A0A077ZDR7_TRITR Loading...

Mucosa associated lymphoid tissue lymphoma transl ocation protein 1, isoform b

AlphaFold DB , UniProt , Accession A0A077ZDR7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 578 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	30.7	Very low	47.5	Very low	181 Å²	181	105.3 Å²	105.3	89%	0.892	60%	0.603	S	S	*	*				0	111.8	0	-152.8	-179.2	78.5	0	0	111.3	L3	M1-L3 HydrophobicContact CE-CG 4.45Å
2	I	28.3	Very low	49.1	Very low	75 Å²	75	104.8 Å²	104.8	39%	0.385	59%	0.591	S	S	.	*			trans	-99	117	168.6	-59.6	168.8	0	0	0	105.6	M4 L17	I2-M4 PolarHBondContact O-N 3.3Å; I2-L17 HydrophobicContact CD1-CD1 3.59Å; I2-L17 HydrophobicContact CD1-CD2 4.17Å; I2-L17 HydrophobicContact CD1-CG 4.3Å; I2-L17 HydrophobicContact CG1-CD1 3.68Å
3	L	30.4	Very low	50.4	Low	152 Å²	152	98.2 Å²	98.2	80%	0.796	55%	0.553	S	S	*	*			trans	-62.7	100.4	168.4	-82.8	159.3	0	0	0	107.6	M1 N5	M1-L3 HydrophobicContact CE-CG 4.45Å; L3-N5 PolarHBondContact O-N 3.02Å; L3-N5 VanDerWaalsContact O-N 3.13Å
4	M	33	Very low	51.7	Low	123 Å²	123	96.6 Å²	96.6	61%	0.606	54%	0.541	S	S	*	.			trans	-69.2	111.7	-179.7	-69.3	-158	-176.8	0	0	109.2	I2 P10 Q13	I2-M4 PolarHBondContact O-N 3.3Å; M4-P10 HydrophobicContact CE-CB 4.33Å; M4-P10 HydrophobicContact SD-CB 4.32Å; M4-P10 HydrophobicContact SD-CG 4.35Å; M4-Q13 VanDerWaalsContact CA-OE1 3.24Å
5	N	37.5	Very low	53.1	Low	117 Å²	117	96.5 Å²	96.5	63%	0.626	54%	0.538	S	S	*	.			trans	-80.1	137.8	176.6	-150.2	-0.6	0	0	0	108.6	L3 S7 Q13	L3-N5 PolarHBondContact O-N 3.02Å; L3-N5 VanDerWaalsContact O-N 3.13Å; N5-S7 PolarHBondContact O-N 3.31Å; N5-Q13 PolarHBondContact O-NE2 3.03Å
6	N	49.2	Very low	54.1	Low	170 Å²	170	96.8 Å²	96.8	91%	0.909	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	8.4	-170.2	-80.8	-21.3	0	0	0	115.6
7	S	50.2	Low	55	Low	104 Å²	104	94.2 Å²	94.2	73%	0.727	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	-6.6	-169.4	57.5	0	0	0	0	115.8	N5	N5-S7 PolarHBondContact O-N 3.31Å
8	S	56.3	Low	55.4	Low	28 Å²	28	89.7 Å²	89.7	20%	0.196	49%	0.494	C	S	.	.	S	Bend	trans	-144.3	155.6	-179.8	48.6	0	0	0	0	111.6	E12 Q13	S8-E12 WeakPolarHBondContact CB-OE2 3.37Å; S8-Q13 PolarHBondContact O-NE2 3.19Å; S8-Q13 WeakPolarHBondContact OG-CG 3.42Å; S8-Q13 PolarHBondContact OG-NE2 3.42Å
9	S	73.1	Confident	56	Low	60 Å²	60	87.6 Å²	87.6	42%	0.42	50%	0.495	S	S	.	.			trans	-64.6	151.3	-179.9	72.4	0	0	0	0	111.3	A11 E12 Q13	S9-A11 PolarHBondContact O-N 3.41Å; S9-A11 VanDerWaalsContact O-N 3.13Å; S9-E12 WeakPolarHBondContact O-CB 3.27Å; S9-E12 PolarHBondContact O-N 3.2Å; S9-E12 WeakPolarHBondContact OG-CB 3.5Å; S9-E12 PolarHBondContact OG-N 2.77Å; S9-Q13 PolarHBondContact O-N 2.74Å
10	P	67.2	Low	56.6	Low	85 Å²	85	92.4 Å²	92.4	55%	0.552	51%	0.51	S	S	*	.	H	α-helix	trans	-53.3	-35.6	177.3	-28.1	35.1	0	0	0	113.5	M4 Q13 L14	M4-P10 HydrophobicContact CE-CB 4.33Å; M4-P10 HydrophobicContact SD-CB 4.32Å; M4-P10 HydrophobicContact SD-CG 4.35Å; P10-Q13 PolarHBondContact O-N 3.07Å; P10-L14 WeakPolarHBondContact O-CB 3.39Å; P10-L14 PolarHBondContact O-N 2.98Å
11	A	67.1	Low	56.9	Low	63 Å²	63	92.6 Å²	92.6	52%	0.521	51%	0.507	S	S	.	.	H	α-helix	trans	-66.3	-41.7	176.2	0	0	0	0	0	112.4	S9 L14 L15	S9-A11 PolarHBondContact O-N 3.41Å; S9-A11 VanDerWaalsContact O-N 3.13Å; A11-L14 PolarHBondContact O-N 2.85Å; A11-L15 WeakPolarHBondContact O-CG 3.29Å; A11-L15 PolarHBondContact O-N 3.47Å
12	E	66.7	Low	58.2	Low	99 Å²	99	87 Å²	87	46%	0.463	50%	0.497	S	S	.	.	H	α-helix	trans	-68.3	-37.3	178	-169.9	174.6	-169.4	0	0	111.7	S8 S9 L15 Q16	S8-E12 WeakPolarHBondContact CB-OE2 3.37Å; S9-E12 WeakPolarHBondContact O-CB 3.27Å; S9-E12 PolarHBondContact O-N 3.2Å; S9-E12 WeakPolarHBondContact OG-CB 3.5Å; S9-E12 PolarHBondContact OG-N 2.77Å; E12-L15 PolarHBondContact O-N 2.99Å; E12-Q16 WeakPolarHBondContact O-CB 3.47Å; E12-Q16 WeakPolarHBondContact O-CG 3.44Å; E12-Q16 PolarHBondContact O-N 3Å
13	Q	65.8	Low	59.8	Low	20 Å²	20	86 Å²	86	9%	0.093	49%	0.489	C	S	.	.	H	α-helix	trans	-65.5	-42	173.7	-65.5	-176.7	39.5	0	0	112	M4 N5 S8 S9 P10 Q16 L17	M4-Q13 VanDerWaalsContact CA-OE1 3.24Å; N5-Q13 PolarHBondContact O-NE2 3.03Å; S8-Q13 PolarHBondContact O-NE2 3.19Å; S8-Q13 WeakPolarHBondContact OG-CG 3.42Å; S8-Q13 PolarHBondContact OG-NE2 3.42Å; S9-Q13 PolarHBondContact O-N 2.74Å; P10-Q13 PolarHBondContact O-N 3.07Å; Q13-Q16 PolarHBondContact O-N 3.16Å; Q13-L17 WeakPolarHBondContact O-CB 3.08Å; Q13-L17 PolarHBondContact O-N 3.44Å
14	L	69.1	Low	61.9	Low	75 Å²	75	82 Å²	82	39%	0.393	47%	0.474	S	S	.	.	H	α-helix	trans	-59.7	-47.3	174.2	178.1	63.4	0	0	0	111.1	P10 A11 Q16 L17 L18 F28	P10-L14 WeakPolarHBondContact O-CB 3.39Å; P10-L14 PolarHBondContact O-N 2.98Å; A11-L14 PolarHBondContact O-N 2.85Å; L14-Q16 PolarHBondContact O-N 3.04Å; L14-L17 PolarHBondContact O-N 2.63Å; L14-L18 HydrophobicContact CD1-CD1 4.24Å; L14-L18 HydrophobicContact CD1-CG 4.34Å; L14-L18 HydrophobicContact CG-CD1 4.09Å; L14-L18 WeakPolarHBondContact O-CG 3.46Å; L14-L18 PolarHBondContact O-N 3.35Å; L14-F28 HydrophobicContact CD2-CE2 4.18Å
15	L	72.5	Confident	64	Low	95 Å²	95	80.4 Å²	80.4	50%	0.497	47%	0.47	S	S	.	.	H	α-helix	trans	-63.9	-40.2	178	-70.9	173.2	0	0	0	112.3	A11 E12 L17 L18 G19	A11-L15 WeakPolarHBondContact O-CG 3.29Å; A11-L15 PolarHBondContact O-N 3.47Å; E12-L15 PolarHBondContact O-N 2.99Å; L15-L17 VanDerWaalsContact C-N 3.34Å; L15-L17 PolarHBondContact O-N 3.34Å; L15-L18 PolarHBondContact O-N 2.79Å; L15-G19 PolarHBondContact O-N 3.21Å
16	Q	69.1	Low	65.5	Low	101 Å²	101	77.3 Å²	77.3	47%	0.472	46%	0.462	S	S	.	.	H	α-helix	trans	-63.5	-39.6	174.4	-77.2	-177.4	6.8	0	0	112.1	E12 Q13 L14 G19 K20	E12-Q16 WeakPolarHBondContact O-CB 3.47Å; E12-Q16 WeakPolarHBondContact O-CG 3.44Å; E12-Q16 PolarHBondContact O-N 3Å; Q13-Q16 PolarHBondContact O-N 3.16Å; L14-Q16 PolarHBondContact O-N 3.04Å; Q16-G19 PolarHBondContact O-N 3.47Å; Q16-K20 WeakPolarHBondContact O-CB 3.44Å; Q16-K20 WeakPolarHBondContact O-CG 3.27Å; Q16-K20 PolarHBondContact O-N 3.19Å
