352	L102-G104 PolarHBondContact O-N 3.41Å; G104-R170 PolarHBondContact O-NE 3.03Å; G104-Q348 PolarHBondContact N-O 3.19Å; G104-F351 VanDerWaalsContact C-C 3.4Å; G104-F351 CarbonylContact O-C 3.59Å; G104-T352 PolarHBondContact O-N 3.09Å; G104-T352 VanDerWaalsContact O-N 3.08Å; G104-T352 PolarHBondContact O-OG1 3.02Å; G104-T352 VanDerWaalsContact O-OG1 3.09Å
105	G	94.7	Very high	81.6	Confident	2 Å²	2	32.3 Å²	32.3	2%	0.021	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	17	172.3	0	0	0	0	0	115.8	L102 R170 I171 F350	L102-G105 PolarHBondContact O-N 3.04Å; G105-R170 WeakPolarHBondContact O-CA 3.35Å; G105-I171 PolarHBondContact O-N 3.31Å; G105-F350 WeakPolarHBondContact CA-O 3.48Å
106	S	96.7	Very high	80.3	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.007	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	133	174.5	-65.7	0	0	0	0	110.4	Q54 L102 Y169 R170	Q54-S106 PolarHBondContact OE1-OG 3.37Å; L102-S106 PolarHBondContact N-O 2.61Å; S106-Y169 WeakPolarHBondContact CA-O 3.35Å; S106-R170 VanDerWaalsContact OG-CD 3.28Å; S106-R170 WeakPolarHBondContact OG-CD 3.49Å
107	W	95.2	Very high	79.4	Confident	4 Å²	4	35.2 Å²	35.2	2%	0.015	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	149.6	178.1	-172	88.1	0	0	0	112	Y99 L100 Y109 Q163 I167 C168 Y169	Y99-W107 HydrophobicContact CG-CZ2 4.49Å; L100-W107 PolarHBondContact O-NE1 3.46Å; W107-Y109 VanDerWaalsContact CZ3-N 3.29Å; W107-Q163 HydrophobicContact CD2-CG 3.85Å; W107-Q163 HydrophobicContact CE3-CG 4.13Å; W107-Q163 HydrophobicContact CG-CG 4.44Å; W107-Q163 HydrophobicContact CH2-CB 3.86Å; W107-Q163 HydrophobicContact CH2-CG 4.04Å; W107-Q163 WeakPolarHBondContact CH2-O 3.41Å; W107-Q163 HydrophobicContact CZ2-CB 3.85Å; W107-Q163 HydrophobicContact CZ2-CG 3.75Å; W107-Q163 HydrophobicContact CZ3-CB 4.31Å; W107-Q163 HydrophobicContact CZ3-CG 4.22Å; W107-I167 WeakPolarHBondContact CZ3-O 3.14Å; W107-C168 WeakPolarHBondContact O-CA 3.5Å; W107-Y169 HydrophobicContact CB-CD1 4.21Å; W107-Y169 HydrophobicContact CB-CE1 3.65Å; W107-Y169 HydrophobicContact CB-CE2 4.03Å; W107-Y169 AromaticContact CD2-CE1 3.84Å; W107-Y169 HydrophobicContact CD2-CE1 3.84Å; W107-Y169 AromaticContact CE3-CD1 3.88Å; W107-Y169 HydrophobicContact CE3-CD1 3.88Å; W107-Y169 AromaticContact CE3-CE1 3.4Å; W107-Y169 HydrophobicContact CE3-CE1 3.4Å; W107-Y169 VanDerWaalsContact CE3-CE1 3.4Å; W107-Y169 AromaticContact CG-CE1 3.96Å; W107-Y169 HydrophobicContact CG-CE1 3.96Å; W107-Y169 HydrophobicContact CZ3-CE1 4.31Å; W107-Y169 PolarHBondContact N-O 3.28Å; W107-Y169 PolarHBondContact O-N 3.1Å
108	I	94	Very high	78.4	Confident	10 Å²	10	39.4 Å²	39.4	5%	0.051	19%	0.188	C	C	.	.			trans	-149.5	150	167	-167.6	173.7	0	0	0	109.7	C56 I59 C60 I63 I133 C168	C56-I108 HydrophobicContact CB-CD1 4.08Å; I59-I108 HydrophobicContact CB-CG2 4.3Å; I59-I108 HydrophobicContact CG2-CB 4.16Å; I59-I108 HydrophobicContact CG2-CG2 3.73Å; C60-I108 HydrophobicContact CB-CG2 3.94Å; I63-I108 HydrophobicContact CD1-CG2 4.07Å; I108-I133 HydrophobicContact CD1-CB 4.42Å; I108-I133 HydrophobicContact CD1-CD1 3.32Å; I108-I133 HydrophobicContact CD1-CG1 4.4Å; I108-I133 HydrophobicContact CD1-CG2 4.39Å; I108-C168 HydrophobicContact CB-CB 4.2Å; I108-C168 HydrophobicContact CD1-CB 3.74Å; I108-C168 HydrophobicContact CG1-CB 3.77Å
109	Y	89.2	Confident	77	Confident	33 Å²	33	45.7 Å²	45.7	13%	0.129	22%	0.221	C	C	.	.			trans	-61.1	135	170.2	174.9	-97.9	0	0	0	111.3	W107 P111 N114 F129 H166	W107-Y109 VanDerWaalsContact CZ3-N 3.29Å; Y109-P111 HydrophobicContact CE1-CB 4.31Å; Y109-N114 HydrophobicContact CD2-CB 4.31Å; Y109-N114 WeakPolarHBondContact CD2-ND2 3.25Å; Y109-N114 HydrophobicContact CE2-CB 3.64Å; Y109-N114 VanDerWaalsContact CE2-ND2 3.31Å; Y109-N114 WeakPolarHBondContact CE2-ND2 3.36Å; Y109-F129 AromaticContact CD1-CZ 4Å; Y109-F129 HydrophobicContact CD1-CZ 4Å; Y109-F129 WeakPolarHBondContact O-CE1 3.34Å; Y109-F129 WeakPolarHBondContact O-CZ 3.14Å; Y109-H166 HydrophobicContact CD2-CB 4.31Å; Y109-H166 AromaticContact CD2-CD2 3.14Å; Y109-H166 WeakPolarHBondContact CD2-CD2 3.41Å; Y109-H166 AromaticContact CD2-CE1 3.93Å; Y109-H166 AromaticContact CD2-CG 3.65Å; Y109-H166 AromaticContact CD2-NE2 3.35Å; Y109-H166 WeakPolarHBondContact CD2-NE2 3.47Å; Y109-H166 AromaticContact CE2-CD2 3.7Å; Y109-H166 AromaticContact CE2-CE1 3.72Å; Y109-H166 AromaticContact CE2-NE2 3.35Å; Y109-H166 WeakPolarHBondContact CE2-NE2 3.47Å; Y109-H166 HydrophobicContact CG-CB 3.98Å; Y109-H166 AromaticContact CG-CD2 3.74Å; Y109-H166 AromaticContact CG-CG 3.79Å
110	H	85.5	Confident	75.7	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.005	26%	0.256	C	S	.	.			trans	-138	122.6	174.5	-167.1	-64.5	0	0	0	111.1	I63 N112 I113 N114 F129	I63-H110 HydrophobicContact CG2-CB 4.12Å; H110-N112 VanDerWaalsContact C-N 3.34Å; H110-N112 PolarHBondContact CE1-ND2 3.19Å; H110-N112 WeakPolarHBondContact ND1-CB 3.27Å; H110-N112 PolarHBondContact ND1-N 3.42Å; H110-N112 VanDerWaalsContact ND1-N 3.16Å; H110-N112 PolarHBondContact O-N 2.92Å; H110-I113 HydrophobicContact CB-CD1 4.21Å; H110-I113 PolarHBondContact O-N 3.28Å; H110-I113 VanDerWaalsContact O-N 3.1Å; H110-N114 PolarHBondContact O-N 3.41Å; H110-F129 AromaticContact CD2-CD1 3.95Å
111	P	78.9	Confident	74.4	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.013	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-30.8	-172.4	24.8	-34.2	0	0	0	114	Y109 I113 N114 I124 K126 F129	Y109-P111 HydrophobicContact CE1-CB 4.31Å; P111-I113 PolarHBondContact O-N 2.97Å; P111-N114 PolarHBondContact O-N 3.08Å; P111-I124 HydrophobicContact CG-CG2 4.44Å; P111-K126 HydrophobicContact CG-CG 4.42Å; P111-F129 HydrophobicContact CG-CB 4.34Å; P111-F129 HydrophobicContact CG-CD1 4.27Å; P111-F129 HydrophobicContact CG-CD2 3.76Å; P111-F129 HydrophobicContact CG-CE2 4.14Å; P111-F129 HydrophobicContact CG-CG 3.84Å
112	N	70.9	Confident	73.2	Confident	34 Å²	34	66.5 Å²	66.5	18%	0.182	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-22.3	175.5	-71.4	-16.8	0	0	0	114.3	H110 K126	H110-N112 VanDerWaalsContact C-N 3.34Å; H110-N112 PolarHBondContact CE1-ND2 3.19Å; H110-N112 WeakPolarHBondContact ND1-CB 3.27Å; H110-N112 PolarHBondContact ND1-N 3.42Å; H110-N112 VanDerWaalsContact ND1-N 3.16Å; H110-N112 PolarHBondContact O-N 2.92Å; N112-K126 VanDerWaalsContact OD1-CB 3.23Å; N112-K126 WeakPolarHBondContact OD1-CB 3.17Å; N112-K126 WeakPolarHBondContact OD1-CD 3.28Å; N112-K126 WeakPolarHBondContact OD1-CE 3.48Å; N112-K126 WeakPolarHBondContact OD1-CG 3.38Å
113	I	70.4	Confident	71.6	Confident	27 Å²	27	75.8 Å²	75.8	14%	0.138	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-37.2	-178.6	-66	166.3	0	0	0	109.2	I63 Y73 H110 P111 Q115	I63-I113 HydrophobicContact CG2-CD1 3.12Å; Y73-I113 PolarHBondContact OH-O 3.34Å; H110-I113 HydrophobicContact CB-CD1 4.21Å; H110-I113 PolarHBondContact O-N 3.28Å; H110-I113 VanDerWaalsContact O-N 3.1Å; P111-I113 PolarHBondContact O-N 2.97Å; I113-Q115 PolarHBondContact O-N 3.2Å
114	N	66.6	Low	70.3	Confident	7 Å²	7	75.2 Å²	75.2	4%	0.037	35%	0.352	C	S	.	.			trans	-99.6	53.7	-170	-60.4	-16.6	0	0	0	113.1	Y99 Y109 H110 P111 F116	Y99-N114 WeakPolarHBondContact CD1-OD1 3.27Å; Y99-N114 HydrophobicContact CE1-CB 4.35Å; Y99-N114 WeakPolarHBondContact CE1-OD1 3.38Å; Y109-N114 HydrophobicContact CD2-CB 4.31Å; Y109-N114 WeakPolarHBondContact CD2-ND2 3.25Å; Y109-N114 HydrophobicContact CE2-CB 3.64Å; Y109-N114 VanDerWaalsContact CE2-ND2 3.31Å; Y109-N114 WeakPolarHBondContact CE2-ND2 3.36Å; H110-N114 PolarHBondContact O-N 3.41Å; P111-N114 PolarHBondContact O-N 3.08Å; N114-F116 PolarHBondContact O-N 3.13Å
115	Q	57.8	Low	69.1	Low	136 Å²	136	80 Å²	80	64%	0.636	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-56.3	-17.5	-171	-84.6	-178.1	-32.4	0	0	116.4	I113 Y117 E118	I113-Q115 PolarHBondContact O-N 3.2Å; Q115-Y117 VanDerWaalsContact C-N 3.28Å; Q115-Y117 PolarHBondContact O-N 3.29Å; Q115-E118 PolarHBondContact O-N 3.41Å
116	F	53.4	Low	68.1	Low	161 Å²	161	82.7 Å²	82.7	71%	0.706	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-69.8	-19.2	-173	-152	-94	0	0	0	114.5	N114	N114-F116 PolarHBondContact O-N 3.13Å
117	Y	52.4	Low	67	Low	117 Å²	117	90.3 Å²	90.3	46%	0.459	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-89.4	3	-179	-71.9	-79.1	0	0	0	114.6	Q115 N119	Q115-Y117 VanDerWaalsContact C-N 3.28Å; Q115-Y117 PolarHBondContact O-N 3.29Å; Y117-N119 PolarHBondContact O-N 3.26Å; Y117-N119 VanDerWaalsContact O-N 3.11Å
118	E	52	Low	66.4	Low	89 Å²	89	95.3 Å²	95.3	42%	0.416	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	33.3	-178.5	-74.4	-165	155.6	0	0	114.6	Q115 K126	Q115-E118 PolarHBondContact O-N 3.41Å; E118-K126 VanDerWaalsContact CD-NZ 3.27Å; E118-K126 WeakPolarHBondContact OE1-CE 3.49Å; E118-K126 IonicContact OE1-NZ 2.66Å; E118-K126 PolarHBondContact OE1-NZ 3.28Å; E118-K126 IonicContact OE2-NZ 3.33Å; E118-K126 PolarHBondContact OE2-NZ 3.43Å
119	N	46.3	Very low	66.2	Low	146 Å²	146	96.4 Å²	96.4	78%	0.781	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-10.4	176.9	-93	5.1	0	0	0	116	Y117	Y117-N119 PolarHBondContact O-N 3.26Å; Y117-N119 VanDerWaalsContact O-N 3.11Å
120	N	50.1	Low	66.3	Low	157 Å²	157	95 Å²	95	84%	0.84	44%	0.44	S	S	*	.	S	Bend	trans	-160	4.9	176.9	-89.7	-40.8	0	0	0	118.6
121	H	51.5	Low	66.6	Low	169 Å²	169	99 Å²	99	78%	0.782	46%	0.462	S	S	*	.	S	Bend	trans	-106.4	137.9	-178.7	-76	-76.2	0	0	0	112.9	K123	H121-K123 PolarHBondContact O-N 3.41Å
122	K	56.8	Low	67.1	Low	194 Å²	194	105.5 Å²	105.5	84%	0.843	50%	0.496	S	S	*	.			trans	-20.2	126.5	175.5	-76.7	175.6	175.6	174.8	0	112.2	I124	K122-I124 VanDerWaalsContact C-N 3.3Å; K122-I124 WeakPolarHBondContact O-CG1 3.39Å; K122-I124 PolarHBondContact O-N 3Å
123	K	58	Low	68.1	Low	212 Å²	212	105.3 Å²	105.3	92%	0.922	50%	0.495	S	S	*	.			trans	-47.8	91.1	174.9	-155.2	176.4	-168.3	177.6	0	109.6	H121 N125	H121-K123 PolarHBondContact O-N 3.41Å; K123-N125 PolarHBondContact O-N 2.87Å
124	I	63	Low	69.1	Low	78 Å²	78	107.7 Å²	107.7	40%	0.4	51%	0.514	S	S	.	.			trans	-63	128.4	179.6	-69.9	168.6	0	0	0	105.9	P111 K122 K126 F129	P111-I124 HydrophobicContact CG-CG2 4.44Å; K122-I124 VanDerWaalsContact C-N 3.3Å; K122-I124 WeakPolarHBondContact O-CG1 3.39Å; K122-I124 PolarHBondContact O-N 3Å; I124-K126 VanDerWaalsContact C-N 3.26Å; I124-K126 PolarHBondContact O-N 3.37Å; I124-F129 HydrophobicContact CG2-CD2 4.22Å
125	N	68.8	Low	70.4	Confident	101 Å²	101	111.2 Å²	111.2	54%	0.54	53%	0.53	S	S	.	.			trans	-71.8	90.7	174.2	-167.3	-13.1	0	0	0	109	K123 K127 Y128	K123-N125 PolarHBondContact O-N 2.87Å; N125-K127 PolarHBondContact O-N 3.1Å; N125-K127 VanDerWaalsContact O-N 3.08Å; N125-K127 PolarHBondContact OD1-N 3.39Å; N125-Y128 WeakPolarHBondContact ND2-CD2 3.46Å; N125-Y128 PolarHBondContact O-N 3.37Å; N125-Y128 VanDerWaalsContact O-N 3.08Å
126	K	71.9	Confident	72.2	Confident	58 Å²	58	109.2 Å²	109.2	25%	0.252	52%	0.519	S	S	.	.	G	3₁₀ helix	trans	-51	-32.3	-176.4	-74.5	159.2	163.6	173.8	0	112.9	P111 N112 E118 I124 Y128 F129	P111-K126 HydrophobicContact CG-CG 4.42Å; N112-K126 VanDerWaalsContact OD1-CB 3.23Å; N112-K126 WeakPolarHBondContact OD1-CB 3.17Å; N112-K126 WeakPolarHBondContact OD1-CD 3.28Å; N112-K126 WeakPolarHBondContact OD1-CE 3.48Å; N112-K126 WeakPolarHBondContact OD1-CG 3.38Å; E118-K126 VanDerWaalsContact CD-NZ 3.27Å; E118-K126 WeakPolarHBondContact OE1-CE 3.49Å; E118-K126 IonicContact OE1-NZ 2.66Å; E118-K126 PolarHBondContact OE1-NZ 3.28Å; E118-K126 IonicContact OE2-NZ 3.33Å; E118-K126 PolarHBondContact OE2-NZ 3.43Å; I124-K126 VanDerWaalsContact C-N 3.26Å; I124-K126 PolarHBondContact O-N 3.37Å; K126-Y128 VanDerWaalsContact C-N 3.29Å; K126-Y128 PolarHBondContact O-N 3.15Å; K126-F129 PolarHBondContact O-N 3.22Å
127	K	74.9	Confident	74.3	Confident	161 Å²	161	101.8 Å²	101.8	70%	0.7	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-63.3	-28.9	-179.6	-172	178.1	179.6	-178.3	0	114.1	N125	N125-K127 PolarHBondContact O-N 3.1Å; N125-K127 VanDerWaalsContact O-N 3.08Å; N125-K127 PolarHBondContact OD1-N 3.39Å
128	Y	82.4	Confident	76.4	Confident	108 Å²	108	96.3 Å²	96.3	42%	0.424	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-112.7	9.9	-176.7	-61	-74.5	0	0	0	112.8	N125 K126 C130 N131	N125-Y128 WeakPolarHBondContact ND2-CD2 3.46Å; N125-Y128 PolarHBondContact O-N 3.37Å; N125-Y128 VanDerWaalsContact O-N 3.08Å; K126-Y128 VanDerWaalsContact C-N 3.29Å; K126-Y128 PolarHBondContact O-N 3.15Å; Y128-C130 PolarHBondContact O-N 3.3Å; Y128-N131 PolarHBondContact O-N 2.94Å; Y128-N131 VanDerWaalsContact O-N 3.1Å
129	F	88.8	Confident	78.7	Confident	33 Å²	33	92.1 Å²	92.1	15%	0.145	45%	0.448	C	S	.	.	G	3₁₀ helix	trans	-56.9	-50.9	-174.1	176	-98.9	0	0	0	111.6	Y109 H110 P111 I124 K126 N131 N132 I133	Y109-F129 AromaticContact CD1-CZ 4Å; Y109-F129 HydrophobicContact CD1-CZ 4Å; Y109-F129 WeakPolarHBondContact O-CE1 3.34Å; Y109-F129 WeakPolarHBondContact O-CZ 3.14Å; H110-F129 AromaticContact CD2-CD1 3.95Å; P111-F129 HydrophobicContact CG-CB 4.34Å; P111-F129 HydrophobicContact CG-CD1 4.27Å; P111-F129 HydrophobicContact CG-CD2 3.76Å; P111-F129 HydrophobicContact CG-CE2 4.14Å; P111-F129 HydrophobicContact CG-CG 3.84Å; I124-F129 HydrophobicContact CG2-CD2 4.22Å; K126-F129 PolarHBondContact O-N 3.22Å; F129-N131 PolarHBondContact O-N 2.96Å; F129-N132 PolarHBondContact O-N 3.18Å; F129-N132 VanDerWaalsContact O-N 3.15Å; F129-I133 HydrophobicContact CE1-CG2 4.14Å; F129-I133 HydrophobicContact CZ-CG2 4.06Å
130	C	91.9	Very high	81.2	Confident	4 Å²	4	85.1 Å²	85.1	3%	0.027	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-63.8	-24.7	180	-59.3	0	0	0	0	113.4	Y57 C60 Q61 Y128 N132 I133	Y57-C130 HydrophobicContact CD2-CB 4.26Å; Y57-C130 VanDerWaalsContact CD2-O 3.23Å; Y57-C130 WeakPolarHBondContact CD2-O 3.23Å; Y57-C130 HydrophobicContact CE2-CB 4.29Å; C60-C130 HydrophobicContact CB-CB 3.71Å; C60-C130 WeakPolarHBondContact CB-SG 3.37Å; C60-C130 WeakPolarHBondContact SG-CA 3.35Å; C60-C130 WeakPolarHBondContact SG-CB 3.49Å; C60-C130 CovalentContact SG-SG 2.04Å; C60-C130 PolarHBondContact SG-SG 3.46Å; Q61-C130 HydrophobicContact CG-CB 4.41Å; Y128-C130 PolarHBondContact O-N 3.3Å; C130-N132 PolarHBondContact O-N 2.04Å; C130-I133 VanDerWaalsContact O-CG1 3.29Å; C130-I133 WeakPolarHBondContact O-CG1 3.4Å
131	N	91	Very high	83.5	Confident	86 Å²	86	77.7 Å²	77.7	46%	0.46	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-73.3	-19.5	179.6	-64.4	0.1	0	0	0	112.7	Y57 Y128 F129	Y57-N131 WeakPolarHBondContact CE2-OD1 3.39Å; Y128-N131 PolarHBondContact O-N 2.94Å; Y128-N131 VanDerWaalsContact O-N 3.1Å; F129-N131 PolarHBondContact O-N 2.96Å
132	N	89.9	Confident	85.8	Confident	137 Å²	137	69.6 Å²	69.6	73%	0.733	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-105.4	4	-170.9	-67	-20.7	0	0	0	113.9	F129 C130	F129-N132 PolarHBondContact O-N 3.18Å; F129-N132 VanDerWaalsContact O-N 3.15Å; C130-N132 PolarHBondContact O-N 2.04Å
133	I	91.4	Very high	87.7	Confident	31 Å²	31	60.5 Å²	60.5	16%	0.159	29%	0.294	C	S	.	.	S	Bend	trans	-88.1	155.5	178.3	61.7	179.1	0	0	0	111.3	C56 C60 I108 F129 C130 Q135	C56-I133 HydrophobicContact CB-CD1 4.09Å; C56-I133 VanDerWaalsContact O-CD1 3.31Å; C56-I133 WeakPolarHBondContact O-CD1 3.39Å; C60-I133 HydrophobicContact CB-CD1 3.59Å; I108-I133 HydrophobicContact CD1-CB 4.42Å; I108-I133 HydrophobicContact CD1-CD1 3.32Å; I108-I133 HydrophobicContact CD1-CG1 4.4Å; I108-I133 HydrophobicContact CD1-CG2 4.39Å; F129-I133 HydrophobicContact CE1-CG2 4.14Å; F129-I133 HydrophobicContact CZ-CG2 4.06Å; C130-I133 VanDerWaalsContact O-CG1 3.29Å; C130-I133 WeakPolarHBondContact O-CG1 3.4Å; I133-Q135 PolarHBondContact O-N 2.93Å
134	S	91.4	Very high	89.5	Confident	77 Å²	77	50.4 Å²	50.4	54%	0.538	25%	0.25	S	C	.	.			trans	-55.4	137.9	167.4	176.3	0	0	0	0	110	C56 K136	C56-S134 WeakPolarHBondContact CB-O 3.49Å; S134-K136 VanDerWaalsContact C-N 3.32Å; S134-K136 PolarHBondContact OG-N 3.13Å; S134-K136 PolarHBondContact OG-O 3.44Å
135	Q	93.9	Very high	91	Very high	81 Å²	81	48.1 Å²	48.1	38%	0.379	24%	0.237	S	C	.	.	S	Bend	trans	-70.9	-30.9	176.8	-67.2	-60.7	-33.4	0	0	112.4	T55 C56 Y57 I133	T55-Q135 WeakPolarHBondContact CA-O 3.25Å; T55-Q135 WeakPolarHBondContact CB-O 3.46Å; T55-Q135 PolarHBondContact OG1-OE1 2.9Å; C56-Q135 PolarHBondContact N-O 3.35Å; Y57-Q135 VanDerWaalsContact CB-OE1 3.28Å; I133-Q135 PolarHBondContact O-N 2.93Å
136	K	96	Very high	92	Very high	93 Å²	93	49.5 Å²	49.5	40%	0.404	24%	0.244	S	C	.	.			trans	-103.9	139.6	-175.8	-61.9	-177.9	-179	-178.5	0	111	C56 S134 Q200 D202	C56-K136 VanDerWaalsContact SG-C 3.56Å; S134-K136 VanDerWaalsContact C-N 3.32Å; S134-K136 PolarHBondContact OG-N 3.13Å; S134-K136 PolarHBondContact OG-O 3.44Å; K136-Q200 WeakPolarHBondContact CA-O 3.2Å; K136-Q200 HydrophobicContact CG-CB 4.05Å; K136-D202 HydrophobicContact CB-CB 4.5Å; K136-D202 WeakPolarHBondContact CB-OD2 3.39Å; K136-D202 HydrophobicContact CD-CB 4.49Å; K136-D202 WeakPolarHBondContact CD-OD1 3.06Å; K136-D202 VanDerWaalsContact CD-OD2 3.31Å; K136-D202 WeakPolarHBondContact CD-OD2 3.31Å; K136-D202 IonicContact NZ-OD1 2.87Å; K136-D202 PolarHBondContact NZ-OD1 3.03Å
137	G	97.1	Very high	93	Very high	5 Å²	5	47.3 Å²	47.3	5%	0.052	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	-153.4	-179	0	0	0	0	0	113.8	C56 C168 Q200 F201 D202	C56-G137 VanDerWaalsContact SG-CA 3.52Å; C56-G137 PolarHBondContact SG-N 2.79Å; C56-G137 VanDerWaalsContact SG-N 3.4Å; G137-C168 WeakPolarHBondContact CA-O 3.14Å; G137-Q200 PolarHBondContact N-O 2.81Å; G137-F201 VanDerWaalsContact O-CA 3.26Å; G137-F201 WeakPolarHBondContact O-CA 3.18Å; G137-F201 WeakPolarHBondContact O-CB 3Å; G137-D202 PolarHBondContact O-N 2.9Å
138	V	98.5	Very high	93.8	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.018	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132.9	176	179.3	0	0	0	0	109.9	I140 C168 Y169 R170 C203 I205 C222	V138-I140 HydrophobicContact CG1-CG1 4.38Å; V138-C168 PolarHBondContact N-O 2.91Å; V138-Y169 CarbonylContact O-C 3.57Å; V138-Y169 WeakPolarHBondContact O-CA 3.43Å; V138-Y169 WeakPolarHBondContact O-CB 2.93Å; V138-R170 PolarHBondContact O-N 2.82Å; V138-C203 WeakPolarHBondContact CA-O 3.45Å; V138-C203 HydrophobicContact CG2-CB 4.43Å; V138-I205 HydrophobicContact CG1-CD1 3.63Å; V138-I205 HydrophobicContact CG1-CG1 3.83Å; V138-C222 HydrophobicContact CG2-CB 3.86Å
139	V	98.8	Very high	94.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	138.4	168	160.9	0	0	0	0	110	I141 R170 F172 A195 F199 F201 C203 V204 I205	V139-I141 HydrophobicContact CG1-CD1 3.98Å; V139-I141 HydrophobicContact CG1-CG1 3.66Å; V139-R170 WeakPolarHBondContact CA-O 3.1Å; V139-F172 HydrophobicContact CG1-CD2 3.88Å; V139-F172 HydrophobicContact CG1-CE2 4.24Å; V139-F172 HydrophobicContact CG2-CD2 4.43Å; V139-F172 HydrophobicContact CG2-CE2 3.99Å; V139-A195 HydrophobicContact CG1-CB 3.78Å; V139-A195 HydrophobicContact CG2-CB 4.08Å; V139-F199 HydrophobicContact CG2-CD1 3.62Å; V139-F199 HydrophobicContact CG2-CE1 4.29Å; V139-F201 HydrophobicContact CB-CB 4.39Å; V139-F201 HydrophobicContact CB-CD1 4.06Å; V139-F201 HydrophobicContact CB-CD2 3.91Å; V139-F201 HydrophobicContact CB-CE1 4.29Å; V139-F201 HydrophobicContact CB-CE2 4.14Å; V139-F201 HydrophobicContact CB-CG 3.86Å; V139-F201 HydrophobicContact CB-CZ 4.32Å; V139-F201 HydrophobicContact CG2-CB 3.83Å; V139-F201 HydrophobicContact CG2-CD1 3.17Å; V139-F201 HydrophobicContact CG2-CD2 3.91Å; V139-F201 HydrophobicContact CG2-CE1 3.58Å; V139-F201 HydrophobicContact CG2-CE2 4.26Å; V139-F201 HydrophobicContact CG2-CG 3.36Å; V139-F201 HydrophobicContact CG2-CZ 4.1Å; V139-C203 PolarHBondContact N-O 3.08Å; V139-V204 HydrophobicContact CG1-CG2 4.15Å; V139-V204 CarbonylContact O-C 3.47Å; V139-V204 WeakPolarHBondContact O-CA 3.49Å; V139-I205 PolarHBondContact O-N 2.91Å
140	I	98.9	Very high	94.4	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	117.6	172.8	-58.2	156.8	0	0	0	107.6	V138 I142 L158 L162 Y169 R170 I171 F172 I205 H207	V138-I140 HydrophobicContact CG1-CG1 4.38Å; I140-I142 HydrophobicContact CG2-CD1 4.47Å; I140-I142 HydrophobicContact CG2-CG1 4.17Å; I140-L158 HydrophobicContact CG2-CD2 4.38Å; I140-L162 HydrophobicContact CD1-CD1 3.31Å; I140-L162 HydrophobicContact CD1-CD2 3.74Å; I140-L162 HydrophobicContact CD1-CG 4.17Å; I140-Y169 HydrophobicContact CD1-CD2 4.23Å; I140-Y169 HydrophobicContact CD1-CG 4.44Å; I140-R170 PolarHBondContact N-O 2.85Å; I140-I171 HydrophobicContact CB-CG1 4.26Å; I140-I171 HydrophobicContact CD1-CG1 4.02Å; I140-I171 CarbonylContact O-C 3.58Å; I140-I171 WeakPolarHBondContact O-CA 3.29Å; I140-F172 PolarHBondContact O-N 3.36Å; I140-I205 CarbonylContact C-O 3.6Å; I140-I205 WeakPolarHBondContact CA-O 3.06Å; I140-I205 HydrophobicContact CG1-CB 4.16Å; I140-I205 HydrophobicContact CG1-CD1 4.34Å; I140-H207 HydrophobicContact CG2-CB 4.15Å
141	I	98.9	Very high	94.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	121	179.9	-67.2	160.6	0	0	0	108.6	V139 F172 I174 F192 V204 I205 F206 H207	V139-I141 HydrophobicContact CG1-CD1 3.98Å; V139-I141 HydrophobicContact CG1-CG1 3.66Å; I141-F172 WeakPolarHBondContact CA-O 3.34Å; I141-F172 HydrophobicContact CG1-CB 4.43Å; I141-I174 HydrophobicContact CG2-CG1 3.89Å; I141-F192 HydrophobicContact CD1-CB 4.09Å; I141-F192 VanDerWaalsContact CD1-N 3.29Å; I141-V204 HydrophobicContact CD1-CG2 3.55Å; I141-V204 HydrophobicContact CG1-CG2 4.3Å; I141-I205 PolarHBondContact N-O 3.09Å; I141-F206 HydrophobicContact CB-CD1 4.04Å; I141-F206 HydrophobicContact CB-CE1 4.3Å; I141-F206 HydrophobicContact CD1-CD1 4.19Å; I141-F206 HydrophobicContact CD1-CE1 3.6Å; I141-F206 HydrophobicContact CD1-CZ 4.37Å; I141-F206 HydrophobicContact CG2-CD1 4.25Å; I141-F206 HydrophobicContact CG2-CE1 4.49Å; I141-H207 PolarHBondContact O-N 3.46Å
142	I	98.7	Very high	94.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	100	178.1	-54.9	174.5	0	0	0	107.7	I140 I144 L151 L155 L158 I171 F172 V173 I174 H207 V209	I140-I142 HydrophobicContact CG2-CD1 4.47Å; I140-I142 HydrophobicContact CG2-CG1 4.17Å; I142-I144 HydrophobicContact CG2-CG2 3.89Å; I142-L151 HydrophobicContact CD1-CD1 3.98Å; I142-L151 HydrophobicContact CG2-CD1 3.95Å; I142-L155 HydrophobicContact CD1-CD2 4.04Å; I142-L158 HydrophobicContact CD1-CD2 4.46Å; I142-I171 HydrophobicContact CD1-CG2 3.91Å; I142-F172 PolarHBondContact N-O 3.17Å; I142-V173 HydrophobicContact CB-CG2 4.36Å; I142-V173 WeakPolarHBondContact O-CA 3.23Å; I142-I174 PolarHBondContact O-N 3.42Å; I142-H207 HydrophobicContact CG1-CB 4.19Å; I142-V209 HydrophobicContact CG2-CB 3.7Å; I142-V209 HydrophobicContact CG2-CG2 3.87Å
143	P	97.8	Very high	94.7	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.013	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	133.4	172.6	31.3	-33.2	0	0	0	109.6	M182 L187 K188	P143-M182 HydrophobicContact CB-CE 3.92Å; P143-L187 HydrophobicContact CB-CB 3.6Å; P143-L187 HydrophobicContact CB-CD1 3.91Å; P143-L187 HydrophobicContact CB-CG 4.43Å; P143-K188 HydrophobicContact CG-CG 4.21Å
144	I	95.9	Very high	94.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	157.5	177.2	72.8	167.5	0	0	0	112.1	I142 Q147 F148 L151 V173 I174 E175 Q176 V209	I142-I144 HydrophobicContact CG2-CG2 3.89Å; I144-Q147 VanDerWaalsContact CA-OE1 3.24Å; I144-F148 HydrophobicContact CD1-CD1 4.32Å; I144-F148 HydrophobicContact CD1-CE1 3.88Å; I144-F148 HydrophobicContact CD1-CE2 4.13Å; I144-F148 HydrophobicContact CD1-CZ 3.77Å; I144-L151 HydrophobicContact CD1-CD2 4.49Å; I144-V173 HydrophobicContact CD1-CG1 3.47Å; I144-V173 VanDerWaalsContact CD1-CG1 3.47Å; I144-V173 HydrophobicContact CG1-CG1 3.72Å; I144-V173 HydrophobicContact CG2-CG1 4.06Å; I144-I174 PolarHBondContact N-O 2.68Å; I144-E175 HydrophobicContact CD1-CB 4.12Å; I144-E175 HydrophobicContact CD1-CG 4.26Å; I144-E175 HydrophobicContact CG1-CB 3.79Å; I144-E175 HydrophobicContact CG1-CG 4.06Å; I144-E175 WeakPolarHBondContact O-CA 3.42Å; I144-Q176 PolarHBondContact O-N 2.91Å; I144-V209 HydrophobicContact CG2-CB 3.88Å; I144-V209 HydrophobicContact CG2-CG1 4.34Å; I144-V209 HydrophobicContact CG2-CG2 3.58Å
