A0A087XTS4_POEFO Loading...

Myoneurin

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession A0A087XTS4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 509 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	A	31.6	Very low	40.6	Very low	147 Å²	147	77.7 Å²	77.7	100%	1.215	58%	0.578	S	S	*	*				0	140.6	0	0	0	0	0	0	109.8
2	P	39.7	Very low	41	Very low	90 Å²	90	82.6 Å²	82.6	58%	0.584	58%	0.582	S	S	*	*			trans	-68.4	154.8	168.5	31.6	-35	0	0	0	110.5	A6	P2-A6 HydrophobicContact CB-CB 4.26Å
3	P	47.1	Very low	41.1	Very low	98 Å²	98	83.1 Å²	83.1	64%	0.636	57%	0.573	S	S	*	*			trans	-62.4	145.6	175.4	27.1	-34.5	0	0	0	110.5	A5 A6 A7	P3-A5 PolarHBondContact O-N 3.47Å; P3-A6 HydrophobicContact CG-CB 4.2Å; P3-A6 WeakPolarHBondContact O-CB 3.47Å; P3-A6 PolarHBondContact O-N 3.29Å; P3-A7 PolarHBondContact O-N 3.3Å
4	A	42.1	Very low	41.4	Very low	85 Å²	85	78.9 Å²	78.9	70%	0.702	55%	0.547	S	S	*	.	H	α-helix	trans	-54	-31.7	-171.3	0	0	0	0	0	114.4	A6 A7 A8	A4-A6 VanDerWaalsContact C-N 3.32Å; A4-A6 PolarHBondContact O-N 3.42Å; A4-A7 PolarHBondContact O-N 3.01Å; A4-A8 WeakPolarHBondContact O-CB 3.5Å; A4-A8 PolarHBondContact O-N 3.27Å
5	A	38.5	Very low	41.7	Very low	79 Å²	79	77.8 Å²	77.8	65%	0.653	54%	0.54	S	S	*	.	H	α-helix	trans	-61.7	-35.3	173.9	0	0	0	0	0	113.5	P3 A9	P3-A5 PolarHBondContact O-N 3.47Å; A5-A9 WeakPolarHBondContact O-CB 3.4Å; A5-A9 PolarHBondContact O-N 3.27Å
6	A	36.5	Very low	41.9	Very low	39 Å²	39	79.6 Å²	79.6	32%	0.322	54%	0.537	S	S	.	.	H	α-helix	trans	-73.9	-37.8	176.3	0	0	0	0	0	111.6	P2 P3 A4 A9 M10	P2-A6 HydrophobicContact CB-CB 4.26Å; P3-A6 HydrophobicContact CG-CB 4.2Å; P3-A6 WeakPolarHBondContact O-CB 3.47Å; P3-A6 PolarHBondContact O-N 3.29Å; A4-A6 VanDerWaalsContact C-N 3.32Å; A4-A6 PolarHBondContact O-N 3.42Å; A6-A9 PolarHBondContact O-N 2.92Å; A6-M10 WeakPolarHBondContact O-CB 3.46Å; A6-M10 WeakPolarHBondContact O-CG 3.25Å; A6-M10 PolarHBondContact O-N 2.97Å
7	A	40.3	Very low	42	Very low	52 Å²	52	76.6 Å²	76.6	43%	0.43	52%	0.523	S	S	.	.	H	α-helix	trans	-62.4	-43.4	172.1	0	0	0	0	0	111.5	P3 A4 M10 A11	P3-A7 PolarHBondContact O-N 3.3Å; A4-A7 PolarHBondContact O-N 3.01Å; A7-M10 PolarHBondContact O-N 2.9Å; A7-A11 WeakPolarHBondContact O-CB 3.47Å; A7-A11 PolarHBondContact O-N 3Å
8	A	41.1	Very low	42.2	Very low	49 Å²	49	81.4 Å²	81.4	41%	0.405	53%	0.528	S	S	.	.	H	α-helix	trans	-61.8	-43.3	174.5	0	0	0	0	0	112.5	A4 A11 Q12	A4-A8 WeakPolarHBondContact O-CB 3.5Å; A4-A8 PolarHBondContact O-N 3.27Å; A8-A11 PolarHBondContact O-N 2.98Å; A8-Q12 WeakPolarHBondContact O-CG 3.28Å; A8-Q12 PolarHBondContact O-N 3.1Å
9	A	41.1	Very low	42.4	Very low	43 Å²	43	81.6 Å²	81.6	36%	0.355	52%	0.523	S	S	.	.	H	α-helix	trans	-64.1	-41	176	0	0	0	0	0	112.5	A5 A6 Q12 L13	A5-A9 WeakPolarHBondContact O-CB 3.4Å; A5-A9 PolarHBondContact O-N 3.27Å; A6-A9 PolarHBondContact O-N 2.92Å; A9-Q12 PolarHBondContact O-N 3.33Å; A9-L13 WeakPolarHBondContact O-CB 3.35Å; A9-L13 WeakPolarHBondContact O-CG 3.25Å; A9-L13 PolarHBondContact O-N 3.26Å
10	M	42.1	Very low	42.4	Very low	114 Å²	114	79.9 Å²	79.9	56%	0.562	51%	0.509	S	S	*	.	H	α-helix	trans	-63	-42.9	174.9	-68.7	-87.7	-82.3	0	0	111.4	A6 A7 Q12 L13 A14 L121	A6-M10 WeakPolarHBondContact O-CB 3.46Å; A6-M10 WeakPolarHBondContact O-CG 3.25Å; A6-M10 PolarHBondContact O-N 2.97Å; A7-M10 PolarHBondContact O-N 2.9Å; M10-Q12 PolarHBondContact O-N 3Å; M10-L13 PolarHBondContact O-N 3.47Å; M10-A14 WeakPolarHBondContact O-CB 3.34Å; M10-A14 PolarHBondContact O-N 3.44Å; M10-L121 HydrophobicContact CE-CD2 4.22Å
11	A	46.6	Very low	42.4	Very low	59 Å²	59	80.3 Å²	80.3	49%	0.488	51%	0.508	S	S	.	.	H	α-helix	trans	-64.2	-38.3	175.9	0	0	0	0	0	112.7	A7 A8 A14 S15	A7-A11 WeakPolarHBondContact O-CB 3.47Å; A7-A11 PolarHBondContact O-N 3Å; A8-A11 PolarHBondContact O-N 2.98Å; A11-A14 PolarHBondContact O-N 3.48Å; A11-S15 PolarHBondContact O-N 3.12Å; A11-S15 PolarHBondContact O-OG 2.82Å
12	Q	45.1	Very low	43.1	Very low	136 Å²	136	79.3 Å²	79.3	64%	0.636	48%	0.478	S	S	*	.	H	α-helix	trans	-68.1	-41.1	174.2	-73	176.6	1.1	0	0	112.3	A8 A9 M10 A14 S15 H16	A8-Q12 WeakPolarHBondContact O-CG 3.28Å; A8-Q12 PolarHBondContact O-N 3.1Å; A9-Q12 PolarHBondContact O-N 3.33Å; M10-Q12 PolarHBondContact O-N 3Å; Q12-A14 VanDerWaalsContact C-N 3.34Å; Q12-A14 PolarHBondContact O-N 2.77Å; Q12-S15 PolarHBondContact O-N 3.14Å; Q12-S15 PolarHBondContact O-OG 3.07Å; Q12-H16 WeakPolarHBondContact O-CB 3.47Å; Q12-H16 PolarHBondContact O-N 3.34Å
13	L	43.1	Very low	43.3	Very low	89 Å²	89	81.1 Å²	81.1	47%	0.466	47%	0.473	S	S	.	.	H	α-helix	trans	-62.7	-40.6	172.4	-76.6	163.8	0	0	0	111.5	A9 M10 H16 G17	A9-L13 WeakPolarHBondContact O-CB 3.35Å; A9-L13 WeakPolarHBondContact O-CG 3.25Å; A9-L13 PolarHBondContact O-N 3.26Å; M10-L13 PolarHBondContact O-N 3.47Å; L13-H16 PolarHBondContact O-N 2.91Å; L13-G17 PolarHBondContact O-N 2.93Å
14	A	44.6	Very low	42.9	Very low	25 Å²	25	79.4 Å²	79.4	21%	0.207	46%	0.458	C	S	.	.	H	α-helix	trans	-69.5	-30.9	177.9	0	0	0	0	0	113.4	M10 A11 Q12 R18	M10-A14 WeakPolarHBondContact O-CB 3.34Å; M10-A14 PolarHBondContact O-N 3.44Å; A11-A14 PolarHBondContact O-N 3.48Å; Q12-A14 VanDerWaalsContact C-N 3.34Å; Q12-A14 PolarHBondContact O-N 2.77Å; A14-R18 WeakPolarHBondContact O-CG 3.17Å; A14-R18 PolarHBondContact O-N 3.28Å; A14-R18 PolarHBondContact O-NE 3.42Å
15	S	46.4	Very low	42.9	Very low	62 Å²	62	83.5 Å²	83.5	43%	0.434	46%	0.462	S	S	.	.	H	α-helix	trans	-76.3	-40.6	172.9	66.9	0	0	0	0	111.7	A11 Q12 R18 L19	A11-S15 PolarHBondContact O-N 3.12Å; A11-S15 PolarHBondContact O-OG 2.82Å; Q12-S15 PolarHBondContact O-N 3.14Å; Q12-S15 PolarHBondContact O-OG 3.07Å; S15-R18 PolarHBondContact O-N 2.94Å; S15-L19 PolarHBondContact O-N 3.39Å; S15-L19 VanDerWaalsContact O-N 3.1Å
16	H	45.4	Very low	43.2	Very low	106 Å²	106	87.4 Å²	87.4	49%	0.491	47%	0.467	S	S	.	.	H	α-helix	trans	-64.9	-41.1	175.5	-140.9	140.2	0	0	0	111.8	Q12 L13 R18 L19 L20	Q12-H16 WeakPolarHBondContact O-CB 3.47Å; Q12-H16 PolarHBondContact O-N 3.34Å; L13-H16 PolarHBondContact O-N 2.91Å; H16-R18 PolarHBondContact O-N 3.02Å; H16-L19 WeakPolarHBondContact O-CB 3.43Å; H16-L19 PolarHBondContact O-N 3.31Å; H16-L20 WeakPolarHBondContact O-CG 3.04Å; H16-L20 PolarHBondContact O-N 3.33Å
17	G	43	Very low	43.5	Very low	29 Å²	29	90.3 Å²	90.3	30%	0.299	47%	0.474	S	S	.	.	H	α-helix	trans	-61.5	-41	175	0	0	0	0	0	113.2	L13 L20 L21	L13-G17 PolarHBondContact O-N 2.93Å; G17-L20 PolarHBondContact O-N 3.45Å; G17-L21 WeakPolarHBondContact O-CB 3.33Å; G17-L21 WeakPolarHBondContact O-CG 3.39Å; G17-L21 PolarHBondContact O-N 3.39Å
18	R	45.9	Very low	43.5	Very low	164 Å²	164	98.6 Å²	98.6	62%	0.619	49%	0.494	S	S	*	.	H	α-helix	trans	-63.7	-41.6	173.9	-79.3	176.9	-84.3	-152.6	-0	112.1	A14 S15 H16 L20 L21 Q22	A14-R18 WeakPolarHBondContact O-CG 3.17Å; A14-R18 PolarHBondContact O-N 3.28Å; A14-R18 PolarHBondContact O-NE 3.42Å; S15-R18 PolarHBondContact O-N 2.94Å; H16-R18 PolarHBondContact O-N 3.02Å; R18-L20 PolarHBondContact O-N 2.86Å; R18-L21 PolarHBondContact O-N 3.36Å; R18-Q22 PolarHBondContact O-N 2.78Å
19	L	45.9	Very low	43.8	Very low	84 Å²	84	104.4 Å²	104.4	44%	0.44	51%	0.513	S	S	.	.	H	α-helix	trans	-63.5	-36.6	173.1	-98	159.1	0	0	0	113.3	S15 H16 R23	S15-L19 PolarHBondContact O-N 3.39Å; S15-L19 VanDerWaalsContact O-N 3.1Å; H16-L19 WeakPolarHBondContact O-CB 3.43Å; H16-L19 PolarHBondContact O-N 3.31Å; L19-R23 WeakPolarHBondContact O-CG 3.39Å; L19-R23 PolarHBondContact O-N 2.7Å
20	L	42.8	Very low	43.6	Very low	47 Å²	47	110.8 Å²	110.8	25%	0.246	54%	0.537	C	S	.	.	H	α-helix	trans	-71.4	-43	175.7	-76.3	164.4	0	0	0	111.9	H16 G17 R18 Q22 R23 L24	H16-L20 WeakPolarHBondContact O-CG 3.04Å; H16-L20 PolarHBondContact O-N 3.33Å; G17-L20 PolarHBondContact O-N 3.45Å; R18-L20 PolarHBondContact O-N 2.86Å; L20-Q22 VanDerWaalsContact C-N 3.27Å; L20-Q22 PolarHBondContact O-N 3.48Å; L20-R23 PolarHBondContact O-N 3.17Å; L20-R23 VanDerWaalsContact O-N 3.12Å; L20-L24 WeakPolarHBondContact O-CG 3.3Å; L20-L24 PolarHBondContact O-N 3.07Å
21	L	42.5	Very low	43.7	Very low	90 Å²	90	109.5 Å²	109.5	47%	0.471	53%	0.533	S	S	.	.	H	α-helix	trans	-58.1	-39.8	173.4	-75.2	166.6	0	0	0	111.8	G17 R18 R23 L24 H25 F114	G17-L21 WeakPolarHBondContact O-CB 3.33Å; G17-L21 WeakPolarHBondContact O-CG 3.39Å; G17-L21 PolarHBondContact O-N 3.39Å; R18-L21 PolarHBondContact O-N 3.36Å; L21-R23 VanDerWaalsContact C-N 3.33Å; L21-R23 PolarHBondContact O-N 3.32Å; L21-L24 PolarHBondContact O-N 3.33Å; L21-H25 WeakPolarHBondContact O-CB 3.41Å; L21-H25 PolarHBondContact O-N 3.14Å; L21-F114 HydrophobicContact CD1-CZ 4.48Å; L21-F114 HydrophobicContact CD2-CZ 4.47Å
22	Q	45.4	Very low	43.5	Very low	125 Å²	125	109.7 Å²	109.7	58%	0.584	52%	0.523	S	S	*	.	H	α-helix	trans	-64.3	-35	176.5	-163.8	176.4	21.6	0	0	112.8	R18 L20 Q26	R18-Q22 PolarHBondContact O-N 2.78Å; L20-Q22 VanDerWaalsContact C-N 3.27Å; L20-Q22 PolarHBondContact O-N 3.48Å; Q22-Q26 PolarHBondContact O-N 3.35Å
23	R	42.8	Very low	43.2	Very low	128 Å²	128	107.6 Å²	107.6	48%	0.483	52%	0.515	S	S	.	.	H	α-helix	trans	-72.9	-45.4	173.4	-66.8	174.9	-167.7	167.8	7	111.9	L19 L20 L21 H25 Q26 Q27	L19-R23 WeakPolarHBondContact O-CG 3.39Å; L19-R23 PolarHBondContact O-N 2.7Å; L20-R23 PolarHBondContact O-N 3.17Å; L20-R23 VanDerWaalsContact O-N 3.12Å; L21-R23 VanDerWaalsContact C-N 3.33Å; L21-R23 PolarHBondContact O-N 3.32Å; R23-H25 VanDerWaalsContact C-N 3.27Å; R23-H25 PolarHBondContact O-N 2.85Å; R23-Q26 WeakPolarHBondContact O-CA 3.21Å; R23-Q26 PolarHBondContact O-N 3.24Å; R23-Q27 PolarHBondContact O-N 3.37Å
24	L	39.2	Very low	43	Very low	63 Å²	63	106.7 Å²	106.7	33%	0.33	52%	0.516	S	S	.	.	H	α-helix	trans	-59.6	-37	177	-72.5	167.5	0	0	0	111.8	L20 L21 Q26 Q27 D35	L20-L24 WeakPolarHBondContact O-CG 3.3Å; L20-L24 PolarHBondContact O-N 3.07Å; L21-L24 PolarHBondContact O-N 3.33Å; L24-Q26 VanDerWaalsContact C-N 3.34Å; L24-Q27 CarbonylContact O-C 3.55Å; L24-Q27 PolarHBondContact O-N 3.37Å; L24-D35 HydrophobicContact CD2-CB 4.41Å; L24-D35 WeakPolarHBondContact CD2-OD2 3.4Å
25	H	43.2	Very low	42.9	Very low	170 Å²	170	107.1 Å²	107.1	79%	0.787	51%	0.514	S	S	*	.	H	α-helix	trans	-71.1	-25.8	174.8	-165.9	-75.4	0	0	0	113.2	L21 R23	L21-H25 WeakPolarHBondContact O-CB 3.41Å; L21-H25 PolarHBondContact O-N 3.14Å; R23-H25 VanDerWaalsContact C-N 3.27Å; R23-H25 PolarHBondContact O-N 2.85Å
26	Q	44.2	Very low	42.7	Very low	162 Å²	162	106.1 Å²	106.1	76%	0.757	50%	0.504	S	S	*	.	H	α-helix	trans	-80.4	-28.8	171.3	-74.3	-175.4	-13.4	0	0	112.7	Q22 R23 L24 R28	Q22-Q26 PolarHBondContact O-N 3.35Å; R23-Q26 WeakPolarHBondContact O-CA 3.21Å; R23-Q26 PolarHBondContact O-N 3.24Å; L24-Q26 VanDerWaalsContact C-N 3.34Å; Q26-R28 PolarHBondContact O-N 3Å
27	Q	42.1	Very low	42.4	Very low	99 Å²	99	104.6 Å²	104.6	46%	0.463	50%	0.502	S	S	.	.	S	Bend	trans	-92.4	79.3	176.3	-72.8	-179.8	-105.2	0	0	111.6	R23 L24 E29	R23-Q27 PolarHBondContact O-N 3.37Å; L24-Q27 CarbonylContact O-C 3.55Å; L24-Q27 PolarHBondContact O-N 3.37Å; Q27-E29 PolarHBondContact O-N 3.42Å
28	R	40.2	Very low	42.2	Very low	227 Å²	227	106.7 Å²	106.7	86%	0.857	51%	0.506	S	S	*	.			trans	-58.5	107.9	160.4	-95	-167.2	171.3	-148.7	-0.8	109.6	Q26	Q26-R28 PolarHBondContact O-N 3Å
29	E	48.8	Very low	41.9	Very low	171 Å²	171	102 Å²	102	80%	0.799	49%	0.492	S	S	*	.	S	Bend	trans	60.9	92.5	158	-57.4	-180	157.1	0	0	116.6	Q27	Q27-E29 PolarHBondContact O-N 3.42Å
30	M	35.6	Very low	41.6	Very low	176 Å²	176	100.8 Å²	100.8	87%	0.867	49%	0.488	S	S	*	.	S	Bend		-169.7	-41.3	130	-99.2	-55.1	164.8	0	0	112.9	F32	M30-F32 PolarHBondContact O-N 2.8Å
31	D	45.3	Very low	41.4	Very low	87 Å²	87	106.3 Å²	106.3	47%	0.465	51%	0.51	S	S	.	.			trans	-93.5	12.1	-157.6	-69.7	-50.5	0	0	0	117.5	L33 C34 D35	D31-L33 PolarHBondContact O-N 2.84Å; D31-C34 HydrophobicContact CB-CB 4.24Å; D31-C34 WeakPolarHBondContact O-CA 3.44Å; D31-C34 WeakPolarHBondContact O-CB 3.46Å; D31-C34 PolarHBondContact O-N 3.17Å; D31-D35 PolarHBondContact O-N 3.49Å
32	F	41.3	Very low	41.1	Very low	64 Å²	64	107.9 Å²	107.9	28%	0.281	52%	0.519	S	S	.	.	H	α-helix	trans	-50.8	-26.6	-174.4	-171.1	-95.2	0	0	0	115.8	M30 I36 R107	M30-F32 PolarHBondContact O-N 2.8Å; F32-I36 HydrophobicContact CD1-CD1 3.89Å; F32-I36 HydrophobicContact CE1-CD1 3.62Å; F32-I36 HydrophobicContact CZ-CD1 4.36Å; F32-I36 WeakPolarHBondContact O-CG1 3.23Å; F32-I36 PolarHBondContact O-N 3.16Å; F32-R107 HydrophobicContact CE1-CG 4.14Å
33	L	39.5	Very low	40.6	Very low	91 Å²	91	103.8 Å²	103.8	48%	0.476	50%	0.502	S	S	.	.	H	α-helix	trans	-83.6	-27	175.6	-67.3	171.4	0	0	0	113.3	D31 T37 Q103	D31-L33 PolarHBondContact O-N 2.84Å; L33-T37 PolarHBondContact O-N 3.16Å; L33-T37 PolarHBondContact O-OG1 3.27Å; L33-Q103 VanDerWaalsContact CD1-NE2 3.34Å
34	C	39.4	Very low	40.2	Very low	70 Å²	70	104.9 Å²	104.9	47%	0.473	51%	0.513	S	S	.	.	H	α-helix	trans	-67.8	-45.4	171.3	-155.1	0	0	0	0	109.7	D31 I36 T37 I38	D31-C34 HydrophobicContact CB-CB 4.24Å; D31-C34 WeakPolarHBondContact O-CA 3.44Å; D31-C34 WeakPolarHBondContact O-CB 3.46Å; D31-C34 PolarHBondContact O-N 3.17Å; C34-I36 PolarHBondContact O-N 2.8Å; C34-T37 CarbonylContact O-C 3.33Å; C34-T37 WeakPolarHBondContact O-CA 3.42Å; C34-T37 WeakPolarHBondContact O-CB 3.29Å; C34-T37 PolarHBondContact O-N 2.95Å; C34-I38 WeakPolarHBondContact O-CG1 3.47Å; C34-I38 PolarHBondContact O-N 2.91Å
35	D	41.4	Very low	39.9	Very low	34 Å²	34	111.1 Å²	111.1	18%	0.182	54%	0.537	C	S	.	.	H	α-helix	trans	-63.9	-37.5	-180	-57.3	-48.2	0	0	0	112.6	L24 D31 T37 I38 M39	L24-D35 HydrophobicContact CD2-CB 4.41Å; L24-D35 WeakPolarHBondContact CD2-OD2 3.4Å; D31-D35 PolarHBondContact O-N 3.49Å; D35-T37 VanDerWaalsContact C-N 3.33Å; D35-I38 PolarHBondContact O-N 3.36Å; D35-M39 PolarHBondContact O-N 3.13Å
36	I	42	Very low	39.3	Very low	42 Å²	42	113 Å²	113	22%	0.215	54%	0.537	C	S	.	.	H	α-helix	trans	-63.5	-39.1	169.9	-70.1	168.8	0	0	0	111.5	F32 C34 I38 M39 V40	F32-I36 HydrophobicContact CD1-CD1 3.89Å; F32-I36 HydrophobicContact CE1-CD1 3.62Å; F32-I36 HydrophobicContact CZ-CD1 4.36Å; F32-I36 WeakPolarHBondContact O-CG1 3.23Å; F32-I36 PolarHBondContact O-N 3.16Å; C34-I36 PolarHBondContact O-N 2.8Å; I36-I38 VanDerWaalsContact C-N 3.25Å; I36-I38 PolarHBondContact O-N 2.96Å; I36-M39 HydrophobicContact CB-CE 4.35Å; I36-M39 HydrophobicContact CG1-CE 3.77Å; I36-M39 PolarHBondContact O-N 2.91Å; I36-V40 WeakPolarHBondContact O-CG2 3.35Å; I36-V40 PolarHBondContact O-N 2.95Å
37	T	39.7	Very low	38.9	Very low	74 Å²	74	106.7 Å²	106.7	45%	0.454	51%	0.513	S	S	.	.	H	α-helix	trans	-68.6	-26.1	177.5	-53.2	0	0	0	0	112.2	L33 C34 D35 K41	L33-T37 PolarHBondContact O-N 3.16Å; L33-T37 PolarHBondContact O-OG1 3.27Å; C34-T37 CarbonylContact O-C 3.33Å; C34-T37 WeakPolarHBondContact O-CA 3.42Å; C34-T37 WeakPolarHBondContact O-CB 3.29Å; C34-T37 PolarHBondContact O-N 2.95Å; D35-T37 VanDerWaalsContact C-N 3.33Å; T37-K41 WeakPolarHBondContact O-CG 3.47Å
38	I	39.5	Very low	38.7	Very low	72 Å²	72	104.6 Å²	104.6	37%	0.369	50%	0.503	S	S	.	.	H	α-helix	trans	-76.8	-47.9	172.3	-67.4	165.1	0	0	0	110.1	C34 D35 I36 V40 K41 D42	C34-I38 WeakPolarHBondContact O-CG1 3.47Å; C34-I38 PolarHBondContact O-N 2.91Å; D35-I38 PolarHBondContact O-N 3.36Å; I36-I38 VanDerWaalsContact C-N 3.25Å; I36-I38 PolarHBondContact O-N 2.96Å; I38-V40 VanDerWaalsContact C-N 3.26Å; I38-V40 PolarHBondContact O-N 3.25Å; I38-K41 PolarHBondContact O-N 3.21Å; I38-D42 VanDerWaalsContact CG2-OD2 3.27Å; I38-D42 WeakPolarHBondContact CG2-OD2 3.48Å; I38-D42 PolarHBondContact O-N 3.2Å
39	M	38.3	Very low	38.6	Very low	67 Å²	67	103.3 Å²	103.3	33%	0.33	50%	0.499	S	S	.	.	H	α-helix	trans	-55.5	-39.5	175.9	-75	-171.4	-68.8	0	0	113	D35 I36 K41 V43 F110	D35-M39 PolarHBondContact O-N 3.13Å; I36-M39 HydrophobicContact CB-CE 4.35Å; I36-M39 HydrophobicContact CG1-CE 3.77Å; I36-M39 PolarHBondContact O-N 2.91Å; M39-K41 PolarHBondContact O-N 3.35Å; M39-V43 WeakPolarHBondContact O-CG2 3.34Å; M39-V43 PolarHBondContact O-N 3.31Å; M39-F110 HydrophobicContact CE-CE1 4.35Å; M39-F110 HydrophobicContact CE-CE2 4.27Å; M39-F110 HydrophobicContact CE-CZ 3.63Å; M39-F110 HydrophobicContact SD-CZ 4.31Å
40	V	41.1	Very low	38	Very low	58 Å²	58	100.7 Å²	100.7	35%	0.352	49%	0.49	S	S	.	.	H	α-helix	trans	-71.2	-8.5	178.1	171	0	0	0	0	113.3	I36 I38 H48 L82	I36-V40 WeakPolarHBondContact O-CG2 3.35Å; I36-V40 PolarHBondContact O-N 2.95Å; I38-V40 VanDerWaalsContact C-N 3.26Å; I38-V40 PolarHBondContact O-N 3.25Å; V40-H48 PolarHBondContact O-CE1 3.27Å; V40-L82 HydrophobicContact CG1-CD2 3.74Å
41	K	38.9	Very low	38.1	Very low	163 Å²	163	96 Å²	96	71%	0.709	47%	0.467	S	S	*	.	H	α-helix	trans	-113.4	-34.1	179.5	-71.6	-176.1	176.7	-169.4	0	114.3	T37 I38 M39	T37-K41 WeakPolarHBondContact O-CG 3.47Å; I38-K41 PolarHBondContact O-N 3.21Å; M39-K41 PolarHBondContact O-N 3.35Å
42	D	34.3	Very low	37.8	Very low	123 Å²	123	97.4 Å²	97.4	66%	0.658	48%	0.475	S	S	*	.	H	α-helix	trans	-87.3	-15.3	-177.1	-70	-3.9	0	0	0	113	I38 E44	I38-D42 VanDerWaalsContact CG2-OD2 3.27Å; I38-D42 WeakPolarHBondContact CG2-OD2 3.48Å; I38-D42 PolarHBondContact O-N 3.2Å; D42-E44 PolarHBondContact O-N 3.17Å
43	V	35.7	Very low	37.7	Very low	39 Å²	39	96.5 Å²	96.5	24%	0.236	48%	0.478	C	S	.	.	S	Bend	trans	-79.5	110.6	169.9	175.1	0	0	0	0	109.2	M39 A47 I51	M39-V43 WeakPolarHBondContact O-CG2 3.34Å; M39-V43 PolarHBondContact O-N 3.31Å; V43-A47 HydrophobicContact CG1-CB 3.67Å; V43-I51 HydrophobicContact CG1-CD1 4.49Å
44	E	35.2	Very low	37.6	Very low	151 Å²	151	94.9 Å²	94.9	71%	0.706	48%	0.479	S	S	*	.			trans	-51.5	144.8	-172.7	-64	-168.6	151.1	0	0	114.2	D42 R46 A47 H48	D42-E44 PolarHBondContact O-N 3.17Å; E44-R46 PolarHBondContact O-N 2.66Å; E44-A47 WeakPolarHBondContact O-CB 3.43Å; E44-A47 PolarHBondContact O-N 2.86Å; E44-H48 PolarHBondContact O-N 3.49Å
45	F	31.7	Very low	37.5	Very low	193 Å²	193	95 Å²	95	85%	0.846	47%	0.471	S	S	*	.	H	α-helix	trans	-53.7	-23.1	-174.4	-154	-97.4	0	0	0	114.8	R49	F45-R49 PolarHBondContact O-N 2.87Å
46	R	31.3	Very low	37.3	Very low	209 Å²	209	96.7 Å²	96.7	79%	0.789	49%	0.486	S	S	*	.	H	α-helix	trans	-75.3	-39.5	172.8	-77.9	-179.5	170.4	164.3	-2.6	113.3	E44 H48 R49 N50	E44-R46 PolarHBondContact O-N 2.66Å; R46-H48 VanDerWaalsContact C-N 3.32Å; R46-R49 PolarHBondContact O-N 3.43Å; R46-N50 PolarHBondContact O-N 3.24Å
47	A	35	Very low	37.1	Very low	30 Å²	30	99.5 Å²	99.5	25%	0.248	50%	0.501	C	S	.	.	H	α-helix	trans	-64.5	-39.3	175.5	0	0	0	0	0	110.6	V43 E44 R49 N50 I51	V43-A47 HydrophobicContact CG1-CB 3.67Å; E44-A47 WeakPolarHBondContact O-CB 3.43Å; E44-A47 PolarHBondContact O-N 2.86Å; A47-R49 VanDerWaalsContact C-N 3.32Å; A47-R49 PolarHBondContact O-N 3.32Å; A47-N50 PolarHBondContact O-N 3.26Å; A47-N50 VanDerWaalsContact O-N 3.17Å; A47-I51 HydrophobicContact CB-CD1 4.42Å; A47-I51 WeakPolarHBondContact O-CB 3.33Å; A47-I51 WeakPolarHBondContact O-CD1 3.38Å; A47-I51 VanDerWaalsContact O-CG1 3.23Å; A47-I51 WeakPolarHBondContact O-CG1 3.49Å; A47-I51 PolarHBondContact O-N 2.81Å
48	H	39.3	Very low	37	Very low	56 Å²	56	101.7 Å²	101.7	26%	0.259	50%	0.502	S	S	.	.	H	α-helix	trans	-55.6	-41.6	171.6	-87.3	-155	0	0	0	113.1	V40 E44 R46 I51 L52	V40-H48 PolarHBondContact O-CE1 3.27Å; E44-H48 PolarHBondContact O-N 3.49Å; R46-H48 VanDerWaalsContact C-N 3.32Å; H48-I51 PolarHBondContact O-N 2.91Å; H48-L52 VanDerWaalsContact O-CB 3.29Å; H48-L52 WeakPolarHBondContact O-CB 3.31Å; H48-L52 WeakPolarHBondContact O-CG 3.43Å; H48-L52 PolarHBondContact O-N 3.29Å
49	R	36.5	Very low	36.8	Very low	200 Å²	200	104 Å²	104	76%	0.755	51%	0.509	S	S	*	.	H	α-helix	trans	-64.3	-41.3	176.7	-175.6	172.2	176.6	155.4	-0.7	112.4	F45 R46 A47 A53	F45-R49 PolarHBondContact O-N 2.87Å; R46-R49 PolarHBondContact O-N 3.43Å; A47-R49 VanDerWaalsContact C-N 3.32Å; A47-R49 PolarHBondContact O-N 3.32Å; R49-A53 WeakPolarHBondContact O-CB 3.46Å; R49-A53 PolarHBondContact O-N 2.83Å
50	N	37.2	Very low	36.9	Very low	116 Å²	116	104.1 Å²	104.1	62%	0.62	52%	0.517	S	S	*	.	H	α-helix	trans	-72.6	-36.2	179.4	-66.3	2.3	0	0	0	112.1	R46 A47 A53 A54	R46-N50 PolarHBondContact O-N 3.24Å; A47-N50 PolarHBondContact O-N 3.26Å; A47-N50 VanDerWaalsContact O-N 3.17Å; N50-A53 PolarHBondContact O-N 3.32Å; N50-A54 WeakPolarHBondContact O-CB 3.23Å; N50-A54 PolarHBondContact O-N 3.02Å
51	I	38.4	Very low	36.8	Very low	76 Å²	76	105 Å²	105	39%	0.39	52%	0.523	S	S	.	.	H	α-helix	trans	-67.6	-42.3	174.8	-70.2	164.8	0	0	0	110.4	V43 A47 H48 A54 F55	V43-I51 HydrophobicContact CG1-CD1 4.49Å; A47-I51 HydrophobicContact CB-CD1 4.42Å; A47-I51 WeakPolarHBondContact O-CB 3.33Å; A47-I51 WeakPolarHBondContact O-CD1 3.38Å; A47-I51 VanDerWaalsContact O-CG1 3.23Å; A47-I51 WeakPolarHBondContact O-CG1 3.49Å; A47-I51 PolarHBondContact O-N 2.81Å; H48-I51 PolarHBondContact O-N 2.91Å; I51-A54 PolarHBondContact O-N 2.93Å; I51-F55 HydrophobicContact CG2-CD2 3.7Å; I51-F55 HydrophobicContact CG2-CE2 3.62Å; I51-F55 VanDerWaalsContact O-CD2 3.23Å; I51-F55 WeakPolarHBondContact O-CD2 3.46Å; I51-F55 PolarHBondContact O-N 2.82Å
52	L	38.9	Very low	36.6	Very low	118 Å²	118	100.7 Å²	100.7	62%	0.618	51%	0.505	S	S	*	.	H	α-helix	trans	-67.8	-34.3	175.3	-72.3	169	0	0	0	112.5	H48 S56	H48-L52 VanDerWaalsContact O-CB 3.29Å; H48-L52 WeakPolarHBondContact O-CB 3.31Å; H48-L52 WeakPolarHBondContact O-CG 3.43Å; H48-L52 PolarHBondContact O-N 3.29Å; L52-S56 WeakPolarHBondContact O-CB 3.47Å; L52-S56 PolarHBondContact O-N 3.46Å
53	A	38.8	Very low	36.6	Very low	44 Å²	44	98.5 Å²	98.5	36%	0.364	50%	0.504	S	S	.	.	H	α-helix	trans	-63	-51.8	169.6	0	0	0	0	0	111.1	R49 N50 F55 S56 D57	R49-A53 WeakPolarHBondContact O-CB 3.46Å; R49-A53 PolarHBondContact O-N 2.83Å; N50-A53 PolarHBondContact O-N 3.32Å; A53-F55 VanDerWaalsContact C-N 3.26Å; A53-F55 PolarHBondContact O-N 3.21Å; A53-S56 CarbonylContact O-C 3.52Å; A53-S56 WeakPolarHBondContact O-CA 3.42Å; A53-S56 VanDerWaalsContact O-CB 3.25Å; A53-S56 WeakPolarHBondContact O-CB 3.35Å; A53-S56 PolarHBondContact O-N 3.28Å; A53-D57 VanDerWaalsContact O-CG 3.25Å; A53-D57 PolarHBondContact O-N 3.29Å
54	A	36.9	Very low	36.7	Very low	58 Å²	58	104.7 Å²	104.7	48%	0.479	53%	0.53	S	S	.	.	H	α-helix	trans	-59.9	-33.6	177	0	0	0	0	0	113.2	N50 I51 Y58	N50-A54 WeakPolarHBondContact O-CB 3.23Å; N50-A54 PolarHBondContact O-N 3.02Å; I51-A54 PolarHBondContact O-N 2.93Å; A54-Y58 WeakPolarHBondContact O-CB 3.33Å; A54-Y58 PolarHBondContact O-N 2.63Å
55	F	36.7	Very low	36.7	Very low	71 Å²	71	104.5 Å²	104.5	31%	0.311	53%	0.527	S	S	.	.	H	α-helix	trans	-69.1	-40.3	169.7	-86.2	-62.3	0	0	0	112.5	I51 A53 Y58 F59 I113	I51-F55 HydrophobicContact CG2-CD2 3.7Å; I51-F55 HydrophobicContact CG2-CE2 3.62Å; I51-F55 VanDerWaalsContact O-CD2 3.23Å; I51-F55 WeakPolarHBondContact O-CD2 3.46Å; I51-F55 PolarHBondContact O-N 2.82Å; A53-F55 VanDerWaalsContact C-N 3.26Å; A53-F55 PolarHBondContact O-N 3.21Å; F55-Y58 PolarHBondContact O-N 3.3Å; F55-F59 HydrophobicContact CB-CD2 4.44Å; F55-F59 HydrophobicContact CB-CE2 4.49Å; F55-F59 HydrophobicContact CD1-CE2 4.09Å; F55-F59 WeakPolarHBondContact O-CB 3.28Å; F55-F59 WeakPolarHBondContact O-CD2 3.39Å; F55-F59 PolarHBondContact O-N 3.49Å; F55-I113 HydrophobicContact CE1-CD1 4.19Å; F55-I113 HydrophobicContact CE1-CG1 4.31Å; F55-I113 HydrophobicContact CZ-CD1 3.91Å; F55-I113 HydrophobicContact CZ-CG1 4.19Å; F55-I113 HydrophobicContact CZ-CG2 4.08Å
56	S	37.8	Very low	36.9	Very low	70 Å²	70	98.3 Å²	98.3	49%	0.49	52%	0.518	S	S	.	.	H	α-helix	trans	-58.6	-50.8	174.2	-166.3	0	0	0	0	110.7	L52 A53 Y58 F59 S60	L52-S56 WeakPolarHBondContact O-CB 3.47Å; L52-S56 PolarHBondContact O-N 3.46Å; A53-S56 CarbonylContact O-C 3.52Å; A53-S56 WeakPolarHBondContact O-CA 3.42Å; A53-S56 VanDerWaalsContact O-CB 3.25Å; A53-S56 WeakPolarHBondContact O-CB 3.35Å; A53-S56 PolarHBondContact O-N 3.28Å; S56-Y58 PolarHBondContact O-N 2.89Å; S56-F59 PolarHBondContact O-N 3.08Å; S56-S60 PolarHBondContact O-N 2.84Å; S56-S60 PolarHBondContact O-OG 2.91Å