17	L	68.5	Low	66.5	Low	53 Å²	53	71.7 Å²	71.7	28%	0.277	43%	0.431	S	S	.	.	H	α-helix	trans	-67.1	-46.2	177.4	-175.8	126.4	0	0	0	111.6	I2 Q13 L14 L15 G19 K20 Q21	I2-L17 HydrophobicContact CD1-CD1 3.59Å; I2-L17 HydrophobicContact CD1-CD2 4.17Å; I2-L17 HydrophobicContact CD1-CG 4.3Å; I2-L17 HydrophobicContact CG1-CD1 3.68Å; Q13-L17 WeakPolarHBondContact O-CB 3.08Å; Q13-L17 PolarHBondContact O-N 3.44Å; L14-L17 PolarHBondContact O-N 2.63Å; L15-L17 VanDerWaalsContact C-N 3.34Å; L15-L17 PolarHBondContact O-N 3.34Å; L17-G19 VanDerWaalsContact C-N 3.3Å; L17-G19 PolarHBondContact O-N 2.77Å; L17-K20 PolarHBondContact O-N 3.39Å; L17-Q21 WeakPolarHBondContact O-CG 3.46Å; L17-Q21 PolarHBondContact O-N 3.22Å
18	L	62.2	Low	67.8	Low	14 Å²	14	68.5 Å²	68.5	7%	0.073	40%	0.404	C	S	.	.	H	α-helix	trans	-59.1	-43.6	174.7	-71.4	172.1	0	0	0	111.1	L14 L15 K20 Q21 G22 K23 F28 Y31	L14-L18 HydrophobicContact CD1-CD1 4.24Å; L14-L18 HydrophobicContact CD1-CG 4.34Å; L14-L18 HydrophobicContact CG-CD1 4.09Å; L14-L18 WeakPolarHBondContact O-CG 3.46Å; L14-L18 PolarHBondContact O-N 3.35Å; L15-L18 PolarHBondContact O-N 2.79Å; L18-K20 PolarHBondContact O-N 3.23Å; L18-Q21 CarbonylContact O-C 3.55Å; L18-Q21 PolarHBondContact O-N 3.43Å; L18-Q21 VanDerWaalsContact O-N 3.13Å; L18-G22 PolarHBondContact O-N 3.41Å; L18-K23 HydrophobicContact CB-CB 4.13Å; L18-K23 HydrophobicContact CD2-CB 4.13Å; L18-K23 HydrophobicContact CD2-CG 4.1Å; L18-K23 WeakPolarHBondContact O-CB 3.48Å; L18-K23 PolarHBondContact O-N 3.13Å; L18-F28 HydrophobicContact CD1-CB 4.37Å; L18-F28 HydrophobicContact CD1-CD2 3.44Å; L18-F28 VanDerWaalsContact CD1-CD2 3.44Å; L18-F28 HydrophobicContact CD1-CE2 4.13Å; L18-F28 HydrophobicContact CD1-CG 4.27Å; L18-Y31 HydrophobicContact CD2-CD2 4.28Å; L18-Y31 HydrophobicContact CD2-CE2 3.93Å
19	G	67.1	Low	68.8	Low	50 Å²	50	68 Å²	68	52%	0.515	40%	0.4	S	S	.	.	H	α-helix	trans	-60.9	-42.9	174.9	0	0	0	0	0	113.2	L15 Q16 L17 Q21 G22	L15-G19 PolarHBondContact O-N 3.21Å; Q16-G19 PolarHBondContact O-N 3.47Å; L17-G19 VanDerWaalsContact C-N 3.3Å; L17-G19 PolarHBondContact O-N 2.77Å; G19-Q21 PolarHBondContact O-N 2.97Å; G19-G22 PolarHBondContact O-N 2.99Å; G19-G22 VanDerWaalsContact O-N 3.07Å
20	K	68.1	Low	68.5	Low	183 Å²	183	68.2 Å²	68.2	80%	0.796	40%	0.396	S	S	*	.	H	α-helix	trans	-63	-28.5	174.5	-77.3	177.9	-179.2	-179.1	0	113	Q16 L17 L18 G22	Q16-K20 WeakPolarHBondContact O-CB 3.44Å; Q16-K20 WeakPolarHBondContact O-CG 3.27Å; Q16-K20 PolarHBondContact O-N 3.19Å; L17-K20 PolarHBondContact O-N 3.39Å; L18-K20 PolarHBondContact O-N 3.23Å; K20-G22 VanDerWaalsContact C-N 3.27Å
21	Q	62.7	Low	68.6	Low	96 Å²	96	69.8 Å²	69.8	45%	0.449	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	7.9	176.1	-68.7	-178.7	-9.4	0	0	113.3	L17 L18 G19 K23	L17-Q21 WeakPolarHBondContact O-CG 3.46Å; L17-Q21 PolarHBondContact O-N 3.22Å; L18-Q21 CarbonylContact O-C 3.55Å; L18-Q21 PolarHBondContact O-N 3.43Å; L18-Q21 VanDerWaalsContact O-N 3.13Å; G19-Q21 PolarHBondContact O-N 2.97Å; Q21-K23 HydrophobicContact CB-CG 4.06Å; Q21-K23 PolarHBondContact O-N 3.39Å
22	G	57.6	Low	68.9	Low	65 Å²	65	66.8 Å²	66.8	67%	0.67	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	14.9	-178.6	0	0	0	0	0	114.1	L18 G19 K20	L18-G22 PolarHBondContact O-N 3.41Å; G19-G22 PolarHBondContact O-N 2.99Å; G19-G22 VanDerWaalsContact O-N 3.07Å; K20-G22 VanDerWaalsContact C-N 3.27Å
23	K	61.8	Low	69.2	Low	52 Å²	52	63.8 Å²	63.8	23%	0.226	35%	0.353	C	S	.	.			trans	-76.1	132.3	-179.8	-61.7	-60.7	-175.4	178.4	0	110.3	L18 Q21 D27	L18-K23 HydrophobicContact CB-CB 4.13Å; L18-K23 HydrophobicContact CD2-CB 4.13Å; L18-K23 HydrophobicContact CD2-CG 4.1Å; L18-K23 WeakPolarHBondContact O-CB 3.48Å; L18-K23 PolarHBondContact O-N 3.13Å; Q21-K23 HydrophobicContact CB-CG 4.06Å; Q21-K23 PolarHBondContact O-N 3.39Å; K23-D27 WeakPolarHBondContact CA-OD2 3.24Å; K23-D27 HydrophobicContact CB-CB 3.97Å; K23-D27 HydrophobicContact CD-CB 4.03Å; K23-D27 HydrophobicContact CG-CB 4.48Å
24	C	75.6	Confident	68.9	Low	69 Å²	69	69.1 Å²	69.1	47%	0.466	38%	0.382	S	S	.	.			trans	-90.4	175.2	-179.9	72.8	0	0	0	0	111.9	A26 D27 F28	C24-A26 PolarHBondContact O-N 3.13Å; C24-A26 VanDerWaalsContact SG-CB 3.6Å; C24-A26 PolarHBondContact SG-N 3.43Å; C24-D27 PolarHBondContact N-OD2 2.93Å; C24-D27 WeakPolarHBondContact O-CB 3.48Å; C24-D27 PolarHBondContact O-N 3.35Å; C24-D27 VanDerWaalsContact O-N 3.13Å; C24-D27 PolarHBondContact SG-OD2 3.27Å; C24-F28 PolarHBondContact O-N 3.3Å; C24-F28 VanDerWaalsContact O-N 3.08Å
25	V	75.7	Confident	68.6	Low	89 Å²	89	68.3 Å²	68.3	54%	0.539	39%	0.386	S	S	.	.	H	α-helix	trans	-59.1	-32.9	175.4	177.9	0	0	0	0	111.5	F28 L29 L44	V25-F28 PolarHBondContact O-N 3.25Å; V25-L29 HydrophobicContact CG1-CD1 4.25Å; V25-L29 HydrophobicContact CG1-CG 4.35Å; V25-L29 WeakPolarHBondContact O-CB 3.38Å; V25-L29 VanDerWaalsContact O-CG 3.31Å; V25-L29 WeakPolarHBondContact O-CG 3.32Å; V25-L29 PolarHBondContact O-N 2.82Å; V25-L44 HydrophobicContact CG1-CD1 4.27Å; V25-L44 HydrophobicContact CG1-CD2 4.48Å
26	A	69.5	Low	68.2	Low	53 Å²	53	66.1 Å²	66.1	44%	0.438	39%	0.386	S	S	.	.	H	α-helix	trans	-66.5	-40.2	176.6	0	0	0	0	0	111.9	C24 F28 L29 N30	C24-A26 PolarHBondContact O-N 3.13Å; C24-A26 VanDerWaalsContact SG-CB 3.6Å; C24-A26 PolarHBondContact SG-N 3.43Å; A26-F28 VanDerWaalsContact C-N 3.35Å; A26-L29 PolarHBondContact O-N 2.76Å; A26-N30 VanDerWaalsContact O-CG 3.31Å; A26-N30 PolarHBondContact O-N 2.77Å; A26-N30 PolarHBondContact O-ND2 3.48Å
27	D	71.2	Confident	68.3	Low	51 Å²	51	65.1 Å²	65.1	27%	0.273	38%	0.383	S	S	.	.	H	α-helix	trans	-62	-45.1	174	-60.7	-55.9	0	0	0	110.8	K23 C24 L29 N30 Y31	K23-D27 WeakPolarHBondContact CA-OD2 3.24Å; K23-D27 HydrophobicContact CB-CB 3.97Å; K23-D27 HydrophobicContact CD-CB 4.03Å; K23-D27 HydrophobicContact CG-CB 4.48Å; C24-D27 PolarHBondContact N-OD2 2.93Å; C24-D27 WeakPolarHBondContact O-CB 3.48Å; C24-D27 PolarHBondContact O-N 3.35Å; C24-D27 VanDerWaalsContact O-N 3.13Å; C24-D27 PolarHBondContact SG-OD2 3.27Å; D27-L29 PolarHBondContact O-N 3.26Å; D27-N30 WeakPolarHBondContact O-CB 3.22Å; D27-N30 PolarHBondContact O-N 3.2Å; D27-N30 VanDerWaalsContact O-N 3.14Å; D27-Y31 WeakPolarHBondContact O-CD2 3.26Å; D27-Y31 PolarHBondContact O-N 3.46Å
