A0A093JLR5_STRCA Loading...

Transcriptional regulator Kaiso

AlphaFold DB , UniProt , Accession A0A093JLR5, Species STRCA (Struthio camelus australis), Gene n/a, Length 680 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.6	Very low	79.6	Confident	233 Å²	233	156.2 Å²	156.2	100%	1.148	83%	0.826	S	S	*	*				0	152.4	0	-65.4	175.2	-176.3	0	0	106.2
2	E	58.1	Low	80.7	Confident	177 Å²	177	153.2 Å²	153.2	83%	0.827	82%	0.819	S	S	*	*			trans	-81.7	124.1	178.5	-64	169.5	143	0	0	109.7	K4	E2-K4 PolarHBondContact O-N 3.41Å
3	D	68.6	Low	81.7	Confident	153 Å²	153	151.7 Å²	151.7	82%	0.818	80%	0.804	S	S	*	*			trans	-74.1	93.5	-177.2	-67	-50	0	0	0	111.1	K5	D3-K5 PolarHBondContact O-N 3.49Å
4	K	78.2	Confident	82.5	Confident	185 Å²	185	151.4 Å²	151.4	80%	0.804	79%	0.788	S	S	*	*			trans	-67.7	100.5	179.8	-66.5	-175.3	179.8	-177.4	0	110.4	E2 L6	E2-K4 PolarHBondContact O-N 3.41Å; K4-L6 PolarHBondContact O-N 3.48Å
5	K	79.4	Confident	83.1	Confident	200 Å²	200	146.7 Å²	146.7	87%	0.87	77%	0.773	S	S	*	*			trans	-56.2	120.8	175.8	-63.1	-176.9	-179.8	-178.5	0	110.6	D3	D3-K5 PolarHBondContact O-N 3.49Å
6	L	85.4	Confident	83.5	Confident	174 Å²	174	142.1 Å²	142.1	91%	0.911	76%	0.757	S	S	*	*			trans	-83	132.5	170.3	-71.8	168.2	0	0	0	109.3	K4	K4-L6 PolarHBondContact O-N 3.48Å
7	I	87.5	Confident	84.1	Confident	161 Å²	161	138.6 Å²	138.6	83%	0.826	74%	0.741	S	S	*	*			trans	-108.6	123.7	173.5	-58.2	176	0	0	0	107.6
8	S	90.8	Very high	84.7	Confident	112 Å²	112	134.9 Å²	134.9	78%	0.783	72%	0.721	S	S	*	*			trans	-107.9	139.3	167.4	-171.8	0	0	0	0	108.8
9	A	91.3	Very high	85.2	Confident	95 Å²	95	129.4 Å²	129.4	79%	0.785	69%	0.691	S	S	*	*			trans	-138.1	140.8	175.7	0	0	0	0	0	108.9
10	T	93.5	Very high	85.6	Confident	122 Å²	122	128.8 Å²	128.8	75%	0.748	68%	0.684	S	S	*	*			trans	-129	116.8	179.6	-58.8	0	0	0	0	108.6	T12	T10-T12 PolarHBondContact O-N 3.46Å
11	D	94.6	Very high	86.1	Confident	106 Å²	106	124.8 Å²	124.8	57%	0.567	67%	0.667	S	S	*	*			trans	-80.8	114.6	173.4	-175.8	-17.7	0	0	0	109.2	Q13 Y14	D11-Q13 WeakPolarHBondContact OD1-CA 3.41Å; D11-Q13 PolarHBondContact OD1-N 3Å; D11-Y14 PolarHBondContact OD1-N 2.97Å
12	T	92.8	Very high	88.3	Confident	120 Å²	120	114.8 Å²	114.8	74%	0.736	62%	0.618	S	S	*	*	S	Bend	trans	-83.5	-11.2	179.6	54.1	0	0	0	0	113.4	T10	T10-T12 PolarHBondContact O-N 3.46Å
13	Q	93.4	Very high	90	Very high	134 Å²	134	108.9 Å²	108.9	63%	0.626	59%	0.592	S	S	*	*	S	Bend	trans	-98.4	-27.9	178.7	-57	-173.2	8.8	0	0	112.1	D11 S15 S16 V17	D11-Q13 WeakPolarHBondContact OD1-CA 3.41Å; D11-Q13 PolarHBondContact OD1-N 3Å; Q13-S15 PolarHBondContact O-N 3.25Å; Q13-S15 VanDerWaalsContact O-N 3.09Å; Q13-S16 PolarHBondContact O-N 3.15Å; Q13-S16 VanDerWaalsContact O-N 3.08Å; Q13-S16 PolarHBondContact O-OG 3.28Å; Q13-V17 PolarHBondContact O-N 3.17Å
14	Y	93.5	Very high	91.2	Very high	148 Å²	148	106.1 Å²	106.1	58%	0.58	57%	0.574	S	S	*	*	H	α-helix	trans	-46.2	-44.2	-178.3	179	-102.6	0	0	0	114	D11 L18	D11-Y14 PolarHBondContact OD1-N 2.97Å; Y14-L18 HydrophobicContact CE1-CD2 3.86Å; Y14-L18 WeakPolarHBondContact O-CB 3.46Å; Y14-L18 PolarHBondContact O-N 3.29Å
15	S	91.3	Very high	92	Very high	80 Å²	80	100 Å²	100	56%	0.559	55%	0.548	S	S	*	.	H	α-helix	trans	-66.4	-37.4	-176.7	56.6	0	0	0	0	113.6	Q13 L19	Q13-S15 PolarHBondContact O-N 3.25Å; Q13-S15 VanDerWaalsContact O-N 3.09Å; S15-L19 WeakPolarHBondContact O-CB 3.44Å; S15-L19 PolarHBondContact O-N 3.41Å; S15-L19 VanDerWaalsContact O-N 3.1Å
16	S	88.9	Confident	92.6	Very high	74 Å²	74	92.4 Å²	92.4	52%	0.517	51%	0.514	S	S	.	.	H	α-helix	trans	-76.6	-40.7	179.2	64.1	0	0	0	0	111.6	Q13 L19 Q20	Q13-S16 PolarHBondContact O-N 3.15Å; Q13-S16 VanDerWaalsContact O-N 3.08Å; Q13-S16 PolarHBondContact O-OG 3.28Å; S16-L19 PolarHBondContact O-N 3.49Å; S16-Q20 PolarHBondContact O-N 2.79Å
17	V	93.9	Very high	92.9	Very high	82 Å²	82	87.4 Å²	87.4	50%	0.497	51%	0.505	S	S	.	.	H	α-helix	trans	-63.9	-41.1	175	178.9	0	0	0	0	111.1	Q13 S21	Q13-V17 PolarHBondContact O-N 3.17Å; V17-S21 WeakPolarHBondContact O-CB 3.4Å; V17-S21 PolarHBondContact O-N 3.22Å; V17-S21 PolarHBondContact O-OG 3.42Å
18	L	94.4	Very high	93	Very high	72 Å²	72	88.8 Å²	88.8	38%	0.377	50%	0.5	S	S	.	.	H	α-helix	trans	-61.7	-45.5	173.5	176.2	61	0	0	0	111.5	Y14 S21 L22	Y14-L18 HydrophobicContact CE1-CD2 3.86Å; Y14-L18 WeakPolarHBondContact O-CB 3.46Å; Y14-L18 PolarHBondContact O-N 3.29Å; L18-S21 WeakPolarHBondContact O-CB 3.44Å; L18-S21 PolarHBondContact O-N 2.91Å; L18-L22 HydrophobicContact CD1-CD1 4.19Å; L18-L22 HydrophobicContact CD1-CG 4.35Å; L18-L22 HydrophobicContact CG-CD1 4.06Å; L18-L22 WeakPolarHBondContact O-CG 3.32Å; L18-L22 PolarHBondContact O-N 3.3Å
19	L	93.9	Very high	93	Very high	30 Å²	30	84.3 Å²	84.3	16%	0.157	47%	0.472	C	S	.	.	H	α-helix	trans	-68.3	-39.1	-178.1	-163.7	65.1	0	0	0	112.2	S15 S16 L22 N23 S88	S15-L19 WeakPolarHBondContact O-CB 3.44Å; S15-L19 PolarHBondContact O-N 3.41Å; S15-L19 VanDerWaalsContact O-N 3.1Å; S16-L19 PolarHBondContact O-N 3.49Å; L19-L22 HydrophobicContact CD1-CD1 4.47Å; L19-L22 PolarHBondContact O-N 2.9Å; L19-N23 PolarHBondContact O-N 3.05Å; L19-S88 VanDerWaalsContact CD2-OG 3.27Å; L19-S88 WeakPolarHBondContact CD2-OG 3.5Å
20	Q	93.7	Very high	93	Very high	117 Å²	117	83.9 Å²	83.9	55%	0.547	46%	0.455	S	S	.	.	H	α-helix	trans	-59	-47.1	169.4	-179.5	-179.1	-29.2	0	0	111.2	S16 L22 N23 E24	S16-Q20 PolarHBondContact O-N 2.79Å; Q20-L22 VanDerWaalsContact C-N 3.29Å; Q20-L22 PolarHBondContact O-N 3.19Å; Q20-N23 WeakPolarHBondContact O-CA 3.31Å; Q20-N23 VanDerWaalsContact O-CB 3.3Å; Q20-N23 WeakPolarHBondContact O-CB 3.24Å; Q20-N23 PolarHBondContact O-N 3.32Å; Q20-E24 PolarHBondContact NE2-OE1 2.96Å; Q20-E24 PolarHBondContact O-N 3.44Å
21	S	95.3	Very high	92.9	Very high	46 Å²	46	85.7 Å²	85.7	32%	0.322	45%	0.453	S	S	.	.	H	α-helix	trans	-59.7	-39.3	178.8	-58.7	0	0	0	0	112.2	V17 L18 N23 E24 Q25	V17-S21 WeakPolarHBondContact O-CB 3.4Å; V17-S21 PolarHBondContact O-N 3.22Å; V17-S21 PolarHBondContact O-OG 3.42Å; L18-S21 WeakPolarHBondContact O-CB 3.44Å; L18-S21 PolarHBondContact O-N 2.91Å; S21-N23 VanDerWaalsContact C-N 3.34Å; S21-E24 PolarHBondContact O-N 3.35Å; S21-Q25 VanDerWaalsContact O-CG 3.28Å; S21-Q25 WeakPolarHBondContact O-CG 3.38Å; S21-Q25 PolarHBondContact O-N 3.41Å
22	L	95.1	Very high	92.9	Very high	23 Å²	23	82 Å²	82	12%	0.12	44%	0.435	C	S	.	.	H	α-helix	trans	-67.1	-32.9	174.5	-72.6	164.6	0	0	0	112.5	L18 L19 Q20 R26 I49 Y86	L18-L22 HydrophobicContact CD1-CD1 4.19Å; L18-L22 HydrophobicContact CD1-CG 4.35Å; L18-L22 HydrophobicContact CG-CD1 4.06Å; L18-L22 WeakPolarHBondContact O-CG 3.32Å; L18-L22 PolarHBondContact O-N 3.3Å; L19-L22 HydrophobicContact CD1-CD1 4.47Å; L19-L22 PolarHBondContact O-N 2.9Å; Q20-L22 VanDerWaalsContact C-N 3.29Å; Q20-L22 PolarHBondContact O-N 3.19Å; L22-R26 WeakPolarHBondContact O-CB 2.97Å; L22-R26 PolarHBondContact O-N 3.49Å; L22-I49 HydrophobicContact CD1-CD1 3.72Å; L22-I49 HydrophobicContact CD1-CG1 4.28Å; L22-I49 HydrophobicContact CD2-CD1 4.49Å; L22-I49 HydrophobicContact CD2-CG1 4.48Å; L22-Y86 HydrophobicContact CB-CD1 4.2Å; L22-Y86 HydrophobicContact CB-CE1 4.23Å
23	N	93.6	Very high	92.8	Very high	52 Å²	52	80.1 Å²	80.1	28%	0.278	42%	0.421	S	S	.	.	H	α-helix	trans	-68.6	-40.8	174	-169.2	16.7	0	0	0	111.9	L19 Q20 S21 R26 G27 Y86	L19-N23 PolarHBondContact O-N 3.05Å; Q20-N23 WeakPolarHBondContact O-CA 3.31Å; Q20-N23 VanDerWaalsContact O-CB 3.3Å; Q20-N23 WeakPolarHBondContact O-CB 3.24Å; Q20-N23 PolarHBondContact O-N 3.32Å; S21-N23 VanDerWaalsContact C-N 3.34Å; N23-R26 WeakPolarHBondContact O-CB 3.38Å; N23-R26 PolarHBondContact O-N 3.45Å; N23-R26 VanDerWaalsContact OD1-CZ 3.24Å; N23-R26 PolarHBondContact OD1-NE 3.36Å; N23-R26 PolarHBondContact OD1-NH2 2.96Å; N23-G27 PolarHBondContact O-N 3.06Å; N23-Y86 HydrophobicContact CB-CD1 4.47Å; N23-Y86 WeakPolarHBondContact CB-O 3.35Å
24	E	94.5	Very high	92.9	Very high	96 Å²	96	73.8 Å²	73.8	45%	0.449	39%	0.391	S	S	.	.	H	α-helix	trans	-66.8	-38.5	174.8	-68	178.8	-148.6	0	0	111.9	Q20 S21 G27 R28	Q20-E24 PolarHBondContact NE2-OE1 2.96Å; Q20-E24 PolarHBondContact O-N 3.44Å; S21-E24 PolarHBondContact O-N 3.35Å; E24-G27 PolarHBondContact O-N 3.09Å; E24-R28 WeakPolarHBondContact O-CG 3.44Å; E24-R28 PolarHBondContact O-N 3.18Å; E24-R28 VanDerWaalsContact O-N 3.11Å
25	Q	94.4	Very high	92.9	Very high	56 Å²	56	68.4 Å²	68.4	26%	0.262	37%	0.374	S	S	.	.	H	α-helix	trans	-62.4	-46.3	171.4	-72	169.2	23.2	0	0	111.7	S21 G27 R28 G29 L30 F31	S21-Q25 VanDerWaalsContact O-CG 3.28Å; S21-Q25 WeakPolarHBondContact O-CG 3.38Å; S21-Q25 PolarHBondContact O-N 3.41Å; Q25-G27 PolarHBondContact O-N 3.08Å; Q25-R28 CarbonylContact O-C 3.58Å; Q25-R28 PolarHBondContact O-N 3.18Å; Q25-R28 VanDerWaalsContact O-N 3.17Å; Q25-G29 PolarHBondContact O-N 2.92Å; Q25-L30 HydrophobicContact CB-CB 4.23Å; Q25-L30 HydrophobicContact CG-CB 4.43Å; Q25-L30 PolarHBondContact O-N 3.31Å; Q25-F31 HydrophobicContact CG-CD2 4.39Å
26	R	93.7	Very high	93.1	Very high	40 Å²	40	64.6 Å²	64.6	15%	0.151	35%	0.347	C	S	.	.	H	α-helix	trans	-53.9	-49.3	173.2	177.6	-173.3	72.7	140.2	5.2	111.4	L22 N23 R28 G29 L82 N83 Y86	L22-R26 WeakPolarHBondContact O-CB 2.97Å; L22-R26 PolarHBondContact O-N 3.49Å; N23-R26 WeakPolarHBondContact O-CB 3.38Å; N23-R26 PolarHBondContact O-N 3.45Å; N23-R26 VanDerWaalsContact OD1-CZ 3.24Å; N23-R26 PolarHBondContact OD1-NE 3.36Å; N23-R26 PolarHBondContact OD1-NH2 2.96Å; R26-R28 VanDerWaalsContact C-N 3.29Å; R26-R28 PolarHBondContact O-N 3.17Å; R26-G29 PolarHBondContact O-N 2.88Å; R26-L82 PolarHBondContact NH1-O 2.98Å; R26-N83 PolarHBondContact NH1-OD1 3.48Å; R26-N83 PolarHBondContact NH2-OD1 2.78Å; R26-Y86 HydrophobicContact CB-CD1 4.13Å; R26-Y86 HydrophobicContact CB-CE1 3.96Å; R26-Y86 HydrophobicContact CG-CE1 4.37Å
27	G	89.8	Confident	93.3	Very high	70 Å²	70	62.8 Å²	62.8	72%	0.722	33%	0.332	S	S	*	.	H	α-helix	trans	-62.3	-32.1	179.2	0	0	0	0	0	114	N23 E24 Q25	N23-G27 PolarHBondContact O-N 3.06Å; E24-G27 PolarHBondContact O-N 3.09Å; Q25-G27 PolarHBondContact O-N 3.08Å
28	R	91.3	Very high	93.4	Very high	190 Å²	190	58.9 Å²	58.9	72%	0.717	31%	0.308	S	S	*	.	H	α-helix	trans	-87.4	-3.7	173.9	-63.9	176.7	-170.2	-110.3	4.3	113.6	E24 Q25 R26 L30	E24-R28 WeakPolarHBondContact O-CG 3.44Å; E24-R28 PolarHBondContact O-N 3.18Å; E24-R28 VanDerWaalsContact O-N 3.11Å; Q25-R28 CarbonylContact O-C 3.58Å; Q25-R28 PolarHBondContact O-N 3.18Å; Q25-R28 VanDerWaalsContact O-N 3.17Å; R26-R28 VanDerWaalsContact C-N 3.29Å; R26-R28 PolarHBondContact O-N 3.17Å; R28-L30 HydrophobicContact CB-CD1 3.97Å; R28-L30 HydrophobicContact CB-CG 3.84Å; R28-L30 PolarHBondContact O-N 3.44Å
29	G	89.5	Confident	93.2	Very high	18 Å²	18	61 Å²	61	19%	0.186	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	18.6	-173.4	0	0	0	0	0	114.5	Q25 R26	Q25-G29 PolarHBondContact O-N 2.92Å; R26-G29 PolarHBondContact O-N 2.88Å
30	L	90.9	Very high	93	Very high	85 Å²	85	66 Å²	66	45%	0.445	34%	0.343	S	S	.	.			trans	-74.4	141.9	176.7	-64.3	173.1	0	0	0	109.6	Q25 R28 C32 H46	Q25-L30 HydrophobicContact CB-CB 4.23Å; Q25-L30 HydrophobicContact CG-CB 4.43Å; Q25-L30 PolarHBondContact O-N 3.31Å; R28-L30 HydrophobicContact CB-CD1 3.97Å; R28-L30 HydrophobicContact CB-CG 3.84Å; R28-L30 PolarHBondContact O-N 3.44Å; L30-C32 PolarHBondContact O-N 2.98Å; L30-C32 PolarHBondContact O-SG 3.35Å; L30-C32 VanDerWaalsContact O-SG 3.33Å; L30-H46 PolarHBondContact O-NE2 2.63Å; L30-H46 VanDerWaalsContact O-NE2 3.15Å
31	F	92.1	Very high	93	Very high	161 Å²	161	65.4 Å²	65.4	71%	0.706	34%	0.335	S	S	*	.	S	Bend	trans	53.2	6	179.3	-50.6	-68.3	0	0	0	116.9	Q25 D33 H46	Q25-F31 HydrophobicContact CG-CD2 4.39Å; F31-D33 PolarHBondContact O-N 3.36Å; F31-D33 VanDerWaalsContact O-N 3.12Å; F31-H46 PolarHBondContact O-CD2 2.83Å; F31-H46 VanDerWaalsContact O-CD2 3.3Å
32	C	93.9	Very high	92.9	Very high	28 Å²	28	70.6 Å²	70.6	19%	0.189	35%	0.352	C	S	.	.			trans	-73.1	102.1	177.9	-66.5	0	0	0	0	110.6	L30 R44 A45	L30-C32 PolarHBondContact O-N 2.98Å; L30-C32 PolarHBondContact O-SG 3.35Å; L30-C32 VanDerWaalsContact O-SG 3.33Å; C32-R44 HydrophobicContact CB-CB 3.86Å; C32-A45 CarbonylContact C-O 3.51Å; C32-A45 VanDerWaalsContact CA-O 3.25Å; C32-A45 WeakPolarHBondContact CA-O 3.49Å; C32-A45 WeakPolarHBondContact CB-O 3.42Å
33	D	92.5	Very high	92.9	Very high	80 Å²	80	70.7 Å²	70.7	43%	0.428	35%	0.352	S	S	.	.			trans	-90	-2.2	-179.2	65.6	-36.8	0	0	0	113.8	F31 A45 H46 R47	F31-D33 PolarHBondContact O-N 3.36Å; F31-D33 VanDerWaalsContact O-N 3.12Å; D33-A45 PolarHBondContact N-O 2.98Å; D33-H46 WeakPolarHBondContact OD1-CA 3.5Å; D33-R47 VanDerWaalsContact CG-CB 3.49Å; D33-R47 VanDerWaalsContact OD1-CB 3.25Å; D33-R47 WeakPolarHBondContact OD1-CB 3.34Å; D33-R47 PolarHBondContact OD1-N 3.39Å; D33-R47 WeakPolarHBondContact OD2-CB 3.41Å
34	V	94.1	Very high	93	Very high	1 Å²	1	75.5 Å²	75.5	1%	0.006	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	142	172.1	59.3	0	0	0	0	112.8	V36 A45 R47 L50 F61 Q66 V68	V34-V36 HydrophobicContact CG2-CG2 4.32Å; V34-A45 HydrophobicContact CG1-CB 4.34Å; V34-A45 VanDerWaalsContact CG1-O 3.3Å; V34-A45 WeakPolarHBondContact CG1-O 3.47Å; V34-A45 PolarHBondContact N-O 3.26Å; V34-A45 PolarHBondContact O-N 2.78Å; V34-A45 VanDerWaalsContact O-O 3.1Å; V34-R47 HydrophobicContact CG1-CB 4.08Å; V34-L50 HydrophobicContact CG1-CD1 4.05Å; V34-F61 HydrophobicContact CB-CE1 4.39Å; V34-F61 HydrophobicContact CB-CZ 4.27Å; V34-F61 HydrophobicContact CG1-CZ 4Å; V34-F61 HydrophobicContact CG2-CE1 3.79Å; V34-F61 HydrophobicContact CG2-CZ 3.79Å; V34-Q66 WeakPolarHBondContact CA-O 3.38Å; V34-V68 HydrophobicContact CG2-CG2 4.26Å
35	T	94.4	Very high	93	Very high	35 Å²	35	71 Å²	71	22%	0.215	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	119.7	164.4	-59.7	0	0	0	0	109.7	K42 F43 Q66 V67 V68	T35-K42 HydrophobicContact CG2-CB 4.08Å; T35-F43 CarbonylContact C-O 3.48Å; T35-F43 WeakPolarHBondContact CA-O 3.48Å; T35-Q66 PolarHBondContact N-O 3.44Å; T35-V67 WeakPolarHBondContact O-CA 3.48Å; T35-V68 PolarHBondContact O-N 3.13Å
36	V	94.6	Very high	93.1	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	119.8	170.8	-171	0	0	0	0	108.5	V34 V38 F43 L50 F57 V68 L70 F78	V34-V36 HydrophobicContact CG2-CG2 4.32Å; V36-V38 HydrophobicContact CG1-CG2 3.88Å; V36-F43 PolarHBondContact N-O 3.29Å; V36-F43 PolarHBondContact O-N 3.31Å; V36-L50 HydrophobicContact CG2-CD1 4.09Å; V36-F57 HydrophobicContact CG1-CZ 4.37Å; V36-F57 HydrophobicContact CG2-CE1 4.07Å; V36-F57 HydrophobicContact CG2-CZ 4.15Å; V36-V68 CarbonylContact C-O 3.48Å; V36-V68 HydrophobicContact CG1-CB 4.45Å; V36-V68 HydrophobicContact CG1-CG1 4.19Å; V36-V68 HydrophobicContact CG2-CB 4.45Å; V36-L70 HydrophobicContact CG1-CD1 3.81Å; V36-L70 HydrophobicContact CG1-CG 3.78Å; V36-F78 HydrophobicContact CB-CE1 3.88Å; V36-F78 HydrophobicContact CB-CZ 4Å; V36-F78 HydrophobicContact CG1-CE1 3.72Å; V36-F78 HydrophobicContact CG1-CZ 3.68Å; V36-F78 HydrophobicContact CG2-CE1 4.5Å; V36-F78 HydrophobicContact CG2-CZ 4.2Å
37	I	93.8	Very high	93	Very high	37 Å²	37	70.4 Å²	70.4	19%	0.19	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	129.9	171.6	-52.9	-176.7	0	0	0	107.3	R41 K42 V67 V68 E69 L70	I37-R41 WeakPolarHBondContact CA-O 3.39Å; I37-K42 HydrophobicContact CG1-CG 4.27Å; I37-V67 HydrophobicContact CD1-CG1 3.61Å; I37-V67 HydrophobicContact CG1-CG1 3.94Å; I37-V68 PolarHBondContact N-O 3.45Å; I37-E69 CarbonylContact O-C 3.58Å; I37-E69 WeakPolarHBondContact O-CA 3.4Å; I37-L70 PolarHBondContact O-N 2.9Å
38	V	94.8	Very high	93.2	Very high	0 Å²	0	72 Å²	72	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	118.1	175.1	-169.9	0	0	0	0	107	V36 D40 R41 F43 L70 V73 A75 F78	V36-V38 HydrophobicContact CG1-CG2 3.88Å; V38-D40 PolarHBondContact O-N 3.38Å; V38-R41 PolarHBondContact N-O 3.05Å; V38-R41 PolarHBondContact O-N 3.39Å; V38-F43 HydrophobicContact CB-CD2 4.45Å; V38-F43 HydrophobicContact CB-CE2 4.09Å; V38-F43 HydrophobicContact CG2-CD2 4.16Å; V38-F43 HydrophobicContact CG2-CE2 4.22Å; V38-L70 HydrophobicContact CG1-CB 4.49Å; V38-L70 HydrophobicContact CG2-CB 4.06Å; V38-L70 HydrophobicContact CG2-CD1 4.02Å; V38-L70 HydrophobicContact CG2-CG 4.24Å; V38-V73 WeakPolarHBondContact CG1-O 3.18Å; V38-A75 HydrophobicContact CB-CB 4.19Å; V38-A75 HydrophobicContact CG1-CB 4.11Å; V38-A75 WeakPolarHBondContact O-CB 3.38Å; V38-F78 HydrophobicContact CB-CD1 4.38Å; V38-F78 HydrophobicContact CG1-CB 4.25Å; V38-F78 HydrophobicContact CG2-CB 4.18Å; V38-F78 HydrophobicContact CG2-CD1 3.39Å; V38-F78 HydrophobicContact CG2-CE1 3.82Å; V38-F78 HydrophobicContact CG2-CG 3.77Å
39	E	91.3	Very high	93.4	Very high	117 Å²	117	64.3 Å²	64.3	55%	0.547	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	-120.5	-171.4	-58.2	174.4	130.9	0	0	111.3	R74 A75	E39-R74 WeakPolarHBondContact OE2-CA 3.49Å; E39-A75 HydrophobicContact CB-CB 4.38Å; E39-A75 WeakPolarHBondContact OE2-CB 3.41Å; E39-A75 PolarHBondContact OE2-N 3.05Å
40	D	90.6	Very high	93.6	Very high	135 Å²	135	63.4 Å²	63.4	72%	0.722	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-11.1	177.2	68.3	-47.2	0	0	0	113.8	V38	V38-D40 PolarHBondContact O-N 3.38Å
41	R	92.6	Very high	93.8	Very high	103 Å²	103	60.9 Å²	60.9	39%	0.389	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	148.5	-167.9	-70.4	172.2	68.2	-150.5	0.3	112.9	I37 V38 F43 A75	I37-R41 WeakPolarHBondContact CA-O 3.39Å; V38-R41 PolarHBondContact N-O 3.05Å; V38-R41 PolarHBondContact O-N 3.39Å; R41-F43 HydrophobicContact CB-CE2 3.68Å; R41-F43 HydrophobicContact CB-CZ 4.02Å; R41-A75 HydrophobicContact CB-CB 4.03Å; R41-A75 HydrophobicContact CG-CB 4.33Å; R41-A75 PolarHBondContact NH1-O 2.94Å
42	K	94.1	Very high	93.9	Very high	155 Å²	155	57.3 Å²	57.3	67%	0.674	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.6	121.9	-178.2	-58.5	-173	-179.3	177.9	0	110.4	T35 I37	T35-K42 HydrophobicContact CG2-CB 4.08Å; I37-K42 HydrophobicContact CG1-CG 4.27Å
43	F	94.7	Very high	93.9	Very high	25 Å²	25	58.1 Å²	58.1	11%	0.11	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	115.1	-176.7	-60.5	-92.6	0	0	0	109.8	T35 V36 V38 R41 A75 F78 A79 L82	T35-F43 CarbonylContact C-O 3.48Å; T35-F43 WeakPolarHBondContact CA-O 3.48Å; V36-F43 PolarHBondContact N-O 3.29Å; V36-F43 PolarHBondContact O-N 3.31Å; V38-F43 HydrophobicContact CB-CD2 4.45Å; V38-F43 HydrophobicContact CB-CE2 4.09Å; V38-F43 HydrophobicContact CG2-CD2 4.16Å; V38-F43 HydrophobicContact CG2-CE2 4.22Å; R41-F43 HydrophobicContact CB-CE2 3.68Å; R41-F43 HydrophobicContact CB-CZ 4.02Å; F43-A75 HydrophobicContact CE2-CB 4.19Å; F43-A75 HydrophobicContact CZ-CB 4.28Å; F43-A75 WeakPolarHBondContact CZ-O 3.43Å; F43-F78 HydrophobicContact CB-CE1 4.04Å; F43-F78 HydrophobicContact CD1-CD1 4.42Å; F43-F78 AromaticContact CD2-CD1 3.68Å; F43-F78 HydrophobicContact CD2-CD1 3.68Å; F43-F78 AromaticContact CD2-CE1 3.94Å; F43-F78 HydrophobicContact CD2-CE1 3.94Å; F43-F78 AromaticContact CE2-CD1 3.9Å; F43-F78 HydrophobicContact CE2-CD1 3.9Å; F43-F78 AromaticContact CG-CD1 3.96Å; F43-F78 HydrophobicContact CG-CD1 3.96Å; F43-F78 AromaticContact CG-CE1 3.97Å; F43-F78 HydrophobicContact CG-CE1 3.97Å; F43-F78 HydrophobicContact CZ-CD1 4.35Å; F43-A79 HydrophobicContact CE1-CB 3.84Å; F43-A79 HydrophobicContact CZ-CB 4.22Å; F43-L82 HydrophobicContact CB-CD1 3.59Å; F43-L82 HydrophobicContact CD1-CD1 3.55Å; F43-L82 HydrophobicContact CE1-CD1 4.41Å; F43-L82 HydrophobicContact CG-CD1 3.72Å
44	R	94.7	Very high	94	Very high	154 Å²	154	54.5 Å²	54.5	58%	0.581	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	136.4	170.4	-68.5	-172.8	179.8	-166.8	1.9	109.6	C32	C32-R44 HydrophobicContact CB-CB 3.86Å
45	A	95.4	Very high	94	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	167.9	179.4	0	0	0	0	0	111.3	C32 D33 V34 L50	C32-A45 CarbonylContact C-O 3.51Å; C32-A45 VanDerWaalsContact CA-O 3.25Å; C32-A45 WeakPolarHBondContact CA-O 3.49Å; C32-A45 WeakPolarHBondContact CB-O 3.42Å; D33-A45 PolarHBondContact N-O 2.98Å; V34-A45 HydrophobicContact CG1-CB 4.34Å; V34-A45 VanDerWaalsContact CG1-O 3.3Å; V34-A45 WeakPolarHBondContact CG1-O 3.47Å; V34-A45 PolarHBondContact N-O 3.26Å; V34-A45 PolarHBondContact O-N 2.78Å; V34-A45 VanDerWaalsContact O-O 3.1Å; A45-L50 HydrophobicContact CB-CD1 3.74Å; A45-L50 HydrophobicContact CB-CD2 4.48Å; A45-L50 HydrophobicContact CB-CG 4.09Å
46	H	95.3	Very high	93.9	Very high	6 Å²	6	59.9 Å²	59.9	3%	0.028	30%	0.299	C	S	.	.			trans	-92.9	126.1	172.2	-42.4	83.8	0	0	0	110	L30 F31 D33 N48 I49 L50 Y86	L30-H46 PolarHBondContact O-NE2 2.63Å; L30-H46 VanDerWaalsContact O-NE2 3.15Å; F31-H46 PolarHBondContact O-CD2 2.83Å; F31-H46 VanDerWaalsContact O-CD2 3.3Å; D33-H46 WeakPolarHBondContact OD1-CA 3.5Å; H46-N48 VanDerWaalsContact C-N 3.3Å; H46-N48 WeakPolarHBondContact CB-OD1 3.5Å; H46-N48 PolarHBondContact O-N 2.76Å; H46-I49 HydrophobicContact CB-CB 4.37Å; H46-I49 HydrophobicContact CB-CG1 3.99Å; H46-I49 PolarHBondContact O-N 3.28Å; H46-L50 PolarHBondContact O-N 3.06Å; H46-L50 VanDerWaalsContact O-N 3.11Å; H46-Y86 AromaticContact CE1-CE1 3.99Å; H46-Y86 PolarHBondContact N-OH 2.83Å; H46-Y86 AromaticContact ND1-CE1 3.46Å; H46-Y86 WeakPolarHBondContact ND1-CE1 3.49Å; H46-Y86 AromaticContact ND1-CZ 3.63Å; H46-Y86 PolarHBondContact ND1-OH 3.18Å
47	R	93.3	Very high	93.8	Very high	78 Å²	78	59.9 Å²	59.9	29%	0.294	30%	0.299	S	S	.	.	H	α-helix	trans	-63.1	-34.1	-176.2	-166.7	-177.3	-175	-140.7	3.1	112.3	D33 V34 S51 F61 V63	D33-R47 VanDerWaalsContact CG-CB 3.49Å; D33-R47 VanDerWaalsContact OD1-CB 3.25Å; D33-R47 WeakPolarHBondContact OD1-CB 3.34Å; D33-R47 PolarHBondContact OD1-N 3.39Å; D33-R47 WeakPolarHBondContact OD2-CB 3.41Å; V34-R47 HydrophobicContact CG1-CB 4.08Å; R47-S51 WeakPolarHBondContact O-CB 3.4Å; R47-S51 PolarHBondContact O-N 3.13Å; R47-F61 HydrophobicContact CB-CD2 4.49Å; R47-F61 HydrophobicContact CG-CB 3.92Å; R47-F61 HydrophobicContact CG-CD1 3.77Å; R47-F61 HydrophobicContact CG-CD2 3.53Å; R47-F61 HydrophobicContact CG-CE1 4.15Å; R47-F61 HydrophobicContact CG-CE2 3.94Å; R47-F61 HydrophobicContact CG-CG 3.46Å; R47-F61 VanDerWaalsContact CG-CG 3.46Å; R47-F61 HydrophobicContact CG-CZ 4.24Å; R47-F61 PolarHBondContact NH2-O 2.89Å; R47-V63 PolarHBondContact NH2-O 3.19Å
48	N	93.4	Very high	93.7	Very high	104 Å²	104	63 Å²	63	56%	0.556	31%	0.313	S	S	*	.	H	α-helix	trans	-65.8	-45.3	175.2	61.9	-20.5	0	0	0	112.4	H46 S51 A52	H46-N48 VanDerWaalsContact C-N 3.3Å; H46-N48 WeakPolarHBondContact CB-OD1 3.5Å; H46-N48 PolarHBondContact O-N 2.76Å; N48-S51 PolarHBondContact O-N 2.78Å; N48-A52 WeakPolarHBondContact O-CB 3.15Å; N48-A52 PolarHBondContact O-N 3.1Å
49	I	95.3	Very high	93.5	Very high	28 Å²	28	70.2 Å²	70.2	14%	0.144	35%	0.347	C	S	.	.	H	α-helix	trans	-66.4	-46.1	178.8	-56.8	-53.6	0	0	0	110.2	L22 H46 S51 A52 S53 I85 Y86	L22-I49 HydrophobicContact CD1-CD1 3.72Å; L22-I49 HydrophobicContact CD1-CG1 4.28Å; L22-I49 HydrophobicContact CD2-CD1 4.49Å; L22-I49 HydrophobicContact CD2-CG1 4.48Å; H46-I49 HydrophobicContact CB-CB 4.37Å; H46-I49 HydrophobicContact CB-CG1 3.99Å; H46-I49 PolarHBondContact O-N 3.28Å; I49-S51 PolarHBondContact O-N 2.9Å; I49-A52 PolarHBondContact O-N 2.93Å; I49-S53 PolarHBondContact O-N 2.94Å; I49-S53 PolarHBondContact O-OG 2.96Å; I49-I85 HydrophobicContact CG2-CG2 3.66Å; I49-Y86 HydrophobicContact CG2-CE1 4.24Å; I49-Y86 HydrophobicContact CG2-CE2 4.05Å
50	L	94.4	Very high	93.3	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-61.1	-45	175.4	-68.6	-175.4	0	0	0	112.6	V34 V36 A45 H46 A52 S53 S54 F57 F61 L82 I85	V34-L50 HydrophobicContact CG1-CD1 4.05Å; V36-L50 HydrophobicContact CG2-CD1 4.09Å; A45-L50 HydrophobicContact CB-CD1 3.74Å; A45-L50 HydrophobicContact CB-CD2 4.48Å; A45-L50 HydrophobicContact CB-CG 4.09Å; H46-L50 PolarHBondContact O-N 3.06Å; H46-L50 VanDerWaalsContact O-N 3.11Å; L50-A52 VanDerWaalsContact C-N 3.27Å; L50-A52 PolarHBondContact O-N 2.96Å; L50-S53 PolarHBondContact O-N 2.75Å; L50-S54 WeakPolarHBondContact O-CB 3.26Å; L50-S54 PolarHBondContact O-N 3.23Å; L50-F57 HydrophobicContact CB-CB 4.03Å; L50-F57 HydrophobicContact CB-CD2 4Å; L50-F57 HydrophobicContact CB-CG 4Å; L50-F57 HydrophobicContact CD1-CD1 4.38Å; L50-F57 HydrophobicContact CD1-CD2 4.33Å; L50-F57 HydrophobicContact CD1-CE1 4.34Å; L50-F57 HydrophobicContact CD1-CE2 4.28Å; L50-F57 HydrophobicContact CD1-CG 4.4Å; L50-F57 HydrophobicContact CD1-CZ 4.29Å; L50-F57 HydrophobicContact CD2-CD2 4.14Å; L50-F57 HydrophobicContact CD2-CE2 4.12Å; L50-F57 HydrophobicContact CG-CD2 4.39Å; L50-F61 HydrophobicContact CB-CE2 3.76Å; L50-F61 HydrophobicContact CD1-CE2 4Å; L50-F61 HydrophobicContact CD1-CZ 4.14Å; L50-L82 HydrophobicContact CD2-CD2 3.67Å; L50-I85 HydrophobicContact CD2-CD1 4.03Å; L50-I85 HydrophobicContact CD2-CG2 4.4Å
51	S	94.7	Very high	93.3	Very high	31 Å²	31	61.9 Å²	61.9	22%	0.217	30%	0.304	C	S	.	.	H	α-helix	trans	-65.2	-27.1	177.4	-177.5	0	0	0	0	113.5	R47 N48 I49 H58	R47-S51 WeakPolarHBondContact O-CB 3.4Å; R47-S51 PolarHBondContact O-N 3.13Å; N48-S51 PolarHBondContact O-N 2.78Å; I49-S51 PolarHBondContact O-N 2.9Å; S51-H58 PolarHBondContact O-ND1 2.9Å; S51-H58 PolarHBondContact OG-ND1 2.95Å
52	A	94	Very high	92.9	Very high	86 Å²	86	59.5 Å²	59.5	71%	0.711	30%	0.303	S	S	*	.	H	α-helix	trans	-79.8	-30.4	174.8	0	0	0	0	0	113.1	N48 I49 L50	N48-A52 WeakPolarHBondContact O-CB 3.15Å; N48-A52 PolarHBondContact O-N 3.1Å; I49-A52 PolarHBondContact O-N 2.93Å; L50-A52 VanDerWaalsContact C-N 3.27Å; L50-A52 PolarHBondContact O-N 2.96Å
53	S	93.7	Very high	92.4	Very high	46 Å²	46	56.9 Å²	56.9	32%	0.322	30%	0.3	S	S	.	.	H	α-helix	trans	-99.6	-11.4	-174.1	-56.2	0	0	0	0	115.4	I49 L50	I49-S53 PolarHBondContact O-N 2.94Å; I49-S53 PolarHBondContact O-OG 2.96Å; L50-S53 PolarHBondContact O-N 2.75Å
54	S	94.8	Very high	90.8	Very high	3 Å²	3	59.3 Å²	59.3	2%	0.021	33%	0.325	C	S	.	.			trans	-142.2	126.2	-173.2	158.7	0	0	0	0	111	L50 Y56 F57 H58 L108	L50-S54 WeakPolarHBondContact O-CB 3.26Å; L50-S54 PolarHBondContact O-N 3.23Å; S54-Y56 VanDerWaalsContact C-N 3.34Å; S54-Y56 PolarHBondContact OG-N 3.01Å; S54-F57 PolarHBondContact O-N 2.78Å; S54-F57 WeakPolarHBondContact OG-CD2 3.39Å; S54-F57 PolarHBondContact OG-N 3.5Å; S54-H58 WeakPolarHBondContact O-CB 3.34Å; S54-H58 PolarHBondContact O-N 2.93Å; S54-L108 WeakPolarHBondContact CB-O 3.34Å; S54-L108 PolarHBondContact OG-O 3.46Å
55	T	93.4	Very high	90	Very high	87 Å²	87	53.9 Å²	53.9	53%	0.534	32%	0.317	S	S	.	.	H	α-helix	trans	-69.3	-33.2	176	60.2	0	0	0	0	112.2	H58 Q59 G109	T55-H58 WeakPolarHBondContact O-CB 3.13Å; T55-H58 PolarHBondContact O-N 3.28Å; T55-Q59 PolarHBondContact O-N 3.13Å; T55-G109 PolarHBondContact N-O 3.47Å; T55-G109 WeakPolarHBondContact OG1-CA 3.44Å