57	D	38.4	Very low	37	Very low	102 Å²	102	96.6 Å²	96.6	55%	0.545	52%	0.519	S	S	.	.	H	α-helix	trans	-63.3	-41.8	180	-56.9	-26.8	0	0	0	111.1	A53 S60 V61	A53-D57 VanDerWaalsContact O-CG 3.25Å; A53-D57 PolarHBondContact O-N 3.29Å; D57-S60 WeakPolarHBondContact O-CB 3.45Å; D57-S60 PolarHBondContact O-N 3.35Å; D57-V61 WeakPolarHBondContact O-CG2 3.29Å; D57-V61 PolarHBondContact O-N 3.44Å
58	Y	38.3	Very low	36.7	Very low	119 Å²	119	103.9 Å²	103.9	47%	0.467	55%	0.547	S	S	.	.	H	α-helix	trans	-62.4	-42.4	173.6	-177.6	-89.7	0	0	0	112.2	A54 F55 S56 V61 Q62	A54-Y58 WeakPolarHBondContact O-CB 3.33Å; A54-Y58 PolarHBondContact O-N 2.63Å; F55-Y58 PolarHBondContact O-N 3.3Å; S56-Y58 PolarHBondContact O-N 2.89Å; Y58-V61 PolarHBondContact O-N 3.08Å; Y58-Q62 HydrophobicContact CD1-CG 4.04Å; Y58-Q62 HydrophobicContact CE1-CG 3.66Å; Y58-Q62 VanDerWaalsContact O-CG 3.27Å; Y58-Q62 WeakPolarHBondContact O-CG 3.47Å; Y58-Q62 PolarHBondContact O-N 2.92Å; Y58-Q62 PolarHBondContact OH-NE2 2.93Å
59	F	35.3	Very low	36.2	Very low	120 Å²	120	109.9 Å²	109.9	53%	0.526	57%	0.573	S	S	.	*	H	α-helix	trans	-70.5	-31.3	176.8	-79.3	-60.3	0	0	0	112.6	F55 S56 Q62 A63	F55-F59 HydrophobicContact CB-CD2 4.44Å; F55-F59 HydrophobicContact CB-CE2 4.49Å; F55-F59 HydrophobicContact CD1-CE2 4.09Å; F55-F59 WeakPolarHBondContact O-CB 3.28Å; F55-F59 WeakPolarHBondContact O-CD2 3.39Å; F55-F59 PolarHBondContact O-N 3.49Å; S56-F59 PolarHBondContact O-N 3.08Å; F59-Q62 PolarHBondContact O-N 2.98Å; F59-A63 WeakPolarHBondContact O-CB 3.32Å; F59-A63 PolarHBondContact O-N 2.91Å
60	S	39	Very low	35.8	Very low	71 Å²	71	105.9 Å²	105.9	50%	0.497	57%	0.571	S	S	.	*	H	α-helix	trans	-61.2	-48.2	168.5	-67.5	0	0	0	0	111.5	S56 D57 Q62 A63 E64	S56-S60 PolarHBondContact O-N 2.84Å; S56-S60 PolarHBondContact O-OG 2.91Å; D57-S60 WeakPolarHBondContact O-CB 3.45Å; D57-S60 PolarHBondContact O-N 3.35Å; S60-Q62 VanDerWaalsContact C-N 3.27Å; S60-Q62 PolarHBondContact O-N 3.34Å; S60-A63 WeakPolarHBondContact O-CB 3.41Å; S60-A63 PolarHBondContact O-N 3.26Å; S60-E64 PolarHBondContact O-N 3.39Å
61	V	39.2	Very low	35.7	Very low	77 Å²	77	106.6 Å²	106.6	47%	0.467	58%	0.58	S	S	.	*	H	α-helix	trans	-66.7	-24.9	178.2	171.6	0	0	0	0	113.2	D57 Y58	D57-V61 WeakPolarHBondContact O-CG2 3.29Å; D57-V61 PolarHBondContact O-N 3.44Å; Y58-V61 PolarHBondContact O-N 3.08Å
62	Q	34.4	Very low	35.1	Very low	71 Å²	71	110.2 Å²	110.2	33%	0.332	60%	0.599	S	S	.	*	H	α-helix	trans	-87.5	-24.2	173.5	-63.1	-65.9	-6	0	0	113.1	Y58 F59 S60 E64 K65	Y58-Q62 HydrophobicContact CD1-CG 4.04Å; Y58-Q62 HydrophobicContact CE1-CG 3.66Å; Y58-Q62 VanDerWaalsContact O-CG 3.27Å; Y58-Q62 WeakPolarHBondContact O-CG 3.47Å; Y58-Q62 PolarHBondContact O-N 2.92Å; Y58-Q62 PolarHBondContact OH-NE2 2.93Å; F59-Q62 PolarHBondContact O-N 2.98Å; S60-Q62 VanDerWaalsContact C-N 3.27Å; S60-Q62 PolarHBondContact O-N 3.34Å; Q62-E64 VanDerWaalsContact C-N 3.27Å; Q62-E64 PolarHBondContact O-N 2.94Å; Q62-K65 PolarHBondContact O-N 3.32Å
63	A	35.3	Very low	34.6	Very low	77 Å²	77	107.9 Å²	107.9	64%	0.636	59%	0.588	S	S	*	*	H	α-helix	trans	-63.7	-34.6	173.5	0	0	0	0	0	111.7	F59 S60 K65 G66	F59-A63 WeakPolarHBondContact O-CB 3.32Å; F59-A63 PolarHBondContact O-N 2.91Å; S60-A63 WeakPolarHBondContact O-CB 3.41Å; S60-A63 PolarHBondContact O-N 3.26Å; A63-K65 PolarHBondContact O-N 3.12Å; A63-K65 VanDerWaalsContact O-N 3.13Å; A63-G66 PolarHBondContact O-N 3.31Å
64	E	36.6	Very low	34.4	Very low	169 Å²	169	110.7 Å²	110.7	79%	0.79	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-10.5	172	-64	-176.7	155.9	0	0	113.9	S60 Q62	S60-E64 PolarHBondContact O-N 3.39Å; Q62-E64 VanDerWaalsContact C-N 3.27Å; Q62-E64 PolarHBondContact O-N 2.94Å
65	K	35.6	Very low	34.2	Very low	147 Å²	147	114.4 Å²	114.4	64%	0.639	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.2	4.6	-177	-66.1	-173.7	176.6	-179.7	0	115.1	Q62 A63 E67	Q62-K65 PolarHBondContact O-N 3.32Å; A63-K65 PolarHBondContact O-N 3.12Å; A63-K65 VanDerWaalsContact O-N 3.13Å; K65-E67 PolarHBondContact O-N 3.16Å
66	G	36.2	Very low	33.9	Very low	63 Å²	63	117.4 Å²	117.4	65%	0.649	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.2	19.4	156.1	0	0	0	0	0	117.9	A63 E68	A63-G66 PolarHBondContact O-N 3.31Å; G66-E68 PolarHBondContact O-N 3.07Å
67	E	32.6	Very low	33.8	Very low	174 Å²	174	117.9 Å²	117.9	81%	0.813	62%	0.622	S	S	*	*			trans	-79.3	101.6	170.5	-71	-164.1	154.3	0	0	111	K65 F69	K65-E67 PolarHBondContact O-N 3.16Å; E67-F69 PolarHBondContact O-N 3.02Å
68	E	30.1	Very low	33.7	Very low	182 Å²	182	117.6 Å²	117.6	85%	0.85	63%	0.628	S	S	*	*			trans	-62.3	119.4	173.7	-71.6	-166.9	113.6	0	0	111.9	G66	G66-E68 PolarHBondContact O-N 3.07Å
69	F	27.9	Very low	33.5	Very low	183 Å²	183	121.2 Å²	121.2	80%	0.803	64%	0.641	S	S	*	*			trans	-120.5	116.4	159.4	-107.6	-87.9	0	0	0	110.1	E67 T71	E67-F69 PolarHBondContact O-N 3.02Å; F69-T71 PolarHBondContact O-N 3.34Å
70	T	29.4	Very low	33.3	Very low	116 Å²	116	122.3 Å²	122.3	71%	0.712	64%	0.643	S	S	*	*			trans	-70	123.7	-166.5	37	0	0	0	0	113.7
71	T	33.1	Very low	33.4	Very low	131 Å²	131	121.5 Å²	121.5	80%	0.804	64%	0.637	S	S	*	*	S	Bend	trans	62.6	55.5	151.5	58.5	0	0	0	0	117.9	F69	F69-T71 PolarHBondContact O-N 3.34Å
72	L	26.8	Very low	33.4	Very low	151 Å²	151	122.7 Å²	122.7	79%	0.791	64%	0.64	S	S	*	*			trans	-120.4	108.9	132.7	-85.4	179.1	0	0	0	109.3	P74	L72-P74 WeakPolarHBondContact O-CD 3.37Å
73	D	28.8	Very low	33.6	Very low	70 Å²	70	126.4 Å²	126.4	37%	0.374	66%	0.657	S	S	.	*			trans	-60.5	111.9	-172.6	-168.7	-4.9	0	0	0	111.6	E75 K76 V77	D73-E75 VanDerWaalsContact C-N 3.29Å; D73-E75 PolarHBondContact O-N 2.95Å; D73-K76 HydrophobicContact CB-CB 4.24Å; D73-K76 HydrophobicContact CB-CD 4.07Å; D73-K76 HydrophobicContact CB-CG 4.03Å; D73-K76 WeakPolarHBondContact O-CB 3.47Å; D73-K76 PolarHBondContact O-N 2.96Å; D73-K76 IonicContact OD2-NZ 3.93Å; D73-K76 PolarHBondContact OD2-NZ 3.28Å; D73-V77 PolarHBondContact O-N 2.8Å
74	P	34.6	Very low	33.7	Very low	103 Å²	103	128.1 Å²	128.1	67%	0.669	65%	0.65	S	S	*	*	H	α-helix	trans	-58.5	-37	-168.6	-27.7	36	0	0	0	113.9	L72 K76 V77 S78	L72-P74 WeakPolarHBondContact O-CD 3.37Å; P74-K76 VanDerWaalsContact C-N 3.26Å; P74-K76 PolarHBondContact O-N 2.82Å; P74-V77 PolarHBondContact O-N 3.14Å; P74-S78 PolarHBondContact O-N 2.92Å
75	E	31.6	Very low	33.9	Very low	136 Å²	136	124.2 Å²	124.2	64%	0.636	64%	0.635	S	S	*	*	H	α-helix	trans	-61.4	-35.1	176	-65.5	-157.3	151.3	0	0	112.3	D73 S78	D73-E75 VanDerWaalsContact C-N 3.29Å; D73-E75 PolarHBondContact O-N 2.95Å; E75-S78 PolarHBondContact O-N 3.24Å; E75-S78 PolarHBondContact O-OG 3.29Å
76	K	31.3	Very low	34.2	Very low	134 Å²	134	121.7 Å²	121.7	58%	0.583	63%	0.628	S	S	*	*	H	α-helix	trans	-73.5	-34.1	178.4	-63.7	-170.8	172.3	81.2	0	111.6	D73 P74 S78 R79	D73-K76 HydrophobicContact CB-CB 4.24Å; D73-K76 HydrophobicContact CB-CD 4.07Å; D73-K76 HydrophobicContact CB-CG 4.03Å; D73-K76 WeakPolarHBondContact O-CB 3.47Å; D73-K76 PolarHBondContact O-N 2.96Å; D73-K76 IonicContact OD2-NZ 3.93Å; D73-K76 PolarHBondContact OD2-NZ 3.28Å; P74-K76 VanDerWaalsContact C-N 3.26Å; P74-K76 PolarHBondContact O-N 2.82Å; K76-S78 VanDerWaalsContact C-N 3.32Å; K76-S78 PolarHBondContact O-N 3.32Å; K76-R79 PolarHBondContact O-N 3Å
77	V	35.7	Very low	34.4	Very low	79 Å²	79	124.4 Å²	124.4	48%	0.479	62%	0.623	S	S	.	*	H	α-helix	trans	-64.1	-37.5	174.9	-177.9	0	0	0	0	111.1	D73 P74 R79 Y80	D73-V77 PolarHBondContact O-N 2.8Å; P74-V77 PolarHBondContact O-N 3.14Å; V77-R79 PolarHBondContact O-N 3.3Å; V77-R79 VanDerWaalsContact O-N 3.07Å; V77-Y80 PolarHBondContact O-N 2.95Å
78	S	36.8	Very low	34.7	Very low	96 Å²	96	121.8 Å²	121.8	67%	0.671	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	-22.2	178.8	79.4	0	0	0	0	115	P74 E75 K76	P74-S78 PolarHBondContact O-N 2.92Å; E75-S78 PolarHBondContact O-N 3.24Å; E75-S78 PolarHBondContact O-OG 3.29Å; K76-S78 VanDerWaalsContact C-N 3.32Å; K76-S78 PolarHBondContact O-N 3.32Å
79	R	33.2	Very low	35.2	Very low	196 Å²	196	114.8 Å²	114.8	74%	0.74	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	-4.5	-173.3	-61.5	-175.1	-173.6	167.9	7.1	114.6	K76 V77	K76-R79 PolarHBondContact O-N 3Å; V77-R79 PolarHBondContact O-N 3.3Å; V77-R79 VanDerWaalsContact O-N 3.07Å
80	Y	31.9	Very low	35.8	Very low	143 Å²	143	114.7 Å²	114.7	56%	0.561	58%	0.575	S	S	*	*	S	Bend	trans	-102.1	113.5	174.7	-82.5	-98.9	0	0	0	110.3	V77 K84	V77-Y80 PolarHBondContact O-N 2.95Å; Y80-K84 HydrophobicContact CD1-CB 3.85Å; Y80-K84 HydrophobicContact CD1-CD 4.21Å; Y80-K84 HydrophobicContact CE1-CD 4.47Å
81	S	39.9	Very low	36.2	Very low	53 Å²	53	113.4 Å²	113.4	37%	0.371	57%	0.566	S	S	.	*			trans	-59.1	148.8	168.7	63.6	0	0	0	0	110.1	E83 K84 L85	S81-E83 PolarHBondContact O-N 3.44Å; S81-E83 VanDerWaalsContact O-N 3.08Å; S81-K84 PolarHBondContact O-N 2.92Å; S81-L85 PolarHBondContact O-N 2.93Å
82	L	39.3	Very low	36.5	Very low	102 Å²	102	110.2 Å²	110.2	53%	0.534	56%	0.56	S	S	.	*	H	α-helix	trans	-55.1	-31.3	-180	-163.2	73.8	0	0	0	111.9	V40 L85 L86	V40-L82 HydrophobicContact CG1-CD2 3.74Å; L82-L85 PolarHBondContact O-N 3.49Å; L82-L86 HydrophobicContact CG-CD1 4.44Å; L82-L86 WeakPolarHBondContact O-CG 3.28Å; L82-L86 PolarHBondContact O-N 3.15Å
83	E	38.4	Very low	37.1	Very low	149 Å²	149	110.2 Å²	110.2	70%	0.696	56%	0.556	S	S	*	*	H	α-helix	trans	-57.5	-47.9	172.3	-63.2	175	122.4	0	0	112.7	S81 L85 L86 E87	S81-E83 PolarHBondContact O-N 3.44Å; S81-E83 VanDerWaalsContact O-N 3.08Å; E83-L85 VanDerWaalsContact C-N 3.31Å; E83-L85 PolarHBondContact O-N 2.77Å; E83-L86 CarbonylContact O-C 3.16Å; E83-L86 PolarHBondContact O-N 2.98Å; E83-E87 VanDerWaalsContact O-CB 3.28Å; E83-E87 WeakPolarHBondContact O-CB 3.41Å; E83-E87 PolarHBondContact O-N 3.24Å
84	K	37.7	Very low	37.7	Very low	113 Å²	113	110.2 Å²	110.2	49%	0.491	55%	0.554	S	S	.	*	H	α-helix	trans	-66.9	-31.9	179.9	-73	-172.2	176.2	-177.1	0	112.8	Y80 S81 F88	Y80-K84 HydrophobicContact CD1-CB 3.85Å; Y80-K84 HydrophobicContact CD1-CD 4.21Å; Y80-K84 HydrophobicContact CE1-CD 4.47Å; S81-K84 PolarHBondContact O-N 2.92Å; K84-F88 WeakPolarHBondContact O-CB 3.49Å; K84-F88 PolarHBondContact O-N 3.03Å
85	L	40.2	Very low	38	Very low	88 Å²	88	111.4 Å²	111.4	46%	0.461	56%	0.555	S	S	.	*	H	α-helix	trans	-69.9	-38.4	172.9	-76.1	168.6	0	0	0	111.8	S81 L82 E83 V89	S81-L85 PolarHBondContact O-N 2.93Å; L82-L85 PolarHBondContact O-N 3.49Å; E83-L85 VanDerWaalsContact C-N 3.31Å; E83-L85 PolarHBondContact O-N 2.77Å; L85-V89 WeakPolarHBondContact O-CG2 3.32Å; L85-V89 PolarHBondContact O-N 2.95Å
86	L	42.4	Very low	38.4	Very low	94 Å²	94	111 Å²	111	49%	0.492	56%	0.557	S	S	.	*	H	α-helix	trans	-67.6	-41.9	172.7	-72.5	165.6	0	0	0	111.8	L82 E83 V89 Y90	L82-L86 HydrophobicContact CG-CD1 4.44Å; L82-L86 WeakPolarHBondContact O-CG 3.28Å; L82-L86 PolarHBondContact O-N 3.15Å; E83-L86 CarbonylContact O-C 3.16Å; E83-L86 PolarHBondContact O-N 2.98Å; L86-V89 CarbonylContact O-C 3.56Å; L86-V89 PolarHBondContact O-N 3.34Å; L86-V89 VanDerWaalsContact O-N 3.12Å; L86-Y90 WeakPolarHBondContact O-CD2 3.4Å; L86-Y90 PolarHBondContact O-N 3.48Å
87	E	39.9	Very low	38.8	Very low	119 Å²	119	108.4 Å²	108.4	56%	0.556	56%	0.555	S	S	*	*	H	α-helix	trans	-60.4	-44.4	176.3	-174.3	173.6	-136.8	0	0	111.5	E83 V89 Y90 T91	E83-E87 VanDerWaalsContact O-CB 3.28Å; E83-E87 WeakPolarHBondContact O-CB 3.41Å; E83-E87 PolarHBondContact O-N 3.24Å; E87-V89 VanDerWaalsContact C-N 3.27Å; E87-V89 PolarHBondContact O-N 3.38Å; E87-Y90 PolarHBondContact O-N 3.34Å; E87-Y90 VanDerWaalsContact O-N 3.07Å; E87-T91 HydrophobicContact CG-CG2 4.15Å; E87-T91 WeakPolarHBondContact O-CB 3.24Å; E87-T91 WeakPolarHBondContact O-CG2 3.46Å; E87-T91 PolarHBondContact O-N 3.2Å; E87-T91 PolarHBondContact O-OG1 2.81Å
88	F	38.8	Very low	39.1	Very low	120 Å²	120	112.3 Å²	112.3	53%	0.526	56%	0.561	S	S	.	*	H	α-helix	trans	-62.8	-30.7	174	-168.6	-98.2	0	0	0	113.2	K84	K84-F88 WeakPolarHBondContact O-CB 3.49Å; K84-F88 PolarHBondContact O-N 3.03Å
89	V	42.1	Very low	39.5	Very low	35 Å²	35	110.8 Å²	110.8	21%	0.212	54%	0.543	C	S	.	.	H	α-helix	trans	-79	-20.4	174.5	170.8	0	0	0	0	112.5	L85 L86 E87 K99 F102	L85-V89 WeakPolarHBondContact O-CG2 3.32Å; L85-V89 PolarHBondContact O-N 2.95Å; L86-V89 CarbonylContact O-C 3.56Å; L86-V89 PolarHBondContact O-N 3.34Å; L86-V89 VanDerWaalsContact O-N 3.12Å; E87-V89 VanDerWaalsContact C-N 3.27Å; E87-V89 PolarHBondContact O-N 3.38Å; V89-K99 PolarHBondContact O-NZ 3.41Å; V89-F102 HydrophobicContact CG2-CD1 4.34Å; V89-F102 HydrophobicContact CG2-CE1 3.96Å
90	Y	39.4	Very low	40.1	Very low	181 Å²	181	105.2 Å²	105.2	71%	0.71	53%	0.527	S	S	*	.	H	α-helix	trans	-96.7	-28.6	179.3	-94.8	-94.3	0	0	0	114.5	L86 E87 G92	L86-Y90 WeakPolarHBondContact O-CD2 3.4Å; L86-Y90 PolarHBondContact O-N 3.48Å; E87-Y90 PolarHBondContact O-N 3.34Å; E87-Y90 VanDerWaalsContact O-N 3.07Å; Y90-G92 PolarHBondContact O-N 3Å
91	T	38.4	Very low	40.6	Very low	88 Å²	88	105.6 Å²	105.6	54%	0.54	53%	0.531	S	S	.	.	S	Bend	trans	-73.4	21.1	-179.2	46.7	0	0	0	0	115.2	E87 Q93	E87-T91 HydrophobicContact CG-CG2 4.15Å; E87-T91 WeakPolarHBondContact O-CB 3.24Å; E87-T91 WeakPolarHBondContact O-CG2 3.46Å; E87-T91 PolarHBondContact O-N 3.2Å; E87-T91 PolarHBondContact O-OG1 2.81Å; T91-Q93 VanDerWaalsContact C-N 3.3Å; T91-Q93 PolarHBondContact O-N 3.42Å; T91-Q93 VanDerWaalsContact O-N 3.1Å
92	G	39.7	Very low	40.6	Very low	64 Å²	64	107.7 Å²	107.7	66%	0.66	53%	0.534	S	S	*	.	S	Bend	trans	78.6	-10.3	160.3	0	0	0	0	0	117.9	Y90 M94	Y90-G92 PolarHBondContact O-N 3Å; G92-M94 PolarHBondContact O-N 2.99Å; G92-M94 VanDerWaalsContact O-N 3.15Å
93	Q	38.9	Very low	40.7	Very low	152 Å²	152	106.3 Å²	106.3	71%	0.71	53%	0.525	S	S	*	.			trans	-71.6	-4.1	-174.6	-73.7	-80.6	-49.6	0	0	115.6	T91	T91-Q93 VanDerWaalsContact C-N 3.3Å; T91-Q93 PolarHBondContact O-N 3.42Å; T91-Q93 VanDerWaalsContact O-N 3.1Å
94	M	41.3	Very low	40.9	Very low	70 Å²	70	103.9 Å²	103.9	35%	0.345	52%	0.517	S	S	.	.	S	Bend	trans	-109	120	-175.9	-82.1	-66.8	112.6	0	0	114	G92 R98	G92-M94 PolarHBondContact O-N 2.99Å; G92-M94 VanDerWaalsContact O-N 3.15Å; M94-R98 HydrophobicContact SD-CB 4.23Å
95	N	41.4	Very low	41.2	Very low	127 Å²	127	103 Å²	103	68%	0.679	52%	0.517	S	S	*	.			trans	-53	139.1	172.2	-81.4	-58.1	0	0	0	112.9	S97 R98 K99	N95-S97 VanDerWaalsContact C-N 3.29Å; N95-S97 PolarHBondContact O-N 2.95Å; N95-S97 VanDerWaalsContact O-N 3.1Å; N95-R98 WeakPolarHBondContact O-CB 3.47Å; N95-R98 PolarHBondContact O-N 3.31Å; N95-K99 PolarHBondContact O-N 3.25Å
96	L	40.5	Very low	41.3	Very low	129 Å²	129	103.5 Å²	103.5	68%	0.675	52%	0.519	S	S	*	.	H	α-helix	trans	-51.5	-40.9	-170.3	-175.4	62	0	0	0	114	R98 K99 I100	L96-R98 VanDerWaalsContact C-N 3.34Å; L96-R98 PolarHBondContact O-N 2.9Å; L96-K99 WeakPolarHBondContact O-CB 3.42Å; L96-K99 PolarHBondContact O-N 2.99Å; L96-K99 VanDerWaalsContact O-N 3.12Å; L96-I100 HydrophobicContact CD1-CD1 4.44Å; L96-I100 HydrophobicContact CG-CD1 4.1Å; L96-I100 WeakPolarHBondContact O-CG1 3.49Å; L96-I100 PolarHBondContact O-N 3.47Å
97	S	39.8	Very low	41.5	Very low	79 Å²	79	105 Å²	105	55%	0.552	52%	0.518	S	S	*	.	H	α-helix	trans	-62	-36.7	177.5	-174.1	0	0	0	0	113.1	N95 K101	N95-S97 VanDerWaalsContact C-N 3.29Å; N95-S97 PolarHBondContact O-N 2.95Å; N95-S97 VanDerWaalsContact O-N 3.1Å; S97-K101 WeakPolarHBondContact O-CG 3.49Å; S97-K101 PolarHBondContact O-N 2.84Å
98	R	42.2	Very low	41.6	Very low	161 Å²	161	102.2 Å²	102.2	61%	0.608	51%	0.512	S	S	*	.	H	α-helix	trans	-69.1	-38.5	173.4	-66.5	-173.7	-179	-178.6	0.9	111.2	M94 N95 L96 K101 F102	M94-R98 HydrophobicContact SD-CB 4.23Å; N95-R98 WeakPolarHBondContact O-CB 3.47Å; N95-R98 PolarHBondContact O-N 3.31Å; L96-R98 VanDerWaalsContact C-N 3.34Å; L96-R98 PolarHBondContact O-N 2.9Å; R98-K101 PolarHBondContact O-N 3.42Å; R98-F102 WeakPolarHBondContact O-CB 3.37Å; R98-F102 PolarHBondContact O-N 2.87Å
99	K	44.1	Very low	42	Very low	63 Å²	63	103.1 Å²	103.1	27%	0.274	51%	0.512	S	S	.	.	H	α-helix	trans	-62.8	-41.9	177.5	-164.5	157.2	-177.3	156.9	0	112	V89 N95 L96 F102 Q103	V89-K99 PolarHBondContact O-NZ 3.41Å; N95-K99 PolarHBondContact O-N 3.25Å; L96-K99 WeakPolarHBondContact O-CB 3.42Å; L96-K99 PolarHBondContact O-N 2.99Å; L96-K99 VanDerWaalsContact O-N 3.12Å; K99-F102 PolarHBondContact O-N 3.5Å; K99-Q103 WeakPolarHBondContact O-CG 3.38Å; K99-Q103 PolarHBondContact O-N 3.48Å
100	I	45.6	Very low	42.1	Very low	80 Å²	80	105 Å²	105	41%	0.41	52%	0.517	S	S	.	.	H	α-helix	trans	-66.1	-46.3	174.2	-65.3	165.9	0	0	0	111.3	L96 F102 Q103 N104	L96-I100 HydrophobicContact CD1-CD1 4.44Å; L96-I100 HydrophobicContact CG-CD1 4.1Å; L96-I100 WeakPolarHBondContact O-CG1 3.49Å; L96-I100 PolarHBondContact O-N 3.47Å; I100-F102 VanDerWaalsContact C-N 3.29Å; I100-F102 PolarHBondContact O-N 3.24Å; I100-Q103 PolarHBondContact O-N 3.3Å; I100-N104 PolarHBondContact O-N 3.26Å
101	K	42	Very low	42.2	Very low	151 Å²	151	100.8 Å²	100.8	66%	0.657	51%	0.507	S	S	*	.	H	α-helix	trans	-58.6	-40.9	175.6	-75.7	-174.9	178.9	-171	0	112.1	S97 R98 N104 L105	S97-K101 WeakPolarHBondContact O-CG 3.49Å; S97-K101 PolarHBondContact O-N 2.84Å; R98-K101 PolarHBondContact O-N 3.42Å; K101-N104 PolarHBondContact O-N 3.26Å; K101-L105 WeakPolarHBondContact O-CB 3.34Å; K101-L105 PolarHBondContact O-N 3.16Å
102	F	40.5	Very low	42.4	Very low	97 Å²	97	103.4 Å²	103.4	43%	0.425	51%	0.511	S	S	.	.	H	α-helix	trans	-67.4	-42.3	177.2	-170.1	-109.2	0	0	0	112.6	V89 R98 K99 I100 N104 L105 L106	V89-F102 HydrophobicContact CG2-CD1 4.34Å; V89-F102 HydrophobicContact CG2-CE1 3.96Å; R98-F102 WeakPolarHBondContact O-CB 3.37Å; R98-F102 PolarHBondContact O-N 2.87Å; K99-F102 PolarHBondContact O-N 3.5Å; I100-F102 VanDerWaalsContact C-N 3.29Å; I100-F102 PolarHBondContact O-N 3.24Å; F102-N104 PolarHBondContact O-N 2.87Å; F102-L105 PolarHBondContact O-N 2.96Å; F102-L106 HydrophobicContact CD1-CD1 3.82Å; F102-L106 HydrophobicContact CD1-CG 4.45Å; F102-L106 HydrophobicContact CE1-CD1 3.55Å; F102-L106 HydrophobicContact CE1-CG 4.24Å; F102-L106 HydrophobicContact CZ-CD1 4.15Å; F102-L106 HydrophobicContact CZ-CG 4.43Å; F102-L106 WeakPolarHBondContact O-CB 3.45Å; F102-L106 WeakPolarHBondContact O-CG 3.24Å; F102-L106 PolarHBondContact O-N 3Å
103	Q	42	Very low	42.6	Very low	72 Å²	72	103.5 Å²	103.5	34%	0.336	50%	0.495	S	S	.	.	H	α-helix	trans	-60.8	-42.1	173.3	-76.4	173	-33.4	0	0	112.3	L33 K99 I100 L106 R107	L33-Q103 VanDerWaalsContact CD1-NE2 3.34Å; K99-Q103 WeakPolarHBondContact O-CG 3.38Å; K99-Q103 PolarHBondContact O-N 3.48Å; I100-Q103 PolarHBondContact O-N 3.3Å; Q103-L106 PolarHBondContact O-N 3.32Å; Q103-R107 WeakPolarHBondContact O-CB 3.35Å; Q103-R107 PolarHBondContact O-N 3.07Å
104	N	41.5	Very low	42.7	Very low	99 Å²	99	100.5 Å²	100.5	53%	0.529	48%	0.48	S	S	.	.	H	α-helix	trans	-69	-36.7	177	-71.6	-12.7	0	0	0	112.3	I100 K101 F102 R107 S108	I100-N104 PolarHBondContact O-N 3.26Å; K101-N104 PolarHBondContact O-N 3.26Å; F102-N104 PolarHBondContact O-N 2.87Å; N104-R107 PolarHBondContact O-N 3.3Å; N104-S108 WeakPolarHBondContact O-CB 3.38Å; N104-S108 PolarHBondContact O-N 3.33Å
105	L	43.6	Very low	42.6	Very low	95 Å²	95	100 Å²	100	50%	0.497	48%	0.484	S	S	.	.	H	α-helix	trans	-65.7	-43.5	174.6	-170.1	70.2	0	0	0	111.7	K101 F102 S108 R109	K101-L105 WeakPolarHBondContact O-CB 3.34Å; K101-L105 PolarHBondContact O-N 3.16Å; F102-L105 PolarHBondContact O-N 2.96Å; L105-S108 PolarHBondContact O-N 2.76Å; L105-R109 PolarHBondContact O-N 3.17Å
106	L	44.1	Very low	42.7	Very low	98 Å²	98	96.9 Å²	96.9	51%	0.513	47%	0.469	S	S	.	.	H	α-helix	trans	-60.8	-47.5	172.6	-76.9	172.6	0	0	0	111.4	F102 Q103 S108 R109 F110	F102-L106 HydrophobicContact CD1-CD1 3.82Å; F102-L106 HydrophobicContact CD1-CG 4.45Å; F102-L106 HydrophobicContact CE1-CD1 3.55Å; F102-L106 HydrophobicContact CE1-CG 4.24Å; F102-L106 HydrophobicContact CZ-CD1 4.15Å; F102-L106 HydrophobicContact CZ-CG 4.43Å; F102-L106 WeakPolarHBondContact O-CB 3.45Å; F102-L106 WeakPolarHBondContact O-CG 3.24Å; F102-L106 PolarHBondContact O-N 3Å; Q103-L106 PolarHBondContact O-N 3.32Å; L106-S108 VanDerWaalsContact C-N 3.33Å; L106-S108 PolarHBondContact O-N 3.38Å; L106-R109 PolarHBondContact O-N 3.16Å; L106-F110 WeakPolarHBondContact O-CB 3.45Å; L106-F110 PolarHBondContact O-N 2.81Å
107	R	45.2	Very low	42.8	Very low	125 Å²	125	95 Å²	95	47%	0.472	46%	0.458	S	S	.	.	H	α-helix	trans	-59.7	-42.4	177.2	-171.8	175.2	179	117.4	-4.4	111.6	F32 Q103 N104 L111	F32-R107 HydrophobicContact CE1-CG 4.14Å; Q103-R107 WeakPolarHBondContact O-CB 3.35Å; Q103-R107 PolarHBondContact O-N 3.07Å; N104-R107 PolarHBondContact O-N 3.3Å; R107-L111 HydrophobicContact CG-CD1 4.25Å; R107-L111 WeakPolarHBondContact O-CB 3.48Å; R107-L111 WeakPolarHBondContact O-CD1 3.45Å; R107-L111 VanDerWaalsContact O-CG 3.25Å; R107-L111 WeakPolarHBondContact O-CG 3.49Å; R107-L111 PolarHBondContact O-N 2.82Å
108	S	43	Very low	42.7	Very low	60 Å²	60	93.6 Å²	93.6	42%	0.42	45%	0.448	S	S	.	.	H	α-helix	trans	-65.6	-47.6	176.9	-178	0	0	0	0	112.6	N104 L105 L106 L111 K112	N104-S108 WeakPolarHBondContact O-CB 3.38Å; N104-S108 PolarHBondContact O-N 3.33Å; L105-S108 PolarHBondContact O-N 2.76Å; L106-S108 VanDerWaalsContact C-N 3.33Å; L106-S108 PolarHBondContact O-N 3.38Å; S108-L111 PolarHBondContact O-N 3.45Å; S108-K112 PolarHBondContact O-N 2.97Å; S108-K112 VanDerWaalsContact O-N 3.07Å
109	R	46.4	Very low	42.6	Very low	139 Å²	139	90.7 Å²	90.7	53%	0.525	44%	0.444	S	S	.	.	H	α-helix	trans	-69.6	-35.9	178.5	-71.7	-164.1	175.6	-143.7	-1	112.6	L105 L106 K112 I113	L105-R109 PolarHBondContact O-N 3.17Å; L106-R109 PolarHBondContact O-N 3.16Å; R109-K112 PolarHBondContact O-N 2.85Å; R109-I113 WeakPolarHBondContact O-CD1 3.41Å; R109-I113 VanDerWaalsContact O-CG1 3.3Å; R109-I113 WeakPolarHBondContact O-CG1 3.4Å; R109-I113 PolarHBondContact O-N 2.83Å
110	F	44.7	Very low	42.3	Very low	75 Å²	75	96.3 Å²	96.3	33%	0.329	47%	0.465	S	S	.	.	H	α-helix	trans	-61.8	-43.8	173.4	-170.5	-90	0	0	0	111.5	M39 L106 K112 I113 F114	M39-F110 HydrophobicContact CE-CE1 4.35Å; M39-F110 HydrophobicContact CE-CE2 4.27Å; M39-F110 HydrophobicContact CE-CZ 3.63Å; M39-F110 HydrophobicContact SD-CZ 4.31Å; L106-F110 WeakPolarHBondContact O-CB 3.45Å; L106-F110 PolarHBondContact O-N 2.81Å; F110-K112 PolarHBondContact O-N 3.11Å; F110-I113 PolarHBondContact O-N 3.48Å; F110-F114 VanDerWaalsContact O-CB 3.28Å; F110-F114 WeakPolarHBondContact O-CB 3.42Å; F110-F114 PolarHBondContact O-N 3.17Å
111	L	41.2	Very low	41.8	Very low	92 Å²	92	95.6 Å²	95.6	48%	0.482	46%	0.461	S	S	.	.	H	α-helix	trans	-64.7	-36.2	175.5	-72.5	168.1	0	0	0	112.7	R107 S108 F114 S115	R107-L111 HydrophobicContact CG-CD1 4.25Å; R107-L111 WeakPolarHBondContact O-CB 3.48Å; R107-L111 WeakPolarHBondContact O-CD1 3.45Å; R107-L111 VanDerWaalsContact O-CG 3.25Å; R107-L111 WeakPolarHBondContact O-CG 3.49Å; R107-L111 PolarHBondContact O-N 2.82Å; S108-L111 PolarHBondContact O-N 3.45Å; L111-F114 PolarHBondContact O-N 3.23Å; L111-S115 PolarHBondContact O-N 3.21Å; L111-S115 PolarHBondContact O-OG 2.91Å
112	K	42.2	Very low	41.6	Very low	144 Å²	144	92.2 Å²	92.2	63%	0.626	46%	0.456	S	S	*	.	H	α-helix	trans	-66.1	-44.9	172.9	-73.4	-170.8	174.6	-165.8	0	112.5	S108 R109 F110 F114 S115 V116	S108-K112 PolarHBondContact O-N 2.97Å; S108-K112 VanDerWaalsContact O-N 3.07Å; R109-K112 PolarHBondContact O-N 2.85Å; F110-K112 PolarHBondContact O-N 3.11Å; K112-F114 VanDerWaalsContact C-N 3.33Å; K112-F114 PolarHBondContact O-N 3.49Å; K112-S115 WeakPolarHBondContact CA-OG 3.5Å; K112-S115 PolarHBondContact O-N 2.88Å; K112-S115 PolarHBondContact O-OG 3.46Å; K112-V116 PolarHBondContact O-N 3.36Å; K112-V116 VanDerWaalsContact O-N 3.13Å