28	F	76.5	Confident	68.6	Low	37 Å²	37	66.7 Å²	66.7	16%	0.162	39%	0.385	C	S	.	.	H	α-helix	trans	-61	-43.6	175.9	-179	-113.5	0	0	0	112.2	L14 L18 C24 V25 A26 N30 Y31 C32 L44	L14-F28 HydrophobicContact CD2-CE2 4.18Å; L18-F28 HydrophobicContact CD1-CB 4.37Å; L18-F28 HydrophobicContact CD1-CD2 3.44Å; L18-F28 VanDerWaalsContact CD1-CD2 3.44Å; L18-F28 HydrophobicContact CD1-CE2 4.13Å; L18-F28 HydrophobicContact CD1-CG 4.27Å; C24-F28 PolarHBondContact O-N 3.3Å; C24-F28 VanDerWaalsContact O-N 3.08Å; V25-F28 PolarHBondContact O-N 3.25Å; A26-F28 VanDerWaalsContact C-N 3.35Å; F28-N30 PolarHBondContact O-N 3.39Å; F28-Y31 WeakPolarHBondContact O-CB 3.49Å; F28-Y31 PolarHBondContact O-N 2.98Å; F28-C32 VanDerWaalsContact CZ-SG 3.58Å; F28-C32 PolarHBondContact O-N 3.04Å; F28-C32 PolarHBondContact O-SG 3.44Å; F28-L44 HydrophobicContact CD1-CD1 3.65Å; F28-L44 HydrophobicContact CE1-CD1 3.76Å
29	L	77	Confident	69.3	Low	19 Å²	19	73.2 Å²	73.2	10%	0.099	42%	0.415	C	S	.	.	H	α-helix	trans	-59.9	-35.5	174.5	-78.8	175.6	0	0	0	112.3	V25 A26 D27 C32 H33 Q41 L44 R46	V25-L29 HydrophobicContact CG1-CD1 4.25Å; V25-L29 HydrophobicContact CG1-CG 4.35Å; V25-L29 WeakPolarHBondContact O-CB 3.38Å; V25-L29 VanDerWaalsContact O-CG 3.31Å; V25-L29 WeakPolarHBondContact O-CG 3.32Å; V25-L29 PolarHBondContact O-N 2.82Å; A26-L29 PolarHBondContact O-N 2.76Å; D27-L29 PolarHBondContact O-N 3.26Å; L29-C32 PolarHBondContact O-N 3.37Å; L29-H33 WeakPolarHBondContact O-CB 3.5Å; L29-H33 PolarHBondContact O-N 3.39Å; L29-Q41 HydrophobicContact CD2-CB 4.04Å; L29-Q41 HydrophobicContact CD2-CG 3.93Å; L29-L44 HydrophobicContact CD2-CB 3.82Å; L29-L44 HydrophobicContact CD2-CD1 4.04Å; L29-L44 HydrophobicContact CG-CB 4.43Å; L29-L44 HydrophobicContact CG-CD1 4.44Å; L29-R46 VanDerWaalsContact C-NH1 3.28Å; L29-R46 HydrophobicContact CD1-CB 4.19Å; L29-R46 HydrophobicContact CD1-CG 4.48Å; L29-R46 HydrophobicContact CD2-CB 4.06Å; L29-R46 PolarHBondContact O-NH1 3.39Å
30	N	68.6	Low	69.8	Low	64 Å²	64	72.9 Å²	72.9	34%	0.342	40%	0.404	S	S	.	.	H	α-helix	trans	-70.1	-40	175.1	-70.5	-22.7	0	0	0	112.1	A26 D27 F28 C32 H33 N34 R46	A26-N30 VanDerWaalsContact O-CG 3.31Å; A26-N30 PolarHBondContact O-N 2.77Å; A26-N30 PolarHBondContact O-ND2 3.48Å; D27-N30 WeakPolarHBondContact O-CB 3.22Å; D27-N30 PolarHBondContact O-N 3.2Å; D27-N30 VanDerWaalsContact O-N 3.14Å; F28-N30 PolarHBondContact O-N 3.39Å; N30-C32 PolarHBondContact O-N 3.19Å; N30-H33 WeakPolarHBondContact O-CB 3.47Å; N30-H33 PolarHBondContact O-N 2.88Å; N30-N34 VanDerWaalsContact O-CG 3.25Å; N30-N34 PolarHBondContact O-N 3.4Å; N30-R46 PolarHBondContact OD1-NH1 3.18Å; N30-R46 PolarHBondContact OD1-NH2 3.28Å
31	Y	68.4	Low	70.6	Confident	118 Å²	118	64.1 Å²	64.1	46%	0.463	37%	0.366	S	S	.	.	H	α-helix	trans	-59.4	-46.5	169.9	-75.2	-64.9	0	0	0	111.7	L18 D27 F28 H33 N34 A35	L18-Y31 HydrophobicContact CD2-CD2 4.28Å; L18-Y31 HydrophobicContact CD2-CE2 3.93Å; D27-Y31 WeakPolarHBondContact O-CD2 3.26Å; D27-Y31 PolarHBondContact O-N 3.46Å; F28-Y31 WeakPolarHBondContact O-CB 3.49Å; F28-Y31 PolarHBondContact O-N 2.98Å; Y31-H33 VanDerWaalsContact C-N 3.26Å; Y31-H33 PolarHBondContact O-N 3.15Å; Y31-N34 PolarHBondContact O-N 3.46Å; Y31-A35 VanDerWaalsContact O-CB 3.28Å; Y31-A35 WeakPolarHBondContact O-CB 3.42Å; Y31-A35 PolarHBondContact O-N 2.92Å
32	C	72.8	Confident	71.5	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-59.1	-40	175.1	-65.1	0	0	0	0	111.8	F28 L29 N30 A35 G36 M37 Q41 Y80	F28-C32 VanDerWaalsContact CZ-SG 3.58Å; F28-C32 PolarHBondContact O-N 3.04Å; F28-C32 PolarHBondContact O-SG 3.44Å; L29-C32 PolarHBondContact O-N 3.37Å; N30-C32 PolarHBondContact O-N 3.19Å; C32-A35 PolarHBondContact O-N 3.02Å; C32-G36 PolarHBondContact O-N 3.04Å; C32-M37 HydrophobicContact CB-CB 4.16Å; C32-M37 HydrophobicContact CB-CE 4.01Å; C32-M37 PolarHBondContact O-N 2.93Å; C32-M37 VanDerWaalsContact SG-CE 3.57Å; C32-Q41 HydrophobicContact CB-CG 3.66Å; C32-Q41 PolarHBondContact O-NE2 2.9Å; C32-Y80 PolarHBondContact O-OH 3.46Å
33	H	73.9	Confident	72.6	Confident	35 Å²	35	60.1 Å²	60.1	16%	0.162	34%	0.335	C	S	.	.	H	α-helix	trans	-64.8	-44.6	177.7	-166.8	79.6	0	0	0	112.5	L29 N30 Y31 A35 G36 Q41 Y80	L29-H33 WeakPolarHBondContact O-CB 3.5Å; L29-H33 PolarHBondContact O-N 3.39Å; N30-H33 WeakPolarHBondContact O-CB 3.47Å; N30-H33 PolarHBondContact O-N 2.88Å; Y31-H33 VanDerWaalsContact C-N 3.26Å; Y31-H33 PolarHBondContact O-N 3.15Å; H33-A35 VanDerWaalsContact C-N 3.26Å; H33-A35 PolarHBondContact O-N 2.82Å; H33-G36 PolarHBondContact O-N 2.83Å; H33-Q41 PolarHBondContact ND1-OE1 2.92Å; H33-Q41 VanDerWaalsContact ND1-OE1 3.16Å; H33-Y80 WeakPolarHBondContact CA-OH 3.4Å; H33-Y80 AromaticContact CE1-CE1 3.57Å; H33-Y80 AromaticContact ND1-CE1 3.84Å; H33-Y80 AromaticContact ND1-CZ 3.96Å; H33-Y80 AromaticContact NE2-CE1 3.91Å; H33-Y80 PolarHBondContact O-OH 2.87Å
34	N	60.1	Low	73.6	Confident	132 Å²	132	61 Å²	61	71%	0.706	34%	0.341	S	S	*	.	H	α-helix	trans	-69.9	-28	178.7	-64.9	-12.7	0	0	0	111.9	N30 Y31	N30-N34 VanDerWaalsContact O-CG 3.25Å; N30-N34 PolarHBondContact O-N 3.4Å; Y31-N34 PolarHBondContact O-N 3.46Å
35	A	61.8	Low	74	Confident	58 Å²	58	62 Å²	62	48%	0.479	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	6	177.6	0	0	0	0	0	114.5	Y31 C32 H33 M37	Y31-A35 VanDerWaalsContact O-CB 3.28Å; Y31-A35 WeakPolarHBondContact O-CB 3.42Å; Y31-A35 PolarHBondContact O-N 2.92Å; C32-A35 PolarHBondContact O-N 3.02Å; H33-A35 VanDerWaalsContact C-N 3.26Å; H33-A35 PolarHBondContact O-N 2.82Å; A35-M37 HydrophobicContact CB-CE 4.05Å; A35-M37 HydrophobicContact CB-CG 4.05Å; A35-M37 PolarHBondContact O-N 3.35Å
36	G	63.7	Low	74.4	Confident	49 Å²	49	58.9 Å²	58.9	51%	0.505	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	11.2	-179.4	0	0	0	0	0	114.9	C32 H33 R38 Y80	C32-G36 PolarHBondContact O-N 3.04Å; H33-G36 PolarHBondContact O-N 2.83Å; G36-R38 PolarHBondContact O-N 3.03Å; G36-R38 VanDerWaalsContact O-N 3.17Å; G36-Y80 WeakPolarHBondContact CA-OH 3.39Å; G36-Y80 PolarHBondContact N-OH 2.83Å