145	K	93.6	Very high	94.9	Very high	30 Å²	30	28.8 Å²	28.8	13%	0.13	14%	0.136	C	C	.	.	S	Bend	trans	-141.4	98.3	162.3	-172.1	177.3	-173.3	-172.6	0	108.8	Q147 Q176 D178 E180 M182	K145-Q147 WeakPolarHBondContact O-CG 3.05Å; K145-Q147 PolarHBondContact O-N 2.79Å; K145-Q176 HydrophobicContact CB-CB 4.49Å; K145-Q176 HydrophobicContact CG-CB 4.47Å; K145-D178 VanDerWaalsContact CE-O 3.22Å; K145-D178 WeakPolarHBondContact CE-O 3.4Å; K145-D178 PolarHBondContact NZ-O 3.02Å; K145-E180 PolarHBondContact NZ-O 3.34Å; K145-M182 HydrophobicContact CB-CB 4.44Å; K145-M182 HydrophobicContact CB-CG 4.13Å; K145-M182 HydrophobicContact CB-SD 3.93Å; K145-M182 HydrophobicContact CD-CB 4.25Å
146	N	90.6	Very high	94.8	Very high	131 Å²	131	25.2 Å²	25.2	70%	0.701	12%	0.12	S	C	*	.	S	Bend	trans	55.3	31	-178.9	-165.1	36.6	0	0	0	114.7
147	Q	92.9	Very high	94.5	Very high	12 Å²	12	22 Å²	22	6%	0.056	11%	0.108	C	C	.	.			trans	-107	41.1	-178.2	-65.2	134.5	-17.2	0	0	112.1	I144 K145 Q149 Q150 L151 V209 Y308	I144-Q147 VanDerWaalsContact CA-OE1 3.24Å; K145-Q147 WeakPolarHBondContact O-CG 3.05Å; K145-Q147 PolarHBondContact O-N 2.79Å; Q147-Q149 VanDerWaalsContact C-N 3.31Å; Q147-Q149 PolarHBondContact O-N 3.08Å; Q147-Q150 HydrophobicContact CB-CB 4.35Å; Q147-Q150 PolarHBondContact O-N 3.34Å; Q147-Q150 PolarHBondContact O-OE1 2.9Å; Q147-L151 WeakPolarHBondContact O-CB 3.06Å; Q147-L151 PolarHBondContact O-N 2.9Å; Q147-V209 HydrophobicContact CB-CG1 3.85Å; Q147-V209 HydrophobicContact CB-CG2 4.36Å; Q147-V209 HydrophobicContact CG-CG1 4.27Å; Q147-Y308 HydrophobicContact CG-CD2 4.24Å
148	F	92.2	Very high	94.4	Very high	54 Å²	54	21.8 Å²	21.8	24%	0.237	11%	0.106	C	C	.	.	H	α-helix	trans	-64.8	-32.3	-175.7	-77.4	-78.5	0	0	0	113.5	I144 L151 Y152 E175 H353	I144-F148 HydrophobicContact CD1-CD1 4.32Å; I144-F148 HydrophobicContact CD1-CE1 3.88Å; I144-F148 HydrophobicContact CD1-CE2 4.13Å; I144-F148 HydrophobicContact CD1-CZ 3.77Å; F148-L151 HydrophobicContact CD1-CD2 3.94Å; F148-L151 HydrophobicContact CE1-CD2 4.27Å; F148-L151 WeakPolarHBondContact O-CB 3.38Å; F148-L151 PolarHBondContact O-N 3.4Å; F148-Y152 HydrophobicContact CB-CE2 4.03Å; F148-Y152 HydrophobicContact CD1-CE2 4.49Å; F148-Y152 WeakPolarHBondContact O-CD2 3.33Å; F148-Y152 PolarHBondContact O-N 2.72Å; F148-E175 WeakPolarHBondContact CE2-OE1 3.29Å; F148-H353 AromaticContact CZ-CE1 3.83Å; F148-H353 AromaticContact CZ-NE2 3.95Å
149	Q	90.9	Very high	94.2	Very high	122 Å²	122	21.7 Å²	21.7	57%	0.57	11%	0.105	S	C	*	.	H	α-helix	trans	-61.9	-50.9	175.6	-178.3	176.9	-2.7	0	0	110.6	Q147 L151 Y152 I153	Q147-Q149 VanDerWaalsContact C-N 3.31Å; Q147-Q149 PolarHBondContact O-N 3.08Å; Q149-L151 VanDerWaalsContact C-N 3.29Å; Q149-L151 PolarHBondContact O-N 3.38Å; Q149-Y152 PolarHBondContact O-N 3.08Å; Q149-I153 HydrophobicContact CG-CD1 3.87Å; Q149-I153 VanDerWaalsContact O-CD1 3.27Å; Q149-I153 WeakPolarHBondContact O-CD1 3.28Å; Q149-I153 VanDerWaalsContact O-CG1 3.25Å; Q149-I153 WeakPolarHBondContact O-CG1 3.3Å; Q149-I153 PolarHBondContact O-N 3.17Å; Q149-I153 VanDerWaalsContact O-N 3.13Å
150	Q	92.2	Very high	93.7	Very high	14 Å²	14	21.8 Å²	21.8	7%	0.065	11%	0.106	C	C	.	.	H	α-helix	trans	-59.1	-43.8	176.6	-65.6	65.9	31.1	0	0	110.2	Q147 Y152 I153 T154 V209 D210 I306 P307	Q147-Q150 HydrophobicContact CB-CB 4.35Å; Q147-Q150 PolarHBondContact O-N 3.34Å; Q147-Q150 PolarHBondContact O-OE1 2.9Å; Q150-Y152 PolarHBondContact O-N 2.75Å; Q150-I153 PolarHBondContact O-N 2.91Å; Q150-T154 WeakPolarHBondContact O-CB 3.42Å; Q150-T154 PolarHBondContact O-N 2.94Å; Q150-T154 PolarHBondContact O-OG1 3.38Å; Q150-V209 CarbonylContact C-O 3.57Å; Q150-V209 HydrophobicContact CB-CG1 4.43Å; Q150-V209 HydrophobicContact CB-CG2 4.12Å; Q150-D210 HydrophobicContact CG-CB 4.43Å; Q150-I306 HydrophobicContact CB-CG2 4.41Å; Q150-I306 HydrophobicContact CG-CB 4.34Å; Q150-I306 HydrophobicContact CG-CG2 3.91Å; Q150-P307 PolarHBondContact NE2-O 2.76Å
151	L	95.1	Very high	93.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-55.2	-51.8	177.1	177.5	67.9	0	0	0	111.6	I142 I144 Q147 F148 Q149 I153 T154 L155 V173 V209 F351	I142-L151 HydrophobicContact CD1-CD1 3.98Å; I142-L151 HydrophobicContact CG2-CD1 3.95Å; I144-L151 HydrophobicContact CD1-CD2 4.49Å; Q147-L151 WeakPolarHBondContact O-CB 3.06Å; Q147-L151 PolarHBondContact O-N 2.9Å; F148-L151 HydrophobicContact CD1-CD2 3.94Å; F148-L151 HydrophobicContact CE1-CD2 4.27Å; F148-L151 WeakPolarHBondContact O-CB 3.38Å; F148-L151 PolarHBondContact O-N 3.4Å; Q149-L151 VanDerWaalsContact C-N 3.29Å; Q149-L151 PolarHBondContact O-N 3.38Å; L151-I153 VanDerWaalsContact C-N 3.32Å; L151-I153 PolarHBondContact O-N 3.08Å; L151-T154 PolarHBondContact O-N 2.99Å; L151-L155 HydrophobicContact CD1-CD1 3.94Å; L151-L155 HydrophobicContact CD1-CG 4.07Å; L151-L155 HydrophobicContact CG-CD1 3.93Å; L151-L155 HydrophobicContact CG-CG 4.37Å; L151-L155 WeakPolarHBondContact O-CB 3.31Å; L151-L155 VanDerWaalsContact O-CG 3.23Å; L151-L155 WeakPolarHBondContact O-CG 3.43Å; L151-L155 PolarHBondContact O-N 3.11Å; L151-V173 HydrophobicContact CD1-CG2 3.76Å; L151-V173 HydrophobicContact CD2-CG1 4.09Å; L151-V173 HydrophobicContact CD2-CG2 4.04Å; L151-V209 VanDerWaalsContact CA-CG2 3.48Å; L151-V209 HydrophobicContact CB-CG2 3.68Å; L151-V209 HydrophobicContact CD1-CG2 4.19Å; L151-F351 HydrophobicContact CD2-CE1 4.05Å; L151-F351 HydrophobicContact CD2-CE2 4.35Å; L151-F351 HydrophobicContact CD2-CZ 3.8Å
152	Y	92.6	Very high	93.3	Very high	53 Å²	53	21.9 Å²	21.9	21%	0.208	11%	0.107	C	C	.	.	H	α-helix	trans	-67	-35	-177.3	-62.9	-47.4	0	0	0	112.7	A89 L91 L94 F148 Q149 Q150 S156 F351	A89-Y152 WeakPolarHBondContact CB-O 3.35Å; A89-Y152 VanDerWaalsContact O-CB 3.29Å; A89-Y152 WeakPolarHBondContact O-CB 3.46Å; L91-Y152 HydrophobicContact CD1-CE1 4.1Å; L94-Y152 HydrophobicContact CD1-CD1 3.92Å; F148-Y152 HydrophobicContact CB-CE2 4.03Å; F148-Y152 HydrophobicContact CD1-CE2 4.49Å; F148-Y152 WeakPolarHBondContact O-CD2 3.33Å; F148-Y152 PolarHBondContact O-N 2.72Å; Q149-Y152 PolarHBondContact O-N 3.08Å; Q150-Y152 PolarHBondContact O-N 2.75Å; Y152-S156 WeakPolarHBondContact O-CB 3.18Å; Y152-S156 PolarHBondContact O-N 3.33Å; Y152-S156 VanDerWaalsContact O-N 3.1Å; Y152-F351 HydrophobicContact CE1-CE1 4.4Å
153	I	90.8	Very high	92.9	Very high	4 Å²	4	22 Å²	22	2%	0.021	11%	0.107	C	C	.	.	H	α-helix	trans	-64.4	-51.4	174.3	-64	157.2	0	0	0	110.1	F87 A89 Q149 Q150 L151 L155 S156 I306	F87-I153 HydrophobicContact CB-CD1 3.8Å; F87-I153 HydrophobicContact CB-CG1 4.13Å; F87-I153 HydrophobicContact CB-CG2 4.12Å; F87-I153 HydrophobicContact CD1-CG2 3.53Å; F87-I153 HydrophobicContact CE1-CG2 4.39Å; F87-I153 HydrophobicContact CG-CG2 4.26Å; F87-I153 WeakPolarHBondContact O-CD1 3.29Å; F87-I153 WeakPolarHBondContact O-CG1 3.49Å; A89-I153 HydrophobicContact CB-CG1 4.48Å; Q149-I153 HydrophobicContact CG-CD1 3.87Å; Q149-I153 VanDerWaalsContact O-CD1 3.27Å; Q149-I153 WeakPolarHBondContact O-CD1 3.28Å; Q149-I153 VanDerWaalsContact O-CG1 3.25Å; Q149-I153 WeakPolarHBondContact O-CG1 3.3Å; Q149-I153 PolarHBondContact O-N 3.17Å; Q149-I153 VanDerWaalsContact O-N 3.13Å; Q150-I153 PolarHBondContact O-N 2.91Å; L151-I153 VanDerWaalsContact C-N 3.32Å; L151-I153 PolarHBondContact O-N 3.08Å; I153-L155 VanDerWaalsContact C-N 3.34Å; I153-L155 PolarHBondContact O-N 3.26Å; I153-S156 WeakPolarHBondContact O-CB 3.41Å; I153-S156 PolarHBondContact O-N 2.9Å; I153-S156 PolarHBondContact O-OG 3Å; I153-I306 HydrophobicContact CB-CD1 3.82Å; I153-I306 HydrophobicContact CD1-CG2 3.65Å; I153-I306 HydrophobicContact CG2-CD1 3.44Å; I153-I306 VanDerWaalsContact CG2-CD1 3.44Å; I153-I306 HydrophobicContact CG2-CG1 3.89Å; I153-I306 HydrophobicContact CG2-CG2 4.48Å
154	T	94.2	Very high	92.5	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59.3	-44.4	178.6	-69	0	0	0	0	111.8	Q150 L151 S156 T157 L158 H207 V209 I306	Q150-T154 WeakPolarHBondContact O-CB 3.42Å; Q150-T154 PolarHBondContact O-N 2.94Å; Q150-T154 PolarHBondContact O-OG1 3.38Å; L151-T154 PolarHBondContact O-N 2.99Å; T154-S156 PolarHBondContact O-N 3.42Å; T154-T157 PolarHBondContact O-N 3.05Å; T154-T157 PolarHBondContact O-OG1 3.39Å; T154-L158 WeakPolarHBondContact O-CB 3.26Å; T154-L158 PolarHBondContact O-N 3.22Å; T154-H207 VanDerWaalsContact CG2-CE1 3.4Å; T154-H207 WeakPolarHBondContact CG2-CE1 3.38Å; T154-V209 WeakPolarHBondContact CB-O 3.26Å; T154-V209 PolarHBondContact OG1-O 3.35Å; T154-I306 WeakPolarHBondContact OG1-CD1 3.5Å
155	L	94.4	Very high	92.4	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.6	-29.2	176.3	-70.8	178.9	0	0	0	112.8	L94 I142 L151 I153 T157 L158 I159 I171 F351	L94-L155 HydrophobicContact CD1-CB 4.06Å; L94-L155 HydrophobicContact CD2-CB 4.36Å; I142-L155 HydrophobicContact CD1-CD2 4.04Å; L151-L155 HydrophobicContact CD1-CD1 3.94Å; L151-L155 HydrophobicContact CD1-CG 4.07Å; L151-L155 HydrophobicContact CG-CD1 3.93Å; L151-L155 HydrophobicContact CG-CG 4.37Å; L151-L155 WeakPolarHBondContact O-CB 3.31Å; L151-L155 VanDerWaalsContact O-CG 3.23Å; L151-L155 WeakPolarHBondContact O-CG 3.43Å; L151-L155 PolarHBondContact O-N 3.11Å; I153-L155 VanDerWaalsContact C-N 3.34Å; I153-L155 PolarHBondContact O-N 3.26Å; L155-T157 VanDerWaalsContact C-N 3.27Å; L155-T157 PolarHBondContact O-N 3.4Å; L155-L158 HydrophobicContact CD2-CD2 4.37Å; L155-I159 HydrophobicContact CB-CD1 4Å; L155-I159 HydrophobicContact CB-CG1 4.45Å; L155-I159 HydrophobicContact CD2-CD1 4.19Å; L155-I159 HydrophobicContact CD2-CG1 4.26Å; L155-I159 WeakPolarHBondContact O-CB 3.34Å; L155-I159 WeakPolarHBondContact O-CG1 3.34Å; L155-I159 PolarHBondContact O-N 2.92Å; L155-I171 HydrophobicContact CD2-CD1 3.93Å; L155-I171 HydrophobicContact CD2-CG2 4.44Å; L155-F351 HydrophobicContact CD1-CD1 3.74Å; L155-F351 HydrophobicContact CD1-CE1 3.82Å
156	S	90.1	Very high	92.3	Very high	7 Å²	7	28.1 Å²	28.1	5%	0.049	14%	0.137	C	C	.	.	H	α-helix	trans	-68	-25.3	-179	79	0	0	0	0	114	L94 Y152 I153 T154 P160	L94-S156 VanDerWaalsContact CD2-CB 3.44Å; Y152-S156 WeakPolarHBondContact O-CB 3.18Å; Y152-S156 PolarHBondContact O-N 3.33Å; Y152-S156 VanDerWaalsContact O-N 3.1Å; I153-S156 WeakPolarHBondContact O-CB 3.41Å; I153-S156 PolarHBondContact O-N 2.9Å; I153-S156 PolarHBondContact O-OG 3Å; T154-S156 PolarHBondContact O-N 3.42Å; S156-P160 WeakPolarHBondContact O-CD 3.39Å; S156-P160 WeakPolarHBondContact O-CG 3.34Å
157	T	90.6	Very high	92.5	Very high	25 Å²	25	22.3 Å²	22.3	15%	0.153	11%	0.106	C	C	.	.	H	α-helix	trans	-101.7	-37.5	173.6	66.3	0	0	0	0	111.8	T154 L155 P160 I161 A212 P213	T154-T157 PolarHBondContact O-N 3.05Å; T154-T157 PolarHBondContact O-OG1 3.39Å; L155-T157 VanDerWaalsContact C-N 3.27Å; L155-T157 PolarHBondContact O-N 3.4Å; T157-P160 WeakPolarHBondContact O-CD 3.12Å; T157-I161 WeakPolarHBondContact O-CG1 3.35Å; T157-I161 PolarHBondContact O-N 2.98Å; T157-A212 HydrophobicContact CG2-CB 4.41Å; T157-P213 VanDerWaalsContact CB-O 3.26Å; T157-P213 WeakPolarHBondContact CB-O 3.39Å; T157-P213 WeakPolarHBondContact OG1-CD 3.48Å; T157-P213 PolarHBondContact OG1-O 3.09Å; T157-P213 VanDerWaalsContact OG1-O 3.08Å
158	L	94.9	Very high	92.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.1	-53.6	-179.1	176.9	60	0	0	0	111.9	I140 I142 T154 L155 I161 L162 P213 Y220	I140-L158 HydrophobicContact CG2-CD2 4.38Å; I142-L158 HydrophobicContact CD1-CD2 4.46Å; T154-L158 WeakPolarHBondContact O-CB 3.26Å; T154-L158 PolarHBondContact O-N 3.22Å; L155-L158 HydrophobicContact CD2-CD2 4.37Å; L158-I161 WeakPolarHBondContact O-CB 3.39Å; L158-I161 PolarHBondContact O-N 2.85Å; L158-L162 HydrophobicContact CD1-CD1 4.2Å; L158-L162 HydrophobicContact CD1-CD2 3.87Å; L158-L162 HydrophobicContact CD1-CG 3.96Å; L158-L162 HydrophobicContact CG-CD1 4Å; L158-L162 HydrophobicContact CG-CG 4.19Å; L158-L162 WeakPolarHBondContact O-CG 3.39Å; L158-L162 PolarHBondContact O-N 3.33Å; L158-P213 HydrophobicContact CB-CG 4.02Å; L158-P213 HydrophobicContact CD1-CG 4.1Å; L158-Y220 HydrophobicContact CD1-CD1 3.84Å; L158-Y220 HydrophobicContact CD1-CE1 3.24Å; L158-Y220 HydrophobicContact CD1-CE2 4.29Å
159	I	93.6	Very high	92.9	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-58.9	-48.2	-173.7	-66.3	169.2	0	0	0	112	T98 L155 I161 L162 Q163 I171 F350	T98-I159 HydrophobicContact CG2-CB 4.15Å; T98-I159 HydrophobicContact CG2-CG2 3.45Å; T98-I159 VanDerWaalsContact CG2-CG2 3.45Å; L155-I159 HydrophobicContact CB-CD1 4Å; L155-I159 HydrophobicContact CB-CG1 4.45Å; L155-I159 HydrophobicContact CD2-CD1 4.19Å; L155-I159 HydrophobicContact CD2-CG1 4.26Å; L155-I159 WeakPolarHBondContact O-CB 3.34Å; L155-I159 WeakPolarHBondContact O-CG1 3.34Å; L155-I159 PolarHBondContact O-N 2.92Å; I159-I161 VanDerWaalsContact C-N 3.26Å; I159-I161 PolarHBondContact O-N 3.06Å; I159-L162 PolarHBondContact O-N 3.44Å; I159-Q163 HydrophobicContact CG2-CG 4.08Å; I159-Q163 WeakPolarHBondContact O-CB 3.24Å; I159-Q163 VanDerWaalsContact O-CG 3.28Å; I159-Q163 WeakPolarHBondContact O-CG 3.11Å; I159-Q163 PolarHBondContact O-N 2.94Å; I159-I171 HydrophobicContact CG1-CD1 4.08Å; I159-F350 HydrophobicContact CD1-CB 3.76Å; I159-F350 HydrophobicContact CD1-CD1 3.65Å; I159-F350 HydrophobicContact CD1-CE1 4.43Å; I159-F350 HydrophobicContact CD1-CG 3.75Å
160	P	89.8	Confident	93.3	Very high	3 Å²	3	15.3 Å²	15.3	2%	0.019	7%	0.074	C	C	.	.	H	α-helix	trans	-54.9	-39.9	174.3	-28.8	36.6	0	0	0	113.7	S156 T157 Q163 I164	S156-P160 WeakPolarHBondContact O-CD 3.39Å; S156-P160 WeakPolarHBondContact O-CG 3.34Å; T157-P160 WeakPolarHBondContact O-CD 3.12Å; P160-Q163 PolarHBondContact O-N 3.37Å; P160-I164 WeakPolarHBondContact O-CB 3.35Å; P160-I164 VanDerWaalsContact O-CG1 3.27Å; P160-I164 WeakPolarHBondContact O-CG1 3.38Å; P160-I164 PolarHBondContact O-N 3.18Å
161	I	92.3	Very high	93.6	Very high	2 Å²	2	14.6 Å²	14.6	1%	0.01	7%	0.071	C	C	.	.	H	α-helix	trans	-62	-50.7	176.3	-70.1	169.4	0	0	0	110.7	T157 L158 I159 Q163 I164 Q165 P213 Y216 Y220	T157-I161 WeakPolarHBondContact O-CG1 3.35Å; T157-I161 PolarHBondContact O-N 2.98Å; L158-I161 WeakPolarHBondContact O-CB 3.39Å; L158-I161 PolarHBondContact O-N 2.85Å; I159-I161 VanDerWaalsContact C-N 3.26Å; I159-I161 PolarHBondContact O-N 3.06Å; I161-Q163 PolarHBondContact O-N 3.19Å; I161-I164 PolarHBondContact O-N 2.02Å; I161-Q165 HydrophobicContact CG2-CG 4.46Å; I161-Q165 VanDerWaalsContact CG2-NE2 3.31Å; I161-Q165 WeakPolarHBondContact O-CB 3.39Å; I161-Q165 VanDerWaalsContact O-CG 3.24Å; I161-Q165 WeakPolarHBondContact O-CG 3.4Å; I161-Q165 PolarHBondContact O-N 3.48Å; I161-P213 HydrophobicContact CD1-CB 3.67Å; I161-P213 HydrophobicContact CD1-CG 3.76Å; I161-Y216 HydrophobicContact CB-CD1 4.33Å; I161-Y216 HydrophobicContact CD1-CD1 4.37Å; I161-Y216 HydrophobicContact CG1-CD1 3.37Å; I161-Y216 HydrophobicContact CG1-CE1 3.69Å; I161-Y216 HydrophobicContact CG1-CG 4.19Å; I161-Y220 HydrophobicContact CG2-CD2 4.33Å
162	L	95.3	Very high	93.8	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-57.4	-41.8	179.2	-56.5	174.9	0	0	0	111.7	I140 L158 I159 Q165 H166 I167 Y169 I171 Y220	I140-L162 HydrophobicContact CD1-CD1 3.31Å; I140-L162 HydrophobicContact CD1-CD2 3.74Å; I140-L162 HydrophobicContact CD1-CG 4.17Å; L158-L162 HydrophobicContact CD1-CD1 4.2Å; L158-L162 HydrophobicContact CD1-CD2 3.87Å; L158-L162 HydrophobicContact CD1-CG 3.96Å; L158-L162 HydrophobicContact CG-CD1 4Å; L158-L162 HydrophobicContact CG-CG 4.19Å; L158-L162 WeakPolarHBondContact O-CG 3.39Å; L158-L162 PolarHBondContact O-N 3.33Å; I159-L162 PolarHBondContact O-N 3.44Å; L162-Q165 PolarHBondContact O-N 3.36Å; L162-H166 PolarHBondContact O-N 2.62Å; L162-I167 HydrophobicContact CB-CD1 4.19Å; L162-I167 HydrophobicContact CB-CG1 4.4Å; L162-I167 HydrophobicContact CD2-CD1 3.68Å; L162-I167 HydrophobicContact CG-CD1 4.47Å; L162-Y169 HydrophobicContact CB-CD1 3.87Å; L162-Y169 HydrophobicContact CB-CE1 3.47Å; L162-Y169 VanDerWaalsContact CB-CE1 3.47Å; L162-Y169 HydrophobicContact CD1-CD1 4.17Å; L162-Y169 HydrophobicContact CD1-CD2 3.92Å; L162-Y169 HydrophobicContact CD1-CE1 3.93Å; L162-Y169 HydrophobicContact CD1-CE2 3.72Å; L162-Y169 HydrophobicContact CD1-CG 4.14Å; L162-Y169 HydrophobicContact CG-CE1 4.34Å; L162-I171 HydrophobicContact CD1-CD1 4.14Å; L162-Y220 VanDerWaalsContact CD2-CB 3.46Å; L162-Y220 HydrophobicContact CD2-CD1 3.45Å; L162-Y220 VanDerWaalsContact CD2-CD1 3.45Å; L162-Y220 HydrophobicContact CD2-CD2 4.45Å; L162-Y220 HydrophobicContact CD2-CE1 4.3Å; L162-Y220 HydrophobicContact CD2-CG 3.56Å
163	Q	91.5	Very high	94.1	Very high	3 Å²	3	12.1 Å²	12.1	1%	0.014	6%	0.061	C	C	.	.	H	α-helix	trans	-71.8	-41.7	-176.9	-67.6	-178.9	-20.9	0	0	111.9	Y99 W107 I159 P160 I161 Q165 H166 Y169	Y99-Q163 HydrophobicContact CD2-CB 3.85Å; Y99-Q163 HydrophobicContact CD2-CG 4.37Å; Y99-Q163 VanDerWaalsContact CD2-OE1 3.29Å; Y99-Q163 HydrophobicContact CE2-CB 4.37Å; W107-Q163 HydrophobicContact CD2-CG 3.85Å; W107-Q163 HydrophobicContact CE3-CG 4.13Å; W107-Q163 HydrophobicContact CG-CG 4.44Å; W107-Q163 HydrophobicContact CH2-CB 3.86Å; W107-Q163 HydrophobicContact CH2-CG 4.04Å; W107-Q163 WeakPolarHBondContact CH2-O 3.41Å; W107-Q163 HydrophobicContact CZ2-CB 3.85Å; W107-Q163 HydrophobicContact CZ2-CG 3.75Å; W107-Q163 HydrophobicContact CZ3-CB 4.31Å; W107-Q163 HydrophobicContact CZ3-CG 4.22Å; I159-Q163 HydrophobicContact CG2-CG 4.08Å; I159-Q163 WeakPolarHBondContact O-CB 3.24Å; I159-Q163 VanDerWaalsContact O-CG 3.28Å; I159-Q163 WeakPolarHBondContact O-CG 3.11Å; I159-Q163 PolarHBondContact O-N 2.94Å; P160-Q163 PolarHBondContact O-N 3.37Å; I161-Q163 PolarHBondContact O-N 3.19Å; Q163-Q165 VanDerWaalsContact C-N 3.25Å; Q163-Q165 PolarHBondContact O-N 3Å; Q163-H166 PolarHBondContact O-CD2 2.91Å; Q163-H166 PolarHBondContact O-N 3Å; Q163-H166 VanDerWaalsContact O-N 3.08Å; Q163-Y169 HydrophobicContact CG-CE1 4.36Å
164	I	89.4	Confident	94.5	Very high	62 Å²	62	11.9 Å²	11.9	32%	0.318	6%	0.06	S	C	.	.	H	α-helix	trans	-63.9	-33.4	173.7	-72.9	167.5	0	0	0	111.3	P160 I161 H166 Y216	P160-I164 WeakPolarHBondContact O-CB 3.35Å; P160-I164 VanDerWaalsContact O-CG1 3.27Å; P160-I164 WeakPolarHBondContact O-CG1 3.38Å; P160-I164 PolarHBondContact O-N 3.18Å; I161-I164 PolarHBondContact O-N 2.02Å; I164-H166 PolarHBondContact O-N 3.4Å; I164-Y216 HydrophobicContact CD1-CD1 3.91Å; I164-Y216 HydrophobicContact CD1-CE1 3.98Å
165	Q	92.6	Very high	94.6	Very high	22 Å²	22	12.8 Å²	12.8	10%	0.103	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-1.5	176.1	-70.3	177.4	5.7	0	0	113.7	I161 L162 Q163 I167 Y216 N218 Q221	I161-Q165 HydrophobicContact CG2-CG 4.46Å; I161-Q165 VanDerWaalsContact CG2-NE2 3.31Å; I161-Q165 WeakPolarHBondContact O-CB 3.39Å; I161-Q165 VanDerWaalsContact O-CG 3.24Å; I161-Q165 WeakPolarHBondContact O-CG 3.4Å; I161-Q165 PolarHBondContact O-N 3.48Å; L162-Q165 PolarHBondContact O-N 3.36Å; Q163-Q165 VanDerWaalsContact C-N 3.25Å; Q163-Q165 PolarHBondContact O-N 3Å; Q165-I167 HydrophobicContact CB-CG2 3.65Å; Q165-I167 WeakPolarHBondContact O-CG2 3.4Å; Q165-I167 PolarHBondContact O-N 2.89Å; Q165-Y216 PolarHBondContact NE2-O 3.38Å; Q165-N218 PolarHBondContact NE2-O 2.95Å; Q165-Q221 PolarHBondContact O-NE2 2.88Å
166	H	92	Very high	94.7	Very high	76 Å²	76	13 Å²	13	35%	0.352	7%	0.065	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	33.5	177.2	-60.4	161.2	0	0	0	114.5	Y109 L162 Q163 I164	Y109-H166 HydrophobicContact CD2-CB 4.31Å; Y109-H166 AromaticContact CD2-CD2 3.14Å; Y109-H166 WeakPolarHBondContact CD2-CD2 3.41Å; Y109-H166 AromaticContact CD2-CE1 3.93Å; Y109-H166 AromaticContact CD2-CG 3.65Å; Y109-H166 AromaticContact CD2-NE2 3.35Å; Y109-H166 WeakPolarHBondContact CD2-NE2 3.47Å; Y109-H166 AromaticContact CE2-CD2 3.7Å; Y109-H166 AromaticContact CE2-CE1 3.72Å; Y109-H166 AromaticContact CE2-NE2 3.35Å; Y109-H166 WeakPolarHBondContact CE2-NE2 3.47Å; Y109-H166 HydrophobicContact CG-CB 3.98Å; Y109-H166 AromaticContact CG-CD2 3.74Å; Y109-H166 AromaticContact CG-CG 3.79Å; L162-H166 PolarHBondContact O-N 2.62Å; Q163-H166 PolarHBondContact O-CD2 2.91Å; Q163-H166 PolarHBondContact O-N 3Å; Q163-H166 VanDerWaalsContact O-N 3.08Å; I164-H166 PolarHBondContact O-N 3.4Å
167	I	94.5	Very high	94.9	Very high	9 Å²	9	14.9 Å²	14.9	5%	0.046	7%	0.074	C	C	.	.			trans	-87.2	150.6	-175.8	83.4	-178.6	0	0	0	111.2	W107 L162 Q165 Y169 Q221	W107-I167 WeakPolarHBondContact CZ3-O 3.14Å; L162-I167 HydrophobicContact CB-CD1 4.19Å; L162-I167 HydrophobicContact CB-CG1 4.4Å; L162-I167 HydrophobicContact CD2-CD1 3.68Å; L162-I167 HydrophobicContact CG-CD1 4.47Å; Q165-I167 HydrophobicContact CB-CG2 3.65Å; Q165-I167 WeakPolarHBondContact O-CG2 3.4Å; Q165-I167 PolarHBondContact O-N 2.89Å; I167-Y169 HydrophobicContact CD1-CD1 4.11Å; I167-Y169 HydrophobicContact CD1-CG 4.43Å; I167-Y169 HydrophobicContact CG1-CD1 3.54Å; I167-Y169 HydrophobicContact CG1-CE1 4.47Å; I167-Y169 HydrophobicContact CG1-CG 4.2Å; I167-Q221 HydrophobicContact CB-CG 4.41Å; I167-Q221 HydrophobicContact CG2-CB 4.26Å; I167-Q221 HydrophobicContact CG2-CG 3.25Å
168	C	97	Very high	94.9	Very high	16 Å²	16	14.4 Å²	14.4	11%	0.108	7%	0.071	C	C	.	.			trans	-85.5	121.4	163.9	175.5	0	0	0	0	109.3	C56 W107 I108 G137 V138	C56-C168 WeakPolarHBondContact CA-SG 3.36Å; C56-C168 HydrophobicContact CB-CB 3.85Å; C56-C168 WeakPolarHBondContact CB-SG 2.97Å; C56-C168 WeakPolarHBondContact SG-CB 3.43Å; C56-C168 CovalentContact SG-SG 2.02Å; C56-C168 PolarHBondContact SG-SG 3.34Å; W107-C168 WeakPolarHBondContact O-CA 3.5Å; I108-C168 HydrophobicContact CB-CB 4.2Å; I108-C168 HydrophobicContact CD1-CB 3.74Å; I108-C168 HydrophobicContact CG1-CB 3.77Å; G137-C168 WeakPolarHBondContact CA-O 3.14Å; V138-C168 PolarHBondContact N-O 2.91Å
169	Y	98.1	Very high	94.6	Very high	6 Å²	6	20.9 Å²	20.9	2%	0.024	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	164.2	-177.1	70	-93.3	0	0	0	114.3	S106 W107 V138 I140 L162 Q163 I167 I171	S106-Y169 WeakPolarHBondContact CA-O 3.35Å; W107-Y169 HydrophobicContact CB-CD1 4.21Å; W107-Y169 HydrophobicContact CB-CE1 3.65Å; W107-Y169 HydrophobicContact CB-CE2 4.03Å; W107-Y169 AromaticContact CD2-CE1 3.84Å; W107-Y169 HydrophobicContact CD2-CE1 3.84Å; W107-Y169 AromaticContact CE3-CD1 3.88Å; W107-Y169 HydrophobicContact CE3-CD1 3.88Å; W107-Y169 AromaticContact CE3-CE1 3.4Å; W107-Y169 HydrophobicContact CE3-CE1 3.4Å; W107-Y169 VanDerWaalsContact CE3-CE1 3.4Å; W107-Y169 AromaticContact CG-CE1 3.96Å; W107-Y169 HydrophobicContact CG-CE1 3.96Å; W107-Y169 HydrophobicContact CZ3-CE1 4.31Å; W107-Y169 PolarHBondContact N-O 3.28Å; W107-Y169 PolarHBondContact O-N 3.1Å; V138-Y169 CarbonylContact O-C 3.57Å; V138-Y169 WeakPolarHBondContact O-CA 3.43Å; V138-Y169 WeakPolarHBondContact O-CB 2.93Å; I140-Y169 HydrophobicContact CD1-CD2 4.23Å; I140-Y169 HydrophobicContact CD1-CG 4.44Å; L162-Y169 HydrophobicContact CB-CD1 3.87Å; L162-Y169 HydrophobicContact CB-CE1 3.47Å; L162-Y169 VanDerWaalsContact CB-CE1 3.47Å; L162-Y169 HydrophobicContact CD1-CD1 4.17Å; L162-Y169 HydrophobicContact CD1-CD2 3.92Å; L162-Y169 HydrophobicContact CD1-CE1 3.93Å; L162-Y169 HydrophobicContact CD1-CE2 3.72Å; L162-Y169 HydrophobicContact CD1-CG 4.14Å; L162-Y169 HydrophobicContact CG-CE1 4.34Å; Q163-Y169 HydrophobicContact CG-CE1 4.36Å; I167-Y169 HydrophobicContact CD1-CD1 4.11Å; I167-Y169 HydrophobicContact CD1-CG 4.43Å; I167-Y169 HydrophobicContact CG1-CD1 3.54Å; I167-Y169 HydrophobicContact CG1-CE1 4.47Å; I167-Y169 HydrophobicContact CG1-CG 4.2Å; Y169-I171 HydrophobicContact CD2-CD1 4.3Å; Y169-I171 HydrophobicContact CD2-CG1 3.82Å; Y169-I171 HydrophobicContact CE2-CD1 3.79Å; Y169-I171 HydrophobicContact CE2-CG1 3.79Å