113	I	44.7	Very low	41.4	Very low	66 Å²	66	92 Å²	92	34%	0.338	46%	0.46	S	S	.	.	H	α-helix	trans	-60.2	-45	174.9	-69.6	161.7	0	0	0	110.2	F55 R109 F110 S115 V116 I117	F55-I113 HydrophobicContact CE1-CD1 4.19Å; F55-I113 HydrophobicContact CE1-CG1 4.31Å; F55-I113 HydrophobicContact CZ-CD1 3.91Å; F55-I113 HydrophobicContact CZ-CG1 4.19Å; F55-I113 HydrophobicContact CZ-CG2 4.08Å; R109-I113 WeakPolarHBondContact O-CD1 3.41Å; R109-I113 VanDerWaalsContact O-CG1 3.3Å; R109-I113 WeakPolarHBondContact O-CG1 3.4Å; R109-I113 PolarHBondContact O-N 2.83Å; F110-I113 PolarHBondContact O-N 3.48Å; I113-S115 PolarHBondContact O-N 3.35Å; I113-V116 PolarHBondContact O-N 2.94Å; I113-I117 HydrophobicContact CG2-CD1 3.8Å; I113-I117 WeakPolarHBondContact O-CG1 3.29Å; I113-I117 PolarHBondContact O-N 3.49Å
114	F	41.4	Very low	41.1	Very low	88 Å²	88	91.7 Å²	91.7	39%	0.386	47%	0.47	S	S	.	.	H	α-helix	trans	-59.7	-43	175.6	-173.9	-99.9	0	0	0	112.2	L21 F110 L111 K112 V116 I117 C118	L21-F114 HydrophobicContact CD1-CZ 4.48Å; L21-F114 HydrophobicContact CD2-CZ 4.47Å; F110-F114 VanDerWaalsContact O-CB 3.28Å; F110-F114 WeakPolarHBondContact O-CB 3.42Å; F110-F114 PolarHBondContact O-N 3.17Å; L111-F114 PolarHBondContact O-N 3.23Å; K112-F114 VanDerWaalsContact C-N 3.33Å; K112-F114 PolarHBondContact O-N 3.49Å; F114-V116 VanDerWaalsContact C-N 3.35Å; F114-V116 PolarHBondContact O-N 2.82Å; F114-I117 PolarHBondContact O-N 3.35Å; F114-C118 PolarHBondContact O-N 3.37Å; F114-C118 PolarHBondContact O-SG 3.34Å
115	S	38.5	Very low	40.8	Very low	60 Å²	60	93.7 Å²	93.7	42%	0.42	48%	0.48	S	S	.	.	H	α-helix	trans	-62.7	-38	176.3	58.4	0	0	0	0	113.3	L111 K112 I113 C118 I119	L111-S115 PolarHBondContact O-N 3.21Å; L111-S115 PolarHBondContact O-OG 2.91Å; K112-S115 WeakPolarHBondContact CA-OG 3.5Å; K112-S115 PolarHBondContact O-N 2.88Å; K112-S115 PolarHBondContact O-OG 3.46Å; I113-S115 PolarHBondContact O-N 3.35Å; S115-C118 PolarHBondContact O-N 2.9Å; S115-I119 WeakPolarHBondContact O-CD1 3.37Å; S115-I119 VanDerWaalsContact O-CG1 3.31Å; S115-I119 WeakPolarHBondContact O-CG1 3.25Å; S115-I119 PolarHBondContact O-N 3.49Å; S115-I119 VanDerWaalsContact O-N 3.09Å
116	V	43.6	Very low	40.5	Very low	61 Å²	61	99 Å²	99	37%	0.37	49%	0.494	S	S	.	.	H	α-helix	trans	-67.4	-42.5	176.1	174.8	0	0	0	0	110.9	K112 I113 F114 C118 I119 Y120	K112-V116 PolarHBondContact O-N 3.36Å; K112-V116 VanDerWaalsContact O-N 3.13Å; I113-V116 PolarHBondContact O-N 2.94Å; F114-V116 VanDerWaalsContact C-N 3.35Å; F114-V116 PolarHBondContact O-N 2.82Å; V116-C118 PolarHBondContact O-N 3.34Å; V116-I119 PolarHBondContact O-N 2.97Å; V116-Y120 HydrophobicContact CG1-CD2 3.93Å; V116-Y120 HydrophobicContact CG1-CE2 4.1Å; V116-Y120 WeakPolarHBondContact O-CD2 3.36Å; V116-Y120 PolarHBondContact O-N 3.14Å
117	I	43.5	Very low	40.1	Very low	89 Å²	89	102.9 Å²	102.9	46%	0.456	51%	0.509	S	S	.	.	H	α-helix	trans	-62.6	-41.9	176.3	-67.8	167.7	0	0	0	111	I113 F114 I119 Y120 L121	I113-I117 HydrophobicContact CG2-CD1 3.8Å; I113-I117 WeakPolarHBondContact O-CG1 3.29Å; I113-I117 PolarHBondContact O-N 3.49Å; F114-I117 PolarHBondContact O-N 3.35Å; I117-I119 VanDerWaalsContact C-N 3.34Å; I117-I119 PolarHBondContact O-N 3.38Å; I117-Y120 PolarHBondContact O-N 2.86Å; I117-L121 HydrophobicContact CG2-CD1 3.84Å; I117-L121 HydrophobicContact CG2-CG 4.41Å; I117-L121 WeakPolarHBondContact O-CB 3.43Å; I117-L121 VanDerWaalsContact O-CG 3.32Å; I117-L121 WeakPolarHBondContact O-CG 3.45Å; I117-L121 PolarHBondContact O-N 3.31Å
118	C	37.3	Very low	39.6	Very low	51 Å²	51	100.8 Å²	100.8	35%	0.345	52%	0.519	S	S	.	.	H	α-helix	trans	-64	-36	176.3	-70.3	0	0	0	0	112.9	F114 S115 V116 S122	F114-C118 PolarHBondContact O-N 3.37Å; F114-C118 PolarHBondContact O-SG 3.34Å; S115-C118 PolarHBondContact O-N 2.9Å; V116-C118 PolarHBondContact O-N 3.34Å; C118-S122 WeakPolarHBondContact O-CB 3.45Å; C118-S122 PolarHBondContact O-N 2.92Å; C118-S122 PolarHBondContact O-OG 2.83Å
119	I	40	Very low	39.2	Very low	99 Å²	99	106.4 Å²	106.4	51%	0.508	54%	0.539	S	S	.	.	H	α-helix	trans	-65.5	-53.2	174.7	-68.2	161.8	0	0	0	109.9	S115 V116 I117 L121 S122 D123	S115-I119 WeakPolarHBondContact O-CD1 3.37Å; S115-I119 VanDerWaalsContact O-CG1 3.31Å; S115-I119 WeakPolarHBondContact O-CG1 3.25Å; S115-I119 PolarHBondContact O-N 3.49Å; S115-I119 VanDerWaalsContact O-N 3.09Å; V116-I119 PolarHBondContact O-N 2.97Å; I117-I119 VanDerWaalsContact C-N 3.34Å; I117-I119 PolarHBondContact O-N 3.38Å; I119-L121 PolarHBondContact O-N 3.4Å; I119-L121 VanDerWaalsContact O-N 3.16Å; I119-S122 WeakPolarHBondContact O-CA 3.48Å; I119-S122 WeakPolarHBondContact O-CB 3.45Å; I119-S122 PolarHBondContact O-N 2.89Å; I119-D123 PolarHBondContact O-N 3.44Å; I119-D123 VanDerWaalsContact O-N 3.07Å
120	Y	36.7	Very low	38.7	Very low	182 Å²	182	105.1 Å²	105.1	71%	0.714	55%	0.548	S	S	*	.	H	α-helix	trans	-57.1	-32.2	178.5	-95.6	-92.3	0	0	0	114.2	V116 I117 A124	V116-Y120 HydrophobicContact CG1-CD2 3.93Å; V116-Y120 HydrophobicContact CG1-CE2 4.1Å; V116-Y120 WeakPolarHBondContact O-CD2 3.36Å; V116-Y120 PolarHBondContact O-N 3.14Å; I117-Y120 PolarHBondContact O-N 2.86Å; Y120-A124 PolarHBondContact O-N 2.84Å
121	L	36.5	Very low	37.9	Very low	65 Å²	65	107.5 Å²	107.5	34%	0.34	57%	0.573	S	S	.	*	H	α-helix	trans	-79.3	-26.1	174.4	-69.9	172.7	0	0	0	112.9	M10 I117 I119	M10-L121 HydrophobicContact CE-CD2 4.22Å; I117-L121 HydrophobicContact CG2-CD1 3.84Å; I117-L121 HydrophobicContact CG2-CG 4.41Å; I117-L121 WeakPolarHBondContact O-CB 3.43Å; I117-L121 VanDerWaalsContact O-CG 3.32Å; I117-L121 WeakPolarHBondContact O-CG 3.45Å; I117-L121 PolarHBondContact O-N 3.31Å; I119-L121 PolarHBondContact O-N 3.4Å; I119-L121 VanDerWaalsContact O-N 3.16Å
122	S	38.1	Very low	37.5	Very low	79 Å²	79	109 Å²	109	55%	0.552	59%	0.588	S	S	*	*	H	α-helix	trans	-75.3	-34.4	177.2	-56.3	0	0	0	0	112.2	C118 I119	C118-S122 WeakPolarHBondContact O-CB 3.45Å; C118-S122 PolarHBondContact O-N 2.92Å; C118-S122 PolarHBondContact O-OG 2.83Å; I119-S122 WeakPolarHBondContact O-CA 3.48Å; I119-S122 WeakPolarHBondContact O-CB 3.45Å; I119-S122 PolarHBondContact O-N 2.89Å
123	D	34.7	Very low	37.4	Very low	93 Å²	93	107.7 Å²	107.7	50%	0.497	59%	0.594	S	S	.	*	H	α-helix	trans	-73.1	-29.7	174.2	-65.4	-43.2	0	0	0	111.8	I119 D125 R126	I119-D123 PolarHBondContact O-N 3.44Å; I119-D123 VanDerWaalsContact O-N 3.07Å; D123-D125 PolarHBondContact O-N 3.22Å; D123-R126 WeakPolarHBondContact O-CB 3.43Å; D123-R126 PolarHBondContact O-N 3.12Å
124	A	37.2	Very low	36.7	Very low	66 Å²	66	109.9 Å²	109.9	55%	0.545	62%	0.615	S	S	.	*	H	α-helix	trans	-68	-28.9	178.7	0	0	0	0	0	114.1	Y120 R126	Y120-A124 PolarHBondContact O-N 2.84Å; A124-R126 PolarHBondContact O-N 3.04Å
125	D	33.4	Very low	36.7	Very low	141 Å²	141	110.8 Å²	110.8	75%	0.754	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-2.1	175.4	-79.7	-22	0	0	0	112.8	D123	D123-D125 PolarHBondContact O-N 3.22Å
126	R	37.9	Very low	36.2	Very low	205 Å²	205	113.4 Å²	113.4	77%	0.774	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	-13.8	-171.1	-145.5	172.8	-176	177.4	-0.8	115.3	D123 A124	D123-R126 WeakPolarHBondContact O-CB 3.43Å; D123-R126 PolarHBondContact O-N 3.12Å; A124-R126 PolarHBondContact O-N 3.04Å
127	E	36.3	Very low	35.5	Very low	180 Å²	180	116.1 Å²	116.1	84%	0.841	67%	0.67	S	S	*	*	S	Bend	trans	-97.5	21.1	-177.7	-69.1	-77.7	123	0	0	113
128	A	35.1	Very low	35.6	Very low	82 Å²	82	117.8 Å²	117.8	68%	0.678	69%	0.687	S	S	*	*			trans	-116.4	69	-171.7	0	0	0	0	0	113
129	E	33.1	Very low	35.9	Very low	178 Å²	178	121.6 Å²	121.6	83%	0.832	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-62.3	136.3	173.7	-81.2	-69.1	148.4	0	0	112.6
130	P	35.9	Very low	35.4	Very low	111 Å²	111	122.1 Å²	122.1	72%	0.721	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-88.4	144.3	-174.6	34.3	-35	0	0	0	114.1
131	C	29.4	Very low	35.6	Very low	125 Å²	125	119.3 Å²	119.3	85%	0.845	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-97.5	150.9	172.5	-75.5	0	0	0	0	113.2
132	P	32.6	Very low	35.4	Very low	124 Å²	124	122.5 Å²	122.5	81%	0.805	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-88.2	169.7	-169.8	35.5	-37.9	0	0	0	115.6
133	P	39.3	Very low	35.2	Very low	116 Å²	116	124.6 Å²	124.6	75%	0.753	76%	0.761	S	S	*	*			trans	-116.2	170.5	-165.3	41.9	-34.1	0	0	0	118.1
134	S	30.5	Very low	34.8	Very low	113 Å²	113	128.5 Å²	128.5	79%	0.79	78%	0.781	S	S	*	*			trans	81.5	166.6	158.7	85.2	0	0	0	0	118.5
135	P	40.7	Very low	34.6	Very low	106 Å²	106	130.8 Å²	130.8	69%	0.688	79%	0.793	S	S	*	*			cis	-138.7	163.5	1	41.8	-24.2	0	0	0	118.9
136	S	27.8	Very low	34.3	Very low	115 Å²	115	131.9 Å²	131.9	80%	0.804	80%	0.797	S	S	*	*			trans	50.8	136.6	143.5	63.9	0	0	0	0	125.2
137	S	30.7	Very low	33.7	Very low	119 Å²	119	126.1 Å²	126.1	83%	0.832	79%	0.793	S	S	*	*			trans	-157.3	139.8	160.6	54.9	0	0	0	0	115.2
138	P	44.8	Very low	33.1	Very low	124 Å²	124	123.2 Å²	123.2	81%	0.805	79%	0.793	S	S	*	*			trans	-132	-168.2	170.5	44.4	-31.5	0	0	0	112.7
139	P	43.4	Very low	32.7	Very low	130 Å²	130	125.9 Å²	125.9	84%	0.844	80%	0.801	S	S	*	*			cis	-123	-164	-12.9	40.3	-22.8	0	0	0	114.6
140	S	30.1	Very low	32.3	Very low	110 Å²	110	123.8 Å²	123.8	77%	0.769	80%	0.8	S	S	*	*			trans	-117.3	-162.2	-169.8	65	0	0	0	0	113.7
141	P	40.2	Very low	31.7	Very low	123 Å²	123	121.6 Å²	121.6	80%	0.799	80%	0.797	S	S	*	*				-144.2	-168.4	50.8	40.6	-17.5	0	0	0	117.4
142	V	32	Very low	31.4	Very low	132 Å²	132	122.7 Å²	122.7	80%	0.8	80%	0.795	S	S	*	*			trans	-108.1	171.6	-177.3	-67.2	0	0	0	0	113.2
143	P	35.4	Very low	31	Very low	124 Å²	124	126.9 Å²	126.9	81%	0.805	80%	0.801	S	S	*	*				-151.3	158.6	103.6	39	-21.4	0	0	0	119.4
144	L	25.9	Very low	30.4	Very low	174 Å²	174	129 Å²	129	91%	0.911	80%	0.798	S	S	*	*			trans	-9.9	171.3	158.5	-60.6	171.9	0	0	0	124.3
145	S	33.3	Very low	30.3	Very low	115 Å²	115	130.3 Å²	130.3	80%	0.804	79%	0.792	S	S	*	*			trans	-129.9	142.2	175.9	173.2	0	0	0	0	112
146	I	25.5	Very low	29.6	Very low	164 Å²	164	132.9 Å²	132.9	84%	0.841	80%	0.799	S	S	*	*			trans	-144.9	155	173	-62.3	-176.1	0	0	0	108.7
147	A	25.4	Very low	29.6	Very low	83 Å²	83	130.3 Å²	130.3	69%	0.686	79%	0.791	S	S	*	*			trans	-117.6	156.6	-178.2	0	0	0	0	0	114.2
148	S	25.2	Very low	29.5	Very low	120 Å²	120	132.4 Å²	132.4	84%	0.839	79%	0.792	S	S	*	*			trans	63.6	129	164.2	-64.7	0	0	0	0	120.2
149	V	25.3	Very low	28.8	Very low	138 Å²	138	135.6 Å²	135.6	84%	0.836	80%	0.796	S	S	*	*			trans	-165.3	137.9	136.4	132.8	0	0	0	0	109.4
150	V	24.3	Very low	28.1	Very low	134 Å²	134	132.7 Å²	132.7	81%	0.812	79%	0.79	S	S	*	*			trans	23.7	135	154	-171.2	0	0	0	0	119.4
151	G	23.2	Very low	28.2	Very low	65 Å²	65	139.1 Å²	139.1	67%	0.67	80%	0.797	S	S	*	*			cis	172.6	-152.6	5.6	0	0	0	0	0	113.9
152	D	24.9	Very low	27.6	Very low	148 Å²	148	143.6 Å²	143.6	79%	0.791	80%	0.804	S	S	*	*			trans	-25.5	139.4	-173.4	-57.2	-95.4	0	0	0	120.1
153	F	24.2	Very low	27.9	Very low	212 Å²	212	149.6 Å²	149.6	93%	0.93	81%	0.812	S	S	*	*				-157.8	178.6	103.4	-122.8	-100.1	0	0	0	111.8
154	K	26.5	Very low	27.5	Very low	159 Å²	159	147 Å²	147	69%	0.691	81%	0.808	S	S	*	*			trans	-136.5	162	-154.5	-168	-155	171.5	-154.7	0	111.4
155	E	28.1	Very low	27.7	Very low	142 Å²	142	150.8 Å²	150.8	66%	0.664	81%	0.81	S	S	*	*			trans	73.3	141.6	170.4	-44.4	-171.1	155.2	0	0	112.9
156	D	26.2	Very low	27.6	Very low	159 Å²	159	156 Å²	156	85%	0.85	81%	0.812	S	S	*	*			cis	-137.4	177.6	1.1	-90.5	-48.8	0	0	0	108.3
157	G	26.5	Very low	27.9	Very low	61 Å²	61	154.1 Å²	154.1	63%	0.629	81%	0.81	S	S	*	*			cis	153.7	144.4	0.3	0	0	0	0	0	110.1
158	L	29.6	Very low	28.2	Very low	164 Å²	164	159.2 Å²	159.2	86%	0.859	82%	0.817	S	S	*	*			trans	57.7	122.5	164.4	-66	164.9	0	0	0	121.6
159	E	29.5	Very low	28.5	Very low	191 Å²	191	158.2 Å²	158.2	89%	0.893	81%	0.81	S	S	*	*			trans	60.4	157.5	141.7	-57.3	-163	120.6	0	0	120.6
160	G	28.5	Very low	28.4	Very low	68 Å²	68	161 Å²	161	70%	0.701	81%	0.812	S	S	*	*			cis	-174.6	163.7	-2.6	0	0	0	0	0	113
161	R	31.9	Very low	28.6	Very low	246 Å²	246	159.8 Å²	159.8	93%	0.928	81%	0.809	S	S	*	*			trans	-48.2	144	-176.8	-65.1	164.2	165.2	163.2	-5.9	115.3
162	K	29.4	Very low	28.7	Very low	217 Å²	217	160.4 Å²	160.4	94%	0.943	82%	0.815	S	S	*	*				-162.8	167.8	127.3	-105.6	144.5	-168.6	170.8	0	114
163	R	37.1	Very low	28.9	Very low	257 Å²	257	162.8 Å²	162.8	97%	0.97	82%	0.822	S	S	*	*			trans	-114.6	142.4	-174.3	-63	172.4	171.9	172	-4.8	111.2
164	G	27.6	Very low	29.8	Very low	69 Å²	69	157.8 Å²	157.8	71%	0.711	81%	0.81	S	S	*	*			trans	-157.3	114	160.6	0	0	0	0	0	108.6
165	R	29.5	Very low	30.3	Very low	254 Å²	254	156.1 Å²	156.1	96%	0.958	82%	0.816	S	S	*	*				79.2	129.3	74.9	-81	-167.5	-179.7	-105.7	3	113.8
166	R	32.3	Very low	30.4	Very low	224 Å²	224	157.8 Å²	157.8	85%	0.845	82%	0.824	S	S	*	*			trans	-61.8	155.8	177.5	-71.1	178.5	167.1	-141.1	6.6	114.2
167	P	31.8	Very low	31.5	Very low	125 Å²	125	155.4 Å²	155.4	81%	0.812	82%	0.817	S	S	*	*			trans	-85.6	167.4	142.9	35	-31	0	0	0	112.9
168	K	31.6	Very low	31.5	Very low	190 Å²	190	158.2 Å²	158.2	83%	0.826	83%	0.827	S	S	*	*			trans	-149.1	177.1	-177.7	-157.9	-172.5	173	-170.1	0	109.1
169	S	30.3	Very low	31.4	Very low	100 Å²	100	154.6 Å²	154.6	70%	0.699	83%	0.829	S	S	*	*			trans	82.5	157.5	-176.7	82.4	0	0	0	0	114
170	F	24.6	Very low	31.2	Very low	197 Å²	197	149.5 Å²	149.5	86%	0.864	83%	0.828	S	S	*	*			cis	-120.3	-169.7	8.9	-125.3	-87.9	0	0	0	113.9
171	S	28.6	Very low	31.1	Very low	108 Å²	108	150.9 Å²	150.9	76%	0.755	83%	0.833	S	S	*	*			trans	-123.4	166.4	-162.4	53	0	0	0	0	115
172	G	24.4	Very low	31	Very low	78 Å²	78	148.6 Å²	148.6	80%	0.804	83%	0.83	S	S	*	*			trans	-166.1	140.9	164.8	0	0	0	0	0	111.6
173	E	29.6	Very low	30.9	Very low	197 Å²	197	144.7 Å²	144.7	92%	0.921	82%	0.818	S	S	*	*			trans	-130.3	167.8	-176.1	-99	-170.5	138.8	0	0	112.1
174	P	42.4	Very low	30.4	Very low	107 Å²	107	141 Å²	141	70%	0.695	81%	0.811	S	S	*	*			trans	-103.5	177.2	-159.3	41	-37.9	0	0	0	115.6
175	P	36.3	Very low	30.4	Very low	125 Å²	125	142.5 Å²	142.5	81%	0.812	81%	0.811	S	S	*	*			trans	-95.7	158.3	167.3	37	-33.3	0	0	0	114.4
176	E	30.1	Very low	30.2	Very low	177 Å²	177	141.2 Å²	141.2	83%	0.827	81%	0.808	S	S	*	*			trans	-138.7	-174.6	177.1	-86.1	-130.3	-174.9	0	0	109.1
177	P	49.8	Very low	30	Very low	109 Å²	109	142.3 Å²	142.3	71%	0.708	81%	0.812	S	S	*	*				-133.7	-171.6	-62.1	41.4	-25.4	0	0	0	112.1
178	S	26.8	Very low	29.7	Very low	120 Å²	120	139.7 Å²	139.7	84%	0.839	81%	0.808	S	S	*	*			trans	-155.3	99.6	165.7	55	0	0	0	0	117.4
179	G	27.1	Very low	29.5	Very low	88 Å²	88	143.1 Å²	143.1	91%	0.907	82%	0.816	S	S	*	*			trans	74.8	149.4	153.2	0	0	0	0	0	119.7
180	G	25.6	Very low	29.3	Very low	84 Å²	84	142.3 Å²	142.3	87%	0.866	82%	0.823	S	S	*	*			cis	158.5	90.7	-14.6	0	0	0	0	0	117.8
181	A	26.4	Very low	29.5	Very low	97 Å²	97	144.8 Å²	144.8	80%	0.802	83%	0.827	S	S	*	*			trans	-161.4	135.1	155.3	0	0	0	0	0	108.9
182	K	28.9	Very low	30	Very low	198 Å²	198	144.8 Å²	144.8	86%	0.861	83%	0.825	S	S	*	*			cis	68.3	130.9	42.4	-99.6	-176.5	-176.7	177.8	0	112.1
183	I	27.9	Very low	30.2	Very low	134 Å²	134	153.1 Å²	153.1	69%	0.687	83%	0.832	S	S	*	*			cis	-149.9	150.3	24.3	-58.9	-177.1	0	0	0	113.7
184	Q	27.4	Very low	30	Very low	180 Å²	180	147 Å²	147	84%	0.841	82%	0.821	S	S	*	*			trans	71.7	152.7	154.2	-82.5	157.1	4.6	0	0	125
185	S	27.2	Very low	29.2	Very low	100 Å²	100	148 Å²	148	70%	0.699	83%	0.831	S	S	*	*			trans	-136.5	164.9	-179.6	59.5	0	0	0	0	109.8
186	Y	24.7	Very low	28.8	Very low	228 Å²	228	146 Å²	146	89%	0.894	83%	0.833	S	S	*	*			trans	-141.9	162	159.7	-104.2	-82.4	0	0	0	112.8
187	R	28.2	Very low	28.7	Very low	246 Å²	246	150 Å²	150	93%	0.928	84%	0.84	S	S	*	*			trans	-124.9	148.2	-171.6	-78.1	174.5	160.1	179.8	-3.5	112.5
188	G	25.2	Very low	27.6	Very low	71 Å²	71	148.6 Å²	148.6	73%	0.732	85%	0.845	S	S	*	*			trans	171	107.3	158.2	0	0	0	0	0	110.4
189	R	28.6	Very low	27.7	Very low	261 Å²	261	155.3 Å²	155.3	99%	0.985	85%	0.853	S	S	*	*				57	106.5	72.4	-70.5	-164.4	175.6	-146.2	1.4	114.1
190	G	25.3	Very low	27.6	Very low	84 Å²	84	154.7 Å²	154.7	87%	0.866	85%	0.846	S	S	*	*			trans	176.9	100.4	169.8	0	0	0	0	0	116.3
191	R	29.1	Very low	27.7	Very low	249 Å²	249	163 Å²	163	94%	0.94	85%	0.851	S	S	*	*			trans	-138	148.7	157.1	-101.4	-170.2	179.1	-136	0.1	104.9
192	P	39.3	Very low	27.6	Very low	108 Å²	108	162 Å²	162	70%	0.701	85%	0.85	S	S	*	*				-160.4	174.4	63.7	43.4	-22.6	0	0	0	119.6
193	R	27.9	Very low	27.4	Very low	253 Å²	253	157.4 Å²	157.4	96%	0.955	85%	0.849	S	S	*	*			trans	60.9	148.2	143.2	-76.5	169.6	-179.6	-128.8	1.4	122.5
194	G	25.9	Very low	27.3	Very low	67 Å²	67	155.4 Å²	155.4	69%	0.691	85%	0.853	S	S	*	*			trans	117	83.8	161.6	0	0	0	0	0	114.3
195	S	26.5	Very low	27.2	Very low	130 Å²	130	157 Å²	157	91%	0.909	85%	0.851	S	S	*	*				60.5	103.3	74.9	77.6	0	0	0	0	115.9
196	G	26.6	Very low	27.1	Very low	82 Å²	82	158.3 Å²	158.3	85%	0.845	85%	0.846	S	S	*	*			trans	-167.4	151.4	172	0	0	0	0	0	112.5
197	R	28.3	Very low	27.2	Very low	260 Å²	260	155.3 Å²	155.3	98%	0.981	84%	0.84	S	S	*	*			trans	-113.3	146.6	176.8	-63.2	176.1	174.9	-175.2	-1.8	109.6
198	G	26.2	Very low	27	Very low	80 Å²	80	150.7 Å²	150.7	83%	0.825	83%	0.834	S	S	*	*			trans	-173.6	129.5	170.2	0	0	0	0	0	113.8
199	R	28.6	Very low	27	Very low	262 Å²	262	154.2 Å²	154.2	99%	0.989	84%	0.835	S	S	*	*			trans	-91.2	154.6	172.3	-60.7	171.6	171.3	-170.3	-3.8	109.6
200	G	25.8	Very low	26.7	Very low	74 Å²	74	146.7 Å²	146.7	76%	0.763	82%	0.823	S	S	*	*			trans	141.2	109.8	142.3	0	0	0	0	0	118.1
201	R	27.7	Very low	26.8	Very low	259 Å²	259	147.5 Å²	147.5	98%	0.977	82%	0.821	S	S	*	*			trans	9.6	127.5	145.7	-57.8	173.8	-179.3	-116.1	1.1	118.8
202	G	25.2	Very low	26.5	Very low	75 Å²	75	139.2 Å²	139.2	77%	0.773	81%	0.813	S	S	*	*				130.1	123.5	120.5	0	0	0	0	0	119.2
203	A	24.9	Very low	25.9	Very low	103 Å²	103	143.6 Å²	143.6	85%	0.851	82%	0.824	S	S	*	*			trans	71.3	148.7	149.5	0	0	0	0	0	121.9
204	A	24.5	Very low	25.7	Very low	92 Å²	92	136.8 Å²	136.8	76%	0.76	82%	0.815	S	S	*	*			trans	65.7	100.2	150	0	0	0	0	0	121.9
205	R	25.7	Very low	25.8	Very low	212 Å²	212	143.5 Å²	143.5	80%	0.8	83%	0.829	S	S	*	*				67.1	139.2	112.6	-128.9	-172.4	132.9	155.2	-8.1	120.6
206	E	25	Very low	25.6	Very low	129 Å²	129	140.5 Å²	140.5	60%	0.603	82%	0.819	S	S	*	*			trans	69.6	139.8	160.3	-49.3	-169	158.8	0	0	116.6
207	E	27.6	Very low	25.4	Very low	165 Å²	165	141 Å²	141	77%	0.771	81%	0.81	S	S	*	*			cis	-155.2	-175.5	-22.7	-132.3	169.6	-150.8	0	0	109.7
208	D	23.6	Very low	25.6	Very low	148 Å²	148	135.1 Å²	135.1	79%	0.791	80%	0.802	S	S	*	*			trans	77.5	164.1	155.1	-104.1	-28.3	0	0	0	123.3
209	L	25.8	Very low	25.5	Very low	145 Å²	145	139.4 Å²	139.4	76%	0.759	80%	0.798	S	S	*	*			trans	80.9	93.5	166	-57.4	-167.9	0	0	0	122.1
210	S	22.1	Very low	25.5	Very low	104 Å²	104	134.4 Å²	134.4	73%	0.727	79%	0.791	S	S	*	*				71.8	122.6	119.1	70.9	0	0	0	0	122.6
211	A	26.4	Very low	25.5	Very low	101 Å²	101	139 Å²	139	84%	0.835	79%	0.79	S	S	*	*			trans	20	110.5	135.5	0	0	0	0	0	119.3
212	G	22.8	Very low	25.6	Very low	75 Å²	75	130.9 Å²	130.9	77%	0.773	79%	0.787	S	S	*	*			trans	-114.5	98.3	155.2	0	0	0	0	0	110.5
213	E	26.5	Very low	25.5	Very low	199 Å²	199	134.6 Å²	134.6	93%	0.93	78%	0.784	S	S	*	*			trans	-67.7	141.9	164.9	-66.5	-175.4	118.7	0	0	109.6
214	S	24.3	Very low	25.5	Very low	110 Å²	110	135.7 Å²	135.7	77%	0.769	78%	0.781	S	S	*	*			trans	-142.3	93	174	42.7	0	0	0	0	111.2	G216	S214-G216 PolarHBondContact O-N 2.79Å
215	E	27.3	Very low	25.7	Very low	208 Å²	208	136.3 Å²	136.3	97%	0.972	78%	0.777	S	S	*	*			trans	-62.2	129.9	155.3	-64.8	-158.6	128.2	0	0	108.6
216	G	22.7	Very low	25.8	Very low	68 Å²	68	130.9 Å²	130.9	70%	0.701	78%	0.777	S	S	*	*			trans	-155.3	48.6	-156.3	0	0	0	0	0	116	S214	S214-G216 PolarHBondContact O-N 2.79Å
217	S	21.8	Very low	26	Very low	93 Å²	93	130.3 Å²	130.3	65%	0.65	78%	0.779	S	S	*	*			trans	57.5	115	169.5	-168.4	0	0	0	0	116.7	K219	S217-K219 PolarHBondContact O-N 3Å
218	V	33.4	Very low	26	Very low	135 Å²	135	127.3 Å²	127.3	82%	0.818	76%	0.763	S	S	*	*			trans	-53	130.7	153.9	178.5	0	0	0	0	108.9
219	K	23.6	Very low	26.1	Very low	171 Å²	171	122.8 Å²	122.8	74%	0.743	75%	0.751	S	S	*	*			trans	-139.4	122.5	161.3	-72.7	-170.3	177.2	179	0	107.8	S217 F221	S217-K219 PolarHBondContact O-N 3Å; K219-F221 PolarHBondContact O-N 3.24Å
220	D	29.9	Very low	26	Very low	157 Å²	157	122.5 Å²	122.5	84%	0.84	75%	0.751	S	S	*	*			trans	-62.9	122.4	174.1	-83.4	-66.6	0	0	0	110.7
221	F	23.8	Very low	26.4	Very low	169 Å²	169	124.6 Å²	124.6	74%	0.741	76%	0.759	S	S	*	*			trans	-129.2	115.1	157.3	-98.1	-91.5	0	0	0	108.6	K219 E223	K219-F221 PolarHBondContact O-N 3.24Å; F221-E223 HydrophobicContact CD1-CG 4.47Å; F221-E223 PolarHBondContact O-N 3.26Å
222	G	29.8	Very low	26.4	Very low	89 Å²	89	122.9 Å²	122.9	92%	0.918	74%	0.741	S	S	*	*			trans	-77	54	-179.3	0	0	0	0	0	113
223	E	23.6	Very low	26.5	Very low	154 Å²	154	122.2 Å²	122.2	72%	0.72	73%	0.729	S	S	*	*			trans	-102.7	131.2	180	-63.2	-165.8	155.6	0	0	111.5	F221 P225	F221-E223 HydrophobicContact CD1-CG 4.47Å; F221-E223 PolarHBondContact O-N 3.26Å; E223-P225 WeakPolarHBondContact O-CD 3.41Å
224	T	25	Very low	26.3	Very low	126 Å²	126	119.2 Å²	119.2	77%	0.773	72%	0.719	S	S	*	*			trans	-78.7	122.4	179.3	49	0	0	0	0	111	A226	T224-A226 PolarHBondContact O-N 2.81Å
225	P	28.3	Very low	26.4	Very low	105 Å²	105	124.7 Å²	124.7	68%	0.682	72%	0.723	S	S	*	*			trans	-67.5	98.4	176.3	-21.6	34.9	0	0	0	111.7	E223 D227	E223-P225 WeakPolarHBondContact O-CD 3.41Å; P225-D227 PolarHBondContact O-N 2.99Å; P225-D227 VanDerWaalsContact O-N 3.08Å
226	A	28.8	Very low	26.2	Very low	98 Å²	98	118.8 Å²	118.8	81%	0.81	71%	0.705	S	S	*	*			trans	-83.5	60.6	175.6	0	0	0	0	0	111.2	T224	T224-A226 PolarHBondContact O-N 2.81Å
227	D	27.9	Very low	26.2	Very low	117 Å²	117	121.2 Å²	121.2	63%	0.626	71%	0.708	S	S	*	*			trans	-149.7	91.9	171.3	-127.6	-28	0	0	0	110.4	P225	P225-D227 PolarHBondContact O-N 2.99Å; P225-D227 VanDerWaalsContact O-N 3.08Å
228	F	28.6	Very low	26.3	Very low	101 Å²	101	122.2 Å²	122.2	44%	0.443	72%	0.715	S	S	.	*			trans	-118.4	78.7	172.9	-92.6	-83.1	0	0	0	109.7	D230 T445 Y448	F228-D230 PolarHBondContact O-N 3.47Å; F228-D230 VanDerWaalsContact O-N 3.14Å; F228-T445 HydrophobicContact CE2-CG2 3.91Å; F228-T445 HydrophobicContact CZ-CG2 3.83Å; F228-Y448 HydrophobicContact CZ-CD1 4.37Å
229	G	25.2	Very low	25.9	Very low	53 Å²	53	126.7 Å²	126.7	55%	0.546	72%	0.717	S	S	.	*			trans	-70.9	98.7	168.1	0	0	0	0	0	111.1
230	D	25.2	Very low	26	Very low	140 Å²	140	127.4 Å²	127.4	75%	0.749	72%	0.723	S	S	*	*			trans	-114.7	150	159.4	-162.3	-5.3	0	0	0	107.8	F228 S232	F228-D230 PolarHBondContact O-N 3.47Å; F228-D230 VanDerWaalsContact O-N 3.14Å; D230-S232 PolarHBondContact O-N 3.39Å
231	T	29.8	Very low	25.8	Very low	147 Å²	147	128.7 Å²	128.7	90%	0.902	72%	0.724	S	S	*	*	S	Bend	trans	-72.4	86.5	-156.1	56	0	0	0	0	114.1
232	S	25.8	Very low	25.9	Very low	65 Å²	65	129.7 Å²	129.7	46%	0.455	73%	0.731	S	S	.	*	S	Bend	trans	-141.7	139.8	169.1	176.1	0	0	0	0	106.9	D230 M395	D230-S232 PolarHBondContact O-N 3.39Å; S232-M395 WeakPolarHBondContact OG-CE 3.43Å
233	A	24.8	Very low	25.6	Very low	62 Å²	62	133.4 Å²	133.4	51%	0.512	73%	0.729	S	S	.	*			trans	-58.2	152.3	-163.7	0	0	0	0	0	114.8	W235	A233-W235 PolarHBondContact O-N 3.47Å
234	D	23.1	Very low	25.8	Very low	136 Å²	136	131.4 Å²	131.4	73%	0.727	73%	0.729	S	S	*	*			trans	-43.9	125.3	174.5	-81.8	-73.1	0	0	0	112.9
235	W	25.3	Very low	25.8	Very low	224 Å²	224	132.1 Å²	132.1	85%	0.848	73%	0.733	S	S	*	*			trans	-149	103.3	158.7	-132.5	55.9	0	0	0	109.4	A233	A233-W235 PolarHBondContact O-N 3.47Å
236	S	23.5	Very low	25.7	Very low	85 Å²	85	136.1 Å²	136.1	59%	0.594	74%	0.74	S	S	*	*			trans	-88.3	132.1	174.1	-71.1	0	0	0	0	109.7	S238	S236-S238 PolarHBondContact O-N 3.03Å
237	P	23.9	Very low	25.8	Very low	118 Å²	118	141 Å²	141	77%	0.766	74%	0.743	S	S	*	*			trans	-76.3	114.9	174.7	30.1	-32	0	0	0	110.2