37	M	70.8	Confident	75	Confident	80 Å²	80	64.3 Å²	64.3	39%	0.394	33%	0.331	S	S	.	.			trans	-85.8	90	-171.2	-64.1	-166.6	-66.6	0	0	111.9	C32 A35 P40 Q41	C32-M37 HydrophobicContact CB-CB 4.16Å; C32-M37 HydrophobicContact CB-CE 4.01Å; C32-M37 PolarHBondContact O-N 2.93Å; C32-M37 VanDerWaalsContact SG-CE 3.57Å; A35-M37 HydrophobicContact CB-CE 4.05Å; A35-M37 HydrophobicContact CB-CG 4.05Å; A35-M37 PolarHBondContact O-N 3.35Å; M37-P40 HydrophobicContact CB-CG 4.23Å; M37-Q41 WeakPolarHBondContact O-CG 3.02Å; M37-Q41 PolarHBondContact O-NE2 3.35Å
38	R	75.9	Confident	75.7	Confident	87 Å²	87	63.5 Å²	63.5	33%	0.328	33%	0.325	S	S	.	.	H	α-helix	trans	-67	-47.6	-176.9	-171.6	179.3	-179	-127.7	-6	113.8	G36 Q41 L42 Y80 E125	G36-R38 PolarHBondContact O-N 3.03Å; G36-R38 VanDerWaalsContact O-N 3.17Å; R38-Q41 WeakPolarHBondContact O-CB 3.08Å; R38-Q41 PolarHBondContact O-N 3.37Å; R38-Q41 VanDerWaalsContact O-N 3.12Å; R38-L42 HydrophobicContact CG-CD1 3.94Å; R38-L42 HydrophobicContact CG-CG 4.34Å; R38-L42 PolarHBondContact O-N 3.12Å; R38-L42 VanDerWaalsContact O-N 3.1Å; R38-Y80 HydrophobicContact CB-CE2 4.48Å; R38-E125 IonicContact CZ-OE1 2.66Å; R38-E125 IonicContact CZ-OE2 2.99Å; R38-E125 IonicContact NH1-OE1 2.76Å; R38-E125 PolarHBondContact NH1-OE1 3.34Å; R38-E125 IonicContact NH2-OE1 3.45Å; R38-E125 PolarHBondContact NH2-OE1 2.99Å; R38-E125 IonicContact NH2-OE2 3.27Å; R38-E125 PolarHBondContact NH2-OE2 3.15Å
39	E	77	Confident	76.1	Confident	150 Å²	150	65.3 Å²	65.3	70%	0.701	33%	0.334	S	S	*	.	H	α-helix	trans	-60.4	-49	-171.8	-74.3	169.7	146.7	0	0	114	Q41 L42 V43	E39-Q41 PolarHBondContact O-N 2.88Å; E39-L42 PolarHBondContact O-N 3.3Å; E39-L42 VanDerWaalsContact O-N 3.09Å; E39-V43 WeakPolarHBondContact O-CG2 3.41Å; E39-V43 PolarHBondContact O-N 3.49Å
40	P	78.2	Confident	76.7	Confident	43 Å²	43	69.3 Å²	69.3	28%	0.279	35%	0.352	S	S	.	.	H	α-helix	trans	-58.4	-33.2	176.1	-24.3	34.4	0	0	0	112.9	M37 L44	M37-P40 HydrophobicContact CB-CG 4.23Å; P40-L44 WeakPolarHBondContact O-CB 3.45Å; P40-L44 WeakPolarHBondContact O-CG 3.33Å; P40-L44 PolarHBondContact O-N 3.14Å
41	Q	84.6	Confident	77.7	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-68.9	-38.8	178.1	-63.5	176.4	75.5	0	0	111.8	L29 C32 H33 M37 R38 E39 H45 R46 F78 Y80	L29-Q41 HydrophobicContact CD2-CB 4.04Å; L29-Q41 HydrophobicContact CD2-CG 3.93Å; C32-Q41 HydrophobicContact CB-CG 3.66Å; C32-Q41 PolarHBondContact O-NE2 2.9Å; H33-Q41 PolarHBondContact ND1-OE1 2.92Å; H33-Q41 VanDerWaalsContact ND1-OE1 3.16Å; M37-Q41 WeakPolarHBondContact O-CG 3.02Å; M37-Q41 PolarHBondContact O-NE2 3.35Å; R38-Q41 WeakPolarHBondContact O-CB 3.08Å; R38-Q41 PolarHBondContact O-N 3.37Å; R38-Q41 VanDerWaalsContact O-N 3.12Å; E39-Q41 PolarHBondContact O-N 2.88Å; Q41-H45 PolarHBondContact O-N 3.48Å; Q41-R46 HydrophobicContact CB-CB 4.02Å; Q41-R46 WeakPolarHBondContact O-CB 3.48Å; Q41-R46 PolarHBondContact O-N 3.31Å; Q41-F78 HydrophobicContact CB-CE2 3.51Å; Q41-F78 HydrophobicContact CB-CZ 3.6Å; Q41-F78 HydrophobicContact CG-CE2 4.24Å; Q41-Y80 PolarHBondContact NE2-OH 3.48Å
42	L	81.1	Confident	78.4	Confident	4 Å²	4	67.9 Å²	67.9	2%	0.021	35%	0.346	C	S	.	.	H	α-helix	trans	-68.6	-44.3	175.2	-67.2	170.6	0	0	0	111.7	R38 E39 L44 H45 F78 E125 W127 Y131	R38-L42 HydrophobicContact CG-CD1 3.94Å; R38-L42 HydrophobicContact CG-CG 4.34Å; R38-L42 PolarHBondContact O-N 3.12Å; R38-L42 VanDerWaalsContact O-N 3.1Å; E39-L42 PolarHBondContact O-N 3.3Å; E39-L42 VanDerWaalsContact O-N 3.09Å; L42-L44 VanDerWaalsContact C-N 3.27Å; L42-L44 PolarHBondContact O-N 3.03Å; L42-H45 PolarHBondContact O-N 3.34Å; L42-F78 HydrophobicContact CD2-CE1 4.05Å; L42-F78 HydrophobicContact CD2-CZ 3.77Å; L42-F78 HydrophobicContact CG-CZ 4.11Å; L42-E125 WeakPolarHBondContact CD1-OE2 3.35Å; L42-W127 HydrophobicContact CB-CG 4Å; L42-Y131 HydrophobicContact CD2-CE2 4.09Å
43	V	80.6	Confident	78.9	Confident	73 Å²	73	69.7 Å²	69.7	44%	0.442	36%	0.355	S	S	.	.	H	α-helix	trans	-59	-40	177.3	171.3	0	0	0	0	111.4	E39 H45 W127	E39-V43 WeakPolarHBondContact O-CG2 3.41Å; E39-V43 PolarHBondContact O-N 3.49Å; V43-H45 PolarHBondContact O-N 3.31Å; V43-W127 HydrophobicContact CG2-CE3 4.45Å; V43-W127 HydrophobicContact CG2-CH2 3.67Å; V43-W127 HydrophobicContact CG2-CZ2 3.87Å; V43-W127 HydrophobicContact CG2-CZ3 3.98Å
44	L	82	Confident	79	Confident	70 Å²	70	72 Å²	72	37%	0.366	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	11.8	178.3	-66.7	173	0	0	0	113.1	V25 F28 L29 P40 L42 R46	V25-L44 HydrophobicContact CG1-CD1 4.27Å; V25-L44 HydrophobicContact CG1-CD2 4.48Å; F28-L44 HydrophobicContact CD1-CD1 3.65Å; F28-L44 HydrophobicContact CE1-CD1 3.76Å; L29-L44 HydrophobicContact CD2-CB 3.82Å; L29-L44 HydrophobicContact CD2-CD1 4.04Å; L29-L44 HydrophobicContact CG-CB 4.43Å; L29-L44 HydrophobicContact CG-CD1 4.44Å; P40-L44 WeakPolarHBondContact O-CB 3.45Å; P40-L44 WeakPolarHBondContact O-CG 3.33Å; P40-L44 PolarHBondContact O-N 3.14Å; L42-L44 VanDerWaalsContact C-N 3.27Å; L42-L44 PolarHBondContact O-N 3.03Å; L44-R46 VanDerWaalsContact C-N 3.32Å; L44-R46 PolarHBondContact O-N 3.38Å
45	H	83.9	Confident	79.6	Confident	90 Å²	90	68.1 Å²	68.1	42%	0.417	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	43.1	176.8	-57.1	142.3	0	0	0	113.7	Q41 L42 V43 K47 F130	Q41-H45 PolarHBondContact O-N 3.48Å; L42-H45 PolarHBondContact O-N 3.34Å; V43-H45 PolarHBondContact O-N 3.31Å; H45-K47 PolarHBondContact O-N 3Å; H45-F130 HydrophobicContact CB-CD1 3.94Å; H45-F130 HydrophobicContact CB-CD2 4.04Å; H45-F130 HydrophobicContact CB-CE1 3.75Å; H45-F130 HydrophobicContact CB-CE2 3.84Å; H45-F130 HydrophobicContact CB-CG 4.09Å; H45-F130 HydrophobicContact CB-CZ 3.69Å; H45-F130 AromaticContact CD2-CG 3.78Å; H45-F130 AromaticContact CG-CD2 3.85Å; H45-F130 AromaticContact CG-CG 3.92Å