56	Y	92.3	Very high	89.2	Confident	62 Å²	62	61.3 Å²	61.3	24%	0.243	35%	0.352	C	S	.	.	H	α-helix	trans	-60	-51.2	173.5	178.2	-90.1	0	0	0	111.2	S54 H58 Q59 L60 L70 F72 L108	S54-Y56 VanDerWaalsContact C-N 3.34Å; S54-Y56 PolarHBondContact OG-N 3.01Å; Y56-H58 VanDerWaalsContact C-N 3.32Å; Y56-H58 PolarHBondContact O-N 2.94Å; Y56-Q59 PolarHBondContact O-N 3.46Å; Y56-L60 HydrophobicContact CE1-CD2 3.81Å; Y56-L60 WeakPolarHBondContact O-CB 3.36Å; Y56-L60 PolarHBondContact O-N 2.79Å; Y56-L70 HydrophobicContact CE1-CD2 3.64Å; Y56-F72 HydrophobicContact CD2-CZ 4.35Å; Y56-F72 HydrophobicContact CE1-CZ 4.11Å; Y56-F72 HydrophobicContact CE2-CE1 4.13Å; Y56-F72 AromaticContact CE2-CZ 3.8Å; Y56-F72 HydrophobicContact CE2-CZ 3.8Å; Y56-F72 AromaticContact CZ-CE1 3.89Å; Y56-F72 AromaticContact CZ-CZ 3.68Å; Y56-L108 WeakPolarHBondContact CB-O 3.37Å; Y56-L108 HydrophobicContact CD1-CD2 3.51Å; Y56-L108 HydrophobicContact CE1-CD2 4.06Å; Y56-L108 HydrophobicContact CG-CD2 3.94Å; Y56-L108 PolarHBondContact N-O 3.34Å
57	F	93.2	Very high	88.9	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-66.2	-33.4	176.4	-76.5	-55.2	0	0	0	112.3	V36 L50 S54 L60 F61 V68 L70 F78 L108	V36-F57 HydrophobicContact CG1-CZ 4.37Å; V36-F57 HydrophobicContact CG2-CE1 4.07Å; V36-F57 HydrophobicContact CG2-CZ 4.15Å; L50-F57 HydrophobicContact CB-CB 4.03Å; L50-F57 HydrophobicContact CB-CD2 4Å; L50-F57 HydrophobicContact CB-CG 4Å; L50-F57 HydrophobicContact CD1-CD1 4.38Å; L50-F57 HydrophobicContact CD1-CD2 4.33Å; L50-F57 HydrophobicContact CD1-CE1 4.34Å; L50-F57 HydrophobicContact CD1-CE2 4.28Å; L50-F57 HydrophobicContact CD1-CG 4.4Å; L50-F57 HydrophobicContact CD1-CZ 4.29Å; L50-F57 HydrophobicContact CD2-CD2 4.14Å; L50-F57 HydrophobicContact CD2-CE2 4.12Å; L50-F57 HydrophobicContact CG-CD2 4.39Å; S54-F57 PolarHBondContact O-N 2.78Å; S54-F57 WeakPolarHBondContact OG-CD2 3.39Å; S54-F57 PolarHBondContact OG-N 3.5Å; F57-L60 HydrophobicContact CD1-CD2 4.37Å; F57-F61 HydrophobicContact CB-CD2 3.89Å; F57-F61 HydrophobicContact CB-CE2 3.66Å; F57-F61 HydrophobicContact CD1-CD2 4.42Å; F57-F61 AromaticContact CD1-CE2 3.57Å; F57-F61 HydrophobicContact CD1-CE2 3.57Å; F57-F61 AromaticContact CD1-CZ 3.63Å; F57-F61 HydrophobicContact CD1-CZ 3.63Å; F57-F61 HydrophobicContact CE1-CE2 4.5Å; F57-F61 HydrophobicContact CE1-CZ 4.23Å; F57-F61 AromaticContact CG-CE2 3.86Å; F57-F61 HydrophobicContact CG-CE2 3.86Å; F57-F61 HydrophobicContact CG-CZ 4.38Å; F57-F61 WeakPolarHBondContact O-CB 3.25Å; F57-F61 WeakPolarHBondContact O-CD2 3.33Å; F57-F61 VanDerWaalsContact O-CG 3.23Å; F57-F61 WeakPolarHBondContact O-CG 3.2Å; F57-F61 PolarHBondContact O-N 2.82Å; F57-V68 HydrophobicContact CE1-CG1 4.4Å; F57-L70 HydrophobicContact CZ-CD1 4.11Å; F57-F78 AromaticContact CE2-CE2 3.9Å; F57-F78 HydrophobicContact CE2-CE2 3.9Å; F57-F78 HydrophobicContact CE2-CZ 4.18Å; F57-F78 AromaticContact CZ-CE2 3.75Å; F57-F78 HydrophobicContact CZ-CE2 3.75Å; F57-F78 AromaticContact CZ-CZ 3.78Å; F57-F78 HydrophobicContact CZ-CZ 3.78Å; F57-L108 HydrophobicContact CE2-CD2 4.23Å; F57-L108 HydrophobicContact CZ-CD2 4.39Å
58	H	92.7	Very high	88.8	Confident	103 Å²	103	62.5 Å²	62.5	48%	0.477	37%	0.368	S	S	.	.	H	α-helix	trans	-60.6	-44.3	173.3	-169.6	83.9	0	0	0	112.8	S51 S54 T55 Y56 S62	S51-H58 PolarHBondContact O-ND1 2.9Å; S51-H58 PolarHBondContact OG-ND1 2.95Å; S54-H58 WeakPolarHBondContact O-CB 3.34Å; S54-H58 PolarHBondContact O-N 2.93Å; T55-H58 WeakPolarHBondContact O-CB 3.13Å; T55-H58 PolarHBondContact O-N 3.28Å; Y56-H58 VanDerWaalsContact C-N 3.32Å; Y56-H58 PolarHBondContact O-N 2.94Å; H58-S62 PolarHBondContact O-N 2.97Å; H58-S62 PolarHBondContact O-OG 3.47Å
59	Q	89.9	Confident	88.7	Confident	152 Å²	152	61.9 Å²	61.9	71%	0.71	36%	0.362	S	S	*	.	H	α-helix	trans	-69	-48.1	176.9	-172.8	172.4	3.2	0	0	111.1	T55 Y56 F61 S62	T55-Q59 PolarHBondContact O-N 3.13Å; Y56-Q59 PolarHBondContact O-N 3.46Å; Q59-F61 VanDerWaalsContact C-N 3.35Å; Q59-F61 PolarHBondContact O-N 2.76Å; Q59-S62 VanDerWaalsContact O-CB 3.32Å; Q59-S62 WeakPolarHBondContact O-CB 3.43Å; Q59-S62 PolarHBondContact O-N 2.97Å; Q59-S62 VanDerWaalsContact O-N 3.07Å
60	L	87.6	Confident	88.4	Confident	57 Å²	57	60.6 Å²	60.6	30%	0.298	36%	0.355	S	S	.	.	H	α-helix	trans	-60.8	-42.1	179.8	-173.3	64.2	0	0	0	112.1	Y56 F57 S62 V63 V68	Y56-L60 HydrophobicContact CE1-CD2 3.81Å; Y56-L60 WeakPolarHBondContact O-CB 3.36Å; Y56-L60 PolarHBondContact O-N 2.79Å; F57-L60 HydrophobicContact CD1-CD2 4.37Å; L60-S62 PolarHBondContact O-N 3.41Å; L60-V63 WeakPolarHBondContact O-CB 3.49Å; L60-V63 PolarHBondContact O-N 3.4Å; L60-V68 HydrophobicContact CD2-CB 4.23Å; L60-V68 HydrophobicContact CD2-CG1 3.49Å; L60-V68 VanDerWaalsContact CD2-CG1 3.49Å; L60-V68 HydrophobicContact CD2-CG2 3.64Å; L60-V68 HydrophobicContact CG-CG2 4.37Å
61	F	90.1	Very high	88.1	Confident	19 Å²	19	63.7 Å²	63.7	8%	0.083	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	5.1	177	-60.6	-39.9	0	0	0	114.7	V34 R47 L50 F57 Q59 V68	V34-F61 HydrophobicContact CB-CE1 4.39Å; V34-F61 HydrophobicContact CB-CZ 4.27Å; V34-F61 HydrophobicContact CG1-CZ 4Å; V34-F61 HydrophobicContact CG2-CE1 3.79Å; V34-F61 HydrophobicContact CG2-CZ 3.79Å; R47-F61 HydrophobicContact CB-CD2 4.49Å; R47-F61 HydrophobicContact CG-CB 3.92Å; R47-F61 HydrophobicContact CG-CD1 3.77Å; R47-F61 HydrophobicContact CG-CD2 3.53Å; R47-F61 HydrophobicContact CG-CE1 4.15Å; R47-F61 HydrophobicContact CG-CE2 3.94Å; R47-F61 HydrophobicContact CG-CG 3.46Å; R47-F61 VanDerWaalsContact CG-CG 3.46Å; R47-F61 HydrophobicContact CG-CZ 4.24Å; R47-F61 PolarHBondContact NH2-O 2.89Å; L50-F61 HydrophobicContact CB-CE2 3.76Å; L50-F61 HydrophobicContact CD1-CE2 4Å; L50-F61 HydrophobicContact CD1-CZ 4.14Å; F57-F61 HydrophobicContact CB-CD2 3.89Å; F57-F61 HydrophobicContact CB-CE2 3.66Å; F57-F61 HydrophobicContact CD1-CD2 4.42Å; F57-F61 AromaticContact CD1-CE2 3.57Å; F57-F61 HydrophobicContact CD1-CE2 3.57Å; F57-F61 AromaticContact CD1-CZ 3.63Å; F57-F61 HydrophobicContact CD1-CZ 3.63Å; F57-F61 HydrophobicContact CE1-CE2 4.5Å; F57-F61 HydrophobicContact CE1-CZ 4.23Å; F57-F61 AromaticContact CG-CE2 3.86Å; F57-F61 HydrophobicContact CG-CE2 3.86Å; F57-F61 HydrophobicContact CG-CZ 4.38Å; F57-F61 WeakPolarHBondContact O-CB 3.25Å; F57-F61 WeakPolarHBondContact O-CD2 3.33Å; F57-F61 VanDerWaalsContact O-CG 3.23Å; F57-F61 WeakPolarHBondContact O-CG 3.2Å; F57-F61 PolarHBondContact O-N 2.82Å; Q59-F61 VanDerWaalsContact C-N 3.35Å; Q59-F61 PolarHBondContact O-N 2.76Å; F61-V68 HydrophobicContact CE1-CG2 3.7Å; F61-V68 HydrophobicContact CZ-CG2 4.29Å
62	S	84.8	Confident	87.8	Confident	53 Å²	53	65.7 Å²	65.7	37%	0.371	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-17.3	157.4	-70.7	0	0	0	0	112.4	H58 Q59 L60 K508	H58-S62 PolarHBondContact O-N 2.97Å; H58-S62 PolarHBondContact O-OG 3.47Å; Q59-S62 VanDerWaalsContact O-CB 3.32Å; Q59-S62 WeakPolarHBondContact O-CB 3.43Å; Q59-S62 PolarHBondContact O-N 2.97Å; Q59-S62 VanDerWaalsContact O-N 3.07Å; L60-S62 PolarHBondContact O-N 3.41Å; S62-K508 PolarHBondContact OG-NZ 3.42Å
63	V	83.2	Confident	87.7	Confident	100 Å²	100	61.9 Å²	61.9	61%	0.606	35%	0.35	S	S	*	.	S	Bend	trans	-93.3	154	171.1	-170.8	0	0	0	0	110	R47 L60	R47-V63 PolarHBondContact NH2-O 3.19Å; L60-V63 WeakPolarHBondContact O-CB 3.49Å; L60-V63 PolarHBondContact O-N 3.4Å
64	A	61.2	Low	87.5	Confident	77 Å²	77	63.5 Å²	63.5	64%	0.636	35%	0.348	S	S	*	.			trans	-77.5	128.1	174.9	0	0	0	0	0	111.3
65	G	76.7	Confident	87.3	Confident	40 Å²	40	63.4 Å²	63.4	41%	0.412	35%	0.348	S	S	.	.			trans	176.8	138.6	176.3	0	0	0	0	0	111.9
66	Q	79.6	Confident	87.2	Confident	156 Å²	156	63 Å²	63	73%	0.729	34%	0.34	S	S	*	.	S	Bend	trans	-99.6	-14.4	174.6	-68.6	179.5	-9.5	0	0	112.7	V34 T35	V34-Q66 WeakPolarHBondContact CA-O 3.38Å; T35-Q66 PolarHBondContact N-O 3.44Å
67	V	88.6	Confident	87.2	Confident	93 Å²	93	60.2 Å²	60.2	56%	0.564	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.3	133.5	178.7	-175.6	0	0	0	0	108.3	T35 I37	T35-V67 WeakPolarHBondContact O-CA 3.48Å; I37-V67 HydrophobicContact CD1-CG1 3.61Å; I37-V67 HydrophobicContact CG1-CG1 3.94Å
68	V	90.4	Very high	87.3	Confident	15 Å²	15	60.2 Å²	60.2	9%	0.091	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	144.5	175.5	167.5	0	0	0	0	108.1	V34 T35 V36 I37 F57 L60 F61 L70	V34-V68 HydrophobicContact CG2-CG2 4.26Å; T35-V68 PolarHBondContact O-N 3.13Å; V36-V68 CarbonylContact C-O 3.48Å; V36-V68 HydrophobicContact CG1-CB 4.45Å; V36-V68 HydrophobicContact CG1-CG1 4.19Å; V36-V68 HydrophobicContact CG2-CB 4.45Å; I37-V68 PolarHBondContact N-O 3.45Å; F57-V68 HydrophobicContact CE1-CG1 4.4Å; L60-V68 HydrophobicContact CD2-CB 4.23Å; L60-V68 HydrophobicContact CD2-CG1 3.49Å; L60-V68 VanDerWaalsContact CD2-CG1 3.49Å; L60-V68 HydrophobicContact CD2-CG2 3.64Å; L60-V68 HydrophobicContact CG-CG2 4.37Å; F61-V68 HydrophobicContact CE1-CG2 3.7Å; F61-V68 HydrophobicContact CZ-CG2 4.29Å; V68-L70 HydrophobicContact CG1-CD2 3.95Å; V68-L70 HydrophobicContact CG1-CG 4.41Å
69	E	91.4	Very high	87.2	Confident	92 Å²	92	56 Å²	56	43%	0.43	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	128.9	170.9	-174.1	177.5	-147.6	0	0	109.4	I37	I37-E69 CarbonylContact O-C 3.58Å; I37-E69 WeakPolarHBondContact O-CA 3.4Å
70	L	90.9	Very high	87.4	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124	170.4	-51.8	179.4	0	0	0	109.2	V36 I37 V38 Y56 F57 V68 F72 F78 L108	V36-L70 HydrophobicContact CG1-CD1 3.81Å; V36-L70 HydrophobicContact CG1-CG 3.78Å; I37-L70 PolarHBondContact O-N 2.9Å; V38-L70 HydrophobicContact CG1-CB 4.49Å; V38-L70 HydrophobicContact CG2-CB 4.06Å; V38-L70 HydrophobicContact CG2-CD1 4.02Å; V38-L70 HydrophobicContact CG2-CG 4.24Å; Y56-L70 HydrophobicContact CE1-CD2 3.64Å; F57-L70 HydrophobicContact CZ-CD1 4.11Å; V68-L70 HydrophobicContact CG1-CD2 3.95Å; V68-L70 HydrophobicContact CG1-CG 4.41Å; L70-F72 HydrophobicContact CD2-CE1 4.1Å; L70-F72 HydrophobicContact CD2-CZ 4Å; L70-F78 HydrophobicContact CD1-CD2 3.81Å; L70-F78 HydrophobicContact CD1-CE2 3.61Å; L70-F78 HydrophobicContact CD1-CG 4.44Å; L70-F78 HydrophobicContact CD1-CZ 4.07Å; L70-L108 HydrophobicContact CD1-CD2 4.14Å
71	S	86.6	Confident	87.6	Confident	64 Å²	64	49 Å²	49	45%	0.448	28%	0.278	S	S	.	.	S	Bend	trans	-110.4	-3.7	179	54.3	0	0	0	0	114.1	G438 C439	S71-G438 WeakPolarHBondContact CB-O 3.32Å; S71-G438 PolarHBondContact OG-O 2.96Å; S71-C439 PolarHBondContact OG-SG 3.15Å; S71-C439 VanDerWaalsContact OG-SG 3.36Å
72	F	88.6	Confident	87.8	Confident	74 Å²	74	48.1 Å²	48.1	33%	0.325	27%	0.274	S	S	.	.	S	Bend	trans	-108.4	9.6	-175.9	59.6	-95.8	0	0	0	114	Y56 L70 L107 L108	Y56-F72 HydrophobicContact CD2-CZ 4.35Å; Y56-F72 HydrophobicContact CE1-CZ 4.11Å; Y56-F72 HydrophobicContact CE2-CE1 4.13Å; Y56-F72 AromaticContact CE2-CZ 3.8Å; Y56-F72 HydrophobicContact CE2-CZ 3.8Å; Y56-F72 AromaticContact CZ-CE1 3.89Å; Y56-F72 AromaticContact CZ-CZ 3.68Å; L70-F72 HydrophobicContact CD2-CE1 4.1Å; L70-F72 HydrophobicContact CD2-CZ 4Å; F72-L107 HydrophobicContact CD2-CB 3.89Å; F72-L107 HydrophobicContact CD2-CD1 3.82Å; F72-L107 HydrophobicContact CD2-CG 4.37Å; F72-L107 HydrophobicContact CE2-CB 3.75Å; F72-L108 HydrophobicContact CE2-CD2 4.02Å; F72-L108 HydrophobicContact CE2-CG 4.39Å; F72-L108 HydrophobicContact CZ-CD2 4.02Å
73	V	91.6	Very high	88.1	Confident	6 Å²	6	48 Å²	48	4%	0.036	27%	0.269	C	S	.	.	S	Bend	trans	-136.6	135.2	178.9	-173.1	0	0	0	0	108.2	V38 I77 F78 L108	V38-V73 WeakPolarHBondContact CG1-O 3.18Å; V73-I77 HydrophobicContact CG1-CB 4.13Å; V73-I77 HydrophobicContact CG1-CG2 4.13Å; V73-F78 HydrophobicContact CG1-CB 3.9Å; V73-L108 HydrophobicContact CG2-CD1 4.44Å
74	R	90.5	Very high	88.6	Confident	79 Å²	79	45.2 Å²	45.2	30%	0.298	25%	0.248	S	C	.	.			trans	-69	144.1	169.5	-76.5	-168.5	-73.2	164.7	-12.4	111.5	E39 E76 I77 F78 E100	E39-R74 WeakPolarHBondContact OE2-CA 3.49Å; R74-E76 HydrophobicContact CB-CG 4.31Å; R74-E76 IonicContact CZ-OE1 3.5Å; R74-E76 IonicContact NE-OE1 3.9Å; R74-E76 IonicContact NH1-OE1 2.71Å; R74-E76 PolarHBondContact NH1-OE1 3.45Å; R74-E76 PolarHBondContact O-N 3.44Å; R74-I77 HydrophobicContact CB-CG1 4.18Å; R74-I77 PolarHBondContact O-N 2.89Å; R74-F78 PolarHBondContact O-N 3.18Å; R74-E100 IonicContact CZ-OE1 2.7Å; R74-E100 IonicContact CZ-OE2 3.5Å; R74-E100 IonicContact NE-OE1 3.43Å; R74-E100 PolarHBondContact NE-OE1 3.4Å; R74-E100 IonicContact NE-OE2 3.9Å; R74-E100 PolarHBondContact NE-OE2 3.25Å; R74-E100 VanDerWaalsContact NH2-CD 3.29Å; R74-E100 IonicContact NH2-OE1 3.36Å; R74-E100 PolarHBondContact NH2-OE1 3.45Å; R74-E100 IonicContact NH2-OE2 2.65Å; R74-E100 PolarHBondContact NH2-OE2 3.06Å
75	A	90.9	Very high	90.1	Very high	2 Å²	2	41.9 Å²	41.9	2%	0.017	22%	0.22	C	C	.	.	H	α-helix	trans	-65.1	-24.1	-178.5	0	0	0	0	0	113.5	V38 E39 R41 F43 A79	V38-A75 HydrophobicContact CB-CB 4.19Å; V38-A75 HydrophobicContact CG1-CB 4.11Å; V38-A75 WeakPolarHBondContact O-CB 3.38Å; E39-A75 HydrophobicContact CB-CB 4.38Å; E39-A75 WeakPolarHBondContact OE2-CB 3.41Å; E39-A75 PolarHBondContact OE2-N 3.05Å; R41-A75 HydrophobicContact CB-CB 4.03Å; R41-A75 HydrophobicContact CG-CB 4.33Å; R41-A75 PolarHBondContact NH1-O 2.94Å; F43-A75 HydrophobicContact CE2-CB 4.19Å; F43-A75 HydrophobicContact CZ-CB 4.28Å; F43-A75 WeakPolarHBondContact CZ-O 3.43Å; A75-A79 WeakPolarHBondContact O-CB 3.35Å; A75-A79 PolarHBondContact O-N 2.66Å; A75-A79 VanDerWaalsContact O-N 3.17Å
76	E	90.9	Very high	91	Very high	77 Å²	77	40 Å²	40	36%	0.36	20%	0.2	S	C	.	.	H	α-helix	trans	-69.5	-43.8	169.8	72.3	-172.9	118.2	0	0	111.8	R74 A79 E80 R94	R74-E76 HydrophobicContact CB-CG 4.31Å; R74-E76 IonicContact CZ-OE1 3.5Å; R74-E76 IonicContact NE-OE1 3.9Å; R74-E76 IonicContact NH1-OE1 2.71Å; R74-E76 PolarHBondContact NH1-OE1 3.45Å; R74-E76 PolarHBondContact O-N 3.44Å; E76-A79 WeakPolarHBondContact O-CB 3.35Å; E76-A79 PolarHBondContact O-N 3.14Å; E76-E80 PolarHBondContact O-N 3.05Å; E76-R94 IonicContact OE2-NH2 3.89Å
77	I	92.8	Very high	91.5	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-67.4	-43.2	177.5	-58.2	-62.1	0	0	0	110.6	V73 R74 A79 E80 I81 L97 E100 L101	V73-I77 HydrophobicContact CG1-CB 4.13Å; V73-I77 HydrophobicContact CG1-CG2 4.13Å; R74-I77 HydrophobicContact CB-CG1 4.18Å; R74-I77 PolarHBondContact O-N 2.89Å; I77-A79 VanDerWaalsContact C-N 3.28Å; I77-A79 PolarHBondContact O-N 3.23Å; I77-E80 PolarHBondContact O-N 2.85Å; I77-E80 VanDerWaalsContact O-N 3.13Å; I77-I81 HydrophobicContact CG2-CD1 4.17Å; I77-I81 WeakPolarHBondContact O-CG1 3.5Å; I77-I81 PolarHBondContact O-N 3.02Å; I77-L97 HydrophobicContact CD1-CB 3.91Å; I77-L97 HydrophobicContact CD1-CD1 4.5Å; I77-L97 HydrophobicContact CD1-CD2 4.09Å; I77-L97 HydrophobicContact CD1-CG 4.39Å; I77-E100 HydrophobicContact CD1-CB 4.27Å; I77-E100 HydrophobicContact CG1-CB 4.43Å; I77-E100 HydrophobicContact CG1-CG 4.27Å; I77-L101 HydrophobicContact CG2-CB 4.29Å; I77-L101 HydrophobicContact CG2-CD1 3.98Å
78	F	93.9	Very high	91.5	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.8	-33	177.7	-172.4	-111.6	0	0	0	112.8	V36 V38 F43 F57 L70 V73 R74 E80 I81 L82 L108	V36-F78 HydrophobicContact CB-CE1 3.88Å; V36-F78 HydrophobicContact CB-CZ 4Å; V36-F78 HydrophobicContact CG1-CE1 3.72Å; V36-F78 HydrophobicContact CG1-CZ 3.68Å; V36-F78 HydrophobicContact CG2-CE1 4.5Å; V36-F78 HydrophobicContact CG2-CZ 4.2Å; V38-F78 HydrophobicContact CB-CD1 4.38Å; V38-F78 HydrophobicContact CG1-CB 4.25Å; V38-F78 HydrophobicContact CG2-CB 4.18Å; V38-F78 HydrophobicContact CG2-CD1 3.39Å; V38-F78 HydrophobicContact CG2-CE1 3.82Å; V38-F78 HydrophobicContact CG2-CG 3.77Å; F43-F78 HydrophobicContact CB-CE1 4.04Å; F43-F78 HydrophobicContact CD1-CD1 4.42Å; F43-F78 AromaticContact CD2-CD1 3.68Å; F43-F78 HydrophobicContact CD2-CD1 3.68Å; F43-F78 AromaticContact CD2-CE1 3.94Å; F43-F78 HydrophobicContact CD2-CE1 3.94Å; F43-F78 AromaticContact CE2-CD1 3.9Å; F43-F78 HydrophobicContact CE2-CD1 3.9Å; F43-F78 AromaticContact CG-CD1 3.96Å; F43-F78 HydrophobicContact CG-CD1 3.96Å; F43-F78 AromaticContact CG-CE1 3.97Å; F43-F78 HydrophobicContact CG-CE1 3.97Å; F43-F78 HydrophobicContact CZ-CD1 4.35Å; F57-F78 AromaticContact CE2-CE2 3.9Å; F57-F78 HydrophobicContact CE2-CE2 3.9Å; F57-F78 HydrophobicContact CE2-CZ 4.18Å; F57-F78 AromaticContact CZ-CE2 3.75Å; F57-F78 HydrophobicContact CZ-CE2 3.75Å; F57-F78 AromaticContact CZ-CZ 3.78Å; F57-F78 HydrophobicContact CZ-CZ 3.78Å; L70-F78 HydrophobicContact CD1-CD2 3.81Å; L70-F78 HydrophobicContact CD1-CE2 3.61Å; L70-F78 HydrophobicContact CD1-CG 4.44Å; L70-F78 HydrophobicContact CD1-CZ 4.07Å; V73-F78 HydrophobicContact CG1-CB 3.9Å; R74-F78 PolarHBondContact O-N 3.18Å; F78-E80 VanDerWaalsContact C-N 3.33Å; F78-E80 PolarHBondContact O-N 3.28Å; F78-I81 PolarHBondContact O-N 3.35Å; F78-L82 HydrophobicContact CD1-CD1 3.77Å; F78-L82 HydrophobicContact CD1-CG 4.16Å; F78-L82 HydrophobicContact CE1-CD1 3.33Å; F78-L82 HydrophobicContact CE1-CD2 4.32Å; F78-L82 HydrophobicContact CE1-CG 3.74Å; F78-L82 HydrophobicContact CE2-CG 4.33Å; F78-L82 HydrophobicContact CZ-CD1 3.89Å; F78-L82 HydrophobicContact CZ-CD2 4.03Å; F78-L82 HydrophobicContact CZ-CG 3.81Å; F78-L82 WeakPolarHBondContact O-CB 3.28Å; F78-L82 WeakPolarHBondContact O-CG 3.27Å; F78-L82 PolarHBondContact O-N 2.78Å; F78-L108 HydrophobicContact CD2-CD1 3.88Å; F78-L108 HydrophobicContact CE2-CD1 3.92Å
79	A	92.2	Very high	91.3	Very high	14 Å²	14	40.2 Å²	40.2	12%	0.116	20%	0.201	C	C	.	.	H	α-helix	trans	-61.2	-41.3	173	0	0	0	0	0	111.8	F43 A75 E76 I77 L82 N83	F43-A79 HydrophobicContact CE1-CB 3.84Å; F43-A79 HydrophobicContact CZ-CB 4.22Å; A75-A79 WeakPolarHBondContact O-CB 3.35Å; A75-A79 PolarHBondContact O-N 2.66Å; A75-A79 VanDerWaalsContact O-N 3.17Å; E76-A79 WeakPolarHBondContact O-CB 3.35Å; E76-A79 PolarHBondContact O-N 3.14Å; I77-A79 VanDerWaalsContact C-N 3.28Å; I77-A79 PolarHBondContact O-N 3.23Å; A79-L82 PolarHBondContact O-N 3.33Å; A79-N83 PolarHBondContact O-N 3.4Å; A79-N83 PolarHBondContact O-ND2 2.93Å; A79-N83 PolarHBondContact O-OD1 3.3Å
80	E	92.3	Very high	91	Very high	62 Å²	62	38.3 Å²	38.3	29%	0.29	19%	0.194	S	C	.	.	H	α-helix	trans	-73.6	-35	177.3	-66.1	-49.3	138.3	0	0	113.5	E76 I77 F78 L82 N83 Y84 V93 L101	E76-E80 PolarHBondContact O-N 3.05Å; I77-E80 PolarHBondContact O-N 2.85Å; I77-E80 VanDerWaalsContact O-N 3.13Å; F78-E80 VanDerWaalsContact C-N 3.33Å; F78-E80 PolarHBondContact O-N 3.28Å; E80-L82 VanDerWaalsContact C-N 3.31Å; E80-L82 PolarHBondContact O-N 3.15Å; E80-N83 PolarHBondContact O-N 3.02Å; E80-N83 VanDerWaalsContact O-N 3.17Å; E80-N83 PolarHBondContact OE1-ND2 3.46Å; E80-N83 PolarHBondContact OE2-ND2 3.45Å; E80-Y84 PolarHBondContact O-N 3.38Å; E80-V93 HydrophobicContact CB-CG2 4.43Å; E80-V93 HydrophobicContact CG-CG2 4.22Å; E80-L101 HydrophobicContact CB-CD1 4.45Å
81	I	93.1	Very high	90.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.4	-43.9	169.8	-65.3	177.6	0	0	0	110.3	I77 F78 Y84 I85 L101 L108 V110 I113	I77-I81 HydrophobicContact CG2-CD1 4.17Å; I77-I81 WeakPolarHBondContact O-CG1 3.5Å; I77-I81 PolarHBondContact O-N 3.02Å; F78-I81 PolarHBondContact O-N 3.35Å; I81-Y84 PolarHBondContact O-N 2.98Å; I81-I85 HydrophobicContact CG2-CD1 3.92Å; I81-I85 VanDerWaalsContact O-CG1 3.27Å; I81-I85 WeakPolarHBondContact O-CG1 3.42Å; I81-I85 PolarHBondContact O-N 2.93Å; I81-L101 HydrophobicContact CD1-CD1 4.12Å; I81-L101 HydrophobicContact CG1-CD1 3.43Å; I81-L101 VanDerWaalsContact CG1-CD1 3.43Å; I81-L108 HydrophobicContact CD1-CD1 3.92Å; I81-L108 HydrophobicContact CG2-CD1 4.19Å; I81-V110 HydrophobicContact CG2-CG2 4.21Å; I81-I113 HydrophobicContact CB-CD1 4.26Å; I81-I113 HydrophobicContact CG1-CD1 3.91Å; I81-I113 HydrophobicContact CG2-CD1 4.14Å
82	L	93.1	Very high	89.7	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-65.3	-36.1	173.9	-78.8	179.7	0	0	0	112.7	R26 F43 L50 F78 A79 E80 I85 Y86	R26-L82 PolarHBondContact NH1-O 2.98Å; F43-L82 HydrophobicContact CB-CD1 3.59Å; F43-L82 HydrophobicContact CD1-CD1 3.55Å; F43-L82 HydrophobicContact CE1-CD1 4.41Å; F43-L82 HydrophobicContact CG-CD1 3.72Å; L50-L82 HydrophobicContact CD2-CD2 3.67Å; F78-L82 HydrophobicContact CD1-CD1 3.77Å; F78-L82 HydrophobicContact CD1-CG 4.16Å; F78-L82 HydrophobicContact CE1-CD1 3.33Å; F78-L82 HydrophobicContact CE1-CD2 4.32Å; F78-L82 HydrophobicContact CE1-CG 3.74Å; F78-L82 HydrophobicContact CE2-CG 4.33Å; F78-L82 HydrophobicContact CZ-CD1 3.89Å; F78-L82 HydrophobicContact CZ-CD2 4.03Å; F78-L82 HydrophobicContact CZ-CG 3.81Å; F78-L82 WeakPolarHBondContact O-CB 3.28Å; F78-L82 WeakPolarHBondContact O-CG 3.27Å; F78-L82 PolarHBondContact O-N 2.78Å; A79-L82 PolarHBondContact O-N 3.33Å; E80-L82 VanDerWaalsContact C-N 3.31Å; E80-L82 PolarHBondContact O-N 3.15Å; L82-I85 PolarHBondContact O-N 2.85Å; L82-Y86 HydrophobicContact CD2-CE2 4.39Å; L82-Y86 VanDerWaalsContact O-CD2 3.31Å; L82-Y86 WeakPolarHBondContact O-CD2 3.34Å; L82-Y86 PolarHBondContact O-N 2.86Å; L82-Y86 VanDerWaalsContact O-N 3.1Å
83	N	91.8	Very high	89.3	Confident	50 Å²	50	49.7 Å²	49.7	27%	0.267	24%	0.235	S	C	.	.	H	α-helix	trans	-66.6	-40.4	175.6	-70.5	-22.2	0	0	0	111.5	R26 A79 E80 Y86 S87	R26-N83 PolarHBondContact NH1-OD1 3.48Å; R26-N83 PolarHBondContact NH2-OD1 2.78Å; A79-N83 PolarHBondContact O-N 3.4Å; A79-N83 PolarHBondContact O-ND2 2.93Å; A79-N83 PolarHBondContact O-OD1 3.3Å; E80-N83 PolarHBondContact O-N 3.02Å; E80-N83 VanDerWaalsContact O-N 3.17Å; E80-N83 PolarHBondContact OE1-ND2 3.46Å; E80-N83 PolarHBondContact OE2-ND2 3.45Å; N83-Y86 CarbonylContact O-C 3.57Å; N83-Y86 PolarHBondContact O-N 3.02Å; N83-S87 WeakPolarHBondContact O-CB 3.28Å; N83-S87 PolarHBondContact O-N 2.98Å; N83-S87 PolarHBondContact O-OG 3.34Å
84	Y	93.3	Very high	88.8	Confident	43 Å²	43	55.2 Å²	55.2	17%	0.169	26%	0.256	C	S	.	.	H	α-helix	trans	-59.3	-50.4	171	169.6	-100.1	0	0	0	111.6	E80 I81 Y86 S87 S88 R89 I90 V110 F112 I113	E80-Y84 PolarHBondContact O-N 3.38Å; I81-Y84 PolarHBondContact O-N 2.98Å; Y84-Y86 PolarHBondContact O-N 3.48Å; Y84-Y86 VanDerWaalsContact O-N 3.15Å; Y84-S87 PolarHBondContact O-N 2.91Å; Y84-S87 VanDerWaalsContact O-N 3.14Å; Y84-S88 WeakPolarHBondContact O-CA 3.41Å; Y84-S88 PolarHBondContact O-N 3.49Å; Y84-R89 WeakPolarHBondContact CA-O 3.42Å; Y84-I90 HydrophobicContact CD2-CD1 4.34Å; Y84-I90 HydrophobicContact CD2-CG1 3.88Å; Y84-I90 HydrophobicContact CG-CG1 4.26Å; Y84-V110 HydrophobicContact CD1-CG1 3.98Å; Y84-V110 HydrophobicContact CE1-CG1 3.76Å; Y84-F112 HydrophobicContact CD2-CD1 4.04Å; Y84-F112 HydrophobicContact CD2-CE1 4.27Å; Y84-F112 HydrophobicContact CE1-CB 4.39Å; Y84-F112 HydrophobicContact CE1-CD1 4.39Å; Y84-F112 HydrophobicContact CE2-CB 4.46Å; Y84-F112 AromaticContact CE2-CD1 3.34Å; Y84-F112 HydrophobicContact CE2-CD1 3.34Å; Y84-F112 AromaticContact CE2-CE1 3.77Å; Y84-F112 HydrophobicContact CE2-CE1 3.77Å; Y84-F112 HydrophobicContact CE2-CG 4.05Å; Y84-F112 AromaticContact CZ-CD1 3.57Å; Y84-F112 AromaticContact CZ-CG 3.9Å; Y84-F112 VanDerWaalsContact OH-CB 3.28Å; Y84-F112 WeakPolarHBondContact OH-CB 3.34Å; Y84-I113 HydrophobicContact CD1-CD1 3.63Å; Y84-I113 HydrophobicContact CD1-CG1 3.88Å; Y84-I113 HydrophobicContact CE1-CD1 4.41Å; Y84-I113 HydrophobicContact CE1-CG1 4.23Å; Y84-I113 HydrophobicContact CG-CD1 3.93Å; Y84-I113 HydrophobicContact CG-CG1 4.19Å
85	I	93.8	Very high	88.4	Confident	6 Å²	6	56.5 Å²	56.5	3%	0.031	28%	0.277	C	S	.	.	H	α-helix	trans	-57.5	-32.5	-179.8	-70.6	169.2	0	0	0	112	I49 L50 I81 L82 V110	I49-I85 HydrophobicContact CG2-CG2 3.66Å; L50-I85 HydrophobicContact CD2-CD1 4.03Å; L50-I85 HydrophobicContact CD2-CG2 4.4Å; I81-I85 HydrophobicContact CG2-CD1 3.92Å; I81-I85 VanDerWaalsContact O-CG1 3.27Å; I81-I85 WeakPolarHBondContact O-CG1 3.42Å; I81-I85 PolarHBondContact O-N 2.93Å; L82-I85 PolarHBondContact O-N 2.85Å; I85-V110 HydrophobicContact CD1-CG2 4.48Å
86	Y	94	Very high	88	Confident	1 Å²	1	61.4 Å²	61.4	0%	0.004	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	14.2	-178.3	-75.8	-97.4	0	0	0	114.5	L22 N23 R26 H46 I49 L82 N83 Y84	L22-Y86 HydrophobicContact CB-CD1 4.2Å; L22-Y86 HydrophobicContact CB-CE1 4.23Å; N23-Y86 HydrophobicContact CB-CD1 4.47Å; N23-Y86 WeakPolarHBondContact CB-O 3.35Å; R26-Y86 HydrophobicContact CB-CD1 4.13Å; R26-Y86 HydrophobicContact CB-CE1 3.96Å; R26-Y86 HydrophobicContact CG-CE1 4.37Å; H46-Y86 AromaticContact CE1-CE1 3.99Å; H46-Y86 PolarHBondContact N-OH 2.83Å; H46-Y86 AromaticContact ND1-CE1 3.46Å; H46-Y86 WeakPolarHBondContact ND1-CE1 3.49Å; H46-Y86 AromaticContact ND1-CZ 3.63Å; H46-Y86 PolarHBondContact ND1-OH 3.18Å; I49-Y86 HydrophobicContact CG2-CE1 4.24Å; I49-Y86 HydrophobicContact CG2-CE2 4.05Å; L82-Y86 HydrophobicContact CD2-CE2 4.39Å; L82-Y86 VanDerWaalsContact O-CD2 3.31Å; L82-Y86 WeakPolarHBondContact O-CD2 3.34Å; L82-Y86 PolarHBondContact O-N 2.86Å; L82-Y86 VanDerWaalsContact O-N 3.1Å; N83-Y86 CarbonylContact O-C 3.57Å; N83-Y86 PolarHBondContact O-N 3.02Å; Y84-Y86 PolarHBondContact O-N 3.48Å; Y84-Y86 VanDerWaalsContact O-N 3.15Å
87	S	90.3	Very high	87.8	Confident	43 Å²	43	58.6 Å²	58.6	30%	0.301	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.3	-7	175.1	69.8	0	0	0	0	115.8	N83 Y84 R89	N83-S87 WeakPolarHBondContact O-CB 3.28Å; N83-S87 PolarHBondContact O-N 2.98Å; N83-S87 PolarHBondContact O-OG 3.34Å; Y84-S87 PolarHBondContact O-N 2.91Å; Y84-S87 VanDerWaalsContact O-N 3.14Å; S87-R89 PolarHBondContact O-N 3.07Å; S87-R89 VanDerWaalsContact O-N 3.13Å; S87-R89 PolarHBondContact OG-N 3.09Å; S87-R89 PolarHBondContact OG-O 3.23Å
88	S	89	Confident	87.6	Confident	79 Å²	79	61.4 Å²	61.4	55%	0.552	30%	0.304	S	S	*	.	S	Bend	trans	53.6	21.5	-168.9	-57.9	0	0	0	0	114.1	L19 Y84	L19-S88 VanDerWaalsContact CD2-OG 3.27Å; L19-S88 WeakPolarHBondContact CD2-OG 3.5Å; Y84-S88 WeakPolarHBondContact O-CA 3.41Å; Y84-S88 PolarHBondContact O-N 3.49Å
89	R	86.5	Confident	87.3	Confident	146 Å²	146	66.4 Å²	66.4	55%	0.551	33%	0.331	S	S	*	.			trans	-135.9	145.8	-175.5	-70.9	176.2	170.7	-179.2	-5.2	110.9	Y84 S87 I91 S173	Y84-R89 WeakPolarHBondContact CA-O 3.42Å; S87-R89 PolarHBondContact O-N 3.07Å; S87-R89 VanDerWaalsContact O-N 3.13Å; S87-R89 PolarHBondContact OG-N 3.09Å; S87-R89 PolarHBondContact OG-O 3.23Å; R89-I91 HydrophobicContact CB-CD1 4.47Å; R89-I91 HydrophobicContact CB-CG1 4.28Å; R89-S173 PolarHBondContact NH2-OG 2.88Å; R89-S173 VanDerWaalsContact NH2-OG 3.17Å
90	I	85.4	Confident	87.2	Confident	53 Å²	53	68.4 Å²	68.4	27%	0.272	34%	0.338	S	S	.	.			trans	-113.3	126.4	170.1	-61.8	174.4	0	0	0	106.2	Y84 V93 L101 F112 I113 L116	Y84-I90 HydrophobicContact CD2-CD1 4.34Å; Y84-I90 HydrophobicContact CD2-CG1 3.88Å; Y84-I90 HydrophobicContact CG-CG1 4.26Å; I90-V93 HydrophobicContact CG2-CB 4.04Å; I90-V93 HydrophobicContact CG2-CG2 3.36Å; I90-L101 HydrophobicContact CD1-CD2 4.41Å; I90-L101 HydrophobicContact CG2-CD2 4.3Å; I90-F112 HydrophobicContact CD1-CD1 4.37Å; I90-F112 HydrophobicContact CD1-CE1 3.9Å; I90-I113 HydrophobicContact CD1-CG1 4.28Å; I90-L116 HydrophobicContact CD1-CD1 3.64Å