238	S	23.7	Very low	25.7	Very low	115 Å²	115	141.4 Å²	141.4	80%	0.804	75%	0.752	S	S	*	*			trans	-65.5	144.6	162.8	-67.2	0	0	0	0	109.9	S236	S236-S238 PolarHBondContact O-N 3.03Å
239	R	24.6	Very low	25.5	Very low	229 Å²	229	147.2 Å²	147.2	86%	0.864	77%	0.771	S	S	*	*			trans	-100	104	-179.9	-170.5	-168.3	-153.4	-162.7	6.7	107.9
240	E	25.8	Very low	25.5	Very low	186 Å²	186	152.4 Å²	152.4	87%	0.869	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-76.6	140.2	169.5	-66.7	-179.5	162.4	0	0	109.1
241	E	25.3	Very low	25.3	Very low	183 Å²	183	149 Å²	149	86%	0.855	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-90.3	138.4	-175.4	-60.2	-170	125.2	0	0	111
242	E	26.1	Very low	24.9	Very low	190 Å²	190	146.8 Å²	146.8	89%	0.888	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-78.4	120.7	176	-66.3	-171.5	160.9	0	0	111.4
243	L	23.7	Very low	24.9	Very low	167 Å²	167	152.1 Å²	152.1	87%	0.874	79%	0.792	S	S	*	*			trans	-143.5	159.7	155.3	-83.6	-168.1	0	0	0	110.3
244	P	27.6	Very low	24.8	Very low	112 Å²	112	153.9 Å²	153.9	73%	0.727	80%	0.796	S	S	*	*				-95.8	144	-126.3	33.3	-38.3	0	0	0	116.6	K246	P244-K246 PolarHBondContact O-N 3.29Å
245	V	25.6	Very low	24.8	Very low	142 Å²	142	156.6 Å²	156.6	86%	0.861	80%	0.796	S	S	*	*			trans	-74.5	114.3	170.9	180	0	0	0	0	111.1
246	K	24.7	Very low	24.9	Very low	189 Å²	189	155.4 Å²	155.4	82%	0.822	79%	0.792	S	S	*	*			trans	-81.4	139.1	161.1	-70.5	-178.5	179	177.2	0	109.8	P244	P244-K246 PolarHBondContact O-N 3.29Å
247	K	32	Very low	24.9	Very low	201 Å²	201	156 Å²	156	87%	0.874	79%	0.788	S	S	*	*			trans	-76.5	144	172.3	-61.1	178	-178.5	176.8	0	111.2
248	P	25.8	Very low	25.1	Very low	125 Å²	125	157.1 Å²	157.1	81%	0.812	79%	0.788	S	S	*	*			trans	-105.4	175.1	142.2	-9.4	28.9	0	0	0	112.5
249	R	23.8	Very low	25.4	Very low	223 Å²	223	159.5 Å²	159.5	84%	0.842	79%	0.786	S	S	*	*			trans	-138.2	145.9	174.7	-102.9	-174.3	169.7	-166.2	-1.8	108.8
250	L	24.4	Very low	25.5	Very low	161 Å²	161	155 Å²	155	84%	0.843	78%	0.779	S	S	*	*			trans	63	140.5	149	-66.1	165.6	0	0	0	120.4
251	G	21.6	Very low	25.7	Very low	69 Å²	69	154.9 Å²	154.9	71%	0.711	78%	0.778	S	S	*	*			trans	79.4	157.7	162	0	0	0	0	0	116.6
252	S	22.6	Very low	25.7	Very low	101 Å²	101	154.4 Å²	154.4	71%	0.706	78%	0.776	S	S	*	*			cis	179.6	132.5	-19.9	37.8	0	0	0	0	109
253	E	23.9	Very low	25.8	Very low	177 Å²	177	149.9 Å²	149.9	83%	0.827	77%	0.766	S	S	*	*			trans	63.9	162.2	157.5	-67.2	170.7	98.8	0	0	116.7
254	T	23.4	Very low	26	Very low	98 Å²	98	145.2 Å²	145.2	60%	0.601	76%	0.758	S	S	*	*			cis	-156.5	167.8	-8.5	13.9	0	0	0	0	109.3
255	R	23.8	Very low	26	Very low	193 Å²	193	149.1 Å²	149.1	73%	0.728	77%	0.766	S	S	*	*			trans	69.1	152.8	150.7	-84.7	170.8	173.9	129.6	-0.8	118.2
256	R	26.4	Very low	25.9	Very low	200 Å²	200	150.6 Å²	150.6	76%	0.755	77%	0.768	S	S	*	*			cis	-118.7	151.3	-2.1	-74.4	-153.8	170.9	83.2	3	110
257	D	24.8	Very low	25.9	Very low	98 Å²	98	144.7 Å²	144.7	52%	0.524	76%	0.762	S	S	.	*				60	126.3	76.6	-20.7	-33.7	0	0	0	109.1
258	D	26.8	Very low	25.5	Very low	141 Å²	141	142.3 Å²	142.3	75%	0.754	76%	0.764	S	S	*	*			cis	-133.7	144	44.9	-52.1	-41.4	0	0	0	110.7
259	E	30.8	Very low	25.6	Very low	165 Å²	165	145.3 Å²	145.3	77%	0.771	77%	0.767	S	S	*	*				69.5	130.9	73.2	-69.9	170.7	-175.9	0	0	112.6
260	D	26.2	Very low	25.7	Very low	135 Å²	135	143.8 Å²	143.8	72%	0.722	77%	0.769	S	S	*	*			cis	-145	167.3	24	-85.5	-48.9	0	0	0	117.2
261	E	29.3	Very low	25.9	Very low	182 Å²	182	144.6 Å²	144.6	85%	0.85	77%	0.769	S	S	*	*			trans	-9.1	157.7	154.7	-47.3	-175.9	133.8	0	0	120.2
262	E	27	Very low	26.2	Very low	173 Å²	173	152.5 Å²	152.5	81%	0.808	78%	0.777	S	S	*	*			cis	-138.6	-174.1	12.7	-139.8	-149.7	-88.5	0	0	108.5
263	S	27.5	Very low	26.4	Very low	96 Å²	96	156.2 Å²	156.2	67%	0.671	78%	0.783	S	S	*	*			cis	-139.9	-170.3	10.3	-57.9	0	0	0	0	108.7
264	G	27.4	Very low	26.6	Very low	68 Å²	68	154.7 Å²	154.7	70%	0.701	79%	0.786	S	S	*	*			cis	95.6	121.1	9.2	0	0	0	0	0	113.8
265	E	27.3	Very low	26.8	Very low	194 Å²	194	159.3 Å²	159.3	91%	0.907	80%	0.801	S	S	*	*			cis	-152.2	-178.6	-20	-142.7	-177	173.7	0	0	110.9
266	L	25	Very low	26.9	Very low	173 Å²	173	154.1 Å²	154.1	91%	0.906	81%	0.808	S	S	*	*			trans	-78.5	154.8	-169.7	-59.8	163.2	0	0	0	114.7
267	G	23.8	Very low	26.9	Very low	66 Å²	66	148.3 Å²	148.3	68%	0.68	81%	0.81	S	S	*	*			trans	172.6	93.6	162.4	0	0	0	0	0	121.1
268	T	23.5	Very low	27.1	Very low	150 Å²	150	153.2 Å²	153.2	92%	0.92	83%	0.83	S	S	*	*			trans	62.9	166.4	140.1	47.7	0	0	0	0	122.8
269	E	27.6	Very low	27.3	Very low	188 Å²	188	156.1 Å²	156.1	88%	0.879	84%	0.839	S	S	*	*			trans	-104.7	148.4	-174	-52.9	157.2	129.9	0	0	111.1
270	E	25.7	Very low	27.2	Very low	191 Å²	191	156.2 Å²	156.2	89%	0.893	85%	0.845	S	S	*	*			trans	-168.7	167.5	136.4	-120.5	-173.2	-177.7	0	0	112.8
271	E	29.8	Very low	27.9	Very low	178 Å²	178	153.1 Å²	153.1	83%	0.832	85%	0.845	S	S	*	*			trans	-97.1	144.9	-172.9	-54.5	176.3	137.5	0	0	113.3
272	R	27.1	Very low	28.1	Very low	236 Å²	236	149.4 Å²	149.4	89%	0.891	84%	0.839	S	S	*	*			trans	-166.3	149.8	135.4	-114.4	177	-157.6	85.2	2.1	114.7
273	E	27.6	Very low	28.5	Very low	178 Å²	178	150.7 Å²	150.7	83%	0.832	85%	0.845	S	S	*	*			trans	-83.9	144.7	171.4	-51.5	166.7	124.1	0	0	110.7
274	T	27.3	Very low	29.1	Very low	145 Å²	145	153.6 Å²	153.6	89%	0.89	85%	0.852	S	S	*	*				-164.2	158.9	129.7	7.4	0	0	0	0	112.8
275	E	27.7	Very low	29.6	Very low	196 Å²	196	153.9 Å²	153.9	92%	0.916	86%	0.855	S	S	*	*			trans	-73.1	161	-167.9	-52.1	166.6	133.5	0	0	114.6
276	G	27.1	Very low	30.7	Very low	84 Å²	84	152.7 Å²	152.7	87%	0.866	85%	0.849	S	S	*	*			trans	141.9	87.5	167.1	0	0	0	0	0	113.3
277	G	26	Very low	32	Very low	78 Å²	78	148 Å²	148	80%	0.804	83%	0.831	S	S	*	*			trans	-110	150.9	-174.7	0	0	0	0	0	114.8
278	E	27.8	Very low	34.2	Very low	201 Å²	201	147.5 Å²	147.5	94%	0.939	81%	0.812	S	S	*	*			trans	-124.6	158.3	156.9	-74	-167.1	126.4	0	0	109.7
279	Q	32.8	Very low	35.9	Very low	201 Å²	201	144.3 Å²	144.3	94%	0.939	79%	0.793	S	S	*	*			trans	-103.4	129.5	-168.2	-62.4	173.2	-3	0	0	111.7
280	D	28.3	Very low	37.9	Very low	167 Å²	167	135.4 Å²	135.4	89%	0.893	75%	0.751	S	S	*	*			trans	-139	146.5	150.7	-160.1	2.8	0	0	0	110.8
281	G	40.6	Very low	40	Very low	71 Å²	71	130.8 Å²	130.8	73%	0.732	74%	0.741	S	S	*	*			trans	-97.4	119.7	-162.5	0	0	0	0	0	114
282	S	32.9	Very low	41.7	Very low	103 Å²	103	128.3 Å²	128.3	72%	0.72	73%	0.729	S	S	*	*			trans	-125.6	95.6	166.4	51.2	0	0	0	0	111.8	L284	S282-L284 PolarHBondContact O-N 3.08Å
283	E	36.3	Very low	43.7	Very low	201 Å²	201	118.8 Å²	118.8	94%	0.939	70%	0.698	S	S	*	*			trans	-66.1	94.8	168.5	-76.9	-166.4	127.7	0	0	110.2	G285	E283-G285 VanDerWaalsContact C-N 3.32Å; E283-G285 PolarHBondContact O-N 2.85Å
284	L	38.8	Very low	45.4	Very low	157 Å²	157	116.4 Å²	116.4	82%	0.822	69%	0.691	S	S	*	*			trans	-66.7	90.8	167.9	-70.2	176.1	0	0	0	109.6	S282 E286	S282-L284 PolarHBondContact O-N 3.08Å; L284-E286 PolarHBondContact O-N 3.48Å
285	G	39.4	Very low	47.2	Very low	73 Å²	73	114.5 Å²	114.5	75%	0.753	67%	0.67	S	S	*	*			trans	-61.9	96.4	-177.2	0	0	0	0	0	113.5	E283 S287	E283-G285 VanDerWaalsContact C-N 3.32Å; E283-G285 PolarHBondContact O-N 2.85Å; G285-S287 PolarHBondContact O-N 2.84Å; G285-S287 VanDerWaalsContact O-N 3.15Å
286	E	49.2	Very low	48.8	Very low	169 Å²	169	110.7 Å²	110.7	79%	0.79	66%	0.655	S	S	*	*			trans	-53	115.6	-177.6	-65.3	-169.3	145.6	0	0	112.6	L284 L288	L284-E286 PolarHBondContact O-N 3.48Å; E286-L288 PolarHBondContact O-N 3.29Å
287	S	52.7	Low	51	Low	76 Å²	76	108.8 Å²	108.8	53%	0.531	62%	0.624	S	S	.	*			trans	-87.9	90.4	-176.8	58.4	0	0	0	0	111.5	G285 T289 L296	G285-S287 PolarHBondContact O-N 2.84Å; G285-S287 VanDerWaalsContact O-N 3.15Å; S287-T289 PolarHBondContact O-N 3.44Å; S287-L296 WeakPolarHBondContact O-CD2 3.21Å
288	L	69.7	Low	52.8	Low	54 Å²	54	114.7 Å²	114.7	28%	0.283	63%	0.627	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-57.1	120.4	-172.9	-61	154.5	0	0	0	112.9	E286 F297 I300 L303	E286-L288 PolarHBondContact O-N 3.29Å; L288-F297 WeakPolarHBondContact CB-O 3.47Å; L288-F297 PolarHBondContact N-O 3.08Å; L288-F297 VanDerWaalsContact N-O 3.16Å; L288-F297 PolarHBondContact O-N 3.29Å; L288-I300 HydrophobicContact CD1-CB 4.28Å; L288-I300 HydrophobicContact CD1-CG1 3.43Å; L288-I300 VanDerWaalsContact CD1-CG1 3.43Å; L288-I300 HydrophobicContact CD2-CG1 4.46Å; L288-L303 HydrophobicContact CB-CD2 4.14Å
289	T	59.4	Low	55	Low	83 Å²	83	107.6 Å²	107.6	51%	0.509	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.3	154.2	179.4	48.3	0	0	0	0	112.5	S287 L296 L303	S287-T289 PolarHBondContact O-N 3.44Å; T289-L296 HydrophobicContact CG2-CD2 3.51Å; T289-L296 HydrophobicContact CG2-CG 4.5Å; T289-L303 WeakPolarHBondContact O-CD2 3.42Å
290	C	70.9	Confident	56.7	Low	1 Å²	1	102 Å²	102	1%	0.007	57%	0.572	C	S	.	*	P	Polyproline II helix	trans	-101	117.4	167.8	-173.9	0	0	0	0	110.8	E292 C293 N294 K295 F297 L303 H306	C290-E292 PolarHBondContact O-N 3.04Å; C290-E292 VanDerWaalsContact O-N 3.13Å; C290-C293 PolarHBondContact O-N 3.42Å; C290-N294 WeakPolarHBondContact O-CA 3.29Å; C290-N294 PolarHBondContact O-N 3.29Å; C290-K295 PolarHBondContact N-O 3.43Å; C290-F297 HydrophobicContact CB-CE2 4.15Å; C290-L303 HydrophobicContact CB-CD1 3.45Å; C290-L303 VanDerWaalsContact CB-CD1 3.45Å; C290-H306 VanDerWaalsContact SG-CD2 3.54Å
291	S	68.1	Low	58.6	Low	95 Å²	95	97.7 Å²	97.7	66%	0.664	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.8	-37.8	179.9	55	0	0	0	0	114.3	C293	S291-C293 PolarHBondContact O-N 2.94Å
292	E	65.7	Low	60	Low	126 Å²	126	95.5 Å²	95.5	59%	0.589	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-19.8	-173.4	-58.9	-61.2	141.8	0	0	114.3	C290 H310	C290-E292 PolarHBondContact O-N 3.04Å; C290-E292 VanDerWaalsContact O-N 3.13Å; E292-H310 HydrophobicContact CB-CB 4.5Å; E292-H310 HydrophobicContact CG-CB 4.25Å
293	C	69.1	Low	61.8	Low	35 Å²	35	91.4 Å²	91.4	24%	0.236	50%	0.498	C	S	.	.	T	Hydrogen-bonded Turn	trans	-160.9	23.7	-179.5	72.5	0	0	0	0	116.3	C290 S291 K295 H306 H310	C290-C293 PolarHBondContact O-N 3.42Å; S291-C293 PolarHBondContact O-N 2.94Å; C293-K295 PolarHBondContact O-N 3.26Å; C293-K295 PolarHBondContact O-NZ 2.86Å; C293-K295 PolarHBondContact SG-NZ 3.18Å; C293-H306 PolarHBondContact SG-NE2 3.46Å; C293-H310 WeakPolarHBondContact CB-NE2 3.23Å; C293-H310 PolarHBondContact SG-NE2 3.4Å
294	N	64.4	Low	63.3	Low	128 Å²	128	89.6 Å²	89.6	68%	0.684	48%	0.482	S	S	*	.			trans	47.2	33.1	172.9	-62.3	-16	0	0	0	115.5	C290	C290-N294 WeakPolarHBondContact O-CA 3.29Å; C290-N294 PolarHBondContact O-N 3.29Å
295	K	64	Low	64.5	Low	106 Å²	106	88 Å²	88	46%	0.461	47%	0.465	S	S	.	.			trans	-85	130.5	174.1	-75.8	175.1	-169.2	62.5	0	110.4	C290 C293 F297	C290-K295 PolarHBondContact N-O 3.43Å; C293-K295 PolarHBondContact O-N 3.26Å; C293-K295 PolarHBondContact O-NZ 2.86Å; C293-K295 PolarHBondContact SG-NZ 3.18Å; K295-F297 HydrophobicContact CB-CD2 4.47Å; K295-F297 HydrophobicContact CB-CE2 3.52Å; K295-F297 HydrophobicContact CB-CZ 3.83Å; K295-F297 WeakPolarHBondContact O-CD2 3.46Å; K295-F297 VanDerWaalsContact O-CE2 3.23Å; K295-F297 WeakPolarHBondContact O-CE2 3.11Å
296	L	60.8	Low	65.9	Low	115 Å²	115	85.5 Å²	85.5	60%	0.602	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	134.1	177.4	-64.9	162.4	0	0	0	110.9	S287 T289	S287-L296 WeakPolarHBondContact O-CD2 3.21Å; T289-L296 HydrophobicContact CG2-CD2 3.51Å; T289-L296 HydrophobicContact CG2-CG 4.5Å
297	F	73.5	Confident	66.7	Low	45 Å²	45	80 Å²	80	20%	0.197	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	132.2	177.8	-64.7	-83.4	0	0	0	110.9	L288 C290 K295 D299 L303 H306	L288-F297 WeakPolarHBondContact CB-O 3.47Å; L288-F297 PolarHBondContact N-O 3.08Å; L288-F297 VanDerWaalsContact N-O 3.16Å; L288-F297 PolarHBondContact O-N 3.29Å; C290-F297 HydrophobicContact CB-CE2 4.15Å; K295-F297 HydrophobicContact CB-CD2 4.47Å; K295-F297 HydrophobicContact CB-CE2 3.52Å; K295-F297 HydrophobicContact CB-CZ 3.83Å; K295-F297 WeakPolarHBondContact O-CD2 3.46Å; K295-F297 VanDerWaalsContact O-CE2 3.23Å; K295-F297 WeakPolarHBondContact O-CE2 3.11Å; F297-D299 PolarHBondContact O-N 3.21Å; F297-D299 VanDerWaalsContact O-N 3.11Å; F297-L303 HydrophobicContact CB-CB 4.22Å; F297-L303 HydrophobicContact CD2-CB 4.24Å; F297-L303 HydrophobicContact CD2-CD1 4.02Å; F297-L303 HydrophobicContact CE2-CD1 4.38Å; F297-L303 HydrophobicContact CG-CB 4.33Å; F297-H306 HydrophobicContact CE1-CB 3.93Å; F297-H306 HydrophobicContact CE2-CB 3.99Å; F297-H306 AromaticContact CE2-CD2 3.18Å; F297-H306 WeakPolarHBondContact CE2-CD2 3.27Å; F297-H306 AromaticContact CE2-CG 3.7Å; F297-H306 AromaticContact CE2-NE2 3.9Å; F297-H306 HydrophobicContact CZ-CB 3.51Å; F297-H306 AromaticContact CZ-CD2 3.25Å; F297-H306 WeakPolarHBondContact CZ-CD2 3.42Å; F297-H306 AromaticContact CZ-CG 3.28Å; F297-H306 AromaticContact CZ-ND1 3.96Å; F297-H306 AromaticContact CZ-NE2 3.88Å
298	K	64.6	Low	67.4	Low	201 Å²	201	81.3 Å²	81.3	87%	0.874	40%	0.404	S	S	*	.	S	Bend	trans	-77.6	16.2	179.2	68.9	175.2	-144	102.8	0	115.4
299	D	73.6	Confident	67	Low	53 Å²	53	82.7 Å²	82.7	28%	0.283	41%	0.411	S	S	.	.	S	Bend	trans	-176	133.1	-170.1	146.3	56.1	0	0	0	111.6	F297 S301 S302 L303 R305	F297-D299 PolarHBondContact O-N 3.21Å; F297-D299 VanDerWaalsContact O-N 3.11Å; D299-S301 VanDerWaalsContact CG-N 3.33Å; D299-S301 PolarHBondContact O-N 2.92Å; D299-S301 WeakPolarHBondContact OD1-CA 3.42Å; D299-S301 WeakPolarHBondContact OD1-CB 3.48Å; D299-S301 PolarHBondContact OD1-N 3.38Å; D299-S301 PolarHBondContact OD1-OG 2.85Å; D299-S301 WeakPolarHBondContact OD2-CB 3.23Å; D299-S302 WeakPolarHBondContact O-CA 3.43Å; D299-S302 WeakPolarHBondContact O-CB 3.35Å; D299-S302 PolarHBondContact O-N 2.92Å; D299-S302 VanDerWaalsContact OD2-CB 3.29Å; D299-S302 WeakPolarHBondContact OD2-CB 3.42Å; D299-S302 PolarHBondContact OD2-N 2.9Å; D299-S302 PolarHBondContact OD2-OG 3.24Å; D299-L303 PolarHBondContact O-N 2.86Å; D299-L303 VanDerWaalsContact O-N 3.09Å; D299-R305 IonicContact OD2-NH2 2.63Å
300	I	69.3	Low	67.2	Low	84 Å²	84	83.1 Å²	83.1	43%	0.431	41%	0.407	S	S	.	.	H	α-helix	trans	-57.4	-36.7	177.8	-55.9	174	0	0	0	111.3	L288 S302 L303 R304	L288-I300 HydrophobicContact CD1-CB 4.28Å; L288-I300 HydrophobicContact CD1-CG1 3.43Å; L288-I300 VanDerWaalsContact CD1-CG1 3.43Å; L288-I300 HydrophobicContact CD2-CG1 4.46Å; I300-S302 PolarHBondContact O-N 2.96Å; I300-L303 PolarHBondContact O-N 2.66Å; I300-R304 HydrophobicContact CG2-CG 4.06Å; I300-R304 WeakPolarHBondContact O-CB 3.49Å; I300-R304 WeakPolarHBondContact O-CG 3.4Å; I300-R304 PolarHBondContact O-N 3.18Å
301	S	68.2	Low	66.9	Low	75 Å²	75	90.1 Å²	90.1	52%	0.524	44%	0.437	S	S	.	.	H	α-helix	trans	-71.3	-11.2	178	-36.1	0	0	0	0	113.3	D299 R305	D299-S301 VanDerWaalsContact CG-N 3.33Å; D299-S301 PolarHBondContact O-N 2.92Å; D299-S301 WeakPolarHBondContact OD1-CA 3.42Å; D299-S301 WeakPolarHBondContact OD1-CB 3.48Å; D299-S301 PolarHBondContact OD1-N 3.38Å; D299-S301 PolarHBondContact OD1-OG 2.85Å; D299-S301 WeakPolarHBondContact OD2-CB 3.23Å; S301-R305 WeakPolarHBondContact O-CB 3.27Å; S301-R305 PolarHBondContact O-NE 3.2Å; S301-R305 VanDerWaalsContact O-NE 3.14Å; S301-R305 PolarHBondContact O-NH2 3.33Å
302	S	69.5	Low	66.3	Low	25 Å²	25	87.4 Å²	87.4	18%	0.175	42%	0.424	C	S	.	.	H	α-helix	trans	-96	-38.7	172.2	-65.1	0	0	0	0	110.9	D299 I300 R305 H306	D299-S302 WeakPolarHBondContact O-CA 3.43Å; D299-S302 WeakPolarHBondContact O-CB 3.35Å; D299-S302 PolarHBondContact O-N 2.92Å; D299-S302 VanDerWaalsContact OD2-CB 3.29Å; D299-S302 WeakPolarHBondContact OD2-CB 3.42Å; D299-S302 PolarHBondContact OD2-N 2.9Å; D299-S302 PolarHBondContact OD2-OG 3.24Å; I300-S302 PolarHBondContact O-N 2.96Å; S302-R305 VanDerWaalsContact CA-NH2 3.31Å; S302-R305 PolarHBondContact O-N 3.48Å; S302-R305 PolarHBondContact OG-NH2 3.35Å; S302-H306 WeakPolarHBondContact O-CB 3.2Å; S302-H306 PolarHBondContact O-N 3.07Å
303	L	69.9	Low	65.7	Low	18 Å²	18	86.5 Å²	86.5	9%	0.094	42%	0.423	C	S	.	.	H	α-helix	trans	-62.5	-56.4	170.3	174.7	55.8	0	0	0	112.2	L288 T289 C290 F297 D299 I300 R305 H306 E307	L288-L303 HydrophobicContact CB-CD2 4.14Å; T289-L303 WeakPolarHBondContact O-CD2 3.42Å; C290-L303 HydrophobicContact CB-CD1 3.45Å; C290-L303 VanDerWaalsContact CB-CD1 3.45Å; F297-L303 HydrophobicContact CB-CB 4.22Å; F297-L303 HydrophobicContact CD2-CB 4.24Å; F297-L303 HydrophobicContact CD2-CD1 4.02Å; F297-L303 HydrophobicContact CE2-CD1 4.38Å; F297-L303 HydrophobicContact CG-CB 4.33Å; D299-L303 PolarHBondContact O-N 2.86Å; D299-L303 VanDerWaalsContact O-N 3.09Å; I300-L303 PolarHBondContact O-N 2.66Å; L303-R305 PolarHBondContact O-N 3.49Å; L303-H306 CarbonylContact O-C 3.5Å; L303-H306 WeakPolarHBondContact O-CA 3.37Å; L303-H306 WeakPolarHBondContact O-CB 3.43Å; L303-H306 PolarHBondContact O-N 3.23Å; L303-E307 HydrophobicContact CD1-CG 4.2Å; L303-E307 WeakPolarHBondContact CG-OE1 3.45Å; L303-E307 WeakPolarHBondContact O-CG 3.41Å; L303-E307 PolarHBondContact O-N 2.93Å
304	R	67.8	Low	65	Low	163 Å²	163	90 Å²	90	62%	0.615	43%	0.434	S	S	*	.	H	α-helix	trans	-57.6	-22.5	177.1	-70.2	179.1	178.6	174.6	0.9	114.1	I300	I300-R304 HydrophobicContact CG2-CG 4.06Å; I300-R304 WeakPolarHBondContact O-CB 3.49Å; I300-R304 WeakPolarHBondContact O-CG 3.4Å; I300-R304 PolarHBondContact O-N 3.18Å
305	R	64.5	Low	64.7	Low	124 Å²	124	87.9 Å²	87.9	47%	0.468	43%	0.427	S	S	.	.	H	α-helix	trans	-88.2	-23.3	175.5	170.1	164.2	35.2	92.1	3.6	112.7	D299 S301 S302 L303	D299-R305 IonicContact OD2-NH2 2.63Å; S301-R305 WeakPolarHBondContact O-CB 3.27Å; S301-R305 PolarHBondContact O-NE 3.2Å; S301-R305 VanDerWaalsContact O-NE 3.14Å; S301-R305 PolarHBondContact O-NH2 3.33Å; S302-R305 VanDerWaalsContact CA-NH2 3.31Å; S302-R305 PolarHBondContact O-N 3.48Å; S302-R305 PolarHBondContact OG-NH2 3.35Å; L303-R305 PolarHBondContact O-N 3.49Å
306	H	69.9	Low	64.2	Low	19 Å²	19	86.4 Å²	86.4	9%	0.088	42%	0.421	C	S	.	.	H	α-helix	trans	-79.7	-40.3	170.3	171.5	53.4	0	0	0	111.9	C290 C293 F297 S302 L303 K308 I309	C290-H306 VanDerWaalsContact SG-CD2 3.54Å; C293-H306 PolarHBondContact SG-NE2 3.46Å; F297-H306 HydrophobicContact CE1-CB 3.93Å; F297-H306 HydrophobicContact CE2-CB 3.99Å; F297-H306 AromaticContact CE2-CD2 3.18Å; F297-H306 WeakPolarHBondContact CE2-CD2 3.27Å; F297-H306 AromaticContact CE2-CG 3.7Å; F297-H306 AromaticContact CE2-NE2 3.9Å; F297-H306 HydrophobicContact CZ-CB 3.51Å; F297-H306 AromaticContact CZ-CD2 3.25Å; F297-H306 WeakPolarHBondContact CZ-CD2 3.42Å; F297-H306 AromaticContact CZ-CG 3.28Å; F297-H306 AromaticContact CZ-ND1 3.96Å; F297-H306 AromaticContact CZ-NE2 3.88Å; S302-H306 WeakPolarHBondContact O-CB 3.2Å; S302-H306 PolarHBondContact O-N 3.07Å; L303-H306 CarbonylContact O-C 3.5Å; L303-H306 WeakPolarHBondContact O-CA 3.37Å; L303-H306 WeakPolarHBondContact O-CB 3.43Å; L303-H306 PolarHBondContact O-N 3.23Å; H306-K308 PolarHBondContact O-N 3.08Å; H306-K308 VanDerWaalsContact O-N 3.17Å; H306-I309 WeakPolarHBondContact O-CA 3.39Å; H306-I309 WeakPolarHBondContact O-CB 3.29Å; H306-I309 VanDerWaalsContact O-CG1 3.28Å; H306-I309 WeakPolarHBondContact O-CG1 3.45Å; H306-I309 PolarHBondContact O-N 3.01Å
307	E	64.7	Low	63.4	Low	54 Å²	54	84.3 Å²	84.3	25%	0.252	42%	0.416	S	S	.	.	H	α-helix	trans	-56.2	-32.4	176.2	-70	166	-176.5	0	0	113.7	L303 I309 H310 K311	L303-E307 HydrophobicContact CD1-CG 4.2Å; L303-E307 WeakPolarHBondContact CG-OE1 3.45Å; L303-E307 WeakPolarHBondContact O-CG 3.41Å; L303-E307 PolarHBondContact O-N 2.93Å; E307-I309 PolarHBondContact O-N 3.32Å; E307-I309 VanDerWaalsContact O-N 3.1Å; E307-H310 PolarHBondContact O-N 3.39Å; E307-K311 PolarHBondContact O-N 2.97Å
308	K	68.5	Low	62.2	Low	103 Å²	103	82.3 Å²	82.3	45%	0.448	41%	0.408	S	S	.	.	H	α-helix	trans	-64.5	-8	172.7	-66.7	178.8	-176.1	-171.9	0	113.8	H306	H306-K308 PolarHBondContact O-N 3.08Å; H306-K308 VanDerWaalsContact O-N 3.17Å
309	I	60.3	Low	61.6	Low	83 Å²	83	79.5 Å²	79.5	43%	0.426	40%	0.401	S	S	.	.	H	α-helix	trans	-78	-46	168.3	-59.4	180	0	0	0	110.1	H306 E307 R326	H306-I309 WeakPolarHBondContact O-CA 3.39Å; H306-I309 WeakPolarHBondContact O-CB 3.29Å; H306-I309 VanDerWaalsContact O-CG1 3.28Å; H306-I309 WeakPolarHBondContact O-CG1 3.45Å; H306-I309 PolarHBondContact O-N 3.01Å; E307-I309 PolarHBondContact O-N 3.32Å; E307-I309 VanDerWaalsContact O-N 3.1Å; I309-R326 PolarHBondContact O-NH2 3.38Å; I309-R326 VanDerWaalsContact O-NH2 3.09Å
310	H	64.6	Low	60.2	Low	92 Å²	92	82.8 Å²	82.8	43%	0.426	41%	0.413	S	S	.	.	H	α-helix	trans	-69.5	-50	178.8	-58.8	-66.7	0	0	0	111.3	E292 C293 E307 G312	E292-H310 HydrophobicContact CB-CB 4.5Å; E292-H310 HydrophobicContact CG-CB 4.25Å; C293-H310 WeakPolarHBondContact CB-NE2 3.23Å; C293-H310 PolarHBondContact SG-NE2 3.4Å; E307-H310 PolarHBondContact O-N 3.39Å; H310-G312 PolarHBondContact O-N 2.92Å
311	K	63	Low	59.4	Low	148 Å²	148	81 Å²	81	64%	0.643	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	6.5	179.3	-63.1	-178.4	178.7	175.3	0	114.2	E307 L313	E307-K311 PolarHBondContact O-N 2.97Å; K311-L313 HydrophobicContact CB-CG 4.44Å; K311-L313 WeakPolarHBondContact O-CG 3.44Å; K311-L313 PolarHBondContact O-N 3.44Å
312	G	55.6	Low	58.4	Low	38 Å²	38	82.3 Å²	82.3	39%	0.392	42%	0.416	S	S	.	.			trans	71.4	-31.5	174.9	0	0	0	0	0	116.7	H310 K314	H310-G312 PolarHBondContact O-N 2.92Å; G312-K314 PolarHBondContact O-N 2.97Å
313	L	53.8	Low	57.4	Low	107 Å²	107	87 Å²	87	56%	0.56	43%	0.433	S	S	*	.			trans	-45.9	123.4	-165.9	-57.5	-178.5	0	0	0	114.6	K311 P315	K311-L313 HydrophobicContact CB-CG 4.44Å; K311-L313 WeakPolarHBondContact O-CG 3.44Å; K311-L313 PolarHBondContact O-N 3.44Å; L313-P315 VanDerWaalsContact C-CD 3.47Å; L313-P315 WeakPolarHBondContact O-CD 3.41Å
314	K	55.6	Low	56.3	Low	109 Å²	109	89.2 Å²	89.2	47%	0.474	45%	0.448	S	S	.	.			trans	-120	68.9	173.5	-62.1	176	-179.9	177.2	0	110.6	G312 F316 T324 F325 R326	G312-K314 PolarHBondContact O-N 2.97Å; K314-F316 PolarHBondContact O-N 3.42Å; K314-T324 VanDerWaalsContact CD-OG1 3.23Å; K314-T324 WeakPolarHBondContact CD-OG1 3.44Å; K314-F325 CarbonylContact C-O 3.59Å; K314-F325 VanDerWaalsContact CA-O 3.25Å; K314-F325 WeakPolarHBondContact CA-O 3.41Å; K314-R326 HydrophobicContact CG-CG 3.97Å
315	P	56.3	Low	56.2	Low	83 Å²	83	83.4 Å²	83.4	54%	0.539	43%	0.427	S	S	.	.			trans	-71	-0.8	-167.4	29.2	-36.2	0	0	0	115.3	L313	L313-P315 VanDerWaalsContact C-CD 3.47Å; L313-P315 WeakPolarHBondContact O-CD 3.41Å
316	F	55.3	Low	55.8	Low	75 Å²	75	81.9 Å²	81.9	33%	0.329	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	99.4	-178.9	-56.7	-74.1	0	0	0	110.3	K314 F325 Q327 A328 L331	K314-F316 PolarHBondContact O-N 3.42Å; F316-F325 HydrophobicContact CB-CB 4.28Å; F316-F325 PolarHBondContact N-O 3.01Å; F316-F325 PolarHBondContact O-N 3.18Å; F316-Q327 VanDerWaalsContact CD2-C 3.41Å; F316-A328 HydrophobicContact CD1-CB 3.95Å; F316-A328 VanDerWaalsContact CD2-N 3.34Å; F316-A328 HydrophobicContact CE1-CB 3.71Å; F316-A328 HydrophobicContact CE2-CB 4.35Å; F316-A328 HydrophobicContact CG-CB 4.38Å; F316-A328 HydrophobicContact CZ-CB 3.92Å; F316-L331 HydrophobicContact CB-CB 4.18Å; F316-L331 HydrophobicContact CB-CD2 3.98Å
317	S	44	Very low	55.4	Low	72 Å²	72	84.4 Å²	84.4	50%	0.503	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	150.6	177	51.4	0	0	0	0	112.4	L331	S317-L331 WeakPolarHBondContact O-CD1 3.01Å; S317-L331 VanDerWaalsContact O-CD2 3.27Å; S317-L331 WeakPolarHBondContact O-CD2 3.25Å
318	C	47.7	Very low	54.9	Low	3 Å²	3	84.2 Å²	84.2	2%	0.02	44%	0.441	C	S	.	.			trans	-93.5	118.3	170.2	-176.9	0	0	0	0	111	F320 C321 S322 K323 F325 L331 H334	C318-F320 PolarHBondContact O-N 3.5Å; C318-C321 PolarHBondContact O-N 2.87Å; C318-S322 VanDerWaalsContact O-CA 3.29Å; C318-S322 WeakPolarHBondContact O-CA 3.34Å; C318-S322 PolarHBondContact O-N 2.83Å; C318-K323 HydrophobicContact CB-CB 4.42Å; C318-K323 WeakPolarHBondContact CB-O 3.4Å; C318-K323 PolarHBondContact N-O 2.77Å; C318-F325 HydrophobicContact CB-CE2 4.27Å; C318-L331 HydrophobicContact CB-CD1 3.81Å; C318-H334 PolarHBondContact SG-CD2 3.34Å; C318-H334 PolarHBondContact SG-NE2 3.41Å