46	R	84.2	Confident	80.9	Confident	23 Å²	23	68.8 Å²	68.8	9%	0.087	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-51	133	172.4	-177	173.7	-176.4	117	7.1	108.8	L29 N30 Q41 L44 E49 F78 Y131	L29-R46 VanDerWaalsContact C-NH1 3.28Å; L29-R46 HydrophobicContact CD1-CB 4.19Å; L29-R46 HydrophobicContact CD1-CG 4.48Å; L29-R46 HydrophobicContact CD2-CB 4.06Å; L29-R46 PolarHBondContact O-NH1 3.39Å; N30-R46 PolarHBondContact OD1-NH1 3.18Å; N30-R46 PolarHBondContact OD1-NH2 3.28Å; Q41-R46 HydrophobicContact CB-CB 4.02Å; Q41-R46 WeakPolarHBondContact O-CB 3.48Å; Q41-R46 PolarHBondContact O-N 3.31Å; L44-R46 VanDerWaalsContact C-N 3.32Å; L44-R46 PolarHBondContact O-N 3.38Å; R46-E49 IonicContact CZ-OE1 3.12Å; R46-E49 IonicContact NE-OE1 3.98Å; R46-E49 PolarHBondContact NE-OE1 3.44Å; R46-E49 IonicContact NH2-OE1 2.95Å; R46-E49 PolarHBondContact NH2-OE1 2.82Å; R46-F78 HydrophobicContact CB-CD1 4.15Å; R46-F78 HydrophobicContact CB-CE1 3.83Å; R46-F78 HydrophobicContact CB-CZ 4.08Å; R46-F78 HydrophobicContact CG-CD1 4.02Å; R46-F78 HydrophobicContact CG-CE1 4.21Å; R46-F78 HydrophobicContact CG-CG 4.2Å; R46-Y131 WeakPolarHBondContact O-CE1 3.47Å; R46-Y131 VanDerWaalsContact O-CZ 3.31Å; R46-Y131 PolarHBondContact O-OH 3.03Å
47	K	83.5	Confident	81.8	Confident	167 Å²	167	67.1 Å²	67.1	73%	0.726	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-61.8	142.6	-179.2	-67.6	-179.8	-178.6	174.5	0	109.9	H45 E49 F78	H45-K47 PolarHBondContact O-N 3Å; K47-E49 PolarHBondContact O-N 3.07Å; K47-F78 WeakPolarHBondContact O-CD1 3.39Å
48	F	85.9	Confident	82.2	Confident	35 Å²	35	67.9 Å²	67.9	15%	0.154	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-59.4	131.2	170.2	-177.2	-89.7	0	0	0	109.2	Q50 F78 N119 I121 Y131 H137 C138	F48-Q50 HydrophobicContact CD1-CG 4.49Å; F48-Q50 HydrophobicContact CE1-CG 4.02Å; F48-F78 VanDerWaalsContact CD2-O 3.23Å; F48-F78 WeakPolarHBondContact CD2-O 3.43Å; F48-N119 WeakPolarHBondContact CZ-OD1 3.41Å; F48-I121 HydrophobicContact CD2-CD1 3.82Å; F48-I121 HydrophobicContact CD2-CG1 4.11Å; F48-I121 HydrophobicContact CE2-CG1 4.47Å; F48-Y131 HydrophobicContact CB-CD1 4.2Å; F48-Y131 HydrophobicContact CB-CE1 4.39Å; F48-H137 HydrophobicContact CD1-CB 4.1Å; F48-H137 WeakPolarHBondContact CD1-O 3.04Å; F48-H137 HydrophobicContact CE1-CB 4.1Å; F48-H137 VanDerWaalsContact CG-O 3.26Å; F48-H137 WeakPolarHBondContact CG-O 3.06Å; F48-C138 WeakPolarHBondContact CE2-O 3.4Å
49	E	84.8	Confident	82.2	Confident	74 Å²	74	66.7 Å²	66.7	35%	0.346	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	120.2	176.5	-69.1	175.2	-149.3	0	0	107.9	R46 K47 G77 F78 N119	R46-E49 IonicContact CZ-OE1 3.12Å; R46-E49 IonicContact NE-OE1 3.98Å; R46-E49 PolarHBondContact NE-OE1 3.44Å; R46-E49 IonicContact NH2-OE1 2.95Å; R46-E49 PolarHBondContact NH2-OE1 2.82Å; K47-E49 PolarHBondContact O-N 3.07Å; E49-G77 WeakPolarHBondContact O-CA 3.41Å; E49-F78 HydrophobicContact CB-CB 4Å; E49-F78 HydrophobicContact CG-CB 4.31Å; E49-F78 PolarHBondContact N-O 3.43Å; E49-F78 PolarHBondContact O-N 3.39Å; E49-N119 PolarHBondContact O-ND2 2.73Å
50	Q	88.6	Confident	81.8	Confident	103 Å²	103	60.3 Å²	60.3	48%	0.481	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	149.1	178.7	-70.6	-177.9	-3.5	0	0	111.1	F48 K52	F48-Q50 HydrophobicContact CD1-CG 4.49Å; F48-Q50 HydrophobicContact CE1-CG 4.02Å; Q50-K52 PolarHBondContact O-N 2.8Å
51	V	89.7	Confident	80.9	Confident	6 Å²	6	64.7 Å²	64.7	4%	0.036	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	131.9	177.4	-178.7	0	0	0	0	109.5	A75 S76 P81 A117 N119 S140 V142	V51-A75 HydrophobicContact CG1-CB 3.92Å; V51-S76 CarbonylContact C-O 3.58Å; V51-S76 VanDerWaalsContact CA-O 3.31Å; V51-S76 WeakPolarHBondContact CA-O 3.27Å; V51-P81 HydrophobicContact CG1-CB 4.4Å; V51-P81 HydrophobicContact CG1-CG 4.29Å; V51-P81 HydrophobicContact CG2-CB 4.33Å; V51-P81 HydrophobicContact CG2-CG 4.24Å; V51-A117 HydrophobicContact CG1-CB 3.69Å; V51-N119 HydrophobicContact CG2-CB 4.06Å; V51-N119 WeakPolarHBondContact CG2-OD1 3.39Å; V51-S140 PolarHBondContact N-OG 2.79Å; V51-S140 VanDerWaalsContact N-OG 3.12Å; V51-V142 HydrophobicContact CB-CG2 4.08Å; V51-V142 HydrophobicContact CG1-CB 4.21Å; V51-V142 HydrophobicContact CG1-CG2 4.26Å; V51-V142 VanDerWaalsContact O-CG2 3.3Å; V51-V142 WeakPolarHBondContact O-CG2 3.5Å
52	K	84.1	Confident	79.5	Confident	147 Å²	147	66.4 Å²	66.4	64%	0.639	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	129.7	168.8	-69.2	-178.8	179.4	179.6	0	108.8	Q50 I54 A75 S76	Q50-K52 PolarHBondContact O-N 2.8Å; K52-I54 PolarHBondContact O-N 3.09Å; K52-A75 CarbonylContact O-C 3.27Å; K52-A75 WeakPolarHBondContact O-CA 3.23Å; K52-A75 WeakPolarHBondContact O-CB 3.47Å; K52-S76 PolarHBondContact N-O 2.79Å; K52-S76 PolarHBondContact O-N 3.27Å; K52-S76 PolarHBondContact O-OG 3.28Å
53	I	83	Confident	77.9	Confident	38 Å²	38	73.9 Å²	73.9	20%	0.195	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	119.8	172.2	-54.5	-54.3	0	0	0	107.8	K55 Q56 A75 A117 V142 T144	I53-K55 WeakPolarHBondContact CG2-O 3.34Å; I53-Q56 HydrophobicContact CG2-CG 4.44Å; I53-A75 HydrophobicContact CD1-CB 3.88Å; I53-A117 HydrophobicContact CD1-CB 3.91Å; I53-V142 HydrophobicContact CD1-CB 4.37Å; I53-V142 HydrophobicContact CD1-CG1 4.25Å; I53-V142 HydrophobicContact CG1-CB 4.36Å; I53-V142 HydrophobicContact CG1-CG1 3.74Å; I53-T144 HydrophobicContact CD1-CG2 3.75Å; I53-T144 HydrophobicContact CG1-CG2 4.15Å; I53-T144 HydrophobicContact CG2-CG2 4.41Å
54	I	76.2	Confident	76.5	Confident	84 Å²	84	73.7 Å²	73.7	43%	0.431	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-47.6	174.7	-59.9	169.4	0	0	0	109.1	K52 L74	K52-I54 PolarHBondContact O-N 3.09Å; I54-L74 HydrophobicContact CB-CB 4.45Å; I54-L74 HydrophobicContact CB-CD2 4.02Å; I54-L74 HydrophobicContact CB-CG 4.13Å; I54-L74 HydrophobicContact CD1-CD2 4.07Å; I54-L74 HydrophobicContact CD1-CG 4.13Å; I54-L74 HydrophobicContact CG2-CD2 4Å; I54-L74 PolarHBondContact N-O 3.18Å
55	K	71.7	Confident	75.4	Confident	50 Å²	50	73.1 Å²	73.1	22%	0.217	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	126.2	175.1	-71.3	-175.4	164.2	171.2	0	110.5	I53 C73 L74 D500	I53-K55 WeakPolarHBondContact CG2-O 3.34Å; K55-C73 PolarHBondContact O-SG 3.02Å; K55-C73 VanDerWaalsContact O-SG 3.36Å; K55-L74 HydrophobicContact CB-CB 3.99Å; K55-L74 PolarHBondContact N-O 3.08Å; K55-L74 PolarHBondContact O-N 3.45Å; K55-D500 WeakPolarHBondContact CE-OD1 3.36Å; K55-D500 WeakPolarHBondContact CE-OD2 3.42Å; K55-D500 IonicContact NZ-OD1 3.32Å; K55-D500 PolarHBondContact NZ-OD1 2.9Å; K55-D500 IonicContact NZ-OD2 2.89Å; K55-D500 PolarHBondContact NZ-OD2 3.37Å