170	R	98.3	Very high	94.2	Very high	18 Å²	18	24.8 Å²	24.8	7%	0.068	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	132	164.4	-168.5	173.3	-178.9	166.1	-3.1	111.8	G104 G105 S106 V138 V139 I140 F172 L198 F199 T352	G104-R170 PolarHBondContact O-NE 3.03Å; G105-R170 WeakPolarHBondContact O-CA 3.35Å; S106-R170 VanDerWaalsContact OG-CD 3.28Å; S106-R170 WeakPolarHBondContact OG-CD 3.49Å; V138-R170 PolarHBondContact O-N 2.82Å; V139-R170 WeakPolarHBondContact CA-O 3.1Å; I140-R170 PolarHBondContact N-O 2.85Å; R170-F172 HydrophobicContact CB-CE2 3.94Å; R170-F172 HydrophobicContact CG-CD2 4.32Å; R170-F172 HydrophobicContact CG-CE2 3.63Å; R170-F172 HydrophobicContact CG-CZ 4.01Å; R170-L198 PolarHBondContact NH1-O 2.79Å; R170-F199 HydrophobicContact CB-CD1 3.77Å; R170-F199 HydrophobicContact CB-CE1 4.1Å; R170-F199 HydrophobicContact CB-CG 4.08Å; R170-T352 PolarHBondContact NE-OG1 3.36Å; R170-T352 PolarHBondContact NH2-OG1 3.03Å
171	I	98.7	Very high	94.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	133.2	179.4	-55	174.9	0	0	0	110.3	G105 I140 I142 L155 I159 L162 Y169 F351 T352	G105-I171 PolarHBondContact O-N 3.31Å; I140-I171 HydrophobicContact CB-CG1 4.26Å; I140-I171 HydrophobicContact CD1-CG1 4.02Å; I140-I171 CarbonylContact O-C 3.58Å; I140-I171 WeakPolarHBondContact O-CA 3.29Å; I142-I171 HydrophobicContact CD1-CG2 3.91Å; L155-I171 HydrophobicContact CD2-CD1 3.93Å; L155-I171 HydrophobicContact CD2-CG2 4.44Å; I159-I171 HydrophobicContact CG1-CD1 4.08Å; L162-I171 HydrophobicContact CD1-CD1 4.14Å; Y169-I171 HydrophobicContact CD2-CD1 4.3Å; Y169-I171 HydrophobicContact CD2-CG1 3.82Å; Y169-I171 HydrophobicContact CE2-CD1 3.79Å; Y169-I171 HydrophobicContact CE2-CG1 3.79Å; I171-F351 HydrophobicContact CB-CB 4Å; I171-F351 HydrophobicContact CG2-CB 3.8Å; I171-F351 CarbonylContact O-C 3.53Å; I171-F351 VanDerWaalsContact O-CA 3.29Å; I171-F351 WeakPolarHBondContact O-CA 3.48Å; I171-F351 WeakPolarHBondContact O-CB 3.37Å; I171-T352 PolarHBondContact O-N 3.43Å
172	F	98.8	Very high	94	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	126.5	175.2	-68.8	-95.7	0	0	0	109.9	V139 I140 I141 I142 R170 I174 A195 L198 T352 L354	V139-F172 HydrophobicContact CG1-CD2 3.88Å; V139-F172 HydrophobicContact CG1-CE2 4.24Å; V139-F172 HydrophobicContact CG2-CD2 4.43Å; V139-F172 HydrophobicContact CG2-CE2 3.99Å; I140-F172 PolarHBondContact O-N 3.36Å; I141-F172 WeakPolarHBondContact CA-O 3.34Å; I141-F172 HydrophobicContact CG1-CB 4.43Å; I142-F172 PolarHBondContact N-O 3.17Å; R170-F172 HydrophobicContact CB-CE2 3.94Å; R170-F172 HydrophobicContact CG-CD2 4.32Å; R170-F172 HydrophobicContact CG-CE2 3.63Å; R170-F172 HydrophobicContact CG-CZ 4.01Å; F172-I174 HydrophobicContact CB-CD1 4.14Å; F172-A195 HydrophobicContact CD1-CB 4.42Å; F172-A195 HydrophobicContact CD2-CB 3.91Å; F172-A195 HydrophobicContact CE1-CB 4.22Å; F172-A195 HydrophobicContact CE2-CB 3.67Å; F172-A195 HydrophobicContact CG-CB 4.27Å; F172-A195 HydrophobicContact CZ-CB 3.83Å; F172-L198 HydrophobicContact CE1-CB 4.28Å; F172-L198 HydrophobicContact CE1-CD1 3.85Å; F172-L198 HydrophobicContact CZ-CB 4.15Å; F172-T352 WeakPolarHBondContact CA-O 3.47Å; F172-T352 HydrophobicContact CD1-CG2 3.94Å; F172-T352 HydrophobicContact CE1-CG2 3.97Å; F172-L354 HydrophobicContact CD1-CD1 4.28Å
173	V	98.8	Very high	93.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	119.1	173.9	174.9	0	0	0	0	108.1	I142 I144 L151 F351 T352 L354	I142-V173 HydrophobicContact CB-CG2 4.36Å; I142-V173 WeakPolarHBondContact O-CA 3.23Å; I144-V173 HydrophobicContact CD1-CG1 3.47Å; I144-V173 VanDerWaalsContact CD1-CG1 3.47Å; I144-V173 HydrophobicContact CG1-CG1 3.72Å; I144-V173 HydrophobicContact CG2-CG1 4.06Å; L151-V173 HydrophobicContact CD1-CG2 3.76Å; L151-V173 HydrophobicContact CD2-CG1 4.09Å; L151-V173 HydrophobicContact CD2-CG2 4.04Å; V173-F351 HydrophobicContact CB-CD2 3.62Å; V173-F351 HydrophobicContact CB-CE2 3.96Å; V173-F351 HydrophobicContact CB-CG 4.26Å; V173-F351 HydrophobicContact CG1-CE2 4.41Å; V173-F351 HydrophobicContact CG2-CB 3.85Å; V173-F351 HydrophobicContact CG2-CD1 4.13Å; V173-F351 HydrophobicContact CG2-CD2 3.4Å; V173-F351 HydrophobicContact CG2-CE2 3.86Å; V173-F351 HydrophobicContact CG2-CG 3.54Å; V173-F351 HydrophobicContact CG2-CZ 4.44Å; V173-T352 PolarHBondContact N-O 3.28Å; V173-L354 PolarHBondContact O-N 3.45Å
174	I	98.7	Very high	93.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	99	-175.5	-43.1	-58.6	0	0	0	108.3	I141 I142 I144 F172 L187 V190 G191 L354 V356	I141-I174 HydrophobicContact CG2-CG1 3.89Å; I142-I174 PolarHBondContact O-N 3.42Å; I144-I174 PolarHBondContact N-O 2.68Å; F172-I174 HydrophobicContact CB-CD1 4.14Å; I174-L187 HydrophobicContact CG2-CB 4.26Å; I174-L187 HydrophobicContact CG2-CD2 3.78Å; I174-V190 HydrophobicContact CG2-CB 4.38Å; I174-V190 HydrophobicContact CG2-CG1 4.04Å; I174-G191 VanDerWaalsContact CD1-CA 3.46Å; I174-L354 HydrophobicContact CD1-CB 4.05Å; I174-L354 HydrophobicContact CD1-CD1 3.61Å; I174-L354 HydrophobicContact CD1-CG 4.25Å; I174-V356 HydrophobicContact CG2-CG1 4.35Å; I174-V356 HydrophobicContact CG2-CG2 3.84Å
175	E	98	Very high	94.2	Very high	19 Å²	19	23.3 Å²	23.3	9%	0.089	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	116.5	-178.7	-175.8	-174.6	-146.6	0	0	110.7	I144 F148 I177 H353 L354 R355 V356	I144-E175 HydrophobicContact CD1-CB 4.12Å; I144-E175 HydrophobicContact CD1-CG 4.26Å; I144-E175 HydrophobicContact CG1-CB 3.79Å; I144-E175 HydrophobicContact CG1-CG 4.06Å; I144-E175 WeakPolarHBondContact O-CA 3.42Å; F148-E175 WeakPolarHBondContact CE2-OE1 3.29Å; E175-I177 HydrophobicContact CB-CG2 4.46Å; E175-I177 HydrophobicContact CG-CG2 3.8Å; E175-H353 VanDerWaalsContact CB-NE2 3.31Å; E175-H353 WeakPolarHBondContact CB-NE2 3.46Å; E175-H353 IonicContact OE2-CE1 4Å; E175-H353 PolarHBondContact OE2-CE1 3.42Å; E175-H353 IonicContact OE2-NE2 2.86Å; E175-H353 PolarHBondContact OE2-NE2 3.29Å; E175-L354 PolarHBondContact N-O 3.28Å; E175-R355 WeakPolarHBondContact OE2-CD 3.47Å; E175-R355 VanDerWaalsContact OE2-CG 3.28Å; E175-R355 WeakPolarHBondContact OE2-CG 3.43Å; E175-R355 IonicContact OE2-CZ 2.97Å; E175-R355 IonicContact OE2-NE 2.77Å; E175-R355 PolarHBondContact OE2-NE 3.04Å; E175-V356 PolarHBondContact O-N 3.05Å
176	Q	96.2	Very high	94.3	Very high	3 Å²	3	22.5 Å²	22.5	1%	0.014	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	123	164.4	-177.3	175.3	-19.3	0	0	109.5	I144 K145 D178 E180 A181 M182 N183 L187 I358	I144-Q176 PolarHBondContact O-N 2.91Å; K145-Q176 HydrophobicContact CB-CB 4.49Å; K145-Q176 HydrophobicContact CG-CB 4.47Å; Q176-D178 WeakPolarHBondContact CG-OD1 3.03Å; Q176-D178 PolarHBondContact NE2-OD1 2.82Å; Q176-E180 PolarHBondContact NE2-O 3.36Å; Q176-A181 PolarHBondContact NE2-O 3.47Å; Q176-M182 VanDerWaalsContact OE1-CA 3.3Å; Q176-N183 VanDerWaalsContact OE1-N 3.1Å; Q176-L187 HydrophobicContact CB-CD1 3.94Å; Q176-L187 HydrophobicContact CB-CD2 3.89Å; Q176-L187 HydrophobicContact CB-CG 4.44Å; Q176-I358 HydrophobicContact CB-CG1 4.4Å; Q176-I358 HydrophobicContact CG-CD1 4.14Å; Q176-I358 HydrophobicContact CG-CG1 3.7Å
177	I	94.7	Very high	94.6	Very high	47 Å²	47	18.9 Å²	18.9	24%	0.241	10%	0.097	C	C	.	.			trans	-112.5	2.2	-176.7	68.9	171	0	0	0	114.4	E175 I343 R355 V356 L357	E175-I177 HydrophobicContact CB-CG2 4.46Å; E175-I177 HydrophobicContact CG-CG2 3.8Å; I177-I343 HydrophobicContact CD1-CB 3.96Å; I177-I343 HydrophobicContact CD1-CG1 3.76Å; I177-I343 HydrophobicContact CD1-CG2 4.09Å; I177-R355 HydrophobicContact CD1-CB 4.27Å; I177-R355 HydrophobicContact CG2-CB 3.85Å; I177-R355 HydrophobicContact CG2-CG 4.33Å; I177-V356 PolarHBondContact N-O 2.84Å; I177-V356 VanDerWaalsContact N-O 3.09Å; I177-L357 HydrophobicContact CD1-CD2 4.24Å; I177-L357 HydrophobicContact CG1-CD2 3.68Å; I177-L357 HydrophobicContact CG1-CG 4.3Å
178	D	90.3	Very high	94.8	Very high	15 Å²	15	18.5 Å²	18.5	8%	0.08	10%	0.095	C	C	.	.	S	Bend	trans	-83.9	168.9	173	53.8	63.6	0	0	0	112.4	K145 Q176 E180 L357 I358	K145-D178 VanDerWaalsContact CE-O 3.22Å; K145-D178 WeakPolarHBondContact CE-O 3.4Å; K145-D178 PolarHBondContact NZ-O 3.02Å; Q176-D178 WeakPolarHBondContact CG-OD1 3.03Å; Q176-D178 PolarHBondContact NE2-OD1 2.82Å; D178-E180 VanDerWaalsContact C-N 3.3Å; D178-E180 WeakPolarHBondContact OD1-CB 3.48Å; D178-E180 PolarHBondContact OD1-N 3.17Å; D178-L357 HydrophobicContact CB-CD2 3.9Å; D178-I358 PolarHBondContact OD2-N 2.93Å; D178-I358 VanDerWaalsContact OD2-O 3.14Å
179	N	87.7	Confident	94.8	Very high	136 Å²	136	17.8 Å²	17.8	73%	0.727	9%	0.089	S	C	*	.	S	Bend	trans	-85.1	-1.5	-176	-67	-16.3	0	0	0	113.2
180	E	86.2	Confident	94.8	Very high	84 Å²	84	17.5 Å²	17.5	39%	0.393	9%	0.088	S	C	.	.	S	Bend	trans	-71.5	161.8	-178.9	-59.3	-56.6	153.9	0	0	111.7	K145 Q176 D178 W272	K145-E180 PolarHBondContact NZ-O 3.34Å; Q176-E180 PolarHBondContact NE2-O 3.36Å; D178-E180 VanDerWaalsContact C-N 3.3Å; D178-E180 WeakPolarHBondContact OD1-CB 3.48Å; D178-E180 PolarHBondContact OD1-N 3.17Å; E180-W272 HydrophobicContact CB-CE3 3.95Å; E180-W272 HydrophobicContact CB-CZ3 3.71Å; E180-W272 HydrophobicContact CG-CZ3 4.38Å
181	A	87.7	Confident	94.9	Very high	9 Å²	9	16.6 Å²	16.6	7%	0.074	9%	0.085	C	C	.	.	P	Polyproline II helix	trans	-54.3	153.2	170.6	0	0	0	0	0	111.1	Q176 N183 W272	Q176-A181 PolarHBondContact NE2-O 3.47Å; A181-N183 PolarHBondContact O-N 2.82Å; A181-W272 HydrophobicContact CB-CB 4.32Å; A181-W272 WeakPolarHBondContact O-CZ3 3.12Å
182	M	90.1	Very high	94.9	Very high	19 Å²	19	16.7 Å²	16.7	9%	0.094	9%	0.085	C	C	.	.	P	Polyproline II helix	trans	-66	136.4	-179.6	-170.9	178.2	178.9	0	0	110.3	P143 K145 Q176 K184 L187 G273	P143-M182 HydrophobicContact CB-CE 3.92Å; K145-M182 HydrophobicContact CB-CB 4.44Å; K145-M182 HydrophobicContact CB-CG 4.13Å; K145-M182 HydrophobicContact CB-SD 3.93Å; K145-M182 HydrophobicContact CD-CB 4.25Å; Q176-M182 VanDerWaalsContact OE1-CA 3.3Å; M182-K184 HydrophobicContact CE-CG 3.76Å; M182-K184 HydrophobicContact CG-CG 4.37Å; M182-K184 HydrophobicContact SD-CG 4.09Å; M182-L187 HydrophobicContact CE-CD1 3.55Å; M182-L187 HydrophobicContact CG-CD1 4.1Å; M182-G273 PolarHBondContact O-N 2.81Å
183	N	92	Very high	94.9	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.095	C	C	.	.			trans	-117.9	88.5	171.8	-173.4	-31.3	0	0	0	109.9	Q176 A181 G185 K186 L187 N269 Y271 W272 I358	Q176-N183 VanDerWaalsContact OE1-N 3.1Å; A181-N183 PolarHBondContact O-N 2.82Å; N183-G185 PolarHBondContact O-N 3.29Å; N183-K186 HydrophobicContact CB-CB 4.01Å; N183-K186 PolarHBondContact O-N 2.78Å; N183-K186 WeakPolarHBondContact OD1-CB 3.46Å; N183-K186 PolarHBondContact OD1-N 3.12Å; N183-L187 WeakPolarHBondContact O-CG 3.35Å; N183-L187 PolarHBondContact O-N 3.01Å; N183-N269 PolarHBondContact ND2-O 3.24Å; N183-Y271 PolarHBondContact OD1-O 2.94Å; N183-W272 HydrophobicContact CB-CD2 3.96Å; N183-W272 HydrophobicContact CB-CE3 3.8Å; N183-W272 HydrophobicContact CB-CH2 4.02Å; N183-W272 HydrophobicContact CB-CZ2 4.27Å; N183-W272 HydrophobicContact CB-CZ3 3.82Å; N183-W272 WeakPolarHBondContact ND2-CZ2 2.89Å; N183-W272 PolarHBondContact ND2-NE1 2.79Å; N183-I358 HydrophobicContact CB-CD1 3.98Å
184	K	93.2	Very high	94.8	Very high	10 Å²	10	18.8 Å²	18.8	4%	0.043	10%	0.096	C	C	.	.	H	α-helix	trans	-56.9	-49.3	-176	-76.3	-173.2	179.7	178.1	0	112.1	M182 K186 L187 K188 D208 D275	M182-K184 HydrophobicContact CE-CG 3.76Å; M182-K184 HydrophobicContact CG-CG 4.37Å; M182-K184 HydrophobicContact SD-CG 4.09Å; K184-K186 PolarHBondContact O-N 2.57Å; K184-L187 CarbonylContact O-C 3.56Å; K184-L187 PolarHBondContact O-N 2.8Å; K184-L187 VanDerWaalsContact O-N 3.14Å; K184-K188 VanDerWaalsContact O-CG 3.3Å; K184-K188 WeakPolarHBondContact O-CG 3.28Å; K184-K188 PolarHBondContact O-N 3.19Å; K184-D208 IonicContact NZ-OD2 2.85Å; K184-D208 PolarHBondContact NZ-OD2 2.86Å; K184-D275 HydrophobicContact CD-CB 4.42Å; K184-D275 WeakPolarHBondContact CD-OD1 3.41Å; K184-D275 WeakPolarHBondContact CE-OD1 3.46Å; K184-D275 WeakPolarHBondContact CE-OD2 3.44Å; K184-D275 IonicContact NZ-OD1 3.61Å; K184-D275 IonicContact NZ-OD2 2.73Å; K184-D275 PolarHBondContact NZ-OD2 3.3Å
185	G	94.6	Very high	94.8	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-59.3	-44.4	-179.6	0	0	0	0	0	112.8	N183 L187 K188 N189 Y267 N278	N183-G185 PolarHBondContact O-N 3.29Å; G185-L187 PolarHBondContact O-N 2.91Å; G185-K188 WeakPolarHBondContact O-CB 3.47Å; G185-K188 PolarHBondContact O-N 3.12Å; G185-N189 PolarHBondContact O-N 3.07Å; G185-Y267 VanDerWaalsContact CA-CB 3.48Å; G185-N278 WeakPolarHBondContact CA-ND2 3.36Å; G185-N278 WeakPolarHBondContact CA-OD1 3.39Å; G185-N278 PolarHBondContact N-ND2 2.99Å
186	K	95	Very high	94.8	Very high	6 Å²	6	21.2 Å²	21.2	3%	0.026	11%	0.109	C	C	.	.	H	α-helix	trans	-60.6	-43.9	174.1	-167.1	164.2	-177.9	174.4	0	111.5	N183 K184 N189 V190 N269 W272 V338 S339 I358 K359	N183-K186 HydrophobicContact CB-CB 4.01Å; N183-K186 PolarHBondContact O-N 2.78Å; N183-K186 WeakPolarHBondContact OD1-CB 3.46Å; N183-K186 PolarHBondContact OD1-N 3.12Å; K184-K186 PolarHBondContact O-N 2.57Å; K186-N189 WeakPolarHBondContact O-CB 3.4Å; K186-N189 PolarHBondContact O-N 3.17Å; K186-V190 VanDerWaalsContact O-CG2 3.28Å; K186-V190 WeakPolarHBondContact O-CG2 3.22Å; K186-V190 PolarHBondContact O-N 2.86Å; K186-N269 HydrophobicContact CD-CB 4.23Å; K186-N269 HydrophobicContact CG-CB 4.4Å; K186-W272 HydrophobicContact CD-CH2 4.35Å; K186-W272 HydrophobicContact CD-CZ2 4.19Å; K186-V338 HydrophobicContact CG-CG2 3.75Å; K186-S339 WeakPolarHBondContact CE-O 3.12Å; K186-S339 PolarHBondContact NZ-O 2.88Å; K186-S339 PolarHBondContact NZ-OG 2.93Å; K186-I358 HydrophobicContact CB-CD1 4.09Å; K186-I358 HydrophobicContact CD-CB 3.95Å; K186-I358 HydrophobicContact CD-CD1 4.23Å; K186-I358 HydrophobicContact CD-CG2 4.26Å; K186-I358 HydrophobicContact CG-CB 4.28Å; K186-I358 HydrophobicContact CG-CD1 4.12Å; K186-I358 HydrophobicContact CG-CG2 4.13Å; K186-K359 PolarHBondContact NZ-O 3.26Å
187	L	97.6	Very high	94.9	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-65	-37.5	175.5	-65.4	169	0	0	0	113	P143 I174 Q176 M182 N183 K184 G185 V190 G191 V356 I358	P143-L187 HydrophobicContact CB-CB 3.6Å; P143-L187 HydrophobicContact CB-CD1 3.91Å; P143-L187 HydrophobicContact CB-CG 4.43Å; I174-L187 HydrophobicContact CG2-CB 4.26Å; I174-L187 HydrophobicContact CG2-CD2 3.78Å; Q176-L187 HydrophobicContact CB-CD1 3.94Å; Q176-L187 HydrophobicContact CB-CD2 3.89Å; Q176-L187 HydrophobicContact CB-CG 4.44Å; M182-L187 HydrophobicContact CE-CD1 3.55Å; M182-L187 HydrophobicContact CG-CD1 4.1Å; N183-L187 WeakPolarHBondContact O-CG 3.35Å; N183-L187 PolarHBondContact O-N 3.01Å; K184-L187 CarbonylContact O-C 3.56Å; K184-L187 PolarHBondContact O-N 2.8Å; K184-L187 VanDerWaalsContact O-N 3.14Å; G185-L187 PolarHBondContact O-N 2.91Å; L187-V190 PolarHBondContact O-N 3.18Å; L187-G191 PolarHBondContact O-N 2.94Å; L187-V356 HydrophobicContact CD2-CG2 3.63Å; L187-I358 HydrophobicContact CD1-CD1 4.5Å; L187-I358 HydrophobicContact CD2-CD1 3.61Å; L187-I358 HydrophobicContact CD2-CG1 4.13Å; L187-I358 HydrophobicContact CG-CD1 3.69Å
188	K	98.4	Very high	94.9	Very high	1 Å²	1	24.4 Å²	24.4	0%	0.004	12%	0.122	C	C	.	.	H	α-helix	trans	-59.8	-46.5	173.4	-70.8	177.9	-173.3	178	0	110.2	P143 K184 G185 G191 F192 F206 Y267 D279	P143-K188 HydrophobicContact CG-CG 4.21Å; K184-K188 VanDerWaalsContact O-CG 3.3Å; K184-K188 WeakPolarHBondContact O-CG 3.28Å; K184-K188 PolarHBondContact O-N 3.19Å; G185-K188 WeakPolarHBondContact O-CB 3.47Å; G185-K188 PolarHBondContact O-N 3.12Å; K188-G191 PolarHBondContact O-N 2.73Å; K188-F192 PolarHBondContact O-N 3.07Å; K188-F206 HydrophobicContact CB-CD1 3.56Å; K188-F206 HydrophobicContact CB-CE1 3.65Å; K188-F206 HydrophobicContact CB-CG 4.43Å; K188-F206 HydrophobicContact CD-CB 4Å; K188-F206 HydrophobicContact CD-CD1 3.95Å; K188-F206 HydrophobicContact CD-CG 4.04Å; K188-F206 HydrophobicContact CG-CB 4.37Å; K188-F206 HydrophobicContact CG-CD1 3.59Å; K188-F206 HydrophobicContact CG-CE1 4.22Å; K188-F206 HydrophobicContact CG-CG 4.19Å; K188-Y267 HydrophobicContact CB-CD2 3.66Å; K188-Y267 HydrophobicContact CB-CE2 3.85Å; K188-Y267 HydrophobicContact CB-CG 4.42Å; K188-Y267 HydrophobicContact CD-CD1 4.2Å; K188-Y267 HydrophobicContact CD-CD2 3.74Å; K188-Y267 HydrophobicContact CD-CE1 3.8Å; K188-Y267 HydrophobicContact CD-CE2 3.32Å; K188-Y267 HydrophobicContact CD-CG 4.17Å; K188-Y267 HydrophobicContact CG-CD2 4.33Å; K188-Y267 HydrophobicContact CG-CE2 4.16Å; K188-Y267 PolarHBondContact NZ-OH 3.41Å; K188-D279 IonicContact NZ-OD1 2.99Å; K188-D279 PolarHBondContact NZ-OD1 3.21Å
189	N	98.2	Very high	95.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.6	-47.5	174.6	-70.5	-16.5	0	0	0	112.6	G185 K186 G191 F192 I193 F261 Y267 N269 L335 V338	G185-N189 PolarHBondContact O-N 3.07Å; K186-N189 WeakPolarHBondContact O-CB 3.4Å; K186-N189 PolarHBondContact O-N 3.17Å; N189-G191 VanDerWaalsContact C-N 3.34Å; N189-G191 PolarHBondContact O-N 2.88Å; N189-F192 WeakPolarHBondContact O-CB 3.33Å; N189-F192 PolarHBondContact O-N 3.45Å; N189-I193 PolarHBondContact O-N 2.98Å; N189-I193 VanDerWaalsContact O-N 3.1Å; N189-F261 WeakPolarHBondContact OD1-CZ 3.31Å; N189-Y267 PolarHBondContact ND2-O 3.38Å; N189-Y267 PolarHBondContact OD1-N 3.24Å; N189-N269 PolarHBondContact ND2-OD1 2.98Å; N189-L335 HydrophobicContact CB-CD1 3.79Å; N189-V338 HydrophobicContact CB-CB 4.28Å; N189-V338 HydrophobicContact CB-CG1 4.33Å; N189-V338 HydrophobicContact CB-CG2 4.13Å
190	V	98.6	Very high	95.8	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-58.5	-47.1	177.2	171.2	0	0	0	0	111	I174 K186 L187 F192 I193 E194 V338 Y340 V356 I358	I174-V190 HydrophobicContact CG2-CB 4.38Å; I174-V190 HydrophobicContact CG2-CG1 4.04Å; K186-V190 VanDerWaalsContact O-CG2 3.28Å; K186-V190 WeakPolarHBondContact O-CG2 3.22Å; K186-V190 PolarHBondContact O-N 2.86Å; L187-V190 PolarHBondContact O-N 3.18Å; V190-F192 VanDerWaalsContact C-N 3.27Å; V190-F192 PolarHBondContact O-N 2.71Å; V190-I193 PolarHBondContact O-N 2.76Å; V190-E194 HydrophobicContact CG1-CG 4.35Å; V190-E194 WeakPolarHBondContact O-CB 3.34Å; V190-E194 WeakPolarHBondContact O-CG 3.49Å; V190-E194 PolarHBondContact O-N 3Å; V190-V338 HydrophobicContact CG2-CG2 3.94Å; V190-Y340 HydrophobicContact CB-CD2 4.4Å; V190-Y340 HydrophobicContact CB-CG 4.41Å; V190-Y340 HydrophobicContact CG1-CD2 3.59Å; V190-Y340 HydrophobicContact CG1-CE2 3.69Å; V190-Y340 HydrophobicContact CG1-CG 4.05Å; V190-Y340 HydrophobicContact CG2-CD1 3.61Å; V190-Y340 HydrophobicContact CG2-CD2 3.95Å; V190-Y340 HydrophobicContact CG2-CE1 4.12Å; V190-Y340 HydrophobicContact CG2-CE2 4.44Å; V190-Y340 HydrophobicContact CG2-CG 3.5Å; V190-Y340 VanDerWaalsContact CG2-CG 3.5Å; V190-V356 HydrophobicContact CG1-CG1 4Å; V190-V356 HydrophobicContact CG1-CG2 4.42Å; V190-I358 HydrophobicContact CG2-CG2 4.1Å
191	G	98.8	Very high	96.4	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-59.4	-39.2	177.9	0	0	0	0	0	112.6	I174 L187 K188 N189 A195	I174-G191 VanDerWaalsContact CD1-CA 3.46Å; L187-G191 PolarHBondContact O-N 2.94Å; K188-G191 PolarHBondContact O-N 2.73Å; N189-G191 VanDerWaalsContact C-N 3.34Å; N189-G191 PolarHBondContact O-N 2.88Å; G191-A195 WeakPolarHBondContact O-CB 3.33Å; G191-A195 PolarHBondContact O-N 3.28Å
192	F	98.8	Very high	96.9	Very high	2 Å²	2	19 Å²	19	1%	0.009	9%	0.092	C	C	.	.	H	α-helix	trans	-63.9	-49.1	178.2	-179.8	-93.6	0	0	0	111.4	I141 K188 N189 V190 E194 A195 L196 F201 V204 T258 F261 I262 L335	I141-F192 HydrophobicContact CD1-CB 4.09Å; I141-F192 VanDerWaalsContact CD1-N 3.29Å; K188-F192 PolarHBondContact O-N 3.07Å; N189-F192 WeakPolarHBondContact O-CB 3.33Å; N189-F192 PolarHBondContact O-N 3.45Å; V190-F192 VanDerWaalsContact C-N 3.27Å; V190-F192 PolarHBondContact O-N 2.71Å; F192-E194 PolarHBondContact O-N 3.36Å; F192-A195 PolarHBondContact O-N 3.47Å; F192-L196 HydrophobicContact CD1-CD1 3.91Å; F192-L196 HydrophobicContact CE1-CD1 3.43Å; F192-L196 VanDerWaalsContact CE1-CD1 3.43Å; F192-L196 HydrophobicContact CE1-CG 4.21Å; F192-L196 HydrophobicContact CZ-CD1 3.99Å; F192-L196 HydrophobicContact CZ-CG 4.43Å; F192-L196 WeakPolarHBondContact O-CG 3.31Å; F192-L196 PolarHBondContact O-N 3.18Å; F192-L196 VanDerWaalsContact O-N 3.08Å; F192-F201 HydrophobicContact CD2-CE2 4.1Å; F192-F201 HydrophobicContact CD2-CZ 4.19Å; F192-F201 AromaticContact CE2-CE2 3.8Å; F192-F201 HydrophobicContact CE2-CE2 3.8Å; F192-F201 HydrophobicContact CE2-CZ 4.11Å; F192-V204 HydrophobicContact CD2-CB 4.36Å; F192-V204 HydrophobicContact CD2-CG1 4.08Å; F192-V204 HydrophobicContact CD2-CG2 4.36Å; F192-V204 HydrophobicContact CE2-CG1 4.11Å; F192-T258 HydrophobicContact CE2-CG2 3.97Å; F192-T258 HydrophobicContact CZ-CG2 3.68Å; F192-F261 HydrophobicContact CB-CD1 4.2Å; F192-F261 HydrophobicContact CB-CE1 3.65Å; F192-F261 HydrophobicContact CB-CZ 4.49Å; F192-F261 AromaticContact CD1-CD1 3.76Å; F192-F261 HydrophobicContact CD1-CD1 3.76Å; F192-F261 AromaticContact CD1-CE1 3.8Å; F192-F261 HydrophobicContact CD1-CE1 3.8Å; F192-F261 AromaticContact CD2-CD1 3.37Å; F192-F261 HydrophobicContact CD2-CD1 3.37Å; F192-F261 AromaticContact CD2-CE1 3.73Å; F192-F261 HydrophobicContact CD2-CE1 3.73Å; F192-F261 HydrophobicContact CD2-CG 4.23Å; F192-F261 AromaticContact CE1-CD1 3.86Å; F192-F261 HydrophobicContact CE1-CD1 3.86Å; F192-F261 HydrophobicContact CE1-CE1 4.34Å; F192-F261 HydrophobicContact CE2-CB 4.16Å; F192-F261 AromaticContact CE2-CD1 3.49Å; F192-F261 HydrophobicContact CE2-CD1 3.49Å; F192-F261 VanDerWaalsContact CE2-CD1 3.49Å; F192-F261 HydrophobicContact CE2-CE1 4.3Å; F192-F261 HydrophobicContact CE2-CG 4.16Å; F192-F261 AromaticContact CG-CD1 3.5Å; F192-F261 HydrophobicContact CG-CD1 3.5Å; F192-F261 VanDerWaalsContact CG-CD1 3.5Å; F192-F261 AromaticContact CG-CE1 3.44Å; F192-F261 HydrophobicContact CG-CE1 3.44Å; F192-F261 VanDerWaalsContact CG-CE1 3.44Å; F192-F261 HydrophobicContact CZ-CB 4.48Å; F192-F261 AromaticContact CZ-CD1 3.73Å; F192-F261 HydrophobicContact CZ-CD1 3.73Å; F192-I262 HydrophobicContact CE1-CD1 4.27Å; F192-I262 HydrophobicContact CE1-CG1 3.8Å; F192-I262 HydrophobicContact CZ-CD1 4.04Å; F192-I262 HydrophobicContact CZ-CG1 3.72Å; F192-L335 HydrophobicContact CD1-CD1 3.96Å; F192-L335 HydrophobicContact CD1-CD2 3.73Å; F192-L335 HydrophobicContact CD1-CG 4.48Å; F192-L335 HydrophobicContact CE1-CD2 3.71Å
193	I	98.6	Very high	97.3	Very high	40 Å²	40	18 Å²	18	21%	0.205	9%	0.088	C	C	.	.	H	α-helix	trans	-62.7	-44.7	179.3	-64.8	168.8	0	0	0	111.2	N189 V190 L196 K197 L335 V338 Y340	N189-I193 PolarHBondContact O-N 2.98Å; N189-I193 VanDerWaalsContact O-N 3.1Å; V190-I193 PolarHBondContact O-N 2.76Å; I193-L196 PolarHBondContact O-N 3.48Å; I193-K197 WeakPolarHBondContact O-CG 3.45Å; I193-L335 HydrophobicContact CD1-CD1 3.84Å; I193-L335 HydrophobicContact CD1-CG 4.5Å; I193-L335 HydrophobicContact CG1-CD1 3.72Å; I193-L335 HydrophobicContact CG1-CG 4.46Å; I193-V338 HydrophobicContact CD1-CG1 3.27Å; I193-Y340 HydrophobicContact CD1-CE1 4.16Å; I193-Y340 WeakPolarHBondContact CG2-OH 3.47Å
194	E	98.2	Very high	97.6	Very high	3 Å²	3	18 Å²	18	1%	0.014	9%	0.088	C	C	.	.	H	α-helix	trans	-70.5	-32.8	-179.1	-71.1	-69.1	122.5	0	0	112.5	V190 F192 K197 Y340 V342 R345 L354	V190-E194 HydrophobicContact CG1-CG 4.35Å; V190-E194 WeakPolarHBondContact O-CB 3.34Å; V190-E194 WeakPolarHBondContact O-CG 3.49Å; V190-E194 PolarHBondContact O-N 3Å; F192-E194 PolarHBondContact O-N 3.36Å; E194-K197 PolarHBondContact O-N 3.24Å; E194-K197 IonicContact OE1-NZ 3.18Å; E194-K197 PolarHBondContact OE1-NZ 3.48Å; E194-Y340 HydrophobicContact CG-CE2 4.06Å; E194-Y340 PolarHBondContact OE1-OH 3.33Å; E194-V342 HydrophobicContact CG-CG2 4.23Å; E194-R345 IonicContact OE1-NH2 2.82Å; E194-R345 PolarHBondContact OE1-NH2 3.29Å; E194-R345 IonicContact OE2-CZ 3.4Å; E194-R345 IonicContact OE2-NE 2.9Å; E194-R345 PolarHBondContact OE2-NE 2.94Å; E194-R345 IonicContact OE2-NH2 3.29Å; E194-R345 PolarHBondContact OE2-NH2 3.01Å; E194-L354 HydrophobicContact CB-CD1 3.42Å; E194-L354 VanDerWaalsContact CB-CD1 3.42Å; E194-L354 HydrophobicContact CG-CD1 3.91Å