319	I	52.1	Low	54.7	Low	141 Å²	141	83.8 Å²	83.8	72%	0.723	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-25.2	179	61.8	179	0	0	0	113.9
320	F	42.8	Very low	54.9	Low	122 Å²	122	83.1 Å²	83.1	54%	0.535	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-17.7	-174.6	-59.7	-66.5	0	0	0	114.8	C318 L335 H338	C318-F320 PolarHBondContact O-N 3.5Å; F320-L335 HydrophobicContact CD2-CD2 3.75Å; F320-L335 HydrophobicContact CE2-CD2 3.95Å; F320-H338 HydrophobicContact CB-CB 4.19Å; F320-H338 HydrophobicContact CD2-CB 3.63Å; F320-H338 AromaticContact CD2-CD2 3.92Å; F320-H338 AromaticContact CD2-CG 3.82Å; F320-H338 HydrophobicContact CE2-CB 4.19Å; F320-H338 HydrophobicContact CG-CB 3.98Å; F320-H338 AromaticContact CG-CG 3.94Å
321	C	52.7	Low	54.7	Low	46 Å²	46	80 Å²	80	31%	0.311	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.9	26.8	178	76.8	0	0	0	0	114.6	C318 K323 H334 H338	C318-C321 PolarHBondContact O-N 2.87Å; C321-K323 PolarHBondContact O-N 3.25Å; C321-K323 VanDerWaalsContact SG-CD 3.58Å; C321-H334 PolarHBondContact SG-NE2 3.28Å; C321-H338 PolarHBondContact SG-NE2 3.3Å
322	S	46.9	Very low	54.7	Low	103 Å²	103	80.5 Å²	80.5	72%	0.72	43%	0.431	S	S	*	.			trans	55.7	9.3	172.4	-51.3	0	0	0	0	117.6	C318 T324	C318-S322 VanDerWaalsContact O-CA 3.29Å; C318-S322 WeakPolarHBondContact O-CA 3.34Å; C318-S322 PolarHBondContact O-N 2.83Å; S322-T324 PolarHBondContact O-N 3.45Å
323	K	48.9	Very low	55	Low	123 Å²	123	82.7 Å²	82.7	54%	0.535	44%	0.437	S	S	.	.			trans	-69.4	127.4	178.8	-72.8	174.2	-171	166	0	110.1	C318 C321 F325	C318-K323 HydrophobicContact CB-CB 4.42Å; C318-K323 WeakPolarHBondContact CB-O 3.4Å; C318-K323 PolarHBondContact N-O 2.77Å; C321-K323 PolarHBondContact O-N 3.25Å; C321-K323 VanDerWaalsContact SG-CD 3.58Å; K323-F325 HydrophobicContact CB-CE2 3.77Å; K323-F325 HydrophobicContact CB-CZ 3.86Å; K323-F325 WeakPolarHBondContact O-CD2 3.4Å; K323-F325 WeakPolarHBondContact O-CE2 3.24Å
324	T	46.8	Very low	55.6	Low	65 Å²	65	78.3 Å²	78.3	40%	0.399	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	137.2	-176.6	49.6	0	0	0	0	112.2	K314 S322	K314-T324 VanDerWaalsContact CD-OG1 3.23Å; K314-T324 WeakPolarHBondContact CD-OG1 3.44Å; S322-T324 PolarHBondContact O-N 3.45Å
325	F	65.4	Low	55.5	Low	41 Å²	41	75.5 Å²	75.5	18%	0.18	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	152.8	-170.9	-60.5	-84.7	0	0	0	112	K314 F316 C318 K323 Q330 L331 H334	K314-F325 CarbonylContact C-O 3.59Å; K314-F325 VanDerWaalsContact CA-O 3.25Å; K314-F325 WeakPolarHBondContact CA-O 3.41Å; F316-F325 HydrophobicContact CB-CB 4.28Å; F316-F325 PolarHBondContact N-O 3.01Å; F316-F325 PolarHBondContact O-N 3.18Å; C318-F325 HydrophobicContact CB-CE2 4.27Å; K323-F325 HydrophobicContact CB-CE2 3.77Å; K323-F325 HydrophobicContact CB-CZ 3.86Å; K323-F325 WeakPolarHBondContact O-CD2 3.4Å; K323-F325 WeakPolarHBondContact O-CE2 3.24Å; F325-Q330 HydrophobicContact CB-CB 4.01Å; F325-Q330 HydrophobicContact CD1-CB 3.69Å; F325-Q330 HydrophobicContact CG-CB 4.09Å; F325-L331 HydrophobicContact CD2-CB 4.11Å; F325-L331 HydrophobicContact CD2-CD1 4.04Å; F325-L331 HydrophobicContact CE2-CD1 4.14Å; F325-H334 HydrophobicContact CE1-CB 4.22Å; F325-H334 HydrophobicContact CE2-CB 4.03Å; F325-H334 AromaticContact CE2-CD2 3.41Å; F325-H334 VanDerWaalsContact CE2-CD2 3.41Å; F325-H334 WeakPolarHBondContact CE2-CD2 3.42Å; F325-H334 AromaticContact CE2-CG 3.87Å; F325-H334 HydrophobicContact CZ-CB 3.59Å; F325-H334 AromaticContact CZ-CD2 3.44Å; F325-H334 VanDerWaalsContact CZ-CD2 3.44Å; F325-H334 WeakPolarHBondContact CZ-CD2 3.25Å; F325-H334 AromaticContact CZ-CG 3.46Å; F325-H334 VanDerWaalsContact CZ-CG 3.46Å
326	R	57.9	Low	55.9	Low	93 Å²	93	78.4 Å²	78.4	35%	0.351	40%	0.404	S	S	.	.	S	Bend	trans	-87	-12	-180	-69.4	-175.4	166.4	152.2	-8.4	113.4	I309 K314	I309-R326 PolarHBondContact O-NH2 3.38Å; I309-R326 VanDerWaalsContact O-NH2 3.09Å; K314-R326 HydrophobicContact CG-CG 3.97Å
327	Q	61.4	Low	56.1	Low	71 Å²	71	80.9 Å²	80.9	33%	0.332	42%	0.419	S	S	.	.	S	Bend	trans	-145.1	137.3	-175.4	-59.9	173	2.2	0	0	110.7	F316 T329 Q330 L331	F316-Q327 VanDerWaalsContact CD2-C 3.41Å; Q327-T329 PolarHBondContact O-N 3.36Å; Q327-Q330 HydrophobicContact CB-CG 4.07Å; Q327-Q330 WeakPolarHBondContact O-CB 3.18Å; Q327-Q330 PolarHBondContact O-N 3.1Å; Q327-L331 PolarHBondContact O-N 3.26Å
328	A	52.4	Low	56.7	Low	51 Å²	51	80.9 Å²	80.9	42%	0.421	41%	0.411	S	S	.	.	H	α-helix	trans	-56.8	-32.5	178.8	0	0	0	0	0	113.3	F316 Q330 L331 K332	F316-A328 HydrophobicContact CD1-CB 3.95Å; F316-A328 VanDerWaalsContact CD2-N 3.34Å; F316-A328 HydrophobicContact CE1-CB 3.71Å; F316-A328 HydrophobicContact CE2-CB 4.35Å; F316-A328 HydrophobicContact CG-CB 4.38Å; F316-A328 HydrophobicContact CZ-CB 3.92Å; A328-Q330 VanDerWaalsContact C-N 3.28Å; A328-Q330 PolarHBondContact O-N 3.39Å; A328-L331 PolarHBondContact O-N 2.97Å; A328-K332 PolarHBondContact O-N 2.91Å
329	T	65.3	Low	57	Low	94 Å²	94	84.3 Å²	84.3	58%	0.577	43%	0.432	S	S	*	.	H	α-helix	trans	-60.5	-35.1	174.7	50.9	0	0	0	0	112.8	Q327 K332 T333	Q327-T329 PolarHBondContact O-N 3.36Å; T329-K332 PolarHBondContact O-N 3.37Å; T329-T333 PolarHBondContact O-N 2.92Å; T329-T333 PolarHBondContact O-OG1 3.27Å
330	Q	64.4	Low	56.8	Low	69 Å²	69	80.5 Å²	80.5	32%	0.322	43%	0.428	S	S	.	.	H	α-helix	trans	-71.8	-41.8	178.2	-62.2	168.7	-9.2	0	0	110.7	F325 Q327 A328 T333 H334	F325-Q330 HydrophobicContact CB-CB 4.01Å; F325-Q330 HydrophobicContact CD1-CB 3.69Å; F325-Q330 HydrophobicContact CG-CB 4.09Å; Q327-Q330 HydrophobicContact CB-CG 4.07Å; Q327-Q330 WeakPolarHBondContact O-CB 3.18Å; Q327-Q330 PolarHBondContact O-N 3.1Å; A328-Q330 VanDerWaalsContact C-N 3.28Å; A328-Q330 PolarHBondContact O-N 3.39Å; Q330-T333 WeakPolarHBondContact CA-OG1 3.5Å; Q330-T333 PolarHBondContact O-N 3.5Å; Q330-T333 PolarHBondContact O-OG1 2.91Å; Q330-H334 WeakPolarHBondContact O-CB 3.41Å; Q330-H334 PolarHBondContact O-N 3.04Å
331	L	59.9	Low	56.7	Low	27 Å²	27	81.3 Å²	81.3	14%	0.141	43%	0.433	C	S	.	.	H	α-helix	trans	-61.2	-46.3	171.4	178.5	59.9	0	0	0	110.9	F316 S317 C318 F325 Q327 A328 T333 H334 L335	F316-L331 HydrophobicContact CB-CB 4.18Å; F316-L331 HydrophobicContact CB-CD2 3.98Å; S317-L331 WeakPolarHBondContact O-CD1 3.01Å; S317-L331 VanDerWaalsContact O-CD2 3.27Å; S317-L331 WeakPolarHBondContact O-CD2 3.25Å; C318-L331 HydrophobicContact CB-CD1 3.81Å; F325-L331 HydrophobicContact CD2-CB 4.11Å; F325-L331 HydrophobicContact CD2-CD1 4.04Å; F325-L331 HydrophobicContact CE2-CD1 4.14Å; Q327-L331 PolarHBondContact O-N 3.26Å; A328-L331 PolarHBondContact O-N 2.97Å; L331-T333 VanDerWaalsContact C-N 3.29Å; L331-T333 PolarHBondContact O-N 2.92Å; L331-H334 CarbonylContact O-C 3.59Å; L331-H334 WeakPolarHBondContact O-CA 3.38Å; L331-H334 PolarHBondContact O-N 3.24Å; L331-L335 HydrophobicContact CD1-CD1 4.11Å; L331-L335 HydrophobicContact CD1-CD2 4.11Å; L331-L335 HydrophobicContact CD1-CG 3.85Å; L331-L335 HydrophobicContact CG-CD1 3.92Å; L331-L335 HydrophobicContact CG-CG 4.15Å; L331-L335 WeakPolarHBondContact O-CG 3.45Å; L331-L335 PolarHBondContact O-N 3.05Å
332	K	64.4	Low	56.2	Low	158 Å²	158	87.6 Å²	87.6	69%	0.687	46%	0.458	S	S	*	.	H	α-helix	trans	-68.3	-19.9	177.3	-166.3	168.5	-176.9	174.2	0	114.3	A328 T329 R336	A328-K332 PolarHBondContact O-N 2.91Å; T329-K332 PolarHBondContact O-N 3.37Å; K332-R336 PolarHBondContact O-NE 3.4Å
333	T	61.2	Low	55.7	Low	84 Å²	84	87.3 Å²	87.3	52%	0.515	46%	0.462	S	S	.	.	H	α-helix	trans	-79.2	-28.6	164.4	46.9	0	0	0	0	113.2	T329 Q330 L331	T329-T333 PolarHBondContact O-N 2.92Å; T329-T333 PolarHBondContact O-OG1 3.27Å; Q330-T333 WeakPolarHBondContact CA-OG1 3.5Å; Q330-T333 PolarHBondContact O-N 3.5Å; Q330-T333 PolarHBondContact O-OG1 2.91Å; L331-T333 VanDerWaalsContact C-N 3.29Å; L331-T333 PolarHBondContact O-N 2.92Å
334	H	66.2	Low	55.1	Low	15 Å²	15	90.9 Å²	90.9	7%	0.069	48%	0.48	C	S	.	.	H	α-helix	trans	-84.3	-36.1	-178	173.2	49.5	0	0	0	113.3	C318 C321 F325 Q330 L331 R336 I337 H338	C318-H334 PolarHBondContact SG-CD2 3.34Å; C318-H334 PolarHBondContact SG-NE2 3.41Å; C321-H334 PolarHBondContact SG-NE2 3.28Å; F325-H334 HydrophobicContact CE1-CB 4.22Å; F325-H334 HydrophobicContact CE2-CB 4.03Å; F325-H334 AromaticContact CE2-CD2 3.41Å; F325-H334 VanDerWaalsContact CE2-CD2 3.41Å; F325-H334 WeakPolarHBondContact CE2-CD2 3.42Å; F325-H334 AromaticContact CE2-CG 3.87Å; F325-H334 HydrophobicContact CZ-CB 3.59Å; F325-H334 AromaticContact CZ-CD2 3.44Å; F325-H334 VanDerWaalsContact CZ-CD2 3.44Å; F325-H334 WeakPolarHBondContact CZ-CD2 3.25Å; F325-H334 AromaticContact CZ-CG 3.46Å; F325-H334 VanDerWaalsContact CZ-CG 3.46Å; Q330-H334 WeakPolarHBondContact O-CB 3.41Å; Q330-H334 PolarHBondContact O-N 3.04Å; L331-H334 CarbonylContact O-C 3.59Å; L331-H334 WeakPolarHBondContact O-CA 3.38Å; L331-H334 PolarHBondContact O-N 3.24Å; H334-R336 PolarHBondContact O-N 2.87Å; H334-I337 VanDerWaalsContact O-CB 3.29Å; H334-I337 WeakPolarHBondContact O-CB 3.49Å; H334-I337 WeakPolarHBondContact O-CG1 3.17Å; H334-I337 PolarHBondContact O-N 3.48Å; H334-H338 AromaticContact CE1-CD2 3.96Å; H334-H338 AromaticContact CE1-NE2 3.3Å; H334-H338 PolarHBondContact CE1-NE2 3.37Å; H334-H338 VanDerWaalsContact CE1-NE2 3.3Å; H334-H338 AromaticContact NE2-CD2 3.88Å; H334-H338 AromaticContact NE2-NE2 3.24Å; H334-H338 PolarHBondContact NE2-NE2 2.96Å
335	L	52.7	Low	54.2	Low	50 Å²	50	96.6 Å²	96.6	26%	0.262	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-60.3	-28	177.3	-69.6	172	0	0	0	112.6	F320 L331 I337 H338 T339	F320-L335 HydrophobicContact CD2-CD2 3.75Å; F320-L335 HydrophobicContact CE2-CD2 3.95Å; L331-L335 HydrophobicContact CD1-CD1 4.11Å; L331-L335 HydrophobicContact CD1-CD2 4.11Å; L331-L335 HydrophobicContact CD1-CG 3.85Å; L331-L335 HydrophobicContact CG-CD1 3.92Å; L331-L335 HydrophobicContact CG-CG 4.15Å; L331-L335 WeakPolarHBondContact O-CG 3.45Å; L331-L335 PolarHBondContact O-N 3.05Å; L335-I337 PolarHBondContact O-N 3.28Å; L335-I337 VanDerWaalsContact O-N 3.16Å; L335-H338 WeakPolarHBondContact O-CA 3.38Å; L335-H338 WeakPolarHBondContact O-CB 3.45Å; L335-H338 PolarHBondContact O-N 3.41Å; L335-T339 PolarHBondContact O-N 3.18Å
336	R	66.1	Low	52.5	Low	144 Å²	144	105.2 Å²	105.2	54%	0.543	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-64.4	-11.2	171.9	-80.3	-178.4	-79.2	170.6	-8.5	115.3	K332 H334 H338 T339	K332-R336 PolarHBondContact O-NE 3.4Å; H334-R336 PolarHBondContact O-N 2.87Å; R336-H338 VanDerWaalsContact C-N 3.34Å; R336-T339 WeakPolarHBondContact CA-OG1 3.23Å
337	I	59.1	Low	51.7	Low	126 Å²	126	109 Å²	109	65%	0.646	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-79.7	-24	169.5	-53.3	-179.5	0	0	0	110.5	H334 L335	H334-I337 VanDerWaalsContact O-CB 3.29Å; H334-I337 WeakPolarHBondContact O-CB 3.49Å; H334-I337 WeakPolarHBondContact O-CG1 3.17Å; H334-I337 PolarHBondContact O-N 3.48Å; L335-I337 PolarHBondContact O-N 3.28Å; L335-I337 VanDerWaalsContact O-N 3.16Å
338	H	56.8	Low	50.1	Low	72 Å²	72	111 Å²	111	33%	0.333	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.5	-29.2	-178.9	-59.3	-71.9	0	0	0	113.2	F320 C321 H334 L335 R336 G340	F320-H338 HydrophobicContact CB-CB 4.19Å; F320-H338 HydrophobicContact CD2-CB 3.63Å; F320-H338 AromaticContact CD2-CD2 3.92Å; F320-H338 AromaticContact CD2-CG 3.82Å; F320-H338 HydrophobicContact CE2-CB 4.19Å; F320-H338 HydrophobicContact CG-CB 3.98Å; F320-H338 AromaticContact CG-CG 3.94Å; C321-H338 PolarHBondContact SG-NE2 3.3Å; H334-H338 AromaticContact CE1-CD2 3.96Å; H334-H338 AromaticContact CE1-NE2 3.3Å; H334-H338 PolarHBondContact CE1-NE2 3.37Å; H334-H338 VanDerWaalsContact CE1-NE2 3.3Å; H334-H338 AromaticContact NE2-CD2 3.88Å; H334-H338 AromaticContact NE2-NE2 3.24Å; H334-H338 PolarHBondContact NE2-NE2 2.96Å; L335-H338 WeakPolarHBondContact O-CA 3.38Å; L335-H338 WeakPolarHBondContact O-CB 3.45Å; L335-H338 PolarHBondContact O-N 3.41Å; R336-H338 VanDerWaalsContact C-N 3.34Å; H338-G340 VanDerWaalsContact C-N 3.32Å; H338-G340 PolarHBondContact O-N 2.74Å
339	T	53.8	Low	49.6	Very low	75 Å²	75	114 Å²	114	46%	0.46	59%	0.594	S	S	.	*	S	Bend	trans	-80.3	-5.5	179.8	56.5	0	0	0	0	114.7	L335 R336 E341	L335-T339 PolarHBondContact O-N 3.18Å; R336-T339 WeakPolarHBondContact CA-OG1 3.23Å; T339-E341 PolarHBondContact O-N 3.21Å; T339-E341 VanDerWaalsContact O-N 3.14Å; T339-E341 PolarHBondContact OG1-OE2 2.96Å
340	G	47.8	Very low	47.6	Very low	62 Å²	62	115.9 Å²	115.9	64%	0.639	60%	0.601	S	S	*	*			trans	70.2	5.3	173.9	0	0	0	0	0	116.1	H338 Q342	H338-G340 VanDerWaalsContact C-N 3.32Å; H338-G340 PolarHBondContact O-N 2.74Å; G340-Q342 VanDerWaalsContact C-N 3.25Å; G340-Q342 PolarHBondContact O-N 3.19Å
341	E	41	Very low	46.5	Very low	139 Å²	139	123.5 Å²	123.5	65%	0.65	63%	0.627	S	S	*	*			trans	-69	70.4	-176.7	-65.1	170.3	118.1	0	0	113.1	T339	T339-E341 PolarHBondContact O-N 3.21Å; T339-E341 VanDerWaalsContact O-N 3.14Å; T339-E341 PolarHBondContact OG1-OE2 2.96Å
342	Q	42.2	Very low	45.1	Very low	178 Å²	178	127.1 Å²	127.1	83%	0.832	64%	0.643	S	S	*	*			trans	-81.5	115.4	157.8	-64.3	-168.5	21.7	0	0	108.5	G340 Q344	G340-Q342 VanDerWaalsContact C-N 3.25Å; G340-Q342 PolarHBondContact O-N 3.19Å; Q342-Q344 PolarHBondContact O-N 2.94Å; Q342-Q344 VanDerWaalsContact O-N 3.12Å
343	A	36.3	Very low	43.5	Very low	97 Å²	97	124.8 Å²	124.8	80%	0.802	64%	0.638	S	S	*	*			trans	-68.1	109.6	176.6	0	0	0	0	0	110.3	E345	A343-E345 VanDerWaalsContact C-N 3.28Å; A343-E345 PolarHBondContact O-N 2.8Å
344	Q	35.5	Very low	42.1	Very low	197 Å²	197	126.2 Å²	126.2	92%	0.921	65%	0.647	S	S	*	*			trans	-78.3	75.6	170.7	-71.8	-173.6	-84.4	0	0	110.8	Q342	Q342-Q344 PolarHBondContact O-N 2.94Å; Q342-Q344 VanDerWaalsContact O-N 3.12Å
345	E	29.5	Very low	40.7	Very low	185 Å²	185	127.8 Å²	127.8	86%	0.864	66%	0.657	S	S	*	*			trans	-113.5	127.9	159.5	-67.9	-163.5	147.3	0	0	110.4	A343	A343-E345 VanDerWaalsContact C-N 3.28Å; A343-E345 PolarHBondContact O-N 2.8Å
346	R	28.4	Very low	39.6	Very low	223 Å²	223	128.1 Å²	128.1	84%	0.842	67%	0.673	S	S	*	*			trans	-32.3	133.8	-173.4	-66	158.5	176.1	157.6	-2.7	113.8	T348	R346-T348 PolarHBondContact O-N 3.13Å
347	I	40.6	Very low	38.3	Very low	172 Å²	172	127.5 Å²	127.5	88%	0.882	67%	0.674	S	S	*	*				45.9	42.9	64	-39.3	-178.8	0	0	0	112.8
348	T	29	Very low	36.9	Very low	114 Å²	114	130.8 Å²	130.8	70%	0.699	68%	0.684	S	S	*	*	S	Bend	trans	-157.4	94.3	148.4	41.3	0	0	0	0	109.7	R346	R346-T348 PolarHBondContact O-N 3.13Å
349	S	40.8	Very low	35.6	Very low	114 Å²	114	137.3 Å²	137.3	80%	0.797	71%	0.705	S	S	*	*	S	Bend	trans	53.6	166.3	168.8	62.6	0	0	0	0	119.3
350	N	24.9	Very low	34.6	Very low	132 Å²	132	144.4 Å²	144.4	71%	0.706	73%	0.73	S	S	*	*			trans	62	162.7	179.6	-70.5	-32.4	0	0	0	118.1
351	R	40.4	Very low	34	Very low	230 Å²	230	147.6 Å²	147.6	87%	0.868	73%	0.731	S	S	*	*			trans	-147.5	70.8	-168.6	-169.1	-167.5	176	174.4	1.8	112.9
352	E	30.5	Very low	33.5	Very low	103 Å²	103	144.7 Å²	144.7	48%	0.481	73%	0.725	S	S	.	*			trans	-129.4	131.3	164.4	-60.5	-154.5	151.1	0	0	109.4	I364 S366	E352-I364 WeakPolarHBondContact OE1-CG2 3.32Å; E352-S366 VanDerWaalsContact OE2-CA 3.24Å; E352-S366 WeakPolarHBondContact OE2-CA 3.35Å; E352-S366 WeakPolarHBondContact OE2-CB 3.39Å; E352-S366 PolarHBondContact OE2-OG 3.01Å
353	N	31.8	Very low	33.2	Very low	108 Å²	108	141 Å²	141	58%	0.578	70%	0.703	S	S	*	*			cis	90.7	40.9	14	-151.9	9.4	0	0	0	117.3	T355	N353-T355 PolarHBondContact O-N 3.09Å; N353-T355 VanDerWaalsContact O-N 3.13Å
354	T	30.3	Very low	33.4	Very low	115 Å²	115	139.2 Å²	139.2	71%	0.706	68%	0.68	S	S	*	*			trans	-79	89.8	167.1	42.4	0	0	0	0	112.6
355	T	37.2	Very low	33.4	Very low	47 Å²	47	135.6 Å²	135.6	29%	0.288	67%	0.667	S	S	.	*				13.7	150.9	125.8	81.6	0	0	0	0	120.2	N353 K357 R363 I364	N353-T355 PolarHBondContact O-N 3.09Å; N353-T355 VanDerWaalsContact O-N 3.13Å; T355-K357 VanDerWaalsContact OG1-CE 3.27Å; T355-K357 WeakPolarHBondContact OG1-CE 3.34Å; T355-K357 PolarHBondContact OG1-NZ 2.57Å; T355-R363 HydrophobicContact CG2-CG 3.93Å; T355-R363 VanDerWaalsContact CG2-NE 3.31Å; T355-I364 WeakPolarHBondContact CG2-O 3.37Å
356	G	29.4	Very low	34	Very low	57 Å²	57	130 Å²	130	59%	0.588	65%	0.648	S	S	*	*			cis	-174.3	-140.6	7.2	0	0	0	0	0	112
357	K	38.6	Very low	34.7	Very low	132 Å²	132	122.2 Å²	122.2	57%	0.574	62%	0.623	S	S	*	*			cis	-161.4	138.3	-2.4	-101.6	124.8	169.2	168.8	0	102.8	T355	T355-K357 VanDerWaalsContact OG1-CE 3.27Å; T355-K357 WeakPolarHBondContact OG1-CE 3.34Å; T355-K357 PolarHBondContact OG1-NZ 2.57Å
358	K	30.8	Very low	34.7	Very low	195 Å²	195	117 Å²	117	85%	0.848	60%	0.602	S	S	*	*			cis	-151.4	134.4	19	-47.2	169.7	-173	174.9	0	110
359	R	29.5	Very low	35.2	Very low	208 Å²	208	116.9 Å²	116.9	79%	0.785	60%	0.603	S	S	*	*	S	Bend	trans	-96.1	152.8	144.3	-85.5	178.8	91.7	164.2	2.7	105.3	I361	R359-I361 PolarHBondContact O-N 2.84Å
360	K	32.1	Very low	35.7	Very low	225 Å²	225	114.8 Å²	114.8	98%	0.978	60%	0.599	S	S	*	*	S	Bend	trans	-74.8	66.3	172.1	-76.5	-166.5	178.4	-175.3	0	111.4
361	I	35.3	Very low	36.7	Very low	128 Å²	128	113.6 Å²	113.6	66%	0.656	59%	0.589	S	S	*	*	S	Bend	trans	-122.5	134.5	159.2	-62.7	173.7	0	0	0	104.1	R359 R363	R359-I361 PolarHBondContact O-N 2.84Å; I361-R363 PolarHBondContact O-N 2.92Å; I361-R363 VanDerWaalsContact O-N 3.17Å
362	C	31.4	Very low	37.5	Very low	78 Å²	78	108.6 Å²	108.6	53%	0.527	57%	0.574	S	S	.	*			trans	-55.3	123.4	-177.9	-61.4	0	0	0	0	109.5	C387	C362-C387 HydrophobicContact CB-CB 4.37Å; C362-C387 WeakPolarHBondContact CB-SG 3.32Å; C362-C387 PolarHBondContact SG-SG 3.17Å
363	R	34.3	Very low	39.2	Very low	100 Å²	100	107.1 Å²	107.1	38%	0.377	57%	0.573	S	S	.	*			trans	-90.1	141.6	-171	-148.2	175.3	-160.6	88	3.2	108.6	T355 I361 N365	T355-R363 HydrophobicContact CG2-CG 3.93Å; T355-R363 VanDerWaalsContact CG2-NE 3.31Å; I361-R363 PolarHBondContact O-N 2.92Å; I361-R363 VanDerWaalsContact O-N 3.17Å; R363-N365 PolarHBondContact O-N 2.71Å
364	I	41.7	Very low	40.8	Very low	61 Å²	61	105.2 Å²	105.2	31%	0.313	56%	0.56	S	S	.	*			trans	-56.5	109	157.4	-58.5	163.1	0	0	0	105.9	E352 T355	E352-I364 WeakPolarHBondContact OE1-CG2 3.32Å; T355-I364 WeakPolarHBondContact CG2-O 3.37Å
365	N	34.9	Very low	42.7	Very low	121 Å²	121	103.7 Å²	103.7	65%	0.647	55%	0.55	S	S	*	*			trans	-82	133	145.3	-79.8	3.8	0	0	0	104.8	R363 L367	R363-N365 PolarHBondContact O-N 2.71Å; N365-L367 PolarHBondContact O-N 3.46Å
366	S	41.9	Very low	44.3	Very low	66 Å²	66	102 Å²	102	46%	0.462	54%	0.54	S	S	.	.			trans	-57.2	124.1	174.4	-64.8	0	0	0	0	109.9	E352	E352-S366 VanDerWaalsContact OE2-CA 3.24Å; E352-S366 WeakPolarHBondContact OE2-CA 3.35Å; E352-S366 WeakPolarHBondContact OE2-CB 3.39Å; E352-S366 PolarHBondContact OE2-OG 3.01Å
367	L	44.2	Very low	46.4	Very low	60 Å²	60	104.7 Å²	104.7	31%	0.314	55%	0.55	S	S	.	*			trans	-123.4	141.3	167.9	-82	162.6	0	0	0	106.2	N365 E371 P373	N365-L367 PolarHBondContact O-N 3.46Å; L367-E371 HydrophobicContact CB-CB 4.49Å; L367-P373 HydrophobicContact CD1-CG 3.73Å; L367-P373 HydrophobicContact CD2-CG 4.37Å
368	S	38.9	Very low	47.9	Very low	64 Å²	64	102.8 Å²	102.8	45%	0.448	55%	0.546	S	S	.	.			trans	-48.7	144	-175.6	-40.6	0	0	0	0	111.5	G370 E371	S368-G370 VanDerWaalsContact C-N 3.3Å; S368-G370 PolarHBondContact O-N 3.44Å; S368-E371 WeakPolarHBondContact CB-OE1 3.28Å; S368-E371 PolarHBondContact O-N 3.3Å; S368-E371 PolarHBondContact OG-OE1 3.45Å
369	P	41.3	Very low	50	Low	111 Å²	111	95.3 Å²	95.3	72%	0.721	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	86.4	-177.4	27	-35.2	0	0	0	111.9
370	G	50.5	Low	51.9	Low	69 Å²	69	93.2 Å²	93.2	71%	0.711	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	150.7	-34	-173.8	0	0	0	0	0	112.7	S368 K372	S368-G370 VanDerWaalsContact C-N 3.3Å; S368-G370 PolarHBondContact O-N 3.44Å; G370-K372 PolarHBondContact O-N 3.2Å
371	E	46.4	Very low	53.3	Low	107 Å²	107	87.3 Å²	87.3	50%	0.5	50%	0.497	S	S	.	.			trans	-77.7	113	-173.7	-75.1	175.6	-132.8	0	0	112.8	L367 S368 P373	L367-E371 HydrophobicContact CB-CB 4.49Å; S368-E371 WeakPolarHBondContact CB-OE1 3.28Å; S368-E371 PolarHBondContact O-N 3.3Å; S368-E371 PolarHBondContact OG-OE1 3.45Å; E371-P373 VanDerWaalsContact C-CD 3.48Å; E371-P373 WeakPolarHBondContact O-CD 3.47Å
372	K	57	Low	54.7	Low	126 Å²	126	83.4 Å²	83.4	55%	0.548	48%	0.48	S	S	.	.			trans	-118.7	71.3	175	-68.7	165.7	170.5	-179.7	0	109.4	G370 F374 C382 F383	G370-K372 PolarHBondContact O-N 3.2Å; K372-F374 PolarHBondContact O-N 2.98Å; K372-C382 HydrophobicContact CB-CB 3.42Å; K372-C382 VanDerWaalsContact CB-CB 3.42Å; K372-C382 HydrophobicContact CD-CB 4.02Å; K372-C382 WeakPolarHBondContact CD-O 3.39Å; K372-C382 HydrophobicContact CG-CB 4.36Å; K372-C382 WeakPolarHBondContact O-CB 3.42Å; K372-F383 CarbonylContact C-O 3.17Å; K372-F383 WeakPolarHBondContact CA-O 3.35Å
373	P	64.9	Low	56.4	Low	72 Å²	72	81.8 Å²	81.8	47%	0.468	46%	0.464	S	S	.	.			trans	-68.3	-10.5	-166.9	27.5	-36.1	0	0	0	114.6	L367 E371 T375	L367-P373 HydrophobicContact CD1-CG 3.73Å; L367-P373 HydrophobicContact CD2-CG 4.37Å; E371-P373 VanDerWaalsContact C-CD 3.48Å; E371-P373 WeakPolarHBondContact O-CD 3.47Å; P373-T375 PolarHBondContact O-N 2.88Å
374	F	67	Low	57.8	Low	68 Å²	68	79.2 Å²	79.2	30%	0.298	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	79.8	177.3	-57.7	-72.6	0	0	0	110.3	K372 F383 Q385 K386 L389	K372-F374 PolarHBondContact O-N 2.98Å; F374-F383 HydrophobicContact CB-CB 4.28Å; F374-F383 WeakPolarHBondContact CB-O 3.42Å; F374-F383 PolarHBondContact N-O 3.34Å; F374-F383 PolarHBondContact O-N 3.5Å; F374-Q385 VanDerWaalsContact CD2-C 3.45Å; F374-K386 HydrophobicContact CD1-CB 3.84Å; F374-K386 HydrophobicContact CD1-CG 4.28Å; F374-K386 VanDerWaalsContact CD2-N 3.34Å; F374-K386 HydrophobicContact CE1-CB 3.7Å; F374-K386 HydrophobicContact CE1-CD 4.41Å; F374-K386 HydrophobicContact CE1-CG 4.28Å; F374-K386 HydrophobicContact CG-CB 4.32Å; F374-K386 HydrophobicContact CZ-CB 4.05Å; F374-L389 HydrophobicContact CB-CB 4.02Å; F374-L389 HydrophobicContact CB-CD2 3.9Å
375	T	68.9	Low	58.9	Low	83 Å²	83	77.8 Å²	77.8	51%	0.509	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	154.7	172.2	63.1	0	0	0	0	111.2	P373 C382 L389	P373-T375 PolarHBondContact O-N 2.88Å; T375-C382 HydrophobicContact CG2-CB 4.36Å; T375-L389 WeakPolarHBondContact O-CD1 2.99Å; T375-L389 WeakPolarHBondContact O-CD2 3.24Å
376	C	71.6	Confident	60.4	Low	10 Å²	10	79 Å²	79	7%	0.068	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	132.5	169.5	-169.4	0	0	0	0	110	N378 C379 K381 L389 H392	C376-N378 PolarHBondContact O-N 3.09Å; C376-C379 WeakPolarHBondContact CB-O 3.46Å; C376-K381 PolarHBondContact N-O 2.84Å; C376-K381 VanDerWaalsContact N-O 3.15Å; C376-L389 HydrophobicContact CB-CD1 3.69Å; C376-H392 PolarHBondContact SG-NE2 3.41Å
377	S	72.4	Confident	61.3	Low	115 Å²	115	78.2 Å²	78.2	80%	0.804	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-8.6	178.1	-52.4	0	0	0	0	113.6
378	N	71.3	Confident	62.1	Low	92 Å²	92	79.4 Å²	79.4	49%	0.492	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-2.4	-171.8	-56.3	78.6	0	0	0	113.2	C376 H397	C376-N378 PolarHBondContact O-N 3.09Å; N378-H397 VanDerWaalsContact CB-CE1 3.41Å; N378-H397 WeakPolarHBondContact CB-CE1 3.45Å; N378-H397 WeakPolarHBondContact CB-ND1 3.33Å; N378-H397 PolarHBondContact O-CE1 3.12Å; N378-H397 VanDerWaalsContact O-CE1 3.29Å
379	C	74.2	Confident	63.4	Low	37 Å²	37	77.4 Å²	77.4	25%	0.25	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	160.2	164.3	63	0	0	0	0	110.9	C376 K381 H392 H397	C376-C379 WeakPolarHBondContact CB-O 3.46Å; C379-K381 PolarHBondContact O-N 3.18Å; C379-H392 PolarHBondContact SG-NE2 2.99Å; C379-H392 VanDerWaalsContact SG-NE2 3.39Å; C379-H397 PolarHBondContact SG-NE2 3.26Å; C379-H397 VanDerWaalsContact SG-NE2 3.42Å