91	I	77.8	Confident	87.2	Confident	104 Å²	104	65.6 Å²	65.6	53%	0.533	33%	0.325	S	S	.	.			trans	-127	118.6	-168.9	-58.1	177.9	0	0	0	109.2	R89 V93	R89-I91 HydrophobicContact CB-CD1 4.47Å; R89-I91 HydrophobicContact CB-CG1 4.28Å; I91-V93 VanDerWaalsContact C-N 3.26Å; I91-V93 PolarHBondContact O-N 2.93Å
92	R	71.9	Confident	87.1	Confident	235 Å²	235	66.2 Å²	66.2	89%	0.887	33%	0.329	S	S	*	.	S	Bend	trans	55.2	30.7	173	-63.5	-177.9	169.3	97.9	-1.5	115.6	R94	R92-R94 PolarHBondContact O-N 3.32Å
93	V	79.3	Confident	87	Confident	38 Å²	38	71.6 Å²	71.6	23%	0.23	35%	0.352	C	S	.	.			trans	-59.9	129.9	168.1	170	0	0	0	0	109.4	E80 I90 I91 L97 L101	E80-V93 HydrophobicContact CB-CG2 4.43Å; E80-V93 HydrophobicContact CG-CG2 4.22Å; I90-V93 HydrophobicContact CG2-CB 4.04Å; I90-V93 HydrophobicContact CG2-CG2 3.36Å; I91-V93 VanDerWaalsContact C-N 3.26Å; I91-V93 PolarHBondContact O-N 2.93Å; V93-L97 HydrophobicContact CG1-CB 4.19Å; V93-L101 HydrophobicContact CB-CD2 4.4Å; V93-L101 HydrophobicContact CG1-CD2 3.92Å; V93-L101 HydrophobicContact CG2-CD2 3.87Å
94	R	81.4	Confident	87.1	Confident	123 Å²	123	69.3 Å²	69.3	46%	0.464	34%	0.34	S	S	.	.			trans	-72	142.7	179.9	-53.1	-175.1	-70.8	112.3	-6.7	109.6	E76 R92 D96 L97 L98	E76-R94 IonicContact OE2-NH2 3.89Å; R92-R94 PolarHBondContact O-N 3.32Å; R94-D96 WeakPolarHBondContact CB-OD1 3.25Å; R94-D96 IonicContact CZ-OD1 3.49Å; R94-D96 IonicContact CZ-OD2 2.83Å; R94-D96 IonicContact NH1-OD1 3.4Å; R94-D96 PolarHBondContact NH1-OD1 2.97Å; R94-D96 IonicContact NH1-OD2 2.75Å; R94-D96 PolarHBondContact NH1-OD2 2.88Å; R94-D96 IonicContact NH2-OD2 3.81Å; R94-D96 PolarHBondContact O-N 3.25Å; R94-D96 VanDerWaalsContact O-N 3.14Å; R94-L97 HydrophobicContact CB-CD1 4.43Å; R94-L97 HydrophobicContact CB-CG 4.33Å; R94-L97 WeakPolarHBondContact O-CB 3.46Å; R94-L97 PolarHBondContact O-N 2.83Å; R94-L98 PolarHBondContact O-N 3.32Å
95	S	83.3	Confident	87	Confident	106 Å²	106	67.3 Å²	67.3	74%	0.741	33%	0.332	S	S	*	.	H	α-helix	trans	-59.4	-30.5	-174.5	-164.3	0	0	0	0	113.4	L97 L98	S95-L97 VanDerWaalsContact C-N 3.28Å; S95-L97 PolarHBondContact O-N 3.42Å; S95-L98 PolarHBondContact O-N 3.47Å
96	D	82.3	Confident	86.9	Confident	105 Å²	105	72.3 Å²	72.3	56%	0.561	36%	0.355	S	S	*	.	H	α-helix	trans	-73.5	-16.4	176.5	64.1	-65.9	0	0	0	113.9	R94	R94-D96 WeakPolarHBondContact CB-OD1 3.25Å; R94-D96 IonicContact CZ-OD1 3.49Å; R94-D96 IonicContact CZ-OD2 2.83Å; R94-D96 IonicContact NH1-OD1 3.4Å; R94-D96 PolarHBondContact NH1-OD1 2.97Å; R94-D96 IonicContact NH1-OD2 2.75Å; R94-D96 PolarHBondContact NH1-OD2 2.88Å; R94-D96 IonicContact NH2-OD2 3.81Å; R94-D96 PolarHBondContact O-N 3.25Å; R94-D96 VanDerWaalsContact O-N 3.14Å
97	L	86.3	Confident	86.8	Confident	17 Å²	17	76.9 Å²	76.9	9%	0.089	38%	0.379	C	S	.	.	H	α-helix	trans	-94.4	-15.6	173.8	-61.3	-176.6	0	0	0	112.9	I77 V93 R94 S95 D99 E100 L101	I77-L97 HydrophobicContact CD1-CB 3.91Å; I77-L97 HydrophobicContact CD1-CD1 4.5Å; I77-L97 HydrophobicContact CD1-CD2 4.09Å; I77-L97 HydrophobicContact CD1-CG 4.39Å; V93-L97 HydrophobicContact CG1-CB 4.19Å; R94-L97 HydrophobicContact CB-CD1 4.43Å; R94-L97 HydrophobicContact CB-CG 4.33Å; R94-L97 WeakPolarHBondContact O-CB 3.46Å; R94-L97 PolarHBondContact O-N 2.83Å; S95-L97 VanDerWaalsContact C-N 3.28Å; S95-L97 PolarHBondContact O-N 3.42Å; L97-D99 PolarHBondContact O-N 3.07Å; L97-E100 PolarHBondContact O-N 2.86Å; L97-L101 WeakPolarHBondContact O-CB 3.45Å; L97-L101 PolarHBondContact O-N 3.4Å
98	L	88.2	Confident	86.9	Confident	63 Å²	63	74.8 Å²	74.8	33%	0.33	37%	0.365	S	S	.	.	H	α-helix	trans	-64.3	-44.6	-171.7	-176.3	59.7	0	0	0	112.4	R94 S95 E100 L101 I102 L116	R94-L98 PolarHBondContact O-N 3.32Å; S95-L98 PolarHBondContact O-N 3.47Å; L98-E100 VanDerWaalsContact C-N 3.25Å; L98-E100 PolarHBondContact O-N 3.46Å; L98-L101 WeakPolarHBondContact O-CB 3.33Å; L98-L101 PolarHBondContact O-N 2.91Å; L98-I102 HydrophobicContact CD1-CD1 4.3Å; L98-I102 HydrophobicContact CG-CD1 3.97Å; L98-I102 WeakPolarHBondContact O-CD1 3.48Å; L98-I102 VanDerWaalsContact O-CG1 3.3Å; L98-I102 WeakPolarHBondContact O-CG1 3.16Å; L98-I102 PolarHBondContact O-N 3.46Å; L98-L116 HydrophobicContact CD1-CD1 4.37Å
99	D	88.6	Confident	87	Confident	106 Å²	106	71.9 Å²	71.9	57%	0.567	35%	0.347	S	S	*	.	H	α-helix	trans	-58.9	-35.6	176.5	-80.7	-2.8	0	0	0	112.9	L97 K103	L97-D99 PolarHBondContact O-N 3.07Å; D99-K103 VanDerWaalsContact O-CD 3.27Å; D99-K103 WeakPolarHBondContact O-CD 3.48Å; D99-K103 WeakPolarHBondContact O-CG 3.3Å; D99-K103 PolarHBondContact O-N 3.04Å; D99-K103 VanDerWaalsContact O-N 3.15Å
100	E	90.3	Very high	87.3	Confident	56 Å²	56	65 Å²	65	26%	0.262	32%	0.321	S	S	.	.	H	α-helix	trans	-83.1	-32.1	179.5	-161	178.7	124.5	0	0	112.3	R74 I77 L97 L98 I102 K103 S104	R74-E100 IonicContact CZ-OE1 2.7Å; R74-E100 IonicContact CZ-OE2 3.5Å; R74-E100 IonicContact NE-OE1 3.43Å; R74-E100 PolarHBondContact NE-OE1 3.4Å; R74-E100 IonicContact NE-OE2 3.9Å; R74-E100 PolarHBondContact NE-OE2 3.25Å; R74-E100 VanDerWaalsContact NH2-CD 3.29Å; R74-E100 IonicContact NH2-OE1 3.36Å; R74-E100 PolarHBondContact NH2-OE1 3.45Å; R74-E100 IonicContact NH2-OE2 2.65Å; R74-E100 PolarHBondContact NH2-OE2 3.06Å; I77-E100 HydrophobicContact CD1-CB 4.27Å; I77-E100 HydrophobicContact CG1-CB 4.43Å; I77-E100 HydrophobicContact CG1-CG 4.27Å; L97-E100 PolarHBondContact O-N 2.86Å; L98-E100 VanDerWaalsContact C-N 3.25Å; L98-E100 PolarHBondContact O-N 3.46Å; E100-I102 VanDerWaalsContact C-N 3.34Å; E100-K103 PolarHBondContact O-N 2.94Å; E100-S104 WeakPolarHBondContact O-CB 3.38Å; E100-S104 PolarHBondContact O-N 2.87Å; E100-S104 PolarHBondContact O-OG 3.18Å
101	L	91.3	Very high	87.5	Confident	2 Å²	2	70.1 Å²	70.1	1%	0.01	34%	0.341	C	S	.	.	H	α-helix	trans	-60.1	-44	168.1	-179.4	60.2	0	0	0	110.9	I77 E80 I81 I90 V93 L97 L98 S104 G105 I113	I77-L101 HydrophobicContact CG2-CB 4.29Å; I77-L101 HydrophobicContact CG2-CD1 3.98Å; E80-L101 HydrophobicContact CB-CD1 4.45Å; I81-L101 HydrophobicContact CD1-CD1 4.12Å; I81-L101 HydrophobicContact CG1-CD1 3.43Å; I81-L101 VanDerWaalsContact CG1-CD1 3.43Å; I90-L101 HydrophobicContact CD1-CD2 4.41Å; I90-L101 HydrophobicContact CG2-CD2 4.3Å; V93-L101 HydrophobicContact CB-CD2 4.4Å; V93-L101 HydrophobicContact CG1-CD2 3.92Å; V93-L101 HydrophobicContact CG2-CD2 3.87Å; L97-L101 WeakPolarHBondContact O-CB 3.45Å; L97-L101 PolarHBondContact O-N 3.4Å; L98-L101 WeakPolarHBondContact O-CB 3.33Å; L98-L101 PolarHBondContact O-N 2.91Å; L101-S104 PolarHBondContact O-N 3.34Å; L101-G105 PolarHBondContact O-N 2.84Å; L101-I113 HydrophobicContact CD1-CD1 4.5Å; L101-I113 HydrophobicContact CD1-CG2 4.01Å; L101-I113 HydrophobicContact CG-CG2 3.81Å; L101-I113 VanDerWaalsContact O-CG2 3.23Å; L101-I113 WeakPolarHBondContact O-CG2 3.28Å
102	I	91.2	Very high	88.2	Confident	14 Å²	14	70 Å²	70	7%	0.072	34%	0.338	C	S	.	.	H	α-helix	trans	-60.1	-52.5	173.5	-69.8	157.6	0	0	0	110.8	L98 E100 S104 G105 Q106 L116	L98-I102 HydrophobicContact CD1-CD1 4.3Å; L98-I102 HydrophobicContact CG-CD1 3.97Å; L98-I102 WeakPolarHBondContact O-CD1 3.48Å; L98-I102 VanDerWaalsContact O-CG1 3.3Å; L98-I102 WeakPolarHBondContact O-CG1 3.16Å; L98-I102 PolarHBondContact O-N 3.46Å; E100-I102 VanDerWaalsContact C-N 3.34Å; I102-S104 VanDerWaalsContact C-N 3.32Å; I102-S104 PolarHBondContact O-N 2.99Å; I102-G105 CarbonylContact O-C 3.59Å; I102-G105 PolarHBondContact O-N 2.74Å; I102-G105 VanDerWaalsContact O-N 3.15Å; I102-Q106 WeakPolarHBondContact O-CG 3.15Å; I102-Q106 PolarHBondContact O-N 3.4Å; I102-L116 HydrophobicContact CD1-CB 4.24Å; I102-L116 HydrophobicContact CG1-CB 3.91Å
103	K	91.8	Very high	89	Confident	113 Å²	113	58.9 Å²	58.9	49%	0.491	30%	0.295	S	S	.	.	H	α-helix	trans	-58.9	-42.3	179.3	-71.6	160	-166.3	159.7	0	112.3	D99 E100 Q106 L107	D99-K103 VanDerWaalsContact O-CD 3.27Å; D99-K103 WeakPolarHBondContact O-CD 3.48Å; D99-K103 WeakPolarHBondContact O-CG 3.3Å; D99-K103 PolarHBondContact O-N 3.04Å; D99-K103 VanDerWaalsContact O-N 3.15Å; E100-K103 PolarHBondContact O-N 2.94Å; K103-Q106 WeakPolarHBondContact O-CB 3.49Å; K103-Q106 PolarHBondContact O-N 2.9Å; K103-L107 VanDerWaalsContact O-CG 3.28Å; K103-L107 WeakPolarHBondContact O-CG 3.43Å; K103-L107 PolarHBondContact O-N 3.27Å
104	S	92.4	Very high	89.5	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-69.9	-35.5	177.6	-61.1	0	0	0	0	112.1	E100 L101 I102 L107 L108	E100-S104 WeakPolarHBondContact O-CB 3.38Å; E100-S104 PolarHBondContact O-N 2.87Å; E100-S104 PolarHBondContact O-OG 3.18Å; L101-S104 PolarHBondContact O-N 3.34Å; I102-S104 VanDerWaalsContact C-N 3.32Å; I102-S104 PolarHBondContact O-N 2.99Å; S104-L107 PolarHBondContact O-N 2.87Å; S104-L108 WeakPolarHBondContact O-CB 3.47Å; S104-L108 WeakPolarHBondContact O-CG 3.44Å; S104-L108 PolarHBondContact O-N 2.97Å
105	G	91.3	Very high	89.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64.9	-36.7	170.2	0	0	0	0	0	112.9	L101 I102 G109 V110	L101-G105 PolarHBondContact O-N 2.84Å; I102-G105 CarbonylContact O-C 3.59Å; I102-G105 PolarHBondContact O-N 2.74Å; I102-G105 VanDerWaalsContact O-N 3.15Å; G105-G109 CarbonylContact O-C 3.55Å; G105-G109 WeakPolarHBondContact O-CA 3.39Å; G105-G109 PolarHBondContact O-N 2.77Å; G105-V110 PolarHBondContact O-N 3.2Å
106	Q	91.8	Very high	89.8	Confident	111 Å²	111	54.7 Å²	54.7	52%	0.519	27%	0.274	S	S	.	.	H	α-helix	trans	-66.5	-49.2	171.8	-71.6	167.1	0.9	0	0	111.4	I102 K103 L108 G109 A114	I102-Q106 WeakPolarHBondContact O-CG 3.15Å; I102-Q106 PolarHBondContact O-N 3.4Å; K103-Q106 WeakPolarHBondContact O-CB 3.49Å; K103-Q106 PolarHBondContact O-N 2.9Å; Q106-L108 VanDerWaalsContact C-N 3.32Å; Q106-L108 PolarHBondContact O-N 3.06Å; Q106-G109 PolarHBondContact O-N 3.08Å; Q106-A114 HydrophobicContact CB-CB 4.33Å; Q106-A114 HydrophobicContact CG-CB 3.52Å; Q106-A114 PolarHBondContact NE2-O 2.95Å
107	L	91.9	Very high	89	Confident	97 Å²	97	51.9 Å²	51.9	51%	0.508	27%	0.27	S	S	.	.	H	α-helix	trans	-63.5	-35.2	179	-69.7	168	0	0	0	112.9	F72 K103 S104	F72-L107 HydrophobicContact CD2-CB 3.89Å; F72-L107 HydrophobicContact CD2-CD1 3.82Å; F72-L107 HydrophobicContact CD2-CG 4.37Å; F72-L107 HydrophobicContact CE2-CB 3.75Å; K103-L107 VanDerWaalsContact O-CG 3.28Å; K103-L107 WeakPolarHBondContact O-CG 3.43Å; K103-L107 PolarHBondContact O-N 3.27Å; S104-L107 PolarHBondContact O-N 2.87Å
108	L	92.3	Very high	87.9	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-4.2	173.6	-65.5	175.7	0	0	0	113.4	S54 Y56 F57 L70 F72 V73 F78 I81 S104 Q106 V110	S54-L108 WeakPolarHBondContact CB-O 3.34Å; S54-L108 PolarHBondContact OG-O 3.46Å; Y56-L108 WeakPolarHBondContact CB-O 3.37Å; Y56-L108 HydrophobicContact CD1-CD2 3.51Å; Y56-L108 HydrophobicContact CE1-CD2 4.06Å; Y56-L108 HydrophobicContact CG-CD2 3.94Å; Y56-L108 PolarHBondContact N-O 3.34Å; F57-L108 HydrophobicContact CE2-CD2 4.23Å; F57-L108 HydrophobicContact CZ-CD2 4.39Å; L70-L108 HydrophobicContact CD1-CD2 4.14Å; F72-L108 HydrophobicContact CE2-CD2 4.02Å; F72-L108 HydrophobicContact CE2-CG 4.39Å; F72-L108 HydrophobicContact CZ-CD2 4.02Å; V73-L108 HydrophobicContact CG2-CD1 4.44Å; F78-L108 HydrophobicContact CD2-CD1 3.88Å; F78-L108 HydrophobicContact CE2-CD1 3.92Å; I81-L108 HydrophobicContact CD1-CD1 3.92Å; I81-L108 HydrophobicContact CG2-CD1 4.19Å; S104-L108 WeakPolarHBondContact O-CB 3.47Å; S104-L108 WeakPolarHBondContact O-CG 3.44Å; S104-L108 PolarHBondContact O-N 2.97Å; Q106-L108 VanDerWaalsContact C-N 3.32Å; Q106-L108 PolarHBondContact O-N 3.06Å; L108-V110 VanDerWaalsContact C-N 3.33Å; L108-V110 HydrophobicContact CB-CG2 4.11Å; L108-V110 PolarHBondContact O-N 2.88Å
109	G	91.4	Very high	85.8	Confident	17 Å²	17	57.6 Å²	57.6	18%	0.175	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	36.3	-179.7	0	0	0	0	0	114.8	T55 G105 Q106 K111	T55-G109 PolarHBondContact N-O 3.47Å; T55-G109 WeakPolarHBondContact OG1-CA 3.44Å; G105-G109 CarbonylContact O-C 3.55Å; G105-G109 WeakPolarHBondContact O-CA 3.39Å; G105-G109 PolarHBondContact O-N 2.77Å; Q106-G109 PolarHBondContact O-N 3.08Å; G109-K111 PolarHBondContact O-N 2.93Å
110	V	93.6	Very high	83.5	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.018	32%	0.322	C	S	.	.			trans	-90.8	88	175.3	-176	0	0	0	0	108.4	I81 Y84 I85 G105 L108 F112 I113 A114	I81-V110 HydrophobicContact CG2-CG2 4.21Å; Y84-V110 HydrophobicContact CD1-CG1 3.98Å; Y84-V110 HydrophobicContact CE1-CG1 3.76Å; I85-V110 HydrophobicContact CD1-CG2 4.48Å; G105-V110 PolarHBondContact O-N 3.2Å; L108-V110 VanDerWaalsContact C-N 3.33Å; L108-V110 HydrophobicContact CB-CG2 4.11Å; L108-V110 PolarHBondContact O-N 2.88Å; V110-F112 PolarHBondContact O-N 3.21Å; V110-I113 HydrophobicContact CB-CB 4.45Å; V110-I113 HydrophobicContact CB-CD1 4.4Å; V110-I113 HydrophobicContact CB-CG1 4.46Å; V110-I113 HydrophobicContact CG1-CB 4.33Å; V110-I113 HydrophobicContact CG1-CD1 3.85Å; V110-I113 HydrophobicContact CG1-CG1 3.86Å; V110-I113 PolarHBondContact O-N 3.43Å; V110-A114 PolarHBondContact O-N 3.11Å
111	K	89.5	Confident	81.1	Confident	159 Å²	159	61.4 Å²	61.4	69%	0.691	35%	0.349	S	S	*	.	H	α-helix	trans	-37.9	-63	-168.6	-66.1	-176.3	178.2	-178.9	0	114.5	G109 I113 A114 D115	G109-K111 PolarHBondContact O-N 2.93Å; K111-I113 VanDerWaalsContact C-N 3.26Å; K111-I113 PolarHBondContact O-N 3.06Å; K111-I113 VanDerWaalsContact O-N 3.11Å; K111-A114 CarbonylContact O-C 3.5Å; K111-A114 WeakPolarHBondContact O-CA 3.39Å; K111-A114 WeakPolarHBondContact O-CB 3.43Å; K111-A114 PolarHBondContact O-N 3.4Å; K111-D115 VanDerWaalsContact C-OD2 3.32Å; K111-D115 WeakPolarHBondContact O-CB 3.4Å; K111-D115 PolarHBondContact O-N 3.19Å
112	F	92.3	Very high	78.5	Confident	103 Å²	103	70.3 Å²	70.3	45%	0.452	39%	0.39	S	S	.	.	H	α-helix	trans	-50.4	-43.1	-178.8	178.3	-98.1	0	0	0	113.6	Y84 I90 V110 D115 L116	Y84-F112 HydrophobicContact CD2-CD1 4.04Å; Y84-F112 HydrophobicContact CD2-CE1 4.27Å; Y84-F112 HydrophobicContact CE1-CB 4.39Å; Y84-F112 HydrophobicContact CE1-CD1 4.39Å; Y84-F112 HydrophobicContact CE2-CB 4.46Å; Y84-F112 AromaticContact CE2-CD1 3.34Å; Y84-F112 HydrophobicContact CE2-CD1 3.34Å; Y84-F112 AromaticContact CE2-CE1 3.77Å; Y84-F112 HydrophobicContact CE2-CE1 3.77Å; Y84-F112 HydrophobicContact CE2-CG 4.05Å; Y84-F112 AromaticContact CZ-CD1 3.57Å; Y84-F112 AromaticContact CZ-CG 3.9Å; Y84-F112 VanDerWaalsContact OH-CB 3.28Å; Y84-F112 WeakPolarHBondContact OH-CB 3.34Å; I90-F112 HydrophobicContact CD1-CD1 4.37Å; I90-F112 HydrophobicContact CD1-CE1 3.9Å; V110-F112 PolarHBondContact O-N 3.21Å; F112-D115 PolarHBondContact O-N 3.26Å; F112-L116 HydrophobicContact CE1-CD2 4.13Å; F112-L116 HydrophobicContact CZ-CD2 4.08Å; F112-L116 WeakPolarHBondContact O-CG 3.21Å; F112-L116 PolarHBondContact O-N 3.48Å
113	I	89.4	Confident	75.7	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	42%	0.422	C	S	.	.	H	α-helix	trans	-72.4	-38.7	179.5	-55.8	-175.2	0	0	0	111.1	I81 Y84 I90 L101 V110 K111 D115 L116	I81-I113 HydrophobicContact CB-CD1 4.26Å; I81-I113 HydrophobicContact CG1-CD1 3.91Å; I81-I113 HydrophobicContact CG2-CD1 4.14Å; Y84-I113 HydrophobicContact CD1-CD1 3.63Å; Y84-I113 HydrophobicContact CD1-CG1 3.88Å; Y84-I113 HydrophobicContact CE1-CD1 4.41Å; Y84-I113 HydrophobicContact CE1-CG1 4.23Å; Y84-I113 HydrophobicContact CG-CD1 3.93Å; Y84-I113 HydrophobicContact CG-CG1 4.19Å; I90-I113 HydrophobicContact CD1-CG1 4.28Å; L101-I113 HydrophobicContact CD1-CD1 4.5Å; L101-I113 HydrophobicContact CD1-CG2 4.01Å; L101-I113 HydrophobicContact CG-CG2 3.81Å; L101-I113 VanDerWaalsContact O-CG2 3.23Å; L101-I113 WeakPolarHBondContact O-CG2 3.28Å; V110-I113 HydrophobicContact CB-CB 4.45Å; V110-I113 HydrophobicContact CB-CD1 4.4Å; V110-I113 HydrophobicContact CB-CG1 4.46Å; V110-I113 HydrophobicContact CG1-CB 4.33Å; V110-I113 HydrophobicContact CG1-CD1 3.85Å; V110-I113 HydrophobicContact CG1-CG1 3.86Å; V110-I113 PolarHBondContact O-N 3.43Å; K111-I113 VanDerWaalsContact C-N 3.26Å; K111-I113 PolarHBondContact O-N 3.06Å; K111-I113 VanDerWaalsContact O-N 3.11Å; I113-D115 VanDerWaalsContact C-N 3.26Å; I113-D115 PolarHBondContact O-N 3.06Å; I113-L116 HydrophobicContact CG2-CD1 4.42Å; I113-L116 PolarHBondContact O-N 2.96Å
114	A	88.9	Confident	72.8	Confident	14 Å²	14	77.6 Å²	77.6	12%	0.116	44%	0.442	C	S	.	.	H	α-helix	trans	-63.2	-33.8	175.6	0	0	0	0	0	112.8	Q106 V110 K111	Q106-A114 HydrophobicContact CB-CB 4.33Å; Q106-A114 HydrophobicContact CG-CB 3.52Å; Q106-A114 PolarHBondContact NE2-O 2.95Å; V110-A114 PolarHBondContact O-N 3.11Å; K111-A114 CarbonylContact O-C 3.5Å; K111-A114 WeakPolarHBondContact O-CA 3.39Å; K111-A114 WeakPolarHBondContact O-CB 3.43Å; K111-A114 PolarHBondContact O-N 3.4Å
115	D	89.2	Confident	69.7	Low	96 Å²	96	82.8 Å²	82.8	51%	0.513	48%	0.478	S	S	.	.	H	α-helix	trans	-81.6	-17.5	-176.7	-60.1	-32.9	0	0	0	113.1	K111 F112 I113 G117 V118	K111-D115 VanDerWaalsContact C-OD2 3.32Å; K111-D115 WeakPolarHBondContact O-CB 3.4Å; K111-D115 PolarHBondContact O-N 3.19Å; F112-D115 PolarHBondContact O-N 3.26Å; I113-D115 VanDerWaalsContact C-N 3.26Å; I113-D115 PolarHBondContact O-N 3.06Å; D115-G117 PolarHBondContact O-N 3.25Å; D115-G117 VanDerWaalsContact O-N 3.08Å; D115-V118 PolarHBondContact O-N 3.46Å
116	L	81.8	Confident	66.6	Low	69 Å²	69	90.8 Å²	90.8	36%	0.361	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-22.8	178.3	-69.9	172.6	0	0	0	114.2	I90 L98 I102 F112 I113	I90-L116 HydrophobicContact CD1-CD1 3.64Å; L98-L116 HydrophobicContact CD1-CD1 4.37Å; I102-L116 HydrophobicContact CD1-CB 4.24Å; I102-L116 HydrophobicContact CG1-CB 3.91Å; F112-L116 HydrophobicContact CE1-CD2 4.13Å; F112-L116 HydrophobicContact CZ-CD2 4.08Å; F112-L116 WeakPolarHBondContact O-CG 3.21Å; F112-L116 PolarHBondContact O-N 3.48Å; I113-L116 HydrophobicContact CG2-CD1 4.42Å; I113-L116 PolarHBondContact O-N 2.96Å
117	G	64.6	Low	63.6	Low	47 Å²	47	91 Å²	91	49%	0.485	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-6.1	177.1	0	0	0	0	0	114.6	D115	D115-G117 PolarHBondContact O-N 3.25Å; D115-G117 VanDerWaalsContact O-N 3.08Å
118	V	63.9	Low	60.5	Low	95 Å²	95	92 Å²	92	58%	0.576	54%	0.543	S	S	*	.	S	Bend	trans	-94	122.3	176.9	-174.3	0	0	0	0	108	D115	D115-V118 PolarHBondContact O-N 3.46Å
119	P	44.8	Very low	57.5	Low	105 Å²	105	101.6 Å²	101.6	68%	0.682	59%	0.588	S	S	*	*			trans	-60.9	134.7	174	26.2	-33.3	0	0	0	108.9	S121	P119-S121 PolarHBondContact O-N 2.65Å
120	P	40.6	Very low	54.5	Low	124 Å²	124	105.3 Å²	105.3	81%	0.805	62%	0.617	S	S	*	*			trans	-61.8	111.4	-178.6	25.1	-33.4	0	0	0	109	E122	P120-E122 PolarHBondContact O-N 2.82Å
121	S	39.1	Very low	51.5	Low	118 Å²	118	114.6 Å²	114.6	83%	0.825	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-59.9	132.5	176	43.4	0	0	0	0	109.2	P119	P119-S121 PolarHBondContact O-N 2.65Å
122	E	36.9	Very low	48.6	Very low	189 Å²	189	114.9 Å²	114.9	88%	0.883	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-58.2	146	-160.2	-66	173.2	114.8	0	0	112.9	P120 K124	P120-E122 PolarHBondContact O-N 2.82Å; E122-K124 PolarHBondContact O-N 3.27Å
123	G	32.3	Very low	45.6	Very low	72 Å²	72	113.4 Å²	113.4	74%	0.742	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-53	125.2	-176.9	0	0	0	0	0	111.4	S125	G123-S125 PolarHBondContact O-N 3.07Å
124	K	31.6	Very low	42.7	Very low	208 Å²	208	117.9 Å²	117.9	90%	0.904	72%	0.717	S	S	*	*			trans	-58.3	108.6	-179.5	-164.3	170.3	-172.4	175	0	109.1	E122 M126	E122-K124 PolarHBondContact O-N 3.27Å; K124-M126 PolarHBondContact O-N 2.83Å
125	S	26.9	Very low	39.8	Very low	111 Å²	111	122.2 Å²	122.2	78%	0.776	75%	0.746	S	S	*	*			trans	-64	122.3	-167.8	38.6	0	0	0	0	111.8	G123	G123-S125 PolarHBondContact O-N 3.07Å
126	M	25.9	Very low	37	Very low	168 Å²	168	125.2 Å²	125.2	83%	0.828	76%	0.757	S	S	*	*			trans	-68.7	131.8	163.7	-71.8	-66.5	-73.3	0	0	108.5	K124 S128	K124-M126 PolarHBondContact O-N 2.83Å; M126-S128 PolarHBondContact O-N 2.85Å
127	P	29.6	Very low	34.4	Very low	115 Å²	115	127.4 Å²	127.4	75%	0.747	77%	0.774	S	S	*	*			trans	-73.9	113.2	173.6	29.6	-32	0	0	0	109.4
128	S	26.6	Very low	32.7	Very low	118 Å²	118	130.7 Å²	130.7	83%	0.825	78%	0.784	S	S	*	*			trans	-67.5	131.5	168.6	-62.6	0	0	0	0	110.2	M126 A130	M126-S128 PolarHBondContact O-N 2.85Å; S128-A130 PolarHBondContact O-N 3.04Å; S128-A130 VanDerWaalsContact O-N 3.15Å
129	E	28.7	Very low	30.9	Very low	203 Å²	203	131.9 Å²	131.9	95%	0.949	79%	0.792	S	S	*	*			trans	-65.4	111.3	172.6	-68.6	-179.3	95.1	0	0	110.9
130	A	28.8	Very low	30.1	Very low	94 Å²	94	132.2 Å²	132.2	78%	0.777	80%	0.796	S	S	*	*			trans	-101.1	117.4	161.6	0	0	0	0	0	108.6	S128 D132	S128-A130 PolarHBondContact O-N 3.04Å; S128-A130 VanDerWaalsContact O-N 3.15Å; A130-D132 PolarHBondContact O-N 2.88Å
131	K	31.1	Very low	29.3	Very low	198 Å²	198	131.7 Å²	131.7	86%	0.861	80%	0.796	S	S	*	*			trans	-69.4	123.8	161.1	-77.4	-179.5	175.6	176	0	108.5
132	D	28.6	Very low	29.3	Very low	166 Å²	166	132.3 Å²	132.3	89%	0.888	80%	0.797	S	S	*	*				-176.2	155.2	122	-97.3	-21.5	0	0	0	113.4	A130	A130-D132 PolarHBondContact O-N 2.88Å
133	G	27.7	Very low	28.7	Very low	71 Å²	71	126.3 Å²	126.3	73%	0.732	79%	0.786	S	S	*	*			trans	74.6	73.7	139.3	0	0	0	0	0	121
134	A	28.4	Very low	28.6	Very low	94 Å²	94	131 Å²	131	78%	0.777	79%	0.788	S	S	*	*			trans	39.2	139	134.9	0	0	0	0	0	123.3
135	S	29.7	Very low	28.4	Very low	105 Å²	105	128.1 Å²	128.1	73%	0.734	78%	0.776	S	S	*	*			trans	62.7	147	154.4	-87.4	0	0	0	0	118.8
136	E	29.6	Very low	28.4	Very low	159 Å²	159	129.4 Å²	129.4	74%	0.743	77%	0.774	S	S	*	*			cis	-163.3	159.1	-16	-134.8	170.7	157.1	0	0	109.1
137	T	26.9	Very low	28.5	Very low	116 Å²	116	125.6 Å²	125.6	71%	0.712	77%	0.769	S	S	*	*			trans	38.7	128.7	153.5	48.5	0	0	0	0	123.4
138	V	30.1	Very low	28.4	Very low	116 Å²	116	128.7 Å²	128.7	70%	0.703	77%	0.774	S	S	*	*				87.7	93.6	127.5	173.7	0	0	0	0	120.6
139	T	25	Very low	28.4	Very low	120 Å²	120	128.8 Å²	128.8	74%	0.736	77%	0.769	S	S	*	*			trans	65.2	154	132.4	68.4	0	0	0	0	124.4
140	S	28.6	Very low	28.5	Very low	111 Å²	111	128.1 Å²	128.1	78%	0.776	77%	0.766	S	S	*	*			trans	90.5	102.3	145.5	70.7	0	0	0	0	120.3
141	S	23.8	Very low	28.5	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	77%	0.769	S	S	*	*			trans	-64.7	159.2	137.2	-32.6	0	0	0	0	109.3
142	P	38.8	Very low	29	Very low	130 Å²	130	126.5 Å²	126.5	84%	0.844	77%	0.765	S	S	*	*			cis	-122.3	-179.9	35.7	26.9	-5.2	0	0	0	113.4
143	G	24.8	Very low	28.9	Very low	63 Å²	63	123.5 Å²	123.5	65%	0.649	76%	0.763	S	S	*	*			cis	122.1	143.6	4	0	0	0	0	0	112.1
144	Q	30.9	Very low	28.9	Very low	170 Å²	170	124.8 Å²	124.8	79%	0.794	77%	0.767	S	S	*	*			trans	70.2	150	-172.8	-54.5	-165.4	22	0	0	114
145	K	26.8	Very low	28.9	Very low	149 Å²	149	132.4 Å²	132.4	65%	0.648	78%	0.776	S	S	*	*			cis	-164.2	174.2	-9.3	-120.7	178.3	-173.7	171.6	0	111.1
146	D	27.1	Very low	28.9	Very low	137 Å²	137	136.9 Å²	136.9	73%	0.733	79%	0.785	S	S	*	*			trans	50.5	112.6	153.7	-49.9	-24.1	0	0	0	118.4
147	A	27.3	Very low	28.7	Very low	88 Å²	88	133.2 Å²	133.2	73%	0.727	79%	0.79	S	S	*	*				88.1	102	52	0	0	0	0	0	115.3
148	Q	28.5	Very low	28.8	Very low	181 Å²	181	133.6 Å²	133.6	85%	0.846	80%	0.797	S	S	*	*			trans	-169.1	121.9	142.1	-100.9	161.4	33.3	0	0	107.6
149	T	26.4	Very low	28.7	Very low	119 Å²	119	139.4 Å²	139.4	73%	0.73	81%	0.807	S	S	*	*				71.8	92.6	73.6	-54.8	0	0	0	0	113.5
150	Q	29	Very low	28.8	Very low	190 Å²	190	142.3 Å²	142.3	89%	0.888	81%	0.812	S	S	*	*			trans	-166.4	125.5	132.8	-108.3	150.4	105.6	0	0	114.5
151	V	30.3	Very low	29.1	Very low	138 Å²	138	143.6 Å²	143.6	84%	0.836	82%	0.815	S	S	*	*			trans	-122.3	139.7	157.7	179.8	0	0	0	0	102.1
152	P	41	Very low	29.3	Very low	119 Å²	119	144.9 Å²	144.9	77%	0.773	82%	0.818	S	S	*	*			cis	-145.8	174.3	44.4	43	-25	0	0	0	117.2
153	A	25.5	Very low	28.9	Very low	103 Å²	103	142.7 Å²	142.7	85%	0.851	82%	0.819	S	S	*	*				-172.6	141.1	123.5	0	0	0	0	0	110.3
154	A	29.6	Very low	29.1	Very low	98 Å²	98	143.2 Å²	143.2	81%	0.81	82%	0.824	S	S	*	*			trans	-105.5	156.7	-179.8	0	0	0	0	0	112.4
155	R	27.5	Very low	29.2	Very low	254 Å²	254	143.2 Å²	143.2	96%	0.958	83%	0.827	S	S	*	*			trans	-141.9	139.4	148.6	-107.2	-178.5	-177.2	-165.4	-1	110.7
156	Q	29.8	Very low	29.5	Very low	200 Å²	200	141.5 Å²	141.5	94%	0.935	83%	0.83	S	S	*	*			trans	-85	150.9	-177.7	-65.2	163.1	-48.1	0	0	111.1
157	G	26.1	Very low	29.8	Very low	82 Å²	82	140 Å²	140	85%	0.845	83%	0.826	S	S	*	*			trans	-150.2	101.5	165.5	0	0	0	0	0	109
158	S	27.5	Very low	30	Very low	123 Å²	123	142.4 Å²	142.4	86%	0.86	83%	0.825	S	S	*	*			trans	-86.9	137.3	-178.4	-173.7	0	0	0	0	111.2
159	R	28.5	Very low	30.3	Very low	239 Å²	239	139.8 Å²	139.8	90%	0.902	82%	0.822	S	S	*	*			trans	-154.8	152	155.4	-150.6	164.7	-176.7	169.1	-0.2	111.7
160	E	27.7	Very low	30.6	Very low	180 Å²	180	140.8 Å²	140.8	84%	0.841	82%	0.818	S	S	*	*			trans	-85.2	169.7	-165.5	-66.6	152.9	108.1	0	0	115.1
161	V	33.3	Very low	30.6	Very low	138 Å²	138	137.2 Å²	137.2	84%	0.836	81%	0.814	S	S	*	*			trans	-78.1	134.3	178.7	173.7	0	0	0	0	112
162	T	28.9	Very low	30.6	Very low	142 Å²	142	138.4 Å²	138.4	87%	0.871	81%	0.808	S	S	*	*			trans	-141	139.5	149.5	40.9	0	0	0	0	111
163	G	30.4	Very low	30.2	Very low	83 Å²	83	136.3 Å²	136.3	86%	0.856	80%	0.797	S	S	*	*			trans	-69.6	162	-161.7	0	0	0	0	0	118.4
164	G	29	Very low	30.5	Very low	75 Å²	75	139.5 Å²	139.5	77%	0.773	80%	0.799	S	S	*	*			trans	-177.1	90.6	172.2	0	0	0	0	0	111
165	M	32.4	Very low	30.7	Very low	170 Å²	170	143.8 Å²	143.8	84%	0.837	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-81.6	129.9	177.2	-69.8	172.6	59.5	0	0	111.5	V167	M165-V167 HydrophobicContact CE-CG2 4.44Å
166	P	34.4	Very low	30.9	Very low	112 Å²	112	135 Å²	135	73%	0.727	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-83.9	121.6	151.1	32	-27.6	0	0	0	109.3
167	V	31.9	Very low	31.1	Very low	107 Å²	107	133.1 Å²	133.1	65%	0.648	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-84	119.9	170.6	174.3	0	0	0	0	108.4	M165 T169	M165-V167 HydrophobicContact CE-CG2 4.44Å; V167-T169 HydrophobicContact CG1-CG2 3.86Å
168	I	32.3	Very low	31.3	Very low	137 Å²	137	138 Å²	138	70%	0.703	79%	0.785	S	S	*	*			trans	-96.4	98.3	174.6	-56.9	178.7	0	0	0	109	E170	I168-E170 HydrophobicContact CG2-CB 4.47Å
169	T	34	Very low	31.5	Very low	127 Å²	127	142.8 Å²	142.8	78%	0.779	79%	0.786	S	S	*	*			trans	-99.1	66.7	172.8	44.1	0	0	0	0	111.2	V167	V167-T169 HydrophobicContact CG1-CG2 3.86Å
170	E	33.5	Very low	31.6	Very low	140 Å²	140	140.4 Å²	140.4	65%	0.654	79%	0.785	S	S	*	*			trans	-126.9	133.8	174.3	-65.7	-163.7	159.1	0	0	111.8	I168 F172	I168-E170 HydrophobicContact CG2-CB 4.47Å; E170-F172 HydrophobicContact CB-CE2 4.39Å; E170-F172 HydrophobicContact CB-CZ 4.08Å