56	Q	88.4	Confident	74.3	Confident	71 Å²	71	73.9 Å²	73.9	33%	0.332	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	157.4	171.3	-64.3	-67.4	9.8	0	0	110.7	I53 Q58 D145	I53-Q56 HydrophobicContact CG2-CG 4.44Å; Q56-Q58 PolarHBondContact O-N 3.11Å; Q56-D145 HydrophobicContact CB-CB 4.48Å; Q56-D145 VanDerWaalsContact CD-CG 3.44Å; Q56-D145 HydrophobicContact CG-CB 4.17Å; Q56-D145 WeakPolarHBondContact CG-OD2 3.44Å; Q56-D145 PolarHBondContact NE2-OD1 2.86Å; Q56-D145 PolarHBondContact NE2-OD2 2.89Å
57	P	84.4	Confident	73.7	Confident	14 Å²	14	77.5 Å²	77.5	9%	0.091	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.1	121.8	175.3	-28.8	35.3	0	0	0	112	I71 A72 C73 W85 T144 I147	P57-I71 HydrophobicContact CB-CG2 3.93Å; P57-A72 WeakPolarHBondContact CA-O 3.27Å; P57-C73 HydrophobicContact CG-CB 4.27Å; P57-W85 HydrophobicContact CB-CH2 4.05Å; P57-W85 HydrophobicContact CB-CZ3 4.2Å; P57-W85 HydrophobicContact CG-CH2 4.22Å; P57-W85 HydrophobicContact CG-CZ3 4.32Å; P57-T144 VanDerWaalsContact CD-CB 3.48Å; P57-T144 HydrophobicContact CG-CG2 4.04Å; P57-T144 WeakPolarHBondContact CG-OG1 3.04Å; P57-I147 HydrophobicContact CB-CB 4.35Å; P57-I147 HydrophobicContact CB-CG2 3.9Å
58	Q	79.1	Confident	73	Confident	96 Å²	96	70.9 Å²	70.9	45%	0.449	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	148	176.9	61.3	-177.3	5.4	0	0	110.6	Q56 V60 I71 A72	Q56-Q58 PolarHBondContact O-N 3.11Å; Q58-V60 PolarHBondContact O-N 2.69Å; Q58-I71 WeakPolarHBondContact O-CA 3.5Å; Q58-A72 PolarHBondContact N-O 3.31Å; Q58-A72 PolarHBondContact O-N 3.37Å
59	V	75.1	Confident	72.5	Confident	63 Å²	63	70.2 Å²	70.2	38%	0.382	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	129.1	173.3	177.9	0	0	0	0	108	M69 L70 I147 I149	V59-M69 HydrophobicContact CG1-CG 3.81Å; V59-M69 HydrophobicContact CG1-SD 4.22Å; V59-M69 HydrophobicContact CG2-CG 4.49Å; V59-M69 HydrophobicContact CG2-SD 4Å; V59-L70 WeakPolarHBondContact CA-O 3.36Å; V59-I147 HydrophobicContact CG2-CD1 3.92Å; V59-I149 HydrophobicContact CG2-CD1 3.64Å
60	V	68.4	Low	72.2	Confident	16 Å²	16	67.2 Å²	67.2	10%	0.097	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	111.4	172.6	173.3	0	0	0	0	107.1	Q58 L70 A72 P483	Q58-V60 PolarHBondContact O-N 2.69Å; V60-L70 HydrophobicContact CB-CB 4.04Å; V60-L70 PolarHBondContact N-O 2.91Å; V60-A72 HydrophobicContact CG2-CB 3.52Å; V60-P483 HydrophobicContact CG1-CB 3.67Å; V60-P483 HydrophobicContact CG1-CG 3.48Å; V60-P483 VanDerWaalsContact CG1-CG 3.48Å
61	E	59.2	Low	71.8	Confident	135 Å²	135	62.3 Å²	62.3	63%	0.631	32%	0.317	S	S	*	.			trans	-66.6	134.4	174.2	-63.5	-166.8	172.5	0	0	109.3
62	H	54.5	Low	71.3	Confident	35 Å²	35	62.4 Å²	62.4	16%	0.162	32%	0.318	C	S	.	.			trans	-146	122.9	-179.9	-157.1	-77.4	0	0	0	109.9	T64 L70 P483 K485	H62-T64 VanDerWaalsContact CE1-CG2 3.45Å; H62-T64 WeakPolarHBondContact CE1-CG2 3.31Å; H62-T64 PolarHBondContact CE1-OG1 2.73Å; H62-T64 PolarHBondContact ND1-N 2.86Å; H62-T64 VanDerWaalsContact ND1-N 3.2Å; H62-T64 PolarHBondContact ND1-OG1 3.43Å; H62-T64 PolarHBondContact O-N 3.33Å; H62-L70 HydrophobicContact CB-CD1 4.39Å; H62-P483 PolarHBondContact CD2-O 3.32Å; H62-P483 VanDerWaalsContact CD2-O 3.23Å; H62-P483 PolarHBondContact NE2-O 3.26Å; H62-P483 VanDerWaalsContact NE2-O 3.08Å; H62-K485 WeakPolarHBondContact CE1-CB 3.16Å; H62-K485 VanDerWaalsContact NE2-CB 3.32Å; H62-K485 WeakPolarHBondContact NE2-CB 3.2Å; H62-K485 PolarHBondContact NE2-N 2.71Å
63	E	48.5	Very low	71.2	Confident	162 Å²	162	55.5 Å²	55.5	76%	0.757	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-15.1	-175.1	-67.2	-170.8	142.6	0	0	114.1	E65	E63-E65 PolarHBondContact O-N 3.41Å
64	T	52	Low	71.1	Confident	69 Å²	69	54.2 Å²	54.2	42%	0.423	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-13	-164.8	67.7	0	0	0	0	115.6	H62	H62-T64 VanDerWaalsContact CE1-CG2 3.45Å; H62-T64 WeakPolarHBondContact CE1-CG2 3.31Å; H62-T64 PolarHBondContact CE1-OG1 2.73Å; H62-T64 PolarHBondContact ND1-N 2.86Å; H62-T64 VanDerWaalsContact ND1-N 3.2Å; H62-T64 PolarHBondContact ND1-OG1 3.43Å; H62-T64 PolarHBondContact O-N 3.33Å
65	E	57.4	Low	71.4	Confident	57 Å²	57	50.7 Å²	50.7	27%	0.266	27%	0.265	S	S	.	.			trans	-141.2	102.5	177.9	-76.1	179.1	178.5	0	0	111	E63 D67 T68 K485	E63-E65 PolarHBondContact O-N 3.41Å; E65-D67 PolarHBondContact O-N 2.94Å; E65-D67 VanDerWaalsContact O-N 3.1Å; E65-T68 WeakPolarHBondContact CB-OG1 3.39Å; E65-T68 PolarHBondContact O-N 3.5Å; E65-T68 PolarHBondContact O-OG1 3.24Å; E65-T68 PolarHBondContact OE2-OG1 3.27Å; E65-K485 IonicContact OE1-NZ 2.86Å; E65-K485 PolarHBondContact OE1-NZ 3.41Å; E65-K485 IonicContact OE2-NZ 3.71Å; E65-K485 PolarHBondContact OE2-NZ 2.98Å
66	P	61.3	Low	71.9	Confident	106 Å²	106	50 Å²	50	69%	0.688	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-17.8	-170.3	23.8	-33	0	0	0	114.5	L104	P66-L104 WeakPolarHBondContact O-CD1 3.13Å
67	D	71.4	Confident	71.7	Confident	100 Å²	100	46.7 Å²	46.7	54%	0.535	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	9.1	-176	-63.8	-37	0	0	0	113.8	E65 R103 L104	E65-D67 PolarHBondContact O-N 2.94Å; E65-D67 VanDerWaalsContact O-N 3.1Å; D67-R103 CarbonylContact O-C 3.46Å; D67-R103 WeakPolarHBondContact O-CA 3.46Å; D67-L104 PolarHBondContact O-N 3.29Å
68	T	70	Confident	71.6	Confident	27 Å²	27	46 Å²	46	17%	0.166	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.6	179.3	40.3	0	0	0	0	112.3	E65 L102 R103	E65-T68 WeakPolarHBondContact CB-OG1 3.39Å; E65-T68 PolarHBondContact O-N 3.5Å; E65-T68 PolarHBondContact O-OG1 3.24Å; E65-T68 PolarHBondContact OE2-OG1 3.27Å; T68-L102 CarbonylContact C-O 3.51Å; T68-L102 VanDerWaalsContact CA-O 3.25Å; T68-L102 WeakPolarHBondContact CA-O 3.3Å; T68-R103 HydrophobicContact CG2-CG 4.08Å