380	D	69.8	Low	64.6	Low	164 Å²	164	74.3 Å²	74.3	88%	0.877	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.7	27.5	-173	-43.5	-78.3	0	0	0	115
381	K	60.6	Low	65.2	Low	101 Å²	101	72.7 Å²	72.7	44%	0.439	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	115.1	179.5	-70.4	177.2	-178.7	168.8	0	110.4	C376 C379 F383	C376-K381 PolarHBondContact N-O 2.84Å; C376-K381 VanDerWaalsContact N-O 3.15Å; C379-K381 PolarHBondContact O-N 3.18Å; K381-F383 HydrophobicContact CB-CE2 3.85Å; K381-F383 HydrophobicContact CB-CZ 3.94Å; K381-F383 WeakPolarHBondContact O-CD2 3.4Å; K381-F383 WeakPolarHBondContact O-CE2 3.25Å
382	C	65	Low	66.3	Low	46 Å²	46	68.1 Å²	68.1	31%	0.311	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	140.1	-177.9	-45.1	0	0	0	0	111.1	K372 T375	K372-C382 HydrophobicContact CB-CB 3.42Å; K372-C382 VanDerWaalsContact CB-CB 3.42Å; K372-C382 HydrophobicContact CD-CB 4.02Å; K372-C382 WeakPolarHBondContact CD-O 3.39Å; K372-C382 HydrophobicContact CG-CB 4.36Å; K372-C382 WeakPolarHBondContact O-CB 3.42Å; T375-C382 HydrophobicContact CG2-CB 4.36Å
383	F	67.3	Low	66.7	Low	44 Å²	44	66.3 Å²	66.3	19%	0.193	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	152.6	-173.7	-60.7	-85.9	0	0	0	112.5	K372 F374 K381 Q388 L389 H392	K372-F383 CarbonylContact C-O 3.17Å; K372-F383 WeakPolarHBondContact CA-O 3.35Å; F374-F383 HydrophobicContact CB-CB 4.28Å; F374-F383 WeakPolarHBondContact CB-O 3.42Å; F374-F383 PolarHBondContact N-O 3.34Å; F374-F383 PolarHBondContact O-N 3.5Å; K381-F383 HydrophobicContact CB-CE2 3.85Å; K381-F383 HydrophobicContact CB-CZ 3.94Å; K381-F383 WeakPolarHBondContact O-CD2 3.4Å; K381-F383 WeakPolarHBondContact O-CE2 3.25Å; F383-Q388 HydrophobicContact CB-CB 4.07Å; F383-Q388 HydrophobicContact CD1-CB 3.89Å; F383-Q388 HydrophobicContact CG-CB 4.21Å; F383-L389 HydrophobicContact CB-CB 4.35Å; F383-L389 HydrophobicContact CD2-CB 4.04Å; F383-L389 HydrophobicContact CD2-CD1 3.98Å; F383-L389 HydrophobicContact CE2-CD1 4.27Å; F383-L389 HydrophobicContact CG-CB 4.39Å; F383-H392 HydrophobicContact CE1-CB 3.99Å; F383-H392 HydrophobicContact CE2-CB 3.78Å; F383-H392 AromaticContact CE2-CD2 3.4Å; F383-H392 WeakPolarHBondContact CE2-CD2 3.5Å; F383-H392 AromaticContact CE2-CG 3.46Å; F383-H392 VanDerWaalsContact CE2-CG 3.46Å; F383-H392 HydrophobicContact CZ-CB 3.45Å; F383-H392 VanDerWaalsContact CZ-CB 3.45Å; F383-H392 AromaticContact CZ-CD2 3.67Å; F383-H392 AromaticContact CZ-CG 3.23Å; F383-H392 AromaticContact CZ-ND1 3.57Å
384	A	64.9	Low	67	Low	46 Å²	46	65.6 Å²	65.6	38%	0.38	35%	0.353	S	S	.	.	S	Bend	trans	-80.8	-17.1	177.9	0	0	0	0	0	113.1
385	Q	64.5	Low	66.8	Low	32 Å²	32	66.2 Å²	66.2	15%	0.15	36%	0.358	C	S	.	.	S	Bend	trans	-139.7	137.6	-179.2	-56.2	-178.3	20.3	0	0	112.2	F374 C387 Q388 L389	F374-Q385 VanDerWaalsContact CD2-C 3.45Å; Q385-C387 PolarHBondContact O-N 3.11Å; Q385-C387 VanDerWaalsContact O-N 3.09Å; Q385-C387 PolarHBondContact OE1-SG 2.85Å; Q385-Q388 HydrophobicContact CB-CG 4.16Å; Q385-Q388 WeakPolarHBondContact O-CA 3.28Å; Q385-Q388 WeakPolarHBondContact O-CB 3.12Å; Q385-Q388 PolarHBondContact O-N 2.63Å; Q385-L389 PolarHBondContact O-N 2.95Å
386	K	64.9	Low	66.7	Low	145 Å²	145	65.6 Å²	65.6	63%	0.63	35%	0.349	S	S	*	.	H	α-helix	trans	-52.9	-32.9	177.1	-169.5	168.8	-178.5	171.3	0	113.6	F374 L389 V390	F374-K386 HydrophobicContact CD1-CB 3.84Å; F374-K386 HydrophobicContact CD1-CG 4.28Å; F374-K386 VanDerWaalsContact CD2-N 3.34Å; F374-K386 HydrophobicContact CE1-CB 3.7Å; F374-K386 HydrophobicContact CE1-CD 4.41Å; F374-K386 HydrophobicContact CE1-CG 4.28Å; F374-K386 HydrophobicContact CG-CB 4.32Å; F374-K386 HydrophobicContact CZ-CB 4.05Å; K386-L389 PolarHBondContact O-N 3Å; K386-V390 WeakPolarHBondContact O-CG2 3.35Å; K386-V390 PolarHBondContact O-N 3.15Å
387	C	60.8	Low	66.6	Low	50 Å²	50	68.1 Å²	68.1	34%	0.338	36%	0.36	S	S	.	.	H	α-helix	trans	-69.6	-30.3	176.3	60.9	0	0	0	0	113.7	C362 Q385 A391	C362-C387 HydrophobicContact CB-CB 4.37Å; C362-C387 WeakPolarHBondContact CB-SG 3.32Å; C362-C387 PolarHBondContact SG-SG 3.17Å; Q385-C387 PolarHBondContact O-N 3.11Å; Q385-C387 VanDerWaalsContact O-N 3.09Å; Q385-C387 PolarHBondContact OE1-SG 2.85Å; C387-A391 WeakPolarHBondContact O-CB 3.34Å; C387-A391 PolarHBondContact O-N 2.76Å
388	Q	62.4	Low	66.2	Low	85 Å²	85	64.6 Å²	64.6	40%	0.397	34%	0.342	S	S	.	.	H	α-helix	trans	-72.8	-42.3	174.4	-65.2	169.8	-33.3	0	0	109.9	F383 Q385 A391 H392	F383-Q388 HydrophobicContact CB-CB 4.07Å; F383-Q388 HydrophobicContact CD1-CB 3.89Å; F383-Q388 HydrophobicContact CG-CB 4.21Å; Q385-Q388 HydrophobicContact CB-CG 4.16Å; Q385-Q388 WeakPolarHBondContact O-CA 3.28Å; Q385-Q388 WeakPolarHBondContact O-CB 3.12Å; Q385-Q388 PolarHBondContact O-N 2.63Å; Q388-A391 PolarHBondContact O-N 2.76Å; Q388-H392 VanDerWaalsContact O-CB 3.25Å; Q388-H392 WeakPolarHBondContact O-CB 3.36Å; Q388-H392 PolarHBondContact O-N 3.19Å
389	L	65.2	Low	65.8	Low	22 Å²	22	64 Å²	64	12%	0.115	34%	0.336	C	S	.	.	H	α-helix	trans	-59	-47.1	171.8	172.6	62.1	0	0	0	111.9	F374 T375 C376 F383 Q385 K386 A391 H392 R393	F374-L389 HydrophobicContact CB-CB 4.02Å; F374-L389 HydrophobicContact CB-CD2 3.9Å; T375-L389 WeakPolarHBondContact O-CD1 2.99Å; T375-L389 WeakPolarHBondContact O-CD2 3.24Å; C376-L389 HydrophobicContact CB-CD1 3.69Å; F383-L389 HydrophobicContact CB-CB 4.35Å; F383-L389 HydrophobicContact CD2-CB 4.04Å; F383-L389 HydrophobicContact CD2-CD1 3.98Å; F383-L389 HydrophobicContact CE2-CD1 4.27Å; F383-L389 HydrophobicContact CG-CB 4.39Å; Q385-L389 PolarHBondContact O-N 2.95Å; K386-L389 PolarHBondContact O-N 3Å; L389-A391 PolarHBondContact O-N 3.19Å; L389-H392 PolarHBondContact O-N 3.33Å; L389-R393 HydrophobicContact CD1-CG 4.03Å; L389-R393 WeakPolarHBondContact O-CG 3.48Å; L389-R393 PolarHBondContact O-N 3.05Å
390	V	67.1	Low	65.4	Low	47 Å²	47	67.1 Å²	67.1	29%	0.285	35%	0.347	S	S	.	.	H	α-helix	trans	-63.2	-41.8	177.1	169.4	0	0	0	0	111.6	K386 R394	K386-V390 WeakPolarHBondContact O-CG2 3.35Å; K386-V390 PolarHBondContact O-N 3.15Å; V390-R394 WeakPolarHBondContact O-CB 3.37Å; V390-R394 WeakPolarHBondContact O-CG 3.37Å; V390-R394 PolarHBondContact O-N 2.7Å; V390-R394 VanDerWaalsContact O-N 3.11Å
391	A	63.4	Low	65.6	Low	34 Å²	34	62.9 Å²	62.9	28%	0.281	32%	0.321	S	S	.	.	H	α-helix	trans	-63.6	-42.1	174.3	0	0	0	0	0	111.8	C387 Q388 L389 M395 T414	C387-A391 WeakPolarHBondContact O-CB 3.34Å; C387-A391 PolarHBondContact O-N 2.76Å; Q388-A391 PolarHBondContact O-N 2.76Å; L389-A391 PolarHBondContact O-N 3.19Å; A391-M395 WeakPolarHBondContact O-CB 3.5Å; A391-M395 WeakPolarHBondContact O-CG 3.45Å; A391-M395 PolarHBondContact O-N 3.45Å; A391-T414 HydrophobicContact CB-CG2 4.49Å
392	H	69.3	Low	66.2	Low	12 Å²	12	61.2 Å²	61.2	6%	0.056	32%	0.32	C	S	.	.	H	α-helix	trans	-61.7	-49.2	176.6	162.7	73.1	0	0	0	112	C376 C379 F383 Q388 L389 R394 M395 H396 H397	C376-H392 PolarHBondContact SG-NE2 3.41Å; C379-H392 PolarHBondContact SG-NE2 2.99Å; C379-H392 VanDerWaalsContact SG-NE2 3.39Å; F383-H392 HydrophobicContact CE1-CB 3.99Å; F383-H392 HydrophobicContact CE2-CB 3.78Å; F383-H392 AromaticContact CE2-CD2 3.4Å; F383-H392 WeakPolarHBondContact CE2-CD2 3.5Å; F383-H392 AromaticContact CE2-CG 3.46Å; F383-H392 VanDerWaalsContact CE2-CG 3.46Å; F383-H392 HydrophobicContact CZ-CB 3.45Å; F383-H392 VanDerWaalsContact CZ-CB 3.45Å; F383-H392 AromaticContact CZ-CD2 3.67Å; F383-H392 AromaticContact CZ-CG 3.23Å; F383-H392 AromaticContact CZ-ND1 3.57Å; Q388-H392 VanDerWaalsContact O-CB 3.25Å; Q388-H392 WeakPolarHBondContact O-CB 3.36Å; Q388-H392 PolarHBondContact O-N 3.19Å; L389-H392 PolarHBondContact O-N 3.33Å; H392-R394 PolarHBondContact O-N 3.36Å; H392-M395 PolarHBondContact O-N 3.45Å; H392-M395 VanDerWaalsContact O-N 3.08Å; H392-H396 AromaticContact CE1-CD2 3.47Å; H392-H396 PolarHBondContact CE1-CD2 2.88Å; H392-H396 VanDerWaalsContact CE1-CD2 3.47Å; H392-H396 AromaticContact CE1-CG 3.73Å; H392-H396 AromaticContact ND1-CD2 3.03Å; H392-H396 PolarHBondContact ND1-CD2 3.33Å; H392-H396 AromaticContact ND1-CG 3.76Å; H392-H396 AromaticContact ND1-NE2 3.6Å; H392-H396 PolarHBondContact O-CD2 2.99Å; H392-H396 PolarHBondContact O-N 3.2Å; H392-H397 AromaticContact NE2-CD2 3.92Å; H392-H397 AromaticContact NE2-NE2 3.56Å
393	R	66	Low	66.8	Low	87 Å²	87	63 Å²	63	33%	0.328	32%	0.321	S	S	.	.	H	α-helix	trans	-57.6	-47.9	177.3	-74	173.9	65.7	-152.8	1.2	111.8	L389 M395 H396 H397 G398 E399	L389-R393 HydrophobicContact CD1-CG 4.03Å; L389-R393 WeakPolarHBondContact O-CG 3.48Å; L389-R393 PolarHBondContact O-N 3.05Å; R393-M395 VanDerWaalsContact C-N 3.27Å; R393-M395 PolarHBondContact O-N 3.34Å; R393-H396 PolarHBondContact O-N 3.47Å; R393-H397 CarbonylContact O-C 3.55Å; R393-H397 WeakPolarHBondContact O-CA 3.34Å; R393-H397 WeakPolarHBondContact O-CB 3.46Å; R393-H397 PolarHBondContact O-N 3.45Å; R393-G398 PolarHBondContact O-N 2.56Å; R393-E399 WeakPolarHBondContact CB-OE2 3.44Å; R393-E399 VanDerWaalsContact CZ-CD 3.47Å; R393-E399 IonicContact CZ-OE1 2.7Å; R393-E399 IonicContact CZ-OE2 3Å; R393-E399 VanDerWaalsContact NE-CD 3.3Å; R393-E399 IonicContact NE-OE1 2.56Å; R393-E399 PolarHBondContact NE-OE1 3Å; R393-E399 IonicContact NE-OE2 3.1Å; R393-E399 PolarHBondContact NE-OE2 2.86Å; R393-E399 IonicContact NH1-OE2 3.05Å; R393-E399 IonicContact NH2-OE1 2.76Å; R393-E399 PolarHBondContact NH2-OE1 2.86Å; R393-E399 IonicContact NH2-OE2 3.86Å; R393-E399 PolarHBondContact NH2-OE2 3.07Å
394	R	70.3	Confident	67.4	Low	57 Å²	57	63.5 Å²	63.5	22%	0.215	33%	0.328	C	S	.	.	H	α-helix	trans	-63.9	-25.8	175.4	-69.4	-176.2	174.2	166.1	-3.2	114.4	V390 H392 E400 A413	V390-R394 WeakPolarHBondContact O-CB 3.37Å; V390-R394 WeakPolarHBondContact O-CG 3.37Å; V390-R394 PolarHBondContact O-N 2.7Å; V390-R394 VanDerWaalsContact O-N 3.11Å; H392-R394 PolarHBondContact O-N 3.36Å; R394-E400 VanDerWaalsContact CB-O 3.24Å; R394-E400 WeakPolarHBondContact CB-O 3.36Å; R394-E400 WeakPolarHBondContact CD-O 3.46Å; R394-E400 HydrophobicContact CG-CB 4.17Å; R394-E400 WeakPolarHBondContact CG-O 3.2Å; R394-E400 IonicContact CZ-OE2 2.95Å; R394-E400 IonicContact NE-OE2 3.06Å; R394-E400 PolarHBondContact NE-OE2 2.89Å; R394-E400 IonicContact NH2-OE2 3.81Å; R394-E400 PolarHBondContact NH2-OE2 2.85Å; R394-A413 HydrophobicContact CB-CB 3.77Å
395	M	63.9	Low	68.4	Low	81 Å²	81	61.5 Å²	61.5	40%	0.399	31%	0.311	S	S	.	.	H	α-helix	trans	-84.8	-43.4	177.4	-70.1	-91.4	-67.8	0	0	112.9	S232 A391 H392 R393 A413	S232-M395 WeakPolarHBondContact OG-CE 3.43Å; A391-M395 WeakPolarHBondContact O-CB 3.5Å; A391-M395 WeakPolarHBondContact O-CG 3.45Å; A391-M395 PolarHBondContact O-N 3.45Å; H392-M395 PolarHBondContact O-N 3.45Å; H392-M395 VanDerWaalsContact O-N 3.08Å; R393-M395 VanDerWaalsContact C-N 3.27Å; R393-M395 PolarHBondContact O-N 3.34Å; M395-A413 HydrophobicContact CG-CB 3.92Å; M395-A413 HydrophobicContact SD-CB 4.02Å
396	H	64.9	Low	69.2	Low	70 Å²	70	67 Å²	67	32%	0.324	34%	0.341	S	S	.	.	H	α-helix	trans	-103.6	-31.2	-170.2	-71.3	-89.6	0	0	0	114.8	H392 R393	H392-H396 AromaticContact CE1-CD2 3.47Å; H392-H396 PolarHBondContact CE1-CD2 2.88Å; H392-H396 VanDerWaalsContact CE1-CD2 3.47Å; H392-H396 AromaticContact CE1-CG 3.73Å; H392-H396 AromaticContact ND1-CD2 3.03Å; H392-H396 PolarHBondContact ND1-CD2 3.33Å; H392-H396 AromaticContact ND1-CG 3.76Å; H392-H396 AromaticContact ND1-NE2 3.6Å; H392-H396 PolarHBondContact O-CD2 2.99Å; H392-H396 PolarHBondContact O-N 3.2Å; R393-H396 PolarHBondContact O-N 3.47Å
397	H	70.6	Confident	70	Confident	64 Å²	64	68.7 Å²	68.7	30%	0.296	34%	0.344	S	S	.	.	S	Bend	trans	-109.7	5.1	-176.2	-56.7	-63.3	0	0	0	112.3	N378 C379 H392 R393 E399	N378-H397 VanDerWaalsContact CB-CE1 3.41Å; N378-H397 WeakPolarHBondContact CB-CE1 3.45Å; N378-H397 WeakPolarHBondContact CB-ND1 3.33Å; N378-H397 PolarHBondContact O-CE1 3.12Å; N378-H397 VanDerWaalsContact O-CE1 3.29Å; C379-H397 PolarHBondContact SG-NE2 3.26Å; C379-H397 VanDerWaalsContact SG-NE2 3.42Å; H392-H397 AromaticContact NE2-CD2 3.92Å; H392-H397 AromaticContact NE2-NE2 3.56Å; R393-H397 CarbonylContact O-C 3.55Å; R393-H397 WeakPolarHBondContact O-CA 3.34Å; R393-H397 WeakPolarHBondContact O-CB 3.46Å; R393-H397 PolarHBondContact O-N 3.45Å; H397-E399 HydrophobicContact CB-CG 4.38Å; H397-E399 PolarHBondContact O-N 2.99Å
398	G	64.8	Low	71.1	Confident	41 Å²	41	69.4 Å²	69.4	42%	0.423	35%	0.349	S	S	.	.			trans	74.6	-16.6	164.6	0	0	0	0	0	117	R393 E400	R393-G398 PolarHBondContact O-N 2.56Å; G398-E400 VanDerWaalsContact C-N 3.34Å; G398-E400 PolarHBondContact O-N 3.34Å
399	E	61	Low	71.9	Confident	79 Å²	79	67.6 Å²	67.6	37%	0.369	35%	0.353	S	S	.	.	S	Bend	trans	-33.8	-53.5	-169.1	-56.9	175.3	167.2	0	0	115.9	R393 H397	R393-E399 WeakPolarHBondContact CB-OE2 3.44Å; R393-E399 VanDerWaalsContact CZ-CD 3.47Å; R393-E399 IonicContact CZ-OE1 2.7Å; R393-E399 IonicContact CZ-OE2 3Å; R393-E399 VanDerWaalsContact NE-CD 3.3Å; R393-E399 IonicContact NE-OE1 2.56Å; R393-E399 PolarHBondContact NE-OE1 3Å; R393-E399 IonicContact NE-OE2 3.1Å; R393-E399 PolarHBondContact NE-OE2 2.86Å; R393-E399 IonicContact NH1-OE2 3.05Å; R393-E399 IonicContact NH2-OE1 2.76Å; R393-E399 PolarHBondContact NH2-OE1 2.86Å; R393-E399 IonicContact NH2-OE2 3.86Å; R393-E399 PolarHBondContact NH2-OE2 3.07Å; H397-E399 HydrophobicContact CB-CG 4.38Å; H397-E399 PolarHBondContact O-N 2.99Å
400	E	66.1	Low	72.6	Confident	103 Å²	103	72.1 Å²	72.1	48%	0.481	37%	0.372	S	S	.	.			trans	-143.2	135.6	178.2	-63.6	179.7	131.3	0	0	110.9	R394 G398 P402	R394-E400 VanDerWaalsContact CB-O 3.24Å; R394-E400 WeakPolarHBondContact CB-O 3.36Å; R394-E400 WeakPolarHBondContact CD-O 3.46Å; R394-E400 HydrophobicContact CG-CB 4.17Å; R394-E400 WeakPolarHBondContact CG-O 3.2Å; R394-E400 IonicContact CZ-OE2 2.95Å; R394-E400 IonicContact NE-OE2 3.06Å; R394-E400 PolarHBondContact NE-OE2 2.89Å; R394-E400 IonicContact NH2-OE2 3.81Å; R394-E400 PolarHBondContact NH2-OE2 2.85Å; G398-E400 VanDerWaalsContact C-N 3.34Å; G398-E400 PolarHBondContact O-N 3.34Å; E400-P402 HydrophobicContact CB-CG 4.16Å
401	K	75	Confident	73.2	Confident	75 Å²	75	75.6 Å²	75.6	33%	0.326	38%	0.383	S	S	.	.			trans	-123.8	77.5	168.4	-66	177.3	-176.9	176.2	0	108.8	Y403 K411 F412	K401-Y403 PolarHBondContact O-N 3.29Å; K401-Y403 VanDerWaalsContact O-N 3.08Å; K401-K411 HydrophobicContact CB-CB 3.63Å; K401-K411 HydrophobicContact CD-CB 4.31Å; K401-F412 CarbonylContact C-O 3.34Å; K401-F412 VanDerWaalsContact C-O 3.27Å; K401-F412 WeakPolarHBondContact CA-O 3.48Å
402	P	73.5	Confident	73.7	Confident	66 Å²	66	75.3 Å²	75.3	43%	0.429	38%	0.376	S	S	.	.			trans	-70.3	-6.6	-165.6	-20	33.5	0	0	0	115.5	E400	E400-P402 HydrophobicContact CB-CG 4.16Å
403	Y	75.9	Confident	73.6	Confident	83 Å²	83	75.3 Å²	75.3	33%	0.325	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	85.7	-174.8	-55.9	-75.8	0	0	0	109.6	K401 F412 T414 Y418	K401-Y403 PolarHBondContact O-N 3.29Å; K401-Y403 VanDerWaalsContact O-N 3.08Å; Y403-F412 PolarHBondContact N-O 2.89Å; Y403-F412 WeakPolarHBondContact O-CD2 3.38Å; Y403-F412 PolarHBondContact O-N 2.79Å; Y403-T414 VanDerWaalsContact CD2-C 3.47Å; Y403-Y418 HydrophobicContact CD1-CD1 4.2Å; Y403-Y418 HydrophobicContact CG-CD1 4.34Å
404	T	81.3	Confident	73.7	Confident	54 Å²	54	72.5 Å²	72.5	33%	0.331	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	144.8	172	-51.5	0	0	0	0	110.1	F410 K411 Y418	T404-F410 CarbonylContact C-O 3.6Å; T404-K411 HydrophobicContact CG2-CG 4.21Å; T404-Y418 WeakPolarHBondContact O-CE2 3.49Å; T404-Y418 PolarHBondContact O-OH 3.36Å
405	C	84.9	Confident	73.8	Confident	5 Å²	5	72.1 Å²	72.1	3%	0.034	38%	0.376	C	S	.	.			trans	-96.8	115.4	166.4	-172.9	0	0	0	0	110.8	R407 C408 G409 F410 F412 Y418 H425	C405-R407 PolarHBondContact O-N 3.41Å; C405-R407 VanDerWaalsContact O-N 3.11Å; C405-C408 PolarHBondContact O-N 2.77Å; C405-G409 WeakPolarHBondContact O-CA 3.36Å; C405-G409 PolarHBondContact O-N 3.42Å; C405-F410 PolarHBondContact N-O 3.28Å; C405-F412 HydrophobicContact CB-CE2 4.37Å; C405-Y418 HydrophobicContact CB-CD2 4.35Å; C405-Y418 HydrophobicContact CB-CE2 3.67Å; C405-H425 VanDerWaalsContact SG-CD2 3.57Å
406	D	81.3	Confident	74.1	Confident	147 Å²	147	71.8 Å²	71.8	79%	0.786	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-21.1	-172.9	-43.8	-62.5	0	0	0	113.4
407	R	81.9	Confident	74.5	Confident	180 Å²	180	71.8 Å²	71.8	68%	0.679	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-16.3	-179.4	-172.1	166.7	174.5	-167.6	-5.9	114.7	C405 H425	C405-R407 PolarHBondContact O-N 3.41Å; C405-R407 VanDerWaalsContact O-N 3.11Å; R407-H425 PolarHBondContact NH1-O 3.26Å
408	C	84.4	Confident	74.8	Confident	65 Å²	65	70.9 Å²	70.9	44%	0.439	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.8	8.9	-178.5	65.7	0	0	0	0	114.9	C405 F410 H421 H425	C405-C408 PolarHBondContact O-N 2.77Å; C408-F410 PolarHBondContact O-N 3.21Å; C408-H421 PolarHBondContact SG-NE2 3.17Å; C408-H425 PolarHBondContact SG-NE2 2.76Å
409	G	79.2	Confident	75.3	Confident	47 Å²	47	75.2 Å²	75.2	49%	0.485	39%	0.386	S	S	.	.			trans	67.9	-9.5	-179.3	0	0	0	0	0	116	C405 K411	C405-G409 WeakPolarHBondContact O-CA 3.36Å; C405-G409 PolarHBondContact O-N 3.42Å; G409-K411 WeakPolarHBondContact O-CG 3.38Å; G409-K411 PolarHBondContact O-N 2.97Å
410	F	79.3	Confident	76.1	Confident	118 Å²	118	73.9 Å²	73.9	52%	0.518	38%	0.381	S	S	.	.			trans	-67.3	132	-171.7	-160	-77.6	0	0	0	111.9	T404 C405 C408 F412	T404-F410 CarbonylContact C-O 3.6Å; C405-F410 PolarHBondContact N-O 3.28Å; C408-F410 PolarHBondContact O-N 3.21Å; F410-F412 HydrophobicContact CB-CE2 4.25Å; F410-F412 HydrophobicContact CB-CZ 4.37Å; F410-F412 HydrophobicContact CD1-CD1 4.24Å; F410-F412 HydrophobicContact CD1-CD2 4.2Å; F410-F412 AromaticContact CD1-CE1 3.66Å; F410-F412 HydrophobicContact CD1-CE1 3.66Å; F410-F412 AromaticContact CD1-CE2 3.61Å; F410-F412 HydrophobicContact CD1-CE2 3.61Å; F410-F412 HydrophobicContact CD1-CG 4.47Å; F410-F412 AromaticContact CD1-CZ 3.28Å; F410-F412 HydrophobicContact CD1-CZ 3.28Å; F410-F412 HydrophobicContact CE1-CD1 4.23Å; F410-F412 AromaticContact CE1-CE1 3.74Å; F410-F412 HydrophobicContact CE1-CE1 3.74Å; F410-F412 HydrophobicContact CE1-CE2 4.48Å; F410-F412 AromaticContact CE1-CZ 3.86Å; F410-F412 HydrophobicContact CE1-CZ 3.86Å; F410-F412 HydrophobicContact CG-CE2 4.35Å; F410-F412 HydrophobicContact CG-CZ 4.11Å
411	K	79.2	Confident	76.9	Confident	120 Å²	120	70.5 Å²	70.5	52%	0.522	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	133.3	-173.8	-53.5	-173.8	-178.4	176.3	0	112.1	K401 T404 G409	K401-K411 HydrophobicContact CB-CB 3.63Å; K401-K411 HydrophobicContact CD-CB 4.31Å; T404-K411 HydrophobicContact CG2-CG 4.21Å; G409-K411 WeakPolarHBondContact O-CG 3.38Å; G409-K411 PolarHBondContact O-N 2.97Å
412	F	74.6	Confident	77.1	Confident	28 Å²	28	69.8 Å²	69.8	12%	0.123	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	141.5	-178.2	-60.4	-86.9	0	0	0	112.4	K401 Y403 C405 F410 T414 N417 Y418 H421	K401-F412 CarbonylContact C-O 3.34Å; K401-F412 VanDerWaalsContact C-O 3.27Å; K401-F412 WeakPolarHBondContact CA-O 3.48Å; Y403-F412 PolarHBondContact N-O 2.89Å; Y403-F412 WeakPolarHBondContact O-CD2 3.38Å; Y403-F412 PolarHBondContact O-N 2.79Å; C405-F412 HydrophobicContact CB-CE2 4.37Å; F410-F412 HydrophobicContact CB-CE2 4.25Å; F410-F412 HydrophobicContact CB-CZ 4.37Å; F410-F412 HydrophobicContact CD1-CD1 4.24Å; F410-F412 HydrophobicContact CD1-CD2 4.2Å; F410-F412 AromaticContact CD1-CE1 3.66Å; F410-F412 HydrophobicContact CD1-CE1 3.66Å; F410-F412 AromaticContact CD1-CE2 3.61Å; F410-F412 HydrophobicContact CD1-CE2 3.61Å; F410-F412 HydrophobicContact CD1-CG 4.47Å; F410-F412 AromaticContact CD1-CZ 3.28Å; F410-F412 HydrophobicContact CD1-CZ 3.28Å; F410-F412 HydrophobicContact CE1-CD1 4.23Å; F410-F412 AromaticContact CE1-CE1 3.74Å; F410-F412 HydrophobicContact CE1-CE1 3.74Å; F410-F412 HydrophobicContact CE1-CE2 4.48Å; F410-F412 AromaticContact CE1-CZ 3.86Å; F410-F412 HydrophobicContact CE1-CZ 3.86Å; F410-F412 HydrophobicContact CG-CE2 4.35Å; F410-F412 HydrophobicContact CG-CZ 4.11Å; F412-T414 VanDerWaalsContact C-N 3.33Å; F412-N417 HydrophobicContact CD1-CB 4.07Å; F412-Y418 AromaticContact CD2-CD2 3.77Å; F412-Y418 HydrophobicContact CD2-CD2 3.77Å; F412-Y418 HydrophobicContact CD2-CG 4.28Å; F412-Y418 HydrophobicContact CE2-CD2 4.1Å; F412-H421 HydrophobicContact CE1-CB 3.94Å; F412-H421 HydrophobicContact CE2-CB 3.85Å; F412-H421 AromaticContact CE2-CD2 3.45Å; F412-H421 VanDerWaalsContact CE2-CD2 3.45Å; F412-H421 WeakPolarHBondContact CE2-CD2 3.47Å; F412-H421 AromaticContact CE2-CG 3.61Å; F412-H421 HydrophobicContact CZ-CB 3.4Å; F412-H421 AromaticContact CZ-CD2 3.53Å; F412-H421 AromaticContact CZ-CG 3.21Å; F412-H421 AromaticContact CZ-ND1 3.56Å
413	A	67.4	Low	77.6	Confident	11 Å²	11	69 Å²	69	9%	0.091	35%	0.352	C	S	.	.	S	Bend	trans	-70.8	-25.4	174.6	0	0	0	0	0	113.5	R394 M395	R394-A413 HydrophobicContact CB-CB 3.77Å; M395-A413 HydrophobicContact CG-CB 3.92Å; M395-A413 HydrophobicContact SD-CB 4.02Å
414	T	68.3	Low	77.8	Confident	29 Å²	29	71 Å²	71	18%	0.178	37%	0.368	C	S	.	.	S	Bend	trans	-134.1	144.9	-174	76.4	0	0	0	0	112.4	A391 Y403 F412 S416 N417 Y418	A391-T414 HydrophobicContact CB-CG2 4.49Å; Y403-T414 VanDerWaalsContact CD2-C 3.47Å; F412-T414 VanDerWaalsContact C-N 3.33Å; T414-S416 VanDerWaalsContact C-N 3.27Å; T414-S416 PolarHBondContact O-N 3.5Å; T414-N417 PolarHBondContact O-N 3.05Å; T414-N417 WeakPolarHBondContact OG1-CB 3.4Å; T414-N417 PolarHBondContact OG1-N 2.88Å; T414-N417 PolarHBondContact OG1-OD1 2.94Å; T414-Y418 PolarHBondContact O-N 3.12Å; T414-Y418 VanDerWaalsContact O-N 3.07Å
415	S	71.4	Confident	77.8	Confident	48 Å²	48	70.8 Å²	70.8	34%	0.336	36%	0.363	S	S	.	.	H	α-helix	trans	-69.5	-23.2	178.4	54.2	0	0	0	0	113.4	K419	S415-K419 WeakPolarHBondContact O-CB 3.27Å; S415-K419 VanDerWaalsContact O-CG 3.25Å; S415-K419 WeakPolarHBondContact O-CG 3.36Å; S415-K419 PolarHBondContact O-N 3.44Å
416	S	71.2	Confident	77.6	Confident	75 Å²	75	73.5 Å²	73.5	52%	0.524	38%	0.382	S	S	.	.	H	α-helix	trans	-65.2	-49.5	171.9	-59.3	0	0	0	0	111.1	T414 K419 I420	T414-S416 VanDerWaalsContact C-N 3.27Å; T414-S416 PolarHBondContact O-N 3.5Å; S416-K419 PolarHBondContact O-N 3.31Å; S416-I420 WeakPolarHBondContact O-CG1 3.08Å; S416-I420 PolarHBondContact O-N 3.21Å
417	N	72.3	Confident	77.6	Confident	70 Å²	70	68.7 Å²	68.7	37%	0.374	37%	0.367	S	S	.	.	H	α-helix	trans	-68.4	-39	-178.9	-63.6	15.4	0	0	0	110.3	F412 T414 I420 H421	F412-N417 HydrophobicContact CD1-CB 4.07Å; T414-N417 PolarHBondContact O-N 3.05Å; T414-N417 WeakPolarHBondContact OG1-CB 3.4Å; T414-N417 PolarHBondContact OG1-N 2.88Å; T414-N417 PolarHBondContact OG1-OD1 2.94Å; N417-I420 PolarHBondContact O-N 2.76Å; N417-H421 WeakPolarHBondContact O-CB 3.35Å; N417-H421 PolarHBondContact O-N 3.1Å
418	Y	77.3	Confident	77.5	Confident	44 Å²	44	65.2 Å²	65.2	17%	0.173	36%	0.359	C	S	.	.	H	α-helix	trans	-57.6	-51.2	171.9	-179	-143.7	0	0	0	111.9	Y403 T404 C405 F412 T414 I420 H421 I422	Y403-Y418 HydrophobicContact CD1-CD1 4.2Å; Y403-Y418 HydrophobicContact CG-CD1 4.34Å; T404-Y418 WeakPolarHBondContact O-CE2 3.49Å; T404-Y418 PolarHBondContact O-OH 3.36Å; C405-Y418 HydrophobicContact CB-CD2 4.35Å; C405-Y418 HydrophobicContact CB-CE2 3.67Å; F412-Y418 AromaticContact CD2-CD2 3.77Å; F412-Y418 HydrophobicContact CD2-CD2 3.77Å; F412-Y418 HydrophobicContact CD2-CG 4.28Å; F412-Y418 HydrophobicContact CE2-CD2 4.1Å; T414-Y418 PolarHBondContact O-N 3.12Å; T414-Y418 VanDerWaalsContact O-N 3.07Å; Y418-I420 VanDerWaalsContact C-N 3.28Å; Y418-I420 PolarHBondContact O-N 2.97Å; Y418-H421 WeakPolarHBondContact O-CA 3.42Å; Y418-H421 WeakPolarHBondContact O-CB 3.32Å; Y418-H421 PolarHBondContact O-N 2.83Å; Y418-I422 HydrophobicContact CD1-CD1 4.09Å; Y418-I422 HydrophobicContact CD2-CD1 4.01Å; Y418-I422 HydrophobicContact CD2-CG1 3.86Å; Y418-I422 HydrophobicContact CE1-CD1 3.8Å; Y418-I422 HydrophobicContact CE2-CD1 3.64Å; Y418-I422 HydrophobicContact CE2-CG1 3.46Å; Y418-I422 VanDerWaalsContact CE2-CG1 3.46Å; Y418-I422 HydrophobicContact CG-CD1 4.21Å; Y418-I422 HydrophobicContact CG-CG1 4.5Å; Y418-I422 WeakPolarHBondContact O-CG1 3.46Å; Y418-I422 PolarHBondContact O-N 2.9Å