171	S	30	Very low	31.8	Very low	114 Å²	114	138.3 Å²	138.3	80%	0.797	79%	0.785	S	S	*	*			trans	-112.9	94.5	-174.7	59	0	0	0	0	110.8	S173	S171-S173 PolarHBondContact O-N 3.39Å
172	F	29	Very low	31.7	Very low	163 Å²	163	138.5 Å²	138.5	72%	0.715	79%	0.787	S	S	*	*			trans	-67.7	124.2	-179.7	-55.3	-75.9	0	0	0	111.5	E170	E170-F172 HydrophobicContact CB-CE2 4.39Å; E170-F172 HydrophobicContact CB-CZ 4.08Å
173	S	33.3	Very low	31.8	Very low	76 Å²	76	141.1 Å²	141.1	53%	0.531	79%	0.786	S	S	.	*			trans	-126.1	104.6	166.4	-70.3	0	0	0	0	107.7	R89 S171	R89-S173 PolarHBondContact NH2-OG 2.88Å; R89-S173 VanDerWaalsContact NH2-OG 3.17Å; S171-S173 PolarHBondContact O-N 3.39Å
174	L	32.2	Very low	31.9	Very low	170 Å²	170	144.7 Å²	144.7	89%	0.89	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-90.2	139.4	-179.6	-71.2	172.1	0	0	0	111
175	H	32.3	Very low	31.8	Very low	187 Å²	187	146.9 Å²	146.9	87%	0.866	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-74.7	161.4	179.2	-103.8	57.2	0	0	0	112.4
176	G	32.6	Very low	31.8	Very low	69 Å²	69	145.3 Å²	145.3	71%	0.711	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-63.4	144.2	176.7	0	0	0	0	0	113	Q178	G176-Q178 PolarHBondContact O-N 2.97Å
177	I	33.9	Very low	31.6	Very low	161 Å²	161	144.7 Å²	144.7	83%	0.826	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-69.2	122.3	179.9	-55.8	168.6	0	0	0	109.3
178	Q	30.4	Very low	31.6	Very low	186 Å²	186	147.5 Å²	147.5	87%	0.869	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-74.7	136.9	171.2	-73.4	179.4	-41.8	0	0	110.6	G176	G176-Q178 PolarHBondContact O-N 2.97Å
179	Y	32.1	Very low	31.8	Very low	222 Å²	222	146.3 Å²	146.3	87%	0.871	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-93.3	120.2	164.6	-96.8	-103.1	0	0	0	108.7
180	E	30.6	Very low	32.2	Very low	190 Å²	190	147.2 Å²	147.2	89%	0.888	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-74.9	130	167.4	-68.8	-173.1	115.5	0	0	110.4
181	T	30.9	Very low	32.8	Very low	135 Å²	135	148.7 Å²	148.7	83%	0.828	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-102.3	119.9	164.5	37.6	0	0	0	0	109.3	K183	T181-K183 PolarHBondContact O-N 3.46Å; T181-K183 VanDerWaalsContact O-N 3.17Å
182	T	32.3	Very low	33.7	Very low	143 Å²	143	152 Å²	152	88%	0.877	81%	0.811	S	S	*	*			trans	-63.1	114.7	-176.9	32	0	0	0	0	111.6	I184	T182-I184 PolarHBondContact O-N 3.17Å
183	K	31.1	Very low	34.5	Very low	196 Å²	196	152.3 Å²	152.3	85%	0.852	82%	0.82	S	S	*	*			trans	-82.4	114.2	178.2	-145.8	178.6	-173	-174.9	0	109.4	T181 T185	T181-K183 PolarHBondContact O-N 3.46Å; T181-K183 VanDerWaalsContact O-N 3.17Å; K183-T185 PolarHBondContact O-N 3.34Å
184	I	31.2	Very low	34.7	Very low	158 Å²	158	156 Å²	156	81%	0.81	83%	0.834	S	S	*	*			trans	-75	123.6	168.4	-63.5	175.1	0	0	0	107.8	T182	T182-I184 PolarHBondContact O-N 3.17Å
185	T	27.4	Very low	35.1	Very low	121 Å²	121	155.7 Å²	155.7	74%	0.742	83%	0.833	S	S	*	*			trans	-87.9	120.3	175.6	49.7	0	0	0	0	110.9	K183	K183-T185 PolarHBondContact O-N 3.34Å
186	V	31.8	Very low	35.4	Very low	137 Å²	137	151.9 Å²	151.9	83%	0.83	82%	0.823	S	S	*	*			trans	-125.9	123.3	152.2	179.5	0	0	0	0	105.8
187	S	30.7	Very low	35.4	Very low	100 Å²	100	156.1 Å²	156.1	70%	0.699	83%	0.827	S	S	*	*			trans	-110.4	134.4	172.9	-54.2	0	0	0	0	108
188	D	32	Very low	35.1	Very low	166 Å²	166	157 Å²	157	89%	0.888	83%	0.826	S	S	*	*			trans	-173.1	165.7	135	-111.6	-14.8	0	0	0	111.8
189	S	35.8	Very low	35	Very low	112 Å²	112	154.1 Å²	154.1	78%	0.783	83%	0.825	S	S	*	*			trans	74.6	115.9	175.3	-152.4	0	0	0	0	116.9
190	D	43	Very low	34.9	Very low	146 Å²	146	148.9 Å²	148.9	78%	0.781	82%	0.82	S	S	*	*			trans	-72.5	159.8	164.7	-39.3	-92.9	0	0	0	111.6
191	D	45.6	Very low	34.9	Very low	170 Å²	170	148 Å²	148	91%	0.909	82%	0.816	S	S	*	*			trans	-164.9	145.8	132.6	-100.1	-32.3	0	0	0	107.8
192	E	49.2	Very low	35	Very low	184 Å²	184	149.1 Å²	149.1	86%	0.86	82%	0.816	S	S	*	*			trans	-96.2	150.2	-177.4	-58.1	-167.4	128.1	0	0	112.1
193	D	46.2	Very low	35.1	Very low	169 Å²	169	147.2 Å²	147.2	90%	0.904	80%	0.804	S	S	*	*			trans	-171.7	153.1	138.9	-102.5	-27.2	0	0	0	110.7
194	D	37.7	Very low	35.3	Very low	154 Å²	154	143 Å²	143	82%	0.824	80%	0.796	S	S	*	*			trans	-69.2	148	-179.2	-76.7	-68.3	0	0	0	113.7
195	D	40.1	Very low	35.5	Very low	163 Å²	163	141.7 Å²	141.7	87%	0.872	80%	0.798	S	S	*	*			trans	-156.4	146.3	130.9	-134.2	-24.1	0	0	0	113.9
196	V	39.3	Very low	35.8	Very low	108 Å²	108	145.7 Å²	145.7	66%	0.655	81%	0.805	S	S	*	*			trans	-92.2	116	-168.1	177.1	0	0	0	0	112.5	F198	V196-F198 HydrophobicContact CG1-CD2 4.37Å; V196-F198 HydrophobicContact CG1-CE2 4.33Å
197	I	31.9	Very low	35.6	Very low	158 Å²	158	148.7 Å²	148.7	81%	0.81	81%	0.81	S	S	*	*			trans	-90.7	113.7	170	-59.9	-178	0	0	0	110.4	C199	I197-C199 PolarHBondContact O-N 3.1Å
198	F	28.7	Very low	35.4	Very low	179 Å²	179	149.8 Å²	149.8	79%	0.785	82%	0.816	S	S	*	*			trans	-68.9	120.5	171.8	-81.9	-101.6	0	0	0	111.7	V196	V196-F198 HydrophobicContact CG1-CD2 4.37Å; V196-F198 HydrophobicContact CG1-CE2 4.33Å
199	C	27.2	Very low	35.1	Very low	126 Å²	126	148.1 Å²	148.1	85%	0.851	81%	0.812	S	S	*	*			trans	-75.6	125.4	164.4	-61.9	0	0	0	0	110.5	I197	I197-C199 PolarHBondContact O-N 3.1Å
200	S	31.4	Very low	34.7	Very low	111 Å²	111	152 Å²	152	78%	0.776	82%	0.815	S	S	*	*			trans	-112.8	96.4	166.7	-72.5	0	0	0	0	109.3
201	E	28.7	Very low	33.9	Very low	173 Å²	173	153.1 Å²	153.1	81%	0.808	82%	0.821	S	S	*	*			trans	-69.2	131.7	175.5	-173.6	-179.2	169.1	0	0	110.6	V203	E201-V203 HydrophobicContact CG-CG2 4.21Å
202	I	32.8	Very low	33.1	Very low	158 Å²	158	151.1 Å²	151.1	81%	0.81	82%	0.815	S	S	*	*			trans	-115.1	96.3	177.8	-58	-179.7	0	0	0	109
203	V	34.9	Very low	32.1	Very low	103 Å²	103	148 Å²	148	62%	0.624	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-79.9	133.3	173.5	-178.9	0	0	0	0	109.4	E201	E201-V203 HydrophobicContact CG-CG2 4.21Å
204	P	36	Very low	31.1	Very low	107 Å²	107	144.6 Å²	144.6	70%	0.695	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-71.9	143.5	179.3	29	-35	0	0	0	112.1
205	P	34.2	Very low	30.6	Very low	130 Å²	130	141.6 Å²	141.6	84%	0.844	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-71.9	140.4	179.7	30	-34.7	0	0	0	111.7
206	K	34.3	Very low	30	Very low	205 Å²	205	140 Å²	140	89%	0.891	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-98.3	147.1	162	-76	-175.4	175.8	179.8	0	110.1
207	E	27.5	Very low	29.5	Very low	201 Å²	201	142.2 Å²	142.2	94%	0.939	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-65.2	150.7	168.7	-59.4	174.6	127.9	0	0	110.7
208	C	26.1	Very low	29.2	Very low	123 Å²	123	141.6 Å²	141.6	83%	0.831	80%	0.803	S	S	*	*			trans	-138.1	127.9	166.4	-168.9	0	0	0	0	108.9
209	T	26.8	Very low	29.2	Very low	131 Å²	131	141.7 Å²	141.7	80%	0.804	81%	0.806	S	S	*	*			trans	-71.6	158.8	175.9	41.2	0	0	0	0	111.4
210	K	26.6	Very low	29.7	Very low	194 Å²	194	140.9 Å²	140.9	84%	0.843	80%	0.799	S	S	*	*			trans	-85.8	148.9	172.1	-61.2	174.9	-177.8	173.7	0	109.8
211	D	27.3	Very low	29.4	Very low	168 Å²	168	141.2 Å²	141.2	90%	0.898	80%	0.8	S	S	*	*			trans	-139.1	157.9	156.8	-114.3	-45.5	0	0	0	110.2
212	T	28.6	Very low	29.9	Very low	129 Å²	129	139 Å²	139	79%	0.791	80%	0.801	S	S	*	*			trans	-130.9	131.7	-159.7	-58.7	0	0	0	0	114.2
213	S	27.7	Very low	29.5	Very low	117 Å²	117	136.7 Å²	136.7	82%	0.818	80%	0.799	S	S	*	*			trans	-174.6	151.5	157.7	42.2	0	0	0	0	110
214	A	26	Very low	30.2	Very low	98 Å²	98	137.5 Å²	137.5	81%	0.81	81%	0.806	S	S	*	*			cis	-155.3	178.2	-19.8	0	0	0	0	0	109.4
215	A	27.1	Very low	29.8	Very low	91 Å²	91	137.5 Å²	137.5	75%	0.752	82%	0.815	S	S	*	*			trans	-55.8	159.5	-174.7	0	0	0	0	0	114.9
216	T	26.4	Very low	29.4	Very low	129 Å²	129	134.7 Å²	134.7	79%	0.791	81%	0.809	S	S	*	*				-167.7	155.2	77.7	-62.9	0	0	0	0	114
217	Q	29.5	Very low	29.2	Very low	156 Å²	156	131.5 Å²	131.5	73%	0.729	81%	0.807	S	S	*	*			trans	-50	146.3	178.7	-50.7	158.5	-11.2	0	0	116.8
218	N	26.5	Very low	29.3	Very low	144 Å²	144	126.5 Å²	126.5	77%	0.77	79%	0.794	S	S	*	*				176.4	163.1	92.9	-100.2	-58.4	0	0	0	116
219	Q	28.7	Very low	29.6	Very low	181 Å²	181	126.6 Å²	126.6	85%	0.846	79%	0.786	S	S	*	*			trans	-83.2	-179.5	169.5	-97.4	-170.6	8.5	0	0	111.9
220	P	37.5	Very low	30	Very low	110 Å²	110	127.3 Å²	127.3	71%	0.714	78%	0.781	S	S	*	*			cis	-131.4	-179.1	6.5	40.2	-22.5	0	0	0	116.2
221	C	24.3	Very low	30.1	Very low	117 Å²	117	126.7 Å²	126.7	79%	0.791	78%	0.778	S	S	*	*			trans	-78.2	159.9	163.7	-61.1	0	0	0	0	111.7
222	P	38.5	Very low	30.2	Very low	126 Å²	126	123.7 Å²	123.7	82%	0.818	77%	0.77	S	S	*	*				-145.1	163.7	96.6	39	-24.7	0	0	0	116.4
223	S	25.8	Very low	30.1	Very low	110 Å²	110	123.1 Å²	123.1	77%	0.769	77%	0.77	S	S	*	*			trans	-82.3	-172.9	170.7	-37	0	0	0	0	111.7
224	P	49.8	Very low	30.2	Very low	121 Å²	121	120.6 Å²	120.6	79%	0.786	76%	0.763	S	S	*	*			cis	-143.1	-167.1	1.3	43.4	-23.3	0	0	0	117
225	A	26.2	Very low	30.7	Very low	107 Å²	107	122.2 Å²	122.2	88%	0.884	77%	0.768	S	S	*	*			trans	82.4	152.8	156.7	0	0	0	0	0	120.2
226	G	26.3	Very low	30.8	Very low	70 Å²	70	122 Å²	122	72%	0.722	78%	0.775	S	S	*	*			trans	-168	-64	-174.3	0	0	0	0	0	119.1
227	V	29.5	Very low	30.8	Very low	138 Å²	138	119.7 Å²	119.7	84%	0.836	78%	0.777	S	S	*	*			trans	72.6	156.5	175.3	-149.1	0	0	0	0	118.5
228	S	30.1	Very low	31	Very low	96 Å²	96	118.1 Å²	118.1	67%	0.671	78%	0.782	S	S	*	*			trans	79.3	141	156.6	-75.2	0	0	0	0	120.6
229	D	32.2	Very low	32.1	Very low	125 Å²	125	117.5 Å²	117.5	67%	0.668	79%	0.787	S	S	*	*			cis	-165.2	170	-9.3	-130.5	-65.3	0	0	0	115.6
230	Q	36.3	Very low	32.3	Very low	147 Å²	147	116.3 Å²	116.3	69%	0.687	79%	0.785	S	S	*	*			trans	66.1	145.5	160.6	-75.1	180	76.2	0	0	120.2
231	K	27.6	Very low	32.9	Very low	181 Å²	181	116.3 Å²	116.3	79%	0.787	79%	0.785	S	S	*	*			cis	-154.9	157.2	1.3	-145.5	167	-171.3	146.4	0	114.9
232	S	28.9	Very low	33.2	Very low	104 Å²	104	116.7 Å²	116.7	73%	0.727	78%	0.784	S	S	*	*			trans	-53.8	163.3	177.5	-157.6	0	0	0	0	116.6
233	C	26.7	Very low	32.8	Very low	118 Å²	118	116.1 Å²	116.1	80%	0.797	78%	0.783	S	S	*	*			cis	-139.5	-178.2	17.9	-47	0	0	0	0	111.6
234	G	30.2	Very low	32.9	Very low	64 Å²	64	115.2 Å²	115.2	66%	0.66	78%	0.776	S	S	*	*			cis	100.4	143.1	-0.3	0	0	0	0	0	115.6
235	S	37.3	Very low	31.9	Very low	132 Å²	132	115.8 Å²	115.8	92%	0.923	78%	0.778	S	S	*	*			cis	-170.7	146.5	-6.7	-71.1	0	0	0	0	112.5
236	G	27.9	Very low	32.1	Very low	87 Å²	87	114.5 Å²	114.5	90%	0.897	77%	0.768	S	S	*	*			trans	133.4	141.8	154.4	0	0	0	0	0	117.8
237	G	26.7	Very low	32.2	Very low	80 Å²	80	116.5 Å²	116.5	83%	0.825	77%	0.766	S	S	*	*			cis	-177.5	167	-4.8	0	0	0	0	0	113.8
238	S	33.8	Very low	32.3	Very low	122 Å²	122	117.9 Å²	117.9	85%	0.853	76%	0.763	S	S	*	*			trans	-113.6	176.3	-178.2	-48.2	0	0	0	0	112.8
239	P	49.1	Very low	32.1	Very low	132 Å²	132	121.2 Å²	121.2	86%	0.857	77%	0.766	S	S	*	*				-149.5	176.2	109.4	38.9	-22.5	0	0	0	116.8
240	L	32.9	Very low	31.9	Very low	155 Å²	155	120.8 Å²	120.8	81%	0.812	77%	0.767	S	S	*	*			trans	-127.2	163.6	174.3	-166.2	89.6	0	0	0	109.8
241	P	51	Low	31.3	Very low	110 Å²	110	120 Å²	120	71%	0.714	77%	0.773	S	S	*	*			trans	-137.8	129.3	132.3	15	7.4	0	0	0	113.7
242	T	30.1	Very low	31.2	Very low	126 Å²	126	115.8 Å²	115.8	77%	0.773	77%	0.766	S	S	*	*				59.8	142.3	90.7	67.4	0	0	0	0	116.6
243	S	29.9	Very low	31	Very low	113 Å²	113	116.5 Å²	116.5	79%	0.79	77%	0.771	S	S	*	*			cis	-142.6	-153.3	4.4	53.1	0	0	0	0	109.3
244	S	27.3	Very low	31	Very low	91 Å²	91	114.8 Å²	114.8	64%	0.636	77%	0.766	S	S	*	*			cis	-159.6	137.7	1	44.6	0	0	0	0	108.2
245	T	28.7	Very low	30.8	Very low	133 Å²	133	119.5 Å²	119.5	82%	0.816	78%	0.776	S	S	*	*				50.3	134.4	81.1	41.6	0	0	0	0	117.3
246	A	31.1	Very low	30.4	Very low	81 Å²	81	121.7 Å²	121.7	67%	0.669	77%	0.771	S	S	*	*			cis	-155.6	-146.4	-8.5	0	0	0	0	0	109.8
247	T	27.8	Very low	30.3	Very low	111 Å²	111	125.4 Å²	125.4	68%	0.681	77%	0.77	S	S	*	*			cis	-169	128.7	14	-18.8	0	0	0	0	112.7
248	Q	32.8	Very low	30.2	Very low	168 Å²	168	126.8 Å²	126.8	79%	0.785	77%	0.767	S	S	*	*			trans	59	158.4	139.8	-74.9	-174.2	53	0	0	122.3
249	K	26	Very low	30.4	Very low	165 Å²	165	127.6 Å²	127.6	72%	0.717	77%	0.769	S	S	*	*			cis	-171.5	132.6	-11.6	162.7	-178.7	175.9	-174.1	0	113.3
250	V	26.7	Very low	29.3	Very low	117 Å²	117	127.6 Å²	127.6	71%	0.709	76%	0.762	S	S	*	*			trans	19.3	127.1	141.6	-162.9	0	0	0	0	121.5
251	T	24.4	Very low	29.1	Very low	130 Å²	130	127.7 Å²	127.7	80%	0.798	76%	0.758	S	S	*	*				156.1	163.9	128.1	38.2	0	0	0	0	112.6
252	S	26.5	Very low	27.9	Very low	92 Å²	92	127.3 Å²	127.3	64%	0.643	75%	0.754	S	S	*	*				-175.1	149.1	-52.7	53.8	0	0	0	0	112.3
253	S	24.9	Very low	27.8	Very low	120 Å²	120	129.6 Å²	129.6	84%	0.839	76%	0.756	S	S	*	*			trans	69.7	164.8	166.5	-56.6	0	0	0	0	118
254	A	26.3	Very low	27.5	Very low	82 Å²	82	128.8 Å²	128.8	68%	0.678	75%	0.75	S	S	*	*			cis	-171	169.3	-32.9	0	0	0	0	0	110.8
255	N	26.3	Very low	27.5	Very low	163 Å²	163	130.2 Å²	130.2	87%	0.872	76%	0.76	S	S	*	*			trans	80	144.2	160.5	-70.1	-6.6	0	0	0	123
256	Q	28.3	Very low	27.4	Very low	177 Å²	177	128.4 Å²	128.4	83%	0.827	76%	0.759	S	S	*	*			trans	-64	163.2	-175	-44.9	179.2	41.3	0	0	116.8
257	L	25.2	Very low	27.1	Very low	166 Å²	166	132.2 Å²	132.2	87%	0.869	76%	0.763	S	S	*	*				-174.6	156.5	118.6	-102.6	161	0	0	0	112.8
258	S	25.2	Very low	26.9	Very low	109 Å²	109	132.4 Å²	132.4	76%	0.762	77%	0.768	S	S	*	*			trans	-127.6	149.7	170.5	-54	0	0	0	0	110.6
259	P	38.3	Very low	27	Very low	138 Å²	138	129.2 Å²	129.2	90%	0.896	76%	0.762	S	S	*	*			trans	-133.7	-169.1	148.8	37	-22.4	0	0	0	112.8
260	N	25	Very low	27	Very low	133 Å²	133	127.6 Å²	127.6	71%	0.711	77%	0.766	S	S	*	*			trans	-124.6	154.2	-146.5	-156.5	-12.7	0	0	0	114.1
261	Q	28.6	Very low	26.9	Very low	157 Å²	157	128 Å²	128	73%	0.734	77%	0.774	S	S	*	*			trans	76.7	134	143	-111.9	172.9	78.9	0	0	124.3
262	T	25.9	Very low	27	Very low	102 Å²	102	126.8 Å²	126.8	63%	0.626	77%	0.771	S	S	*	*			trans	111.6	116.6	130.8	-62.2	0	0	0	0	122.1
263	Q	27.6	Very low	27	Very low	173 Å²	173	128.8 Å²	128.8	81%	0.808	78%	0.779	S	S	*	*			trans	76	99.6	149.2	-80.3	168.1	15.1	0	0	124.9
264	S	24.8	Very low	27.6	Very low	97 Å²	97	128 Å²	128	68%	0.678	77%	0.772	S	S	*	*				69.2	131.9	115.7	69.3	0	0	0	0	124.5
265	S	26.1	Very low	27.7	Very low	121 Å²	121	132.5 Å²	132.5	85%	0.846	78%	0.778	S	S	*	*			trans	70.8	135.6	151.4	-56.9	0	0	0	0	118.3
266	A	26.6	Very low	27.7	Very low	95 Å²	95	132.8 Å²	132.8	79%	0.785	77%	0.774	S	S	*	*			cis	-163.4	-175.6	-11.4	0	0	0	0	0	107.4
267	E	25.1	Very low	27.6	Very low	161 Å²	161	131.4 Å²	131.4	75%	0.752	77%	0.772	S	S	*	*			cis	-158.5	163	2.4	-156	-147	92.6	0	0	109.6
268	S	24	Very low	27.7	Very low	114 Å²	114	129.5 Å²	129.5	80%	0.797	77%	0.767	S	S	*	*			trans	-173.4	153.6	146.1	18.1	0	0	0	0	111.5
269	P	35.5	Very low	28.4	Very low	101 Å²	101	129.1 Å²	129.1	66%	0.656	76%	0.762	S	S	*	*			trans	-126.1	171.1	-164.1	42.9	-29.6	0	0	0	117.3
270	V	25.4	Very low	27.9	Very low	132 Å²	132	129 Å²	129	80%	0.8	75%	0.754	S	S	*	*			trans	73.4	114.6	163.9	-163.9	0	0	0	0	118.7
271	S	23.8	Very low	27.9	Very low	125 Å²	125	129.3 Å²	129.3	87%	0.874	75%	0.754	S	S	*	*			trans	-136	149.5	135.6	70.8	0	0	0	0	108.8
272	S	27.1	Very low	28	Very low	104 Å²	104	129 Å²	129	73%	0.727	76%	0.756	S	S	*	*			trans	-146.1	121.5	-174.3	57	0	0	0	0	112.7
273	T	26.5	Very low	27.9	Very low	135 Å²	135	131 Å²	131	83%	0.828	76%	0.762	S	S	*	*			trans	-83.2	-171.9	162.8	55.2	0	0	0	0	108.6
274	P	38.4	Very low	27.8	Very low	104 Å²	104	130.5 Å²	130.5	68%	0.675	76%	0.764	S	S	*	*			cis	-150	-166.4	15.6	32.1	-3.5	0	0	0	118.1
275	Q	28.3	Very low	28.1	Very low	176 Å²	176	131.6 Å²	131.6	82%	0.822	76%	0.762	S	S	*	*			trans	89.5	88.4	153.9	-54	-170.9	-3.6	0	0	122
276	H	26	Very low	28.4	Very low	168 Å²	168	134.3 Å²	134.3	78%	0.778	76%	0.761	S	S	*	*				40.4	116.7	100.5	-164.6	-105.2	0	0	0	120.6
277	L	26.9	Very low	28.7	Very low	148 Å²	148	133.6 Å²	133.6	78%	0.775	76%	0.756	S	S	*	*				175.4	156	123.6	-95.5	170.9	0	0	0	113.9
278	T	27.3	Very low	30.1	Very low	126 Å²	126	131.1 Å²	131.1	77%	0.773	75%	0.754	S	S	*	*			trans	-106.9	179.5	167.2	54.4	0	0	0	0	109.3
279	P	39.8	Very low	30.3	Very low	101 Å²	101	132.7 Å²	132.7	66%	0.656	75%	0.752	S	S	*	*			cis	-145.6	-174.1	12	44.7	-24.5	0	0	0	118.3
280	N	26.9	Very low	29.9	Very low	137 Å²	137	134.5 Å²	134.5	73%	0.733	76%	0.757	S	S	*	*			trans	72.2	123.9	144.8	-75	-16.6	0	0	0	125.1
281	I	26.4	Very low	29.9	Very low	138 Å²	138	133 Å²	133	71%	0.708	76%	0.758	S	S	*	*			trans	78.9	108.7	130.3	-63.2	172.8	0	0	0	121.3
282	I	29.9	Very low	30	Very low	152 Å²	152	132.5 Å²	132.5	78%	0.779	76%	0.755	S	S	*	*			trans	40.4	122.3	133.5	-50.4	172.4	0	0	0	120.3
283	L	24	Very low	31	Very low	144 Å²	144	132.9 Å²	132.9	75%	0.754	75%	0.754	S	S	*	*				-175.8	142.9	119.2	-164.6	64	0	0	0	114
284	L	24.5	Very low	31.1	Very low	161 Å²	161	131.5 Å²	131.5	84%	0.843	75%	0.75	S	S	*	*			trans	-168.6	138.5	150.1	-119.3	122.7	0	0	0	110.2
285	N	32.3	Very low	30.6	Very low	121 Å²	121	134.6 Å²	134.6	65%	0.647	76%	0.759	S	S	*	*			cis	-167	174.4	-24.5	-150.1	-10.8	0	0	0	112.9
286	Q	32.3	Very low	30.5	Very low	177 Å²	177	130.8 Å²	130.8	83%	0.827	75%	0.752	S	S	*	*			trans	79.4	156.3	165	-64.2	-177.1	113.4	0	0	117.3
287	A	32.6	Very low	30.8	Very low	81 Å²	81	127.8 Å²	127.8	67%	0.669	75%	0.75	S	S	*	*			cis	179.1	175.6	-22.7	0	0	0	0	0	108.9
288	P	55.2	Low	31.2	Very low	109 Å²	109	124.6 Å²	124.6	71%	0.708	74%	0.74	S	S	*	*			cis	-129.7	178.1	-38	28.9	-9	0	0	0	112.8
289	L	27.6	Very low	31.5	Very low	147 Å²	147	126 Å²	126	77%	0.77	74%	0.738	S	S	*	*				168	146.5	112.4	-86.7	178.9	0	0	0	115.1
290	N	26.3	Very low	31.2	Very low	139 Å²	139	128.2 Å²	128.2	74%	0.743	74%	0.739	S	S	*	*			trans	69.2	90.2	153.1	-65.4	-5.5	0	0	0	122.9
291	A	26.5	Very low	31.2	Very low	99 Å²	99	127.5 Å²	127.5	82%	0.818	74%	0.74	S	S	*	*				89	139.8	108.8	0	0	0	0	0	122.2
292	S	24.5	Very low	31.3	Very low	116 Å²	116	127.8 Å²	127.8	81%	0.811	74%	0.743	S	S	*	*			trans	-104.1	-163.2	-171.6	-34.7	0	0	0	0	110.7
293	P	49.7	Very low	31.4	Very low	111 Å²	111	126.6 Å²	126.6	72%	0.721	74%	0.742	S	S	*	*			cis	-144.7	160.7	7.9	44.6	-24.9	0	0	0	120.3
294	S	27.8	Very low	32.8	Very low	106 Å²	106	125 Å²	125	74%	0.741	74%	0.741	S	S	*	*			trans	37.1	145.3	137.3	71.4	0	0	0	0	125.1
295	I	28.8	Very low	34.5	Very low	169 Å²	169	122.3 Å²	122.3	87%	0.867	73%	0.733	S	S	*	*			trans	-152.9	160.1	130.2	-106.8	158.9	0	0	0	111.3
296	S	25.6	Very low	34.5	Very low	96 Å²	96	122.3 Å²	122.3	67%	0.671	74%	0.737	S	S	*	*			trans	-47.7	151.3	-174.4	-47.2	0	0	0	0	117.4
297	S	32.3	Very low	34.7	Very low	106 Å²	106	120.3 Å²	120.3	74%	0.741	73%	0.731	S	S	*	*				72.1	143.9	56.9	121.2	0	0	0	0	114.2
298	S	35.2	Very low	34.6	Very low	80 Å²	80	122.7 Å²	122.7	56%	0.559	73%	0.732	S	S	*	*			cis	179.2	164.1	-3.2	41.9	0	0	0	0	113
299	H	33.9	Very low	33.4	Very low	157 Å²	157	124 Å²	124	73%	0.727	73%	0.732	S	S	*	*			trans	71.7	159.7	158.6	-58.2	-57.2	0	0	0	119.5
300	Q	32.4	Very low	33.4	Very low	147 Å²	147	123.5 Å²	123.5	69%	0.687	73%	0.73	S	S	*	*			cis	-171.5	141	-24.4	-108.2	175.9	-13.7	0	0	112.8
301	T	27.3	Very low	33.7	Very low	121 Å²	121	124.2 Å²	124.2	74%	0.742	73%	0.729	S	S	*	*			trans	61	170	148.1	70	0	0	0	0	119.3
302	N	28.6	Very low	33.6	Very low	144 Å²	144	126.9 Å²	126.9	77%	0.77	72%	0.724	S	S	*	*			cis	-161.9	-178.5	-1.7	-136.6	-24.4	0	0	0	112.7
303	V	32.1	Very low	33.7	Very low	127 Å²	127	127 Å²	127	77%	0.77	72%	0.716	S	S	*	*			trans	87.1	137.5	158.9	-158.2	0	0	0	0	121.3
304	P	54.3	Low	32.6	Very low	112 Å²	112	130.1 Å²	130.1	73%	0.727	72%	0.721	S	S	*	*			trans	-121.4	-148.3	172.4	47	-34.6	0	0	0	112.7
305	P	58.8	Low	32.5	Very low	103 Å²	103	133.4 Å²	133.4	67%	0.669	73%	0.725	S	S	*	*			cis	-130.9	-161.7	-30.2	37.8	-17	0	0	0	115
306	T	33.4	Very low	33	Very low	121 Å²	121	130.6 Å²	130.6	74%	0.742	72%	0.717	S	S	*	*			trans	74.3	157.5	155.4	49.2	0	0	0	0	122
307	I	36.2	Very low	33.1	Very low	136 Å²	136	130.2 Å²	130.2	70%	0.697	72%	0.715	S	S	*	*			cis	-175.5	165.4	-25.3	-159.5	173.7	0	0	0	113.2
308	N	30.4	Very low	32.8	Very low	130 Å²	130	134.1 Å²	134.1	70%	0.695	72%	0.719	S	S	*	*			trans	75.4	163.4	159.1	-73.3	-18.1	0	0	0	120.9
309	L	30.2	Very low	32.3	Very low	136 Å²	136	138.2 Å²	138.2	71%	0.712	73%	0.726	S	S	*	*			cis	-156.6	135.5	11.3	-158	76.9	0	0	0	115.1
310	L	28.2	Very low	32.1	Very low	137 Å²	137	138.2 Å²	138.2	72%	0.717	73%	0.726	S	S	*	*			trans	51.1	-175.8	155.7	-62.1	167.2	0	0	0	120.4
311	E	31.5	Very low	31.8	Very low	154 Å²	154	137 Å²	137	72%	0.72	73%	0.734	S	S	*	*			cis	-162.5	167.8	12.7	-166.2	51.5	-77.8	0	0	115.5
312	E	24.8	Very low	31.8	Very low	155 Å²	155	138.8 Å²	138.8	72%	0.724	74%	0.738	S	S	*	*			trans	73.1	112.5	156.3	-109	-155.3	91	0	0	127.9
313	N	25.4	Very low	32.8	Very low	120 Å²	120	136.4 Å²	136.4	64%	0.642	73%	0.731	S	S	*	*				88.6	141.3	123.8	-119.4	-19.8	0	0	0	129.4
314	Q	27.1	Very low	32.6	Very low	176 Å²	176	138.2 Å²	138.2	82%	0.822	73%	0.731	S	S	*	*			trans	80.1	150.2	152.6	-85.3	170.4	85.4	0	0	125.8
315	Q	26.6	Very low	31.6	Very low	175 Å²	175	140.4 Å²	140.4	82%	0.818	73%	0.734	S	S	*	*			trans	-144	160.7	-175.7	-148.5	-161.1	14.9	0	0	108.4
316	P	39.9	Very low	30.3	Very low	109 Å²	109	143.9 Å²	143.9	71%	0.708	74%	0.741	S	S	*	*				-164.4	157.7	87.2	42.1	-20.1	0	0	0	120.7
317	S	26	Very low	30.2	Very low	89 Å²	89	141.1 Å²	141.1	62%	0.622	73%	0.73	S	S	*	*			trans	82.9	131	134.8	75.2	0	0	0	0	126.8
318	K	26.7	Very low	29.9	Very low	188 Å²	188	141 Å²	141	82%	0.817	74%	0.736	S	S	*	*			trans	106.6	121.6	130.6	-86.8	167.3	-179.1	174.3	0	124.4
319	K	25.3	Very low	30	Very low	165 Å²	165	138.8 Å²	138.8	72%	0.717	74%	0.736	S	S	*	*			trans	71.8	125.7	145.5	-66.2	-160.4	165.3	-94	0	119.2
320	E	28.6	Very low	30.1	Very low	157 Å²	157	138.2 Å²	138.2	73%	0.734	74%	0.738	S	S	*	*				72.9	135.7	64.3	-66.6	175.4	136.2	0	0	112.7
321	S	27.2	Very low	30.4	Very low	122 Å²	122	138 Å²	138	85%	0.853	74%	0.737	S	S	*	*			cis	-151.5	177.3	36.1	57.8	0	0	0	0	117.5
322	L	27.3	Very low	30.6	Very low	158 Å²	158	137 Å²	137	83%	0.827	74%	0.737	S	S	*	*			trans	-75	-174.4	179.6	-82.3	166.9	0	0	0	114.4
323	P	48.4	Very low	31.1	Very low	95 Å²	95	136.4 Å²	136.4	62%	0.617	74%	0.739	S	S	*	*			cis	-147.9	176	20	47.4	-28.1	0	0	0	120.8
324	E	28	Very low	31.9	Very low	164 Å²	164	138.5 Å²	138.5	77%	0.766	75%	0.745	S	S	*	*			trans	49.9	157.1	137.2	-71.8	160.8	160.6	0	0	121.4
325	M	33.1	Very low	32.4	Very low	159 Å²	159	138.5 Å²	138.5	78%	0.783	75%	0.745	S	S	*	*			cis	-174.9	172.6	-16.1	62.4	-169.3	176.4	0	0	106.2
326	E	31.6	Very low	33.1	Very low	175 Å²	175	137.3 Å²	137.3	82%	0.818	74%	0.744	S	S	*	*			cis	-157.2	-168.1	-3.8	-141.1	-159.5	121.3	0	0	105.9
327	A	31.3	Very low	33	Very low	64 Å²	64	139.2 Å²	139.2	53%	0.529	75%	0.753	S	S	.	*			cis	-157.5	-161.5	2.8	0	0	0	0	0	109.8
328	T	30.4	Very low	34	Very low	132 Å²	132	143.5 Å²	143.5	81%	0.81	76%	0.764	S	S	*	*			trans	32.2	122.2	153.8	53.2	0	0	0	0	120.7
329	A	32	Very low	34.6	Very low	85 Å²	85	141.3 Å²	141.3	70%	0.702	76%	0.761	S	S	*	*			cis	91.3	139.6	32.4	0	0	0	0	0	116
330	V	33.6	Very low	35.5	Very low	123 Å²	123	140.2 Å²	140.2	75%	0.745	76%	0.763	S	S	*	*			trans	61.4	149.6	169.3	-54.8	0	0	0	0	119
331	D	33.8	Very low	35.9	Very low	132 Å²	132	139.7 Å²	139.7	71%	0.706	77%	0.765	S	S	*	*			cis	-162.1	158.4	-24.5	-93.9	-21.3	0	0	0	108.4
332	D	35.9	Very low	36.3	Very low	135 Å²	135	140.7 Å²	140.7	72%	0.722	76%	0.761	S	S	*	*			trans	49.7	160.5	148.7	-62.9	-31	0	0	0	125.6
333	D	35.1	Very low	36.6	Very low	141 Å²	141	139.1 Å²	139.1	75%	0.754	75%	0.752	S	S	*	*			trans	66.5	104.3	152.9	-65.1	-17.6	0	0	0	124
334	E	41.8	Very low	36	Very low	165 Å²	165	141.3 Å²	141.3	77%	0.771	76%	0.757	S	S	*	*				59.6	149.3	109.4	-66.9	-71.4	-167.3	0	0	125.5
335	E	37.3	Very low	36.1	Very low	175 Å²	175	138.9 Å²	138.9	82%	0.818	76%	0.758	S	S	*	*			trans	63.9	148.6	157.2	-75	-172.4	-165	0	0	123.9
336	D	41	Very low	36	Very low	151 Å²	151	136.2 Å²	136.2	81%	0.807	76%	0.755	S	S	*	*			trans	-60	151.9	-171.2	-58.7	-74.2	0	0	0	117.7
337	V	37.8	Very low	35.9	Very low	149 Å²	149	132.6 Å²	132.6	90%	0.903	75%	0.749	S	S	*	*			trans	-150.8	164.9	145.1	-113.2	0	0	0	0	112.4
338	E	47.1	Very low	36.3	Very low	179 Å²	179	135.1 Å²	135.1	84%	0.836	76%	0.763	S	S	*	*			trans	-98.4	-160	-164.2	-56.8	177	111.7	0	0	113.9
339	D	39.8	Very low	37.2	Very low	141 Å²	141	134.9 Å²	134.9	75%	0.754	76%	0.764	S	S	*	*			trans	88.2	101.2	161.3	-59.6	-6.3	0	0	0	121.3
340	D	43.8	Very low	37.1	Very low	142 Å²	142	134.3 Å²	134.3	76%	0.759	77%	0.766	S	S	*	*				60	145	116.8	-69.5	-11.1	0	0	0	126
341	D	37.5	Very low	37.2	Very low	146 Å²	146	133.8 Å²	133.8	78%	0.781	77%	0.768	S	S	*	*			trans	73.4	108.5	142.4	-77.5	-8.7	0	0	0	125.1
342	D	36.3	Very low	37	Very low	143 Å²	143	133.6 Å²	133.6	77%	0.765	77%	0.771	S	S	*	*				91.5	160.5	117.1	-143.8	7	0	0	0	122.9
343	I	33.2	Very low	36.8	Very low	126 Å²	126	132.1 Å²	132.1	65%	0.646	77%	0.771	S	S	*	*			trans	79.2	102.9	162.8	-52.7	-70.8	0	0	0	121.7
344	I	35.3	Very low	36.8	Very low	141 Å²	141	130.1 Å²	130.1	72%	0.723	77%	0.768	S	S	*	*			trans	8.4	143.2	136.2	-17.4	175.4	0	0	0	122
345	S	30.8	Very low	36.1	Very low	112 Å²	112	130.2 Å²	130.2	78%	0.783	77%	0.774	S	S	*	*			trans	91.5	151.2	156.6	-49.2	0	0	0	0	117.4
346	S	30.8	Very low	35.7	Very low	103 Å²	103	127.5 Å²	127.5	72%	0.72	77%	0.774	S	S	*	*			cis	-166.3	145	-8.2	45.6	0	0	0	0	114.5
347	S	30.4	Very low	35.2	Very low	100 Å²	100	127.7 Å²	127.7	70%	0.699	78%	0.775	S	S	*	*			trans	42.9	131.4	143.2	66.7	0	0	0	0	126.3
348	S	39.4	Very low	34.7	Very low	116 Å²	116	126.9 Å²	126.9	81%	0.811	77%	0.77	S	S	*	*			trans	78.4	167.8	135.3	-65.2	0	0	0	0	120.6
349	P	49	Very low	33.8	Very low	128 Å²	128	127.3 Å²	127.3	83%	0.831	77%	0.772	S	S	*	*			cis	-120.3	-170.5	-3.8	42.5	-28.6	0	0	0	113.9
350	G	30.1	Very low	33.3	Very low	72 Å²	72	129.4 Å²	129.4	74%	0.742	78%	0.777	S	S	*	*			cis	141.5	89.7	-15.8	0	0	0	0	0	117.3
351	S	34.6	Very low	33.3	Very low	113 Å²	113	127.9 Å²	127.9	79%	0.79	78%	0.775	S	S	*	*			trans	-150.4	139.2	165.6	53.6	0	0	0	0	111.2
352	V	31.1	Very low	32.7	Very low	128 Å²	128	126.6 Å²	126.6	78%	0.776	78%	0.777	S	S	*	*			cis	87.5	131.6	21.2	-44.1	0	0	0	0	116.5
353	S	31.3	Very low	32.2	Very low	103 Å²	103	126 Å²	126	72%	0.72	78%	0.779	S	S	*	*			cis	-166.3	156.1	-12.1	-103.9	0	0	0	0	114.7
354	S	33.9	Very low	32.3	Very low	100 Å²	100	125 Å²	125	70%	0.699	78%	0.78	S	S	*	*			trans	46.4	131.4	143.8	-54.3	0	0	0	0	124.3
355	N	26.7	Very low	31.9	Very low	166 Å²	166	127.9 Å²	127.9	89%	0.888	79%	0.788	S	S	*	*				-168.3	168.8	103.9	-101.7	-15.6	0	0	0	114.3
356	S	30	Very low	31.5	Very low	118 Å²	118	126.5 Å²	126.5	83%	0.825	78%	0.784	S	S	*	*			trans	-157.9	-175.2	-172.6	-171.1	0	0	0	0	112.3