69	M	75	Confident	72	Confident	22 Å²	22	41.7 Å²	41.7	11%	0.108	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.5	174.8	-175.9	-171.7	70.4	0	0	108.8	V59 I71 L102 L104 I149	V59-M69 HydrophobicContact CG1-CG 3.81Å; V59-M69 HydrophobicContact CG1-SD 4.22Å; V59-M69 HydrophobicContact CG2-CG 4.49Å; V59-M69 HydrophobicContact CG2-SD 4Å; M69-I71 HydrophobicContact CE-CD1 3.82Å; M69-I71 HydrophobicContact CE-CG1 3.87Å; M69-L102 HydrophobicContact CE-CB 4.41Å; M69-L102 HydrophobicContact CE-CD1 3.56Å; M69-L102 PolarHBondContact N-O 3.24Å; M69-L102 PolarHBondContact O-N 2.97Å; M69-L104 HydrophobicContact CB-CD2 4.3Å; M69-L104 HydrophobicContact CB-CG 4.48Å; M69-I149 HydrophobicContact CE-CB 4.28Å; M69-I149 HydrophobicContact CE-CD1 3.48Å; M69-I149 VanDerWaalsContact CE-CD1 3.48Å; M69-I149 HydrophobicContact CE-CG1 3.69Å; M69-I149 HydrophobicContact CE-CG2 3.7Å; M69-I149 HydrophobicContact SD-CD1 3.76Å; M69-I149 HydrophobicContact SD-CG1 4.38Å; M69-I149 HydrophobicContact SD-CG2 3.66Å
70	L	77.8	Confident	72.2	Confident	10 Å²	10	42.3 Å²	42.3	5%	0.052	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	133.7	176.7	-61	178.9	0	0	0	109.1	V59 V60 H62 V99 L100 L496	V59-L70 WeakPolarHBondContact CA-O 3.36Å; V60-L70 HydrophobicContact CB-CB 4.04Å; V60-L70 PolarHBondContact N-O 2.91Å; H62-L70 HydrophobicContact CB-CD1 4.39Å; L70-V99 HydrophobicContact CB-CG1 4.37Å; L70-V99 HydrophobicContact CD2-CG1 4.37Å; L70-L100 WeakPolarHBondContact CA-O 3.45Å; L70-L496 HydrophobicContact CD1-CD1 3.81Å; L70-L496 HydrophobicContact CD1-CD2 3.95Å
71	I	80.5	Confident	73.1	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.7	170	-51.9	177.9	0	0	0	107.1	P57 Q58 M69 W85 V99 L100 L102 Y113 I147 I149	P57-I71 HydrophobicContact CB-CG2 3.93Å; Q58-I71 WeakPolarHBondContact O-CA 3.5Å; M69-I71 HydrophobicContact CE-CD1 3.82Å; M69-I71 HydrophobicContact CE-CG1 3.87Å; I71-W85 HydrophobicContact CB-CH2 4.18Å; I71-W85 HydrophobicContact CB-CZ3 4.43Å; I71-W85 HydrophobicContact CG2-CH2 3.62Å; I71-W85 HydrophobicContact CG2-CZ3 3.88Å; I71-V99 CarbonylContact O-C 3.59Å; I71-V99 WeakPolarHBondContact O-CA 3.24Å; I71-L100 HydrophobicContact CB-CB 4.39Å; I71-L100 HydrophobicContact CD1-CD2 4.42Å; I71-L100 PolarHBondContact N-O 2.72Å; I71-L100 PolarHBondContact O-N 3.48Å; I71-L102 HydrophobicContact CD1-CD1 3.66Å; I71-L102 HydrophobicContact CG1-CD1 4.28Å; I71-Y113 HydrophobicContact CD1-CD2 3.97Å; I71-Y113 HydrophobicContact CD1-CG 3.93Å; I71-I147 HydrophobicContact CD1-CG2 4.21Å; I71-I147 HydrophobicContact CG2-CG2 4.07Å; I71-I149 HydrophobicContact CD1-CD1 3.82Å; I71-I149 HydrophobicContact CD1-CG1 4.11Å; I71-I149 HydrophobicContact CG1-CD1 4.38Å
72	A	79.5	Confident	74.6	Confident	8 Å²	8	40 Å²	40	7%	0.066	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	141.5	179.4	0	0	0	0	0	111.2	P57 Q58 V60 V99	P57-A72 WeakPolarHBondContact CA-O 3.27Å; Q58-A72 PolarHBondContact N-O 3.31Å; Q58-A72 PolarHBondContact O-N 3.37Å; V60-A72 HydrophobicContact CG2-CB 3.52Å; A72-V99 HydrophobicContact CB-CG2 4.02Å
73	C	81.4	Confident	76.3	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.014	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	152.6	169.8	-179.3	0	0	0	0	109	K55 P57 Y83 W85 N98 C115 T144	K55-C73 PolarHBondContact O-SG 3.02Å; K55-C73 VanDerWaalsContact O-SG 3.36Å; P57-C73 HydrophobicContact CG-CB 4.27Å; C73-Y83 HydrophobicContact CB-CE1 4.35Å; C73-W85 HydrophobicContact CB-CH2 4.09Å; C73-W85 HydrophobicContact CB-CZ2 4Å; C73-N98 PolarHBondContact N-O 2.82Å; C73-N98 WeakPolarHBondContact O-CB 3.47Å; C73-N98 PolarHBondContact O-ND2 2.87Å; C73-C115 VanDerWaalsContact CB-SG 3.55Å; C73-T144 WeakPolarHBondContact SG-CG2 3.44Å
74	L	80.8	Confident	78.5	Confident	12 Å²	12	33.6 Å²	33.6	6%	0.063	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	131.3	174.2	-174.7	68.3	0	0	0	111.2	I54 K55 Y512	I54-L74 HydrophobicContact CB-CB 4.45Å; I54-L74 HydrophobicContact CB-CD2 4.02Å; I54-L74 HydrophobicContact CB-CG 4.13Å; I54-L74 HydrophobicContact CD1-CD2 4.07Å; I54-L74 HydrophobicContact CD1-CG 4.13Å; I54-L74 HydrophobicContact CG2-CD2 4Å; I54-L74 PolarHBondContact N-O 3.18Å; K55-L74 HydrophobicContact CB-CB 3.99Å; K55-L74 PolarHBondContact N-O 3.08Å; K55-L74 PolarHBondContact O-N 3.45Å; L74-Y512 HydrophobicContact CD1-CD1 3.97Å; L74-Y512 HydrophobicContact CD1-CE1 3.66Å; L74-Y512 HydrophobicContact CD2-CE1 3.86Å; L74-Y512 HydrophobicContact CD2-CE2 3.78Å; L74-Y512 WeakPolarHBondContact CD2-OH 3.13Å; L74-Y512 HydrophobicContact CG-CE1 4.4Å
75	A	83.2	Confident	80.3	Confident	9 Å²	9	30.3 Å²	30.3	7%	0.074	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	144.9	174.4	0	0	0	0	0	110.7	V51 K52 I53 P81 Y83 A117	V51-A75 HydrophobicContact CG1-CB 3.92Å; K52-A75 CarbonylContact O-C 3.27Å; K52-A75 WeakPolarHBondContact O-CA 3.23Å; K52-A75 WeakPolarHBondContact O-CB 3.47Å; I53-A75 HydrophobicContact CD1-CB 3.88Å; A75-P81 HydrophobicContact CB-CB 4.16Å; A75-P81 HydrophobicContact CB-CG 4.07Å; A75-Y83 HydrophobicContact CB-CE1 4.12Å; A75-Y83 PolarHBondContact N-OH 3.4Å; A75-Y83 PolarHBondContact O-OH 3.06Å; A75-A117 HydrophobicContact CB-CB 3.64Å
76	S	82.1	Confident	82	Confident	37 Å²	37	30 Å²	30	26%	0.259	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	155	169.4	55.9	0	0	0	0	111	V51 K52	V51-S76 CarbonylContact C-O 3.58Å; V51-S76 VanDerWaalsContact CA-O 3.31Å; V51-S76 WeakPolarHBondContact CA-O 3.27Å; K52-S76 PolarHBondContact N-O 2.79Å; K52-S76 PolarHBondContact O-N 3.27Å; K52-S76 PolarHBondContact O-OG 3.28Å
77	G	83.6	Confident	83.4	Confident	1 Å²	1	26 Å²	26	1%	0.01	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.6	170	171.6	0	0	0	0	0	110.3	E49 P79	E49-G77 WeakPolarHBondContact O-CA 3.41Å; G77-P79 CarbonylContact C-O 3.54Å; G77-P79 CarbonylContact O-C 3.6Å