419	K	76.1	Confident	77.5	Confident	132 Å²	132	68.1 Å²	68.1	57%	0.574	36%	0.364	S	S	*	.	H	α-helix	trans	-62	-32.5	178.4	-75.9	176.4	179.6	-173.2	0	113.8	S415 S416	S415-K419 WeakPolarHBondContact O-CB 3.27Å; S415-K419 VanDerWaalsContact O-CG 3.25Å; S415-K419 WeakPolarHBondContact O-CG 3.36Å; S415-K419 PolarHBondContact O-N 3.44Å; S416-K419 PolarHBondContact O-N 3.31Å
420	I	77.9	Confident	77.6	Confident	52 Å²	52	69.2 Å²	69.2	27%	0.267	36%	0.363	S	S	.	.	H	α-helix	trans	-68.7	-40.4	173.1	-72.4	166.4	0	0	0	110.5	S416 N417 Y418 R423 Q442	S416-I420 WeakPolarHBondContact O-CG1 3.08Å; S416-I420 PolarHBondContact O-N 3.21Å; N417-I420 PolarHBondContact O-N 2.76Å; Y418-I420 VanDerWaalsContact C-N 3.28Å; Y418-I420 PolarHBondContact O-N 2.97Å; I420-R423 PolarHBondContact O-N 2.86Å; I420-Q442 HydrophobicContact CG2-CG 3.82Å
421	H	81.7	Confident	77.9	Confident	32 Å²	32	67.3 Å²	67.3	15%	0.148	35%	0.352	C	S	.	.	H	α-helix	trans	-66.8	-40.8	176.9	174.9	79.8	0	0	0	113.2	C408 F412 N417 Y418 R423 L424 H425	C408-H421 PolarHBondContact SG-NE2 3.17Å; F412-H421 HydrophobicContact CE1-CB 3.94Å; F412-H421 HydrophobicContact CE2-CB 3.85Å; F412-H421 AromaticContact CE2-CD2 3.45Å; F412-H421 VanDerWaalsContact CE2-CD2 3.45Å; F412-H421 WeakPolarHBondContact CE2-CD2 3.47Å; F412-H421 AromaticContact CE2-CG 3.61Å; F412-H421 HydrophobicContact CZ-CB 3.4Å; F412-H421 AromaticContact CZ-CD2 3.53Å; F412-H421 AromaticContact CZ-CG 3.21Å; F412-H421 AromaticContact CZ-ND1 3.56Å; N417-H421 WeakPolarHBondContact O-CB 3.35Å; N417-H421 PolarHBondContact O-N 3.1Å; Y418-H421 WeakPolarHBondContact O-CA 3.42Å; Y418-H421 WeakPolarHBondContact O-CB 3.32Å; Y418-H421 PolarHBondContact O-N 2.83Å; H421-R423 PolarHBondContact O-N 3.06Å; H421-R423 VanDerWaalsContact O-N 3.15Å; H421-L424 VanDerWaalsContact O-CB 3.24Å; H421-L424 WeakPolarHBondContact O-CB 3.48Å; H421-L424 WeakPolarHBondContact O-CG 3.39Å; H421-L424 PolarHBondContact O-N 3.08Å; H421-H425 AromaticContact CD2-CD2 3.9Å; H421-H425 AromaticContact CD2-NE2 3.77Å; H421-H425 AromaticContact CE1-NE2 3.57Å; H421-H425 AromaticContact NE2-CD2 3.57Å; H421-H425 AromaticContact NE2-NE2 2.98Å; H421-H425 PolarHBondContact NE2-NE2 3Å
422	I	80.3	Confident	78.3	Confident	59 Å²	59	65.6 Å²	65.6	30%	0.303	35%	0.352	S	S	.	.	H	α-helix	trans	-56.2	-33.8	177.5	-61.3	163.9	0	0	0	111.5	Y418 L424 H425 S426	Y418-I422 HydrophobicContact CD1-CD1 4.09Å; Y418-I422 HydrophobicContact CD2-CD1 4.01Å; Y418-I422 HydrophobicContact CD2-CG1 3.86Å; Y418-I422 HydrophobicContact CE1-CD1 3.8Å; Y418-I422 HydrophobicContact CE2-CD1 3.64Å; Y418-I422 HydrophobicContact CE2-CG1 3.46Å; Y418-I422 VanDerWaalsContact CE2-CG1 3.46Å; Y418-I422 HydrophobicContact CG-CD1 4.21Å; Y418-I422 HydrophobicContact CG-CG1 4.5Å; Y418-I422 WeakPolarHBondContact O-CG1 3.46Å; Y418-I422 PolarHBondContact O-N 2.9Å; I422-L424 PolarHBondContact O-N 3.17Å; I422-H425 WeakPolarHBondContact O-CA 3.38Å; I422-H425 WeakPolarHBondContact O-CB 3.36Å; I422-H425 PolarHBondContact O-N 2.99Å; I422-S426 PolarHBondContact O-N 3.49Å; I422-S426 PolarHBondContact O-OG 3.49Å
423	R	83.8	Confident	79	Confident	51 Å²	51	64.3 Å²	64.3	19%	0.192	35%	0.346	C	S	.	.	H	α-helix	trans	-63.4	-23.3	176.5	-64.8	-178.6	-172.9	142.8	6.7	114.1	I420 H421 H425 G427 E428 A441	I420-R423 PolarHBondContact O-N 2.86Å; H421-R423 PolarHBondContact O-N 3.06Å; H421-R423 VanDerWaalsContact O-N 3.15Å; R423-H425 VanDerWaalsContact C-N 3.3Å; R423-G427 CarbonylContact O-C 3.58Å; R423-G427 WeakPolarHBondContact O-CA 3.36Å; R423-G427 PolarHBondContact O-N 2.94Å; R423-E428 HydrophobicContact CB-CB 4.16Å; R423-E428 HydrophobicContact CG-CB 3.93Å; R423-E428 PolarHBondContact O-N 3.44Å; R423-A441 HydrophobicContact CB-CB 4.09Å; R423-A441 WeakPolarHBondContact CD-O 3.17Å; R423-A441 PolarHBondContact NH1-O 3.06Å
424	L	80.6	Confident	80	Confident	123 Å²	123	69.4 Å²	69.4	64%	0.644	37%	0.372	S	S	*	.	H	α-helix	trans	-68.7	-34.4	172.1	-53.6	176.3	0	0	0	110.6	H421 I422	H421-L424 VanDerWaalsContact O-CB 3.24Å; H421-L424 WeakPolarHBondContact O-CB 3.48Å; H421-L424 WeakPolarHBondContact O-CG 3.39Å; H421-L424 PolarHBondContact O-N 3.08Å; I422-L424 PolarHBondContact O-N 3.17Å
425	H	80.8	Confident	81	Confident	50 Å²	50	72.6 Å²	72.6	23%	0.231	39%	0.387	C	S	.	.	H	α-helix	trans	-80.6	-38	177.9	-68.2	-62.4	0	0	0	113.5	C405 R407 C408 H421 I422 R423	C405-H425 VanDerWaalsContact SG-CD2 3.57Å; R407-H425 PolarHBondContact NH1-O 3.26Å; C408-H425 PolarHBondContact SG-NE2 2.76Å; H421-H425 AromaticContact CD2-CD2 3.9Å; H421-H425 AromaticContact CD2-NE2 3.77Å; H421-H425 AromaticContact CE1-NE2 3.57Å; H421-H425 AromaticContact NE2-CD2 3.57Å; H421-H425 AromaticContact NE2-NE2 2.98Å; H421-H425 PolarHBondContact NE2-NE2 3Å; I422-H425 WeakPolarHBondContact O-CA 3.38Å; I422-H425 WeakPolarHBondContact O-CB 3.36Å; I422-H425 PolarHBondContact O-N 2.99Å; R423-H425 VanDerWaalsContact C-N 3.3Å
426	S	80.6	Confident	81.8	Confident	63 Å²	63	73.4 Å²	73.4	44%	0.441	39%	0.392	S	S	.	.	H	α-helix	trans	-85.8	-12.1	177.7	65.6	0	0	0	0	114	I422 E428	I422-S426 PolarHBondContact O-N 3.49Å; I422-S426 PolarHBondContact O-OG 3.49Å; S426-E428 PolarHBondContact O-N 3.03Å; S426-E428 WeakPolarHBondContact OG-CB 3.5Å; S426-E428 WeakPolarHBondContact OG-CG 3.41Å; S426-E428 PolarHBondContact OG-OE1 3.13Å
427	G	81.8	Confident	82.5	Confident	46 Å²	46	72.3 Å²	72.3	47%	0.474	39%	0.393	S	S	.	.			trans	72.5	3.4	-174.6	0	0	0	0	0	114.4	R423 K429	R423-G427 CarbonylContact O-C 3.58Å; R423-G427 WeakPolarHBondContact O-CA 3.36Å; R423-G427 PolarHBondContact O-N 2.94Å; G427-K429 PolarHBondContact O-N 3.06Å
428	E	79.8	Confident	83.3	Confident	107 Å²	107	73.4 Å²	73.4	50%	0.5	40%	0.395	S	S	.	.			trans	-56.7	121.4	-179	-86.8	174.8	-135.9	0	0	112.4	R423 S426 P430	R423-E428 HydrophobicContact CB-CB 4.16Å; R423-E428 HydrophobicContact CG-CB 3.93Å; R423-E428 PolarHBondContact O-N 3.44Å; S426-E428 PolarHBondContact O-N 3.03Å; S426-E428 WeakPolarHBondContact OG-CB 3.5Å; S426-E428 WeakPolarHBondContact OG-CG 3.41Å; S426-E428 PolarHBondContact OG-OE1 3.13Å; E428-P430 WeakPolarHBondContact O-CD 3.46Å
429	K	84.6	Confident	83.8	Confident	125 Å²	125	72.9 Å²	72.9	54%	0.543	40%	0.4	S	S	.	.			trans	-124.8	74.2	178.7	-73.5	162.3	174.4	-179.4	0	111.1	G427 Y431 A439 F440	G427-K429 PolarHBondContact O-N 3.06Å; K429-Y431 PolarHBondContact O-N 3.43Å; K429-Y431 VanDerWaalsContact O-N 3.16Å; K429-A439 HydrophobicContact CB-CB 3.65Å; K429-A439 HydrophobicContact CD-CB 4.36Å; K429-A439 WeakPolarHBondContact CD-O 3.36Å; K429-F440 CarbonylContact C-O 3.52Å; K429-F440 VanDerWaalsContact CA-O 3.24Å; K429-F440 WeakPolarHBondContact CA-O 3.33Å
430	P	81.5	Confident	84.2	Confident	71 Å²	71	67.9 Å²	67.9	46%	0.461	38%	0.379	S	S	.	.			trans	-69.7	-10.8	-172.6	-18.9	33.5	0	0	0	115	E428	E428-P430 WeakPolarHBondContact O-CD 3.46Å
431	Y	86.1	Confident	84.3	Confident	77 Å²	77	66.3 Å²	66.3	30%	0.302	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	89.9	-171.9	-55.8	-78.9	0	0	0	110	K429 F440	K429-Y431 PolarHBondContact O-N 3.43Å; K429-Y431 VanDerWaalsContact O-N 3.16Å; Y431-F440 WeakPolarHBondContact CB-O 3.27Å; Y431-F440 WeakPolarHBondContact CD2-O 3.47Å; Y431-F440 PolarHBondContact N-O 2.68Å; Y431-F440 VanDerWaalsContact N-O 3.07Å; Y431-F440 PolarHBondContact O-N 3.48Å
432	V	86.4	Confident	84.3	Confident	84 Å²	84	67.6 Å²	67.6	51%	0.509	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	138.5	-179.8	-173.9	0	0	0	0	110.7	A439 L446	V432-A439 HydrophobicContact CG2-CB 4.09Å; V432-L446 WeakPolarHBondContact O-CD2 3.37Å
433	C	89.6	Confident	84.4	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.007	39%	0.386	C	S	.	.			trans	-78.4	124.6	168.1	-174.9	0	0	0	0	110.7	I435 G437 Q438 F440 L446 H449	C433-I435 VanDerWaalsContact C-N 3.31Å; C433-I435 PolarHBondContact SG-N 3.07Å; C433-I435 VanDerWaalsContact SG-N 3.39Å; C433-G437 WeakPolarHBondContact O-CA 3.41Å; C433-G437 PolarHBondContact O-N 3.16Å; C433-Q438 WeakPolarHBondContact CB-O 3.2Å; C433-Q438 PolarHBondContact N-O 3.42Å; C433-F440 HydrophobicContact CB-CE2 4.44Å; C433-L446 HydrophobicContact CB-CD1 3.64Å; C433-H449 PolarHBondContact SG-NE2 3.18Å
434	D	89.3	Confident	84.2	Confident	118 Å²	118	67.8 Å²	67.8	63%	0.631	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-28.4	172.6	41	0.9	0	0	0	113.9	K450	D434-K450 WeakPolarHBondContact OD1-CE 3.39Å; D434-K450 IonicContact OD1-NZ 3.18Å; D434-K450 PolarHBondContact OD1-NZ 3.37Å; D434-K450 IonicContact OD2-NZ 2.78Å; D434-K450 PolarHBondContact OD2-NZ 3.34Å
435	I	87.8	Confident	84.3	Confident	96 Å²	96	63.3 Å²	63.3	49%	0.492	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-35.6	-175.9	-58.4	171.1	0	0	0	112.3	C433 H453	C433-I435 VanDerWaalsContact C-N 3.31Å; C433-I435 PolarHBondContact SG-N 3.07Å; C433-I435 VanDerWaalsContact SG-N 3.39Å; I435-H453 HydrophobicContact CD1-CB 3.57Å; I435-H453 HydrophobicContact CG2-CB 4.06Å
436	C	89.1	Confident	84.6	Confident	66 Å²	66	62 Å²	62	45%	0.446	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.4	12.1	-174.6	77.7	0	0	0	0	115.3	Q438 H449 H453	C436-Q438 PolarHBondContact O-N 3.42Å; C436-H449 PolarHBondContact SG-NE2 3.03Å; C436-H453 PolarHBondContact SG-NE2 2.88Å; C436-H453 VanDerWaalsContact SG-NE2 3.42Å
437	G	86.1	Confident	84.7	Confident	52 Å²	52	62.8 Å²	62.8	54%	0.536	37%	0.368	S	S	.	.			trans	68.8	-4.6	179.5	0	0	0	0	0	116.2	C433 A439	C433-G437 WeakPolarHBondContact O-CA 3.41Å; C433-G437 PolarHBondContact O-N 3.16Å; G437-A439 PolarHBondContact O-N 3.26Å
438	Q	89.4	Confident	84.7	Confident	92 Å²	92	65.1 Å²	65.1	43%	0.43	36%	0.364	S	S	.	.			trans	-67.7	128.4	-175.4	-167.5	174.2	13.4	0	0	111.1	C433 C436 F440 H449	C433-Q438 WeakPolarHBondContact CB-O 3.2Å; C433-Q438 PolarHBondContact N-O 3.42Å; C436-Q438 PolarHBondContact O-N 3.42Å; Q438-F440 HydrophobicContact CB-CE2 4.03Å; Q438-F440 HydrophobicContact CB-CZ 4.06Å; Q438-F440 HydrophobicContact CG-CE1 4.28Å; Q438-F440 HydrophobicContact CG-CE2 3.97Å; Q438-F440 HydrophobicContact CG-CZ 3.59Å; Q438-F440 WeakPolarHBondContact O-CD2 3.33Å; Q438-F440 VanDerWaalsContact O-CE2 3.23Å; Q438-F440 WeakPolarHBondContact O-CE2 3.44Å; Q438-H449 PolarHBondContact OE1-CE1 2.92Å; Q438-H449 PolarHBondContact OE1-ND1 3.25Å
439	A	87.4	Confident	85.1	Confident	33 Å²	33	60.6 Å²	60.6	27%	0.273	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	139.9	-173.7	0	0	0	0	0	113.3	K429 V432 G437	K429-A439 HydrophobicContact CB-CB 3.65Å; K429-A439 HydrophobicContact CD-CB 4.36Å; K429-A439 WeakPolarHBondContact CD-O 3.36Å; V432-A439 HydrophobicContact CG2-CB 4.09Å; G437-A439 PolarHBondContact O-N 3.26Å
440	F	83.4	Confident	85	Confident	27 Å²	27	57.7 Å²	57.7	12%	0.118	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	150.3	-174.5	-58.4	-82.4	0	0	0	112.7	K429 Y431 C433 Q438 T445 L446 H449	K429-F440 CarbonylContact C-O 3.52Å; K429-F440 VanDerWaalsContact CA-O 3.24Å; K429-F440 WeakPolarHBondContact CA-O 3.33Å; Y431-F440 WeakPolarHBondContact CB-O 3.27Å; Y431-F440 WeakPolarHBondContact CD2-O 3.47Å; Y431-F440 PolarHBondContact N-O 2.68Å; Y431-F440 VanDerWaalsContact N-O 3.07Å; Y431-F440 PolarHBondContact O-N 3.48Å; C433-F440 HydrophobicContact CB-CE2 4.44Å; Q438-F440 HydrophobicContact CB-CE2 4.03Å; Q438-F440 HydrophobicContact CB-CZ 4.06Å; Q438-F440 HydrophobicContact CG-CE1 4.28Å; Q438-F440 HydrophobicContact CG-CE2 3.97Å; Q438-F440 HydrophobicContact CG-CZ 3.59Å; Q438-F440 WeakPolarHBondContact O-CD2 3.33Å; Q438-F440 VanDerWaalsContact O-CE2 3.23Å; Q438-F440 WeakPolarHBondContact O-CE2 3.44Å; F440-T445 HydrophobicContact CD1-CG2 3.55Å; F440-T445 HydrophobicContact CE1-CG2 4.1Å; F440-T445 HydrophobicContact CG-CG2 4.27Å; F440-L446 HydrophobicContact CB-CB 4.47Å; F440-L446 HydrophobicContact CD2-CB 4.01Å; F440-L446 HydrophobicContact CD2-CD1 3.91Å; F440-L446 HydrophobicContact CE2-CD1 4.11Å; F440-L446 HydrophobicContact CG-CB 4.47Å; F440-H449 HydrophobicContact CE1-CB 4.35Å; F440-H449 HydrophobicContact CE2-CB 3.94Å; F440-H449 AromaticContact CE2-CD2 3.63Å; F440-H449 AromaticContact CE2-CG 3.61Å; F440-H449 HydrophobicContact CZ-CB 3.71Å; F440-H449 AromaticContact CZ-CD2 3.85Å; F440-H449 AromaticContact CZ-CE1 3.85Å; F440-H449 AromaticContact CZ-CG 3.39Å; F440-H449 AromaticContact CZ-ND1 3.42Å; F440-H449 WeakPolarHBondContact CZ-ND1 3.37Å
441	A	79.9	Confident	85.3	Confident	19 Å²	19	56.7 Å²	56.7	16%	0.157	32%	0.317	C	S	.	.	S	Bend	trans	-80.6	-12.7	177.7	0	0	0	0	0	113.9	R423	R423-A441 HydrophobicContact CB-CB 4.09Å; R423-A441 WeakPolarHBondContact CD-O 3.17Å; R423-A441 PolarHBondContact NH1-O 3.06Å
442	Q	82	Confident	85.2	Confident	59 Å²	59	61.2 Å²	61.2	28%	0.276	33%	0.334	S	S	.	.	S	Bend	trans	-135.4	147.5	179	-52.9	-176.8	29.6	0	0	111.6	I420 S444 L446	I420-Q442 HydrophobicContact CG2-CG 3.82Å; Q442-S444 WeakPolarHBondContact CB-OG 3.25Å; Q442-S444 PolarHBondContact OE1-OG 3.46Å; Q442-L446 PolarHBondContact O-N 2.91Å
443	S	82.3	Confident	85	Confident	62 Å²	62	60.6 Å²	60.6	43%	0.434	33%	0.325	S	S	.	.	H	α-helix	trans	-71.3	-33	175.8	50.7	0	0	0	0	113.3	L446 T447	S443-L446 PolarHBondContact O-N 3.29Å; S443-T447 PolarHBondContact O-N 3.24Å; S443-T447 PolarHBondContact O-OG1 3.3Å; S443-T447 VanDerWaalsContact O-OG1 3.12Å
444	S	80.4	Confident	84.8	Confident	53 Å²	53	64 Å²	64	37%	0.371	35%	0.346	S	S	.	.	H	α-helix	trans	-55.6	-48.8	172.5	42.3	0	0	0	0	111.5	Q442 T447 Y448	Q442-S444 WeakPolarHBondContact CB-OG 3.25Å; Q442-S444 PolarHBondContact OE1-OG 3.46Å; S444-T447 PolarHBondContact O-N 3.13Å; S444-Y448 PolarHBondContact O-N 3.46Å
445	T	83.2	Confident	84.6	Confident	29 Å²	29	60.9 Å²	60.9	18%	0.178	34%	0.341	C	S	.	.	H	α-helix	trans	-63.8	-40.5	177.3	-43.7	0	0	0	0	112.1	F228 F440 Y448 H449	F228-T445 HydrophobicContact CE2-CG2 3.91Å; F228-T445 HydrophobicContact CZ-CG2 3.83Å; F440-T445 HydrophobicContact CD1-CG2 3.55Å; F440-T445 HydrophobicContact CE1-CG2 4.1Å; F440-T445 HydrophobicContact CG-CG2 4.27Å; T445-Y448 PolarHBondContact O-N 3.09Å; T445-H449 VanDerWaalsContact O-CB 3.29Å; T445-H449 WeakPolarHBondContact O-CB 3.18Å; T445-H449 PolarHBondContact O-N 3.44Å
446	L	86.1	Confident	84.3	Confident	22 Å²	22	60.9 Å²	60.9	12%	0.115	34%	0.339	C	S	.	.	H	α-helix	trans	-62.3	-45.8	173	173.4	60.3	0	0	0	111.7	V432 C433 F440 Q442 S443 Y448 H449 K450	V432-L446 WeakPolarHBondContact O-CD2 3.37Å; C433-L446 HydrophobicContact CB-CD1 3.64Å; F440-L446 HydrophobicContact CB-CB 4.47Å; F440-L446 HydrophobicContact CD2-CB 4.01Å; F440-L446 HydrophobicContact CD2-CD1 3.91Å; F440-L446 HydrophobicContact CE2-CD1 4.11Å; F440-L446 HydrophobicContact CG-CB 4.47Å; Q442-L446 PolarHBondContact O-N 2.91Å; S443-L446 PolarHBondContact O-N 3.29Å; L446-Y448 PolarHBondContact O-N 3.02Å; L446-H449 PolarHBondContact O-N 3.42Å; L446-K450 HydrophobicContact CD1-CG 4.13Å; L446-K450 WeakPolarHBondContact O-CG 3.33Å; L446-K450 PolarHBondContact O-N 3.48Å
447	T	83.7	Confident	84.1	Confident	79 Å²	79	64 Å²	64	49%	0.485	35%	0.345	S	S	.	.	H	α-helix	trans	-60.8	-44.6	178.4	-60.6	0	0	0	0	111.6	S443 S444 K450 R451	S443-T447 PolarHBondContact O-N 3.24Å; S443-T447 PolarHBondContact O-OG1 3.3Å; S443-T447 VanDerWaalsContact O-OG1 3.12Å; S444-T447 PolarHBondContact O-N 3.13Å; T447-K450 PolarHBondContact O-N 3.49Å; T447-R451 PolarHBondContact O-N 2.92Å
448	Y	81.3	Confident	83.8	Confident	96 Å²	96	65 Å²	65	38%	0.376	34%	0.342	S	S	.	.	H	α-helix	trans	-61.2	-45.4	173.9	170	-124.8	0	0	0	111.8	F228 S444 T445 L446 K450 R451 V470	F228-Y448 HydrophobicContact CZ-CD1 4.37Å; S444-Y448 PolarHBondContact O-N 3.46Å; T445-Y448 PolarHBondContact O-N 3.09Å; L446-Y448 PolarHBondContact O-N 3.02Å; Y448-K450 VanDerWaalsContact C-N 3.32Å; Y448-K450 PolarHBondContact O-N 2.84Å; Y448-R451 WeakPolarHBondContact O-CB 3.19Å; Y448-R451 PolarHBondContact O-N 2.73Å; Y448-R451 VanDerWaalsContact O-N 3.14Å; Y448-V470 HydrophobicContact CD2-CG2 3.58Å; Y448-V470 HydrophobicContact CE2-CG2 3.17Å; Y448-V470 HydrophobicContact CG-CG2 4.44Å
449	H	87.1	Confident	83.5	Confident	11 Å²	11	64.2 Å²	64.2	5%	0.051	34%	0.336	C	S	.	.	H	α-helix	trans	-59.3	-39.7	176.5	169.2	90	0	0	0	112.6	C433 C436 Q438 F440 T445 L446 R451 R452 H453	C433-H449 PolarHBondContact SG-NE2 3.18Å; C436-H449 PolarHBondContact SG-NE2 3.03Å; Q438-H449 PolarHBondContact OE1-CE1 2.92Å; Q438-H449 PolarHBondContact OE1-ND1 3.25Å; F440-H449 HydrophobicContact CE1-CB 4.35Å; F440-H449 HydrophobicContact CE2-CB 3.94Å; F440-H449 AromaticContact CE2-CD2 3.63Å; F440-H449 AromaticContact CE2-CG 3.61Å; F440-H449 HydrophobicContact CZ-CB 3.71Å; F440-H449 AromaticContact CZ-CD2 3.85Å; F440-H449 AromaticContact CZ-CE1 3.85Å; F440-H449 AromaticContact CZ-CG 3.39Å; F440-H449 AromaticContact CZ-ND1 3.42Å; F440-H449 WeakPolarHBondContact CZ-ND1 3.37Å; T445-H449 VanDerWaalsContact O-CB 3.29Å; T445-H449 WeakPolarHBondContact O-CB 3.18Å; T445-H449 PolarHBondContact O-N 3.44Å; L446-H449 PolarHBondContact O-N 3.42Å; H449-R451 VanDerWaalsContact C-N 3.3Å; H449-R451 PolarHBondContact O-N 3.48Å; H449-R452 PolarHBondContact CE1-NH2 3.15Å; H449-R452 PolarHBondContact ND1-NH2 3.41Å; H449-R452 VanDerWaalsContact O-CB 3.3Å; H449-R452 WeakPolarHBondContact O-CB 3.22Å; H449-R452 PolarHBondContact O-N 2.81Å; H449-H453 AromaticContact CD2-NE2 3.72Å; H449-H453 AromaticContact CE1-NE2 3.55Å; H449-H453 AromaticContact NE2-CD2 3.72Å; H449-H453 AromaticContact NE2-NE2 2.98Å; H449-H453 PolarHBondContact NE2-NE2 3.44Å
450	K	83.4	Confident	83.5	Confident	65 Å²	65	67.9 Å²	67.9	28%	0.283	35%	0.347	S	S	.	.	H	α-helix	trans	-60.2	-36.5	175.6	-72.2	-157.3	-172.8	-158.5	0	113	D434 L446 T447 Y448 R452 H453 T454	D434-K450 WeakPolarHBondContact OD1-CE 3.39Å; D434-K450 IonicContact OD1-NZ 3.18Å; D434-K450 PolarHBondContact OD1-NZ 3.37Å; D434-K450 IonicContact OD2-NZ 2.78Å; D434-K450 PolarHBondContact OD2-NZ 3.34Å; L446-K450 HydrophobicContact CD1-CG 4.13Å; L446-K450 WeakPolarHBondContact O-CG 3.33Å; L446-K450 PolarHBondContact O-N 3.48Å; T447-K450 PolarHBondContact O-N 3.49Å; Y448-K450 VanDerWaalsContact C-N 3.32Å; Y448-K450 PolarHBondContact O-N 2.84Å; K450-R452 PolarHBondContact O-N 3.28Å; K450-H453 WeakPolarHBondContact O-CA 3.42Å; K450-H453 WeakPolarHBondContact O-CB 3.46Å; K450-H453 PolarHBondContact O-N 3.1Å; K450-T454 PolarHBondContact O-N 2.91Å; K450-T454 PolarHBondContact O-OG1 3.34Å
451	R	86.6	Confident	83.6	Confident	49 Å²	49	66.8 Å²	66.8	19%	0.185	34%	0.343	C	S	.	.	H	α-helix	trans	-60	-24.9	175.1	-64.2	-173.9	176.2	154.4	1.1	113.5	T447 Y448 H449 H453 G455 E456 S469	T447-R451 PolarHBondContact O-N 2.92Å; Y448-R451 WeakPolarHBondContact O-CB 3.19Å; Y448-R451 PolarHBondContact O-N 2.73Å; Y448-R451 VanDerWaalsContact O-N 3.14Å; H449-R451 VanDerWaalsContact C-N 3.3Å; H449-R451 PolarHBondContact O-N 3.48Å; R451-H453 VanDerWaalsContact C-N 3.31Å; R451-G455 CarbonylContact O-C 3.58Å; R451-G455 WeakPolarHBondContact O-CA 3.49Å; R451-G455 PolarHBondContact O-N 3.41Å; R451-E456 HydrophobicContact CB-CB 4.07Å; R451-E456 HydrophobicContact CG-CB 3.85Å; R451-E456 PolarHBondContact O-N 3.01Å; R451-S469 PolarHBondContact NH1-O 2.59Å
452	R	85.1	Confident	83.8	Confident	173 Å²	173	73.5 Å²	73.5	65%	0.653	38%	0.376	S	S	*	.	H	α-helix	trans	-71	-26.9	173.5	-168.5	175.8	65	177.2	2.6	112.5	H449 K450	H449-R452 PolarHBondContact CE1-NH2 3.15Å; H449-R452 PolarHBondContact ND1-NH2 3.41Å; H449-R452 VanDerWaalsContact O-CB 3.3Å; H449-R452 WeakPolarHBondContact O-CB 3.22Å; H449-R452 PolarHBondContact O-N 2.81Å; K450-R452 PolarHBondContact O-N 3.28Å
453	H	82.9	Confident	83.8	Confident	70 Å²	70	76.5 Å²	76.5	32%	0.324	39%	0.394	S	S	.	.	H	α-helix	trans	-86.6	-39.6	174.7	-60.6	-61.7	0	0	0	112.4	I435 C436 H449 K450 R451	I435-H453 HydrophobicContact CD1-CB 3.57Å; I435-H453 HydrophobicContact CG2-CB 4.06Å; C436-H453 PolarHBondContact SG-NE2 2.88Å; C436-H453 VanDerWaalsContact SG-NE2 3.42Å; H449-H453 AromaticContact CD2-NE2 3.72Å; H449-H453 AromaticContact CE1-NE2 3.55Å; H449-H453 AromaticContact NE2-CD2 3.72Å; H449-H453 AromaticContact NE2-NE2 2.98Å; H449-H453 PolarHBondContact NE2-NE2 3.44Å; K450-H453 WeakPolarHBondContact O-CA 3.42Å; K450-H453 WeakPolarHBondContact O-CB 3.46Å; K450-H453 PolarHBondContact O-N 3.1Å; R451-H453 VanDerWaalsContact C-N 3.31Å
454	T	84.7	Confident	84	Confident	74 Å²	74	76.2 Å²	76.2	45%	0.454	39%	0.391	S	S	.	.	H	α-helix	trans	-83.6	-10.7	-179.7	59.8	0	0	0	0	114	K450 E456	K450-T454 PolarHBondContact O-N 2.91Å; K450-T454 PolarHBondContact O-OG1 3.34Å; T454-E456 WeakPolarHBondContact CB-OE1 3.49Å; T454-E456 PolarHBondContact O-N 3.38Å; T454-E456 VanDerWaalsContact OG1-CD 3.25Å; T454-E456 WeakPolarHBondContact OG1-CG 3.45Å; T454-E456 PolarHBondContact OG1-OE1 2.89Å
455	G	84	Confident	84.1	Confident	51 Å²	51	75.5 Å²	75.5	53%	0.526	39%	0.392	S	S	.	.			trans	72.6	3.1	-174.9	0	0	0	0	0	114.4	R451 K457	R451-G455 CarbonylContact O-C 3.58Å; R451-G455 WeakPolarHBondContact O-CA 3.49Å; R451-G455 PolarHBondContact O-N 3.41Å; G455-K457 PolarHBondContact O-N 3.37Å
456	E	82.2	Confident	84.2	Confident	96 Å²	96	79.5 Å²	79.5	45%	0.449	41%	0.41	S	S	.	.			trans	-55.7	121.6	-177.4	-84.9	167.8	-117.9	0	0	112.8	R451 T454 S469	R451-E456 HydrophobicContact CB-CB 4.07Å; R451-E456 HydrophobicContact CG-CB 3.85Å; R451-E456 PolarHBondContact O-N 3.01Å; T454-E456 WeakPolarHBondContact CB-OE1 3.49Å; T454-E456 PolarHBondContact O-N 3.38Å; T454-E456 VanDerWaalsContact OG1-CD 3.25Å; T454-E456 WeakPolarHBondContact OG1-CG 3.45Å; T454-E456 PolarHBondContact OG1-OE1 2.89Å; E456-S469 WeakPolarHBondContact O-CB 3.3Å
457	K	84.1	Confident	84.2	Confident	131 Å²	131	80.2 Å²	80.2	57%	0.57	42%	0.417	S	S	*	.			trans	-125.7	76.5	178.1	-74.8	165.5	159.6	-164.5	0	110.9	G455 Y459 S467 F468	G455-K457 PolarHBondContact O-N 3.37Å; K457-Y459 PolarHBondContact O-N 2.92Å; K457-S467 VanDerWaalsContact CD-O 3.25Å; K457-S467 WeakPolarHBondContact CD-O 3.21Å; K457-S467 WeakPolarHBondContact CE-O 3.47Å; K457-F468 CarbonylContact C-O 3.56Å; K457-F468 WeakPolarHBondContact CA-O 3.28Å
458	P	80.9	Confident	84.1	Confident	73 Å²	73	78.6 Å²	78.6	47%	0.474	40%	0.403	S	S	.	.			trans	-74.6	-6.6	-170.7	-18.3	34.4	0	0	0	115.4
459	Y	83.7	Confident	84	Confident	77 Å²	77	75.5 Å²	75.5	30%	0.302	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	94.9	-174.7	-52.6	-76.3	0	0	0	109.5	K457 S467 F468	K457-Y459 PolarHBondContact O-N 2.92Å; Y459-S467 WeakPolarHBondContact O-CA 3.4Å; Y459-F468 WeakPolarHBondContact CD2-O 3.4Å; Y459-F468 PolarHBondContact N-O 3.14Å; Y459-F468 VanDerWaalsContact N-O 3.08Å; Y459-F468 PolarHBondContact O-N 2.92Å
460	Q	85.8	Confident	83.6	Confident	109 Å²	109	76.5 Å²	76.5	51%	0.509	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	149.4	177	-167.1	163.3	23.4	0	0	111.2	G465 M466 S467 L474	Q460-G465 WeakPolarHBondContact CG-O 3.38Å; Q460-G465 PolarHBondContact NE2-O 2.83Å; Q460-M466 CarbonylContact C-O 3.59Å; Q460-S467 WeakPolarHBondContact CG-OG 3.5Å; Q460-L474 VanDerWaalsContact O-CD2 3.29Å; Q460-L474 WeakPolarHBondContact O-CD2 3.45Å
461	C	86.3	Confident	83.5	Confident	4 Å²	4	75.5 Å²	75.5	3%	0.027	40%	0.403	C	S	.	.			trans	-95	118.2	170.4	-174.1	0	0	0	0	110.5	L463 C464 G465 M466 F468 L474	C461-L463 PolarHBondContact O-N 2.83Å; C461-C464 PolarHBondContact O-N 3.03Å; C461-G465 WeakPolarHBondContact O-CA 3.43Å; C461-G465 PolarHBondContact O-N 3.47Å; C461-M466 PolarHBondContact N-O 2.84Å; C461-F468 HydrophobicContact CB-CE2 4.46Å; C461-L474 HydrophobicContact CB-CD1 3.47Å; C461-L474 VanDerWaalsContact CB-CD1 3.47Å