357	L	30	Very low	31.2	Very low	156 Å²	156	126 Å²	126	82%	0.817	79%	0.785	S	S	*	*			trans	109.3	152.3	152.2	-148.9	73.7	0	0	0	120.1
358	V	28.5	Very low	31	Very low	132 Å²	132	127.6 Å²	127.6	80%	0.8	79%	0.791	S	S	*	*			trans	100.7	155.3	160	-167.8	0	0	0	0	117.8
359	Q	27.6	Very low	30.5	Very low	188 Å²	188	126.4 Å²	126.4	88%	0.879	78%	0.783	S	S	*	*			trans	-117.8	-179	-155.7	-64.3	166.2	-29.6	0	0	114.5
360	Q	29.5	Very low	29.3	Very low	185 Å²	185	129.7 Å²	129.7	86%	0.864	79%	0.787	S	S	*	*			trans	-64	176.3	172.7	-72	-165.9	7.5	0	0	113.9
361	P	43.1	Very low	29.2	Very low	110 Å²	110	129.5 Å²	129.5	71%	0.714	79%	0.785	S	S	*	*			cis	-143.9	-178.6	16.8	44.1	-24.9	0	0	0	118.3
362	S	24.6	Very low	28.9	Very low	119 Å²	119	130.1 Å²	130.1	83%	0.832	79%	0.789	S	S	*	*			trans	157.2	168.1	136.5	56.9	0	0	0	0	115.5
363	T	26.2	Very low	28.8	Very low	131 Å²	131	127.4 Å²	127.4	80%	0.804	79%	0.788	S	S	*	*			trans	-131.4	176.5	171.3	62.4	0	0	0	0	107.8
364	P	36.2	Very low	28.8	Very low	103 Å²	103	128 Å²	128	67%	0.669	79%	0.787	S	S	*	*			cis	-145.5	-168.4	13.2	45.6	-25.9	0	0	0	117.1
365	K	25.1	Very low	28.8	Very low	202 Å²	202	129.8 Å²	129.8	88%	0.878	78%	0.784	S	S	*	*			trans	66.7	164	160.1	-72.8	-177	176.2	179.4	0	118.3
366	A	24.3	Very low	29.1	Very low	84 Å²	84	129.8 Å²	129.8	69%	0.694	78%	0.776	S	S	*	*			cis	-175.3	156.7	-33.9	0	0	0	0	0	110.4
367	A	24	Very low	29.2	Very low	92 Å²	92	132.3 Å²	132.3	76%	0.76	77%	0.772	S	S	*	*			trans	66.7	158.6	167.6	0	0	0	0	0	115.3
368	T	25.8	Very low	29.1	Very low	134 Å²	134	131.2 Å²	131.2	82%	0.822	76%	0.763	S	S	*	*			cis	-163.7	176.2	-6.7	4.8	0	0	0	0	107.3
369	S	28.1	Very low	29	Very low	90 Å²	90	131.1 Å²	131.1	63%	0.629	76%	0.762	S	S	*	*			cis	-168	159.4	0.1	36.5	0	0	0	0	110.1
370	E	23.9	Very low	29	Very low	197 Å²	197	127 Å²	127	92%	0.921	75%	0.75	S	S	*	*			trans	64.6	156.8	158.5	-70.7	174.1	177	0	0	119.3
371	G	27.8	Very low	28.9	Very low	69 Å²	69	123 Å²	123	71%	0.711	74%	0.738	S	S	*	*			cis	178.4	105	-8.1	0	0	0	0	0	117.5
372	S	30.1	Very low	28.1	Very low	125 Å²	125	126.4 Å²	126.4	87%	0.874	74%	0.742	S	S	*	*			trans	63.7	144.2	141.9	-154.2	0	0	0	0	123.2
373	G	28.5	Very low	28.2	Very low	72 Å²	72	125.1 Å²	125.1	74%	0.742	74%	0.739	S	S	*	*			trans	-170.4	41	-176.5	0	0	0	0	0	117.9
374	V	30.9	Very low	28.1	Very low	115 Å²	115	130.2 Å²	130.2	70%	0.697	74%	0.743	S	S	*	*			trans	21.8	135.9	144.3	-148.4	0	0	0	0	117.6
375	Q	32.9	Very low	27.5	Very low	138 Å²	138	133.5 Å²	133.5	65%	0.645	75%	0.749	S	S	*	*				-163.1	145.9	54.2	-26.1	-165.9	-9	0	0	117.2
376	K	33.2	Very low	28.2	Very low	166 Å²	166	128.8 Å²	128.8	72%	0.722	74%	0.74	S	S	*	*			trans	64.9	139.8	140.2	-67.2	162.4	-170.2	167.2	0	117.7
377	K	31.9	Very low	28.4	Very low	171 Å²	171	129.9 Å²	129.9	74%	0.743	74%	0.742	S	S	*	*			cis	-168.7	176.5	9.6	-111.6	-171.6	169.7	-153.9	0	107.2
378	Q	29	Very low	28.5	Very low	133 Å²	133	131.3 Å²	131.3	62%	0.621	75%	0.747	S	S	*	*			cis	-170.8	121.9	-9.2	158.7	174.3	-36.7	0	0	110.5
379	V	26.9	Very low	28.9	Very low	129 Å²	129	134.7 Å²	134.7	78%	0.782	75%	0.75	S	S	*	*			trans	59.6	138.9	138.1	163.2	0	0	0	0	120.1
380	V	27.7	Very low	29.4	Very low	102 Å²	102	136.5 Å²	136.5	62%	0.618	76%	0.759	S	S	*	*			cis	-154.2	135.9	2.5	113.6	0	0	0	0	108
381	T	26.1	Very low	29.6	Very low	102 Å²	102	130.7 Å²	130.7	63%	0.626	75%	0.752	S	S	*	*				68.8	132.9	78.4	-34.6	0	0	0	0	113
382	F	26.1	Very low	29.7	Very low	181 Å²	181	134.5 Å²	134.5	79%	0.794	75%	0.752	S	S	*	*			cis	-141.9	148.5	43.4	-74.1	-96.7	0	0	0	111.5
383	A	26.9	Very low	29.6	Very low	92 Å²	92	136.4 Å²	136.4	76%	0.76	75%	0.745	S	S	*	*				69.2	139.1	70.2	0	0	0	0	0	114.7
384	R	24.2	Very low	29.6	Very low	238 Å²	238	141.9 Å²	141.9	90%	0.898	75%	0.748	S	S	*	*			cis	-161.6	168.2	-1.2	-176.9	171.3	177.2	173.9	-1.1	110.5
385	E	23.6	Very low	29.7	Very low	171 Å²	171	143.5 Å²	143.5	80%	0.799	75%	0.751	S	S	*	*			trans	-72.4	-169	179.9	-31.7	172.4	120.3	0	0	115.6
386	P	40.6	Very low	29.4	Very low	104 Å²	104	146.9 Å²	146.9	68%	0.675	76%	0.764	S	S	*	*			cis	-143.9	172.4	-6.3	38.7	-17.3	0	0	0	119.6
387	S	28.2	Very low	29.4	Very low	106 Å²	106	145.6 Å²	145.6	74%	0.741	76%	0.763	S	S	*	*			trans	51.8	134.2	142.2	67.1	0	0	0	0	126.1
388	S	26.6	Very low	29.2	Very low	123 Å²	123	143.1 Å²	143.1	86%	0.86	77%	0.768	S	S	*	*			trans	172.5	176	135.1	45.9	0	0	0	0	114.5
389	K	33	Very low	29.1	Very low	204 Å²	204	143.9 Å²	143.9	89%	0.887	78%	0.776	S	S	*	*			trans	-157.5	-178.6	-179.3	-70.9	-166.7	176.6	-176.5	0	109.1
390	P	39.8	Very low	29.1	Very low	128 Å²	128	144.5 Å²	144.5	83%	0.831	78%	0.78	S	S	*	*			cis	-137.3	-167.1	0.3	45.1	-26.8	0	0	0	116.2
391	G	28.3	Very low	29.3	Very low	75 Å²	75	146.9 Å²	146.9	77%	0.773	79%	0.788	S	S	*	*			trans	100.4	167.7	161.5	0	0	0	0	0	116.7
392	E	29.2	Very low	29.4	Very low	149 Å²	149	149.1 Å²	149.1	70%	0.696	80%	0.802	S	S	*	*			cis	-168.6	-176.9	-19.9	-144.4	-83	92.9	0	0	108.5
393	F	28.3	Very low	29.4	Very low	166 Å²	166	143.8 Å²	143.8	73%	0.728	80%	0.798	S	S	*	*			trans	96	94.5	159.3	-74.1	-80.5	0	0	0	121.9
394	K	28.4	Very low	29.5	Very low	186 Å²	186	146.7 Å²	146.7	81%	0.809	80%	0.801	S	S	*	*				57.2	168.4	124.6	-92.8	171.9	178.6	165.2	0	124.1
395	I	32.3	Very low	29.7	Very low	150 Å²	150	142 Å²	142	77%	0.769	79%	0.794	S	S	*	*			trans	-133.3	149.2	-151.6	-60.3	153.4	0	0	0	112.3
396	K	26.6	Very low	30.1	Very low	208 Å²	208	141.5 Å²	141.5	90%	0.904	79%	0.789	S	S	*	*			trans	-169.1	163.8	138.1	-110.3	175.8	-178	-171.2	0	115.4
397	I	34.3	Very low	29.5	Very low	139 Å²	139	143.1 Å²	143.1	71%	0.713	79%	0.787	S	S	*	*			trans	-130.8	155.9	-167.5	-57.6	162.2	0	0	0	110.2
398	S	26.5	Very low	29.4	Very low	120 Å²	120	146 Å²	146	84%	0.839	79%	0.787	S	S	*	*			trans	-160.1	144.4	158.6	-71	0	0	0	0	112.8
399	D	27.6	Very low	29.4	Very low	148 Å²	148	145.9 Å²	145.9	79%	0.791	78%	0.781	S	S	*	*			trans	-103.8	174.3	179	-53.5	-76.9	0	0	0	113.5
400	V	27.4	Very low	29.2	Very low	142 Å²	142	141.2 Å²	141.2	86%	0.861	78%	0.78	S	S	*	*			trans	-177	154.7	138.2	140	0	0	0	0	112.3
401	L	31.1	Very low	28.5	Very low	153 Å²	153	138.5 Å²	138.5	80%	0.801	78%	0.776	S	S	*	*			trans	-101.2	171.6	-170	-56.2	83.6	0	0	0	115.3
402	T	29.6	Very low	28.6	Very low	148 Å²	148	143.6 Å²	143.6	91%	0.908	78%	0.783	S	S	*	*			trans	124.7	136	131.5	-47.6	0	0	0	0	116.8
403	G	25.8	Very low	28.5	Very low	69 Å²	69	140.8 Å²	140.8	71%	0.711	79%	0.786	S	S	*	*			trans	156	130.6	156.4	0	0	0	0	0	116.8
404	N	27.9	Very low	28.5	Very low	153 Å²	153	138 Å²	138	82%	0.818	79%	0.787	S	S	*	*			trans	-114.9	166.8	-178.7	-76.1	-8.6	0	0	0	113.9
405	N	29.6	Very low	28.7	Very low	141 Å²	141	138.5 Å²	138.5	75%	0.754	79%	0.789	S	S	*	*			trans	94.7	114.6	143.2	-75.4	-29.6	0	0	0	123.6
406	K	32	Very low	28.4	Very low	160 Å²	160	140.6 Å²	140.6	70%	0.696	80%	0.795	S	S	*	*				75.2	113.4	124.2	-90.4	176.8	158.9	-96.3	0	124.3
407	E	27.8	Very low	28.4	Very low	137 Å²	137	137 Å²	137	64%	0.64	79%	0.791	S	S	*	*				102.8	158.7	111	-149.9	159.3	-155.2	0	0	121.5
408	F	26	Very low	28.2	Very low	168 Å²	168	134.8 Å²	134.8	74%	0.737	79%	0.792	S	S	*	*			trans	85.9	79.6	175.1	-73.9	-82	0	0	0	122.9
409	T	26.7	Very low	28.3	Very low	119 Å²	119	138.6 Å²	138.6	73%	0.73	80%	0.797	S	S	*	*				60.8	124.3	121.5	58.1	0	0	0	0	124.9
410	A	27.5	Very low	28.4	Very low	106 Å²	106	134.8 Å²	134.8	88%	0.876	79%	0.793	S	S	*	*			trans	79.2	120.1	130.7	0	0	0	0	0	121.7
411	G	25.4	Very low	28.6	Very low	71 Å²	71	137 Å²	137	73%	0.732	79%	0.794	S	S	*	*			trans	170.5	73.9	166.1	0	0	0	0	0	118.8
412	I	32	Very low	28.7	Very low	182 Å²	182	138.7 Å²	138.7	93%	0.933	80%	0.795	S	S	*	*			trans	71	144.4	155.5	-55.3	173	0	0	0	117.6
413	A	26.4	Very low	28.7	Very low	91 Å²	91	138 Å²	138	75%	0.752	79%	0.785	S	S	*	*			trans	-94.3	153.6	-163.1	0	0	0	0	0	116.6
414	S	28	Very low	28.8	Very low	107 Å²	107	139.5 Å²	139.5	75%	0.748	78%	0.775	S	S	*	*				-166	136.3	126	-133.2	0	0	0	0	115.6
415	K	32.1	Very low	28.9	Very low	197 Å²	197	136.8 Å²	136.8	86%	0.857	76%	0.764	S	S	*	*			trans	64.2	155.5	153.9	-69.8	176.3	179.6	178.9	0	120.7
416	H	27.5	Very low	29.2	Very low	194 Å²	194	137.1 Å²	137.1	90%	0.898	77%	0.765	S	S	*	*			trans	-57.6	142.2	-178.4	-81.9	-118.3	0	0	0	113.5
417	V	25.5	Very low	29.1	Very low	133 Å²	133	136.1 Å²	136.1	81%	0.806	77%	0.767	S	S	*	*			trans	-110.2	133.3	155.6	175.3	0	0	0	0	107.4
418	A	29.9	Very low	29.6	Very low	91 Å²	91	135.8 Å²	135.8	75%	0.752	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-90.3	138.4	166.6	0	0	0	0	0	108.8	G420	A418-G420 PolarHBondContact O-N 3.42Å
419	E	28.7	Very low	30.4	Very low	200 Å²	200	132.4 Å²	132.4	94%	0.935	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-69.1	118.5	173.3	-69.6	-177.7	116.1	0	0	109.4
420	G	29.6	Very low	31.1	Very low	69 Å²	69	133.5 Å²	133.5	71%	0.711	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-79.4	129.9	-174.8	0	0	0	0	0	112.5	A418	A418-G420 PolarHBondContact O-N 3.42Å
421	Q	32.9	Very low	31.5	Very low	187 Å²	187	136.8 Å²	136.8	87%	0.874	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-57.2	136	155.5	-69.6	168.7	-92.3	0	0	108.5
422	K	32.3	Very low	32	Very low	189 Å²	189	140.2 Å²	140.2	82%	0.822	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-85.9	141.3	173.8	-79.2	-171.7	174.5	-177.6	0	110.7
423	I	29.3	Very low	32.2	Very low	135 Å²	135	141.3 Å²	141.3	69%	0.692	78%	0.783	S	S	*	*			trans	-126.2	129.4	-178.7	-77.4	174	0	0	0	104.9	Y450	I423-Y450 WeakPolarHBondContact CA-OH 3.41Å; I423-Y450 HydrophobicContact CG1-CE2 4.36Å; I423-Y450 WeakPolarHBondContact CG2-OH 3.34Å
424	I	28.9	Very low	32.9	Very low	99 Å²	99	140 Å²	140	51%	0.508	78%	0.778	S	S	.	*			trans	-147.7	107.2	-174.2	-56.6	-179.6	0	0	0	106.5	Y450	I424-Y450 VanDerWaalsContact N-CE1 3.29Å; I424-Y450 PolarHBondContact N-OH 3.13Å; I424-Y450 WeakPolarHBondContact O-CE1 3.35Å; I424-Y450 PolarHBondContact O-OH 2.86Å
425	T	29.4	Very low	33.1	Very low	96 Å²	96	143 Å²	143	59%	0.589	79%	0.785	S	S	*	*			trans	-88.8	156.5	171.3	45.9	0	0	0	0	110.9
426	L	35.2	Very low	33.2	Very low	148 Å²	148	139.5 Å²	139.5	78%	0.775	79%	0.785	S	S	*	*			trans	-138.4	118.1	178.7	-116.8	165.2	0	0	0	110.7
427	D	30.8	Very low	34.2	Very low	139 Å²	139	137 Å²	137	74%	0.743	78%	0.784	S	S	*	*			trans	-101.3	150.5	-172	-97.5	-46.2	0	0	0	113.7
428	T	38.4	Very low	34.9	Very low	131 Å²	131	133 Å²	133	80%	0.804	77%	0.77	S	S	*	*			trans	62.3	107.7	164.8	53.4	0	0	0	0	118.6
429	A	42.7	Very low	35.2	Very low	96 Å²	96	132 Å²	132	79%	0.793	76%	0.757	S	S	*	*			trans	-55.3	141.2	175.4	0	0	0	0	0	115.8
430	T	41.3	Very low	35.4	Very low	142 Å²	142	129.7 Å²	129.7	87%	0.871	74%	0.743	S	S	*	*			trans	-151.1	48.9	157.4	-34.7	0	0	0	0	113.3
431	E	35	Very low	35.5	Very low	176 Å²	176	132.9 Å²	132.9	82%	0.822	75%	0.749	S	S	*	*			trans	-159.1	152.4	170.1	-116.7	177.9	-144.5	0	0	106.7
432	I	37	Very low	35.2	Very low	143 Å²	143	133.5 Å²	133.5	73%	0.733	74%	0.744	S	S	*	*			cis	-136.5	131.4	7.8	-53.1	172.3	0	0	0	108.4
433	E	35.9	Very low	35.1	Very low	204 Å²	204	127.9 Å²	127.9	95%	0.953	73%	0.733	S	S	*	*			trans	-94.8	119.2	161	-178.4	174.9	-148.3	0	0	108.1
434	G	39.9	Very low	35.1	Very low	64 Å²	64	129 Å²	129	66%	0.66	74%	0.74	S	S	*	*			trans	160	-5.5	176	0	0	0	0	0	120.8
435	L	33.8	Very low	35.3	Very low	171 Å²	171	131.7 Å²	131.7	90%	0.895	75%	0.754	S	S	*	*	S	Bend	trans	-132.8	144.2	174.6	-74.5	178.1	0	0	0	113.3	T437	L435-T437 PolarHBondContact O-N 3.25Å
436	S	33.5	Very low	35.3	Very low	122 Å²	122	130.2 Å²	130.2	85%	0.853	76%	0.759	S	S	*	*			trans	-39.1	118.3	-165.7	-163	0	0	0	0	116.3	G438	S436-G438 PolarHBondContact O-N 3.01Å
437	T	47.3	Very low	35.4	Very low	143 Å²	143	132.2 Å²	132.2	88%	0.877	76%	0.764	S	S	*	*			trans	-69.4	119.3	170.9	52.8	0	0	0	0	110.7	L435	L435-T437 PolarHBondContact O-N 3.25Å
438	G	41.2	Very low	35.4	Very low	49 Å²	49	132.7 Å²	132.7	51%	0.505	77%	0.766	S	S	.	*			trans	-167.1	-21.5	-179.2	0	0	0	0	0	120.4	S71 S436	S71-G438 WeakPolarHBondContact CB-O 3.32Å; S71-G438 PolarHBondContact OG-O 2.96Å; S436-G438 PolarHBondContact O-N 3.01Å
439	C	37	Very low	34.9	Very low	70 Å²	70	130.6 Å²	130.6	47%	0.473	75%	0.753	S	S	.	*			trans	-127.9	143.6	-173.2	-64.2	0	0	0	0	112.7	S71	S71-C439 PolarHBondContact OG-SG 3.15Å; S71-C439 VanDerWaalsContact OG-SG 3.36Å
440	K	32	Very low	34.3	Very low	150 Å²	150	131.5 Å²	131.5	65%	0.652	74%	0.737	S	S	*	*			trans	-115.8	93.8	172.1	-73.9	-176.8	179	176.8	0	110.7	Y442	K440-Y442 HydrophobicContact CB-CE2 4.05Å; K440-Y442 WeakPolarHBondContact O-CD2 3.48Å; K440-Y442 PolarHBondContact O-N 2.91Å
441	V	31	Very low	33.5	Very low	136 Å²	136	130.1 Å²	130.1	82%	0.824	72%	0.724	S	S	*	*			trans	-74.8	110.8	168.3	-177.9	0	0	0	0	108.4	A443	V441-A443 PolarHBondContact O-N 3.3Å
442	Y	26.4	Very low	33.3	Very low	200 Å²	200	129.4 Å²	129.4	78%	0.784	73%	0.725	S	S	*	*			trans	-79.4	100.3	172.9	-71.6	-89.4	0	0	0	109.9	K440	K440-Y442 HydrophobicContact CB-CE2 4.05Å; K440-Y442 WeakPolarHBondContact O-CD2 3.48Å; K440-Y442 PolarHBondContact O-N 2.91Å
443	A	30.1	Very low	32.9	Very low	71 Å²	71	128.6 Å²	128.6	59%	0.587	73%	0.726	S	S	*	*			trans	-116.8	130.3	164.2	0	0	0	0	0	108.7	V441 I445	V441-A443 PolarHBondContact O-N 3.3Å; A443-I445 PolarHBondContact O-N 2.83Å
444	N	29.8	Very low	32.8	Very low	158 Å²	158	125.6 Å²	125.6	85%	0.845	72%	0.715	S	S	*	*			trans	-74.8	116.1	166.1	-79.2	-2.7	0	0	0	107.5
445	I	33.3	Very low	32.4	Very low	156 Å²	156	128 Å²	128	80%	0.8	72%	0.719	S	S	*	*			trans	-89.9	111.2	176.2	-60.7	175.2	0	0	0	107.9	A443	A443-I445 PolarHBondContact O-N 2.83Å
446	G	29	Very low	32.2	Very low	66 Å²	66	126 Å²	126	68%	0.68	71%	0.714	S	S	*	*			trans	-80	148.1	154.1	0	0	0	0	0	109.4	D448	G446-D448 PolarHBondContact O-N 3.33Å
447	E	38.9	Very low	32.3	Very low	190 Å²	190	127.5 Å²	127.5	89%	0.888	71%	0.705	S	S	*	*	S	Bend	trans	-73.5	120.3	-173.3	-62.8	161.7	139.2	0	0	111.6
448	D	30.4	Very low	31.6	Very low	148 Å²	148	128.2 Å²	128.2	79%	0.791	70%	0.703	S	S	*	*			trans	173	146.4	137.4	-92.4	-25.5	0	0	0	110.8	G446	G446-D448 PolarHBondContact O-N 3.33Å
449	T	26.6	Very low	31.2	Very low	87 Å²	87	131.8 Å²	131.8	53%	0.534	71%	0.711	S	S	.	*			trans	-123.7	135.8	-174.7	36	0	0	0	0	112.1
450	Y	30.8	Very low	31.8	Very low	116 Å²	116	134.5 Å²	134.5	46%	0.455	73%	0.728	S	S	.	*			trans	-143.8	156.7	165.1	-88.8	-59.8	0	0	0	114.8	I423 I424	I423-Y450 WeakPolarHBondContact CA-OH 3.41Å; I423-Y450 HydrophobicContact CG1-CE2 4.36Å; I423-Y450 WeakPolarHBondContact CG2-OH 3.34Å; I424-Y450 VanDerWaalsContact N-CE1 3.29Å; I424-Y450 PolarHBondContact N-OH 3.13Å; I424-Y450 WeakPolarHBondContact O-CE1 3.35Å; I424-Y450 PolarHBondContact O-OH 2.86Å
451	D	23.5	Very low	31.8	Very low	112 Å²	112	135.8 Å²	135.8	60%	0.599	74%	0.736	S	S	*	*			trans	-77	157.9	-158.7	-60	-67.9	0	0	0	117
452	I	31.1	Very low	32	Very low	161 Å²	161	138.2 Å²	138.2	83%	0.826	74%	0.738	S	S	*	*			trans	-109.7	121.5	162.6	-60.7	173.8	0	0	0	108.5
453	V	29.7	Very low	32.2	Very low	126 Å²	126	132.3 Å²	132.3	76%	0.764	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-91	126.4	169.3	178.4	0	0	0	0	109.4	P455	V453-P455 WeakPolarHBondContact O-CD 3.43Å
454	I	33.3	Very low	32.3	Very low	141 Å²	141	136.7 Å²	136.7	72%	0.723	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-85.3	120.5	170	-59.6	174.1	0	0	0	108.3	V456	I454-V456 PolarHBondContact O-N 3.18Å
455	P	31.2	Very low	32.3	Very low	116 Å²	116	134.1 Å²	134.1	75%	0.753	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-66.1	125.6	168.3	-18.4	32.7	0	0	0	110.2	V453	V453-P455 WeakPolarHBondContact O-CD 3.43Å
456	V	29.9	Very low	32.2	Very low	128 Å²	128	134 Å²	134	78%	0.776	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-67.7	146.3	171	175.9	0	0	0	0	109.2	I454 D458	I454-V456 PolarHBondContact O-N 3.18Å; V456-D458 PolarHBondContact O-N 3.47Å
457	K	36.3	Very low	32.2	Very low	154 Å²	154	137.5 Å²	137.5	67%	0.67	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-70.4	121.5	169.1	-74.1	168.6	103	-90.9	0	109.4	D459	K457-D459 IonicContact NZ-OD1 2.71Å; K457-D459 PolarHBondContact NZ-OD1 2.91Å; K457-D459 IonicContact NZ-OD2 3.24Å; K457-D459 PolarHBondContact NZ-OD2 3.14Å
458	D	32.4	Very low	31.7	Very low	157 Å²	157	134.9 Å²	134.9	84%	0.84	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-95.1	123.4	148.2	-66.6	-49	0	0	0	107.2	V456	V456-D458 PolarHBondContact O-N 3.47Å
459	D	32.3	Very low	31.5	Very low	124 Å²	124	135.6 Å²	135.6	66%	0.663	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-85.8	147.1	176.6	-78.1	-50.9	0	0	0	110.7	K457	K457-D459 IonicContact NZ-OD1 2.71Å; K457-D459 PolarHBondContact NZ-OD1 2.91Å; K457-D459 IonicContact NZ-OD2 3.24Å; K457-D459 PolarHBondContact NZ-OD2 3.14Å
460	P	48.8	Very low	31.7	Very low	127 Å²	127	137.3 Å²	137.3	83%	0.825	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-92.1	124.9	-173.2	34	-33	0	0	0	113.3
461	E	33.4	Very low	32.5	Very low	177 Å²	177	136.8 Å²	136.8	83%	0.827	76%	0.755	S	S	*	*			trans	-134.7	120.2	172.5	-171.3	167.1	-135.4	0	0	111.3
462	E	35.6	Very low	32.7	Very low	188 Å²	188	142.6 Å²	142.6	88%	0.879	77%	0.769	S	S	*	*			trans	53.6	147.7	166.3	-58.9	-169	159.1	0	0	120.2
463	G	30.6	Very low	32.5	Very low	76 Å²	76	140.6 Å²	140.6	78%	0.784	77%	0.765	S	S	*	*			cis	-162.4	-176.6	3.7	0	0	0	0	0	113.4
464	E	30.8	Very low	32.5	Very low	162 Å²	162	140.4 Å²	140.4	76%	0.757	77%	0.769	S	S	*	*			trans	-80.4	151.7	-167.6	-57	-170.6	-178.4	0	0	116.2	K466	E464-K466 IonicContact OE2-NZ 3.35Å; E464-K466 PolarHBondContact OE2-NZ 3.35Å
465	A	29.6	Very low	32.3	Very low	104 Å²	104	137.4 Å²	137.4	86%	0.86	77%	0.773	S	S	*	*			trans	-150	112.3	148.3	0	0	0	0	0	113.8
466	K	31	Very low	32.4	Very low	154 Å²	154	139.5 Å²	139.5	67%	0.67	78%	0.778	S	S	*	*			trans	-67.9	172.3	159.3	-71.5	177.4	-179.3	91.7	0	110.1	E464	E464-K466 IonicContact OE2-NZ 3.35Å; E464-K466 PolarHBondContact OE2-NZ 3.35Å
467	L	30	Very low	32.4	Very low	140 Å²	140	140 Å²	140	73%	0.733	78%	0.776	S	S	*	*			cis	-172.4	172.1	-9.8	-104.6	172.5	0	0	0	105.1
468	D	28.3	Very low	32.3	Very low	134 Å²	134	137.8 Å²	137.8	72%	0.717	78%	0.779	S	S	*	*			cis	-156.9	-156.9	1.7	-151.8	-28.4	0	0	0	108.7
469	E	25.8	Very low	32.7	Very low	163 Å²	163	135 Å²	135	76%	0.762	77%	0.77	S	S	*	*			trans	90.5	145.8	150.3	-81.4	-80.6	56.2	0	0	120.7
470	T	31.7	Very low	33.1	Very low	123 Å²	123	134.2 Å²	134.2	76%	0.755	77%	0.774	S	S	*	*			trans	-135.5	-160.7	-168.5	61.5	0	0	0	0	113.2
471	P	46.3	Very low	32.6	Very low	105 Å²	105	139.9 Å²	139.9	68%	0.682	78%	0.779	S	S	*	*				-120.9	165.8	-109.8	38.6	-22.2	0	0	0	115.6
472	R	27.9	Very low	32.9	Very low	234 Å²	234	140.7 Å²	140.7	88%	0.883	78%	0.78	S	S	*	*			trans	-171.4	145.2	145.4	-105.2	149	-158.9	-110.3	3.6	116.9
473	T	27.5	Very low	32.9	Very low	120 Å²	120	141 Å²	141	74%	0.736	77%	0.773	S	S	*	*			trans	58.8	119.4	146.8	52.4	0	0	0	0	123.1
474	S	29.8	Very low	33.2	Very low	122 Å²	122	145.4 Å²	145.4	85%	0.853	78%	0.775	S	S	*	*			trans	58.1	108.6	136.6	63.5	0	0	0	0	120.5
475	G	28.6	Very low	33.7	Very low	78 Å²	78	145.9 Å²	145.9	80%	0.804	78%	0.775	S	S	*	*			trans	-166.7	117.1	157.1	0	0	0	0	0	108.8
476	D	34.6	Very low	34.2	Very low	160 Å²	160	145.1 Å²	145.1	86%	0.856	76%	0.759	S	S	*	*			trans	-88.7	111.3	178.9	179.5	29.3	0	0	0	110.1
477	D	28.2	Very low	34.9	Very low	139 Å²	139	146.9 Å²	146.9	74%	0.743	77%	0.767	S	S	*	*			trans	-156.7	145.4	156.4	-157.9	-64.7	0	0	0	109.5
478	S	35.4	Very low	36	Very low	106 Å²	106	146.9 Å²	146.9	74%	0.741	76%	0.763	S	S	*	*			trans	-130.5	82.2	-171.2	-77.4	0	0	0	0	114	S480	S478-S480 PolarHBondContact O-N 3.25Å
479	P	40.6	Very low	38.1	Very low	98 Å²	98	146.3 Å²	146.3	64%	0.636	76%	0.76	S	S	*	*			trans	-87.9	89.1	167.6	33	-31.7	0	0	0	111.6	R481	P479-R481 PolarHBondContact O-N 3.23Å
480	S	40.4	Very low	40.9	Very low	109 Å²	109	139.7 Å²	139.7	76%	0.762	73%	0.73	S	S	*	*			trans	15.9	72.5	146.2	53.6	0	0	0	0	117.7	S478 K482	S478-S480 PolarHBondContact O-N 3.25Å; S480-K482 PolarHBondContact O-N 2.98Å
481	R	37.5	Very low	43.7	Very low	245 Å²	245	135.5 Å²	135.5	93%	0.925	70%	0.702	S	S	*	*			trans	-64.7	94	171.3	-72.6	-170.5	179.8	-164	0.5	110.3	P479 R483	P479-R481 PolarHBondContact O-N 3.23Å; R481-R483 PolarHBondContact O-N 3.35Å
482	K	39.8	Very low	45.8	Very low	195 Å²	195	135.5 Å²	135.5	85%	0.848	69%	0.689	S	S	*	*			trans	-49.5	112.2	167.2	-67.7	176.1	-178.8	174.4	0	107.9	S480 M484	S480-K482 PolarHBondContact O-N 2.98Å; K482-M484 PolarHBondContact O-N 3.35Å
483	R	37.3	Very low	48.9	Very low	194 Å²	194	129.7 Å²	129.7	73%	0.732	67%	0.672	S	S	*	*			trans	-61.2	98	179.1	177.4	175.4	166.8	160	-1.7	108	R481 K485 E527	R481-R483 PolarHBondContact O-N 3.35Å; R483-K485 PolarHBondContact O-N 3.49Å; R483-E527 IonicContact CZ-OE1 3.62Å; R483-E527 IonicContact NH1-OE1 2.65Å; R483-E527 PolarHBondContact NH1-OE1 2.73Å; R483-E527 IonicContact NH2-OE1 2.76Å; R483-E527 PolarHBondContact NH2-OE1 3.06Å; R483-E527 IonicContact NH2-OE2 3.27Å
484	M	37	Very low	52	Low	168 Å²	168	127.2 Å²	127.2	83%	0.828	65%	0.653	S	S	*	*			trans	-56.7	105.2	179.8	-172.3	102.2	85.1	0	0	107.6	K482 V486	K482-M484 PolarHBondContact O-N 3.35Å; M484-V486 HydrophobicContact CG-CG2 4.29Å; M484-V486 PolarHBondContact O-N 2.92Å
485	K	40.3	Very low	55	Low	172 Å²	172	126.9 Å²	126.9	75%	0.748	64%	0.641	S	S	*	*			trans	-82.3	71.1	-177.1	-162.4	166.9	-173.4	171.9	0	108.3	R483 K487	R483-K485 PolarHBondContact O-N 3.49Å; K485-K487 PolarHBondContact O-N 3.17Å; K485-K487 VanDerWaalsContact O-N 3.1Å
486	V	40.6	Very low	57.9	Low	88 Å²	88	126 Å²	126	53%	0.533	62%	0.62	S	S	.	*			trans	-46	118.6	165.8	177.4	0	0	0	0	106.5	M484 H488	M484-V486 HydrophobicContact CG-CG2 4.29Å; M484-V486 PolarHBondContact O-N 2.92Å; V486-H488 PolarHBondContact O-N 3.36Å
487	K	45.3	Very low	60.4	Low	191 Å²	191	124.6 Å²	124.6	83%	0.83	61%	0.612	S	S	*	*			trans	-69.2	92.5	166.7	-71.3	-175.3	178.8	-176.9	0	105.9	K485	K485-K487 PolarHBondContact O-N 3.17Å; K485-K487 VanDerWaalsContact O-N 3.1Å
488	H	52.1	Low	63.3	Low	141 Å²	141	121.5 Å²	121.5	65%	0.653	61%	0.613	S	S	*	*			trans	-69.6	123.5	154.7	-67.6	-81.9	0	0	0	106	V486 D490	V486-H488 PolarHBondContact O-N 3.36Å; H488-D490 PolarHBondContact O-N 3.35Å
489	D	74.3	Confident	66	Low	121 Å²	121	124.3 Å²	124.3	65%	0.647	61%	0.608	S	S	*	*			trans	-72.2	80.3	166	-65.6	-37.3	0	0	0	107.4	H491	D489-H491 PolarHBondContact O-N 3.11Å
490	D	82.9	Confident	68.4	Low	24 Å²	24	122.1 Å²	122.1	13%	0.128	59%	0.593	C	S	.	*			trans	-67.9	-10.2	174.2	60.9	-24.3	0	0	0	112.1	H488 I505 F521	H488-D490 PolarHBondContact O-N 3.35Å; D490-I505 PolarHBondContact O-N 2.71Å; D490-F521 HydrophobicContact CB-CD1 3.87Å; D490-F521 HydrophobicContact CB-CD2 3.71Å; D490-F521 HydrophobicContact CB-CE1 3.75Å; D490-F521 HydrophobicContact CB-CE2 3.59Å; D490-F521 HydrophobicContact CB-CG 3.85Å; D490-F521 HydrophobicContact CB-CZ 3.61Å
491	H	90.6	Very high	70.9	Confident	36 Å²	36	119.9 Å²	119.9	17%	0.167	57%	0.568	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-157.6	168.4	-178.6	67.1	-68.5	0	0	0	113.8	D489 Y502 I503 L517	D489-H491 PolarHBondContact O-N 3.11Å; H491-Y502 AromaticContact CD2-CD1 3.78Å; H491-Y502 AromaticContact NE2-CD1 3.82Å; H491-I503 WeakPolarHBondContact CA-O 3.33Å; H491-I503 WeakPolarHBondContact CB-O 3.27Å; H491-L517 HydrophobicContact CB-CD1 4.22Å; H491-L517 HydrophobicContact CB-CD2 3.24Å; H491-L517 HydrophobicContact CB-CG 4.26Å
492	Y	90.9	Very high	73.5	Confident	104 Å²	104	110.7 Å²	110.7	41%	0.408	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	158.7	161.4	55.8	-83.9	0	0	0	109.5	I503	Y492-I503 HydrophobicContact CD1-CB 4.44Å; Y492-I503 HydrophobicContact CD2-CB 4.16Å; Y492-I503 HydrophobicContact CE1-CB 4.1Å; Y492-I503 HydrophobicContact CE1-CG2 3.88Å; Y492-I503 HydrophobicContact CE2-CB 3.81Å; Y492-I503 HydrophobicContact CE2-CD1 3.92Å; Y492-I503 HydrophobicContact CE2-CG1 4.26Å; Y492-I503 HydrophobicContact CE2-CG2 4.03Å; Y492-I503 HydrophobicContact CG-CB 4.47Å; Y492-I503 PolarHBondContact N-O 3.44Å; Y492-I503 VanDerWaalsContact N-O 3.08Å; Y492-I503 PolarHBondContact O-N 3.27Å; Y492-I503 WeakPolarHBondContact OH-CG2 3.36Å
493	E	93.4	Very high	76	Confident	112 Å²	112	102 Å²	102	52%	0.523	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	140.5	176	-67.7	-178.1	-167.7	0	0	110.5	V500 Y502	E493-V500 HydrophobicContact CB-CG1 4.11Å; E493-V500 HydrophobicContact CG-CG1 4.05Å; E493-Y502 HydrophobicContact CG-CD1 3.84Å; E493-Y502 HydrophobicContact CG-CE1 4.06Å; E493-Y502 WeakPolarHBondContact OE1-CE1 3.45Å
494	L	91.8	Very high	78.7	Confident	68 Å²	68	92.8 Å²	92.8	36%	0.356	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.4	171.3	178.6	70.6	0	0	0	108.4	V496 Y501 I503	L494-V496 HydrophobicContact CD2-CG2 3.89Å; L494-V496 HydrophobicContact CG-CG2 3.92Å; L494-Y501 PolarHBondContact N-O 3.42Å; L494-Y501 PolarHBondContact O-N 3.14Å; L494-I503 HydrophobicContact CB-CD1 3.57Å; L494-I503 HydrophobicContact CB-CG1 4.13Å; L494-I503 HydrophobicContact CD2-CD1 3.64Å; L494-I503 HydrophobicContact CG-CD1 4.22Å
495	I	93.4	Very high	81.4	Confident	115 Å²	115	89.3 Å²	89.3	59%	0.59	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	125.7	176.5	-52.3	-177.4	0	0	0	108.6	R499 V500	I495-R499 WeakPolarHBondContact CA-O 3.27Å; I495-V500 HydrophobicContact CG1-CG2 4.33Å
496	V	89	Confident	83.9	Confident	59 Å²	59	85.3 Å²	85.3	36%	0.358	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	129.1	174.3	-172.4	0	0	0	0	108	L494 G498 R499 Y501	L494-V496 HydrophobicContact CD2-CG2 3.89Å; L494-V496 HydrophobicContact CG-CG2 3.92Å; V496-G498 PolarHBondContact O-N 2.96Å; V496-G498 VanDerWaalsContact O-N 3.17Å; V496-R499 PolarHBondContact N-O 3.26Å; V496-R499 WeakPolarHBondContact O-CA 3.43Å; V496-R499 WeakPolarHBondContact O-CB 3.23Å; V496-R499 PolarHBondContact O-N 2.93Å; V496-Y501 HydrophobicContact CB-CD2 4.45Å; V496-Y501 HydrophobicContact CB-CE2 4.14Å; V496-Y501 HydrophobicContact CG2-CD2 4.46Å
497	D	88.1	Confident	86.3	Confident	131 Å²	131	83.1 Å²	83.1	70%	0.701	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	39.4	-178.8	-53.3	-34	0	0	0	113.8	R499	D497-R499 PolarHBondContact O-N 3.37Å
498	G	87.8	Confident	88.6	Confident	74 Å²	74	79.4 Å²	79.4	76%	0.763	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	8.1	-176.6	0	0	0	0	0	115.3	V496	V496-G498 PolarHBondContact O-N 2.96Å; V496-G498 VanDerWaalsContact O-N 3.17Å
499	R	92.2	Very high	90.5	Very high	165 Å²	165	78.4 Å²	78.4	62%	0.623	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	128.7	179.5	-54.9	178.4	-173.4	-154.1	-0.6	110.4	I495 V496 D497 Y501	I495-R499 WeakPolarHBondContact CA-O 3.27Å; V496-R499 PolarHBondContact N-O 3.26Å; V496-R499 WeakPolarHBondContact O-CA 3.43Å; V496-R499 WeakPolarHBondContact O-CB 3.23Å; V496-R499 PolarHBondContact O-N 2.93Å; D497-R499 PolarHBondContact O-N 3.37Å; R499-Y501 HydrophobicContact CB-CD2 4.46Å; R499-Y501 HydrophobicContact CB-CE2 3.73Å; R499-Y501 WeakPolarHBondContact O-CD2 3.14Å