195	A	98.5	Very high	97.9	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-66.2	-41.1	174.4	0	0	0	0	0	112.1	V139 F172 G191 F192 K197 L198 F199 F201	V139-A195 HydrophobicContact CG1-CB 3.78Å; V139-A195 HydrophobicContact CG2-CB 4.08Å; F172-A195 HydrophobicContact CD1-CB 4.42Å; F172-A195 HydrophobicContact CD2-CB 3.91Å; F172-A195 HydrophobicContact CE1-CB 4.22Å; F172-A195 HydrophobicContact CE2-CB 3.67Å; F172-A195 HydrophobicContact CG-CB 4.27Å; F172-A195 HydrophobicContact CZ-CB 3.83Å; G191-A195 WeakPolarHBondContact O-CB 3.33Å; G191-A195 PolarHBondContact O-N 3.28Å; F192-A195 PolarHBondContact O-N 3.47Å; A195-K197 PolarHBondContact O-N 3.42Å; A195-K197 VanDerWaalsContact O-N 3.14Å; A195-L198 PolarHBondContact O-N 2.85Å; A195-F199 PolarHBondContact O-N 2.76Å; A195-F201 HydrophobicContact CB-CE1 3.83Å; A195-F201 HydrophobicContact CB-CZ 4.08Å
196	L	97.9	Very high	98.1	Very high	71 Å²	71	17.6 Å²	17.6	37%	0.372	9%	0.086	S	C	.	.	H	α-helix	trans	-57.2	-29.2	177.2	-76.8	173.6	0	0	0	112.8	F192 I193 L198 F201 T258	F192-L196 HydrophobicContact CD1-CD1 3.91Å; F192-L196 HydrophobicContact CE1-CD1 3.43Å; F192-L196 VanDerWaalsContact CE1-CD1 3.43Å; F192-L196 HydrophobicContact CE1-CG 4.21Å; F192-L196 HydrophobicContact CZ-CD1 3.99Å; F192-L196 HydrophobicContact CZ-CG 4.43Å; F192-L196 WeakPolarHBondContact O-CG 3.31Å; F192-L196 PolarHBondContact O-N 3.18Å; F192-L196 VanDerWaalsContact O-N 3.08Å; I193-L196 PolarHBondContact O-N 3.48Å; L196-L198 VanDerWaalsContact C-N 3.29Å; L196-L198 PolarHBondContact O-N 2.98Å; L196-F201 HydrophobicContact CD2-CE1 3.77Å; L196-F201 HydrophobicContact CD2-CE2 4.4Å; L196-F201 HydrophobicContact CD2-CZ 3.63Å; L196-F201 HydrophobicContact CG-CE1 4.09Å; L196-F201 HydrophobicContact CG-CZ 3.83Å; L196-T258 HydrophobicContact CD2-CG2 4.15Å
197	K	96.8	Very high	98.2	Very high	92 Å²	92	17.3 Å²	17.3	40%	0.4	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-17.5	178.2	-62.1	170.8	-170.9	174.3	0	113.3	I193 E194 A195	I193-K197 WeakPolarHBondContact O-CG 3.45Å; E194-K197 PolarHBondContact O-N 3.24Å; E194-K197 IonicContact OE1-NZ 3.18Å; E194-K197 PolarHBondContact OE1-NZ 3.48Å; A195-K197 PolarHBondContact O-N 3.42Å; A195-K197 VanDerWaalsContact O-N 3.14Å
198	L	96.4	Very high	98.2	Very high	24 Å²	24	17.8 Å²	17.8	13%	0.126	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.3	-22.7	-165.3	-67.1	175.5	0	0	0	114	Q54 R170 F172 A195 L196 T352	Q54-L198 WeakPolarHBondContact CB-O 3.29Å; Q54-L198 PolarHBondContact N-O 2.84Å; R170-L198 PolarHBondContact NH1-O 2.79Å; F172-L198 HydrophobicContact CE1-CB 4.28Å; F172-L198 HydrophobicContact CE1-CD1 3.85Å; F172-L198 HydrophobicContact CZ-CB 4.15Å; A195-L198 PolarHBondContact O-N 2.85Å; L196-L198 VanDerWaalsContact C-N 3.29Å; L196-L198 PolarHBondContact O-N 2.98Å; L198-T352 HydrophobicContact CD1-CG2 4.33Å
199	F	97.9	Very high	98.1	Very high	1 Å²	1	17.9 Å²	17.9	0%	0.004	9%	0.088	C	C	.	.	B	Isolated β-bridge	trans	-149.3	142.5	-177.1	-176.2	-123.8	0	0	0	111.1	Q54 I59 V139 R170 A195 F201	Q54-F199 HydrophobicContact CB-CD2 4.18Å; Q54-F199 CarbonylContact O-C 3.59Å; Q54-F199 WeakPolarHBondContact O-CA 3.43Å; Q54-F199 WeakPolarHBondContact O-CD2 3.32Å; I59-F199 HydrophobicContact CD1-CD2 4.15Å; I59-F199 HydrophobicContact CD1-CE2 3.43Å; I59-F199 VanDerWaalsContact CD1-CE2 3.43Å; I59-F199 HydrophobicContact CD1-CZ 4.02Å; V139-F199 HydrophobicContact CG2-CD1 3.62Å; V139-F199 HydrophobicContact CG2-CE1 4.29Å; R170-F199 HydrophobicContact CB-CD1 3.77Å; R170-F199 HydrophobicContact CB-CE1 4.1Å; R170-F199 HydrophobicContact CB-CG 4.08Å; A195-F199 PolarHBondContact O-N 2.76Å; F199-F201 HydrophobicContact CD1-CB 4.17Å; F199-F201 HydrophobicContact CD1-CD1 4.27Å; F199-F201 HydrophobicContact CE1-CB 4.18Å; F199-F201 WeakPolarHBondContact O-CD1 3.34Å
200	Q	98	Very high	97.9	Very high	70 Å²	70	18.4 Å²	18.4	33%	0.327	9%	0.09	S	C	.	.			trans	-89	122.6	173.8	-56.9	-168.4	10.2	0	0	110.5	P53 Q54 T55 K136 G137	P53-Q200 HydrophobicContact CB-CG 3.9Å; Q54-Q200 PolarHBondContact O-N 3.46Å; T55-Q200 HydrophobicContact CG2-CG 4.17Å; K136-Q200 WeakPolarHBondContact CA-O 3.2Å; K136-Q200 HydrophobicContact CG-CB 4.05Å; G137-Q200 PolarHBondContact N-O 2.81Å
201	F	98.4	Very high	97.8	Very high	7 Å²	7	18.6 Å²	18.6	3%	0.031	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	146.9	-178.1	59	-83.4	0	0	0	112	G137 V139 F192 A195 L196 F199 C203 V204 T258	G137-F201 VanDerWaalsContact O-CA 3.26Å; G137-F201 WeakPolarHBondContact O-CA 3.18Å; G137-F201 WeakPolarHBondContact O-CB 3Å; V139-F201 HydrophobicContact CB-CB 4.39Å; V139-F201 HydrophobicContact CB-CD1 4.06Å; V139-F201 HydrophobicContact CB-CD2 3.91Å; V139-F201 HydrophobicContact CB-CE1 4.29Å; V139-F201 HydrophobicContact CB-CE2 4.14Å; V139-F201 HydrophobicContact CB-CG 3.86Å; V139-F201 HydrophobicContact CB-CZ 4.32Å; V139-F201 HydrophobicContact CG2-CB 3.83Å; V139-F201 HydrophobicContact CG2-CD1 3.17Å; V139-F201 HydrophobicContact CG2-CD2 3.91Å; V139-F201 HydrophobicContact CG2-CE1 3.58Å; V139-F201 HydrophobicContact CG2-CE2 4.26Å; V139-F201 HydrophobicContact CG2-CG 3.36Å; V139-F201 HydrophobicContact CG2-CZ 4.1Å; F192-F201 HydrophobicContact CD2-CE2 4.1Å; F192-F201 HydrophobicContact CD2-CZ 4.19Å; F192-F201 AromaticContact CE2-CE2 3.8Å; F192-F201 HydrophobicContact CE2-CE2 3.8Å; F192-F201 HydrophobicContact CE2-CZ 4.11Å; A195-F201 HydrophobicContact CB-CE1 3.83Å; A195-F201 HydrophobicContact CB-CZ 4.08Å; L196-F201 HydrophobicContact CD2-CE1 3.77Å; L196-F201 HydrophobicContact CD2-CE2 4.4Å; L196-F201 HydrophobicContact CD2-CZ 3.63Å; L196-F201 HydrophobicContact CG-CE1 4.09Å; L196-F201 HydrophobicContact CG-CZ 3.83Å; F199-F201 HydrophobicContact CD1-CB 4.17Å; F199-F201 HydrophobicContact CD1-CD1 4.27Å; F199-F201 HydrophobicContact CE1-CB 4.18Å; F199-F201 WeakPolarHBondContact O-CD1 3.34Å; F201-C203 WeakPolarHBondContact CD2-O 3.49Å; F201-V204 HydrophobicContact CD2-CB 4.4Å; F201-V204 HydrophobicContact CE2-CB 4.07Å; F201-T258 WeakPolarHBondContact CD2-OG1 3.38Å; F201-T258 HydrophobicContact CE2-CG2 4.23Å; F201-T258 WeakPolarHBondContact CE2-OG1 3.27Å; F201-T258 PolarHBondContact O-OG1 3.31Å
202	D	97.8	Very high	97.7	Very high	52 Å²	52	18.7 Å²	18.7	28%	0.278	9%	0.092	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-20.4	174.8	-76.2	-40	0	0	0	112.6	K136 G137 S257 T258	K136-D202 HydrophobicContact CB-CB 4.5Å; K136-D202 WeakPolarHBondContact CB-OD2 3.39Å; K136-D202 HydrophobicContact CD-CB 4.49Å; K136-D202 WeakPolarHBondContact CD-OD1 3.06Å; K136-D202 VanDerWaalsContact CD-OD2 3.31Å; K136-D202 WeakPolarHBondContact CD-OD2 3.31Å; K136-D202 IonicContact NZ-OD1 2.87Å; K136-D202 PolarHBondContact NZ-OD1 3.03Å; G137-D202 PolarHBondContact O-N 2.9Å; D202-S257 CarbonylContact O-C 3.57Å; D202-S257 VanDerWaalsContact O-CA 3.27Å; D202-S257 WeakPolarHBondContact O-CA 3.3Å; D202-T258 PolarHBondContact O-N 2.97Å; D202-T258 PolarHBondContact O-OG1 3.17Å
203	C	98.7	Very high	97.5	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	143.6	178.5	-67	0	0	0	0	111	V138 V139 F201 C222 T226 I256	V138-C203 WeakPolarHBondContact CA-O 3.45Å; V138-C203 HydrophobicContact CG2-CB 4.43Å; V139-C203 PolarHBondContact N-O 3.08Å; F201-C203 WeakPolarHBondContact CD2-O 3.49Å; C203-C222 HydrophobicContact CB-CB 3.62Å; C203-C222 WeakPolarHBondContact CB-SG 3.39Å; C203-C222 WeakPolarHBondContact SG-CA 3.24Å; C203-C222 WeakPolarHBondContact SG-CB 3.39Å; C203-C222 CovalentContact SG-SG 2.03Å; C203-C222 PolarHBondContact SG-SG 2.94Å; C203-T226 HydrophobicContact CB-CG2 4.27Å; C203-T226 WeakPolarHBondContact SG-CG2 3.5Å; C203-I256 WeakPolarHBondContact CA-O 3.38Å
204	V	98.8	Very high	97.3	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.7	173.1	57.8	0	0	0	0	109.5	V139 I141 F192 F201 F206 K255 I256 F261	V139-V204 HydrophobicContact CG1-CG2 4.15Å; V139-V204 CarbonylContact O-C 3.47Å; V139-V204 WeakPolarHBondContact O-CA 3.49Å; I141-V204 HydrophobicContact CD1-CG2 3.55Å; I141-V204 HydrophobicContact CG1-CG2 4.3Å; F192-V204 HydrophobicContact CD2-CB 4.36Å; F192-V204 HydrophobicContact CD2-CG1 4.08Å; F192-V204 HydrophobicContact CD2-CG2 4.36Å; F192-V204 HydrophobicContact CE2-CG1 4.11Å; F201-V204 HydrophobicContact CD2-CB 4.4Å; F201-V204 HydrophobicContact CE2-CB 4.07Å; V204-F206 HydrophobicContact CG1-CE2 3.76Å; V204-F206 HydrophobicContact CG1-CZ 3.97Å; V204-F206 HydrophobicContact CG2-CD1 4.44Å; V204-F206 HydrophobicContact CG2-CD2 4.49Å; V204-F206 HydrophobicContact CG2-CE1 3.96Å; V204-F206 HydrophobicContact CG2-CE2 4Å; V204-F206 HydrophobicContact CG2-CZ 3.71Å; V204-K255 WeakPolarHBondContact O-CA 3.08Å; V204-I256 HydrophobicContact CG1-CG2 3.57Å; V204-I256 PolarHBondContact N-O 3.34Å; V204-I256 PolarHBondContact O-N 3.22Å; V204-F261 HydrophobicContact CG1-CB 4.34Å; V204-F261 HydrophobicContact CG1-CG 4.48Å
205	I	98.9	Very high	97.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	119.7	173.2	-60.6	178.7	0	0	0	107	V138 V139 I140 I141 H207 Y220 L233 V253 L254 K255	V138-I205 HydrophobicContact CG1-CD1 3.63Å; V138-I205 HydrophobicContact CG1-CG1 3.83Å; V139-I205 PolarHBondContact O-N 2.91Å; I140-I205 CarbonylContact C-O 3.6Å; I140-I205 WeakPolarHBondContact CA-O 3.06Å; I140-I205 HydrophobicContact CG1-CB 4.16Å; I140-I205 HydrophobicContact CG1-CD1 4.34Å; I141-I205 PolarHBondContact N-O 3.09Å; I205-H207 HydrophobicContact CG2-CB 4.39Å; I205-Y220 HydrophobicContact CD1-CD1 3.34Å; I205-Y220 HydrophobicContact CD1-CE1 4.2Å; I205-Y220 HydrophobicContact CD1-CG 3.86Å; I205-Y220 HydrophobicContact CG2-CD1 4.28Å; I205-Y220 HydrophobicContact CG2-CE1 4.12Å; I205-L233 HydrophobicContact CG2-CD1 4.44Å; I205-V253 HydrophobicContact CG2-CG1 3.99Å; I205-L254 CarbonylContact C-O 3.37Å; I205-L254 VanDerWaalsContact CA-O 3.27Å; I205-L254 WeakPolarHBondContact CA-O 3.25Å; I205-K255 HydrophobicContact CD1-CB 4.49Å; I205-K255 HydrophobicContact CD1-CD 3.81Å; I205-K255 HydrophobicContact CD1-CG 4.13Å; I205-K255 HydrophobicContact CG1-CB 3.86Å; I205-K255 HydrophobicContact CG1-CD 3.89Å; I205-K255 HydrophobicContact CG1-CG 3.61Å
206	F	98.8	Very high	96.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126.4	168	-61.5	-73.3	0	0	0	107.5	I141 K188 V204 V253 L254 I256 F261 Y267	I141-F206 HydrophobicContact CB-CD1 4.04Å; I141-F206 HydrophobicContact CB-CE1 4.3Å; I141-F206 HydrophobicContact CD1-CD1 4.19Å; I141-F206 HydrophobicContact CD1-CE1 3.6Å; I141-F206 HydrophobicContact CD1-CZ 4.37Å; I141-F206 HydrophobicContact CG2-CD1 4.25Å; I141-F206 HydrophobicContact CG2-CE1 4.49Å; K188-F206 HydrophobicContact CB-CD1 3.56Å; K188-F206 HydrophobicContact CB-CE1 3.65Å; K188-F206 HydrophobicContact CB-CG 4.43Å; K188-F206 HydrophobicContact CD-CB 4Å; K188-F206 HydrophobicContact CD-CD1 3.95Å; K188-F206 HydrophobicContact CD-CG 4.04Å; K188-F206 HydrophobicContact CG-CB 4.37Å; K188-F206 HydrophobicContact CG-CD1 3.59Å; K188-F206 HydrophobicContact CG-CE1 4.22Å; K188-F206 HydrophobicContact CG-CG 4.19Å; V204-F206 HydrophobicContact CG1-CE2 3.76Å; V204-F206 HydrophobicContact CG1-CZ 3.97Å; V204-F206 HydrophobicContact CG2-CD1 4.44Å; V204-F206 HydrophobicContact CG2-CD2 4.49Å; V204-F206 HydrophobicContact CG2-CE1 3.96Å; V204-F206 HydrophobicContact CG2-CE2 4Å; V204-F206 HydrophobicContact CG2-CZ 3.71Å; F206-V253 VanDerWaalsContact O-CA 3.32Å; F206-V253 WeakPolarHBondContact O-CA 3.32Å; F206-L254 HydrophobicContact CD2-CD1 3.83Å; F206-L254 PolarHBondContact N-O 3.46Å; F206-L254 PolarHBondContact O-N 3.36Å; F206-I256 HydrophobicContact CD2-CG2 4.43Å; F206-I256 HydrophobicContact CE2-CG2 3.97Å; F206-F261 HydrophobicContact CD2-CE2 4.45Å; F206-F261 HydrophobicContact CE1-CE2 4.34Å; F206-F261 HydrophobicContact CE1-CZ 4.15Å; F206-F261 AromaticContact CE2-CD2 3.49Å; F206-F261 HydrophobicContact CE2-CD2 3.49Å; F206-F261 VanDerWaalsContact CE2-CD2 3.49Å; F206-F261 AromaticContact CE2-CE2 3.36Å; F206-F261 HydrophobicContact CE2-CE2 3.36Å; F206-F261 HydrophobicContact CE2-CG 4.17Å; F206-F261 AromaticContact CE2-CZ 3.95Å; F206-F261 HydrophobicContact CE2-CZ 3.95Å; F206-F261 HydrophobicContact CZ-CD1 4.2Å; F206-F261 AromaticContact CZ-CD2 3.71Å; F206-F261 HydrophobicContact CZ-CD2 3.71Å; F206-F261 AromaticContact CZ-CE1 3.83Å; F206-F261 HydrophobicContact CZ-CE1 3.83Å; F206-F261 AromaticContact CZ-CE2 3.29Å; F206-F261 HydrophobicContact CZ-CE2 3.29Å; F206-F261 HydrophobicContact CZ-CG 4.14Å; F206-F261 AromaticContact CZ-CZ 3.34Å; F206-F261 HydrophobicContact CZ-CZ 3.34Å; F206-Y267 HydrophobicContact CD1-CE2 4.25Å; F206-Y267 AromaticContact CD2-CE2 3.78Å; F206-Y267 HydrophobicContact CD2-CE2 3.78Å; F206-Y267 HydrophobicContact CE1-CE2 4.32Å; F206-Y267 AromaticContact CE2-CE2 3.87Å; F206-Y267 HydrophobicContact CE2-CE2 3.87Å; F206-Y267 AromaticContact CG-CE2 3.97Å; F206-Y267 HydrophobicContact CG-CE2 3.97Å; F206-Y267 HydrophobicContact CZ-CE2 4.14Å
207	H	98.6	Very high	96.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	112.4	-168.8	-166	-61.2	0	0	0	110.3	I140 I141 I142 T154 I205 V209 L211 Y220 V253	I140-H207 HydrophobicContact CG2-CB 4.15Å; I141-H207 PolarHBondContact O-N 3.46Å; I142-H207 HydrophobicContact CG1-CB 4.19Å; T154-H207 VanDerWaalsContact CG2-CE1 3.4Å; T154-H207 WeakPolarHBondContact CG2-CE1 3.38Å; I205-H207 HydrophobicContact CG2-CB 4.39Å; H207-V209 PolarHBondContact O-N 2.97Å; H207-L211 PolarHBondContact CE1-O 2.57Å; H207-Y220 AromaticContact CD2-CE1 3.77Å; H207-Y220 PolarHBondContact CD2-OH 2.87Å; H207-Y220 AromaticContact NE2-CZ 3.99Å; H207-Y220 PolarHBondContact NE2-OH 2.86Å; H207-V253 HydrophobicContact CB-CG1 4.2Å; H207-V253 WeakPolarHBondContact CD2-CG1 3.14Å
208	D	96.9	Very high	96.7	Very high	10 Å²	10	25.3 Å²	25.3	5%	0.053	11%	0.114	C	C	.	.			trans	-60.9	136.1	172.6	-84.1	20.9	0	0	0	110.8	K184 D210 L211 G252	K184-D208 IonicContact NZ-OD2 2.85Å; K184-D208 PolarHBondContact NZ-OD2 2.86Å; D208-D210 WeakPolarHBondContact CB-OD1 3.49Å; D208-D210 PolarHBondContact O-N 2.72Å; D208-L211 HydrophobicContact CB-CD1 4.1Å; D208-L211 HydrophobicContact CB-CG 4.26Å; D208-L211 PolarHBondContact O-N 3.05Å; D208-G252 PolarHBondContact N-O 2.99Å
209	V	96.3	Very high	96.7	Very high	4 Å²	4	25.9 Å²	25.9	2%	0.024	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-21.5	-170.1	67.2	0	0	0	0	113.2	I142 I144 Q147 Q150 L151 T154 H207	I142-V209 HydrophobicContact CG2-CB 3.7Å; I142-V209 HydrophobicContact CG2-CG2 3.87Å; I144-V209 HydrophobicContact CG2-CB 3.88Å; I144-V209 HydrophobicContact CG2-CG1 4.34Å; I144-V209 HydrophobicContact CG2-CG2 3.58Å; Q147-V209 HydrophobicContact CB-CG1 3.85Å; Q147-V209 HydrophobicContact CB-CG2 4.36Å; Q147-V209 HydrophobicContact CG-CG1 4.27Å; Q150-V209 CarbonylContact C-O 3.57Å; Q150-V209 HydrophobicContact CB-CG1 4.43Å; Q150-V209 HydrophobicContact CB-CG2 4.12Å; L151-V209 VanDerWaalsContact CA-CG2 3.48Å; L151-V209 HydrophobicContact CB-CG2 3.68Å; L151-V209 HydrophobicContact CD1-CG2 4.19Å; T154-V209 WeakPolarHBondContact CB-O 3.26Å; T154-V209 PolarHBondContact OG1-O 3.35Å; H207-V209 PolarHBondContact O-N 2.97Å
210	D	94.2	Very high	96.7	Very high	10 Å²	10	25.8 Å²	25.8	5%	0.053	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	9.1	-174.6	56.8	-3.9	0	0	0	113.4	Q150 D208 Y305 I306 Y308	Q150-D210 HydrophobicContact CG-CB 4.43Å; D208-D210 WeakPolarHBondContact CB-OD1 3.49Å; D208-D210 PolarHBondContact O-N 2.72Å; D210-Y305 HydrophobicContact CB-CD2 4.43Å; D210-Y305 HydrophobicContact CB-CE2 4.16Å; D210-Y305 CarbonylContact O-C 3.51Å; D210-Y305 WeakPolarHBondContact O-CA 3.33Å; D210-Y305 VanDerWaalsContact OD2-CE2 3.24Å; D210-Y305 WeakPolarHBondContact OD2-CE2 3.49Å; D210-I306 WeakPolarHBondContact CB-O 3.44Å; D210-I306 PolarHBondContact O-N 3.15Å; D210-Y308 HydrophobicContact CB-CD1 4.23Å; D210-Y308 HydrophobicContact CB-CE1 4.35Å; D210-Y308 VanDerWaalsContact OD2-CE1 3.26Å; D210-Y308 WeakPolarHBondContact OD2-CE1 3.49Å
211	L	96.8	Very high	96.6	Very high	5 Å²	5	26.6 Å²	26.6	3%	0.026	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	100.8	178.9	-64.7	-177.8	0	0	0	111.2	H207 D208 P213 I237 V253 Y303 Y305	H207-L211 PolarHBondContact CE1-O 2.57Å; D208-L211 HydrophobicContact CB-CD1 4.1Å; D208-L211 HydrophobicContact CB-CG 4.26Å; D208-L211 PolarHBondContact O-N 3.05Å; L211-P213 WeakPolarHBondContact O-CD 3.4Å; L211-I237 HydrophobicContact CD1-CD1 3.97Å; L211-I237 HydrophobicContact CD2-CD1 3.94Å; L211-I237 HydrophobicContact CD2-CG1 4.37Å; L211-I237 HydrophobicContact CD2-CG2 3.95Å; L211-V253 HydrophobicContact CB-CG2 4.13Å; L211-V253 HydrophobicContact CD1-CG2 4.01Å; L211-Y303 HydrophobicContact CB-CD1 3.76Å; L211-Y303 HydrophobicContact CB-CG 4.35Å; L211-Y305 HydrophobicContact CD2-CD2 4.17Å
212	A	95.6	Very high	96.5	Very high	2 Å²	2	27.9 Å²	27.9	2%	0.017	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	120.8	175.1	0	0	0	0	0	110.2	T157 I214 Y303 L304 I306	T157-A212 HydrophobicContact CG2-CB 4.41Å; A212-I214 WeakPolarHBondContact O-CG2 3.43Å; A212-Y303 VanDerWaalsContact O-CA 3.3Å; A212-Y303 WeakPolarHBondContact O-CA 3.37Å; A212-L304 PolarHBondContact N-O 2.65Å; A212-L304 PolarHBondContact O-N 3.09Å; A212-I306 HydrophobicContact CB-CD1 3.98Å; A212-I306 HydrophobicContact CB-CG1 4.4Å
213	P	96.2	Very high	96.3	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.006	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	145.4	173.2	27.9	-36	0	0	0	111.2	T157 L158 I161 L211 Y303	T157-P213 VanDerWaalsContact CB-O 3.26Å; T157-P213 WeakPolarHBondContact CB-O 3.39Å; T157-P213 WeakPolarHBondContact OG1-CD 3.48Å; T157-P213 PolarHBondContact OG1-O 3.09Å; T157-P213 VanDerWaalsContact OG1-O 3.08Å; L158-P213 HydrophobicContact CB-CG 4.02Å; L158-P213 HydrophobicContact CD1-CG 4.1Å; I161-P213 HydrophobicContact CD1-CB 3.67Å; I161-P213 HydrophobicContact CD1-CG 3.76Å; L211-P213 WeakPolarHBondContact O-CD 3.4Å; P213-Y303 HydrophobicContact CB-CD1 4.03Å; P213-Y303 HydrophobicContact CB-CE1 3.53Å; P213-Y303 HydrophobicContact CG-CE1 4.21Å
214	I	94	Very high	96.1	Very high	37 Å²	37	33.5 Å²	33.5	19%	0.19	16%	0.159	C	C	.	.			trans	-130.7	-8.1	-166.3	88	170.9	0	0	0	113.6	W84 A212 F242 Q302 L304	W84-I214 HydrophobicContact CH2-CB 3.17Å; W84-I214 HydrophobicContact CH2-CD1 3.64Å; W84-I214 HydrophobicContact CH2-CG1 3.95Å; W84-I214 HydrophobicContact CH2-CG2 3.19Å; W84-I214 HydrophobicContact CZ2-CB 4.26Å; W84-I214 HydrophobicContact CZ2-CD1 4.11Å; W84-I214 HydrophobicContact CZ2-CG2 4.47Å; W84-I214 HydrophobicContact CZ3-CB 3.36Å; W84-I214 HydrophobicContact CZ3-CG2 3.32Å; A212-I214 WeakPolarHBondContact O-CG2 3.43Å; I214-F242 HydrophobicContact CD1-CE1 3.97Å; I214-F242 HydrophobicContact CD1-CZ 4.31Å; I214-Q302 HydrophobicContact CD1-CB 3.71Å; I214-Q302 HydrophobicContact CG1-CB 3.46Å; I214-Q302 VanDerWaalsContact CG1-CB 3.46Å; I214-Q302 WeakPolarHBondContact CG1-O 3.38Å; I214-Q302 PolarHBondContact N-O 3.49Å; I214-L304 HydrophobicContact CG2-CB 4.32Å; I214-L304 HydrophobicContact CG2-CG 3.96Å
215	N	93.4	Very high	96	Very high	30 Å²	30	37.3 Å²	37.3	16%	0.16	18%	0.179	C	C	.	.			trans	-123.4	115.9	-179.8	-172.6	-25.1	0	0	0	109.4	Y217 N218 K299 I300	N215-Y217 PolarHBondContact O-N 3.48Å; N215-Y217 VanDerWaalsContact OD1-CB 3.32Å; N215-Y217 WeakPolarHBondContact OD1-CB 3.21Å; N215-Y217 VanDerWaalsContact OD1-CD2 3.29Å; N215-Y217 WeakPolarHBondContact OD1-CD2 3.4Å; N215-Y217 PolarHBondContact OD1-N 3.36Å; N215-N218 WeakPolarHBondContact O-CB 3.34Å; N215-N218 PolarHBondContact O-N 2.96Å; N215-N218 VanDerWaalsContact O-N 3.07Å; N215-K299 PolarHBondContact ND2-O 2.88Å; N215-I300 WeakPolarHBondContact CB-O 3.26Å
216	Y	92.1	Very high	95.9	Very high	81 Å²	81	37.3 Å²	37.3	32%	0.318	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-19.5	-179.6	-59.8	-82.9	0	0	0	113.7	I161 I164 Q165 N218	I161-Y216 HydrophobicContact CB-CD1 4.33Å; I161-Y216 HydrophobicContact CD1-CD1 4.37Å; I161-Y216 HydrophobicContact CG1-CD1 3.37Å; I161-Y216 HydrophobicContact CG1-CE1 3.69Å; I161-Y216 HydrophobicContact CG1-CG 4.19Å; I164-Y216 HydrophobicContact CD1-CD1 3.91Å; I164-Y216 HydrophobicContact CD1-CE1 3.98Å; Q165-Y216 PolarHBondContact NE2-O 3.38Å; Y216-N218 VanDerWaalsContact C-N 3.29Å
217	Y	95.2	Very high	95.8	Very high	196 Å²	196	42 Å²	42	77%	0.769	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-9.5	175.9	-63.1	-68.3	0	0	0	113.7	N215 S219	N215-Y217 PolarHBondContact O-N 3.48Å; N215-Y217 VanDerWaalsContact OD1-CB 3.32Å; N215-Y217 WeakPolarHBondContact OD1-CB 3.21Å; N215-Y217 VanDerWaalsContact OD1-CD2 3.29Å; N215-Y217 WeakPolarHBondContact OD1-CD2 3.4Å; N215-Y217 PolarHBondContact OD1-N 3.36Å; Y217-S219 PolarHBondContact O-N 3.14Å; Y217-S219 VanDerWaalsContact O-N 3.12Å
218	N	96.9	Very high	95.7	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.011	23%	0.225	C	C	.	.	S	Bend	trans	-72.6	105.3	175.3	-166.5	9.4	0	0	0	110	Q165 N215 Y216 Y220 I300 Y303	Q165-N218 PolarHBondContact NE2-O 2.95Å; N215-N218 WeakPolarHBondContact O-CB 3.34Å; N215-N218 PolarHBondContact O-N 2.96Å; N215-N218 VanDerWaalsContact O-N 3.07Å; Y216-N218 VanDerWaalsContact C-N 3.29Å; N218-Y220 VanDerWaalsContact O-CD2 3.31Å; N218-Y220 WeakPolarHBondContact O-CD2 3.38Å; N218-Y220 PolarHBondContact O-N 3.48Å; N218-I300 VanDerWaalsContact CA-CG2 3.49Å; N218-I300 HydrophobicContact CB-CG2 3.92Å; N218-Y303 VanDerWaalsContact ND2-CE2 3.31Å; N218-Y303 WeakPolarHBondContact ND2-CE2 3.14Å; N218-Y303 PolarHBondContact ND2-OH 2.95Å
219	S	97.2	Very high	95.8	Very high	35 Å²	35	48.8 Å²	48.8	25%	0.245	23%	0.231	C	C	.	.			trans	-72.1	122.2	-169.6	177.4	0	0	0	0	113.1	Y217 Q221 D223 K255	Y217-S219 PolarHBondContact O-N 3.14Å; Y217-S219 VanDerWaalsContact O-N 3.12Å; S219-Q221 WeakPolarHBondContact OG-CB 3.21Å; S219-Q221 PolarHBondContact OG-N 2.95Å; S219-D223 WeakPolarHBondContact CB-OD2 3.22Å; S219-D223 PolarHBondContact OG-OD1 3.08Å; S219-D223 PolarHBondContact OG-OD2 3.33Å; S219-K255 PolarHBondContact O-NZ 3.45Å
220	Y	98.1	Very high	95.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.23	C	C	.	.			trans	-98.2	6.2	168.5	-78.2	-116	0	0	0	112.4	L158 I161 L162 I205 H207 N218 L233 Y303	L158-Y220 HydrophobicContact CD1-CD1 3.84Å; L158-Y220 HydrophobicContact CD1-CE1 3.24Å; L158-Y220 HydrophobicContact CD1-CE2 4.29Å; I161-Y220 HydrophobicContact CG2-CD2 4.33Å; L162-Y220 VanDerWaalsContact CD2-CB 3.46Å; L162-Y220 HydrophobicContact CD2-CD1 3.45Å; L162-Y220 VanDerWaalsContact CD2-CD1 3.45Å; L162-Y220 HydrophobicContact CD2-CD2 4.45Å; L162-Y220 HydrophobicContact CD2-CE1 4.3Å; L162-Y220 HydrophobicContact CD2-CG 3.56Å; I205-Y220 HydrophobicContact CD1-CD1 3.34Å; I205-Y220 HydrophobicContact CD1-CE1 4.2Å; I205-Y220 HydrophobicContact CD1-CG 3.86Å; I205-Y220 HydrophobicContact CG2-CD1 4.28Å; I205-Y220 HydrophobicContact CG2-CE1 4.12Å; H207-Y220 AromaticContact CD2-CE1 3.77Å; H207-Y220 PolarHBondContact CD2-OH 2.87Å; H207-Y220 AromaticContact NE2-CZ 3.99Å; H207-Y220 PolarHBondContact NE2-OH 2.86Å; N218-Y220 VanDerWaalsContact O-CD2 3.31Å; N218-Y220 WeakPolarHBondContact O-CD2 3.38Å; N218-Y220 PolarHBondContact O-N 3.48Å; Y220-L233 HydrophobicContact CD2-CD1 4.48Å; Y220-L233 HydrophobicContact CE1-CD1 4.47Å; Y220-L233 HydrophobicContact CE2-CD1 4.3Å; Y220-Y303 PolarHBondContact OH-OH 3.31Å