462	D	83.9	Confident	83.2	Confident	160 Å²	160	75.7 Å²	75.7	86%	0.856	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-21.4	-175.6	-47	-65.2	0	0	0	113.4
463	L	83	Confident	83.1	Confident	123 Å²	123	69.8 Å²	69.8	64%	0.644	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-19.7	-177	-60	177.1	0	0	0	114.3	C461 H481	C461-L463 PolarHBondContact O-N 2.83Å; L463-H481 HydrophobicContact CD1-CB 3.52Å
464	C	86.7	Confident	83.2	Confident	56 Å²	56	68 Å²	68	38%	0.378	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.5	1.1	-173.7	69.6	0	0	0	0	114.7	C461 M466 H477	C461-C464 PolarHBondContact O-N 3.03Å; C464-M466 PolarHBondContact O-N 3.09Å; C464-M466 VanDerWaalsContact O-N 3.12Å; C464-H477 PolarHBondContact SG-NE2 3Å
465	G	82.1	Confident	83	Confident	38 Å²	38	68.9 Å²	68.9	39%	0.392	39%	0.391	S	S	.	.			trans	70.4	-3	-178.4	0	0	0	0	0	116	Q460 C461 S467	Q460-G465 WeakPolarHBondContact CG-O 3.38Å; Q460-G465 PolarHBondContact NE2-O 2.83Å; C461-G465 WeakPolarHBondContact O-CA 3.43Å; C461-G465 PolarHBondContact O-N 3.47Å; G465-S467 PolarHBondContact O-N 3.28Å
466	M	85.1	Confident	82.9	Confident	112 Å²	112	67.8 Å²	67.8	55%	0.552	38%	0.377	S	S	*	.			trans	-67.6	130.8	-178.7	-71.8	-166.4	174.2	0	0	112.3	Q460 C461 C464 F468	Q460-M466 CarbonylContact C-O 3.59Å; C461-M466 PolarHBondContact N-O 2.84Å; C464-M466 PolarHBondContact O-N 3.09Å; C464-M466 VanDerWaalsContact O-N 3.12Å; M466-F468 HydrophobicContact CB-CE2 3.92Å; M466-F468 HydrophobicContact CB-CZ 4.02Å; M466-F468 WeakPolarHBondContact O-CE2 3.32Å
467	S	86.2	Confident	83.1	Confident	37 Å²	37	64.6 Å²	64.6	26%	0.259	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	138.6	-177.4	-50.9	0	0	0	0	113.8	K457 Y459 Q460 G465	K457-S467 VanDerWaalsContact CD-O 3.25Å; K457-S467 WeakPolarHBondContact CD-O 3.21Å; K457-S467 WeakPolarHBondContact CE-O 3.47Å; Y459-S467 WeakPolarHBondContact O-CA 3.4Å; Q460-S467 WeakPolarHBondContact CG-OG 3.5Å; G465-S467 PolarHBondContact O-N 3.28Å
468	F	81.3	Confident	83	Confident	45 Å²	45	60 Å²	60	20%	0.197	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	151.7	-174	-57.4	-86.9	0	0	0	111.8	K457 Y459 C461 M466 L474 H477	K457-F468 CarbonylContact C-O 3.56Å; K457-F468 WeakPolarHBondContact CA-O 3.28Å; Y459-F468 WeakPolarHBondContact CD2-O 3.4Å; Y459-F468 PolarHBondContact N-O 3.14Å; Y459-F468 VanDerWaalsContact N-O 3.08Å; Y459-F468 PolarHBondContact O-N 2.92Å; C461-F468 HydrophobicContact CB-CE2 4.46Å; M466-F468 HydrophobicContact CB-CE2 3.92Å; M466-F468 HydrophobicContact CB-CZ 4.02Å; M466-F468 WeakPolarHBondContact O-CE2 3.32Å; F468-L474 HydrophobicContact CB-CB 4.46Å; F468-L474 HydrophobicContact CD2-CB 3.96Å; F468-L474 HydrophobicContact CD2-CD1 3.99Å; F468-L474 HydrophobicContact CE2-CD1 4.16Å; F468-L474 HydrophobicContact CG-CB 4.41Å; F468-H477 HydrophobicContact CE1-CB 4.21Å; F468-H477 HydrophobicContact CE2-CB 3.91Å; F468-H477 AromaticContact CE2-CD2 3.94Å; F468-H477 AromaticContact CE2-CG 3.8Å; F468-H477 HydrophobicContact CZ-CB 3.56Å; F468-H477 AromaticContact CZ-CD2 3.95Å; F468-H477 AromaticContact CZ-CG 3.41Å; F468-H477 VanDerWaalsContact CZ-CG 3.41Å; F468-H477 AromaticContact CZ-ND1 3.62Å
469	S	78.4	Confident	83.2	Confident	31 Å²	31	58.8 Å²	58.8	22%	0.217	33%	0.334	C	S	.	.	S	Bend	trans	-86.9	-10.6	178.1	51.4	0	0	0	0	114	R451 E456	R451-S469 PolarHBondContact NH1-O 2.59Å; E456-S469 WeakPolarHBondContact O-CB 3.3Å
470	V	79.8	Confident	83.2	Confident	32 Å²	32	62.1 Å²	62.1	19%	0.194	35%	0.35	C	S	.	.	S	Bend	trans	-134.3	141.6	177	-161	0	0	0	0	110.6	Y448 S472 S473 L474	Y448-V470 HydrophobicContact CD2-CG2 3.58Å; Y448-V470 HydrophobicContact CE2-CG2 3.17Å; Y448-V470 HydrophobicContact CG-CG2 4.44Å; V470-S472 VanDerWaalsContact CG1-OG 3.32Å; V470-S472 WeakPolarHBondContact CG1-OG 3.45Å; V470-S473 PolarHBondContact O-N 3.13Å; V470-L474 PolarHBondContact O-N 2.78Å
471	S	81	Confident	83	Confident	44 Å²	44	61 Å²	61	31%	0.308	35%	0.345	S	S	.	.	H	α-helix	trans	-64.3	-37	176.9	47.8	0	0	0	0	113.3	S473 L474 I475	S471-S473 VanDerWaalsContact C-N 3.29Å; S471-S473 PolarHBondContact O-N 3.23Å; S471-L474 WeakPolarHBondContact O-CB 3.49Å; S471-L474 PolarHBondContact O-N 3.26Å; S471-L474 VanDerWaalsContact O-N 3.16Å; S471-I475 WeakPolarHBondContact O-CG1 3.29Å; S471-I475 PolarHBondContact O-N 3.19Å
472	S	79.3	Confident	82.7	Confident	54 Å²	54	64.7 Å²	64.7	38%	0.378	37%	0.367	S	S	.	.	H	α-helix	trans	-62	-35.8	176.5	57.3	0	0	0	0	112.5	V470 I475 A476	V470-S472 VanDerWaalsContact CG1-OG 3.32Å; V470-S472 WeakPolarHBondContact CG1-OG 3.45Å; S472-I475 PolarHBondContact O-N 3.06Å; S472-A476 VanDerWaalsContact O-CB 3.31Å; S472-A476 WeakPolarHBondContact O-CB 3.23Å; S472-A476 PolarHBondContact O-N 3.04Å
473	S	83.4	Confident	82.4	Confident	48 Å²	48	59.6 Å²	59.6	34%	0.336	35%	0.353	S	S	.	.	H	α-helix	trans	-66.9	-39.9	173.3	-51.9	0	0	0	0	112.2	V470 S471 H477	V470-S473 PolarHBondContact O-N 3.13Å; S471-S473 VanDerWaalsContact C-N 3.29Å; S471-S473 PolarHBondContact O-N 3.23Å; S473-H477 WeakPolarHBondContact O-CB 3.18Å; S473-H477 PolarHBondContact O-N 3.27Å
474	L	84.5	Confident	82.3	Confident	34 Å²	34	58.6 Å²	58.6	18%	0.178	35%	0.345	C	S	.	.	H	α-helix	trans	-62.7	-46.2	172.7	171.2	61	0	0	0	111.4	Q460 C461 F468 V470 S471 A476 H477 A478	Q460-L474 VanDerWaalsContact O-CD2 3.29Å; Q460-L474 WeakPolarHBondContact O-CD2 3.45Å; C461-L474 HydrophobicContact CB-CD1 3.47Å; C461-L474 VanDerWaalsContact CB-CD1 3.47Å; F468-L474 HydrophobicContact CB-CB 4.46Å; F468-L474 HydrophobicContact CD2-CB 3.96Å; F468-L474 HydrophobicContact CD2-CD1 3.99Å; F468-L474 HydrophobicContact CE2-CD1 4.16Å; F468-L474 HydrophobicContact CG-CB 4.41Å; V470-L474 PolarHBondContact O-N 2.78Å; S471-L474 WeakPolarHBondContact O-CB 3.49Å; S471-L474 PolarHBondContact O-N 3.26Å; S471-L474 VanDerWaalsContact O-N 3.16Å; L474-A476 PolarHBondContact O-N 3.39Å; L474-H477 CarbonylContact O-C 3.12Å; L474-H477 WeakPolarHBondContact O-CB 3.47Å; L474-H477 PolarHBondContact O-N 3.07Å; L474-H477 VanDerWaalsContact O-N 3.16Å; L474-A478 WeakPolarHBondContact O-CB 3.34Å; L474-A478 PolarHBondContact O-N 3.41Å
475	I	81.3	Confident	82	Confident	92 Å²	92	58.7 Å²	58.7	47%	0.472	34%	0.344	S	S	.	.	H	α-helix	trans	-62.5	-45	178.8	-66.3	163	0	0	0	110.7	S471 S472 H477 A478 R479	S471-I475 WeakPolarHBondContact O-CG1 3.29Å; S471-I475 PolarHBondContact O-N 3.19Å; S472-I475 PolarHBondContact O-N 3.06Å; I475-H477 VanDerWaalsContact C-N 3.26Å; I475-H477 PolarHBondContact O-N 2.91Å; I475-A478 PolarHBondContact O-N 3.37Å; I475-R479 WeakPolarHBondContact O-CG 3.33Å; I475-R479 PolarHBondContact O-N 2.9Å
476	A	82.1	Confident	81.9	Confident	27 Å²	27	60.1 Å²	60.1	22%	0.223	35%	0.346	C	S	.	.	H	α-helix	trans	-62.6	-31.6	175.3	0	0	0	0	0	113.1	S472 L474 T500	S472-A476 VanDerWaalsContact O-CB 3.31Å; S472-A476 WeakPolarHBondContact O-CB 3.23Å; S472-A476 PolarHBondContact O-N 3.04Å; L474-A476 PolarHBondContact O-N 3.39Å; A476-T500 HydrophobicContact CB-CG2 3.67Å
477	H	85.7	Confident	81.8	Confident	30 Å²	30	57.8 Å²	57.8	14%	0.139	33%	0.331	C	S	.	.	H	α-helix	trans	-74.5	-43.9	172.7	177	86.9	0	0	0	112.1	C464 F468 S473 L474 I475 R479 K480 H481	C464-H477 PolarHBondContact SG-NE2 3Å; F468-H477 HydrophobicContact CE1-CB 4.21Å; F468-H477 HydrophobicContact CE2-CB 3.91Å; F468-H477 AromaticContact CE2-CD2 3.94Å; F468-H477 AromaticContact CE2-CG 3.8Å; F468-H477 HydrophobicContact CZ-CB 3.56Å; F468-H477 AromaticContact CZ-CD2 3.95Å; F468-H477 AromaticContact CZ-CG 3.41Å; F468-H477 VanDerWaalsContact CZ-CG 3.41Å; F468-H477 AromaticContact CZ-ND1 3.62Å; S473-H477 WeakPolarHBondContact O-CB 3.18Å; S473-H477 PolarHBondContact O-N 3.27Å; L474-H477 CarbonylContact O-C 3.12Å; L474-H477 WeakPolarHBondContact O-CB 3.47Å; L474-H477 PolarHBondContact O-N 3.07Å; L474-H477 VanDerWaalsContact O-N 3.16Å; I475-H477 VanDerWaalsContact C-N 3.26Å; I475-H477 PolarHBondContact O-N 2.91Å; H477-R479 PolarHBondContact O-N 3.4Å; H477-K480 VanDerWaalsContact O-CB 3.25Å; H477-K480 WeakPolarHBondContact O-CB 3.34Å; H477-K480 PolarHBondContact O-N 2.89Å; H477-H481 AromaticContact CD2-NE2 3.61Å; H477-H481 AromaticContact CE1-NE2 3.88Å; H477-H481 AromaticContact NE2-CD2 3.88Å; H477-H481 AromaticContact NE2-CE1 3.88Å; H477-H481 AromaticContact NE2-NE2 3Å; H477-H481 PolarHBondContact NE2-NE2 3.48Å
478	A	82.4	Confident	81.8	Confident	33 Å²	33	62.6 Å²	62.6	27%	0.273	35%	0.348	S	S	.	.	H	α-helix	trans	-57.7	-37.4	-179.4	0	0	0	0	0	112.4	L474 I475 K480 H481 T482	L474-A478 WeakPolarHBondContact O-CB 3.34Å; L474-A478 PolarHBondContact O-N 3.41Å; I475-A478 PolarHBondContact O-N 3.37Å; A478-K480 PolarHBondContact O-N 3.43Å; A478-K480 VanDerWaalsContact O-N 3.13Å; A478-H481 WeakPolarHBondContact O-CB 3.37Å; A478-H481 PolarHBondContact O-N 2.9Å; A478-T482 PolarHBondContact O-N 3.47Å
479	R	84.7	Confident	82.1	Confident	49 Å²	49	61.1 Å²	61.1	19%	0.185	34%	0.343	C	S	.	.	H	α-helix	trans	-59.1	-20.7	173.4	-69.7	-175.7	178.7	152.9	4.9	114.6	I475 H477 H481 G483 E484 A499	I475-R479 WeakPolarHBondContact O-CG 3.33Å; I475-R479 PolarHBondContact O-N 2.9Å; H477-R479 PolarHBondContact O-N 3.4Å; R479-H481 VanDerWaalsContact C-N 3.34Å; R479-G483 WeakPolarHBondContact O-CA 3.31Å; R479-G483 PolarHBondContact O-N 3.31Å; R479-E484 HydrophobicContact CB-CB 4.19Å; R479-E484 HydrophobicContact CG-CB 3.88Å; R479-E484 IonicContact NE-OE2 2.63Å; R479-E484 PolarHBondContact O-N 2.93Å; R479-A499 HydrophobicContact CB-CB 4.08Å; R479-A499 VanDerWaalsContact CD-O 3.28Å; R479-A499 WeakPolarHBondContact CD-O 3.46Å; R479-A499 PolarHBondContact NH1-O 3.12Å
480	K	83.5	Confident	82.2	Confident	146 Å²	146	65.6 Å²	65.6	64%	0.635	37%	0.369	S	S	*	.	H	α-helix	trans	-74.1	-25.8	173.9	-57.4	-168.1	173.9	-164.4	0	112.7	H477 A478	H477-K480 VanDerWaalsContact O-CB 3.25Å; H477-K480 WeakPolarHBondContact O-CB 3.34Å; H477-K480 PolarHBondContact O-N 2.89Å; A478-K480 PolarHBondContact O-N 3.43Å; A478-K480 VanDerWaalsContact O-N 3.13Å
481	H	82.1	Confident	82.3	Confident	86 Å²	86	70 Å²	70	40%	0.398	39%	0.387	S	S	.	.	H	α-helix	trans	-84.3	-38	173.4	-57.9	-63.5	0	0	0	111.9	L463 H477 A478 R479	L463-H481 HydrophobicContact CD1-CB 3.52Å; H477-H481 AromaticContact CD2-NE2 3.61Å; H477-H481 AromaticContact CE1-NE2 3.88Å; H477-H481 AromaticContact NE2-CD2 3.88Å; H477-H481 AromaticContact NE2-CE1 3.88Å; H477-H481 AromaticContact NE2-NE2 3Å; H477-H481 PolarHBondContact NE2-NE2 3.48Å; A478-H481 WeakPolarHBondContact O-CB 3.37Å; A478-H481 PolarHBondContact O-N 2.9Å; R479-H481 VanDerWaalsContact C-N 3.34Å
482	T	79.8	Confident	82	Confident	81 Å²	81	74 Å²	74	50%	0.497	41%	0.411	S	S	.	.	H	α-helix	trans	-84.9	-12.5	-179.9	63.7	0	0	0	0	114.3	A478 E484	A478-T482 PolarHBondContact O-N 3.47Å; T482-E484 PolarHBondContact O-N 2.94Å; T482-E484 WeakPolarHBondContact OG1-CG 3.49Å; T482-E484 PolarHBondContact OG1-OE1 3.28Å
483	G	78.8	Confident	81.9	Confident	54 Å²	54	78.5 Å²	78.5	56%	0.557	43%	0.43	S	S	*	.			trans	71.6	7.3	-175.4	0	0	0	0	0	114.4	R479 T485	R479-G483 WeakPolarHBondContact O-CA 3.31Å; R479-G483 PolarHBondContact O-N 3.31Å; G483-T485 PolarHBondContact O-N 3.44Å
484	E	79.6	Confident	81.6	Confident	101 Å²	101	78.1 Å²	78.1	47%	0.472	43%	0.427	S	S	.	.			trans	-61.3	121.6	-179.1	-84.9	173.7	-138.9	0	0	112.2	R479 T482 P486	R479-E484 HydrophobicContact CB-CB 4.19Å; R479-E484 HydrophobicContact CG-CB 3.88Å; R479-E484 IonicContact NE-OE2 2.63Å; R479-E484 PolarHBondContact O-N 2.93Å; T482-E484 PolarHBondContact O-N 2.94Å; T482-E484 WeakPolarHBondContact OG1-CG 3.49Å; T482-E484 PolarHBondContact OG1-OE1 3.28Å; E484-P486 WeakPolarHBondContact O-CD 3.25Å
485	T	81.8	Confident	81.4	Confident	59 Å²	59	83.7 Å²	83.7	36%	0.362	46%	0.457	S	S	.	.			trans	-124.1	75	177	45.2	0	0	0	0	111.5	G483 Y487 K497 F498	G483-T485 PolarHBondContact O-N 3.44Å; T485-Y487 VanDerWaalsContact C-N 3.27Å; T485-Y487 PolarHBondContact O-N 2.97Å; T485-K497 HydrophobicContact CG2-CB 4.36Å; T485-F498 CarbonylContact C-O 3.57Å; T485-F498 VanDerWaalsContact CA-O 3.28Å; T485-F498 WeakPolarHBondContact CA-O 3.36Å
486	P	80.1	Confident	81.5	Confident	67 Å²	67	80.8 Å²	80.8	44%	0.435	45%	0.447	S	S	.	.			trans	-67.1	-26.3	-174.4	-20.6	34.3	0	0	0	113.8	E484	E484-P486 WeakPolarHBondContact O-CD 3.25Å
487	Y	82.3	Confident	81.7	Confident	63 Å²	63	85.4 Å²	85.4	25%	0.247	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	105.3	-174.5	-52.9	-77	0	0	0	109.9	T485 K497 F498 A499 S501	T485-Y487 VanDerWaalsContact C-N 3.27Å; T485-Y487 PolarHBondContact O-N 2.97Å; Y487-K497 CarbonylContact O-C 3.27Å; Y487-K497 WeakPolarHBondContact O-CA 3.36Å; Y487-F498 PolarHBondContact N-O 2.97Å; Y487-F498 PolarHBondContact O-N 3.05Å; Y487-A499 WeakPolarHBondContact CE2-O 3.45Å; Y487-S501 VanDerWaalsContact CE2-N 3.28Å
488	K	85.8	Confident	81.6	Confident	138 Å²	138	85.9 Å²	85.9	60%	0.6	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	148.2	173.3	-56	179.3	-173.8	173.8	0	109.7	K497	K488-K497 HydrophobicContact CG-CG 4.28Å
489	C	87.3	Confident	81.4	Confident	15 Å²	15	85 Å²	85	10%	0.101	46%	0.456	C	S	.	.			trans	-65.3	145	163.9	-166.1	0	0	0	0	109.7	C494 A496 L504 H507	C489-C494 HydrophobicContact CB-CB 4.33Å; C489-C494 WeakPolarHBondContact CB-O 3.45Å; C489-A496 HydrophobicContact CB-CB 4.44Å; C489-A496 PolarHBondContact N-O 3.35Å; C489-L504 HydrophobicContact CB-CD1 4.25Å; C489-H507 PolarHBondContact SG-NE2 3.16Å
490	T	81.9	Confident	81.2	Confident	125 Å²	125	83.9 Å²	83.9	77%	0.767	46%	0.455	S	S	*	.			trans	-105.7	3.6	179	53.9	0	0	0	0	112.5
491	Q	81	Confident	81.1	Confident	123 Å²	123	78.4 Å²	78.4	58%	0.575	44%	0.435	S	S	*	.	S	Bend	trans	-79.4	134.2	179.4	-163.3	65	18.6	0	0	110.2	N493 C494	Q491-N493 PolarHBondContact O-N 3.36Å; Q491-C494 HydrophobicContact CB-CB 4.43Å; Q491-C494 PolarHBondContact O-N 3.44Å
492	T	73.8	Confident	81.2	Confident	130 Å²	130	77.1 Å²	77.1	80%	0.798	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-21.3	-172.4	56.7	0	0	0	0	115.4
493	N	77.7	Confident	81.4	Confident	148 Å²	148	76.4 Å²	76.4	79%	0.791	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	24.5	-176.8	-61.1	28.1	0	0	0	111.9	Q491	Q491-N493 PolarHBondContact O-N 3.36Å
494	C	78.4	Confident	81.7	Confident	39 Å²	39	75 Å²	75	26%	0.264	41%	0.406	S	S	.	.			trans	-147.3	110.5	179.5	-160.7	0	0	0	0	115.2	C489 Q491 A496 H507	C489-C494 HydrophobicContact CB-CB 4.33Å; C489-C494 WeakPolarHBondContact CB-O 3.45Å; Q491-C494 HydrophobicContact CB-CB 4.43Å; Q491-C494 PolarHBondContact O-N 3.44Å; C494-A496 VanDerWaalsContact C-N 3.25Å; C494-A496 PolarHBondContact O-N 2.9Å; C494-A496 VanDerWaalsContact SG-CB 3.53Å; C494-H507 PolarHBondContact SG-CE1 3.2Å; C494-H507 PolarHBondContact SG-NE2 3.11Å
495	D	79.5	Confident	82	Confident	152 Å²	152	75 Å²	75	81%	0.813	41%	0.405	S	S	*	.			trans	-82.3	12.1	174.5	-65.5	-75.4	0	0	0	114.9	K497	D495-K497 WeakPolarHBondContact O-CG 3.38Å
496	A	84.1	Confident	82.2	Confident	30 Å²	30	79.3 Å²	79.3	25%	0.248	42%	0.418	C	S	.	.			trans	-63.3	139.6	-174	0	0	0	0	0	112.5	C489 C494 F498	C489-A496 HydrophobicContact CB-CB 4.44Å; C489-A496 PolarHBondContact N-O 3.35Å; C494-A496 VanDerWaalsContact C-N 3.25Å; C494-A496 PolarHBondContact O-N 2.9Å; C494-A496 VanDerWaalsContact SG-CB 3.53Å; A496-F498 HydrophobicContact CB-CE2 3.72Å; A496-F498 HydrophobicContact CB-CZ 3.61Å
497	K	85.5	Confident	82.5	Confident	124 Å²	124	79.7 Å²	79.7	54%	0.539	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	142	-177	-45	177.9	-171.7	156.9	0	109.9	T485 Y487 K488 D495	T485-K497 HydrophobicContact CG2-CB 4.36Å; Y487-K497 CarbonylContact O-C 3.27Å; Y487-K497 WeakPolarHBondContact O-CA 3.36Å; K488-K497 HydrophobicContact CG-CG 4.28Å; D495-K497 WeakPolarHBondContact O-CG 3.38Å
498	F	82.7	Confident	82.6	Confident	41 Å²	41	80.8 Å²	80.8	18%	0.18	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	146.7	-169.1	-55.1	-82.5	0	0	0	111.6	T485 Y487 A496 E503 L504 H507	T485-F498 CarbonylContact C-O 3.57Å; T485-F498 VanDerWaalsContact CA-O 3.28Å; T485-F498 WeakPolarHBondContact CA-O 3.36Å; Y487-F498 PolarHBondContact N-O 2.97Å; Y487-F498 PolarHBondContact O-N 3.05Å; A496-F498 HydrophobicContact CB-CE2 3.72Å; A496-F498 HydrophobicContact CB-CZ 3.61Å; F498-E503 HydrophobicContact CB-CB 3.97Å; F498-E503 HydrophobicContact CD1-CB 3.79Å; F498-E503 HydrophobicContact CG-CB 4.15Å; F498-L504 HydrophobicContact CB-CB 4.41Å; F498-L504 HydrophobicContact CD2-CB 3.83Å; F498-L504 HydrophobicContact CD2-CD1 3.77Å; F498-L504 HydrophobicContact CD2-CG 4.38Å; F498-L504 HydrophobicContact CE2-CB 4.5Å; F498-L504 HydrophobicContact CE2-CD1 3.78Å; F498-L504 HydrophobicContact CG-CB 4.26Å; F498-H507 HydrophobicContact CE1-CB 4.05Å; F498-H507 HydrophobicContact CE2-CB 4.03Å; F498-H507 AromaticContact CE2-CD2 3.54Å; F498-H507 AromaticContact CE2-CG 3.86Å; F498-H507 HydrophobicContact CZ-CB 3.47Å; F498-H507 VanDerWaalsContact CZ-CB 3.47Å; F498-H507 AromaticContact CZ-CD2 3.51Å; F498-H507 AromaticContact CZ-CG 3.36Å
499	A	80.1	Confident	82.5	Confident	14 Å²	14	85.8 Å²	85.8	12%	0.116	44%	0.439	C	S	.	.	S	Bend	trans	-76	-27	178.6	0	0	0	0	0	112.2	R479 Y487 E503	R479-A499 HydrophobicContact CB-CB 4.08Å; R479-A499 VanDerWaalsContact CD-O 3.28Å; R479-A499 WeakPolarHBondContact CD-O 3.46Å; R479-A499 PolarHBondContact NH1-O 3.12Å; Y487-A499 WeakPolarHBondContact CE2-O 3.45Å; A499-E503 PolarHBondContact N-OE2 2.95Å
500	T	80.4	Confident	82.2	Confident	25 Å²	25	89.3 Å²	89.3	15%	0.153	46%	0.456	C	S	.	.	S	Bend	trans	-128.1	150.3	-179.7	74.3	0	0	0	0	113.5	A476 S502 E503 L504	A476-T500 HydrophobicContact CB-CG2 3.67Å; T500-S502 PolarHBondContact O-N 3.4Å; T500-E503 WeakPolarHBondContact CB-OE2 3.44Å; T500-E503 WeakPolarHBondContact CG2-OE2 3.4Å; T500-E503 PolarHBondContact N-OE2 2.85Å; T500-E503 PolarHBondContact O-N 3.1Å; T500-E503 VanDerWaalsContact OG1-CG 3.28Å; T500-E503 WeakPolarHBondContact OG1-CG 3.45Å; T500-E503 PolarHBondContact OG1-N 3.24Å; T500-E503 PolarHBondContact OG1-OE2 2.89Å; T500-L504 PolarHBondContact O-N 3.26Å
501	S	81.2	Confident	82.3	Confident	32 Å²	32	87.4 Å²	87.4	22%	0.224	44%	0.439	C	S	.	.	H	α-helix	trans	-61.3	-30.4	172.1	-178.2	0	0	0	0	112	Y487 L504 K505	Y487-S501 VanDerWaalsContact CE2-N 3.28Å; S501-L504 PolarHBondContact O-N 2.89Å; S501-K505 WeakPolarHBondContact O-CB 3.42Å; S501-K505 VanDerWaalsContact O-CG 3.23Å; S501-K505 WeakPolarHBondContact O-CG 3.07Å; S501-K505 PolarHBondContact O-N 2.94Å; S501-K505 VanDerWaalsContact OG-CE 3.32Å; S501-K505 WeakPolarHBondContact OG-CE 3.37Å
502	S	83.4	Confident	82.3	Confident	59 Å²	59	85.4 Å²	85.4	41%	0.413	43%	0.432	S	S	.	.	H	α-helix	trans	-69.3	-30.3	177.9	-82	0	0	0	0	113.6	T500 K506	T500-S502 PolarHBondContact O-N 3.4Å; S502-K506 WeakPolarHBondContact O-CG 3.33Å; S502-K506 PolarHBondContact O-N 2.75Å
503	E	83.4	Confident	82.8	Confident	66 Å²	66	82.8 Å²	82.8	31%	0.308	41%	0.41	S	S	.	.	H	α-helix	trans	-73.1	-45.4	172.5	-70.9	150.1	159.6	0	0	110.6	F498 A499 T500 K505 K506 H507	F498-E503 HydrophobicContact CB-CB 3.97Å; F498-E503 HydrophobicContact CD1-CB 3.79Å; F498-E503 HydrophobicContact CG-CB 4.15Å; A499-E503 PolarHBondContact N-OE2 2.95Å; T500-E503 WeakPolarHBondContact CB-OE2 3.44Å; T500-E503 WeakPolarHBondContact CG2-OE2 3.4Å; T500-E503 PolarHBondContact N-OE2 2.85Å; T500-E503 PolarHBondContact O-N 3.1Å; T500-E503 VanDerWaalsContact OG1-CG 3.28Å; T500-E503 WeakPolarHBondContact OG1-CG 3.45Å; T500-E503 PolarHBondContact OG1-N 3.24Å; T500-E503 PolarHBondContact OG1-OE2 2.89Å; E503-K505 VanDerWaalsContact C-N 3.33Å; E503-K505 PolarHBondContact O-N 3.35Å; E503-K506 WeakPolarHBondContact O-CA 3.37Å; E503-K506 WeakPolarHBondContact O-CB 3.46Å; E503-K506 PolarHBondContact O-N 3.27Å; E503-H507 PolarHBondContact O-N 3.34Å; E503-H507 VanDerWaalsContact O-N 3.07Å
504	L	86.5	Confident	83.2	Confident	23 Å²	23	78.8 Å²	78.8	12%	0.12	39%	0.387	C	S	.	.	H	α-helix	trans	-57.9	-44.8	173	177.5	61.2	0	0	0	111.5	C489 F498 T500 S501 K506 H507 L508	C489-L504 HydrophobicContact CB-CD1 4.25Å; F498-L504 HydrophobicContact CB-CB 4.41Å; F498-L504 HydrophobicContact CD2-CB 3.83Å; F498-L504 HydrophobicContact CD2-CD1 3.77Å; F498-L504 HydrophobicContact CD2-CG 4.38Å; F498-L504 HydrophobicContact CE2-CB 4.5Å; F498-L504 HydrophobicContact CE2-CD1 3.78Å; F498-L504 HydrophobicContact CG-CB 4.26Å; T500-L504 PolarHBondContact O-N 3.26Å; S501-L504 PolarHBondContact O-N 2.89Å; L504-K506 PolarHBondContact O-N 3.26Å; L504-K506 VanDerWaalsContact O-N 3.14Å; L504-H507 PolarHBondContact O-N 2.79Å; L504-L508 HydrophobicContact CD1-CD1 3.81Å; L504-L508 HydrophobicContact CD1-CD2 4.34Å; L504-L508 HydrophobicContact CD1-CG 3.81Å; L504-L508 HydrophobicContact CD2-CD1 4.34Å; L504-L508 HydrophobicContact CG-CD1 3.77Å; L504-L508 HydrophobicContact CG-CG 4.2Å; L504-L508 WeakPolarHBondContact O-CG 3.43Å; L504-L508 PolarHBondContact O-N 3.15Å
505	K	85.5	Confident	83.5	Confident	103 Å²	103	81.4 Å²	81.4	45%	0.448	40%	0.395	S	S	.	.	H	α-helix	trans	-66.5	-6.8	173.9	-72	169.5	-178.6	169.4	0	114.4	S501 E503 R509	S501-K505 WeakPolarHBondContact O-CB 3.42Å; S501-K505 VanDerWaalsContact O-CG 3.23Å; S501-K505 WeakPolarHBondContact O-CG 3.07Å; S501-K505 PolarHBondContact O-N 2.94Å; S501-K505 VanDerWaalsContact OG-CE 3.32Å; S501-K505 WeakPolarHBondContact OG-CE 3.37Å; E503-K505 VanDerWaalsContact C-N 3.33Å; E503-K505 PolarHBondContact O-N 3.35Å; K505-R509 VanDerWaalsContact O-CZ 3.29Å; K505-R509 PolarHBondContact O-NE 2.89Å; K505-R509 PolarHBondContact O-NH2 2.92Å
506	K	86.4	Confident	83.8	Confident	149 Å²	149	76.4 Å²	76.4	65%	0.648	37%	0.365	S	S	*	.	H	α-helix	trans	-99.9	-19.5	169.2	-76.3	174.4	179.2	-176	0	112.7	S502 E503 L504	S502-K506 WeakPolarHBondContact O-CG 3.33Å; S502-K506 PolarHBondContact O-N 2.75Å; E503-K506 WeakPolarHBondContact O-CA 3.37Å; E503-K506 WeakPolarHBondContact O-CB 3.46Å; E503-K506 PolarHBondContact O-N 3.27Å; L504-K506 PolarHBondContact O-N 3.26Å; L504-K506 VanDerWaalsContact O-N 3.14Å
507	H	86.4	Confident	83.7	Confident	74 Å²	74	79.9 Å²	79.9	34%	0.343	37%	0.374	S	S	.	.	H	α-helix	trans	-89.3	-28.9	175.5	168.1	67.4	0	0	0	112.6	C489 C494 F498 E503 L504 R509	C489-H507 PolarHBondContact SG-NE2 3.16Å; C494-H507 PolarHBondContact SG-CE1 3.2Å; C494-H507 PolarHBondContact SG-NE2 3.11Å; F498-H507 HydrophobicContact CE1-CB 4.05Å; F498-H507 HydrophobicContact CE2-CB 4.03Å; F498-H507 AromaticContact CE2-CD2 3.54Å; F498-H507 AromaticContact CE2-CG 3.86Å; F498-H507 HydrophobicContact CZ-CB 3.47Å; F498-H507 VanDerWaalsContact CZ-CB 3.47Å; F498-H507 AromaticContact CZ-CD2 3.51Å; F498-H507 AromaticContact CZ-CG 3.36Å; E503-H507 PolarHBondContact O-N 3.34Å; E503-H507 VanDerWaalsContact O-N 3.07Å; L504-H507 PolarHBondContact O-N 2.79Å; H507-R509 PolarHBondContact O-N 2.89Å
508	L	83.3	Confident	83.6	Confident	87 Å²	87	76.3 Å²	76.3	46%	0.455	36%	0.36	S	S	.	.			trans	-82.7	19.9	171.5	-62.5	175.2	0	0	0	113.3	L504	L504-L508 HydrophobicContact CD1-CD1 3.81Å; L504-L508 HydrophobicContact CD1-CD2 4.34Å; L504-L508 HydrophobicContact CD1-CG 3.81Å; L504-L508 HydrophobicContact CD2-CD1 4.34Å; L504-L508 HydrophobicContact CG-CD1 3.77Å; L504-L508 HydrophobicContact CG-CG 4.2Å; L504-L508 WeakPolarHBondContact O-CG 3.43Å; L504-L508 PolarHBondContact O-N 3.15Å
509	R	83.8	Confident	83.7	Confident	242 Å²	242	79.5 Å²	79.5	91%	0.913	38%	0.376	S	S	*	.			trans	-136.9	0	178.5	-88.2	-170.1	-69	170.9	-3.3	109.9	K505 H507	K505-R509 VanDerWaalsContact O-CZ 3.29Å; K505-R509 PolarHBondContact O-NE 2.89Å; K505-R509 PolarHBondContact O-NH2 2.92Å; H507-R509 PolarHBondContact O-N 2.89Å

Retrieved 509 of 509 residues in 246.2 ms (Link to these results)

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