500	V	92.1	Very high	91.3	Very high	53 Å²	53	76 Å²	76	32%	0.321	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	127.3	175.7	-173.9	0	0	0	0	110	E493 I495 Y502	E493-V500 HydrophobicContact CB-CG1 4.11Å; E493-V500 HydrophobicContact CG-CG1 4.05Å; I495-V500 HydrophobicContact CG1-CG2 4.33Å; V500-Y502 HydrophobicContact CG1-CE1 4.38Å; V500-Y502 HydrophobicContact CG1-CE2 4.38Å
501	Y	91.9	Very high	91.8	Very high	62 Å²	62	77 Å²	77	24%	0.243	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	130.1	171.3	-63.4	-93.3	0	0	0	109.5	L494 V496 R499 V512	L494-Y501 PolarHBondContact N-O 3.42Å; L494-Y501 PolarHBondContact O-N 3.14Å; V496-Y501 HydrophobicContact CB-CD2 4.45Å; V496-Y501 HydrophobicContact CB-CE2 4.14Å; V496-Y501 HydrophobicContact CG2-CD2 4.46Å; R499-Y501 HydrophobicContact CB-CD2 4.46Å; R499-Y501 HydrophobicContact CB-CE2 3.73Å; R499-Y501 WeakPolarHBondContact O-CD2 3.14Å; Y501-V512 HydrophobicContact CD1-CG2 4.24Å; Y501-V512 HydrophobicContact CE1-CG2 3.97Å
502	Y	93.5	Very high	91.9	Very high	51 Å²	51	80.3 Å²	80.3	20%	0.2	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	119	177.8	-49.5	-96.8	0	0	0	108.9	H491 E493 V500 S510 Y511 L514 L517	H491-Y502 AromaticContact CD2-CD1 3.78Å; H491-Y502 AromaticContact NE2-CD1 3.82Å; E493-Y502 HydrophobicContact CG-CD1 3.84Å; E493-Y502 HydrophobicContact CG-CE1 4.06Å; E493-Y502 WeakPolarHBondContact OE1-CE1 3.45Å; V500-Y502 HydrophobicContact CG1-CE1 4.38Å; V500-Y502 HydrophobicContact CG1-CE2 4.38Å; Y502-S510 CarbonylContact O-C 3.45Å; Y502-Y511 PolarHBondContact N-O 3.12Å; Y502-Y511 PolarHBondContact O-N 2.97Å; Y502-L514 HydrophobicContact CD1-CB 3.96Å; Y502-L514 HydrophobicContact CD1-CD1 4.11Å; Y502-L514 HydrophobicContact CD1-CD2 4.46Å; Y502-L514 HydrophobicContact CD1-CG 4.4Å; Y502-L514 HydrophobicContact CD2-CB 4.18Å; Y502-L514 HydrophobicContact CE1-CB 3.91Å; Y502-L514 HydrophobicContact CE1-CD2 4.19Å; Y502-L514 HydrophobicContact CE1-CG 4.47Å; Y502-L514 HydrophobicContact CE2-CB 4.17Å; Y502-L514 HydrophobicContact CG-CB 4.1Å; Y502-L514 HydrophobicContact CG-CD1 4.5Å; Y502-L517 VanDerWaalsContact CB-CD2 3.43Å; Y502-L517 HydrophobicContact CG-CD2 4.41Å
503	I	92.7	Very high	91.9	Very high	13 Å²	13	77.3 Å²	77.3	7%	0.067	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	123.4	-173.1	-55.1	-167.2	0	0	0	110.7	H491 Y492 L494 I505 K508 R509	H491-I503 WeakPolarHBondContact CA-O 3.33Å; H491-I503 WeakPolarHBondContact CB-O 3.27Å; Y492-I503 HydrophobicContact CD1-CB 4.44Å; Y492-I503 HydrophobicContact CD2-CB 4.16Å; Y492-I503 HydrophobicContact CE1-CB 4.1Å; Y492-I503 HydrophobicContact CE1-CG2 3.88Å; Y492-I503 HydrophobicContact CE2-CB 3.81Å; Y492-I503 HydrophobicContact CE2-CD1 3.92Å; Y492-I503 HydrophobicContact CE2-CG1 4.26Å; Y492-I503 HydrophobicContact CE2-CG2 4.03Å; Y492-I503 HydrophobicContact CG-CB 4.47Å; Y492-I503 PolarHBondContact N-O 3.44Å; Y492-I503 VanDerWaalsContact N-O 3.08Å; Y492-I503 PolarHBondContact O-N 3.27Å; Y492-I503 WeakPolarHBondContact OH-CG2 3.36Å; L494-I503 HydrophobicContact CB-CD1 3.57Å; L494-I503 HydrophobicContact CB-CG1 4.13Å; L494-I503 HydrophobicContact CD2-CD1 3.64Å; L494-I503 HydrophobicContact CG-CD1 4.22Å; I503-I505 PolarHBondContact O-N 3.36Å; I503-K508 HydrophobicContact CG2-CB 4.41Å; I503-R509 WeakPolarHBondContact CA-O 3.31Å
504	C	93.9	Very high	91.7	Very high	0 Å²	0	73.7 Å²	73.7	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	124.3	177.5	-179.2	0	0	0	0	111.3	V506 C507 K508 R509 L517	C504-V506 PolarHBondContact O-N 3.08Å; C504-C507 PolarHBondContact O-N 3.48Å; C504-K508 VanDerWaalsContact O-CA 3.3Å; C504-K508 WeakPolarHBondContact O-CA 3.32Å; C504-K508 PolarHBondContact O-N 3.31Å; C504-R509 PolarHBondContact N-O 2.92Å; C504-L517 HydrophobicContact CB-CD1 3.62Å
505	I	93.5	Very high	91.6	Very high	95 Å²	95	75.3 Å²	75.3	49%	0.487	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-27.6	-176.2	-161.9	167.9	0	0	0	113.4	D490 I503 F521	D490-I505 PolarHBondContact O-N 2.71Å; I503-I505 PolarHBondContact O-N 3.36Å; I505-F521 HydrophobicContact CG2-CE2 4.46Å
506	V	91.8	Very high	91.5	Very high	88 Å²	88	70.4 Å²	70.4	53%	0.533	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-38.7	-174.8	-175.8	0	0	0	0	113	C504 F521 H524	C504-V506 PolarHBondContact O-N 3.08Å; V506-F521 HydrophobicContact CG2-CE2 3.94Å; V506-H524 HydrophobicContact CB-CB 4.46Å; V506-H524 HydrophobicContact CG1-CB 4.32Å; V506-H524 WeakPolarHBondContact CG1-ND1 3.46Å; V506-H524 HydrophobicContact CG2-CB 4.29Å
507	C	91.7	Very high	91.7	Very high	43 Å²	43	67.6 Å²	67.6	29%	0.291	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	2.9	-171.8	71.1	0	0	0	0	114.7	C504 R509 H520 H524	C504-C507 PolarHBondContact O-N 3.48Å; C507-R509 PolarHBondContact O-N 3.12Å; C507-H520 PolarHBondContact SG-NE2 3.46Å; C507-H524 PolarHBondContact SG-NE2 3.03Å
508	K	92.8	Very high	91.7	Very high	112 Å²	112	67.1 Å²	67.1	49%	0.487	35%	0.353	S	S	.	.			trans	54.9	18.8	-178	-52.2	-172.8	-172.5	-177	0	115.4	S62 I503 C504	S62-K508 PolarHBondContact OG-NZ 3.42Å; I503-K508 HydrophobicContact CG2-CB 4.41Å; C504-K508 VanDerWaalsContact O-CA 3.3Å; C504-K508 WeakPolarHBondContact O-CA 3.32Å; C504-K508 PolarHBondContact O-N 3.31Å
509	R	92.1	Very high	91.8	Very high	120 Å²	120	68 Å²	68	45%	0.453	33%	0.333	S	S	.	.			trans	-72.7	127.9	172	-75.1	180	168.2	147.8	-8.7	110.4	I503 C504 C507 Y511	I503-R509 WeakPolarHBondContact CA-O 3.31Å; C504-R509 PolarHBondContact N-O 2.92Å; C507-R509 PolarHBondContact O-N 3.12Å; R509-Y511 HydrophobicContact CB-CE2 3.64Å; R509-Y511 WeakPolarHBondContact CD-OH 3.48Å; R509-Y511 WeakPolarHBondContact O-CD2 3.37Å; R509-Y511 WeakPolarHBondContact O-CE2 3.49Å
510	S	91.9	Very high	91.7	Very high	72 Å²	72	60.9 Å²	60.9	50%	0.503	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	145.8	174.1	53.1	0	0	0	0	112.1	Y502	Y502-S510 CarbonylContact O-C 3.45Å
511	Y	92.7	Very high	91.7	Very high	44 Å²	44	60.4 Å²	60.4	17%	0.173	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	134	178	-66.4	-84.8	0	0	0	109.8	Y502 R509 C513 L517 H520	Y502-Y511 PolarHBondContact N-O 3.12Å; Y502-Y511 PolarHBondContact O-N 2.97Å; R509-Y511 HydrophobicContact CB-CE2 3.64Å; R509-Y511 WeakPolarHBondContact CD-OH 3.48Å; R509-Y511 WeakPolarHBondContact O-CD2 3.37Å; R509-Y511 WeakPolarHBondContact O-CE2 3.49Å; Y511-C513 PolarHBondContact O-N 3.48Å; Y511-L517 HydrophobicContact CD2-CB 3.85Å; Y511-L517 HydrophobicContact CD2-CD1 3.87Å; Y511-L517 HydrophobicContact CD2-CG 4.46Å; Y511-L517 HydrophobicContact CE2-CD1 4.26Å; Y511-L517 HydrophobicContact CG-CB 3.94Å; Y511-H520 HydrophobicContact CE1-CB 4.18Å; Y511-H520 HydrophobicContact CE2-CB 4.23Å; Y511-H520 AromaticContact CE2-CD2 3.51Å; Y511-H520 AromaticContact CZ-CD2 3.51Å; Y511-H520 AromaticContact CZ-CG 3.67Å; Y511-H520 PolarHBondContact OH-CD2 3.44Å
512	V	92.8	Very high	91.6	Very high	106 Å²	106	58.2 Å²	58.2	64%	0.642	29%	0.293	S	S	*	.	S	Bend	trans	-66.6	-23.4	175.5	-175.6	0	0	0	0	111.6	Y501	Y501-V512 HydrophobicContact CD1-CG2 4.24Å; Y501-V512 HydrophobicContact CE1-CG2 3.97Å
513	C	91.6	Very high	91.5	Very high	40 Å²	40	58.1 Å²	58.1	27%	0.27	30%	0.298	S	S	.	.	S	Bend	trans	-135.9	134.7	-179.7	60.7	0	0	0	0	113	Y511 T515 S516 L517	Y511-C513 PolarHBondContact O-N 3.48Å; C513-T515 PolarHBondContact O-N 3.01Å; C513-T515 VanDerWaalsContact O-N 3.12Å; C513-T515 PolarHBondContact SG-OG1 2.77Å; C513-S516 PolarHBondContact O-N 2.99Å; C513-S516 PolarHBondContact SG-OG 2.93Å; C513-S516 VanDerWaalsContact SG-OG 3.39Å; C513-L517 PolarHBondContact O-N 2.98Å
514	L	88.7	Confident	91.3	Very high	37 Å²	37	60.7 Å²	60.7	19%	0.194	31%	0.31	C	S	.	.	H	α-helix	trans	-57.3	-24.7	178.1	-178.3	52.7	0	0	0	113.4	Y502 L517 R518	Y502-L514 HydrophobicContact CD1-CB 3.96Å; Y502-L514 HydrophobicContact CD1-CD1 4.11Å; Y502-L514 HydrophobicContact CD1-CD2 4.46Å; Y502-L514 HydrophobicContact CD1-CG 4.4Å; Y502-L514 HydrophobicContact CD2-CB 4.18Å; Y502-L514 HydrophobicContact CE1-CB 3.91Å; Y502-L514 HydrophobicContact CE1-CD2 4.19Å; Y502-L514 HydrophobicContact CE1-CG 4.47Å; Y502-L514 HydrophobicContact CE2-CB 4.17Å; Y502-L514 HydrophobicContact CG-CB 4.1Å; Y502-L514 HydrophobicContact CG-CD1 4.5Å; L514-L517 HydrophobicContact CD1-CD2 3.58Å; L514-L517 HydrophobicContact CD1-CG 4.42Å; L514-R518 HydrophobicContact CD1-CG 4.21Å; L514-R518 WeakPolarHBondContact O-CB 3.4Å; L514-R518 VanDerWaalsContact O-CG 3.29Å; L514-R518 WeakPolarHBondContact O-CG 3.43Å; L514-R518 PolarHBondContact O-N 3.36Å
515	T	90.3	Very high	91.1	Very high	102 Å²	102	63.3 Å²	63.3	63%	0.626	33%	0.328	S	S	*	.	H	α-helix	trans	-68.3	-41.5	173.3	49	0	0	0	0	112.7	C513 R519	C513-T515 PolarHBondContact O-N 3.01Å; C513-T515 VanDerWaalsContact O-N 3.12Å; C513-T515 PolarHBondContact SG-OG1 2.77Å; T515-R519 WeakPolarHBondContact O-CB 3.35Å; T515-R519 PolarHBondContact O-N 3.32Å; T515-R519 VanDerWaalsContact O-N 3.08Å
516	S	91.4	Very high	90.9	Very high	12 Å²	12	63.7 Å²	63.7	8%	0.084	32%	0.323	C	S	.	.	H	α-helix	trans	-71.3	-37.7	175.6	-75.8	0	0	0	0	112.2	C513 R519 H520	C513-S516 PolarHBondContact O-N 2.99Å; C513-S516 PolarHBondContact SG-OG 2.93Å; C513-S516 VanDerWaalsContact SG-OG 3.39Å; S516-R519 PolarHBondContact O-N 3.3Å; S516-R519 PolarHBondContact OG-NH2 2.84Å; S516-H520 WeakPolarHBondContact O-CB 3.28Å; S516-H520 PolarHBondContact O-N 2.93Å
517	L	92.1	Very high	90.5	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-57.7	-53.2	170.9	166.4	65.4	0	0	0	111.7	H491 Y502 C504 Y511 C513 L514 R519 H520 F521	H491-L517 HydrophobicContact CB-CD1 4.22Å; H491-L517 HydrophobicContact CB-CD2 3.24Å; H491-L517 HydrophobicContact CB-CG 4.26Å; Y502-L517 VanDerWaalsContact CB-CD2 3.43Å; Y502-L517 HydrophobicContact CG-CD2 4.41Å; C504-L517 HydrophobicContact CB-CD1 3.62Å; Y511-L517 HydrophobicContact CD2-CB 3.85Å; Y511-L517 HydrophobicContact CD2-CD1 3.87Å; Y511-L517 HydrophobicContact CD2-CG 4.46Å; Y511-L517 HydrophobicContact CE2-CD1 4.26Å; Y511-L517 HydrophobicContact CG-CB 3.94Å; C513-L517 PolarHBondContact O-N 2.98Å; L514-L517 HydrophobicContact CD1-CD2 3.58Å; L514-L517 HydrophobicContact CD1-CG 4.42Å; L517-R519 VanDerWaalsContact C-N 3.3Å; L517-R519 PolarHBondContact O-N 2.85Å; L517-H520 CarbonylContact O-C 3.6Å; L517-H520 WeakPolarHBondContact O-CA 3.11Å; L517-H520 WeakPolarHBondContact O-CB 3.16Å; L517-H520 PolarHBondContact O-N 3.39Å; L517-F521 PolarHBondContact O-N 3.04Å
518	R	89.3	Confident	90.4	Very high	121 Å²	121	67.4 Å²	67.4	46%	0.457	33%	0.329	S	S	.	.	H	α-helix	trans	-61.3	-37.8	179.9	-75.4	172.2	178.2	167.1	4	112.6	L514 H520 F521	L514-R518 HydrophobicContact CD1-CG 4.21Å; L514-R518 WeakPolarHBondContact O-CB 3.4Å; L514-R518 VanDerWaalsContact O-CG 3.29Å; L514-R518 WeakPolarHBondContact O-CG 3.43Å; L514-R518 PolarHBondContact O-N 3.36Å; R518-H520 VanDerWaalsContact C-N 3.33Å; R518-F521 PolarHBondContact O-N 2.75Å
519	R	89.3	Confident	90.3	Very high	92 Å²	92	68.7 Å²	68.7	35%	0.347	33%	0.334	S	S	.	.	H	α-helix	trans	-60.9	-41.3	171.2	170.9	176.1	57	156.6	-3	111.7	T515 S516 L517 L541 E543	T515-R519 WeakPolarHBondContact O-CB 3.35Å; T515-R519 PolarHBondContact O-N 3.32Å; T515-R519 VanDerWaalsContact O-N 3.08Å; S516-R519 PolarHBondContact O-N 3.3Å; S516-R519 PolarHBondContact OG-NH2 2.84Å; L517-R519 VanDerWaalsContact C-N 3.3Å; L517-R519 PolarHBondContact O-N 2.85Å; R519-L541 HydrophobicContact CG-CD2 3.64Å; R519-L541 HydrophobicContact CG-CG 4.11Å; R519-E543 WeakPolarHBondContact CD-OE2 3.15Å; R519-E543 IonicContact CZ-OE2 3.68Å; R519-E543 IonicContact NE-OE2 3.73Å; R519-E543 IonicContact NH1-OE1 3.48Å; R519-E543 PolarHBondContact NH1-OE1 3.24Å; R519-E543 IonicContact NH1-OE2 2.64Å; R519-E543 PolarHBondContact NH1-OE2 3.5Å
520	H	90.6	Very high	90.3	Very high	16 Å²	16	65.6 Å²	65.6	7%	0.074	32%	0.323	C	S	.	.	H	α-helix	trans	-71.6	-40.9	176.7	169.7	47.2	0	0	0	113	C507 Y511 S516 L517 R518 N522 V523 H524	C507-H520 PolarHBondContact SG-NE2 3.46Å; Y511-H520 HydrophobicContact CE1-CB 4.18Å; Y511-H520 HydrophobicContact CE2-CB 4.23Å; Y511-H520 AromaticContact CE2-CD2 3.51Å; Y511-H520 AromaticContact CZ-CD2 3.51Å; Y511-H520 AromaticContact CZ-CG 3.67Å; Y511-H520 PolarHBondContact OH-CD2 3.44Å; S516-H520 WeakPolarHBondContact O-CB 3.28Å; S516-H520 PolarHBondContact O-N 2.93Å; L517-H520 CarbonylContact O-C 3.6Å; L517-H520 WeakPolarHBondContact O-CA 3.11Å; L517-H520 WeakPolarHBondContact O-CB 3.16Å; L517-H520 PolarHBondContact O-N 3.39Å; R518-H520 VanDerWaalsContact C-N 3.33Å; H520-N522 PolarHBondContact O-N 3.39Å; H520-N522 VanDerWaalsContact O-N 3.08Å; H520-V523 WeakPolarHBondContact O-CB 3.47Å; H520-V523 VanDerWaalsContact O-CG2 3.28Å; H520-V523 WeakPolarHBondContact O-CG2 3.44Å; H520-V523 PolarHBondContact O-N 3.43Å; H520-H524 AromaticContact CE1-CD2 3.86Å; H520-H524 AromaticContact CE1-NE2 3.42Å; H520-H524 PolarHBondContact CE1-NE2 3.38Å; H520-H524 AromaticContact NE2-CD2 3.73Å; H520-H524 AromaticContact NE2-NE2 3.31Å; H520-H524 PolarHBondContact NE2-NE2 2.92Å
521	F	90.4	Very high	90.3	Very high	43 Å²	43	65.6 Å²	65.6	19%	0.189	32%	0.321	C	S	.	.	H	α-helix	trans	-58.8	-27.2	-176.8	-170.5	-101.3	0	0	0	112.8	D490 I505 V506 L517 R518 V523 H524 S525	D490-F521 HydrophobicContact CB-CD1 3.87Å; D490-F521 HydrophobicContact CB-CD2 3.71Å; D490-F521 HydrophobicContact CB-CE1 3.75Å; D490-F521 HydrophobicContact CB-CE2 3.59Å; D490-F521 HydrophobicContact CB-CG 3.85Å; D490-F521 HydrophobicContact CB-CZ 3.61Å; I505-F521 HydrophobicContact CG2-CE2 4.46Å; V506-F521 HydrophobicContact CG2-CE2 3.94Å; L517-F521 PolarHBondContact O-N 3.04Å; R518-F521 PolarHBondContact O-N 2.75Å; F521-V523 PolarHBondContact O-N 2.94Å; F521-H524 WeakPolarHBondContact O-CA 3.42Å; F521-H524 WeakPolarHBondContact O-CB 3.44Å; F521-H524 PolarHBondContact O-N 3.48Å; F521-S525 PolarHBondContact O-N 3.38Å
522	N	90.8	Very high	90.3	Very high	16 Å²	16	64.1 Å²	64.1	9%	0.086	32%	0.317	C	S	.	.	H	α-helix	trans	-65	-14.4	173.3	-163	72.7	0	0	0	114.2	H520 H524 W526 E527 K528 P540	H520-N522 PolarHBondContact O-N 3.39Å; H520-N522 VanDerWaalsContact O-N 3.08Å; N522-H524 VanDerWaalsContact C-N 3.32Å; N522-W526 WeakPolarHBondContact O-CA 3.43Å; N522-W526 PolarHBondContact O-N 2.96Å; N522-E527 PolarHBondContact OD1-N 3.3Å; N522-K528 PolarHBondContact ND2-O 2.57Å; N522-K528 PolarHBondContact OD1-N 2.8Å; N522-P540 PolarHBondContact ND2-O 3.03Å
523	V	91.3	Very high	90.2	Very high	48 Å²	48	68 Å²	68	29%	0.291	32%	0.32	S	S	.	.	H	α-helix	trans	-73.4	-24.4	167.4	-175.3	0	0	0	0	111.9	H520 F521 W526 P540 L541	H520-V523 WeakPolarHBondContact O-CB 3.47Å; H520-V523 VanDerWaalsContact O-CG2 3.28Å; H520-V523 WeakPolarHBondContact O-CG2 3.44Å; H520-V523 PolarHBondContact O-N 3.43Å; F521-V523 PolarHBondContact O-N 2.94Å; V523-W526 PolarHBondContact O-NE1 3.44Å; V523-P540 HydrophobicContact CB-CB 4.41Å; V523-P540 HydrophobicContact CG2-CB 4.04Å; V523-P540 HydrophobicContact CG2-CG 4.05Å; V523-L541 HydrophobicContact CG2-CD1 3.38Å
524	H	89.3	Confident	90.2	Very high	68 Å²	68	71.3 Å²	71.3	32%	0.315	33%	0.328	S	S	.	.	H	α-helix	trans	-92.6	-47.5	175.5	-65.7	-61.5	0	0	0	111.6	V506 C507 H520 F521 N522	V506-H524 HydrophobicContact CB-CB 4.46Å; V506-H524 HydrophobicContact CG1-CB 4.32Å; V506-H524 WeakPolarHBondContact CG1-ND1 3.46Å; V506-H524 HydrophobicContact CG2-CB 4.29Å; C507-H524 PolarHBondContact SG-NE2 3.03Å; H520-H524 AromaticContact CE1-CD2 3.86Å; H520-H524 AromaticContact CE1-NE2 3.42Å; H520-H524 PolarHBondContact CE1-NE2 3.38Å; H520-H524 AromaticContact NE2-CD2 3.73Å; H520-H524 AromaticContact NE2-NE2 3.31Å; H520-H524 PolarHBondContact NE2-NE2 2.92Å; F521-H524 WeakPolarHBondContact O-CA 3.42Å; F521-H524 WeakPolarHBondContact O-CB 3.44Å; F521-H524 PolarHBondContact O-N 3.48Å; N522-H524 VanDerWaalsContact C-N 3.32Å
525	S	88.4	Confident	90.4	Very high	54 Å²	54	71.4 Å²	71.4	38%	0.378	33%	0.331	S	S	.	.	H	α-helix	trans	-77.2	-28.9	-177.9	70.5	0	0	0	0	114.4	F521 E527	F521-S525 PolarHBondContact O-N 3.38Å; S525-E527 PolarHBondContact O-N 3.14Å; S525-E527 PolarHBondContact OG-N 3.44Å
526	W	88.9	Confident	90.6	Very high	104 Å²	104	74.5 Å²	74.5	39%	0.394	34%	0.344	S	S	.	.			trans	49.1	25.8	-168.9	-69.5	83.9	0	0	0	114.3	N522 V523 K528 K529 P540	N522-W526 WeakPolarHBondContact O-CA 3.43Å; N522-W526 PolarHBondContact O-N 2.96Å; V523-W526 PolarHBondContact O-NE1 3.44Å; W526-K528 VanDerWaalsContact C-N 3.32Å; W526-K528 PolarHBondContact O-N 3.45Å; W526-K529 HydrophobicContact CE3-CG 4.44Å; W526-K529 WeakPolarHBondContact O-CE 3.41Å; W526-K529 WeakPolarHBondContact O-CG 3.21Å; W526-P540 HydrophobicContact CD2-CB 4.32Å; W526-P540 HydrophobicContact CE3-CB 4.09Å; W526-P540 HydrophobicContact CH2-CB 3.92Å; W526-P540 HydrophobicContact CH2-CG 3.96Å; W526-P540 HydrophobicContact CZ2-CB 4.1Å; W526-P540 HydrophobicContact CZ2-CG 4.23Å; W526-P540 HydrophobicContact CZ3-CB 3.89Å; W526-P540 HydrophobicContact CZ3-CG 4.34Å
527	E	85.1	Confident	90.7	Very high	113 Å²	113	80.1 Å²	80.1	53%	0.528	37%	0.367	S	S	.	.			trans	-58.7	-45	-179.1	-170.3	-158.7	153.9	0	0	110.6	R483 N522 S525	R483-E527 IonicContact CZ-OE1 3.62Å; R483-E527 IonicContact NH1-OE1 2.65Å; R483-E527 PolarHBondContact NH1-OE1 2.73Å; R483-E527 IonicContact NH2-OE1 2.76Å; R483-E527 PolarHBondContact NH2-OE1 3.06Å; R483-E527 IonicContact NH2-OE2 3.27Å; N522-E527 PolarHBondContact OD1-N 3.3Å; S525-E527 PolarHBondContact O-N 3.14Å; S525-E527 PolarHBondContact OG-N 3.44Å
528	K	88.2	Confident	90.7	Very high	95 Å²	95	83.4 Å²	83.4	41%	0.413	39%	0.387	S	S	.	.	S	Bend	trans	-103.8	113.3	175.4	-60.6	-172.8	179.9	-174.2	0	109.9	N522 W526 Y530	N522-K528 PolarHBondContact ND2-O 2.57Å; N522-K528 PolarHBondContact OD1-N 2.8Å; W526-K528 VanDerWaalsContact C-N 3.32Å; W526-K528 PolarHBondContact O-N 3.45Å; K528-Y530 HydrophobicContact CB-CE2 3.87Å
529	K	91.2	Very high	90.8	Very high	139 Å²	139	79.5 Å²	79.5	60%	0.604	37%	0.373	S	S	*	.			trans	-99.1	133.1	177.1	-67	-178.8	-178	177.1	0	109.8	W526 P531 V538	W526-K529 HydrophobicContact CE3-CG 4.44Å; W526-K529 WeakPolarHBondContact O-CE 3.41Å; W526-K529 WeakPolarHBondContact O-CG 3.21Å; K529-P531 VanDerWaalsContact C-CD 3.49Å; K529-P531 WeakPolarHBondContact O-CD 3.41Å; K529-V538 HydrophobicContact CB-CG1 3.74Å; K529-V538 HydrophobicContact CG-CG1 4.26Å
530	Y	92.8	Very high	90.7	Very high	56 Å²	56	75.9 Å²	75.9	22%	0.22	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	79.7	-178.9	-60.1	-82.3	0	0	0	110.2	K528 F539 A542	K528-Y530 HydrophobicContact CB-CE2 3.87Å; Y530-F539 WeakPolarHBondContact CB-O 3.33Å; Y530-F539 PolarHBondContact N-O 3.4Å; Y530-F539 PolarHBondContact O-N 3.15Å; Y530-A542 HydrophobicContact CD1-CB 3.77Å; Y530-A542 HydrophobicContact CE1-CB 3.63Å; Y530-A542 HydrophobicContact CG-CB 4.29Å
531	P	90.9	Very high	90.7	Very high	71 Å²	71	75.5 Å²	75.5	46%	0.461	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	138.1	175.5	29	-35.1	0	0	0	111.1	K529 V538 R545	K529-P531 VanDerWaalsContact C-CD 3.49Å; K529-P531 WeakPolarHBondContact O-CD 3.41Å; P531-V538 HydrophobicContact CB-CG2 4.23Å; P531-R545 WeakPolarHBondContact O-CD 3.45Å
532	C	92.5	Very high	90.6	Very high	13 Å²	13	75.4 Å²	75.4	9%	0.088	37%	0.367	C	S	.	.			trans	-65.5	144.6	171.5	-178.1	0	0	0	0	111.1	Y534 C535 K537 F539 H548	C532-Y534 VanDerWaalsContact C-N 3.27Å; C532-Y534 PolarHBondContact O-N 2.89Å; C532-Y534 PolarHBondContact SG-N 3.36Å; C532-Y534 VanDerWaalsContact SG-N 3.42Å; C532-C535 WeakPolarHBondContact CB-O 3.39Å; C532-K537 WeakPolarHBondContact CB-O 3.36Å; C532-K537 PolarHBondContact N-O 3.4Å; C532-F539 HydrophobicContact CB-CE2 4.32Å; C532-H548 PolarHBondContact SG-CD2 3.15Å; C532-H548 PolarHBondContact SG-NE2 2.82Å; C532-H548 VanDerWaalsContact SG-NE2 3.36Å
533	R	91.9	Very high	90.4	Very high	188 Å²	188	78 Å²	78	71%	0.709	38%	0.379	S	S	*	.	S	Bend	trans	-78.3	-5.7	176.6	-66.1	175.6	69.4	121.5	3.6	114.8	E549	R533-E549 WeakPolarHBondContact CG-OE1 3.44Å; R533-E549 PolarHBondContact N-OE1 3.17Å
534	Y	90.1	Very high	90.3	Very high	109 Å²	109	79.5 Å²	79.5	43%	0.427	38%	0.38	S	S	.	.	S	Bend	trans	-124.7	-9	-172	-54.2	-79	0	0	0	114.7	C532 E549 H552 T553 L600	C532-Y534 VanDerWaalsContact C-N 3.27Å; C532-Y534 PolarHBondContact O-N 2.89Å; C532-Y534 PolarHBondContact SG-N 3.36Å; C532-Y534 VanDerWaalsContact SG-N 3.42Å; Y534-E549 HydrophobicContact CD2-CB 4.4Å; Y534-E549 HydrophobicContact CD2-CG 4.1Å; Y534-E549 HydrophobicContact CE2-CB 4.15Å; Y534-E549 HydrophobicContact CE2-CG 4.16Å; Y534-H552 WeakPolarHBondContact CB-ND1 3.39Å; Y534-H552 HydrophobicContact CD2-CB 3.64Å; Y534-H552 AromaticContact CD2-CG 3.97Å; Y534-H552 HydrophobicContact CE2-CB 4.23Å; Y534-H552 HydrophobicContact CG-CB 3.82Å; Y534-H552 AromaticContact CG-CG 3.93Å; Y534-T553 HydrophobicContact CE2-CG2 4.37Å; Y534-L600 HydrophobicContact CE2-CD2 3.93Å; Y534-L600 WeakPolarHBondContact OH-CD2 3.43Å
535	C	93.6	Very high	90.4	Very high	40 Å²	40	79.3 Å²	79.3	27%	0.27	38%	0.376	S	S	.	.	S	Bend	trans	-161.5	168.1	172.7	67.2	0	0	0	0	110.8	C532 K537 H548 H552	C532-C535 WeakPolarHBondContact CB-O 3.39Å; C535-K537 PolarHBondContact O-N 2.9Å; C535-H548 PolarHBondContact SG-NE2 3.48Å; C535-H548 VanDerWaalsContact SG-NE2 3.35Å; C535-H552 PolarHBondContact SG-NE2 3.11Å; C535-H552 VanDerWaalsContact SG-NE2 3.41Å
536	D	94.4	Very high	90.5	Very high	166 Å²	166	78.1 Å²	78.1	89%	0.888	37%	0.367	S	S	*	.	S	Bend	trans	-70.5	9.2	-173.6	-50.1	-55.8	0	0	0	115.1	V538	D536-V538 PolarHBondContact O-N 2.75Å
537	K	93.3	Very high	90.4	Very high	130 Å²	130	77.3 Å²	77.3	57%	0.565	37%	0.366	S	S	*	.			trans	-74.2	124.4	-178.8	-69.2	-171	177.4	-172.2	0	111.6	C532 C535 F539	C532-K537 WeakPolarHBondContact CB-O 3.36Å; C532-K537 PolarHBondContact N-O 3.4Å; C535-K537 PolarHBondContact O-N 2.9Å; K537-F539 HydrophobicContact CB-CE2 3.72Å; K537-F539 HydrophobicContact CB-CZ 4.02Å
538	V	92.6	Very high	90.7	Very high	69 Å²	69	73.6 Å²	73.6	42%	0.418	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.3	178.7	-173.9	0	0	0	0	110.5	K529 P531 D536	K529-V538 HydrophobicContact CB-CG1 3.74Å; K529-V538 HydrophobicContact CG-CG1 4.26Å; P531-V538 HydrophobicContact CB-CG2 4.23Å; D536-V538 PolarHBondContact O-N 2.75Å
539	F	90.9	Very high	90.7	Very high	39 Å²	39	69.2 Å²	69.2	17%	0.171	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	149.6	-178.8	-62.1	-93.5	0	0	0	111.3	Y530 C532 K537 L541 R545 H548	Y530-F539 WeakPolarHBondContact CB-O 3.33Å; Y530-F539 PolarHBondContact N-O 3.4Å; Y530-F539 PolarHBondContact O-N 3.15Å; C532-F539 HydrophobicContact CB-CE2 4.32Å; K537-F539 HydrophobicContact CB-CE2 3.72Å; K537-F539 HydrophobicContact CB-CZ 4.02Å; F539-L541 VanDerWaalsContact C-N 3.32Å; F539-R545 HydrophobicContact CB-CB 4.2Å; F539-R545 HydrophobicContact CD2-CB 3.95Å; F539-R545 HydrophobicContact CD2-CG 4.08Å; F539-R545 HydrophobicContact CG-CB 4.22Å; F539-H548 HydrophobicContact CE1-CB 4.18Å; F539-H548 HydrophobicContact CE2-CB 4.13Å; F539-H548 AromaticContact CE2-CD2 3.24Å; F539-H548 WeakPolarHBondContact CE2-CD2 3.46Å; F539-H548 AromaticContact CE2-CG 3.84Å; F539-H548 AromaticContact CE2-NE2 3.98Å; F539-H548 HydrophobicContact CZ-CB 3.66Å; F539-H548 AromaticContact CZ-CD2 3.31Å; F539-H548 WeakPolarHBondContact CZ-CD2 3.07Å; F539-H548 AromaticContact CZ-CG 3.45Å; F539-H548 VanDerWaalsContact CZ-CG 3.45Å; F539-H548 AromaticContact CZ-NE2 4Å
540	P	88.4	Confident	90.6	Very high	16 Å²	16	63.2 Å²	63.2	10%	0.104	30%	0.304	C	S	.	.	S	Bend	trans	-82	-9.8	173.3	33	-34	0	0	0	112.8	N522 V523 W526	N522-P540 PolarHBondContact ND2-O 3.03Å; V523-P540 HydrophobicContact CB-CB 4.41Å; V523-P540 HydrophobicContact CG2-CB 4.04Å; V523-P540 HydrophobicContact CG2-CG 4.05Å; W526-P540 HydrophobicContact CD2-CB 4.32Å; W526-P540 HydrophobicContact CE3-CB 4.09Å; W526-P540 HydrophobicContact CH2-CB 3.92Å; W526-P540 HydrophobicContact CH2-CG 3.96Å; W526-P540 HydrophobicContact CZ2-CB 4.1Å; W526-P540 HydrophobicContact CZ2-CG 4.23Å; W526-P540 HydrophobicContact CZ3-CB 3.89Å; W526-P540 HydrophobicContact CZ3-CG 4.34Å
541	L	90.8	Very high	90.5	Very high	9 Å²	9	65.4 Å²	65.4	5%	0.047	32%	0.316	C	S	.	.	S	Bend	trans	-131.6	138	179.3	-84.1	80.3	0	0	0	111.4	R519 V523 F539 E543 Y544 R545	R519-L541 HydrophobicContact CG-CD2 3.64Å; R519-L541 HydrophobicContact CG-CG 4.11Å; V523-L541 HydrophobicContact CG2-CD1 3.38Å; F539-L541 VanDerWaalsContact C-N 3.32Å; L541-E543 VanDerWaalsContact C-N 3.32Å; L541-E543 HydrophobicContact CB-CG 3.98Å; L541-E543 HydrophobicContact CD2-CG 3.87Å; L541-E543 PolarHBondContact O-N 3.25Å; L541-Y544 HydrophobicContact CB-CD1 4.37Å; L541-Y544 HydrophobicContact CB-CD2 3.79Å; L541-Y544 HydrophobicContact CB-CE2 4.19Å; L541-Y544 HydrophobicContact CB-CG 3.88Å; L541-Y544 HydrophobicContact CD1-CD2 4.26Å; L541-Y544 HydrophobicContact CD1-CE2 3.96Å; L541-Y544 HydrophobicContact CD2-CD2 4.44Å; L541-Y544 HydrophobicContact CD2-CE1 4.12Å; L541-Y544 HydrophobicContact CD2-CE2 4.03Å; L541-Y544 HydrophobicContact CG-CD2 4.39Å; L541-Y544 HydrophobicContact CG-CE2 4.3Å; L541-Y544 PolarHBondContact O-N 2.89Å; L541-R545 PolarHBondContact O-N 3.01Å; L541-R545 VanDerWaalsContact O-N 3.13Å
542	A	88.4	Confident	90.4	Very high	40 Å²	40	65.9 Å²	65.9	33%	0.331	31%	0.312	S	S	.	.	H	α-helix	trans	-61.1	-37.4	177	0	0	0	0	0	113.2	Y530 R545 T546	Y530-A542 HydrophobicContact CD1-CB 3.77Å; Y530-A542 HydrophobicContact CE1-CB 3.63Å; Y530-A542 HydrophobicContact CG-CB 4.29Å; A542-R545 PolarHBondContact O-N 3.48Å; A542-T546 WeakPolarHBondContact O-CB 3.35Å; A542-T546 PolarHBondContact O-N 3.29Å; A542-T546 PolarHBondContact O-OG1 3.13Å
543	E	86.4	Confident	90.2	Very high	72 Å²	72	67.6 Å²	67.6	34%	0.336	32%	0.322	S	S	.	.	H	α-helix	trans	-65.7	-35.9	176.4	54.6	-174.6	-105	0	0	112.4	R519 L541 T546 K547	R519-E543 WeakPolarHBondContact CD-OE2 3.15Å; R519-E543 IonicContact CZ-OE2 3.68Å; R519-E543 IonicContact NE-OE2 3.73Å; R519-E543 IonicContact NH1-OE1 3.48Å; R519-E543 PolarHBondContact NH1-OE1 3.24Å; R519-E543 IonicContact NH1-OE2 2.64Å; R519-E543 PolarHBondContact NH1-OE2 3.5Å; L541-E543 VanDerWaalsContact C-N 3.32Å; L541-E543 HydrophobicContact CB-CG 3.98Å; L541-E543 HydrophobicContact CD2-CG 3.87Å; L541-E543 PolarHBondContact O-N 3.25Å; E543-T546 PolarHBondContact O-N 2.92Å; E543-K547 WeakPolarHBondContact O-CB 3.48Å; E543-K547 WeakPolarHBondContact O-CG 3.3Å; E543-K547 PolarHBondContact O-N 3.36Å