221	Q	96.1	Very high	96.1	Very high	86 Å²	86	48.6 Å²	48.6	40%	0.402	23%	0.229	S	C	.	.	S	Bend	trans	-68.6	156.4	177.1	-74.6	177.2	10.6	0	0	112.4	Q165 I167 S219 D223 K255	Q165-Q221 PolarHBondContact O-NE2 2.88Å; I167-Q221 HydrophobicContact CB-CG 4.41Å; I167-Q221 HydrophobicContact CG2-CB 4.26Å; I167-Q221 HydrophobicContact CG2-CG 3.25Å; S219-Q221 WeakPolarHBondContact OG-CB 3.21Å; S219-Q221 PolarHBondContact OG-N 2.95Å; Q221-D223 WeakPolarHBondContact CB-OD1 3.47Å; Q221-D223 PolarHBondContact O-N 2.7Å; Q221-K255 VanDerWaalsContact O-CD 3.25Å; Q221-K255 WeakPolarHBondContact O-CD 3.41Å; Q221-K255 WeakPolarHBondContact O-CE 3.08Å; Q221-K255 PolarHBondContact O-NZ 3.41Å
222	C	96.6	Very high	96.1	Very high	35 Å²	35	48.3 Å²	48.3	24%	0.236	23%	0.228	C	C	.	.			trans	-79.9	72.1	168.4	-168	0	0	0	0	110	V138 C203	V138-C222 HydrophobicContact CG2-CB 3.86Å; C203-C222 HydrophobicContact CB-CB 3.62Å; C203-C222 WeakPolarHBondContact CB-SG 3.39Å; C203-C222 WeakPolarHBondContact SG-CA 3.24Å; C203-C222 WeakPolarHBondContact SG-CB 3.39Å; C203-C222 CovalentContact SG-SG 2.03Å; C203-C222 PolarHBondContact SG-SG 2.94Å
223	D	93.3	Very high	96.3	Very high	47 Å²	47	48.3 Å²	48.3	25%	0.251	23%	0.228	S	C	.	.			trans	-67.4	157.8	-173	-57.2	-46	0	0	0	112.1	S219 Q221 L225 T226 K227 K255	S219-D223 WeakPolarHBondContact CB-OD2 3.22Å; S219-D223 PolarHBondContact OG-OD1 3.08Å; S219-D223 PolarHBondContact OG-OD2 3.33Å; Q221-D223 WeakPolarHBondContact CB-OD1 3.47Å; Q221-D223 PolarHBondContact O-N 2.7Å; D223-L225 PolarHBondContact O-N 3.23Å; D223-L225 VanDerWaalsContact O-N 3.12Å; D223-T226 WeakPolarHBondContact O-CB 3.32Å; D223-T226 PolarHBondContact O-N 3.18Å; D223-K227 PolarHBondContact O-N 2.88Å; D223-K255 IonicContact OD2-NZ 2.7Å; D223-K255 PolarHBondContact OD2-NZ 2.82Å
224	Q	94.6	Very high	96.4	Very high	122 Å²	122	48.2 Å²	48.2	57%	0.57	23%	0.227	S	C	*	.	H	α-helix	trans	-55.7	-33.2	175.7	-171.3	66.2	0.6	0	0	111.9	K227 H228	Q224-K227 WeakPolarHBondContact O-CB 3.45Å; Q224-K227 PolarHBondContact O-N 2.66Å; Q224-H228 PolarHBondContact O-ND1 3.3Å
225	L	96.4	Very high	96.5	Very high	80 Å²	80	46.9 Å²	46.9	42%	0.419	22%	0.221	S	C	.	.	H	α-helix	trans	-64.2	-42.5	176.5	-162.8	61.2	0	0	0	111.9	D223 K227 H228 M229 I231 I294	D223-L225 PolarHBondContact O-N 3.23Å; D223-L225 VanDerWaalsContact O-N 3.12Å; L225-K227 PolarHBondContact O-N 2.93Å; L225-H228 PolarHBondContact O-N 3.3Å; L225-M229 HydrophobicContact CD1-CE 3.56Å; L225-M229 HydrophobicContact CD1-CG 4.17Å; L225-M229 HydrophobicContact CD1-SD 3.57Å; L225-M229 VanDerWaalsContact CD1-SD 3.57Å; L225-M229 HydrophobicContact CG-CE 4.41Å; L225-M229 HydrophobicContact CG-CG 4Å; L225-M229 HydrophobicContact CG-SD 3.84Å; L225-M229 WeakPolarHBondContact O-CG 3.47Å; L225-M229 PolarHBondContact O-N 3Å; L225-I231 HydrophobicContact CB-CD1 4.34Å; L225-I231 HydrophobicContact CD2-CD1 3.92Å; L225-I231 HydrophobicContact CG-CD1 3.82Å; L225-I294 HydrophobicContact CD2-CD1 3.46Å; L225-I294 VanDerWaalsContact CD2-CD1 3.46Å; L225-I294 HydrophobicContact CG-CD1 4.3Å
226	T	97.4	Very high	96.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64	-26.3	179.4	-55.6	0	0	0	0	113.3	C203 D223 H228 M229 I231 K255	C203-T226 HydrophobicContact CB-CG2 4.27Å; C203-T226 WeakPolarHBondContact SG-CG2 3.5Å; D223-T226 WeakPolarHBondContact O-CB 3.32Å; D223-T226 PolarHBondContact O-N 3.18Å; T226-H228 PolarHBondContact O-N 3.46Å; T226-M229 CarbonylContact C-O 3.5Å; T226-M229 VanDerWaalsContact CA-O 3.31Å; T226-M229 WeakPolarHBondContact CA-O 3.32Å; T226-M229 VanDerWaalsContact O-O 3.1Å; T226-I231 WeakPolarHBondContact OG1-CG1 3.39Å; T226-K255 HydrophobicContact CG2-CD 4.34Å; T226-K255 HydrophobicContact CG2-CG 3.74Å; T226-K255 WeakPolarHBondContact OG1-CE 3.18Å
227	K	95.6	Very high	97	Very high	99 Å²	99	42.2 Å²	42.2	43%	0.43	20%	0.201	S	C	.	.	H	α-helix	trans	-66.3	-24.9	172.8	-60.5	-177.7	-172.6	168.1	0	112.7	D223 Q224 L225 H260	D223-K227 PolarHBondContact O-N 2.88Å; Q224-K227 WeakPolarHBondContact O-CB 3.45Å; Q224-K227 PolarHBondContact O-N 2.66Å; L225-K227 PolarHBondContact O-N 2.93Å; K227-H260 PolarHBondContact O-CE1 3.25Å
228	H	97	Very high	96.9	Very high	116 Å²	116	35.5 Å²	35.5	54%	0.537	18%	0.179	S	C	.	.	H	α-helix	trans	-108.2	-18	-175.5	-59.3	89.4	0	0	0	114	Q224 L225 T226 H260	Q224-H228 PolarHBondContact O-ND1 3.3Å; L225-H228 PolarHBondContact O-N 3.3Å; T226-H228 PolarHBondContact O-N 3.46Å; H228-H260 VanDerWaalsContact C-CE1 3.4Å; H228-H260 PolarHBondContact O-CE1 2.89Å
229	M	98	Very high	96.8	Very high	37 Å²	37	39.4 Å²	39.4	18%	0.182	20%	0.203	C	C	.	.	S	Bend	trans	-157.1	161.8	-178.8	60.5	-168.8	72.1	0	0	112	L225 T226 I231 K292 I294	L225-M229 HydrophobicContact CD1-CE 3.56Å; L225-M229 HydrophobicContact CD1-CG 4.17Å; L225-M229 HydrophobicContact CD1-SD 3.57Å; L225-M229 VanDerWaalsContact CD1-SD 3.57Å; L225-M229 HydrophobicContact CG-CE 4.41Å; L225-M229 HydrophobicContact CG-CG 4Å; L225-M229 HydrophobicContact CG-SD 3.84Å; L225-M229 WeakPolarHBondContact O-CG 3.47Å; L225-M229 PolarHBondContact O-N 3Å; T226-M229 CarbonylContact C-O 3.5Å; T226-M229 VanDerWaalsContact CA-O 3.31Å; T226-M229 WeakPolarHBondContact CA-O 3.32Å; T226-M229 VanDerWaalsContact O-O 3.1Å; M229-I231 HydrophobicContact CG-CD1 3.8Å; M229-K292 WeakPolarHBondContact CA-O 3.32Å; M229-K292 HydrophobicContact CB-CB 4.32Å; M229-K292 VanDerWaalsContact CB-O 3.22Å; M229-K292 WeakPolarHBondContact CB-O 3.48Å; M229-I294 HydrophobicContact SD-CB 4.48Å; M229-I294 HydrophobicContact SD-CD1 4.13Å; M229-I294 HydrophobicContact SD-CG1 4.06Å; M229-I294 HydrophobicContact SD-CG2 3.66Å
230	M	98.4	Very high	96.6	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	140.8	170.7	-176.1	-80.9	-85.9	0	0	110.6	H232 I250 L254 I256 L286 K292 Y293 I294	M230-H232 HydrophobicContact SD-CB 4.4Å; M230-I250 HydrophobicContact CE-CB 3.82Å; M230-I250 HydrophobicContact CE-CD1 3.63Å; M230-I250 HydrophobicContact CE-CG1 4.35Å; M230-I250 HydrophobicContact CE-CG2 3.78Å; M230-L254 HydrophobicContact CE-CD2 4.01Å; M230-L254 HydrophobicContact CG-CD1 3.96Å; M230-L254 HydrophobicContact SD-CB 3.81Å; M230-L254 HydrophobicContact SD-CD1 4.19Å; M230-L254 HydrophobicContact SD-CD2 4.2Å; M230-L254 HydrophobicContact SD-CG 4.31Å; M230-I256 HydrophobicContact CB-CB 4.3Å; M230-I256 HydrophobicContact CB-CD1 4.12Å; M230-I256 HydrophobicContact CB-CG1 4.13Å; M230-I256 HydrophobicContact CG-CB 3.95Å; M230-I256 HydrophobicContact CG-CD1 4.2Å; M230-I256 HydrophobicContact CG-CG1 4.26Å; M230-L286 HydrophobicContact CB-CD1 4.43Å; M230-L286 HydrophobicContact CB-CD2 4.22Å; M230-L286 HydrophobicContact CE-CD1 3.52Å; M230-L286 HydrophobicContact CG-CD1 4.49Å; M230-K292 PolarHBondContact N-O 3.46Å; M230-Y293 HydrophobicContact CE-CG 4.09Å; M230-Y293 CarbonylContact O-C 3.47Å; M230-Y293 WeakPolarHBondContact O-CA 3.46Å; M230-Y293 WeakPolarHBondContact O-CB 3.49Å; M230-I294 PolarHBondContact O-N 2.99Å
231	I	98.6	Very high	96.5	Very high	9 Å²	9	49.6 Å²	49.6	5%	0.046	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	114.5	179.5	-43.6	-59	0	0	0	109.1	L225 T226 M229 L233 L254 K255 I294 V296	L225-I231 HydrophobicContact CB-CD1 4.34Å; L225-I231 HydrophobicContact CD2-CD1 3.92Å; L225-I231 HydrophobicContact CG-CD1 3.82Å; T226-I231 WeakPolarHBondContact OG1-CG1 3.39Å; M229-I231 HydrophobicContact CG-CD1 3.8Å; I231-L233 HydrophobicContact CB-CD2 4.47Å; I231-L233 HydrophobicContact CG2-CD2 3.85Å; I231-L254 CarbonylContact O-C 3.39Å; I231-L254 WeakPolarHBondContact O-CA 3.22Å; I231-K255 HydrophobicContact CB-CB 4.44Å; I231-K255 PolarHBondContact N-O 3.03Å; I231-K255 PolarHBondContact O-N 2.82Å; I231-I294 HydrophobicContact CD1-CD1 3.88Å; I231-I294 HydrophobicContact CD1-CG1 3.65Å; I231-V296 HydrophobicContact CG2-CG1 3.6Å
232	H	98.5	Very high	96.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	116.1	171.6	176.3	-142.4	0	0	0	108.9	M230 S234 V235 Y249 I250 G251 V253 I294 H295 V296	M230-H232 HydrophobicContact SD-CB 4.4Å; H232-S234 PolarHBondContact CE1-O 3.07Å; H232-S234 PolarHBondContact NE2-O 3Å; H232-S234 PolarHBondContact NE2-OG 2.96Å; H232-S234 VanDerWaalsContact NE2-OG 3.13Å; H232-V235 WeakPolarHBondContact O-CG2 3.15Å; H232-Y249 AromaticContact CE1-CD1 3.75Å; H232-Y249 AromaticContact CE1-CE1 3.99Å; H232-Y249 PolarHBondContact CE1-O 2.85Å; H232-Y249 PolarHBondContact ND1-O 3.25Å; H232-I250 HydrophobicContact CB-CG2 4.43Å; H232-G251 PolarHBondContact NE2-O 2.8Å; H232-V253 PolarHBondContact CD2-O 2.87Å; H232-I294 PolarHBondContact N-O 2.99Å; H232-H295 WeakPolarHBondContact CB-ND1 3.33Å; H232-H295 AromaticContact CG-ND1 3.59Å; H232-H295 AromaticContact ND1-CE1 3.57Å; H232-H295 AromaticContact ND1-ND1 3.02Å; H232-H295 PolarHBondContact ND1-ND1 2.89Å; H232-V296 WeakPolarHBondContact O-CG2 3.21Å; H232-V296 PolarHBondContact O-N 3.07Å; H232-V296 VanDerWaalsContact O-N 3.12Å
233	L	98.5	Very high	96.4	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.005	26%	0.259	C	S	.	.			trans	-90.9	-39.4	-173.3	-59.5	-179.2	0	0	0	112.2	I205 Y220 I231 V235 V253 K255 V296 G301 Y303	I205-L233 HydrophobicContact CG2-CD1 4.44Å; Y220-L233 HydrophobicContact CD2-CD1 4.48Å; Y220-L233 HydrophobicContact CE1-CD1 4.47Å; Y220-L233 HydrophobicContact CE2-CD1 4.3Å; I231-L233 HydrophobicContact CB-CD2 4.47Å; I231-L233 HydrophobicContact CG2-CD2 3.85Å; L233-V235 VanDerWaalsContact C-N 3.29Å; L233-V235 PolarHBondContact O-N 3.31Å; L233-V235 VanDerWaalsContact O-N 3.07Å; L233-V253 WeakPolarHBondContact CA-O 3.46Å; L233-V253 HydrophobicContact CB-CB 4.31Å; L233-V253 HydrophobicContact CB-CG1 4.14Å; L233-V253 WeakPolarHBondContact CB-O 3.27Å; L233-V253 HydrophobicContact CD1-CG1 4Å; L233-V253 PolarHBondContact N-O 2.79Å; L233-K255 HydrophobicContact CD1-CB 4.11Å; L233-K255 HydrophobicContact CG-CB 4.37Å; L233-V296 HydrophobicContact CD2-CG1 3.95Å; L233-V296 VanDerWaalsContact O-CG2 3.23Å; L233-V296 WeakPolarHBondContact O-CG2 3.28Å; L233-G301 CarbonylContact O-C 3.47Å; L233-G301 WeakPolarHBondContact O-CA 3.48Å; L233-Y303 WeakPolarHBondContact O-CE2 3.18Å
234	S	97.9	Very high	96.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.259	C	S	.	.			trans	-87.1	57.3	-176.4	53.9	0	0	0	0	114	H232 G251 V253 Y303	H232-S234 PolarHBondContact CE1-O 3.07Å; H232-S234 PolarHBondContact NE2-O 3Å; H232-S234 PolarHBondContact NE2-OG 2.96Å; H232-S234 VanDerWaalsContact NE2-OG 3.13Å; S234-G251 PolarHBondContact OG-O 3.13Å; S234-V253 PolarHBondContact N-O 2.83Å; S234-V253 PolarHBondContact OG-N 2.77Å; S234-V253 PolarHBondContact OG-O 3.42Å; S234-Y303 VanDerWaalsContact CA-CE2 3.48Å
235	V	97.6	Very high	96.4	Very high	9 Å²	9	50.9 Å²	50.9	6%	0.055	25%	0.25	C	C	.	.			trans	-72.7	-32.1	-177.2	173	0	0	0	0	112.5	H232 L233 K243 L244 H295 V296 D298 G301	H232-V235 WeakPolarHBondContact O-CG2 3.15Å; L233-V235 VanDerWaalsContact C-N 3.29Å; L233-V235 PolarHBondContact O-N 3.31Å; L233-V235 VanDerWaalsContact O-N 3.07Å; V235-K243 CarbonylContact O-C 3.56Å; V235-L244 HydrophobicContact CG1-CB 4.35Å; V235-L244 HydrophobicContact CG1-CD1 4.25Å; V235-L244 WeakPolarHBondContact O-CA 3.31Å; V235-L244 PolarHBondContact O-N 3.03Å; V235-H295 HydrophobicContact CG1-CB 4.41Å; V235-H295 HydrophobicContact CG2-CB 3.63Å; V235-V296 HydrophobicContact CB-CG2 4.2Å; V235-V296 HydrophobicContact CG2-CG2 3.71Å; V235-V296 WeakPolarHBondContact CG2-O 3.41Å; V235-D298 HydrophobicContact CG1-CB 4.3Å; V235-G301 PolarHBondContact N-O 3.02Å
236	A	97.5	Very high	96.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	91.8	-171.8	0	0	0	0	0	110.8	F242 D298 G301 Q302 Y303	A236-F242 HydrophobicContact CB-CB 4Å; A236-F242 HydrophobicContact CB-CD1 4.21Å; A236-F242 VanDerWaalsContact CB-O 3.28Å; A236-F242 WeakPolarHBondContact CB-O 3.42Å; A236-F242 WeakPolarHBondContact O-CD1 3.23Å; A236-D298 HydrophobicContact CB-CB 4.16Å; A236-D298 WeakPolarHBondContact CB-O 3.46Å; A236-G301 PolarHBondContact N-O 3.18Å; A236-Q302 HydrophobicContact CB-CG 4.02Å; A236-Q302 CarbonylContact O-C 3.57Å; A236-Q302 VanDerWaalsContact O-CA 3.28Å; A236-Q302 WeakPolarHBondContact O-CA 3.22Å; A236-Y303 PolarHBondContact O-N 3.27Å
237	I	96.9	Very high	96.2	Very high	12 Å²	12	60 Å²	60	6%	0.062	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	137.9	177.7	-51.4	174.3	0	0	0	109.3	L211 T239 N240 F242	L211-I237 HydrophobicContact CD1-CD1 3.97Å; L211-I237 HydrophobicContact CD2-CD1 3.94Å; L211-I237 HydrophobicContact CD2-CG1 4.37Å; L211-I237 HydrophobicContact CD2-CG2 3.95Å; I237-T239 VanDerWaalsContact C-N 3.28Å; I237-T239 WeakPolarHBondContact CG2-OG1 3.28Å; I237-T239 PolarHBondContact O-N 3.4Å; I237-N240 CarbonylContact O-C 3.5Å; I237-N240 PolarHBondContact O-N 2.79Å; I237-F242 WeakPolarHBondContact O-CA 3.07Å; I237-F242 PolarHBondContact O-N 2.78Å
238	N	95	Very high	96.2	Very high	56 Å²	56	57.7 Å²	57.7	30%	0.299	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-55.9	-36.9	-177.3	67.1	-35.3	0	0	0	114.1	N240 K241 F242 Y303 L304 Y305	N238-N240 PolarHBondContact O-N 2.84Å; N238-K241 PolarHBondContact O-N 2.86Å; N238-F242 HydrophobicContact CB-CE1 3.99Å; N238-F242 HydrophobicContact CB-CE2 3.82Å; N238-F242 HydrophobicContact CB-CZ 3.52Å; N238-Y303 PolarHBondContact N-O 3.04Å; N238-L304 HydrophobicContact CB-CD2 3.86Å; N238-Y305 WeakPolarHBondContact OD1-CB 3.42Å; N238-Y305 PolarHBondContact OD1-N 2.9Å
239	T	93.2	Very high	96.1	Very high	84 Å²	84	53.3 Å²	53.3	52%	0.515	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-60.1	-25.3	176.5	49.5	0	0	0	0	113	I237 Y305	I237-T239 VanDerWaalsContact C-N 3.28Å; I237-T239 WeakPolarHBondContact CG2-OG1 3.28Å; I237-T239 PolarHBondContact O-N 3.4Å; T239-Y305 HydrophobicContact CG2-CD1 3.71Å; T239-Y305 HydrophobicContact CG2-CG 3.81Å
240	N	93.6	Very high	96	Very high	68 Å²	68	51.6 Å²	51.6	36%	0.364	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-106.4	26.5	178.7	-66.4	66.5	0	0	0	111.1	I237 N238 F242 K243	I237-N240 CarbonylContact O-C 3.5Å; I237-N240 PolarHBondContact O-N 2.79Å; N238-N240 PolarHBondContact O-N 2.84Å; N240-F242 PolarHBondContact O-N 3.47Å; N240-K243 WeakPolarHBondContact CB-O 3.42Å; N240-K243 PolarHBondContact O-N 2.85Å
241	K	95.8	Very high	95.8	Very high	181 Å²	181	51.6 Å²	51.6	79%	0.787	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	54	37.2	-177.8	-54.5	-179.7	-179	178.8	0	112.4	N238 K243	N238-K241 PolarHBondContact O-N 2.86Å; K241-K243 PolarHBondContact O-N 2.66Å
242	F	96.2	Very high	95.7	Very high	68 Å²	68	51.3 Å²	51.3	30%	0.298	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	34	-177	-64.7	-78.4	0	0	0	113.5	I214 A236 I237 N238 N240 Q302 L304	I214-F242 HydrophobicContact CD1-CE1 3.97Å; I214-F242 HydrophobicContact CD1-CZ 4.31Å; A236-F242 HydrophobicContact CB-CB 4Å; A236-F242 HydrophobicContact CB-CD1 4.21Å; A236-F242 VanDerWaalsContact CB-O 3.28Å; A236-F242 WeakPolarHBondContact CB-O 3.42Å; A236-F242 WeakPolarHBondContact O-CD1 3.23Å; I237-F242 WeakPolarHBondContact O-CA 3.07Å; I237-F242 PolarHBondContact O-N 2.78Å; N238-F242 HydrophobicContact CB-CE1 3.99Å; N238-F242 HydrophobicContact CB-CE2 3.82Å; N238-F242 HydrophobicContact CB-CZ 3.52Å; N240-F242 PolarHBondContact O-N 3.47Å; F242-Q302 HydrophobicContact CD1-CB 4.27Å; F242-Q302 HydrophobicContact CD1-CG 4.13Å; F242-Q302 HydrophobicContact CE1-CB 4.28Å; F242-L304 HydrophobicContact CZ-CD2 4.39Å
243	K	95.4	Very high	95.7	Very high	143 Å²	143	51.3 Å²	51.3	62%	0.622	25%	0.248	S	C	*	.	S	Bend	trans	-124	150.4	175.4	-66	-175.6	178.6	-174.4	0	111.1	V235 N240 K241	V235-K243 CarbonylContact O-C 3.56Å; N240-K243 WeakPolarHBondContact CB-O 3.42Å; N240-K243 PolarHBondContact O-N 2.85Å; K241-K243 PolarHBondContact O-N 2.66Å
244	L	95.1	Very high	95.7	Very high	47 Å²	47	51.3 Å²	51.3	25%	0.246	25%	0.248	C	C	.	.			trans	-62.5	130.4	172.1	-166.9	71.8	0	0	0	109.4	V235 Y246 Y249	V235-L244 HydrophobicContact CG1-CB 4.35Å; V235-L244 HydrophobicContact CG1-CD1 4.25Å; V235-L244 WeakPolarHBondContact O-CA 3.31Å; V235-L244 PolarHBondContact O-N 3.03Å; L244-Y246 WeakPolarHBondContact CD2-O 3.46Å; L244-Y246 WeakPolarHBondContact CG-O 3.41Å; L244-Y246 PolarHBondContact O-N 2.95Å; L244-Y249 HydrophobicContact CD1-CD1 3.77Å; L244-Y249 HydrophobicContact CD1-CG 4.45Å
245	P	92.5	Very high	95.7	Very high	58 Å²	58	51.4 Å²	51.4	38%	0.377	25%	0.248	S	C	.	.	S	Bend	trans	-60.7	-43.5	-178.2	-22.4	31.1	0	0	0	113.4	Y249	P245-Y249 HydrophobicContact CB-CG 4.44Å; P245-Y249 HydrophobicContact CG-CD1 3.93Å; P245-Y249 HydrophobicContact CG-CD2 4.19Å; P245-Y249 HydrophobicContact CG-CE1 4.13Å; P245-Y249 HydrophobicContact CG-CE2 4.4Å; P245-Y249 HydrophobicContact CG-CG 3.94Å
246	Y	93.9	Very high	95.8	Very high	87 Å²	87	51 Å²	51	34%	0.341	25%	0.246	S	C	.	.	S	Bend	trans	-157.3	160.6	175.6	51.7	-90.6	0	0	0	110	L244 T248 Y249 D280	L244-Y246 WeakPolarHBondContact CD2-O 3.46Å; L244-Y246 WeakPolarHBondContact CG-O 3.41Å; L244-Y246 PolarHBondContact O-N 2.95Å; Y246-T248 VanDerWaalsContact C-N 3.27Å; Y246-T248 WeakPolarHBondContact CD2-OG1 3.09Å; Y246-T248 PolarHBondContact O-N 2.96Å; Y246-T248 VanDerWaalsContact O-N 3.12Å; Y246-Y249 AromaticContact CE1-CD2 3.83Å; Y246-Y249 HydrophobicContact CE1-CD2 3.83Å; Y246-Y249 HydrophobicContact CE1-CG 4.36Å; Y246-Y249 HydrophobicContact CE2-CD2 4.4Å; Y246-Y249 AromaticContact CZ-CD2 3.7Å; Y246-Y249 VanDerWaalsContact O-CB 3.25Å; Y246-Y249 WeakPolarHBondContact O-CB 3.04Å; Y246-Y249 PolarHBondContact O-N 2.03Å; Y246-D280 PolarHBondContact OH-OD1 3.09Å; Y246-D280 PolarHBondContact OH-OD2 3.19Å
247	K	95.4	Very high	95.8	Very high	186 Å²	186	51.2 Å²	51.2	81%	0.809	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-31	-167.5	-174.9	177.9	177.5	-177.3	0	115.2	H295	K247-H295 PolarHBondContact O-NE2 3.22Å
248	T	95.3	Very high	95.9	Very high	50 Å²	50	51.5 Å²	51.5	31%	0.307	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99	6.7	-178.5	53.9	0	0	0	0	113	Y246 I250	Y246-T248 VanDerWaalsContact C-N 3.27Å; Y246-T248 WeakPolarHBondContact CD2-OG1 3.09Å; Y246-T248 PolarHBondContact O-N 2.96Å; Y246-T248 VanDerWaalsContact O-N 3.12Å; T248-I250 PolarHBondContact O-N 2.86Å
249	Y	94.8	Very high	96	Very high	24 Å²	24	54.9 Å²	54.9	9%	0.094	26%	0.264	C	S	.	.			trans	-69.4	122.9	-179	178.4	-97	0	0	0	110.9	H232 L244 P245 Y246 H295	H232-Y249 AromaticContact CE1-CD1 3.75Å; H232-Y249 AromaticContact CE1-CE1 3.99Å; H232-Y249 PolarHBondContact CE1-O 2.85Å; H232-Y249 PolarHBondContact ND1-O 3.25Å; L244-Y249 HydrophobicContact CD1-CD1 3.77Å; L244-Y249 HydrophobicContact CD1-CG 4.45Å; P245-Y249 HydrophobicContact CB-CG 4.44Å; P245-Y249 HydrophobicContact CG-CD1 3.93Å; P245-Y249 HydrophobicContact CG-CD2 4.19Å; P245-Y249 HydrophobicContact CG-CE1 4.13Å; P245-Y249 HydrophobicContact CG-CE2 4.4Å; P245-Y249 HydrophobicContact CG-CG 3.94Å; Y246-Y249 AromaticContact CE1-CD2 3.83Å; Y246-Y249 HydrophobicContact CE1-CD2 3.83Å; Y246-Y249 HydrophobicContact CE1-CG 4.36Å; Y246-Y249 HydrophobicContact CE2-CD2 4.4Å; Y246-Y249 AromaticContact CZ-CD2 3.7Å; Y246-Y249 VanDerWaalsContact O-CB 3.25Å; Y246-Y249 WeakPolarHBondContact O-CB 3.04Å; Y246-Y249 PolarHBondContact O-N 2.03Å; Y249-H295 PolarHBondContact O-CE1 2.73Å
250	I	96.2	Very high	96.3	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	25%	0.245	C	C	.	.			trans	-128.9	19.7	178.6	59.9	164.3	0	0	0	112.9	M230 H232 T248 L254 F282 E283 L286 Y293	M230-I250 HydrophobicContact CE-CB 3.82Å; M230-I250 HydrophobicContact CE-CD1 3.63Å; M230-I250 HydrophobicContact CE-CG1 4.35Å; M230-I250 HydrophobicContact CE-CG2 3.78Å; H232-I250 HydrophobicContact CB-CG2 4.43Å; T248-I250 PolarHBondContact O-N 2.86Å; I250-L254 WeakPolarHBondContact O-CD2 3.5Å; I250-F282 HydrophobicContact CD1-CB 4.48Å; I250-F282 HydrophobicContact CD1-CD1 3.86Å; I250-E283 HydrophobicContact CD1-CB 3.58Å; I250-E283 HydrophobicContact CD1-CG 4.02Å; I250-E283 HydrophobicContact CG1-CB 3.96Å; I250-E283 HydrophobicContact CG1-CG 4.27Å; I250-L286 HydrophobicContact CD1-CD1 3.85Å; I250-Y293 HydrophobicContact CG2-CD2 3.67Å; I250-Y293 HydrophobicContact CG2-CE2 3.61Å; I250-Y293 HydrophobicContact CG2-CG 4.25Å
251	G	93.9	Very high	96.5	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.228	C	C	.	.			trans	-76.3	174.5	-178.9	0	0	0	0	0	114.6	H232 S234 V253 D279	H232-G251 PolarHBondContact NE2-O 2.8Å; S234-G251 PolarHBondContact OG-O 3.13Å; G251-V253 PolarHBondContact O-N 3.22Å; G251-D279 VanDerWaalsContact CA-CG 3.42Å; G251-D279 WeakPolarHBondContact CA-OD2 3.5Å
252	G	96.2	Very high	96.6	Very high	2 Å²	2	44.6 Å²	44.6	2%	0.021	21%	0.212	C	C	.	.	S	Bend	trans	82.7	-101.4	179.7	0	0	0	0	0	113.6	D208	D208-G252 PolarHBondContact N-O 2.99Å
253	V	98.5	Very high	96.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	120.9	-174.8	-168.6	0	0	0	0	110.9	I205 F206 H207 L211 H232 L233 S234 G251 Y303	I205-V253 HydrophobicContact CG2-CG1 3.99Å; F206-V253 VanDerWaalsContact O-CA 3.32Å; F206-V253 WeakPolarHBondContact O-CA 3.32Å; H207-V253 HydrophobicContact CB-CG1 4.2Å; H207-V253 WeakPolarHBondContact CD2-CG1 3.14Å; L211-V253 HydrophobicContact CB-CG2 4.13Å; L211-V253 HydrophobicContact CD1-CG2 4.01Å; H232-V253 PolarHBondContact CD2-O 2.87Å; L233-V253 WeakPolarHBondContact CA-O 3.46Å; L233-V253 HydrophobicContact CB-CB 4.31Å; L233-V253 HydrophobicContact CB-CG1 4.14Å; L233-V253 WeakPolarHBondContact CB-O 3.27Å; L233-V253 HydrophobicContact CD1-CG1 4Å; L233-V253 PolarHBondContact N-O 2.79Å; S234-V253 PolarHBondContact N-O 2.83Å; S234-V253 PolarHBondContact OG-N 2.77Å; S234-V253 PolarHBondContact OG-O 3.42Å; G251-V253 PolarHBondContact O-N 3.22Å; V253-Y303 HydrophobicContact CB-CE1 4.27Å; V253-Y303 HydrophobicContact CG2-CD1 4.28Å; V253-Y303 HydrophobicContact CG2-CE1 3.71Å
254	L	98.5	Very high	96.7	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	159	177	71.1	80.5	0	0	0	112.2	I205 F206 M230 I231 I250 I256 Y267 F282	I205-L254 CarbonylContact C-O 3.37Å; I205-L254 VanDerWaalsContact CA-O 3.27Å; I205-L254 WeakPolarHBondContact CA-O 3.25Å; F206-L254 HydrophobicContact CD2-CD1 3.83Å; F206-L254 PolarHBondContact N-O 3.46Å; F206-L254 PolarHBondContact O-N 3.36Å; M230-L254 HydrophobicContact CE-CD2 4.01Å; M230-L254 HydrophobicContact CG-CD1 3.96Å; M230-L254 HydrophobicContact SD-CB 3.81Å; M230-L254 HydrophobicContact SD-CD1 4.19Å; M230-L254 HydrophobicContact SD-CD2 4.2Å; M230-L254 HydrophobicContact SD-CG 4.31Å; I231-L254 CarbonylContact O-C 3.39Å; I231-L254 WeakPolarHBondContact O-CA 3.22Å; I250-L254 WeakPolarHBondContact O-CD2 3.5Å; L254-I256 HydrophobicContact CD1-CB 4.42Å; L254-I256 HydrophobicContact CD1-CG2 4.24Å; L254-Y267 WeakPolarHBondContact CD2-OH 3.38Å; L254-F282 HydrophobicContact CD1-CE1 4.26Å; L254-F282 HydrophobicContact CD2-CD1 4.1Å; L254-F282 HydrophobicContact CD2-CE1 4.02Å
255	K	98.4	Very high	96.8	Very high	1 Å²	1	36.5 Å²	36.5	0%	0.004	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.4	-177.3	-177.1	173.3	76.4	-172.5	0	110.3	V204 I205 S219 Q221 D223 T226 I231 L233	V204-K255 WeakPolarHBondContact O-CA 3.08Å; I205-K255 HydrophobicContact CD1-CB 4.49Å; I205-K255 HydrophobicContact CD1-CD 3.81Å; I205-K255 HydrophobicContact CD1-CG 4.13Å; I205-K255 HydrophobicContact CG1-CB 3.86Å; I205-K255 HydrophobicContact CG1-CD 3.89Å; I205-K255 HydrophobicContact CG1-CG 3.61Å; S219-K255 PolarHBondContact O-NZ 3.45Å; Q221-K255 VanDerWaalsContact O-CD 3.25Å; Q221-K255 WeakPolarHBondContact O-CD 3.41Å; Q221-K255 WeakPolarHBondContact O-CE 3.08Å; Q221-K255 PolarHBondContact O-NZ 3.41Å; D223-K255 IonicContact OD2-NZ 2.7Å; D223-K255 PolarHBondContact OD2-NZ 2.82Å; T226-K255 HydrophobicContact CG2-CD 4.34Å; T226-K255 HydrophobicContact CG2-CG 3.74Å; T226-K255 WeakPolarHBondContact OG1-CE 3.18Å; I231-K255 HydrophobicContact CB-CB 4.44Å; I231-K255 PolarHBondContact N-O 3.03Å; I231-K255 PolarHBondContact O-N 2.82Å; L233-K255 HydrophobicContact CD1-CB 4.11Å; L233-K255 HydrophobicContact CG-CB 4.37Å
256	I	98.7	Very high	97	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	151.8	-175.6	-170.9	168.9	0	0	0	110.4	C203 V204 F206 M230 L254 H260 F261 F282 L286	C203-I256 WeakPolarHBondContact CA-O 3.38Å; V204-I256 HydrophobicContact CG1-CG2 3.57Å; V204-I256 PolarHBondContact N-O 3.34Å; V204-I256 PolarHBondContact O-N 3.22Å; F206-I256 HydrophobicContact CD2-CG2 4.43Å; F206-I256 HydrophobicContact CE2-CG2 3.97Å; M230-I256 HydrophobicContact CB-CB 4.3Å; M230-I256 HydrophobicContact CB-CD1 4.12Å; M230-I256 HydrophobicContact CB-CG1 4.13Å; M230-I256 HydrophobicContact CG-CB 3.95Å; M230-I256 HydrophobicContact CG-CD1 4.2Å; M230-I256 HydrophobicContact CG-CG1 4.26Å; L254-I256 HydrophobicContact CD1-CB 4.42Å; L254-I256 HydrophobicContact CD1-CG2 4.24Å; I256-H260 HydrophobicContact CD1-CB 3.79Å; I256-H260 HydrophobicContact CG1-CB 3.64Å; I256-F261 HydrophobicContact CD1-CB 4.46Å; I256-F261 HydrophobicContact CG2-CB 4.07Å; I256-F261 HydrophobicContact CG2-CD2 4.22Å; I256-F282 HydrophobicContact CD1-CZ 4.03Å; I256-L286 HydrophobicContact CD1-CD2 4.03Å
257	S	98.6	Very high	97.1	Very high	6 Å²	6	29.6 Å²	29.6	4%	0.042	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	148.9	172.8	71.5	0	0	0	0	111.4	D202 H259 H260 F261	D202-S257 CarbonylContact O-C 3.57Å; D202-S257 VanDerWaalsContact O-CA 3.27Å; D202-S257 WeakPolarHBondContact O-CA 3.3Å; S257-H259 PolarHBondContact O-N 3.43Å; S257-H260 PolarHBondContact O-N 3.14Å; S257-H260 WeakPolarHBondContact OG-CB 3.21Å; S257-H260 VanDerWaalsContact OG-CG 3.22Å; S257-H260 PolarHBondContact OG-N 3.36Å; S257-H260 VanDerWaalsContact OG-N 3.09Å; S257-H260 PolarHBondContact OG-ND1 3.2Å; S257-F261 PolarHBondContact O-N 3.03Å
258	T	98.5	Very high	97	Very high	17 Å²	17	20.9 Å²	20.9	10%	0.104	11%	0.11	C	C	.	.	H	α-helix	trans	-53.8	-41.8	173.9	-56.5	0	0	0	0	110.6	F192 L196 F201 D202 I262	F192-T258 HydrophobicContact CE2-CG2 3.97Å; F192-T258 HydrophobicContact CZ-CG2 3.68Å; L196-T258 HydrophobicContact CD2-CG2 4.15Å; F201-T258 WeakPolarHBondContact CD2-OG1 3.38Å; F201-T258 HydrophobicContact CE2-CG2 4.23Å; F201-T258 WeakPolarHBondContact CE2-OG1 3.27Å; F201-T258 PolarHBondContact O-OG1 3.31Å; D202-T258 PolarHBondContact O-N 2.97Å; D202-T258 PolarHBondContact O-OG1 3.17Å; T258-I262 HydrophobicContact CG2-CD1 4.14Å; T258-I262 WeakPolarHBondContact O-CD1 3.46Å; T258-I262 WeakPolarHBondContact O-CG1 3.19Å; T258-I262 PolarHBondContact O-N 2.96Å
259	H	98.3	Very high	96.9	Very high	128 Å²	128	19 Å²	19	59%	0.593	10%	0.098	S	C	*	.	H	α-helix	trans	-58.7	-55.6	176	176.3	-93.5	0	0	0	111.6	S257 F261 I262 T263	S257-H259 PolarHBondContact O-N 3.43Å; H259-F261 VanDerWaalsContact C-N 3.32Å; H259-F261 PolarHBondContact O-N 2.86Å; H259-I262 PolarHBondContact O-N 3.38Å; H259-I262 VanDerWaalsContact O-N 3.16Å; H259-T263 PolarHBondContact O-N 2.93Å; H259-T263 PolarHBondContact O-OG1 3.34Å
260	H	98.5	Very high	96.5	Very high	26 Å²	26	19.3 Å²	19.3	12%	0.12	10%	0.101	C	C	.	.	H	α-helix	trans	-62.9	-37.2	-178.3	-72.1	156.3	0	0	0	112.9	K227 H228 I256 S257 I262 T263 V264 I291	K227-H260 PolarHBondContact O-CE1 3.25Å; H228-H260 VanDerWaalsContact C-CE1 3.4Å; H228-H260 PolarHBondContact O-CE1 2.89Å; I256-H260 HydrophobicContact CD1-CB 3.79Å; I256-H260 HydrophobicContact CG1-CB 3.64Å; S257-H260 PolarHBondContact O-N 3.14Å; S257-H260 WeakPolarHBondContact OG-CB 3.21Å; S257-H260 VanDerWaalsContact OG-CG 3.22Å; S257-H260 PolarHBondContact OG-N 3.36Å; S257-H260 VanDerWaalsContact OG-N 3.09Å; S257-H260 PolarHBondContact OG-ND1 3.2Å; H260-I262 VanDerWaalsContact C-N 3.3Å; H260-I262 PolarHBondContact O-N 2.91Å; H260-T263 PolarHBondContact O-N 3.38Å; H260-V264 WeakPolarHBondContact O-CG1 2.91Å; H260-V264 WeakPolarHBondContact O-CG2 3.3Å; H260-V264 PolarHBondContact O-N 2.95Å; H260-I291 HydrophobicContact CB-CD1 3.8Å; H260-I291 HydrophobicContact CB-CG2 4.25Å
261	F	98.6	Very high	96.1	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-63.5	-37.2	177	-170.9	-105.5	0	0	0	112.7	N189 F192 V204 F206 I256 S257 H259 V264 G266 Y267 F282 L335	N189-F261 WeakPolarHBondContact OD1-CZ 3.31Å; F192-F261 HydrophobicContact CB-CD1 4.2Å; F192-F261 HydrophobicContact CB-CE1 3.65Å; F192-F261 HydrophobicContact CB-CZ 4.49Å; F192-F261 AromaticContact CD1-CD1 3.76Å; F192-F261 HydrophobicContact CD1-CD1 3.76Å; F192-F261 AromaticContact CD1-CE1 3.8Å; F192-F261 HydrophobicContact CD1-CE1 3.8Å; F192-F261 AromaticContact CD2-CD1 3.37Å; F192-F261 HydrophobicContact CD2-CD1 3.37Å; F192-F261 AromaticContact CD2-CE1 3.73Å; F192-F261 HydrophobicContact CD2-CE1 3.73Å; F192-F261 HydrophobicContact CD2-CG 4.23Å; F192-F261 AromaticContact CE1-CD1 3.86Å; F192-F261 HydrophobicContact CE1-CD1 3.86Å; F192-F261 HydrophobicContact CE1-CE1 4.34Å; F192-F261 HydrophobicContact CE2-CB 4.16Å; F192-F261 AromaticContact CE2-CD1 3.49Å; F192-F261 HydrophobicContact CE2-CD1 3.49Å; F192-F261 VanDerWaalsContact CE2-CD1 3.49Å; F192-F261 HydrophobicContact CE2-CE1 4.3Å; F192-F261 HydrophobicContact CE2-CG 4.16Å; F192-F261 AromaticContact CG-CD1 3.5Å; F192-F261 HydrophobicContact CG-CD1 3.5Å; F192-F261 VanDerWaalsContact CG-CD1 3.5Å; F192-F261 AromaticContact CG-CE1 3.44Å; F192-F261 HydrophobicContact CG-CE1 3.44Å; F192-F261 VanDerWaalsContact CG-CE1 3.44Å; F192-F261 HydrophobicContact CZ-CB 4.48Å; F192-F261 AromaticContact CZ-CD1 3.73Å; F192-F261 HydrophobicContact CZ-CD1 3.73Å; V204-F261 HydrophobicContact CG1-CB 4.34Å; V204-F261 HydrophobicContact CG1-CG 4.48Å; F206-F261 HydrophobicContact CD2-CE2 4.45Å; F206-F261 HydrophobicContact CE1-CE2 4.34Å; F206-F261 HydrophobicContact CE1-CZ 4.15Å; F206-F261 AromaticContact CE2-CD2 3.49Å; F206-F261 HydrophobicContact CE2-CD2 3.49Å; F206-F261 VanDerWaalsContact CE2-CD2 3.49Å; F206-F261 AromaticContact CE2-CE2 3.36Å; F206-F261 HydrophobicContact CE2-CE2 3.36Å; F206-F261 HydrophobicContact CE2-CG 4.17Å; F206-F261 AromaticContact CE2-CZ 3.95Å; F206-F261 HydrophobicContact CE2-CZ 3.95Å; F206-F261 HydrophobicContact CZ-CD1 4.2Å; F206-F261 AromaticContact CZ-CD2 3.71Å; F206-F261 HydrophobicContact CZ-CD2 3.71Å; F206-F261 AromaticContact CZ-CE1 3.83Å; F206-F261 HydrophobicContact CZ-CE1 3.83Å; F206-F261 AromaticContact CZ-CE2 3.29Å; F206-F261 HydrophobicContact CZ-CE2 3.29Å; F206-F261 HydrophobicContact CZ-CG 4.14Å; F206-F261 AromaticContact CZ-CZ 3.34Å; F206-F261 HydrophobicContact CZ-CZ 3.34Å; I256-F261 HydrophobicContact CD1-CB 4.46Å; I256-F261 HydrophobicContact CG2-CB 4.07Å; I256-F261 HydrophobicContact CG2-CD2 4.22Å; S257-F261 PolarHBondContact O-N 3.03Å; H259-F261 VanDerWaalsContact C-N 3.32Å; H259-F261 PolarHBondContact O-N 2.86Å; F261-V264 HydrophobicContact CD2-CG2 4.48Å; F261-V264 VanDerWaalsContact O-CG2 3.31Å; F261-V264 WeakPolarHBondContact O-CG2 3.44Å; F261-G266 VanDerWaalsContact CE2-CA 3.49Å; F261-G266 PolarHBondContact O-N 2.96Å; F261-Y267 AromaticContact CE2-CD2 3.6Å; F261-Y267 HydrophobicContact CE2-CD2 3.6Å; F261-Y267 AromaticContact CE2-CE2 3.62Å; F261-Y267 HydrophobicContact CE2-CE2 3.62Å; F261-Y267 AromaticContact CZ-CD2 3.89Å; F261-Y267 HydrophobicContact CZ-CD2 3.89Å; F261-Y267 HydrophobicContact CZ-CE2 4.23Å; F261-F282 HydrophobicContact CD2-CE2 4.04Å; F261-F282 AromaticContact CD2-CZ 3.97Å; F261-F282 HydrophobicContact CD2-CZ 3.97Å; F261-F282 AromaticContact CE2-CE2 3.9Å; F261-F282 HydrophobicContact CE2-CE2 3.9Å; F261-F282 HydrophobicContact CE2-CZ 4.14Å; F261-L335 HydrophobicContact CD1-CD2 4.18Å; F261-L335 HydrophobicContact CE1-CD1 4.04Å; F261-L335 HydrophobicContact CE1-CD2 4.08Å
262	I	98.2	Very high	95.8	Very high	91 Å²	91	21 Å²	21	47%	0.467	11%	0.108	S	C	.	.	H	α-helix	trans	-68	-44.6	172.5	-66.3	165.4	0	0	0	110.1	F192 T258 H259 H260 V264 N265 L335	F192-I262 HydrophobicContact CE1-CD1 4.27Å; F192-I262 HydrophobicContact CE1-CG1 3.8Å; F192-I262 HydrophobicContact CZ-CD1 4.04Å; F192-I262 HydrophobicContact CZ-CG1 3.72Å; T258-I262 HydrophobicContact CG2-CD1 4.14Å; T258-I262 WeakPolarHBondContact O-CD1 3.46Å; T258-I262 WeakPolarHBondContact O-CG1 3.19Å; T258-I262 PolarHBondContact O-N 2.96Å; H259-I262 PolarHBondContact O-N 3.38Å; H259-I262 VanDerWaalsContact O-N 3.16Å; H260-I262 VanDerWaalsContact C-N 3.3Å; H260-I262 PolarHBondContact O-N 2.91Å; I262-V264 VanDerWaalsContact C-N 3.33Å; I262-V264 PolarHBondContact O-N 3.45Å; I262-N265 WeakPolarHBondContact O-CA 3.47Å; I262-N265 PolarHBondContact O-N 3.31Å; I262-L335 HydrophobicContact CG1-CD2 4.38Å
263	T	97.1	Very high	95.1	Very high	64 Å²	64	22 Å²	22	39%	0.393	12%	0.118	S	C	.	.	H	α-helix	trans	-58.7	-40.1	-179.8	-51.8	0	0	0	0	112.8	H259 H260 N265 T289 I291	H259-T263 PolarHBondContact O-N 2.93Å; H259-T263 PolarHBondContact O-OG1 3.34Å; H260-T263 PolarHBondContact O-N 3.38Å; T263-N265 PolarHBondContact O-N 3.1Å; T263-T289 HydrophobicContact CG2-CG2 4.42Å; T263-I291 HydrophobicContact CG2-CD1 3.89Å
264	V	96.2	Very high	93.9	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.006	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	0.1	176.7	-57.8	0	0	0	0	114.2	H260 F261 I262 G266 F282 R285 L286 T289 I291	H260-V264 WeakPolarHBondContact O-CG1 2.91Å; H260-V264 WeakPolarHBondContact O-CG2 3.3Å; H260-V264 PolarHBondContact O-N 2.95Å; F261-V264 HydrophobicContact CD2-CG2 4.48Å; F261-V264 VanDerWaalsContact O-CG2 3.31Å; F261-V264 WeakPolarHBondContact O-CG2 3.44Å; I262-V264 VanDerWaalsContact C-N 3.33Å; I262-V264 PolarHBondContact O-N 3.45Å; V264-G266 VanDerWaalsContact C-N 3.27Å; V264-G266 PolarHBondContact O-N 3.35Å; V264-F282 HydrophobicContact CG2-CD2 4.47Å; V264-F282 HydrophobicContact CG2-CE2 3.53Å; V264-F282 HydrophobicContact CG2-CZ 4.01Å; V264-R285 HydrophobicContact CB-CB 4.18Å; V264-R285 PolarHBondContact O-NH1 3.23Å; V264-L286 HydrophobicContact CG1-CD2 3.84Å; V264-L286 HydrophobicContact CG1-CG 4.34Å; V264-T289 HydrophobicContact CG1-CG2 4.31Å; V264-T289 WeakPolarHBondContact CG1-OG1 3.34Å; V264-I291 HydrophobicContact CG1-CD1 3.59Å
265	N	97	Very high	92.6	Very high	22 Å²	22	24.9 Å²	24.9	12%	0.118	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	42.8	-170.8	-166.6	22.5	0	0	0	112.6	I262 T263 R285 N331 G334 L335 D336	I262-N265 WeakPolarHBondContact O-CA 3.47Å; I262-N265 PolarHBondContact O-N 3.31Å; T263-N265 PolarHBondContact O-N 3.1Å; N265-R285 PolarHBondContact O-NH1 3.5Å; N265-N331 PolarHBondContact ND2-O 3.05Å; N265-G334 CarbonylContact O-C 3.53Å; N265-G334 WeakPolarHBondContact O-CA 3.24Å; N265-L335 PolarHBondContact O-N 3.21Å; N265-L335 WeakPolarHBondContact OD1-CB 3.31Å; N265-L335 PolarHBondContact OD1-N 3.04Å; N265-D336 PolarHBondContact ND2-OD1 3.03Å; N265-D336 PolarHBondContact ND2-OD2 3.44Å; N265-D336 PolarHBondContact OD1-N 3.24Å; N265-D336 PolarHBondContact OD1-OD1 3.12Å
266	G	97.2	Very high	91.4	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	S	Bend	trans	56.3	-154.1	178.6	0	0	0	0	0	116	F261 V264 F282 R285	F261-G266 VanDerWaalsContact CE2-CA 3.49Å; F261-G266 PolarHBondContact O-N 2.96Å; V264-G266 VanDerWaalsContact C-N 3.27Å; V264-G266 PolarHBondContact O-N 3.35Å; G266-F282 WeakPolarHBondContact O-CD2 3.31Å; G266-R285 VanDerWaalsContact O-CD 3.24Å; G266-R285 WeakPolarHBondContact O-CD 3.36Å
267	Y	95.6	Very high	90.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	-85	161.8	174.8	-71	-94	0	0	0	111.2	G185 K188 N189 F206 L254 F261 N278 F282 G334	G185-Y267 VanDerWaalsContact CA-CB 3.48Å; K188-Y267 HydrophobicContact CB-CD2 3.66Å; K188-Y267 HydrophobicContact CB-CE2 3.85Å; K188-Y267 HydrophobicContact CB-CG 4.42Å; K188-Y267 HydrophobicContact CD-CD1 4.2Å; K188-Y267 HydrophobicContact CD-CD2 3.74Å; K188-Y267 HydrophobicContact CD-CE1 3.8Å; K188-Y267 HydrophobicContact CD-CE2 3.32Å; K188-Y267 HydrophobicContact CD-CG 4.17Å; K188-Y267 HydrophobicContact CG-CD2 4.33Å; K188-Y267 HydrophobicContact CG-CE2 4.16Å; K188-Y267 PolarHBondContact NZ-OH 3.41Å; N189-Y267 PolarHBondContact ND2-O 3.38Å; N189-Y267 PolarHBondContact OD1-N 3.24Å; F206-Y267 HydrophobicContact CD1-CE2 4.25Å; F206-Y267 AromaticContact CD2-CE2 3.78Å; F206-Y267 HydrophobicContact CD2-CE2 3.78Å; F206-Y267 HydrophobicContact CE1-CE2 4.32Å; F206-Y267 AromaticContact CE2-CE2 3.87Å; F206-Y267 HydrophobicContact CE2-CE2 3.87Å; F206-Y267 AromaticContact CG-CE2 3.97Å; F206-Y267 HydrophobicContact CG-CE2 3.97Å; F206-Y267 HydrophobicContact CZ-CE2 4.14Å; L254-Y267 WeakPolarHBondContact CD2-OH 3.38Å; F261-Y267 AromaticContact CE2-CD2 3.6Å; F261-Y267 HydrophobicContact CE2-CD2 3.6Å; F261-Y267 AromaticContact CE2-CE2 3.62Å; F261-Y267 HydrophobicContact CE2-CE2 3.62Å; F261-Y267 AromaticContact CZ-CD2 3.89Å; F261-Y267 HydrophobicContact CZ-CD2 3.89Å; F261-Y267 HydrophobicContact CZ-CE2 4.23Å; Y267-N278 VanDerWaalsContact CD1-OD1 3.23Å; Y267-N278 WeakPolarHBondContact CD1-OD1 3.21Å; Y267-F282 HydrophobicContact CD1-CB 3.71Å; Y267-F282 AromaticContact CD1-CD2 3.78Å; Y267-F282 HydrophobicContact CD1-CD2 3.78Å; Y267-F282 AromaticContact CD1-CG 3.77Å; Y267-F282 HydrophobicContact CD1-CG 3.77Å; Y267-F282 HydrophobicContact CD2-CD2 4.21Å; Y267-F282 HydrophobicContact CD2-CE2 4.25Å; Y267-F282 HydrophobicContact CE1-CB 3.64Å; Y267-F282 AromaticContact CE1-CD1 3.85Å; Y267-F282 HydrophobicContact CE1-CD1 3.85Å; Y267-F282 AromaticContact CE1-CD2 3.87Å; Y267-F282 HydrophobicContact CE1-CD2 3.87Å; Y267-F282 HydrophobicContact CE1-CE1 4.49Å; Y267-F282 HydrophobicContact CE1-CE2 4.49Å; Y267-F282 AromaticContact CE1-CG 3.51Å; Y267-F282 HydrophobicContact CE1-CG 3.51Å; Y267-F282 HydrophobicContact CE2-CD2 4.26Å; Y267-F282 HydrophobicContact CE2-CE2 4.13Å; Y267-F282 HydrophobicContact CE2-CZ 4.32Å; Y267-F282 AromaticContact CG-CD2 3.97Å; Y267-F282 HydrophobicContact CG-CD2 3.97Å; Y267-F282 HydrophobicContact CG-CE2 4.45Å; Y267-F282 HydrophobicContact CG-CG 4.42Å; Y267-F282 AromaticContact CZ-CD1 3.93Å; Y267-F282 AromaticContact CZ-CG 3.92Å; Y267-G334 WeakPolarHBondContact O-CA 3.44Å
268	S	92.6	Very high	89.4	Confident	3 Å²	3	30.7 Å²	30.7	2%	0.021	16%	0.162	C	C	.	.			trans	-70.4	140.6	169.2	169.3	0	0	0	0	111.8	D270 Y271 N281 H333	S268-D270 VanDerWaalsContact C-N 3.29Å; S268-D270 PolarHBondContact O-N 3.46Å; S268-D270 PolarHBondContact OG-N 3.02Å; S268-D270 VanDerWaalsContact OG-N 3.15Å; S268-Y271 WeakPolarHBondContact OG-CD2 3.47Å; S268-Y271 WeakPolarHBondContact OG-CE2 3.49Å; S268-N281 WeakPolarHBondContact CB-OD1 3.42Å; S268-H333 WeakPolarHBondContact CA-O 3.46Å
269	N	92.3	Very high	88.8	Confident	11 Å²	11	30 Å²	30	6%	0.059	16%	0.158	C	C	.	.	S	Bend	trans	-84.2	4.4	175.3	-62.1	-41	0	0	0	113.9	N183 K186 N189 H333 G334 V338	N183-N269 PolarHBondContact ND2-O 3.24Å; K186-N269 HydrophobicContact CD-CB 4.23Å; K186-N269 HydrophobicContact CG-CB 4.4Å; N189-N269 PolarHBondContact ND2-OD1 2.98Å; N269-H333 PolarHBondContact N-O 3.11Å; N269-H333 PolarHBondContact ND2-O 2.87Å; N269-G334 PolarHBondContact ND2-O 2.82Å; N269-V338 WeakPolarHBondContact ND2-CA 3.1Å; N269-V338 WeakPolarHBondContact OD1-CG2 3.32Å
270	D	88.1	Confident	88.3	Confident	30 Å²	30	26.2 Å²	26.2	16%	0.16	14%	0.142	C	C	.	.			trans	-105.1	-9.8	-165.7	-59.4	-39.8	0	0	0	115	S268 W272 L322 R325 H333	S268-D270 VanDerWaalsContact C-N 3.29Å; S268-D270 PolarHBondContact O-N 3.46Å; S268-D270 PolarHBondContact OG-N 3.02Å; S268-D270 VanDerWaalsContact OG-N 3.15Å; D270-W272 VanDerWaalsContact O-CD1 3.26Å; D270-W272 PolarHBondContact O-N 3.12Å; D270-L322 HydrophobicContact CB-CD2 4.1Å; D270-R325 IonicContact OD2-CZ 3.72Å; D270-R325 IonicContact OD2-NH1 2.67Å; D270-R325 PolarHBondContact OD2-NH1 3Å; D270-R325 IonicContact OD2-NH2 3.95Å; D270-H333 VanDerWaalsContact OD2-CB 3.32Å; D270-H333 WeakPolarHBondContact OD2-CB 3.28Å; D270-H333 IonicContact OD2-CD2 3.89Å; D270-H333 IonicContact OD2-CG 3.54Å
271	Y	86.9	Confident	87.9	Confident	9 Å²	9	25.3 Å²	25.3	4%	0.035	14%	0.138	C	C	.	.			trans	-92.3	91.9	-174.9	-64.4	-83.7	0	0	0	111.4	N183 S268 L274 E277 N281 L322	N183-Y271 PolarHBondContact OD1-O 2.94Å; S268-Y271 WeakPolarHBondContact OG-CD2 3.47Å; S268-Y271 WeakPolarHBondContact OG-CE2 3.49Å; Y271-L274 HydrophobicContact CD1-CB 4.47Å; Y271-L274 HydrophobicContact CD1-CD1 4.2Å; Y271-E277 HydrophobicContact CD1-CB 3.7Å; Y271-E277 HydrophobicContact CE1-CB 3.76Å; Y271-N281 HydrophobicContact CD2-CB 4.43Å; Y271-N281 HydrophobicContact CE2-CB 3.53Å; Y271-N281 PolarHBondContact OH-ND2 3.24Å; Y271-L322 HydrophobicContact CD1-CD1 4.09Å; Y271-L322 HydrophobicContact CE1-CB 4.06Å; Y271-L322 HydrophobicContact CE1-CD1 4.18Å
272	W	87.1	Confident	87.7	Confident	29 Å²	29	25.3 Å²	25.3	11%	0.11	14%	0.138	C	C	.	.	S	Bend	trans	-91.9	121	177.2	-62.8	85.4	0	0	0	110.8	E180 A181 N183 K186 D270 L274 I358 Q360	E180-W272 HydrophobicContact CB-CE3 3.95Å; E180-W272 HydrophobicContact CB-CZ3 3.71Å; E180-W272 HydrophobicContact CG-CZ3 4.38Å; A181-W272 HydrophobicContact CB-CB 4.32Å; A181-W272 WeakPolarHBondContact O-CZ3 3.12Å; N183-W272 HydrophobicContact CB-CD2 3.96Å; N183-W272 HydrophobicContact CB-CE3 3.8Å; N183-W272 HydrophobicContact CB-CH2 4.02Å; N183-W272 HydrophobicContact CB-CZ2 4.27Å; N183-W272 HydrophobicContact CB-CZ3 3.82Å; N183-W272 WeakPolarHBondContact ND2-CZ2 2.89Å; N183-W272 PolarHBondContact ND2-NE1 2.79Å; K186-W272 HydrophobicContact CD-CH2 4.35Å; K186-W272 HydrophobicContact CD-CZ2 4.19Å; D270-W272 VanDerWaalsContact O-CD1 3.26Å; D270-W272 PolarHBondContact O-N 3.12Å; W272-L274 PolarHBondContact O-N 3.37Å; W272-I358 HydrophobicContact CH2-CD1 4.34Å; W272-I358 HydrophobicContact CH2-CG1 4.41Å; W272-I358 WeakPolarHBondContact CH2-O 3.45Å; W272-Q360 HydrophobicContact CH2-CB 4.45Å; W272-Q360 HydrophobicContact CZ2-CB 3.96Å; W272-Q360 HydrophobicContact CZ2-CG 4.38Å
273	G	82	Confident	87.6	Confident	23 Å²	23	21.4 Å²	21.4	24%	0.237	12%	0.118	C	C	.	.	S	Bend	trans	69.7	12.3	179.7	0	0	0	0	0	115.1	M182	M182-G273 PolarHBondContact O-N 2.81Å
274	L	73.4	Confident	87.4	Confident	17 Å²	17	22.3 Å²	22.3	9%	0.089	12%	0.117	C	C	.	.			trans	-124	89	-172.8	-67.4	176.4	0	0	0	110.2	Y271 W272 E277 N278 L319 L322	Y271-L274 HydrophobicContact CD1-CB 4.47Å; Y271-L274 HydrophobicContact CD1-CD1 4.2Å; W272-L274 PolarHBondContact O-N 3.37Å; L274-E277 HydrophobicContact CB-CB 4.33Å; L274-E277 WeakPolarHBondContact CB-OE2 3.34Å; L274-N278 PolarHBondContact O-N 2.94Å; L274-L319 HydrophobicContact CD1-CD1 3.58Å; L274-L319 HydrophobicContact CD2-CD1 4.11Å; L274-L319 HydrophobicContact CG-CD1 4.45Å; L274-L322 HydrophobicContact CD1-CD1 4.43Å
275	D	72	Confident	87.3	Confident	44 Å²	44	22.3 Å²	22.3	24%	0.235	12%	0.117	C	C	.	.	H	α-helix	trans	-70.1	-54.4	-174.3	-72.5	-10.5	0	0	0	112.2	K184 E277 N278 D279	K184-D275 HydrophobicContact CD-CB 4.42Å; K184-D275 WeakPolarHBondContact CD-OD1 3.41Å; K184-D275 WeakPolarHBondContact CE-OD1 3.46Å; K184-D275 WeakPolarHBondContact CE-OD2 3.44Å; K184-D275 IonicContact NZ-OD1 3.61Å; K184-D275 IonicContact NZ-OD2 2.73Å; K184-D275 PolarHBondContact NZ-OD2 3.3Å; D275-E277 VanDerWaalsContact C-N 3.33Å; D275-E277 PolarHBondContact O-N 2.81Å; D275-N278 VanDerWaalsContact O-CB 3.29Å; D275-N278 WeakPolarHBondContact O-CB 3.46Å; D275-N278 PolarHBondContact O-N 3.37Å; D275-D279 PolarHBondContact O-N 3.37Å
276	N	73	Confident	87.3	Confident	89 Å²	89	21.3 Å²	21.3	48%	0.476	11%	0.111	S	C	.	.	H	α-helix	trans	-61.3	-40.8	-175.1	-68.7	-24.5	0	0	0	112.2	N278 D279 D280	N276-N278 VanDerWaalsContact C-N 3.28Å; N276-N278 PolarHBondContact O-N 3.19Å; N276-D279 PolarHBondContact O-N 3.34Å; N276-D280 PolarHBondContact O-N 3.44Å
277	E	74.6	Confident	87.2	Confident	39 Å²	39	27 Å²	27	18%	0.182	14%	0.136	C	C	.	.	H	α-helix	trans	-71.1	-25.6	-177.6	-64.3	89.8	162.2	0	0	112.9	Y271 L274 D275 N281 L319 L323	Y271-E277 HydrophobicContact CD1-CB 3.7Å; Y271-E277 HydrophobicContact CE1-CB 3.76Å; L274-E277 HydrophobicContact CB-CB 4.33Å; L274-E277 WeakPolarHBondContact CB-OE2 3.34Å; D275-E277 VanDerWaalsContact C-N 3.33Å; D275-E277 PolarHBondContact O-N 2.81Å; E277-N281 WeakPolarHBondContact O-CB 3.47Å; E277-N281 PolarHBondContact O-N 3.49Å; E277-L319 HydrophobicContact CG-CD1 3.7Å; E277-L319 WeakPolarHBondContact OE1-CD1 3.36Å; E277-L323 HydrophobicContact CG-CD2 4.48Å
278	N	79.3	Confident	87.1	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-63.7	-45.8	171.6	-154.5	-49.1	0	0	0	110.6	G185 Y267 L274 D275 N276 N281 F282	G185-N278 WeakPolarHBondContact CA-ND2 3.36Å; G185-N278 WeakPolarHBondContact CA-OD1 3.39Å; G185-N278 PolarHBondContact N-ND2 2.99Å; Y267-N278 VanDerWaalsContact CD1-OD1 3.23Å; Y267-N278 WeakPolarHBondContact CD1-OD1 3.21Å; L274-N278 PolarHBondContact O-N 2.94Å; D275-N278 VanDerWaalsContact O-CB 3.29Å; D275-N278 WeakPolarHBondContact O-CB 3.46Å; D275-N278 PolarHBondContact O-N 3.37Å; N276-N278 VanDerWaalsContact C-N 3.28Å; N276-N278 PolarHBondContact O-N 3.19Å; N278-N281 PolarHBondContact O-N 3.28Å; N278-F282 PolarHBondContact O-N 2.92Å; N278-F282 VanDerWaalsContact O-N 3.07Å
279	D	87.1	Confident	87.2	Confident	4 Å²	4	32.5 Å²	32.5	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-74.5	-36.4	-178.4	-62.1	-34.9	0	0	0	111.6	K188 G251 D275 N276 N281 F282 E283	K188-D279 IonicContact NZ-OD1 2.99Å; K188-D279 PolarHBondContact NZ-OD1 3.21Å; G251-D279 VanDerWaalsContact CA-CG 3.42Å; G251-D279 WeakPolarHBondContact CA-OD2 3.5Å; D275-D279 PolarHBondContact O-N 3.37Å; N276-D279 PolarHBondContact O-N 3.34Å; D279-N281 VanDerWaalsContact C-N 3.34Å; D279-N281 PolarHBondContact O-N 2.98Å; D279-F282 WeakPolarHBondContact O-CB 3.39Å; D279-F282 PolarHBondContact O-N 3.48Å; D279-E283 PolarHBondContact O-N 3.39Å
280	D	87.2	Confident	87.4	Confident	47 Å²	47	34.8 Å²	34.8	25%	0.251	19%	0.192	S	C	.	.	H	α-helix	trans	-64.1	-36.5	171.4	-75.5	-17.5	0	0	0	112.3	Y246 N276 E283 K284	Y246-D280 PolarHBondContact OH-OD1 3.09Å; Y246-D280 PolarHBondContact OH-OD2 3.19Å; N276-D280 PolarHBondContact O-N 3.44Å; D280-E283 WeakPolarHBondContact O-CB 3.42Å; D280-E283 PolarHBondContact O-N 2.89Å; D280-K284 PolarHBondContact O-N 3.27Å
281	N	91.1	Very high	87.9	Confident	7 Å²	7	34 Å²	34	4%	0.037	19%	0.188	C	C	.	.	H	α-helix	trans	-64.8	-42.6	172.6	-177.8	-94.2	0	0	0	111.4	S268 Y271 E277 N278 D279 E283 K284 R285	S268-N281 WeakPolarHBondContact CB-OD1 3.42Å; Y271-N281 HydrophobicContact CD2-CB 4.43Å; Y271-N281 HydrophobicContact CE2-CB 3.53Å; Y271-N281 PolarHBondContact OH-ND2 3.24Å; E277-N281 WeakPolarHBondContact O-CB 3.47Å; E277-N281 PolarHBondContact O-N 3.49Å; N278-N281 PolarHBondContact O-N 3.28Å; D279-N281 VanDerWaalsContact C-N 3.34Å; D279-N281 PolarHBondContact O-N 2.98Å; N281-E283 VanDerWaalsContact C-N 3.25Å; N281-E283 PolarHBondContact O-N 3.35Å; N281-K284 WeakPolarHBondContact O-CB 3.35Å; N281-K284 PolarHBondContact O-N 2.72Å; N281-R285 WeakPolarHBondContact O-CG 2.96Å; N281-R285 PolarHBondContact O-N 3Å; N281-R285 PolarHBondContact OD1-NE 3.32Å