544	Y	88.5	Confident	90	Very high	79 Å²	79	60.1 Å²	60.1	31%	0.31	30%	0.304	S	S	.	.	H	α-helix	trans	-70.9	-43.1	175.9	-62.9	-9.9	0	0	0	111.1	L541 T546 K547 H548	L541-Y544 HydrophobicContact CB-CD1 4.37Å; L541-Y544 HydrophobicContact CB-CD2 3.79Å; L541-Y544 HydrophobicContact CB-CE2 4.19Å; L541-Y544 HydrophobicContact CB-CG 3.88Å; L541-Y544 HydrophobicContact CD1-CD2 4.26Å; L541-Y544 HydrophobicContact CD1-CE2 3.96Å; L541-Y544 HydrophobicContact CD2-CD2 4.44Å; L541-Y544 HydrophobicContact CD2-CE1 4.12Å; L541-Y544 HydrophobicContact CD2-CE2 4.03Å; L541-Y544 HydrophobicContact CG-CD2 4.39Å; L541-Y544 HydrophobicContact CG-CE2 4.3Å; L541-Y544 PolarHBondContact O-N 2.89Å; Y544-T546 VanDerWaalsContact C-N 3.34Å; Y544-T546 PolarHBondContact O-N 3.32Å; Y544-K547 PolarHBondContact O-N 3.4Å; Y544-H548 WeakPolarHBondContact O-CB 3.25Å; Y544-H548 PolarHBondContact O-N 3.42Å
545	R	92.1	Very high	90	Very high	64 Å²	64	56.7 Å²	56.7	24%	0.242	29%	0.291	C	S	.	.	H	α-helix	trans	-57.1	-49.1	171.1	-168.6	-155.6	64.5	-154.8	-0.1	110.7	P531 F539 L541 A542 K547 H548 E549	P531-R545 WeakPolarHBondContact O-CD 3.45Å; F539-R545 HydrophobicContact CB-CB 4.2Å; F539-R545 HydrophobicContact CD2-CB 3.95Å; F539-R545 HydrophobicContact CD2-CG 4.08Å; F539-R545 HydrophobicContact CG-CB 4.22Å; L541-R545 PolarHBondContact O-N 3.01Å; L541-R545 VanDerWaalsContact O-N 3.13Å; A542-R545 PolarHBondContact O-N 3.48Å; R545-K547 PolarHBondContact O-N 3.39Å; R545-H548 CarbonylContact O-C 3.59Å; R545-H548 WeakPolarHBondContact O-CB 3.48Å; R545-H548 PolarHBondContact O-N 3.21Å; R545-H548 VanDerWaalsContact O-N 3.13Å; R545-E549 WeakPolarHBondContact CD-OE1 3.41Å; R545-E549 WeakPolarHBondContact CD-OE2 3.25Å; R545-E549 HydrophobicContact CG-CG 4.17Å; R545-E549 IonicContact CZ-OE2 3.69Å; R545-E549 VanDerWaalsContact NE-CD 3.32Å; R545-E549 IonicContact NE-OE1 3.36Å; R545-E549 PolarHBondContact NE-OE1 3.02Å; R545-E549 IonicContact NE-OE2 3.86Å; R545-E549 PolarHBondContact NE-OE2 3.3Å; R545-E549 IonicContact NH2-OE2 2.75Å; R545-E549 WeakPolarHBondContact O-CB 3.43Å; R545-E549 WeakPolarHBondContact O-CG 3.4Å; R545-E549 PolarHBondContact O-N 3.04Å
546	T	88.6	Confident	89.9	Confident	28 Å²	28	63 Å²	63	17%	0.172	31%	0.309	C	S	.	.	H	α-helix	trans	-60.3	-45.8	-179.5	-59.1	0	0	0	0	112.1	A542 E543 Y544 H548 E549 I550 I602	A542-T546 WeakPolarHBondContact O-CB 3.35Å; A542-T546 PolarHBondContact O-N 3.29Å; A542-T546 PolarHBondContact O-OG1 3.13Å; E543-T546 PolarHBondContact O-N 2.92Å; Y544-T546 VanDerWaalsContact C-N 3.34Å; Y544-T546 PolarHBondContact O-N 3.32Å; T546-H548 VanDerWaalsContact C-N 3.29Å; T546-H548 PolarHBondContact O-N 2.97Å; T546-E549 PolarHBondContact O-N 3.38Å; T546-I550 HydrophobicContact CG2-CD1 4.38Å; T546-I550 WeakPolarHBondContact O-CG1 3.46Å; T546-I550 PolarHBondContact O-N 2.81Å; T546-I602 HydrophobicContact CG2-CG2 3.75Å
547	K	88.5	Confident	89.7	Confident	87 Å²	87	56.4 Å²	56.4	38%	0.378	27%	0.272	S	S	.	.	H	α-helix	trans	-61.4	-37.7	175.6	-77.8	-179.7	172.7	-177.5	0	111.8	E543 Y544 R545 H551 E678	E543-K547 WeakPolarHBondContact O-CB 3.48Å; E543-K547 WeakPolarHBondContact O-CG 3.3Å; E543-K547 PolarHBondContact O-N 3.36Å; Y544-K547 PolarHBondContact O-N 3.4Å; R545-K547 PolarHBondContact O-N 3.39Å; K547-H551 PolarHBondContact O-ND1 3.25Å; K547-E678 VanDerWaalsContact CE-OE1 3.27Å; K547-E678 WeakPolarHBondContact CE-OE1 3.1Å; K547-E678 IonicContact NZ-OE1 2.79Å; K547-E678 PolarHBondContact NZ-OE1 3.36Å
548	H	89.9	Confident	89.6	Confident	35 Å²	35	51.4 Å²	51.4	16%	0.162	25%	0.25	C	C	.	.	H	α-helix	trans	-70.5	-40.1	174.6	168.7	58.6	0	0	0	113.3	C532 C535 F539 Y544 R545 T546 I550 H551 H552	C532-H548 PolarHBondContact SG-CD2 3.15Å; C532-H548 PolarHBondContact SG-NE2 2.82Å; C532-H548 VanDerWaalsContact SG-NE2 3.36Å; C535-H548 PolarHBondContact SG-NE2 3.48Å; C535-H548 VanDerWaalsContact SG-NE2 3.35Å; F539-H548 HydrophobicContact CE1-CB 4.18Å; F539-H548 HydrophobicContact CE2-CB 4.13Å; F539-H548 AromaticContact CE2-CD2 3.24Å; F539-H548 WeakPolarHBondContact CE2-CD2 3.46Å; F539-H548 AromaticContact CE2-CG 3.84Å; F539-H548 AromaticContact CE2-NE2 3.98Å; F539-H548 HydrophobicContact CZ-CB 3.66Å; F539-H548 AromaticContact CZ-CD2 3.31Å; F539-H548 WeakPolarHBondContact CZ-CD2 3.07Å; F539-H548 AromaticContact CZ-CG 3.45Å; F539-H548 VanDerWaalsContact CZ-CG 3.45Å; F539-H548 AromaticContact CZ-NE2 4Å; Y544-H548 WeakPolarHBondContact O-CB 3.25Å; Y544-H548 PolarHBondContact O-N 3.42Å; R545-H548 CarbonylContact O-C 3.59Å; R545-H548 WeakPolarHBondContact O-CB 3.48Å; R545-H548 PolarHBondContact O-N 3.21Å; R545-H548 VanDerWaalsContact O-N 3.13Å; T546-H548 VanDerWaalsContact C-N 3.29Å; T546-H548 PolarHBondContact O-N 2.97Å; H548-I550 VanDerWaalsContact C-N 3.29Å; H548-I550 PolarHBondContact O-N 3.46Å; H548-H551 WeakPolarHBondContact O-CA 3.39Å; H548-H551 WeakPolarHBondContact O-CB 3.48Å; H548-H551 PolarHBondContact O-N 3.12Å; H548-H552 AromaticContact CE1-CD2 3.49Å; H548-H552 PolarHBondContact CE1-CD2 2.64Å; H548-H552 VanDerWaalsContact CE1-CD2 3.49Å; H548-H552 AromaticContact CE1-NE2 3.19Å; H548-H552 PolarHBondContact CE1-NE2 2.83Å; H548-H552 AromaticContact NE2-CD2 3.61Å; H548-H552 AromaticContact NE2-NE2 3.3Å; H548-H552 PolarHBondContact NE2-NE2 3.25Å; H548-H552 PolarHBondContact O-N 2.81Å
549	E	89.3	Confident	89.7	Confident	4 Å²	4	50.3 Å²	50.3	2%	0.019	24%	0.24	C	C	.	.	H	α-helix	trans	-63.1	-34.4	176.3	-73.9	173	146	0	0	111.8	R533 Y534 R545 T546 H551 H552 T553 L600	R533-E549 WeakPolarHBondContact CG-OE1 3.44Å; R533-E549 PolarHBondContact N-OE1 3.17Å; Y534-E549 HydrophobicContact CD2-CB 4.4Å; Y534-E549 HydrophobicContact CD2-CG 4.1Å; Y534-E549 HydrophobicContact CE2-CB 4.15Å; Y534-E549 HydrophobicContact CE2-CG 4.16Å; R545-E549 WeakPolarHBondContact CD-OE1 3.41Å; R545-E549 WeakPolarHBondContact CD-OE2 3.25Å; R545-E549 HydrophobicContact CG-CG 4.17Å; R545-E549 IonicContact CZ-OE2 3.69Å; R545-E549 VanDerWaalsContact NE-CD 3.32Å; R545-E549 IonicContact NE-OE1 3.36Å; R545-E549 PolarHBondContact NE-OE1 3.02Å; R545-E549 IonicContact NE-OE2 3.86Å; R545-E549 PolarHBondContact NE-OE2 3.3Å; R545-E549 IonicContact NH2-OE2 2.75Å; R545-E549 WeakPolarHBondContact O-CB 3.43Å; R545-E549 WeakPolarHBondContact O-CG 3.4Å; R545-E549 PolarHBondContact O-N 3.04Å; T546-E549 PolarHBondContact O-N 3.38Å; E549-H551 PolarHBondContact O-N 3.36Å; E549-H552 WeakPolarHBondContact O-CB 3.47Å; E549-H552 PolarHBondContact O-N 3.2Å; E549-T553 PolarHBondContact O-N 2.82Å; E549-L600 HydrophobicContact CB-CD1 3.57Å; E549-L600 HydrophobicContact CB-CD2 4.06Å; E549-L600 HydrophobicContact CB-CG 4.5Å
550	I	89.8	Confident	89.9	Confident	13 Å²	13	48.5 Å²	48.5	7%	0.067	23%	0.232	C	C	.	.	H	α-helix	trans	-61.6	-30.5	171.4	-68.7	168.3	0	0	0	111.8	T546 H548 T553 G554 I568 L600	T546-I550 HydrophobicContact CG2-CD1 4.38Å; T546-I550 WeakPolarHBondContact O-CG1 3.46Å; T546-I550 PolarHBondContact O-N 2.81Å; H548-I550 VanDerWaalsContact C-N 3.29Å; H548-I550 PolarHBondContact O-N 3.46Å; I550-T553 PolarHBondContact O-N 2.83Å; I550-T553 PolarHBondContact O-OG1 2.86Å; I550-G554 PolarHBondContact O-N 2.93Å; I550-I568 HydrophobicContact CG2-CG1 3.91Å; I550-L600 HydrophobicContact CG1-CD1 3.72Å
551	H	89.3	Confident	90.1	Very high	101 Å²	101	51.1 Å²	51.1	47%	0.468	25%	0.245	S	C	.	.	H	α-helix	trans	-73.9	-26.8	174.5	-68.4	74.7	0	0	0	112.6	K547 H548 E549	K547-H551 PolarHBondContact O-ND1 3.25Å; H548-H551 WeakPolarHBondContact O-CA 3.39Å; H548-H551 WeakPolarHBondContact O-CB 3.48Å; H548-H551 PolarHBondContact O-N 3.12Å; E549-H551 PolarHBondContact O-N 3.36Å
552	H	89.4	Confident	90.1	Very high	82 Å²	82	54 Å²	54	38%	0.38	26%	0.263	S	S	.	.	H	α-helix	trans	-73.2	-36.3	170.1	-81.1	-83.4	0	0	0	112.5	Y534 C535 H548 E549	Y534-H552 WeakPolarHBondContact CB-ND1 3.39Å; Y534-H552 HydrophobicContact CD2-CB 3.64Å; Y534-H552 AromaticContact CD2-CG 3.97Å; Y534-H552 HydrophobicContact CE2-CB 4.23Å; Y534-H552 HydrophobicContact CG-CB 3.82Å; Y534-H552 AromaticContact CG-CG 3.93Å; C535-H552 PolarHBondContact SG-NE2 3.11Å; C535-H552 VanDerWaalsContact SG-NE2 3.41Å; H548-H552 AromaticContact CE1-CD2 3.49Å; H548-H552 PolarHBondContact CE1-CD2 2.64Å; H548-H552 VanDerWaalsContact CE1-CD2 3.49Å; H548-H552 AromaticContact CE1-NE2 3.19Å; H548-H552 PolarHBondContact CE1-NE2 2.83Å; H548-H552 AromaticContact NE2-CD2 3.61Å; H548-H552 AromaticContact NE2-NE2 3.3Å; H548-H552 PolarHBondContact NE2-NE2 3.25Å; H548-H552 PolarHBondContact O-N 2.81Å; E549-H552 WeakPolarHBondContact O-CB 3.47Å; E549-H552 PolarHBondContact O-N 3.2Å
553	T	88.2	Confident	90.3	Very high	49 Å²	49	54.5 Å²	54.5	30%	0.301	26%	0.264	S	S	.	.	H	α-helix	trans	-82.9	-16.3	177.7	65.5	0	0	0	0	113.8	Y534 E549 I550 E555 S599 L600	Y534-T553 HydrophobicContact CE2-CG2 4.37Å; E549-T553 PolarHBondContact O-N 2.82Å; I550-T553 PolarHBondContact O-N 2.83Å; I550-T553 PolarHBondContact O-OG1 2.86Å; T553-E555 PolarHBondContact O-N 3Å; T553-S599 WeakPolarHBondContact CB-OG 3.41Å; T553-S599 WeakPolarHBondContact OG1-CB 3.17Å; T553-S599 PolarHBondContact OG1-OG 2.89Å; T553-L600 HydrophobicContact CG2-CD2 3.83Å; T553-L600 HydrophobicContact CG2-CG 4.22Å
554	G	88.2	Confident	90.6	Very high	31 Å²	31	52.8 Å²	52.8	32%	0.32	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	15.6	-179.6	0	0	0	0	0	114.3	I550 R556	I550-G554 PolarHBondContact O-N 2.93Å; G554-R556 PolarHBondContact O-N 3.08Å
555	E	89.6	Confident	90.8	Very high	36 Å²	36	54.5 Å²	54.5	17%	0.168	27%	0.274	C	S	.	.			trans	-71.5	111.1	-168	-168.4	178.8	-147.6	0	0	112.4	T553 R557 C597 R598 S599	T553-E555 PolarHBondContact O-N 3Å; E555-R557 VanDerWaalsContact C-N 3.33Å; E555-R557 HydrophobicContact CB-CG 4.36Å; E555-R557 HydrophobicContact CG-CG 3.76Å; E555-R557 PolarHBondContact O-N 3.01Å; E555-C597 WeakPolarHBondContact OE2-CA 3.49Å; E555-C597 PolarHBondContact OE2-SG 2.86Å; E555-R598 PolarHBondContact OE1-N 3.08Å; E555-S599 WeakPolarHBondContact CB-OG 3.38Å; E555-S599 VanDerWaalsContact CD-OG 3.27Å; E555-S599 PolarHBondContact OE1-N 3.08Å; E555-S599 WeakPolarHBondContact OE2-CB 3.45Å; E555-S599 PolarHBondContact OE2-N 2.81Å; E555-S599 PolarHBondContact OE2-OG 2.84Å
556	R	91.1	Very high	90.9	Very high	173 Å²	173	53.4 Å²	53.4	65%	0.653	28%	0.277	S	S	*	.			trans	-80.7	73.7	-177.4	-70.5	175	171.4	94	-5.1	111.9	G554 S566 F567	G554-R556 PolarHBondContact O-N 3.08Å; R556-S566 WeakPolarHBondContact CD-O 3.39Å; R556-F567 CarbonylContact C-O 3.56Å; R556-F567 VanDerWaalsContact CA-O 3.26Å; R556-F567 WeakPolarHBondContact CA-O 3.32Å
557	R	89.3	Confident	91.1	Very high	27 Å²	27	53.6 Å²	53.6	10%	0.102	28%	0.275	C	S	.	.			trans	-74.2	-25.4	-173.4	-64.9	-174.7	59	-150.1	-8.8	115.8	E555 F567 L594 H595	E555-R557 VanDerWaalsContact C-N 3.33Å; E555-R557 HydrophobicContact CB-CG 4.36Å; E555-R557 HydrophobicContact CG-CG 3.76Å; E555-R557 PolarHBondContact O-N 3.01Å; R557-F567 PolarHBondContact N-O 2.96Å; R557-L594 HydrophobicContact CB-CD1 3.9Å; R557-H595 VanDerWaalsContact CZ-O 3.32Å; R557-H595 PolarHBondContact NE-O 3.19Å; R557-H595 PolarHBondContact NH2-O 3.34Å; R557-H595 PolarHBondContact O-N 2.96Å
558	Y	93.1	Very high	91.1	Very high	25 Å²	25	51.4 Å²	51.4	10%	0.098	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	106.7	-174.8	-68.7	-104.9	0	0	0	110.4	S566 F567 Y570 M573 Y592 L594 E678	Y558-S566 CarbonylContact O-C 3.49Å; Y558-S566 WeakPolarHBondContact O-CA 3.44Å; Y558-F567 PolarHBondContact N-O 3.29Å; Y558-F567 WeakPolarHBondContact O-CD2 3.05Å; Y558-F567 PolarHBondContact O-N 3.01Å; Y558-Y570 HydrophobicContact CD1-CD2 4.27Å; Y558-Y570 AromaticContact CE1-CD2 3.96Å; Y558-Y570 HydrophobicContact CE1-CD2 3.96Å; Y558-Y570 HydrophobicContact CE1-CG 4.26Å; Y558-M573 HydrophobicContact CD1-SD 3.98Å; Y558-M573 HydrophobicContact CG-SD 4.45Å; Y558-Y592 HydrophobicContact CD1-CD2 4.26Å; Y558-Y592 HydrophobicContact CD1-CE2 4.14Å; Y558-Y592 HydrophobicContact CE1-CE2 4.47Å; Y558-L594 HydrophobicContact CD1-CD1 4.05Å; Y558-L594 HydrophobicContact CD2-CD1 3.89Å; Y558-L594 HydrophobicContact CE1-CD1 3.99Å; Y558-L594 HydrophobicContact CE2-CD1 3.81Å; Y558-L594 HydrophobicContact CG-CD1 4.01Å; Y558-E678 PolarHBondContact OH-OE2 2.86Å
559	Q	93.4	Very high	91.1	Very high	47 Å²	47	51.2 Å²	51.2	22%	0.22	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	122.8	-179.4	-174.7	174.4	33.3	0	0	111.6	G564 K565 Y592 R593 H595	Q559-G564 WeakPolarHBondContact CG-O 3.47Å; Q559-G564 PolarHBondContact NE2-O 2.88Å; Q559-K565 WeakPolarHBondContact CA-O 3.29Å; Q559-Y592 CarbonylContact O-C 3.14Å; Q559-Y592 WeakPolarHBondContact O-CA 3.42Å; Q559-Y592 WeakPolarHBondContact O-CB 3.3Å; Q559-R593 PolarHBondContact N-O 3.24Å; Q559-R593 PolarHBondContact O-N 2.93Å; Q559-H595 PolarHBondContact OE1-NE2 3.26Å
560	C	95.3	Very high	91.2	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	130.6	166.5	175.9	0	0	0	0	109.7	T562 G564 K565 F567 I577	C560-T562 PolarHBondContact SG-N 2.94Å; C560-T562 VanDerWaalsContact SG-N 3.42Å; C560-G564 CarbonylContact O-C 3.51Å; C560-G564 WeakPolarHBondContact O-CA 3.42Å; C560-G564 PolarHBondContact O-N 3.08Å; C560-K565 PolarHBondContact N-O 3.21Å; C560-F567 HydrophobicContact CB-CE2 4.14Å; C560-I577 HydrophobicContact CB-CD1 4.3Å; C560-I577 HydrophobicContact CB-CG1 4.28Å
561	L	93.6	Very high	91.2	Very high	72 Å²	72	56.6 Å²	56.6	38%	0.377	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-22	179.8	-68.3	171	0	0	0	112.8	K590 L591 R593	L561-K590 WeakPolarHBondContact CD1-O 3.37Å; L561-L591 PolarHBondContact N-O 3.35Å; L561-R593 HydrophobicContact CD1-CB 4.33Å; L561-R593 HydrophobicContact CD2-CB 4.03Å; L561-R593 HydrophobicContact CG-CB 4.32Å
562	T	90.5	Very high	91.4	Very high	70 Å²	70	55.1 Å²	55.1	43%	0.429	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-31.5	178.9	-40.8	0	0	0	0	113.3	C560 H581	C560-T562 PolarHBondContact SG-N 2.94Å; C560-T562 VanDerWaalsContact SG-N 3.42Å; T562-H581 HydrophobicContact CG2-CB 4.45Å
563	C	93.1	Very high	91.6	Very high	50 Å²	50	51.2 Å²	51.2	34%	0.338	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.2	9.3	179.1	70.8	0	0	0	0	115.3	K565 H576 H581	C563-K565 PolarHBondContact O-N 2.96Å; C563-K565 VanDerWaalsContact SG-CG 3.6Å; C563-H576 VanDerWaalsContact SG-CE1 3.56Å; C563-H576 PolarHBondContact SG-NE2 2.86Å; C563-H581 PolarHBondContact SG-NE2 3.44Å
564	G	92.1	Very high	91.8	Very high	36 Å²	36	48.9 Å²	48.9	37%	0.371	26%	0.256	S	S	.	.			trans	70.8	-8.4	176.7	0	0	0	0	0	116.5	Q559 C560	Q559-G564 WeakPolarHBondContact CG-O 3.47Å; Q559-G564 PolarHBondContact NE2-O 2.88Å; C560-G564 CarbonylContact O-C 3.51Å; C560-G564 WeakPolarHBondContact O-CA 3.42Å; C560-G564 PolarHBondContact O-N 3.08Å
565	K	93.3	Very high	92.1	Very high	114 Å²	114	50.8 Å²	50.8	50%	0.496	26%	0.264	S	S	.	.			trans	-63.1	138.9	-178.2	-68.4	178.3	-175.1	174.4	0	111.7	Q559 C560 C563 F567	Q559-K565 WeakPolarHBondContact CA-O 3.29Å; C560-K565 PolarHBondContact N-O 3.21Å; C563-K565 PolarHBondContact O-N 2.96Å; C563-K565 VanDerWaalsContact SG-CG 3.6Å; K565-F567 HydrophobicContact CB-CE2 3.72Å; K565-F567 HydrophobicContact CB-CZ 3.57Å; K565-F567 HydrophobicContact CD-CZ 4.4Å; K565-F567 VanDerWaalsContact O-CE2 3.25Å; K565-F567 WeakPolarHBondContact O-CE2 3.23Å
566	S	94	Very high	92.3	Very high	42 Å²	42	49.9 Å²	49.9	29%	0.294	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	142.9	-178.7	-58.1	0	0	0	0	112.8	R556 Y558	R556-S566 WeakPolarHBondContact CD-O 3.39Å; Y558-S566 CarbonylContact O-C 3.49Å; Y558-S566 WeakPolarHBondContact O-CA 3.44Å
567	F	92.6	Very high	92.3	Very high	32 Å²	32	41.6 Å²	41.6	14%	0.14	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	156.1	-170.1	-55	-80.3	0	0	0	111.6	R556 R557 Y558 C560 K565 V572 M573 H576	R556-F567 CarbonylContact C-O 3.56Å; R556-F567 VanDerWaalsContact CA-O 3.26Å; R556-F567 WeakPolarHBondContact CA-O 3.32Å; R557-F567 PolarHBondContact N-O 2.96Å; Y558-F567 PolarHBondContact N-O 3.29Å; Y558-F567 WeakPolarHBondContact O-CD2 3.05Å; Y558-F567 PolarHBondContact O-N 3.01Å; C560-F567 HydrophobicContact CB-CE2 4.14Å; K565-F567 HydrophobicContact CB-CE2 3.72Å; K565-F567 HydrophobicContact CB-CZ 3.57Å; K565-F567 HydrophobicContact CD-CZ 4.4Å; K565-F567 VanDerWaalsContact O-CE2 3.25Å; K565-F567 WeakPolarHBondContact O-CE2 3.23Å; F567-V572 HydrophobicContact CB-CG1 4.47Å; F567-V572 HydrophobicContact CD1-CG1 3.68Å; F567-V572 HydrophobicContact CE1-CG1 4.39Å; F567-V572 HydrophobicContact CG-CG1 4.39Å; F567-M573 HydrophobicContact CB-CB 3.99Å; F567-M573 HydrophobicContact CD2-CB 3.86Å; F567-M573 HydrophobicContact CD2-CG 3.93Å; F567-M573 HydrophobicContact CG-CB 4.09Å; F567-H576 HydrophobicContact CE1-CB 4.11Å; F567-H576 HydrophobicContact CE2-CB 4.35Å; F567-H576 AromaticContact CE2-CD2 3.2Å; F567-H576 WeakPolarHBondContact CE2-CD2 3.2Å; F567-H576 AromaticContact CE2-CG 3.9Å; F567-H576 AromaticContact CE2-NE2 3.89Å; F567-H576 HydrophobicContact CZ-CB 3.82Å; F567-H576 AromaticContact CZ-CD2 3.13Å; F567-H576 WeakPolarHBondContact CZ-CD2 3.27Å; F567-H576 AromaticContact CZ-CG 3.38Å; F567-H576 AromaticContact CZ-NE2 3.76Å
568	I	88.7	Confident	92.5	Very high	40 Å²	40	46.5 Å²	46.5	21%	0.205	25%	0.247	C	C	.	.	S	Bend	trans	-79.7	-27.2	-172.3	-160.8	164.2	0	0	0	113.7	I550	I550-I568 HydrophobicContact CG2-CG1 3.91Å
569	N	90.1	Very high	92.6	Very high	32 Å²	32	49.3 Å²	49.3	17%	0.171	27%	0.271	C	S	.	.	S	Bend	trans	-145.7	167.5	-178.9	63.8	39.7	0	0	0	111.3	Q571 V572 M573	N569-Q571 VanDerWaalsContact C-N 3.31Å; N569-Q571 PolarHBondContact O-N 3.34Å; N569-Q571 PolarHBondContact OD1-N 3.3Å; N569-V572 WeakPolarHBondContact OD1-CB 3.21Å; N569-V572 WeakPolarHBondContact OD1-CG2 3.28Å; N569-V572 PolarHBondContact OD1-N 3.41Å; N569-M573 PolarHBondContact O-N 3.39Å
570	Y	90.9	Very high	92.6	Very high	42 Å²	42	50.8 Å²	50.8	17%	0.165	28%	0.283	C	S	.	.	H	α-helix	trans	-62.3	-37.7	178.7	-178.1	-99.4	0	0	0	112.4	Y558 M573 A574 Y592	Y558-Y570 HydrophobicContact CD1-CD2 4.27Å; Y558-Y570 AromaticContact CE1-CD2 3.96Å; Y558-Y570 HydrophobicContact CE1-CD2 3.96Å; Y558-Y570 HydrophobicContact CE1-CG 4.26Å; Y570-M573 HydrophobicContact CD2-CE 3.5Å; Y570-M573 HydrophobicContact CD2-SD 4.43Å; Y570-M573 HydrophobicContact CE2-CE 3.44Å; Y570-M573 VanDerWaalsContact CE2-CE 3.44Å; Y570-M573 HydrophobicContact CG-CE 4.33Å; Y570-M573 WeakPolarHBondContact O-CB 3.3Å; Y570-M573 PolarHBondContact O-N 3.47Å; Y570-A574 HydrophobicContact CD1-CB 4.23Å; Y570-A574 HydrophobicContact CE1-CB 3.85Å; Y570-A574 VanDerWaalsContact O-CB 3.25Å; Y570-A574 WeakPolarHBondContact O-CB 3.4Å; Y570-A574 PolarHBondContact O-N 2.91Å; Y570-Y592 AromaticContact CE2-CE1 3.98Å; Y570-Y592 HydrophobicContact CE2-CE1 3.98Å; Y570-Y592 AromaticContact CE2-CZ 3.89Å
571	Q	90.4	Very high	92.4	Very high	88 Å²	88	52.8 Å²	52.8	41%	0.411	29%	0.292	S	S	.	.	H	α-helix	trans	-64.6	-46.2	-172	-66.1	72.1	18.2	0	0	111.7	N569 A574 S575 E678	N569-Q571 VanDerWaalsContact C-N 3.31Å; N569-Q571 PolarHBondContact O-N 3.34Å; N569-Q571 PolarHBondContact OD1-N 3.3Å; Q571-A574 PolarHBondContact O-N 3.07Å; Q571-S575 WeakPolarHBondContact O-CB 3.33Å; Q571-S575 PolarHBondContact O-N 3.3Å; Q571-E678 PolarHBondContact NE2-O 3.37Å
572	V	91.9	Very high	92.3	Very high	70 Å²	70	54.8 Å²	54.8	42%	0.424	31%	0.312	S	S	.	.	H	α-helix	trans	-68.1	-41.5	176	177.6	0	0	0	0	110.9	F567 N569 A574 S575 H576	F567-V572 HydrophobicContact CB-CG1 4.47Å; F567-V572 HydrophobicContact CD1-CG1 3.68Å; F567-V572 HydrophobicContact CE1-CG1 4.39Å; F567-V572 HydrophobicContact CG-CG1 4.39Å; N569-V572 WeakPolarHBondContact OD1-CB 3.21Å; N569-V572 WeakPolarHBondContact OD1-CG2 3.28Å; N569-V572 PolarHBondContact OD1-N 3.41Å; V572-A574 PolarHBondContact O-N 3.4Å; V572-S575 PolarHBondContact O-N 3.05Å; V572-H576 WeakPolarHBondContact O-CB 3.11Å; V572-H576 PolarHBondContact O-N 3.04Å
573	M	94.4	Very high	92.2	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.2	-43.9	175.1	-178.5	-139.2	68.7	0	0	111.9	Y558 F567 N569 Y570 H576 I577 P585 Y592	Y558-M573 HydrophobicContact CD1-SD 3.98Å; Y558-M573 HydrophobicContact CG-SD 4.45Å; F567-M573 HydrophobicContact CB-CB 3.99Å; F567-M573 HydrophobicContact CD2-CB 3.86Å; F567-M573 HydrophobicContact CD2-CG 3.93Å; F567-M573 HydrophobicContact CG-CB 4.09Å; N569-M573 PolarHBondContact O-N 3.39Å; Y570-M573 HydrophobicContact CD2-CE 3.5Å; Y570-M573 HydrophobicContact CD2-SD 4.43Å; Y570-M573 HydrophobicContact CE2-CE 3.44Å; Y570-M573 VanDerWaalsContact CE2-CE 3.44Å; Y570-M573 HydrophobicContact CG-CE 4.33Å; Y570-M573 WeakPolarHBondContact O-CB 3.3Å; Y570-M573 PolarHBondContact O-N 3.47Å; M573-H576 WeakPolarHBondContact O-CB 3.4Å; M573-H576 PolarHBondContact O-N 3.32Å; M573-I577 HydrophobicContact CE-CD1 4.09Å; M573-I577 HydrophobicContact CG-CD1 4.02Å; M573-I577 WeakPolarHBondContact O-CG1 3.49Å; M573-I577 PolarHBondContact O-N 2.8Å; M573-I577 HydrophobicContact SD-CD1 4.2Å; M573-P585 HydrophobicContact CE-CB 3.96Å; M573-P585 HydrophobicContact CE-CG 4.03Å; M573-Y592 HydrophobicContact CE-CD1 3.88Å; M573-Y592 HydrophobicContact CE-CD2 4.34Å; M573-Y592 HydrophobicContact CE-CE1 4.22Å; M573-Y592 HydrophobicContact CE-CG 3.95Å; M573-Y592 WeakPolarHBondContact SD-CB 3.4Å; M573-Y592 HydrophobicContact SD-CD1 3.9Å; M573-Y592 HydrophobicContact SD-CD2 3.48Å; M573-Y592 WeakPolarHBondContact SD-CD2 3.33Å; M573-Y592 HydrophobicContact SD-CE2 4.19Å; M573-Y592 HydrophobicContact SD-CG 3.31Å
574	A	92.4	Very high	92	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-76.6	-29.9	-177.8	0	0	0	0	0	113.3	Y570 Q571 V572 R578 P585	Y570-A574 HydrophobicContact CD1-CB 4.23Å; Y570-A574 HydrophobicContact CE1-CB 3.85Å; Y570-A574 VanDerWaalsContact O-CB 3.25Å; Y570-A574 WeakPolarHBondContact O-CB 3.4Å; Y570-A574 PolarHBondContact O-N 2.91Å; Q571-A574 PolarHBondContact O-N 3.07Å; V572-A574 PolarHBondContact O-N 3.4Å; A574-R578 WeakPolarHBondContact O-CB 3.18Å; A574-R578 WeakPolarHBondContact O-CG 3.42Å; A574-R578 PolarHBondContact O-N 2.91Å; A574-R578 PolarHBondContact O-NE 3.44Å; A574-R578 VanDerWaalsContact O-NE 3.09Å; A574-P585 HydrophobicContact CB-CG 3.65Å
575	S	93.7	Very high	91.7	Very high	70 Å²	70	55.1 Å²	55.1	49%	0.49	30%	0.297	S	S	.	.	H	α-helix	trans	-60.6	-50	165.1	-177.9	0	0	0	0	110.2	Q571 V572 I577 R578 S579	Q571-S575 WeakPolarHBondContact O-CB 3.33Å; Q571-S575 PolarHBondContact O-N 3.3Å; V572-S575 PolarHBondContact O-N 3.05Å; S575-I577 PolarHBondContact O-N 2.89Å; S575-R578 PolarHBondContact O-N 2.85Å; S575-S579 WeakPolarHBondContact O-CB 3.4Å; S575-S579 PolarHBondContact O-N 2.92Å; S575-S579 PolarHBondContact O-OG 2.88Å; S575-S579 VanDerWaalsContact O-OG 3.07Å
576	H	93.5	Very high	91.4	Very high	17 Å²	17	54.2 Å²	54.2	8%	0.079	31%	0.305	C	S	.	.	H	α-helix	trans	-59.8	-46.6	178.7	159.8	56.2	0	0	0	113.9	C563 F567 V572 M573 R578 S579 V580 H581	C563-H576 VanDerWaalsContact SG-CE1 3.56Å; C563-H576 PolarHBondContact SG-NE2 2.86Å; F567-H576 HydrophobicContact CE1-CB 4.11Å; F567-H576 HydrophobicContact CE2-CB 4.35Å; F567-H576 AromaticContact CE2-CD2 3.2Å; F567-H576 WeakPolarHBondContact CE2-CD2 3.2Å; F567-H576 AromaticContact CE2-CG 3.9Å; F567-H576 AromaticContact CE2-NE2 3.89Å; F567-H576 HydrophobicContact CZ-CB 3.82Å; F567-H576 AromaticContact CZ-CD2 3.13Å; F567-H576 WeakPolarHBondContact CZ-CD2 3.27Å; F567-H576 AromaticContact CZ-CG 3.38Å; F567-H576 AromaticContact CZ-NE2 3.76Å; V572-H576 WeakPolarHBondContact O-CB 3.11Å; V572-H576 PolarHBondContact O-N 3.04Å; M573-H576 WeakPolarHBondContact O-CB 3.4Å; M573-H576 PolarHBondContact O-N 3.32Å; H576-R578 VanDerWaalsContact C-N 3.33Å; H576-R578 PolarHBondContact O-N 2.89Å; H576-S579 PolarHBondContact O-N 2.7Å; H576-S579 PolarHBondContact O-OG 3.36Å; H576-V580 VanDerWaalsContact ND1-CG2 3.34Å; H576-V580 WeakPolarHBondContact ND1-CG2 3.42Å; H576-V580 WeakPolarHBondContact O-CB 3.48Å; H576-V580 PolarHBondContact O-N 2.65Å; H576-H581 AromaticContact CE1-CD2 3.92Å; H576-H581 AromaticContact CE1-NE2 3.52Å; H576-H581 AromaticContact NE2-CD2 3.87Å; H576-H581 AromaticContact NE2-NE2 3.57Å
577	I	91.9	Very high	90.7	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-65.3	-39	-179	-66.7	172	0	0	0	110.5	C560 M573 S575 H581 S582 Q583 P585 L591	C560-I577 HydrophobicContact CB-CD1 4.3Å; C560-I577 HydrophobicContact CB-CG1 4.28Å; M573-I577 HydrophobicContact CE-CD1 4.09Å; M573-I577 HydrophobicContact CG-CD1 4.02Å; M573-I577 WeakPolarHBondContact O-CG1 3.49Å; M573-I577 PolarHBondContact O-N 2.8Å; M573-I577 HydrophobicContact SD-CD1 4.2Å; S575-I577 PolarHBondContact O-N 2.89Å; I577-H581 CarbonylContact O-C 3.52Å; I577-H581 WeakPolarHBondContact O-CA 3.43Å; I577-H581 WeakPolarHBondContact O-CB 3.43Å; I577-H581 PolarHBondContact O-N 3.22Å; I577-H581 VanDerWaalsContact O-N 3.07Å; I577-S582 PolarHBondContact O-N 2.75Å; I577-Q583 CarbonylContact C-O 3.58Å; I577-Q583 HydrophobicContact CG2-CB 4.01Å; I577-Q583 PolarHBondContact O-N 3.4Å; I577-P585 HydrophobicContact CB-CG 4.34Å; I577-P585 HydrophobicContact CD1-CB 3.98Å; I577-P585 HydrophobicContact CD1-CG 4.45Å; I577-P585 HydrophobicContact CG2-CB 4.32Å; I577-P585 HydrophobicContact CG2-CG 4.42Å; I577-L591 HydrophobicContact CD1-CB 4.23Å; I577-L591 HydrophobicContact CG2-CB 4.36Å; I577-L591 HydrophobicContact CG2-CD1 3.81Å
578	R	93.6	Very high	89.6	Confident	129 Å²	129	60.9 Å²	60.9	49%	0.487	35%	0.35	S	S	.	.	H	α-helix	trans	-69.1	-36.7	174.9	-74.2	-179.1	-67.6	-149.9	8.3	113.5	A574 S575 H576 S582 Q583 D584	A574-R578 WeakPolarHBondContact O-CB 3.18Å; A574-R578 WeakPolarHBondContact O-CG 3.42Å; A574-R578 PolarHBondContact O-N 2.91Å; A574-R578 PolarHBondContact O-NE 3.44Å; A574-R578 VanDerWaalsContact O-NE 3.09Å; S575-R578 PolarHBondContact O-N 2.85Å; H576-R578 VanDerWaalsContact C-N 3.33Å; H576-R578 PolarHBondContact O-N 2.89Å; R578-S582 WeakPolarHBondContact O-CA 3.18Å; R578-S582 PolarHBondContact O-N 2.9Å; R578-Q583 WeakPolarHBondContact CA-O 3.39Å; R578-Q583 WeakPolarHBondContact CG-O 3.09Å; R578-Q583 PolarHBondContact N-O 2.83Å; R578-D584 IonicContact NH1-OD2 3.56Å
579	S	94.6	Very high	89.2	Confident	85 Å²	85	61.5 Å²	61.5	59%	0.594	36%	0.361	S	S	*	.	H	α-helix	trans	-90.4	-22.9	-175	71	0	0	0	0	115.4	S575 H576	S575-S579 WeakPolarHBondContact O-CB 3.4Å; S575-S579 PolarHBondContact O-N 2.92Å; S575-S579 PolarHBondContact O-OG 2.88Å; S575-S579 VanDerWaalsContact O-OG 3.07Å; H576-S579 PolarHBondContact O-N 2.7Å; H576-S579 PolarHBondContact O-OG 3.36Å
580	V	94.6	Very high	89	Confident	78 Å²	78	67.4 Å²	67.4	47%	0.473	39%	0.385	S	S	.	.	H	α-helix	trans	-112.8	-22.8	-176.7	-175.1	0	0	0	0	112.5	H576	H576-V580 VanDerWaalsContact ND1-CG2 3.34Å; H576-V580 WeakPolarHBondContact ND1-CG2 3.42Å; H576-V580 WeakPolarHBondContact O-CB 3.48Å; H576-V580 PolarHBondContact O-N 2.65Å