282	F	94.6	Very high	88.4	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.3	-35.9	177.2	-168.5	-113.2	0	0	0	111.9	I250 L254 I256 F261 V264 G266 Y267 N278 D279 K284 R285 L286	I250-F282 HydrophobicContact CD1-CB 4.48Å; I250-F282 HydrophobicContact CD1-CD1 3.86Å; L254-F282 HydrophobicContact CD1-CE1 4.26Å; L254-F282 HydrophobicContact CD2-CD1 4.1Å; L254-F282 HydrophobicContact CD2-CE1 4.02Å; I256-F282 HydrophobicContact CD1-CZ 4.03Å; F261-F282 HydrophobicContact CD2-CE2 4.04Å; F261-F282 AromaticContact CD2-CZ 3.97Å; F261-F282 HydrophobicContact CD2-CZ 3.97Å; F261-F282 AromaticContact CE2-CE2 3.9Å; F261-F282 HydrophobicContact CE2-CE2 3.9Å; F261-F282 HydrophobicContact CE2-CZ 4.14Å; V264-F282 HydrophobicContact CG2-CD2 4.47Å; V264-F282 HydrophobicContact CG2-CE2 3.53Å; V264-F282 HydrophobicContact CG2-CZ 4.01Å; G266-F282 WeakPolarHBondContact O-CD2 3.31Å; Y267-F282 HydrophobicContact CD1-CB 3.71Å; Y267-F282 AromaticContact CD1-CD2 3.78Å; Y267-F282 HydrophobicContact CD1-CD2 3.78Å; Y267-F282 AromaticContact CD1-CG 3.77Å; Y267-F282 HydrophobicContact CD1-CG 3.77Å; Y267-F282 HydrophobicContact CD2-CD2 4.21Å; Y267-F282 HydrophobicContact CD2-CE2 4.25Å; Y267-F282 HydrophobicContact CE1-CB 3.64Å; Y267-F282 AromaticContact CE1-CD1 3.85Å; Y267-F282 HydrophobicContact CE1-CD1 3.85Å; Y267-F282 AromaticContact CE1-CD2 3.87Å; Y267-F282 HydrophobicContact CE1-CD2 3.87Å; Y267-F282 HydrophobicContact CE1-CE1 4.49Å; Y267-F282 HydrophobicContact CE1-CE2 4.49Å; Y267-F282 AromaticContact CE1-CG 3.51Å; Y267-F282 HydrophobicContact CE1-CG 3.51Å; Y267-F282 HydrophobicContact CE2-CD2 4.26Å; Y267-F282 HydrophobicContact CE2-CE2 4.13Å; Y267-F282 HydrophobicContact CE2-CZ 4.32Å; Y267-F282 AromaticContact CG-CD2 3.97Å; Y267-F282 HydrophobicContact CG-CD2 3.97Å; Y267-F282 HydrophobicContact CG-CE2 4.45Å; Y267-F282 HydrophobicContact CG-CG 4.42Å; Y267-F282 AromaticContact CZ-CD1 3.93Å; Y267-F282 AromaticContact CZ-CG 3.92Å; N278-F282 PolarHBondContact O-N 2.92Å; N278-F282 VanDerWaalsContact O-N 3.07Å; D279-F282 WeakPolarHBondContact O-CB 3.39Å; D279-F282 PolarHBondContact O-N 3.48Å; F282-K284 PolarHBondContact O-N 2.95Å; F282-R285 WeakPolarHBondContact O-CB 3.41Å; F282-R285 PolarHBondContact O-N 3.5Å; F282-L286 HydrophobicContact CD1-CD1 4Å; F282-L286 HydrophobicContact CE1-CD1 3.91Å; F282-L286 HydrophobicContact CE1-CG 4.32Å; F282-L286 WeakPolarHBondContact O-CG 3.39Å; F282-L286 PolarHBondContact O-N 3.45Å
283	E	95	Very high	89	Confident	10 Å²	10	42 Å²	42	5%	0.047	22%	0.223	C	C	.	.	H	α-helix	trans	-60.9	-43.7	174	-162.2	-85	167.3	0	0	112.2	I250 D279 D280 N281 L286 K287 Y293	I250-E283 HydrophobicContact CD1-CB 3.58Å; I250-E283 HydrophobicContact CD1-CG 4.02Å; I250-E283 HydrophobicContact CG1-CB 3.96Å; I250-E283 HydrophobicContact CG1-CG 4.27Å; D279-E283 PolarHBondContact O-N 3.39Å; D280-E283 WeakPolarHBondContact O-CB 3.42Å; D280-E283 PolarHBondContact O-N 2.89Å; N281-E283 VanDerWaalsContact C-N 3.25Å; N281-E283 PolarHBondContact O-N 3.35Å; E283-L286 WeakPolarHBondContact O-CB 3.48Å; E283-L286 PolarHBondContact O-N 3.18Å; E283-K287 PolarHBondContact O-N 3.43Å; E283-K287 VanDerWaalsContact O-N 3.11Å; E283-K287 WeakPolarHBondContact OE1-CE 3.29Å; E283-K287 IonicContact OE1-NZ 2.67Å; E283-K287 PolarHBondContact OE1-NZ 2.79Å; E283-K287 WeakPolarHBondContact OE2-CE 3.23Å; E283-K287 IonicContact OE2-NZ 2.83Å; E283-K287 PolarHBondContact OE2-NZ 2.97Å; E283-Y293 HydrophobicContact CG-CE1 3.71Å; E283-Y293 WeakPolarHBondContact OE1-CE1 3.44Å; E283-Y293 VanDerWaalsContact OE1-CZ 3.26Å; E283-Y293 PolarHBondContact OE1-OH 3.16Å
284	K	93.1	Very high	89.7	Confident	83 Å²	83	44 Å²	44	36%	0.361	23%	0.228	S	C	.	.	H	α-helix	trans	-62.4	-42.6	174.7	-67.3	178	-177.6	-176.9	0	111.6	D280 N281 F282 L286 K287 L288 I330	D280-K284 PolarHBondContact O-N 3.27Å; N281-K284 WeakPolarHBondContact O-CB 3.35Å; N281-K284 PolarHBondContact O-N 2.72Å; F282-K284 PolarHBondContact O-N 2.95Å; K284-L286 VanDerWaalsContact C-N 3.33Å; K284-L286 PolarHBondContact O-N 3.01Å; K284-K287 WeakPolarHBondContact O-CB 3.49Å; K284-K287 PolarHBondContact O-N 3.01Å; K284-K287 VanDerWaalsContact O-N 3.16Å; K284-L288 VanDerWaalsContact O-CG 3.31Å; K284-L288 WeakPolarHBondContact O-CG 3.25Å; K284-L288 PolarHBondContact O-N 3.49Å; K284-I330 HydrophobicContact CB-CD1 4.46Å; K284-I330 HydrophobicContact CD-CD1 4.15Å
285	R	94.7	Very high	90.9	Very high	1 Å²	1	45.8 Å²	45.8	0%	0.004	24%	0.236	C	C	.	.	H	α-helix	trans	-61.1	-40.4	177.1	-68.7	171.2	174.7	-102.8	6.8	112.6	V264 N265 G266 N281 F282 L288 T289 I330	V264-R285 HydrophobicContact CB-CB 4.18Å; V264-R285 PolarHBondContact O-NH1 3.23Å; N265-R285 PolarHBondContact O-NH1 3.5Å; G266-R285 VanDerWaalsContact O-CD 3.24Å; G266-R285 WeakPolarHBondContact O-CD 3.36Å; N281-R285 WeakPolarHBondContact O-CG 2.96Å; N281-R285 PolarHBondContact O-N 3Å; N281-R285 PolarHBondContact OD1-NE 3.32Å; F282-R285 WeakPolarHBondContact O-CB 3.41Å; F282-R285 PolarHBondContact O-N 3.5Å; R285-L288 PolarHBondContact O-N 2.97Å; R285-T289 WeakPolarHBondContact O-CG2 3.16Å; R285-T289 PolarHBondContact O-N 3.21Å; R285-T289 VanDerWaalsContact O-N 3.16Å; R285-T289 PolarHBondContact O-OG1 3.32Å; R285-I330 HydrophobicContact CG-CG2 3.52Å; R285-I330 PolarHBondContact NH1-O 3.45Å; R285-I330 PolarHBondContact NH2-O 3.12Å
286	L	96.5	Very high	92.1	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.9	-46.3	173.4	-72.5	164.3	0	0	0	111.1	M230 I250 I256 V264 F282 E283 K284 T289 G290 I291 Y293	M230-L286 HydrophobicContact CB-CD1 4.43Å; M230-L286 HydrophobicContact CB-CD2 4.22Å; M230-L286 HydrophobicContact CE-CD1 3.52Å; M230-L286 HydrophobicContact CG-CD1 4.49Å; I250-L286 HydrophobicContact CD1-CD1 3.85Å; I256-L286 HydrophobicContact CD1-CD2 4.03Å; V264-L286 HydrophobicContact CG1-CD2 3.84Å; V264-L286 HydrophobicContact CG1-CG 4.34Å; F282-L286 HydrophobicContact CD1-CD1 4Å; F282-L286 HydrophobicContact CE1-CD1 3.91Å; F282-L286 HydrophobicContact CE1-CG 4.32Å; F282-L286 WeakPolarHBondContact O-CG 3.39Å; F282-L286 PolarHBondContact O-N 3.45Å; E283-L286 WeakPolarHBondContact O-CB 3.48Å; E283-L286 PolarHBondContact O-N 3.18Å; K284-L286 VanDerWaalsContact C-N 3.33Å; K284-L286 PolarHBondContact O-N 3.01Å; L286-T289 PolarHBondContact O-N 3.34Å; L286-T289 PolarHBondContact O-OG1 2.65Å; L286-G290 PolarHBondContact O-N 3.03Å; L286-I291 CarbonylContact C-O 3.55Å; L286-I291 HydrophobicContact CD2-CB 3.94Å; L286-I291 HydrophobicContact CD2-CG2 3.56Å; L286-I291 PolarHBondContact O-N 3.21Å; L286-Y293 HydrophobicContact CD1-CD1 4.19Å
287	K	95.3	Very high	93.3	Very high	120 Å²	120	44.9 Å²	44.9	52%	0.522	23%	0.232	S	C	.	.	H	α-helix	trans	-62.5	-46.6	176.6	-77.1	174.7	169.1	150.4	0	113.1	E283 K284 T289 G290	E283-K287 PolarHBondContact O-N 3.43Å; E283-K287 VanDerWaalsContact O-N 3.11Å; E283-K287 WeakPolarHBondContact OE1-CE 3.29Å; E283-K287 IonicContact OE1-NZ 2.67Å; E283-K287 PolarHBondContact OE1-NZ 2.79Å; E283-K287 WeakPolarHBondContact OE2-CE 3.23Å; E283-K287 IonicContact OE2-NZ 2.83Å; E283-K287 PolarHBondContact OE2-NZ 2.97Å; K284-K287 WeakPolarHBondContact O-CB 3.49Å; K284-K287 PolarHBondContact O-N 3.01Å; K284-K287 VanDerWaalsContact O-N 3.16Å; K287-T289 PolarHBondContact O-N 3.01Å; K287-G290 PolarHBondContact O-N 3.39Å
288	L	94	Very high	94.3	Very high	72 Å²	72	46.7 Å²	46.7	38%	0.377	24%	0.242	S	C	.	.	H	α-helix	trans	-61.9	-29.9	-178.5	-71.7	172.4	0	0	0	112.7	K284 R285 D327 I330	K284-L288 VanDerWaalsContact O-CG 3.31Å; K284-L288 WeakPolarHBondContact O-CG 3.25Å; K284-L288 PolarHBondContact O-N 3.49Å; R285-L288 PolarHBondContact O-N 2.97Å; L288-D327 HydrophobicContact CD1-CB 3.9Å; L288-D327 HydrophobicContact CD2-CB 3.9Å; L288-I330 HydrophobicContact CD1-CB 4.47Å; L288-I330 HydrophobicContact CD1-CD1 4.46Å; L288-I330 HydrophobicContact CD1-CG2 4.23Å
289	T	95	Very high	95.1	Very high	46 Å²	46	54 Å²	54	28%	0.282	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-0.4	177	54.1	0	0	0	0	113.8	T263 V264 R285 L286 K287 I291	T263-T289 HydrophobicContact CG2-CG2 4.42Å; V264-T289 HydrophobicContact CG1-CG2 4.31Å; V264-T289 WeakPolarHBondContact CG1-OG1 3.34Å; R285-T289 WeakPolarHBondContact O-CG2 3.16Å; R285-T289 PolarHBondContact O-N 3.21Å; R285-T289 VanDerWaalsContact O-N 3.16Å; R285-T289 PolarHBondContact O-OG1 3.32Å; L286-T289 PolarHBondContact O-N 3.34Å; L286-T289 PolarHBondContact O-OG1 2.65Å; K287-T289 PolarHBondContact O-N 3.01Å; T289-I291 PolarHBondContact O-N 2.91Å
290	G	96.9	Very high	95.6	Very high	59 Å²	59	56.6 Å²	56.6	61%	0.608	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	9.9	-177	0	0	0	0	0	114.6	L286 K287 K292	L286-G290 PolarHBondContact O-N 3.03Å; K287-G290 PolarHBondContact O-N 3.39Å; G290-K292 PolarHBondContact O-N 2.98Å
291	I	97.8	Very high	96.1	Very high	15 Å²	15	54.4 Å²	54.4	8%	0.077	28%	0.276	C	S	.	.			trans	-78.9	115.5	177.3	-66.1	165.1	0	0	0	108.6	H260 T263 V264 L286 T289	H260-I291 HydrophobicContact CB-CD1 3.8Å; H260-I291 HydrophobicContact CB-CG2 4.25Å; T263-I291 HydrophobicContact CG2-CD1 3.89Å; V264-I291 HydrophobicContact CG1-CD1 3.59Å; L286-I291 CarbonylContact C-O 3.55Å; L286-I291 HydrophobicContact CD2-CB 3.94Å; L286-I291 HydrophobicContact CD2-CG2 3.56Å; L286-I291 PolarHBondContact O-N 3.21Å; T289-I291 PolarHBondContact O-N 2.91Å
292	K	98.1	Very high	96.4	Very high	156 Å²	156	56.7 Å²	56.7	68%	0.678	29%	0.286	S	S	*	.			trans	-72.5	156.8	177.9	-63.8	-178.7	-178.6	177.4	0	111	M229 M230 G290	M229-K292 WeakPolarHBondContact CA-O 3.32Å; M229-K292 HydrophobicContact CB-CB 4.32Å; M229-K292 VanDerWaalsContact CB-O 3.22Å; M229-K292 WeakPolarHBondContact CB-O 3.48Å; M230-K292 PolarHBondContact N-O 3.46Å; G290-K292 PolarHBondContact O-N 2.98Å
293	Y	98.2	Very high	96.6	Very high	48 Å²	48	56.7 Å²	56.7	19%	0.188	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	158	166.9	66.5	-92.8	0	0	0	111.1	M230 I250 E283 L286 H295	M230-Y293 HydrophobicContact CE-CG 4.09Å; M230-Y293 CarbonylContact O-C 3.47Å; M230-Y293 WeakPolarHBondContact O-CA 3.46Å; M230-Y293 WeakPolarHBondContact O-CB 3.49Å; I250-Y293 HydrophobicContact CG2-CD2 3.67Å; I250-Y293 HydrophobicContact CG2-CE2 3.61Å; I250-Y293 HydrophobicContact CG2-CG 4.25Å; E283-Y293 HydrophobicContact CG-CE1 3.71Å; E283-Y293 WeakPolarHBondContact OE1-CE1 3.44Å; E283-Y293 VanDerWaalsContact OE1-CZ 3.26Å; E283-Y293 PolarHBondContact OE1-OH 3.16Å; L286-Y293 HydrophobicContact CD1-CD1 4.19Å; Y293-H295 AromaticContact CE2-CE1 3.75Å; Y293-H295 AromaticContact CE2-NE2 3.81Å
294	I	97.8	Very high	96.6	Very high	66 Å²	66	57 Å²	57	34%	0.338	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	156.7	173.3	63.7	164.5	0	0	0	111.1	L225 M229 M230 I231 H232	L225-I294 HydrophobicContact CD2-CD1 3.46Å; L225-I294 VanDerWaalsContact CD2-CD1 3.46Å; L225-I294 HydrophobicContact CG-CD1 4.3Å; M229-I294 HydrophobicContact SD-CB 4.48Å; M229-I294 HydrophobicContact SD-CD1 4.13Å; M229-I294 HydrophobicContact SD-CG1 4.06Å; M229-I294 HydrophobicContact SD-CG2 3.66Å; M230-I294 PolarHBondContact O-N 2.99Å; I231-I294 HydrophobicContact CD1-CD1 3.88Å; I231-I294 HydrophobicContact CD1-CG1 3.65Å; H232-I294 PolarHBondContact N-O 2.99Å
295	H	98.3	Very high	96.7	Very high	55 Å²	55	56.4 Å²	56.4	26%	0.255	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.8	169.6	-60.4	-45.3	0	0	0	109.2	H232 V235 K247 Y249 Y293	H232-H295 WeakPolarHBondContact CB-ND1 3.33Å; H232-H295 AromaticContact CG-ND1 3.59Å; H232-H295 AromaticContact ND1-CE1 3.57Å; H232-H295 AromaticContact ND1-ND1 3.02Å; H232-H295 PolarHBondContact ND1-ND1 2.89Å; V235-H295 HydrophobicContact CG1-CB 4.41Å; V235-H295 HydrophobicContact CG2-CB 3.63Å; K247-H295 PolarHBondContact O-NE2 3.22Å; Y249-H295 PolarHBondContact O-CE1 2.73Å; Y293-H295 AromaticContact CE2-CE1 3.75Å; Y293-H295 AromaticContact CE2-NE2 3.81Å
296	V	97.7	Very high	96.5	Very high	28 Å²	28	56.6 Å²	56.6	17%	0.17	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-61.4	159.4	167.2	-60.4	0	0	0	0	110.5	I231 H232 L233 V235 D298 G301	I231-V296 HydrophobicContact CG2-CG1 3.6Å; H232-V296 WeakPolarHBondContact O-CG2 3.21Å; H232-V296 PolarHBondContact O-N 3.07Å; H232-V296 VanDerWaalsContact O-N 3.12Å; L233-V296 HydrophobicContact CD2-CG1 3.95Å; L233-V296 VanDerWaalsContact O-CG2 3.23Å; L233-V296 WeakPolarHBondContact O-CG2 3.28Å; V235-V296 HydrophobicContact CB-CG2 4.2Å; V235-V296 HydrophobicContact CG2-CG2 3.71Å; V235-V296 WeakPolarHBondContact CG2-O 3.41Å; V296-D298 PolarHBondContact O-N 3.41Å; V296-G301 VanDerWaalsContact CG2-CA 3.43Å
297	N	97.3	Very high	96.1	Very high	86 Å²	86	60.8 Å²	60.8	46%	0.46	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-57.7	138	175	-174.6	-78.2	0	0	0	110.4	K299 I300 G301	N297-K299 PolarHBondContact O-N 2.97Å; N297-K299 WeakPolarHBondContact OD1-CB 3.33Å; N297-K299 WeakPolarHBondContact OD1-CG 3.25Å; N297-K299 PolarHBondContact OD1-N 3.39Å; N297-I300 HydrophobicContact CB-CB 4.39Å; N297-I300 HydrophobicContact CB-CD1 4.12Å; N297-I300 HydrophobicContact CB-CG1 4.2Å; N297-I300 CarbonylContact O-C 3.11Å; N297-I300 WeakPolarHBondContact O-CA 3.16Å; N297-I300 WeakPolarHBondContact O-CB 3.2Å; N297-I300 PolarHBondContact O-N 3.4Å; N297-G301 PolarHBondContact O-N 3.48Å
298	D	96.4	Very high	95.6	Very high	76 Å²	76	57.6 Å²	57.6	41%	0.406	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-25.6	-178	60.2	-10.2	0	0	0	113.9	V235 A236 V296 I300 Q302	V235-D298 HydrophobicContact CG1-CB 4.3Å; A236-D298 HydrophobicContact CB-CB 4.16Å; A236-D298 WeakPolarHBondContact CB-O 3.46Å; V296-D298 PolarHBondContact O-N 3.41Å; D298-I300 VanDerWaalsContact C-N 3.27Å; D298-Q302 WeakPolarHBondContact O-CG 3.36Å; D298-Q302 PolarHBondContact O-NE2 3.05Å
299	K	96.5	Very high	94.4	Very high	154 Å²	154	60.7 Å²	60.7	67%	0.67	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-22.6	170.8	-57.4	-178.8	-179.8	179.6	0	112.7	N215 N297	N215-K299 PolarHBondContact ND2-O 2.88Å; N297-K299 PolarHBondContact O-N 2.97Å; N297-K299 WeakPolarHBondContact OD1-CB 3.33Å; N297-K299 WeakPolarHBondContact OD1-CG 3.25Å; N297-K299 PolarHBondContact OD1-N 3.39Å
300	I	97.5	Very high	92.9	Very high	60 Å²	60	61.3 Å²	61.3	31%	0.308	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-50.1	-179.3	-62.6	177.5	0	0	0	110.9	N215 N218 N297 D298 Q302	N215-I300 WeakPolarHBondContact CB-O 3.26Å; N218-I300 VanDerWaalsContact CA-CG2 3.49Å; N218-I300 HydrophobicContact CB-CG2 3.92Å; N297-I300 HydrophobicContact CB-CB 4.39Å; N297-I300 HydrophobicContact CB-CD1 4.12Å; N297-I300 HydrophobicContact CB-CG1 4.2Å; N297-I300 CarbonylContact O-C 3.11Å; N297-I300 WeakPolarHBondContact O-CA 3.16Å; N297-I300 WeakPolarHBondContact O-CB 3.2Å; N297-I300 PolarHBondContact O-N 3.4Å; D298-I300 VanDerWaalsContact C-N 3.27Å; I300-Q302 PolarHBondContact O-N 3.24Å
301	G	97.6	Very high	91.1	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.334	C	S	.	.	S	Bend	trans	-76.5	44.6	-174.6	0	0	0	0	0	114.8	L233 V235 A236 V296 N297	L233-G301 CarbonylContact O-C 3.47Å; L233-G301 WeakPolarHBondContact O-CA 3.48Å; V235-G301 PolarHBondContact N-O 3.02Å; A236-G301 PolarHBondContact N-O 3.18Å; V296-G301 VanDerWaalsContact CG2-CA 3.43Å; N297-G301 PolarHBondContact O-N 3.48Å
302	Q	97.5	Very high	89	Confident	55 Å²	55	69.7 Å²	69.7	26%	0.257	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	131.9	-173.8	-64.6	-172.6	-13.2	0	0	112.5	I214 A236 F242 D298 I300	I214-Q302 HydrophobicContact CD1-CB 3.71Å; I214-Q302 HydrophobicContact CG1-CB 3.46Å; I214-Q302 VanDerWaalsContact CG1-CB 3.46Å; I214-Q302 WeakPolarHBondContact CG1-O 3.38Å; I214-Q302 PolarHBondContact N-O 3.49Å; A236-Q302 HydrophobicContact CB-CG 4.02Å; A236-Q302 CarbonylContact O-C 3.57Å; A236-Q302 VanDerWaalsContact O-CA 3.28Å; A236-Q302 WeakPolarHBondContact O-CA 3.22Å; F242-Q302 HydrophobicContact CD1-CB 4.27Å; F242-Q302 HydrophobicContact CD1-CG 4.13Å; F242-Q302 HydrophobicContact CE1-CB 4.28Å; D298-Q302 WeakPolarHBondContact O-CG 3.36Å; D298-Q302 PolarHBondContact O-NE2 3.05Å; I300-Q302 PolarHBondContact O-N 3.24Å
303	Y	97.4	Very high	86.9	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	145.6	179.2	-71.3	-102.9	0	0	0	111.5	L211 A212 P213 N218 Y220 L233 S234 A236 N238 V253	L211-Y303 HydrophobicContact CB-CD1 3.76Å; L211-Y303 HydrophobicContact CB-CG 4.35Å; A212-Y303 VanDerWaalsContact O-CA 3.3Å; A212-Y303 WeakPolarHBondContact O-CA 3.37Å; P213-Y303 HydrophobicContact CB-CD1 4.03Å; P213-Y303 HydrophobicContact CB-CE1 3.53Å; P213-Y303 HydrophobicContact CG-CE1 4.21Å; N218-Y303 VanDerWaalsContact ND2-CE2 3.31Å; N218-Y303 WeakPolarHBondContact ND2-CE2 3.14Å; N218-Y303 PolarHBondContact ND2-OH 2.95Å; Y220-Y303 PolarHBondContact OH-OH 3.31Å; L233-Y303 WeakPolarHBondContact O-CE2 3.18Å; S234-Y303 VanDerWaalsContact CA-CE2 3.48Å; A236-Y303 PolarHBondContact O-N 3.27Å; N238-Y303 PolarHBondContact N-O 3.04Å; V253-Y303 HydrophobicContact CB-CE1 4.27Å; V253-Y303 HydrophobicContact CG2-CD1 4.28Å; V253-Y303 HydrophobicContact CG2-CE1 3.71Å
304	L	95.5	Very high	84.7	Confident	18 Å²	18	70.2 Å²	70.2	9%	0.094	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	126.7	163.3	-72.9	-178.9	0	0	0	109.5	W84 F87 A212 I214 N238 F242	W84-L304 HydrophobicContact CD2-CD1 4.48Å; W84-L304 HydrophobicContact CE3-CD1 4.25Å; W84-L304 HydrophobicContact CH2-CD1 3.12Å; W84-L304 HydrophobicContact CH2-CD2 4.33Å; W84-L304 HydrophobicContact CH2-CG 3.49Å; W84-L304 VanDerWaalsContact CH2-CG 3.49Å; W84-L304 HydrophobicContact CZ2-CD1 3.48Å; W84-L304 VanDerWaalsContact CZ2-CD1 3.48Å; W84-L304 HydrophobicContact CZ2-CG 4.07Å; W84-L304 HydrophobicContact CZ3-CD1 3.58Å; W84-L304 HydrophobicContact CZ3-CG 4.16Å; F87-L304 HydrophobicContact CE1-CB 4.41Å; F87-L304 HydrophobicContact CE1-CD1 3.91Å; F87-L304 HydrophobicContact CZ-CB 4.43Å; F87-L304 HydrophobicContact CZ-CD1 3.87Å; A212-L304 PolarHBondContact N-O 2.65Å; A212-L304 PolarHBondContact O-N 3.09Å; I214-L304 HydrophobicContact CG2-CB 4.32Å; I214-L304 HydrophobicContact CG2-CG 3.96Å; N238-L304 HydrophobicContact CB-CD2 3.86Å; F242-L304 HydrophobicContact CZ-CD2 4.39Å
305	Y	94.1	Very high	82.5	Confident	70 Å²	70	75.9 Å²	75.9	28%	0.275	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	131.5	165.6	179.4	-104.5	0	0	0	110.6	D210 L211 N238 T239 P307	D210-Y305 HydrophobicContact CB-CD2 4.43Å; D210-Y305 HydrophobicContact CB-CE2 4.16Å; D210-Y305 CarbonylContact O-C 3.51Å; D210-Y305 WeakPolarHBondContact O-CA 3.33Å; D210-Y305 VanDerWaalsContact OD2-CE2 3.24Å; D210-Y305 WeakPolarHBondContact OD2-CE2 3.49Å; L211-Y305 HydrophobicContact CD2-CD2 4.17Å; N238-Y305 WeakPolarHBondContact OD1-CB 3.42Å; N238-Y305 PolarHBondContact OD1-N 2.9Å; T239-Y305 HydrophobicContact CG2-CD1 3.71Å; T239-Y305 HydrophobicContact CG2-CG 3.81Å; Y305-P307 HydrophobicContact CD1-CG 4.29Å; Y305-P307 HydrophobicContact CE1-CB 4.27Å; Y305-P307 HydrophobicContact CE1-CG 4.21Å
306	I	92.3	Very high	80.4	Confident	4 Å²	4	74.8 Å²	74.8	2%	0.021	39%	0.394	C	S	.	.			trans	-105.5	108.4	178.1	-55.1	156.5	0	0	0	107.7	F87 Q150 I153 T154 D210 A212	F87-I306 HydrophobicContact CD1-CG1 4.47Å; F87-I306 HydrophobicContact CE1-CG1 4.35Å; Q150-I306 HydrophobicContact CB-CG2 4.41Å; Q150-I306 HydrophobicContact CG-CB 4.34Å; Q150-I306 HydrophobicContact CG-CG2 3.91Å; I153-I306 HydrophobicContact CB-CD1 3.82Å; I153-I306 HydrophobicContact CD1-CG2 3.65Å; I153-I306 HydrophobicContact CG2-CD1 3.44Å; I153-I306 VanDerWaalsContact CG2-CD1 3.44Å; I153-I306 HydrophobicContact CG2-CG1 3.89Å; I153-I306 HydrophobicContact CG2-CG2 4.48Å; T154-I306 WeakPolarHBondContact OG1-CD1 3.5Å; D210-I306 WeakPolarHBondContact CB-O 3.44Å; D210-I306 PolarHBondContact O-N 3.15Å; A212-I306 HydrophobicContact CB-CD1 3.98Å; A212-I306 HydrophobicContact CB-CG1 4.4Å
307	P	87.5	Confident	78.1	Confident	89 Å²	89	81.3 Å²	81.3	58%	0.578	43%	0.428	S	S	*	.			trans	-58.7	146.7	-178.3	-24.6	34.2	0	0	0	113	Q150 Y305	Q150-P307 PolarHBondContact NE2-O 2.76Å; Y305-P307 HydrophobicContact CD1-CG 4.29Å; Y305-P307 HydrophobicContact CE1-CB 4.27Å; Y305-P307 HydrophobicContact CE1-CG 4.21Å
308	Y	83.7	Confident	76.2	Confident	52 Å²	52	81.5 Å²	81.5	20%	0.204	43%	0.429	C	S	.	.			trans	-146.7	150.9	171	72.4	-82.6	0	0	0	110.6	Q147 D210 S310	Q147-Y308 HydrophobicContact CG-CD2 4.24Å; D210-Y308 HydrophobicContact CB-CD1 4.23Å; D210-Y308 HydrophobicContact CB-CE1 4.35Å; D210-Y308 VanDerWaalsContact OD2-CE1 3.26Å; D210-Y308 WeakPolarHBondContact OD2-CE1 3.49Å; Y308-S310 PolarHBondContact O-N 3.21Å
309	T	69.4	Low	74.6	Confident	137 Å²	137	80.3 Å²	80.3	84%	0.84	42%	0.422	S	S	*	.			trans	-82.2	103.4	173.1	51.3	0	0	0	0	109.1	L311	T309-L311 PolarHBondContact O-N 3.4Å
310	S	63.9	Low	72.7	Confident	60 Å²	60	81.1 Å²	81.1	42%	0.42	43%	0.426	S	S	.	.			trans	-79.4	115.3	168.3	-174.8	0	0	0	0	109.5	Y308 Y312	Y308-S310 PolarHBondContact O-N 3.21Å; S310-Y312 PolarHBondContact O-N 3.21Å; S310-Y312 PolarHBondContact OG-N 3.43Å
311	L	58.4	Low	70.9	Confident	150 Å²	150	85.7 Å²	85.7	79%	0.785	44%	0.443	S	S	*	.	S	Bend	trans	-74.7	-12.4	171.5	-74.5	165.7	0	0	0	112.7	T309	T309-L311 PolarHBondContact O-N 3.4Å
312	Y	54.9	Low	69.4	Low	100 Å²	100	86.5 Å²	86.5	39%	0.392	45%	0.447	S	S	.	.			trans	-126.8	27.7	-162.7	-64.9	-78	0	0	0	114.4	S310 L314	S310-Y312 PolarHBondContact O-N 3.21Å; S310-Y312 PolarHBondContact OG-N 3.43Å; Y312-L314 PolarHBondContact O-N 3Å
313	S	53.4	Low	67.8	Low	100 Å²	100	87.8 Å²	87.8	70%	0.699	46%	0.455	S	S	*	.			trans	-70.3	77.5	167.9	62.6	0	0	0	0	109.8
314	L	52.2	Low	66.2	Low	114 Å²	114	95.3 Å²	95.3	60%	0.597	49%	0.491	S	S	*	.			trans	-76.4	126.5	169.2	-72.3	173.3	0	0	0	108.2	Y312 S316	Y312-L314 PolarHBondContact O-N 3Å; L314-S316 PolarHBondContact O-N 3.3Å
315	Q	51.2	Low	64.9	Low	186 Å²	186	98.2 Å²	98.2	87%	0.869	50%	0.5	S	S	*	.			trans	-63.9	104.5	158.5	-77.2	-176.1	-6	0	0	107	N317	Q315-N317 PolarHBondContact O-N 2.97Å
316	S	53.4	Low	63.5	Low	32 Å²	32	97.4 Å²	97.4	22%	0.224	51%	0.505	C	S	.	.			trans	-60.3	110.5	173.8	165.8	0	0	0	0	109.5	L314 N318 L319	L314-S316 PolarHBondContact O-N 3.3Å; S316-N318 PolarHBondContact O-N 3.43Å; S316-N318 PolarHBondContact OG-N 3.16Å; S316-L319 WeakPolarHBondContact O-CB 3.44Å; S316-L319 PolarHBondContact O-N 2.98Å; S316-L319 VanDerWaalsContact O-N 3.09Å; S316-L319 PolarHBondContact OG-N 3.35Å
317	N	50.6	Low	62.5	Low	165 Å²	165	101.8 Å²	101.8	88%	0.882	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-19	169.9	-75.4	-20.7	0	0	0	112.3	Q315	Q315-N317 PolarHBondContact O-N 2.97Å
318	N	57.8	Low	61.4	Low	90 Å²	90	105.5 Å²	105.5	48%	0.481	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	2.7	-179.5	-77.1	-27.1	0	0	0	114.4	S316 K320 K321 L322	S316-N318 PolarHBondContact O-N 3.43Å; S316-N318 PolarHBondContact OG-N 3.16Å; N318-K320 PolarHBondContact O-N 3.2Å; N318-K321 WeakPolarHBondContact O-CB 3.49Å; N318-K321 PolarHBondContact O-N 2.94Å; N318-L322 PolarHBondContact O-N 2.67Å
319	L	61.5	Low	60.8	Low	51 Å²	51	107.4 Å²	107.4	27%	0.267	55%	0.549	S	S	.	.	H	α-helix	trans	-52	-49.8	-176.5	-177.6	66	0	0	0	112.8	L274 E277 S316 K321 L322 L323	L274-L319 HydrophobicContact CD1-CD1 3.58Å; L274-L319 HydrophobicContact CD2-CD1 4.11Å; L274-L319 HydrophobicContact CG-CD1 4.45Å; E277-L319 HydrophobicContact CG-CD1 3.7Å; E277-L319 WeakPolarHBondContact OE1-CD1 3.36Å; S316-L319 WeakPolarHBondContact O-CB 3.44Å; S316-L319 PolarHBondContact O-N 2.98Å; S316-L319 VanDerWaalsContact O-N 3.09Å; S316-L319 PolarHBondContact OG-N 3.35Å; L319-K321 VanDerWaalsContact C-N 3.31Å; L319-K321 PolarHBondContact O-N 2.94Å; L319-L322 PolarHBondContact O-N 2.9Å; L319-L323 HydrophobicContact CD1-CD1 4.16Å; L319-L323 HydrophobicContact CD1-CG 4.46Å; L319-L323 HydrophobicContact CG-CD1 4.06Å; L319-L323 WeakPolarHBondContact O-CG 3.43Å; L319-L323 PolarHBondContact O-N 2.99Å; L319-L323 VanDerWaalsContact O-N 3.09Å
320	K	57.5	Low	61	Low	171 Å²	171	101.4 Å²	101.4	74%	0.743	51%	0.512	S	S	*	.	H	α-helix	trans	-59.6	-40.8	178.3	-76	-176.9	178	178.4	0	112.4	N318 L323 Q324	N318-K320 PolarHBondContact O-N 3.2Å; K320-L323 PolarHBondContact O-N 3.32Å; K320-Q324 VanDerWaalsContact O-CG 3.31Å; K320-Q324 WeakPolarHBondContact O-CG 3.48Å; K320-Q324 PolarHBondContact O-N 3.42Å
321	K	59.5	Low	61.5	Low	156 Å²	156	101.5 Å²	101.5	68%	0.678	51%	0.507	S	S	*	.	H	α-helix	trans	-67.1	-37.8	-179.5	-116.8	179.3	-179.2	178.4	0	112	N318 L319	N318-K321 WeakPolarHBondContact O-CB 3.49Å; N318-K321 PolarHBondContact O-N 2.94Å; L319-K321 VanDerWaalsContact C-N 3.31Å; L319-K321 PolarHBondContact O-N 2.94Å
322	L	65.3	Low	62.4	Low	17 Å²	17	97.1 Å²	97.1	9%	0.089	49%	0.489	C	S	.	.	H	α-helix	trans	-69.7	-38.7	177.2	-67.4	175	0	0	0	112	D270 Y271 L274 N318 L319 Q324	D270-L322 HydrophobicContact CB-CD2 4.1Å; Y271-L322 HydrophobicContact CD1-CD1 4.09Å; Y271-L322 HydrophobicContact CE1-CB 4.06Å; Y271-L322 HydrophobicContact CE1-CD1 4.18Å; L274-L322 HydrophobicContact CD1-CD1 4.43Å; N318-L322 PolarHBondContact O-N 2.67Å; L319-L322 PolarHBondContact O-N 2.9Å; L322-Q324 VanDerWaalsContact C-N 3.31Å; L322-Q324 PolarHBondContact O-N 2.84Å
323	L	65.2	Low	64	Low	81 Å²	81	95.8 Å²	95.8	42%	0.424	49%	0.486	S	S	.	.	H	α-helix	trans	-73.3	-19.8	-179.1	-68.3	173.7	0	0	0	114	E277 L319 K320	E277-L323 HydrophobicContact CG-CD2 4.48Å; L319-L323 HydrophobicContact CD1-CD1 4.16Å; L319-L323 HydrophobicContact CD1-CG 4.46Å; L319-L323 HydrophobicContact CG-CD1 4.06Å; L319-L323 WeakPolarHBondContact O-CG 3.43Å; L319-L323 PolarHBondContact O-N 2.99Å; L319-L323 VanDerWaalsContact O-N 3.09Å; K320-L323 PolarHBondContact O-N 3.32Å
324	Q	63.9	Low	65.9	Low	158 Å²	158	91 Å²	91	74%	0.738	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	1.9	-179.6	-74.7	177.7	-13.7	0	0	114.5	K320 L322	K320-Q324 VanDerWaalsContact O-CG 3.31Å; K320-Q324 WeakPolarHBondContact O-CG 3.48Å; K320-Q324 PolarHBondContact O-N 3.42Å; L322-Q324 VanDerWaalsContact C-N 3.31Å; L322-Q324 PolarHBondContact O-N 2.84Å
325	R	68.2	Low	68	Low	80 Å²	80	86.6 Å²	86.6	30%	0.302	43%	0.43	S	S	.	.			trans	-67.9	149.2	-178.7	-70.1	-172.9	174.8	162.6	-8.6	112.6	D270 Q329	D270-R325 IonicContact OD2-CZ 3.72Å; D270-R325 IonicContact OD2-NH1 2.67Å; D270-R325 PolarHBondContact OD2-NH1 3Å; D270-R325 IonicContact OD2-NH2 3.95Å; R325-Q329 HydrophobicContact CB-CB 4.16Å; R325-Q329 VanDerWaalsContact CG-OE1 3.29Å
326	S	63.3	Low	70.1	Confident	53 Å²	53	83.6 Å²	83.6	37%	0.371	42%	0.42	S	S	.	.			trans	-71.4	159.3	175.5	63.8	0	0	0	0	112.1	E328 Q329 I330	S326-E328 PolarHBondContact O-N 3.35Å; S326-Q329 WeakPolarHBondContact O-CB 3.34Å; S326-Q329 PolarHBondContact O-N 2.75Å; S326-Q329 WeakPolarHBondContact OG-CG 3.46Å; S326-I330 PolarHBondContact O-N 2.78Å
327	D	71.8	Confident	72	Confident	95 Å²	95	84.4 Å²	84.4	51%	0.508	43%	0.428	S	S	.	.	H	α-helix	trans	-58.7	-33.3	177.5	-66.2	-27.8	0	0	0	112.9	L288 I330 N331	L288-D327 HydrophobicContact CD1-CB 3.9Å; L288-D327 HydrophobicContact CD2-CB 3.9Å; D327-I330 WeakPolarHBondContact O-CB 3.43Å; D327-I330 PolarHBondContact O-N 3.38Å; D327-N331 PolarHBondContact O-N 3.22Å
328	E	64.2	Low	74.1	Confident	167 Å²	167	77.4 Å²	77.4	78%	0.78	39%	0.391	S	S	*	.	H	α-helix	trans	-62.7	-43.4	174	-66.4	178.9	169.2	0	0	111.9	S326 I330 N331	S326-E328 PolarHBondContact O-N 3.35Å; E328-I330 VanDerWaalsContact C-N 3.28Å; E328-I330 PolarHBondContact O-N 2.83Å; E328-N331 PolarHBondContact O-N 2.67Å
329	Q	71.5	Confident	75.8	Confident	92 Å²	92	76 Å²	76	43%	0.43	39%	0.389	S	S	.	.	H	α-helix	trans	-71.3	-25.1	177.3	-69.3	175.9	6	0	0	112.4	R325 S326 N331 S332	R325-Q329 HydrophobicContact CB-CB 4.16Å; R325-Q329 VanDerWaalsContact CG-OE1 3.29Å; S326-Q329 WeakPolarHBondContact O-CB 3.34Å; S326-Q329 PolarHBondContact O-N 2.75Å; S326-Q329 WeakPolarHBondContact OG-CG 3.46Å; Q329-N331 PolarHBondContact O-N 2.99Å; Q329-S332 PolarHBondContact O-OG 2.56Å
330	I	74.1	Confident	77.5	Confident	12 Å²	12	76.5 Å²	76.5	6%	0.062	39%	0.388	C	S	.	.	H	α-helix	trans	-61	-39.2	174	-70.9	175.2	0	0	0	109.5	K284 R285 L288 S326 D327 E328	K284-I330 HydrophobicContact CB-CD1 4.46Å; K284-I330 HydrophobicContact CD-CD1 4.15Å; R285-I330 HydrophobicContact CG-CG2 3.52Å; R285-I330 PolarHBondContact NH1-O 3.45Å; R285-I330 PolarHBondContact NH2-O 3.12Å; L288-I330 HydrophobicContact CD1-CB 4.47Å; L288-I330 HydrophobicContact CD1-CD1 4.46Å; L288-I330 HydrophobicContact CD1-CG2 4.23Å; S326-I330 PolarHBondContact O-N 2.78Å; D327-I330 WeakPolarHBondContact O-CB 3.43Å; D327-I330 PolarHBondContact O-N 3.38Å; E328-I330 VanDerWaalsContact C-N 3.28Å; E328-I330 PolarHBondContact O-N 2.83Å
331	N	72.8	Confident	79.4	Confident	61 Å²	61	74.4 Å²	74.4	33%	0.326	38%	0.379	S	S	.	.	H	α-helix	trans	-83.5	-17.2	-173.8	-71.2	-26.1	0	0	0	115.3	N265 D327 E328 Q329	N265-N331 PolarHBondContact ND2-O 3.05Å; D327-N331 PolarHBondContact O-N 3.22Å; E328-N331 PolarHBondContact O-N 2.67Å; Q329-N331 PolarHBondContact O-N 2.99Å
332	S	78.9	Confident	81.2	Confident	58 Å²	58	68.4 Å²	68.4	41%	0.406	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-14.2	-172.7	59.6	0	0	0	0	115.9	Q329	Q329-S332 PolarHBondContact O-OG 2.56Å
333	H	87.4	Confident	82.8	Confident	73 Å²	73	69.4 Å²	69.4	34%	0.338	36%	0.36	S	S	.	.	S	Bend	trans	-114.9	42.4	-173.5	-63.1	-77	0	0	0	112.6	S268 N269 D270	S268-H333 WeakPolarHBondContact CA-O 3.46Å; N269-H333 PolarHBondContact N-O 3.11Å; N269-H333 PolarHBondContact ND2-O 2.87Å; D270-H333 VanDerWaalsContact OD2-CB 3.32Å; D270-H333 WeakPolarHBondContact OD2-CB 3.28Å; D270-H333 IonicContact OD2-CD2 3.89Å; D270-H333 IonicContact OD2-CG 3.54Å
334	G	93.8	Very high	84.3	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.352	C	S	.	.	S	Bend	trans	-105.7	-146.4	-171.4	0	0	0	0	0	115.5	N265 Y267 N269 D336 A337 V338	N265-G334 CarbonylContact O-C 3.53Å; N265-G334 WeakPolarHBondContact O-CA 3.24Å; Y267-G334 WeakPolarHBondContact O-CA 3.44Å; N269-G334 PolarHBondContact ND2-O 2.82Å; G334-D336 VanDerWaalsContact C-N 3.32Å; G334-D336 PolarHBondContact O-N 3.35Å; G334-A337 PolarHBondContact O-N 3.37Å; G334-V338 PolarHBondContact O-N 3.19Å
335	L	96.1	Very high	85.9	Confident	20 Å²	20	65.9 Å²	65.9	11%	0.105	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-58.9	-39.3	179.8	-174.8	64.7	0	0	0	113.1	N189 F192 I193 F261 I262 N265 A337 V338	N189-L335 HydrophobicContact CB-CD1 3.79Å; F192-L335 HydrophobicContact CD1-CD1 3.96Å; F192-L335 HydrophobicContact CD1-CD2 3.73Å; F192-L335 HydrophobicContact CD1-CG 4.48Å; F192-L335 HydrophobicContact CE1-CD2 3.71Å; I193-L335 HydrophobicContact CD1-CD1 3.84Å; I193-L335 HydrophobicContact CD1-CG 4.5Å; I193-L335 HydrophobicContact CG1-CD1 3.72Å; I193-L335 HydrophobicContact CG1-CG 4.46Å; F261-L335 HydrophobicContact CD1-CD2 4.18Å; F261-L335 HydrophobicContact CE1-CD1 4.04Å; F261-L335 HydrophobicContact CE1-CD2 4.08Å; I262-L335 HydrophobicContact CG1-CD2 4.38Å; N265-L335 PolarHBondContact O-N 3.21Å; N265-L335 WeakPolarHBondContact OD1-CB 3.31Å; N265-L335 PolarHBondContact OD1-N 3.04Å; L335-A337 VanDerWaalsContact C-N 3.33Å; L335-A337 PolarHBondContact O-N 3.16Å; L335-V338 WeakPolarHBondContact O-CG1 3.45Å
336	D	94.6	Very high	87.2	Confident	123 Å²	123	63.8 Å²	63.8	66%	0.658	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-70	-25.8	-179.8	62.5	-6.7	0	0	0	114.3	N265 G334	N265-D336 PolarHBondContact ND2-OD1 3.03Å; N265-D336 PolarHBondContact ND2-OD2 3.44Å; N265-D336 PolarHBondContact OD1-N 3.24Å; N265-D336 PolarHBondContact OD1-OD1 3.12Å; G334-D336 VanDerWaalsContact C-N 3.32Å; G334-D336 PolarHBondContact O-N 3.35Å
337	A	93.7	Very high	88.7	Confident	49 Å²	49	66 Å²	66	41%	0.405	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-101.8	4.3	-177.8	0	0	0	0	0	113.5	G334 L335 S339	G334-A337 PolarHBondContact O-N 3.37Å; L335-A337 VanDerWaalsContact C-N 3.33Å; L335-A337 PolarHBondContact O-N 3.16Å; A337-S339 PolarHBondContact O-N 3.43Å
338	V	94.9	Very high	89.7	Confident	18 Å²	18	64.4 Å²	64.4	11%	0.109	33%	0.334	C	S	.	.			trans	-70.9	117.7	-172.7	71.3	0	0	0	0	112.4	K186 N189 V190 I193 N269 G334 L335 Y340	K186-V338 HydrophobicContact CG-CG2 3.75Å; N189-V338 HydrophobicContact CB-CB 4.28Å; N189-V338 HydrophobicContact CB-CG1 4.33Å; N189-V338 HydrophobicContact CB-CG2 4.13Å; V190-V338 HydrophobicContact CG2-CG2 3.94Å; I193-V338 HydrophobicContact CD1-CG1 3.27Å; N269-V338 WeakPolarHBondContact ND2-CA 3.1Å; N269-V338 WeakPolarHBondContact OD1-CG2 3.32Å; G334-V338 PolarHBondContact O-N 3.19Å; L335-V338 WeakPolarHBondContact O-CG1 3.45Å; V338-Y340 HydrophobicContact CG1-CD1 4.19Å; V338-Y340 HydrophobicContact CG1-CE1 4.04Å; V338-Y340 HydrophobicContact CG2-CD1 4.28Å
339	S	94.6	Very high	90.9	Very high	62 Å²	62	58.2 Å²	58.2	43%	0.434	31%	0.308	S	S	.	.			trans	-100.7	125.7	176.8	62.7	0	0	0	0	112	K186 A337	K186-S339 WeakPolarHBondContact CE-O 3.12Å; K186-S339 PolarHBondContact NZ-O 2.88Å; K186-S339 PolarHBondContact NZ-OG 2.93Å; A337-S339 PolarHBondContact O-N 3.43Å
340	Y	96.9	Very high	92	Very high	61 Å²	61	54.1 Å²	54.1	24%	0.239	29%	0.289	C	S	.	.			trans	-159.3	163.2	-179.1	66	-78.8	0	0	0	111.9	V190 I193 E194 V338 V342 L357	V190-Y340 HydrophobicContact CB-CD2 4.4Å; V190-Y340 HydrophobicContact CB-CG 4.41Å; V190-Y340 HydrophobicContact CG1-CD2 3.59Å; V190-Y340 HydrophobicContact CG1-CE2 3.69Å; V190-Y340 HydrophobicContact CG1-CG 4.05Å; V190-Y340 HydrophobicContact CG2-CD1 3.61Å; V190-Y340 HydrophobicContact CG2-CD2 3.95Å; V190-Y340 HydrophobicContact CG2-CE1 4.12Å; V190-Y340 HydrophobicContact CG2-CE2 4.44Å; V190-Y340 HydrophobicContact CG2-CG 3.5Å; V190-Y340 VanDerWaalsContact CG2-CG 3.5Å; I193-Y340 HydrophobicContact CD1-CE1 4.16Å; I193-Y340 WeakPolarHBondContact CG2-OH 3.47Å; E194-Y340 HydrophobicContact CG-CE2 4.06Å; E194-Y340 PolarHBondContact OE1-OH 3.33Å; V338-Y340 HydrophobicContact CG1-CD1 4.19Å; V338-Y340 HydrophobicContact CG1-CE1 4.04Å; V338-Y340 HydrophobicContact CG2-CD1 4.28Å; Y340-V342 HydrophobicContact CD2-CG2 4.03Å; Y340-V342 HydrophobicContact CE2-CG2 3.78Å; Y340-L357 WeakPolarHBondContact CA-O 3.44Å
341	K	97.3	Very high	93.1	Very high	127 Å²	127	53.6 Å²	53.6	55%	0.552	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	124.1	170.3	-175	177.6	179.9	175.6	0	110.2	I343 V356 L357	K341-I343 HydrophobicContact CD-CD1 3.89Å; K341-I343 HydrophobicContact CG-CD1 3.92Å; K341-V356 CarbonylContact O-C 3.51Å; K341-V356 VanDerWaalsContact O-CA 3.32Å; K341-V356 WeakPolarHBondContact O-CA 3.49Å; K341-L357 HydrophobicContact CB-CB 4.43Å; K341-L357 PolarHBondContact N-O 3.5Å; K341-L357 PolarHBondContact O-N 3.26Å
342	V	97.4	Very high	94.3	Very high	30 Å²	30	50.8 Å²	50.8	18%	0.182	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	123.7	169.8	-175.7	0	0	0	0	109.1	E194 Y340 R345 L354 V356	E194-V342 HydrophobicContact CG-CG2 4.23Å; Y340-V342 HydrophobicContact CD2-CG2 4.03Å; Y340-V342 HydrophobicContact CE2-CG2 3.78Å; V342-R345 HydrophobicContact CG1-CG 3.64Å; V342-L354 HydrophobicContact CG1-CD2 4.37Å; V342-V356 HydrophobicContact CG2-CG1 4.18Å
343	I	97.9	Very high	95.2	Very high	37 Å²	37	48.7 Å²	48.7	19%	0.19	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-45.3	-178.6	-58.5	-57.3	0	0	0	110.7	P41 I177 K341 R355 L357	P41-I343 HydrophobicContact CG-CG2 4.03Å; I177-I343 HydrophobicContact CD1-CB 3.96Å; I177-I343 HydrophobicContact CD1-CG1 3.76Å; I177-I343 HydrophobicContact CD1-CG2 4.09Å; K341-I343 HydrophobicContact CD-CD1 3.89Å; K341-I343 HydrophobicContact CG-CD1 3.92Å; I343-R355 PolarHBondContact N-O 3.27Å; I343-L357 HydrophobicContact CD1-CD1 3.72Å; I343-L357 HydrophobicContact CD1-CG 3.96Å; I343-L357 HydrophobicContact CG1-CD1 4.17Å; I343-L357 HydrophobicContact CG1-CG 3.85Å
344	T	97.5	Very high	95.8	Very high	43 Å²	43	45.2 Å²	45.2	26%	0.264	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	144.2	174	62.5	0	0	0	0	110.7	R355	T344-R355 PolarHBondContact N-O 3.27Å; T344-R355 PolarHBondContact O-N 3.03Å; T344-R355 WeakPolarHBondContact OG1-CB 3.46Å; T344-R355 WeakPolarHBondContact OG1-CD 3.31Å; T344-R355 VanDerWaalsContact OG1-CG 3.22Å; T344-R355 WeakPolarHBondContact OG1-CG 3.42Å
345	R	97.3	Very high	96	Very high	122 Å²	122	49.5 Å²	49.5	46%	0.46	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	128	165.1	-50.4	-161.8	172.4	91.1	-3.2	108.4	E194 V342 L354	E194-R345 IonicContact OE1-NH2 2.82Å; E194-R345 PolarHBondContact OE1-NH2 3.29Å; E194-R345 IonicContact OE2-CZ 3.4Å; E194-R345 IonicContact OE2-NE 2.9Å; E194-R345 PolarHBondContact OE2-NE 2.94Å; E194-R345 IonicContact OE2-NH2 3.29Å; E194-R345 PolarHBondContact OE2-NH2 3.01Å; V342-R345 HydrophobicContact CG1-CG 3.64Å; R345-L354 HydrophobicContact CB-CD2 3.77Å; R345-L354 HydrophobicContact CG-CD2 3.38Å
346	S	95.2	Very high	96.1	Very high	36 Å²	36	48.5 Å²	48.5	25%	0.252	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	136.6	175.6	64	0	0	0	0	111.3	Q348 H353	S346-Q348 PolarHBondContact O-N 2.82Å; S346-Q348 PolarHBondContact OG-NE2 3.43Å; S346-H353 PolarHBondContact N-O 3.28Å; S346-H353 PolarHBondContact O-N 3.26Å; S346-H353 WeakPolarHBondContact OG-CB 3.31Å
347	N	94.4	Very high	96.2	Very high	101 Å²	101	45 Å²	45	54%	0.54	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	98.9	173	-74.5	-22.4	0	0	0	108.4	P103 T352	P103-N347 HydrophobicContact CB-CB 4.45Å; N347-T352 PolarHBondContact OD1-OG1 3.45Å
348	Q	93.4	Very high	96.1	Very high	60 Å²	60	42.6 Å²	42.6	28%	0.28	21%	0.211	S	C	.	.			trans	-79.5	164.2	170.1	-57.5	-59.5	-40.3	0	0	109.2	G104 S346 F350 F351 H353	G104-Q348 PolarHBondContact N-O 3.19Å; S346-Q348 PolarHBondContact O-N 2.82Å; S346-Q348 PolarHBondContact OG-NE2 3.43Å; Q348-F350 VanDerWaalsContact C-N 3.32Å; Q348-F350 PolarHBondContact O-N 3.45Å; Q348-F351 CarbonylContact C-O 3.55Å; Q348-F351 WeakPolarHBondContact CA-O 3.42Å; Q348-F351 HydrophobicContact CB-CD1 4.42Å; Q348-F351 HydrophobicContact CB-CD2 3.91Å; Q348-F351 HydrophobicContact CB-CE1 4.27Å; Q348-F351 HydrophobicContact CB-CE2 3.8Å; Q348-F351 HydrophobicContact CB-CG 4.24Å; Q348-F351 HydrophobicContact CB-CZ 3.97Å; Q348-F351 VanDerWaalsContact CB-O 3.3Å; Q348-F351 WeakPolarHBondContact CB-O 3.47Å; Q348-F351 HydrophobicContact CG-CD2 3.97Å; Q348-F351 HydrophobicContact CG-CE2 3.55Å; Q348-F351 HydrophobicContact CG-CZ 3.98Å; Q348-F351 PolarHBondContact N-O 3.29Å; Q348-F351 VanDerWaalsContact O-O 3.14Å; Q348-H353 HydrophobicContact CG-CB 3.8Å
349	P	89.8	Confident	95.5	Very high	37 Å²	37	48.5 Å²	48.5	24%	0.24	24%	0.236	C	C	.	.	S	Bend	trans	-51.2	-50.2	-178.8	-29.5	36.7	0	0	0	112.8	L91 H101	L91-P349 HydrophobicContact CD1-CG 4.32Å; L91-P349 HydrophobicContact CD2-CG 3.89Å; L91-P349 HydrophobicContact CG-CG 4.33Å; H101-P349 PolarHBondContact CD2-O 3.16Å
350	F	93.8	Very high	94.3	Very high	6 Å²	6	50.6 Å²	50.6	3%	0.026	24%	0.238	C	C	.	.	S	Bend	trans	-102.6	-4	-173	-53.9	-70.7	0	0	0	115.9	L91 L94 Y95 T98 H101 G105 I159 Q348	L91-F350 HydrophobicContact CD1-CD2 3.49Å; L91-F350 VanDerWaalsContact CD1-CD2 3.49Å; L91-F350 HydrophobicContact CD1-CE2 3.57Å; L91-F350 HydrophobicContact CG-CE2 4.19Å; L94-F350 HydrophobicContact CB-CD2 4.17Å; L94-F350 HydrophobicContact CB-CE2 3.48Å; L94-F350 VanDerWaalsContact CB-CE2 3.48Å; L94-F350 HydrophobicContact CB-CZ 3.71Å; L94-F350 HydrophobicContact CD1-CD2 4.22Å; L94-F350 HydrophobicContact CD1-CE2 4.28Å; Y95-F350 HydrophobicContact CD2-CZ 4.25Å; T98-F350 HydrophobicContact CG2-CE1 4.28Å; T98-F350 VanDerWaalsContact OG1-CE1 3.31Å; T98-F350 WeakPolarHBondContact OG1-CE1 3.43Å; H101-F350 AromaticContact CD2-CD1 3.99Å; H101-F350 AromaticContact CE1-CD1 3.74Å; H101-F350 AromaticContact CE1-CE1 3.05Å; H101-F350 WeakPolarHBondContact CE1-CE1 3.18Å; H101-F350 AromaticContact CE1-CZ 3.67Å; H101-F350 AromaticContact ND1-CE1 3.55Å; H101-F350 AromaticContact NE2-CD1 3.71Å; H101-F350 AromaticContact NE2-CE1 3.39Å; H101-F350 WeakPolarHBondContact NE2-CE1 2.84Å; H101-F350 AromaticContact NE2-CZ 3.9Å; G105-F350 WeakPolarHBondContact CA-O 3.48Å; I159-F350 HydrophobicContact CD1-CB 3.76Å; I159-F350 HydrophobicContact CD1-CD1 3.65Å; I159-F350 HydrophobicContact CD1-CE1 4.43Å; I159-F350 HydrophobicContact CD1-CG 3.75Å; Q348-F350 VanDerWaalsContact C-N 3.32Å; Q348-F350 PolarHBondContact O-N 3.45Å
351	F	97.3	Very high	92.6	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.009	28%	0.282	C	S	.	.	S	Bend	trans	-158.7	156.3	-176.1	52.7	-91.3	0	0	0	112.2	G104 L151 Y152 L155 I171 V173 Q348 H353	G104-F351 VanDerWaalsContact C-C 3.4Å; G104-F351 CarbonylContact O-C 3.59Å; L151-F351 HydrophobicContact CD2-CE1 4.05Å; L151-F351 HydrophobicContact CD2-CE2 4.35Å; L151-F351 HydrophobicContact CD2-CZ 3.8Å; Y152-F351 HydrophobicContact CE1-CE1 4.4Å; L155-F351 HydrophobicContact CD1-CD1 3.74Å; L155-F351 HydrophobicContact CD1-CE1 3.82Å; I171-F351 HydrophobicContact CB-CB 4Å; I171-F351 HydrophobicContact CG2-CB 3.8Å; I171-F351 CarbonylContact O-C 3.53Å; I171-F351 VanDerWaalsContact O-CA 3.29Å; I171-F351 WeakPolarHBondContact O-CA 3.48Å; I171-F351 WeakPolarHBondContact O-CB 3.37Å; V173-F351 HydrophobicContact CB-CD2 3.62Å; V173-F351 HydrophobicContact CB-CE2 3.96Å; V173-F351 HydrophobicContact CB-CG 4.26Å; V173-F351 HydrophobicContact CG1-CE2 4.41Å; V173-F351 HydrophobicContact CG2-CB 3.85Å; V173-F351 HydrophobicContact CG2-CD1 4.13Å; V173-F351 HydrophobicContact CG2-CD2 3.4Å; V173-F351 HydrophobicContact CG2-CE2 3.86Å; V173-F351 HydrophobicContact CG2-CG 3.54Å; V173-F351 HydrophobicContact CG2-CZ 4.44Å; Q348-F351 CarbonylContact C-O 3.55Å; Q348-F351 WeakPolarHBondContact CA-O 3.42Å; Q348-F351 HydrophobicContact CB-CD1 4.42Å; Q348-F351 HydrophobicContact CB-CD2 3.91Å; Q348-F351 HydrophobicContact CB-CE1 4.27Å; Q348-F351 HydrophobicContact CB-CE2 3.8Å; Q348-F351 HydrophobicContact CB-CG 4.24Å; Q348-F351 HydrophobicContact CB-CZ 3.97Å; Q348-F351 VanDerWaalsContact CB-O 3.3Å; Q348-F351 WeakPolarHBondContact CB-O 3.47Å; Q348-F351 HydrophobicContact CG-CD2 3.97Å; Q348-F351 HydrophobicContact CG-CE2 3.55Å; Q348-F351 HydrophobicContact CG-CZ 3.98Å; Q348-F351 PolarHBondContact N-O 3.29Å; Q348-F351 VanDerWaalsContact O-O 3.14Å; F351-H353 HydrophobicContact CD2-CB 3.88Å; F351-H353 HydrophobicContact CE2-CB 3.76Å
352	T	98.2	Very high	92.4	Very high	1 Å²	1	52 Å²	52	1%	0.006	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	119.3	162	-71.3	0	0	0	0	108.3	G104 R170 I171 F172 V173 L198 N347 L354	G104-T352 PolarHBondContact O-N 3.09Å; G104-T352 VanDerWaalsContact O-N 3.08Å; G104-T352 PolarHBondContact O-OG1 3.02Å; G104-T352 VanDerWaalsContact O-OG1 3.09Å; R170-T352 PolarHBondContact NE-OG1 3.36Å; R170-T352 PolarHBondContact NH2-OG1 3.03Å; I171-T352 PolarHBondContact O-N 3.43Å; F172-T352 WeakPolarHBondContact CA-O 3.47Å; F172-T352 HydrophobicContact CD1-CG2 3.94Å; F172-T352 HydrophobicContact CE1-CG2 3.97Å; V173-T352 PolarHBondContact N-O 3.28Å; L198-T352 HydrophobicContact CD1-CG2 4.33Å; N347-T352 PolarHBondContact OD1-OG1 3.45Å; T352-L354 HydrophobicContact CG2-CD2 4.19Å; T352-L354 HydrophobicContact CG2-CG 4.2Å
353	H	98.4	Very high	92.1	Very high	14 Å²	14	53.2 Å²	53.2	7%	0.065	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	120.7	179.5	-177	-151	0	0	0	110.4	F148 E175 S346 Q348 F351	F148-H353 AromaticContact CZ-CE1 3.83Å; F148-H353 AromaticContact CZ-NE2 3.95Å; E175-H353 VanDerWaalsContact CB-NE2 3.31Å; E175-H353 WeakPolarHBondContact CB-NE2 3.46Å; E175-H353 IonicContact OE2-CE1 4Å; E175-H353 PolarHBondContact OE2-CE1 3.42Å; E175-H353 IonicContact OE2-NE2 2.86Å; E175-H353 PolarHBondContact OE2-NE2 3.29Å; S346-H353 PolarHBondContact N-O 3.28Å; S346-H353 PolarHBondContact O-N 3.26Å; S346-H353 WeakPolarHBondContact OG-CB 3.31Å; Q348-H353 HydrophobicContact CG-CB 3.8Å; F351-H353 HydrophobicContact CD2-CB 3.88Å; F351-H353 HydrophobicContact CE2-CB 3.76Å
354	L	98.5	Very high	91.8	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	116.3	178.9	-62.2	173.8	0	0	0	108.9	F172 V173 I174 E175 E194 V342 R345 T352 V356	F172-L354 HydrophobicContact CD1-CD1 4.28Å; V173-L354 PolarHBondContact O-N 3.45Å; I174-L354 HydrophobicContact CD1-CB 4.05Å; I174-L354 HydrophobicContact CD1-CD1 3.61Å; I174-L354 HydrophobicContact CD1-CG 4.25Å; E175-L354 PolarHBondContact N-O 3.28Å; E194-L354 HydrophobicContact CB-CD1 3.42Å; E194-L354 VanDerWaalsContact CB-CD1 3.42Å; E194-L354 HydrophobicContact CG-CD1 3.91Å; V342-L354 HydrophobicContact CG1-CD2 4.37Å; R345-L354 HydrophobicContact CB-CD2 3.77Å; R345-L354 HydrophobicContact CG-CD2 3.38Å; T352-L354 HydrophobicContact CG2-CD2 4.19Å; T352-L354 HydrophobicContact CG2-CG 4.2Å; L354-V356 HydrophobicContact CB-CG1 4.28Å
355	R	98.4	Very high	91.5	Very high	90 Å²	90	54.7 Å²	54.7	34%	0.34	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	119.4	173.7	-56.9	-175.6	68.5	-144	-1.9	108.1	E175 I177 I343 T344	E175-R355 WeakPolarHBondContact OE2-CD 3.47Å; E175-R355 VanDerWaalsContact OE2-CG 3.28Å; E175-R355 WeakPolarHBondContact OE2-CG 3.43Å; E175-R355 IonicContact OE2-CZ 2.97Å; E175-R355 IonicContact OE2-NE 2.77Å; E175-R355 PolarHBondContact OE2-NE 3.04Å; I177-R355 HydrophobicContact CD1-CB 4.27Å; I177-R355 HydrophobicContact CG2-CB 3.85Å; I177-R355 HydrophobicContact CG2-CG 4.33Å; I343-R355 PolarHBondContact N-O 3.27Å; T344-R355 PolarHBondContact N-O 3.27Å; T344-R355 PolarHBondContact O-N 3.03Å; T344-R355 WeakPolarHBondContact OG1-CB 3.46Å; T344-R355 WeakPolarHBondContact OG1-CD 3.31Å; T344-R355 VanDerWaalsContact OG1-CG 3.22Å; T344-R355 WeakPolarHBondContact OG1-CG 3.42Å
356	V	98.2	Very high	91.1	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	142	-170	-55.4	0	0	0	0	111.7	I174 E175 I177 L187 V190 K341 V342 L354 I358	I174-V356 HydrophobicContact CG2-CG1 4.35Å; I174-V356 HydrophobicContact CG2-CG2 3.84Å; E175-V356 PolarHBondContact O-N 3.05Å; I177-V356 PolarHBondContact N-O 2.84Å; I177-V356 VanDerWaalsContact N-O 3.09Å; L187-V356 HydrophobicContact CD2-CG2 3.63Å; V190-V356 HydrophobicContact CG1-CG1 4Å; V190-V356 HydrophobicContact CG1-CG2 4.42Å; K341-V356 CarbonylContact O-C 3.51Å; K341-V356 VanDerWaalsContact O-CA 3.32Å; K341-V356 WeakPolarHBondContact O-CA 3.49Å; V342-V356 HydrophobicContact CG2-CG1 4.18Å; L354-V356 HydrophobicContact CB-CG1 4.28Å; V356-I358 HydrophobicContact CG2-CG2 4.21Å
357	L	96.7	Very high	90.8	Very high	48 Å²	48	51.5 Å²	51.5	25%	0.251	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	122.9	163.2	-65.3	175.2	0	0	0	108.1	I177 D178 Y340 K341 I343	I177-L357 HydrophobicContact CD1-CD2 4.24Å; I177-L357 HydrophobicContact CG1-CD2 3.68Å; I177-L357 HydrophobicContact CG1-CG 4.3Å; D178-L357 HydrophobicContact CB-CD2 3.9Å; Y340-L357 WeakPolarHBondContact CA-O 3.44Å; K341-L357 HydrophobicContact CB-CB 4.43Å; K341-L357 PolarHBondContact N-O 3.5Å; K341-L357 PolarHBondContact O-N 3.26Å; I343-L357 HydrophobicContact CD1-CD1 3.72Å; I343-L357 HydrophobicContact CD1-CG 3.96Å; I343-L357 HydrophobicContact CG1-CD1 4.17Å; I343-L357 HydrophobicContact CG1-CG 3.85Å
358	I	92.4	Very high	90.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.249	C	C	.	.			trans	-121.9	88.8	169.7	50.6	160.7	0	0	0	106.1	Q176 D178 N183 K186 L187 V190 W272 V356	Q176-I358 HydrophobicContact CB-CG1 4.4Å; Q176-I358 HydrophobicContact CG-CD1 4.14Å; Q176-I358 HydrophobicContact CG-CG1 3.7Å; D178-I358 PolarHBondContact OD2-N 2.93Å; D178-I358 VanDerWaalsContact OD2-O 3.14Å; N183-I358 HydrophobicContact CB-CD1 3.98Å; K186-I358 HydrophobicContact CB-CD1 4.09Å; K186-I358 HydrophobicContact CD-CB 3.95Å; K186-I358 HydrophobicContact CD-CD1 4.23Å; K186-I358 HydrophobicContact CD-CG2 4.26Å; K186-I358 HydrophobicContact CG-CB 4.28Å; K186-I358 HydrophobicContact CG-CD1 4.12Å; K186-I358 HydrophobicContact CG-CG2 4.13Å; L187-I358 HydrophobicContact CD1-CD1 4.5Å; L187-I358 HydrophobicContact CD2-CD1 3.61Å; L187-I358 HydrophobicContact CD2-CG1 4.13Å; L187-I358 HydrophobicContact CG-CD1 3.69Å; V190-I358 HydrophobicContact CG2-CG2 4.1Å; W272-I358 HydrophobicContact CH2-CD1 4.34Å; W272-I358 HydrophobicContact CH2-CG1 4.41Å; W272-I358 WeakPolarHBondContact CH2-O 3.45Å; V356-I358 HydrophobicContact CG2-CG2 4.21Å
359	K	81.1	Confident	90.3	Very high	142 Å²	142	47 Å²	47	62%	0.617	25%	0.247	S	C	*	.			trans	-73.9	149.1	175.7	-67.3	-172.4	176.1	-171.7	0	109.9	K186 S361	K186-K359 PolarHBondContact NZ-O 3.26Å; K359-S361 PolarHBondContact O-N 3.45Å
360	Q	69.8	Low	90.4	Very high	105 Å²	105	47.8 Å²	47.8	49%	0.491	25%	0.247	S	C	.	.			trans	-63.4	129.6	160.9	-167.8	168.5	0.9	0	0	107.4	W272	W272-Q360 HydrophobicContact CH2-CB 4.45Å; W272-Q360 HydrophobicContact CZ2-CB 3.96Å; W272-Q360 HydrophobicContact CZ2-CG 4.38Å
361	S	62	Low	90.1	Very high	166 Å²	166	51.6 Å²	51.6	100%	1.161	27%	0.267	S	S	*	.			trans	-65.7	0	-179.9	55.6	0	0	0	0	111.9	K359	K359-S361 PolarHBondContact O-N 3.45Å

Retrieved 361 of 361 residues in 84.4 ms (Link to these results)

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