581	H	90.5	Very high	88.9	Confident	41 Å²	41	66.5 Å²	66.5	19%	0.19	38%	0.383	C	S	.	.	S	Bend	trans	-119.7	0.1	179.7	-58.1	-48.8	0	0	0	113.5	T562 C563 H576 I577 Q583	T562-H581 HydrophobicContact CG2-CB 4.45Å; C563-H581 PolarHBondContact SG-NE2 3.44Å; H576-H581 AromaticContact CE1-CD2 3.92Å; H576-H581 AromaticContact CE1-NE2 3.52Å; H576-H581 AromaticContact NE2-CD2 3.87Å; H576-H581 AromaticContact NE2-NE2 3.57Å; I577-H581 CarbonylContact O-C 3.52Å; I577-H581 WeakPolarHBondContact O-CA 3.43Å; I577-H581 WeakPolarHBondContact O-CB 3.43Å; I577-H581 PolarHBondContact O-N 3.22Å; I577-H581 VanDerWaalsContact O-N 3.07Å; H581-Q583 VanDerWaalsContact O-CG 3.28Å; H581-Q583 WeakPolarHBondContact O-CG 3.32Å; H581-Q583 PolarHBondContact O-N 2.97Å; H581-Q583 VanDerWaalsContact O-N 3.14Å
582	S	91.6	Very high	89	Confident	114 Å²	114	65.8 Å²	65.8	80%	0.797	38%	0.377	S	S	*	.			trans	52	33.5	179.1	-56.4	0	0	0	0	113.8	I577 R578	I577-S582 PolarHBondContact O-N 2.75Å; R578-S582 WeakPolarHBondContact O-CA 3.18Å; R578-S582 PolarHBondContact O-N 2.9Å
583	Q	89	Confident	89	Confident	78 Å²	78	65.6 Å²	65.6	36%	0.364	37%	0.369	S	S	.	.			trans	-127.3	150.6	-173.6	-77.2	164.1	-7.4	0	0	110.8	I577 R578 H581 L591	I577-Q583 CarbonylContact C-O 3.58Å; I577-Q583 HydrophobicContact CG2-CB 4.01Å; I577-Q583 PolarHBondContact O-N 3.4Å; R578-Q583 WeakPolarHBondContact CA-O 3.39Å; R578-Q583 WeakPolarHBondContact CG-O 3.09Å; R578-Q583 PolarHBondContact N-O 2.83Å; H581-Q583 VanDerWaalsContact O-CG 3.28Å; H581-Q583 WeakPolarHBondContact O-CG 3.32Å; H581-Q583 PolarHBondContact O-N 2.97Å; H581-Q583 VanDerWaalsContact O-N 3.14Å; Q583-L591 HydrophobicContact CB-CD1 3.52Å; Q583-L591 HydrophobicContact CG-CD1 4.2Å
584	D	88.7	Confident	88.9	Confident	79 Å²	79	67.8 Å²	67.8	42%	0.422	38%	0.38	S	S	.	.			trans	-97	118.4	172.3	-158	-42.5	0	0	0	111.4	R578 S586 G587	R578-D584 IonicContact NH1-OD2 3.56Å; D584-S586 PolarHBondContact O-N 2.8Å; D584-S586 WeakPolarHBondContact OD1-CB 3.44Å; D584-S586 PolarHBondContact OD1-N 2.73Å; D584-G587 PolarHBondContact O-N 3.08Å
585	P	85.9	Confident	88.7	Confident	6 Å²	6	70.8 Å²	70.8	4%	0.039	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	5.4	175.2	34.5	-38.2	0	0	0	114.4	M573 A574 I577 Y592	M573-P585 HydrophobicContact CE-CB 3.96Å; M573-P585 HydrophobicContact CE-CG 4.03Å; A574-P585 HydrophobicContact CB-CG 3.65Å; I577-P585 HydrophobicContact CB-CG 4.34Å; I577-P585 HydrophobicContact CD1-CB 3.98Å; I577-P585 HydrophobicContact CD1-CG 4.45Å; I577-P585 HydrophobicContact CG2-CB 4.32Å; I577-P585 HydrophobicContact CG2-CG 4.42Å; P585-Y592 HydrophobicContact CB-CD1 4.14Å; P585-Y592 HydrophobicContact CB-CE1 4.42Å
586	S	86.3	Confident	88.3	Confident	95 Å²	95	68.2 Å²	68.2	66%	0.664	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-4.7	172.7	-165.8	0	0	0	0	113.8	D584	D584-S586 PolarHBondContact O-N 2.8Å; D584-S586 WeakPolarHBondContact OD1-CB 3.44Å; D584-S586 PolarHBondContact OD1-N 2.73Å
587	G	79.9	Confident	87.8	Confident	45 Å²	45	68.2 Å²	68.2	46%	0.464	38%	0.377	S	S	.	.	S	Bend	trans	-88.3	-177	173.8	0	0	0	0	0	113.6	D584 A589	D584-G587 PolarHBondContact O-N 3.08Å; G587-A589 PolarHBondContact O-N 3.24Å; G587-A589 VanDerWaalsContact O-N 3.08Å
588	D	70.1	Confident	87.3	Confident	169 Å²	169	78.6 Å²	78.6	90%	0.904	42%	0.417	S	S	*	.	S	Bend	trans	-62.2	-18.7	-178.4	-53.7	-62.2	0	0	0	114.1	K590	D588-K590 PolarHBondContact O-N 2.71Å
589	A	78.6	Confident	86.5	Confident	54 Å²	54	74.6 Å²	74.6	45%	0.446	41%	0.408	S	S	.	.	S	Bend	trans	-66.6	112.4	176	0	0	0	0	0	110.7	G587 L591	G587-A589 PolarHBondContact O-N 3.24Å; G587-A589 VanDerWaalsContact O-N 3.08Å; A589-L591 HydrophobicContact CB-CD1 4.13Å; A589-L591 HydrophobicContact CB-CD2 3.99Å; A589-L591 HydrophobicContact CB-CG 3.76Å; A589-L591 WeakPolarHBondContact O-CG 3.01Å; A589-L591 PolarHBondContact O-N 3.44Å
590	K	86.3	Confident	85.6	Confident	156 Å²	156	71.4 Å²	71.4	68%	0.678	39%	0.385	S	S	*	.			trans	-76.2	68	177.5	-64.9	176.4	-175.5	173.6	0	110.7	L561 D588 Y592	L561-K590 WeakPolarHBondContact CD1-O 3.37Å; D588-K590 PolarHBondContact O-N 2.71Å; K590-Y592 VanDerWaalsContact C-N 3.27Å; K590-Y592 PolarHBondContact O-N 3.1Å
591	L	89.6	Confident	84.7	Confident	23 Å²	23	75.6 Å²	75.6	12%	0.12	40%	0.399	C	S	.	.			trans	-77.6	-5	-174.1	-60.6	175.4	0	0	0	114.5	L561 I577 Q583 A589	L561-L591 PolarHBondContact N-O 3.35Å; I577-L591 HydrophobicContact CD1-CB 4.23Å; I577-L591 HydrophobicContact CG2-CB 4.36Å; I577-L591 HydrophobicContact CG2-CD1 3.81Å; Q583-L591 HydrophobicContact CB-CD1 3.52Å; Q583-L591 HydrophobicContact CG-CD1 4.2Å; A589-L591 HydrophobicContact CB-CD1 4.13Å; A589-L591 HydrophobicContact CB-CD2 3.99Å; A589-L591 HydrophobicContact CB-CG 3.76Å; A589-L591 WeakPolarHBondContact O-CG 3.01Å; A589-L591 PolarHBondContact O-N 3.44Å
592	Y	93	Very high	84.1	Confident	73 Å²	73	76.2 Å²	76.2	29%	0.286	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	162.1	179	75.6	-83	0	0	0	113.3	Y558 Q559 Y570 M573 P585 K590	Y558-Y592 HydrophobicContact CD1-CD2 4.26Å; Y558-Y592 HydrophobicContact CD1-CE2 4.14Å; Y558-Y592 HydrophobicContact CE1-CE2 4.47Å; Q559-Y592 CarbonylContact O-C 3.14Å; Q559-Y592 WeakPolarHBondContact O-CA 3.42Å; Q559-Y592 WeakPolarHBondContact O-CB 3.3Å; Y570-Y592 AromaticContact CE2-CE1 3.98Å; Y570-Y592 HydrophobicContact CE2-CE1 3.98Å; Y570-Y592 AromaticContact CE2-CZ 3.89Å; M573-Y592 HydrophobicContact CE-CD1 3.88Å; M573-Y592 HydrophobicContact CE-CD2 4.34Å; M573-Y592 HydrophobicContact CE-CE1 4.22Å; M573-Y592 HydrophobicContact CE-CG 3.95Å; M573-Y592 WeakPolarHBondContact SD-CB 3.4Å; M573-Y592 HydrophobicContact SD-CD1 3.9Å; M573-Y592 HydrophobicContact SD-CD2 3.48Å; M573-Y592 WeakPolarHBondContact SD-CD2 3.33Å; M573-Y592 HydrophobicContact SD-CE2 4.19Å; M573-Y592 HydrophobicContact SD-CG 3.31Å; P585-Y592 HydrophobicContact CB-CD1 4.14Å; P585-Y592 HydrophobicContact CB-CE1 4.42Å; K590-Y592 VanDerWaalsContact C-N 3.27Å; K590-Y592 PolarHBondContact O-N 3.1Å
593	R	91.4	Very high	83.1	Confident	65 Å²	65	80.3 Å²	80.3	25%	0.245	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	124.8	171.7	171.8	-177.1	-89.7	127.8	-11.9	108.5	Q559 L561 R611	Q559-R593 PolarHBondContact N-O 3.24Å; Q559-R593 PolarHBondContact O-N 2.93Å; L561-R593 HydrophobicContact CD1-CB 4.33Å; L561-R593 HydrophobicContact CD2-CB 4.03Å; L561-R593 HydrophobicContact CG-CB 4.32Å; R593-R611 PolarHBondContact NH2-O 3.25Å; R593-R611 VanDerWaalsContact NH2-O 3.13Å
594	L	92	Very high	82	Confident	46 Å²	46	82.1 Å²	82.1	24%	0.241	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	126.1	167.1	-180	63.5	0	0	0	109	R557 Y558 I608	R557-L594 HydrophobicContact CB-CD1 3.9Å; Y558-L594 HydrophobicContact CD1-CD1 4.05Å; Y558-L594 HydrophobicContact CD2-CD1 3.89Å; Y558-L594 HydrophobicContact CE1-CD1 3.99Å; Y558-L594 HydrophobicContact CE2-CD1 3.81Å; Y558-L594 HydrophobicContact CG-CD1 4.01Å; L594-I608 WeakPolarHBondContact O-CG2 3.39Å
595	H	87.4	Confident	80.2	Confident	63 Å²	63	84.4 Å²	84.4	29%	0.292	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-89.2	155.3	175.5	-72.1	-81	0	0	0	111.9	R557 Q559	R557-H595 VanDerWaalsContact CZ-O 3.32Å; R557-H595 PolarHBondContact NE-O 3.19Å; R557-H595 PolarHBondContact NH2-O 3.34Å; R557-H595 PolarHBondContact O-N 2.96Å; Q559-H595 PolarHBondContact OE1-NE2 3.26Å
596	P	87	Confident	78.5	Confident	17 Å²	17	87.5 Å²	87.5	11%	0.11	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-56.5	146.3	170.2	-23.1	33.9	0	0	0	111.2	R598 I608	P596-R598 PolarHBondContact O-N 2.9Å; P596-I608 HydrophobicContact CB-CG2 4.44Å; P596-I608 HydrophobicContact CG-CB 4.46Å; P596-I608 HydrophobicContact CG-CG2 3.9Å; P596-I608 WeakPolarHBondContact CG-O 3.45Å
597	C	82.3	Confident	77.2	Confident	16 Å²	16	90.6 Å²	90.6	11%	0.108	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-75.5	120.7	167.4	-174.4	0	0	0	0	107.9	E555 I602	E555-C597 WeakPolarHBondContact OE2-CA 3.49Å; E555-C597 PolarHBondContact OE2-SG 2.86Å; C597-I602 HydrophobicContact CB-CD1 3.4Å; C597-I602 VanDerWaalsContact CB-CD1 3.4Å; C597-I602 HydrophobicContact CB-CG1 3.74Å
598	R	81.5	Confident	76.1	Confident	219 Å²	219	89.3 Å²	89.3	83%	0.826	42%	0.42	S	S	*	.			trans	-107	-19.5	174.1	-60.9	-179.3	179.3	-177.5	-0.6	111.5	E555 P596	E555-R598 PolarHBondContact OE1-N 3.08Å; P596-R598 PolarHBondContact O-N 2.9Å
599	S	76.5	Confident	75.1	Confident	44 Å²	44	83.6 Å²	83.6	31%	0.308	39%	0.391	S	S	.	.	S	Bend	trans	-78.1	-20.1	-178.5	70.4	0	0	0	0	114.8	T553 E555	T553-S599 WeakPolarHBondContact CB-OG 3.41Å; T553-S599 WeakPolarHBondContact OG1-CB 3.17Å; T553-S599 PolarHBondContact OG1-OG 2.89Å; E555-S599 WeakPolarHBondContact CB-OG 3.38Å; E555-S599 VanDerWaalsContact CD-OG 3.27Å; E555-S599 PolarHBondContact OE1-N 3.08Å; E555-S599 WeakPolarHBondContact OE2-CB 3.45Å; E555-S599 PolarHBondContact OE2-N 2.81Å; E555-S599 PolarHBondContact OE2-OG 2.84Å
600	L	76	Confident	73.4	Confident	19 Å²	19	86.1 Å²	86.1	10%	0.099	40%	0.397	C	S	.	.	S	Bend	trans	-134.6	143.3	-179.2	-57.1	170.4	0	0	0	110.8	Y534 E549 I550 T553 I602	Y534-L600 HydrophobicContact CE2-CD2 3.93Å; Y534-L600 WeakPolarHBondContact OH-CD2 3.43Å; E549-L600 HydrophobicContact CB-CD1 3.57Å; E549-L600 HydrophobicContact CB-CD2 4.06Å; E549-L600 HydrophobicContact CB-CG 4.5Å; I550-L600 HydrophobicContact CG1-CD1 3.72Å; T553-L600 HydrophobicContact CG2-CD2 3.83Å; T553-L600 HydrophobicContact CG2-CG 4.22Å; L600-I602 HydrophobicContact CB-CG2 4.02Å; L600-I602 PolarHBondContact O-N 2.85Å
601	Q	75.8	Confident	71.5	Confident	166 Å²	166	85 Å²	85	78%	0.776	39%	0.389	S	S	*	.			trans	-77.8	73.1	174.8	-164.7	-179.3	34.3	0	0	111.1
602	I	77.6	Confident	69.4	Low	54 Å²	54	87.2 Å²	87.2	28%	0.277	41%	0.406	S	S	.	.			trans	-98.8	161.1	172.8	67.2	171.1	0	0	0	110.9	T546 C597 L600 Q604	T546-I602 HydrophobicContact CG2-CG2 3.75Å; C597-I602 HydrophobicContact CB-CD1 3.4Å; C597-I602 VanDerWaalsContact CB-CD1 3.4Å; C597-I602 HydrophobicContact CB-CG1 3.74Å; L600-I602 HydrophobicContact CB-CG2 4.02Å; L600-I602 PolarHBondContact O-N 2.85Å; I602-Q604 PolarHBondContact O-N 3.12Å
603	R	70.6	Confident	66.9	Low	199 Å²	199	88.3 Å²	88.3	75%	0.751	43%	0.425	S	S	*	.			trans	-61.5	112.9	174.7	-173.9	173.9	-177.7	163.1	0.1	109.6	Y605	R603-Y605 VanDerWaalsContact O-CD2 3.32Å; R603-Y605 WeakPolarHBondContact O-CD2 3.35Å; R603-Y605 WeakPolarHBondContact O-CE2 3.21Å
604	Q	65.7	Low	64.4	Low	116 Å²	116	90.1 Å²	90.1	54%	0.542	45%	0.447	S	S	.	.			trans	-75.2	132.2	175.3	-174.7	168.9	-18.5	0	0	109.6	I602 T609	I602-Q604 PolarHBondContact O-N 3.12Å; Q604-T609 PolarHBondContact NE2-OG1 3.49Å
605	Y	51.6	Low	61.6	Low	127 Å²	127	93.8 Å²	93.8	50%	0.498	47%	0.466	S	S	.	.			trans	-98.6	137.4	177.8	-62.9	-97.9	0	0	0	109.7	R603 Y607 I608 T609	R603-Y605 VanDerWaalsContact O-CD2 3.32Å; R603-Y605 WeakPolarHBondContact O-CD2 3.35Å; R603-Y605 WeakPolarHBondContact O-CE2 3.21Å; Y605-Y607 VanDerWaalsContact C-N 3.35Å; Y605-Y607 VanDerWaalsContact CB-CE1 3.44Å; Y605-Y607 HydrophobicContact CD1-CE1 4.17Å; Y605-Y607 AromaticContact CG-CE1 3.94Å; Y605-Y607 HydrophobicContact CG-CE1 3.94Å; Y605-Y607 PolarHBondContact O-N 3.41Å; Y605-I608 HydrophobicContact CD2-CD1 4.24Å; Y605-I608 PolarHBondContact O-N 2.88Å; Y605-I608 VanDerWaalsContact O-N 3.14Å; Y605-T609 PolarHBondContact O-OG1 3.02Å
606	A	50.6	Low	58.9	Low	72 Å²	72	95.2 Å²	95.2	60%	0.595	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-54	-47.2	-173.3	0	0	0	0	0	112.8	I608 T609 D610	A606-I608 PolarHBondContact O-N 2.75Å; A606-T609 WeakPolarHBondContact O-CA 3.36Å; A606-T609 WeakPolarHBondContact O-CB 3.49Å; A606-T609 PolarHBondContact O-N 2.97Å; A606-T609 PolarHBondContact O-OG1 2.91Å; A606-D610 PolarHBondContact O-N 3.31Å
607	Y	57.2	Low	56.4	Low	160 Å²	160	100.3 Å²	100.3	63%	0.627	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-58.2	-18	-178.3	73.4	-96.9	0	0	0	115.5	Y605	Y605-Y607 VanDerWaalsContact C-N 3.35Å; Y605-Y607 VanDerWaalsContact CB-CE1 3.44Å; Y605-Y607 HydrophobicContact CD1-CE1 4.17Å; Y605-Y607 AromaticContact CG-CE1 3.94Å; Y605-Y607 HydrophobicContact CG-CE1 3.94Å; Y605-Y607 PolarHBondContact O-N 3.41Å
608	I	57.9	Low	54.2	Low	17 Å²	17	105.7 Å²	105.7	9%	0.087	54%	0.537	C	S	.	.	G	3₁₀ helix	trans	-87.6	-12.3	176.8	-38.5	178	0	0	0	111.3	L594 P596 Y605 A606	L594-I608 WeakPolarHBondContact O-CG2 3.39Å; P596-I608 HydrophobicContact CB-CG2 4.44Å; P596-I608 HydrophobicContact CG-CB 4.46Å; P596-I608 HydrophobicContact CG-CG2 3.9Å; P596-I608 WeakPolarHBondContact CG-O 3.45Å; Y605-I608 HydrophobicContact CD2-CD1 4.24Å; Y605-I608 PolarHBondContact O-N 2.88Å; Y605-I608 VanDerWaalsContact O-N 3.14Å; A606-I608 PolarHBondContact O-N 2.75Å
609	T	48.2	Very low	52	Low	49 Å²	49	101 Å²	101	30%	0.301	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-48.3	-171.5	-44.1	0	0	0	0	111.7	Q604 Y605 A606 R611 S612	Q604-T609 PolarHBondContact NE2-OG1 3.49Å; Y605-T609 PolarHBondContact O-OG1 3.02Å; A606-T609 WeakPolarHBondContact O-CA 3.36Å; A606-T609 WeakPolarHBondContact O-CB 3.49Å; A606-T609 PolarHBondContact O-N 2.97Å; A606-T609 PolarHBondContact O-OG1 2.91Å; T609-R611 PolarHBondContact O-N 2.94Å; T609-S612 PolarHBondContact O-OG 3.38Å
610	D	43.6	Very low	50.3	Low	107 Å²	107	108.6 Å²	108.6	57%	0.572	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-70.2	-29.5	-174.1	-61.1	-55.4	0	0	0	113.5	A606 S612 S613	A606-D610 PolarHBondContact O-N 3.31Å; D610-S612 PolarHBondContact O-N 3.38Å; D610-S613 PolarHBondContact O-N 3.26Å
611	R	45.9	Very low	49	Very low	133 Å²	133	115.1 Å²	115.1	50%	0.502	59%	0.594	S	S	.	*	G	3₁₀ helix	trans	-74.5	17.7	-176.7	-149.5	175.9	173.7	-136.6	-9.4	114.8	R593 T609	R593-R611 PolarHBondContact NH2-O 3.25Å; R593-R611 VanDerWaalsContact NH2-O 3.13Å; T609-R611 PolarHBondContact O-N 2.94Å
612	S	45.6	Very low	47.4	Very low	70 Å²	70	109.9 Å²	109.9	49%	0.49	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-127.4	-5.3	173.8	23.4	0	0	0	0	113.9	T609 D610	T609-S612 PolarHBondContact O-OG 3.38Å; D610-S612 PolarHBondContact O-N 3.38Å
613	S	40.6	Very low	45.5	Very low	96 Å²	96	113.6 Å²	113.6	67%	0.671	60%	0.604	S	S	*	*	S	Bend	trans	-97.6	0.6	-170.5	-56.7	0	0	0	0	114.8	D610	D610-S613 PolarHBondContact O-N 3.26Å
614	S	38.6	Very low	43.8	Very low	102 Å²	102	108.7 Å²	108.7	71%	0.713	60%	0.596	S	S	*	*			trans	-142.8	89.7	177.6	48.1	0	0	0	0	111.8
615	I	33.2	Very low	42.1	Very low	123 Å²	123	112.8 Å²	112.8	63%	0.631	61%	0.608	S	S	*	*			trans	-116.7	104.9	159.9	-59.5	177.4	0	0	0	106.3	V617	I615-V617 PolarHBondContact O-N 2.82Å
616	P	31	Very low	41.1	Very low	94 Å²	94	114.7 Å²	114.7	61%	0.61	62%	0.621	S	S	*	*			trans	-67.5	113.6	167.7	27.8	-31.2	0	0	0	108.1	I618	P616-I618 PolarHBondContact O-N 2.81Å
617	V	33.8	Very low	40.1	Very low	124 Å²	124	117.4 Å²	117.4	75%	0.752	63%	0.63	S	S	*	*			trans	-75.8	107.8	169.2	178.1	0	0	0	0	107	I615	I615-V617 PolarHBondContact O-N 2.82Å
618	I	35.9	Very low	38.7	Very low	128 Å²	128	117.1 Å²	117.1	66%	0.656	64%	0.639	S	S	*	*			trans	-86.7	116.4	176.5	-59.2	172.2	0	0	0	107.7	P616	P616-I618 PolarHBondContact O-N 2.81Å
619	N	37	Very low	37.3	Very low	122 Å²	122	122.5 Å²	122.5	65%	0.652	67%	0.673	S	S	*	*			trans	-90.5	163.6	162.4	-72	3.7	0	0	0	109.5	D621 G622	N619-D621 PolarHBondContact O-N 3.36Å; N619-G622 PolarHBondContact O-N 2.66Å; N619-G622 VanDerWaalsContact O-N 3.12Å
620	E	40.8	Very low	36.4	Very low	202 Å²	202	124 Å²	124	94%	0.944	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-13.5	-157	-57.9	-174.4	131	0	0	116.1
621	D	47.8	Very low	35.8	Very low	156 Å²	156	127.2 Å²	127.2	83%	0.834	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-0.9	177.5	-60.2	-64.4	0	0	0	115.1	N619 I623	N619-D621 PolarHBondContact O-N 3.36Å; D621-I623 PolarHBondContact O-N 2.99Å
622	G	42.7	Very low	34.9	Very low	57 Å²	57	127.8 Å²	127.8	59%	0.588	72%	0.721	S	S	*	*			trans	70.9	18.4	157.7	0	0	0	0	0	119.4	N619	N619-G622 PolarHBondContact O-N 2.66Å; N619-G622 VanDerWaalsContact O-N 3.12Å
623	I	36.7	Very low	33.9	Very low	131 Å²	131	128 Å²	128	67%	0.672	73%	0.734	S	S	*	*			trans	-100.8	131.8	178.4	-61.5	175.9	0	0	0	111.8	D621 Y625	D621-I623 PolarHBondContact O-N 2.99Å; I623-Y625 HydrophobicContact CG2-CD2 4.31Å; I623-Y625 HydrophobicContact CG2-CE2 3.93Å
624	V	35.4	Very low	33.2	Very low	97 Å²	97	128.5 Å²	128.5	59%	0.588	74%	0.744	S	S	*	*			trans	-114.2	130.1	175	179.6	0	0	0	0	110
625	Y	30.6	Very low	32.6	Very low	202 Å²	202	133.1 Å²	133.1	79%	0.792	75%	0.754	S	S	*	*			trans	-101.1	126.2	174	-74.7	-83.7	0	0	0	111.6	I623	I623-Y625 HydrophobicContact CG2-CD2 4.31Å; I623-Y625 HydrophobicContact CG2-CE2 3.93Å
626	H	31.2	Very low	32.2	Very low	166 Å²	166	131 Å²	131	77%	0.769	76%	0.762	S	S	*	*			trans	-107.3	145.4	158.8	-83.8	-106.6	0	0	0	109.1
627	V	28.3	Very low	31.8	Very low	129 Å²	129	132.7 Å²	132.7	78%	0.782	77%	0.771	S	S	*	*			trans	-132.5	102.2	173.6	-179.4	0	0	0	0	108.6
628	D	28.6	Very low	31.3	Very low	154 Å²	154	132.7 Å²	132.7	82%	0.824	77%	0.771	S	S	*	*			trans	-93.2	142.6	167.9	-79.2	-60.6	0	0	0	110.4
629	T	28.5	Very low	30.8	Very low	130 Å²	130	132 Å²	132	80%	0.798	78%	0.778	S	S	*	*			trans	-132.1	115.5	165.4	55.2	0	0	0	0	109.6
630	G	28	Very low	30.6	Very low	81 Å²	81	134 Å²	134	84%	0.835	79%	0.789	S	S	*	*			trans	-76.8	-155.4	177.5	0	0	0	0	0	114.1
631	K	31.1	Very low	30.1	Very low	175 Å²	175	129.6 Å²	129.6	76%	0.761	78%	0.777	S	S	*	*			cis	-168.8	150	14.7	167.6	172.8	168.1	172	0	111.4
632	D	27	Very low	29.3	Very low	145 Å²	145	128.1 Å²	128.1	78%	0.775	78%	0.777	S	S	*	*			trans	59.3	158.4	165.1	-62.5	-3.9	0	0	0	120.1
633	G	24.8	Very low	28.9	Very low	74 Å²	74	130.4 Å²	130.4	76%	0.763	79%	0.79	S	S	*	*			trans	-174	-28.9	172.8	0	0	0	0	0	123.7
634	A	26.8	Very low	28.6	Very low	106 Å²	106	133.9 Å²	133.9	88%	0.876	80%	0.8	S	S	*	*			trans	67.3	175.1	176.1	0	0	0	0	0	119.8
635	E	26.4	Very low	28.5	Very low	200 Å²	200	138.1 Å²	138.1	94%	0.935	81%	0.814	S	S	*	*			trans	-92	162.1	-154.7	-56.3	164.4	115.4	0	0	116.5
636	G	24	Very low	28.5	Very low	78 Å²	78	136 Å²	136	80%	0.804	81%	0.812	S	S	*	*			trans	-174.4	137.3	168	0	0	0	0	0	113.7
637	T	23.4	Very low	28.6	Very low	130 Å²	130	132 Å²	132	80%	0.798	80%	0.8	S	S	*	*			trans	-114.4	154.7	-161.2	-37.8	0	0	0	0	114.5
638	T	23.4	Very low	28.9	Very low	123 Å²	123	133.8 Å²	133.8	76%	0.755	79%	0.793	S	S	*	*			trans	109.9	142.4	149.9	71.2	0	0	0	0	121.1
639	S	23.8	Very low	29.3	Very low	114 Å²	114	132.6 Å²	132.6	80%	0.797	79%	0.787	S	S	*	*			trans	81.9	117.8	154.7	74.2	0	0	0	0	120.8
640	N	32.6	Very low	29.9	Very low	165 Å²	165	130.9 Å²	130.9	88%	0.882	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-96.2	135	164.2	-89.1	-31.5	0	0	0	110.7
641	P	31.3	Very low	30.5	Very low	108 Å²	108	131.7 Å²	131.7	70%	0.701	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-89.8	162.7	149	33.5	-27.2	0	0	0	111.1
642	P	30.6	Very low	30.7	Very low	126 Å²	126	129.5 Å²	129.5	82%	0.818	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-80.5	148.5	-159.7	30.4	-36.5	0	0	0	115.3	K644	P642-K644 PolarHBondContact O-N 3.4Å
643	A	34.8	Very low	31.1	Very low	104 Å²	104	129.7 Å²	129.7	86%	0.86	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-64.4	123	172.8	0	0	0	0	0	111.9
644	K	30.7	Very low	31.5	Very low	204 Å²	204	131.7 Å²	131.7	89%	0.887	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-73.4	138.2	162.7	-92.9	-178	172.9	178.3	0	109.5	P642 M646	P642-K644 PolarHBondContact O-N 3.4Å; K644-M646 PolarHBondContact O-N 3.44Å
645	Q	32.9	Very low	31.8	Very low	187 Å²	187	133.6 Å²	133.6	87%	0.874	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-63.3	120.8	170.6	-83.6	177.9	-56.3	0	0	110.5
646	M	30.9	Very low	31.8	Very low	156 Å²	156	127.1 Å²	127.1	77%	0.768	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-67.5	137.7	167.7	-156.4	175.1	-159.2	0	0	109	K644 D650	K644-M646 PolarHBondContact O-N 3.44Å; M646-D650 HydrophobicContact CE-CB 4.01Å; M646-D650 HydrophobicContact CG-CB 4.09Å; M646-D650 WeakPolarHBondContact CG-OD2 3.37Å
647	T	33.4	Very low	32.1	Very low	84 Å²	84	130.9 Å²	130.9	52%	0.515	73%	0.726	S	S	.	*			trans	-110.2	153.6	-170.4	-58.6	0	0	0	0	110.7	D649 D650	T647-D649 PolarHBondContact O-N 2.85Å; T647-D650 PolarHBondContact N-OD2 3.31Å; T647-D650 WeakPolarHBondContact O-CB 3.42Å; T647-D650 PolarHBondContact O-N 3.25Å
648	W	34.2	Very low	32.5	Very low	165 Å²	165	133.1 Å²	133.1	63%	0.625	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-14.4	-166.8	-84.7	86.7	0	0	0	116.1	I651	W648-I651 HydrophobicContact CE3-CD1 4.4Å
649	D	36.3	Very low	32.7	Very low	130 Å²	130	130.9 Å²	130.9	70%	0.695	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-24	176.6	-58.6	-70.2	0	0	0	112.7	T647 I651 F652	T647-D649 PolarHBondContact O-N 2.85Å; D649-I651 PolarHBondContact O-N 3.25Å; D649-I651 VanDerWaalsContact O-N 3.08Å; D649-F652 PolarHBondContact O-N 3.17Å; D649-F652 VanDerWaalsContact O-N 3.08Å
650	D	40.5	Very low	33	Very low	93 Å²	93	132.4 Å²	132.4	50%	0.497	72%	0.719	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.9	-18.5	178.4	-60.4	-43.3	0	0	0	113	M646 T647	M646-D650 HydrophobicContact CE-CB 4.01Å; M646-D650 HydrophobicContact CG-CB 4.09Å; M646-D650 WeakPolarHBondContact CG-OD2 3.37Å; T647-D650 PolarHBondContact N-OD2 3.31Å; T647-D650 WeakPolarHBondContact O-CB 3.42Å; T647-D650 PolarHBondContact O-N 3.25Å
651	I	42	Very low	32.8	Very low	98 Å²	98	134.1 Å²	134.1	50%	0.503	72%	0.719	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.2	-19.6	-179.5	-62.3	175.1	0	0	0	111.8	W648 D649	W648-I651 HydrophobicContact CE3-CD1 4.4Å; D649-I651 PolarHBondContact O-N 3.25Å; D649-I651 VanDerWaalsContact O-N 3.08Å
652	F	35.5	Very low	32.8	Very low	130 Å²	130	138.2 Å²	138.2	57%	0.57	73%	0.726	S	S	*	*	S	Bend	trans	-130.1	73.2	-173.1	-69.1	-75.6	0	0	0	112.3	D649 P654	D649-F652 PolarHBondContact O-N 3.17Å; D649-F652 VanDerWaalsContact O-N 3.08Å; F652-P654 WeakPolarHBondContact O-CD 3.36Å; F652-P654 VanDerWaalsContact O-N 3.1Å
653	I	35.3	Very low	32.7	Very low	149 Å²	149	141.5 Å²	141.5	76%	0.764	73%	0.73	S	S	*	*			trans	-48.5	114.7	175.3	-57.2	173.1	0	0	0	110.9
654	P	32.7	Very low	32.5	Very low	116 Å²	116	144.2 Å²	144.2	75%	0.753	73%	0.73	S	S	*	*			trans	-77.2	123.7	163.4	-4.2	23.4	0	0	0	107.7	F652 G656	F652-P654 WeakPolarHBondContact O-CD 3.36Å; F652-P654 VanDerWaalsContact O-N 3.1Å; P654-G656 PolarHBondContact O-N 3.37Å
655	Q	33.5	Very low	32.8	Very low	145 Å²	145	139.6 Å²	139.6	68%	0.678	72%	0.721	S	S	*	*			trans	-72.1	99.1	175.5	-79.9	-169.6	-41	0	0	110.7
656	G	26.5	Very low	32.6	Very low	65 Å²	65	136.2 Å²	136.2	67%	0.67	72%	0.718	S	S	*	*			trans	-124.4	105.2	165.8	0	0	0	0	0	110.4	P654	P654-G656 PolarHBondContact O-N 3.37Å
657	N	30.2	Very low	32.5	Very low	156 Å²	156	138.3 Å²	138.3	83%	0.834	73%	0.726	S	S	*	*			trans	34.6	121.7	165.1	-64.1	3.7	0	0	0	121.5
658	E	30.6	Very low	32.1	Very low	178 Å²	178	137.8 Å²	137.8	83%	0.832	74%	0.737	S	S	*	*			trans	74.7	140.1	136	-68.2	-68.8	86.8	0	0	122.8
659	A	29.2	Very low	31.7	Very low	75 Å²	75	135.1 Å²	135.1	62%	0.62	74%	0.744	S	S	*	*			trans	69	107.4	152.4	0	0	0	0	0	121.7
660	I	30.3	Very low	31.4	Very low	147 Å²	147	134.6 Å²	134.6	75%	0.754	75%	0.746	S	S	*	*			trans	62.1	108.7	133.7	-52.7	166.2	0	0	0	118
661	F	27.4	Very low	30.8	Very low	201 Å²	201	137.6 Å²	137.6	88%	0.882	76%	0.756	S	S	*	*				-159.7	150.8	108.4	-117.6	-80.5	0	0	0	111.7
662	K	32	Very low	29.9	Very low	194 Å²	194	141.9 Å²	141.9	84%	0.843	77%	0.772	S	S	*	*			trans	-100.4	127.1	171.5	-73.3	-177.2	178.3	-179.7	0	110
663	Q	28.8	Very low	29.7	Very low	195 Å²	195	143.3 Å²	143.3	91%	0.911	78%	0.78	S	S	*	*			trans	-158.3	151.5	146.9	-115	163.7	-2.7	0	0	109.9
664	N	29.1	Very low	29.3	Very low	160 Å²	160	143.8 Å²	143.8	86%	0.856	78%	0.777	S	S	*	*			trans	-125.6	170	-177.8	-126.2	19.5	0	0	0	109
665	P	38.6	Very low	29.1	Very low	108 Å²	108	143.8 Å²	143.8	70%	0.701	78%	0.775	S	S	*	*				-96.2	168.7	-129.2	37	-41.1	0	0	0	115.8
666	S	27.8	Very low	29.1	Very low	116 Å²	116	141.1 Å²	141.1	81%	0.811	76%	0.764	S	S	*	*			trans	-110.3	129.7	156.3	56.8	0	0	0	0	109.5
667	E	28.3	Very low	29.4	Very low	200 Å²	200	142.6 Å²	142.6	94%	0.935	76%	0.762	S	S	*	*			trans	-73.4	155.8	177.6	-64.8	170.2	105.1	0	0	112.2
668	G	25.8	Very low	29.7	Very low	73 Å²	73	138.8 Å²	138.8	75%	0.753	74%	0.739	S	S	*	*			trans	176.9	93.5	-178.7	0	0	0	0	0	112.3
669	S	24.9	Very low	29.6	Very low	108 Å²	108	134.9 Å²	134.9	76%	0.755	73%	0.731	S	S	*	*			trans	-23.9	135.3	174.5	50	0	0	0	0	116.6
670	T	30	Very low	29.5	Very low	120 Å²	120	142.2 Å²	142.2	74%	0.736	75%	0.745	S	S	*	*				-163.4	156.9	66.9	25.8	0	0	0	0	111.9
671	E	27.7	Very low	29.5	Very low	155 Å²	155	142 Å²	142	72%	0.724	74%	0.744	S	S	*	*			trans	-73.3	135.5	177.2	51.4	-85.9	86.5	0	0	113.4
672	F	24.5	Very low	29.6	Very low	189 Å²	189	138.8 Å²	138.8	83%	0.829	74%	0.737	S	S	*	*			trans	-137.9	84.6	149.4	-102.1	-73.9	0	0	0	109.3	F674	F672-F674 HydrophobicContact CD1-CE2 4.13Å
673	E	29.9	Very low	29.4	Very low	160 Å²	160	135.8 Å²	135.8	75%	0.748	73%	0.731	S	S	*	*			trans	-70.6	124.6	174.4	-179.6	170.9	-157.6	0	0	110.5	V675	E673-V675 HydrophobicContact CG-CG2 4.25Å
674	F	27.6	Very low	29.5	Very low	159 Å²	159	132.3 Å²	132.3	70%	0.697	72%	0.721	S	S	*	*			trans	-137.9	77.4	168.3	-94.2	-76.9	0	0	0	110.5	F672 I676	F672-F674 HydrophobicContact CD1-CE2 4.13Å; F674-I676 PolarHBondContact O-N 3.27Å
675	V	29.3	Very low	29.5	Very low	116 Å²	116	130.6 Å²	130.6	70%	0.703	71%	0.712	S	S	*	*			trans	-74.6	107	163.1	-179.1	0	0	0	0	108	E673	E673-V675 HydrophobicContact CG-CG2 4.25Å
676	I	32.7	Very low	28.9	Very low	88 Å²	88	132.1 Å²	132.1	45%	0.451	71%	0.713	S	S	.	*			trans	-87.6	130.5	167.2	-62.3	174.7	0	0	0	107.2	F674	F674-I676 PolarHBondContact O-N 3.27Å
677	P	32.2	Very low	29	Very low	97 Å²	97	133.2 Å²	133.2	63%	0.63	71%	0.706	S	S	*	*			trans	-54.3	141.1	-174.4	-29.3	35.8	0	0	0	114.5	S679	P677-S679 PolarHBondContact O-N 3.45Å
678	E	38	Very low	29	Very low	75 Å²	75	128.1 Å²	128.1	35%	0.35	69%	0.688	S	S	.	*	S	Bend	trans	-76.2	35.2	179.1	-60.1	-146	85.7	0	0	113.8	K547 Y558 Q571	K547-E678 VanDerWaalsContact CE-OE1 3.27Å; K547-E678 WeakPolarHBondContact CE-OE1 3.1Å; K547-E678 IonicContact NZ-OE1 2.79Å; K547-E678 PolarHBondContact NZ-OE1 3.36Å; Y558-E678 PolarHBondContact OH-OE2 2.86Å; Q571-E678 PolarHBondContact NE2-O 3.37Å
679	S	28.5	Very low	29.3	Very low	96 Å²	96	132.7 Å²	132.7	67%	0.671	68%	0.683	S	S	*	*			trans	-104.6	97.2	175.6	58.6	0	0	0	0	110.9	P677	P677-S679 PolarHBondContact O-N 3.45Å
680	Y	26.3	Very low	29.7	Very low	229 Å²	229	134.9 Å²	134.9	90%	0.898	68%	0.676	S	S	*	*			trans	-140.8	0	164.4	-143.5	-68.7	0	0	0	107.8

Retrieved 680 of 680 residues in 100.4 ms (Link to these results)

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