78	F	83.3	Confident	84.3	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	120.1	171.4	-176.7	-97.5	0	0	0	110.3	Q41 L42 R46 K47 F48 E49 N119	Q41-F78 HydrophobicContact CB-CE2 3.51Å; Q41-F78 HydrophobicContact CB-CZ 3.6Å; Q41-F78 HydrophobicContact CG-CE2 4.24Å; L42-F78 HydrophobicContact CD2-CE1 4.05Å; L42-F78 HydrophobicContact CD2-CZ 3.77Å; L42-F78 HydrophobicContact CG-CZ 4.11Å; R46-F78 HydrophobicContact CB-CD1 4.15Å; R46-F78 HydrophobicContact CB-CE1 3.83Å; R46-F78 HydrophobicContact CB-CZ 4.08Å; R46-F78 HydrophobicContact CG-CD1 4.02Å; R46-F78 HydrophobicContact CG-CE1 4.21Å; R46-F78 HydrophobicContact CG-CG 4.2Å; K47-F78 WeakPolarHBondContact O-CD1 3.39Å; F48-F78 VanDerWaalsContact CD2-O 3.23Å; F48-F78 WeakPolarHBondContact CD2-O 3.43Å; E49-F78 HydrophobicContact CB-CB 4Å; E49-F78 HydrophobicContact CG-CB 4.31Å; E49-F78 PolarHBondContact N-O 3.43Å; E49-F78 PolarHBondContact O-N 3.39Å; F78-N119 PolarHBondContact N-ND2 2.7Å; F78-N119 PolarHBondContact O-ND2 3.42Å
79	P	86.4	Confident	85.1	Confident	5 Å²	5	28.5 Å²	28.5	3%	0.032	16%	0.159	C	C	.	.	S	Bend	cis	-59.1	165	-1.7	-24.7	36.6	0	0	0	113.9	G77 N119 I121	G77-P79 CarbonylContact C-O 3.54Å; G77-P79 CarbonylContact O-C 3.6Å; P79-N119 WeakPolarHBondContact O-CB 3.22Å; P79-N119 PolarHBondContact O-ND2 3.29Å; P79-I121 HydrophobicContact CG-CD1 4.21Å; P79-I121 HydrophobicContact CG-CG1 3.48Å; P79-I121 VanDerWaalsContact CG-CG1 3.48Å
80	Y	80.3	Confident	85.9	Confident	75 Å²	75	31.9 Å²	31.9	29%	0.294	18%	0.182	S	C	.	.	P	Polyproline II helix	trans	-54.1	133.5	178.7	-63.3	-78.7	0	0	0	110.2	C32 H33 G36 R38 Q41 T82	C32-Y80 PolarHBondContact O-OH 3.46Å; H33-Y80 WeakPolarHBondContact CA-OH 3.4Å; H33-Y80 AromaticContact CE1-CE1 3.57Å; H33-Y80 AromaticContact ND1-CE1 3.84Å; H33-Y80 AromaticContact ND1-CZ 3.96Å; H33-Y80 AromaticContact NE2-CE1 3.91Å; H33-Y80 PolarHBondContact O-OH 2.87Å; G36-Y80 WeakPolarHBondContact CA-OH 3.39Å; G36-Y80 PolarHBondContact N-OH 2.83Å; R38-Y80 HydrophobicContact CB-CE2 4.48Å; Q41-Y80 PolarHBondContact NE2-OH 3.48Å; Y80-T82 PolarHBondContact O-N 2.98Å
81	P	88	Confident	86.5	Confident	17 Å²	17	35 Å²	35	11%	0.11	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-63.6	136.4	-179.4	-22.5	33.6	0	0	0	112.5	V51 A75 Y83 A117 S118	V51-P81 HydrophobicContact CG1-CB 4.4Å; V51-P81 HydrophobicContact CG1-CG 4.29Å; V51-P81 HydrophobicContact CG2-CB 4.33Å; V51-P81 HydrophobicContact CG2-CG 4.24Å; A75-P81 HydrophobicContact CB-CB 4.16Å; A75-P81 HydrophobicContact CB-CG 4.07Å; P81-Y83 HydrophobicContact CB-CE2 4.48Å; P81-Y83 VanDerWaalsContact O-CE2 3.31Å; P81-Y83 WeakPolarHBondContact O-CE2 3.47Å; P81-A117 HydrophobicContact CB-CB 4.32Å; P81-S118 CarbonylContact C-O 3.53Å; P81-S118 VanDerWaalsContact CA-O 3.28Å; P81-S118 WeakPolarHBondContact CA-O 3.39Å
82	T	89.3	Confident	86.9	Confident	87 Å²	87	37 Å²	37	53%	0.534	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	161.2	161	57.7	0	0	0	0	109.7	Y80 A117 S118	Y80-T82 PolarHBondContact O-N 2.98Å; T82-A117 CarbonylContact O-C 3.54Å; T82-A117 VanDerWaalsContact O-CA 3.29Å; T82-A117 WeakPolarHBondContact O-CA 3.16Å; T82-S118 PolarHBondContact N-O 3.07Å; T82-S118 PolarHBondContact O-N 3.45Å; T82-S118 PolarHBondContact OG1-O 3.34Å; T82-S118 VanDerWaalsContact OG1-O 3.12Å; T82-S118 PolarHBondContact OG1-OG 2.77Å
83	Y	89.9	Confident	87.2	Confident	21 Å²	21	43.1 Å²	43.1	8%	0.082	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	156.4	-176.4	-60.3	-103.6	0	0	0	110.1	C73 A75 P81 V96 A97 N98 I116 A117	C73-Y83 HydrophobicContact CB-CE1 4.35Å; A75-Y83 HydrophobicContact CB-CE1 4.12Å; A75-Y83 PolarHBondContact N-OH 3.4Å; A75-Y83 PolarHBondContact O-OH 3.06Å; P81-Y83 HydrophobicContact CB-CE2 4.48Å; P81-Y83 VanDerWaalsContact O-CE2 3.31Å; P81-Y83 WeakPolarHBondContact O-CE2 3.47Å; Y83-V96 PolarHBondContact N-O 2.89Å; Y83-V96 CarbonylContact O-C 3.55Å; Y83-V96 WeakPolarHBondContact O-CA 3.36Å; Y83-V96 WeakPolarHBondContact O-CB 3.5Å; Y83-A97 WeakPolarHBondContact CB-O 3.12Å; Y83-N98 HydrophobicContact CD1-CB 4Å; Y83-N98 HydrophobicContact CD2-CB 3.55Å; Y83-N98 HydrophobicContact CE1-CB 3.76Å; Y83-N98 HydrophobicContact CE2-CB 3.34Å; Y83-N98 HydrophobicContact CG-CB 3.91Å; Y83-N98 VanDerWaalsContact CZ-CB 3.42Å; Y83-I116 CarbonylContact C-O 3.42Å; Y83-I116 WeakPolarHBondContact CA-O 3.41Å; Y83-A117 HydrophobicContact CD1-CB 4.08Å; Y83-A117 HydrophobicContact CE1-CB 3.97Å
84	Q	94.5	Very high	87	Confident	41 Å²	41	45.9 Å²	45.9	19%	0.192	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	120.3	167.5	179.7	56.4	71.9	0	0	109.4	Y86 L91 L92 C115 I116	Q84-Y86 HydrophobicContact CB-CE2 4.31Å; Q84-Y86 HydrophobicContact CG-CE2 3.85Å; Q84-Y86 WeakPolarHBondContact O-CD2 3.11Å; Q84-Y86 WeakPolarHBondContact O-CE2 3.23Å; Q84-L91 HydrophobicContact CG-CD1 3.41Å; Q84-L91 VanDerWaalsContact CG-CD1 3.41Å; Q84-L91 VanDerWaalsContact NE2-CD1 3.29Å; Q84-L92 PolarHBondContact NE2-O 2.93Å; Q84-C115 CarbonylContact O-C 3.52Å; Q84-C115 VanDerWaalsContact O-CA 3.25Å; Q84-C115 WeakPolarHBondContact O-CA 3.28Å; Q84-C115 WeakPolarHBondContact O-CB 3.49Å; Q84-I116 PolarHBondContact N-O 2.83Å; Q84-I116 PolarHBondContact O-N 3.21Å
85	W	90.5	Very high	87.3	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	149.9	-178.2	-71.6	89.1	0	0	0	113.6	P57 I71 C73 L92 E95 A97 L100 C115	P57-W85 HydrophobicContact CB-CH2 4.05Å; P57-W85 HydrophobicContact CB-CZ3 4.2Å; P57-W85 HydrophobicContact CG-CH2 4.22Å; P57-W85 HydrophobicContact CG-CZ3 4.32Å; I71-W85 HydrophobicContact CB-CH2 4.18Å; I71-W85 HydrophobicContact CB-CZ3 4.43Å; I71-W85 HydrophobicContact CG2-CH2 3.62Å; I71-W85 HydrophobicContact CG2-CZ3 3.88Å; C73-W85 HydrophobicContact CB-CH2 4.09Å; C73-W85 HydrophobicContact CB-CZ2 4Å; W85-L92 HydrophobicContact CB-CB 4.38Å; W85-L92 HydrophobicContact CB-CD1 4.05Å; W85-L92 PolarHBondContact O-N 3.05Å; W85-E95 HydrophobicContact CB-CB 3.99Å; W85-E95 HydrophobicContact CG-CB 4.42Å; W85-E95 PolarHBondContact N-O 2.92Å; W85-E95 VanDerWaalsContact N-O 3.11Å; W85-A97 PolarHBondContact NE1-O 3.12Å; W85-L100 HydrophobicContact CB-CD1 4.33Å; W85-L100 HydrophobicContact CB-CD2 4.26Å; W85-L100 HydrophobicContact CD2-CB 3.6Å; W85-L100 HydrophobicContact CD2-CD2 3.85Å; W85-L100 HydrophobicContact CD2-CG 4.23Å; W85-L100 HydrophobicContact CE3-CB 4.02Å; W85-L100 HydrophobicContact CE3-CD2 3.64Å; W85-L100 HydrophobicContact CE3-CG 4.45Å; W85-L100 HydrophobicContact CG-CB 3.95Å; W85-L100 HydrophobicContact CG-CD1 4.27Å; W85-L100 HydrophobicContact CG-CD2 4.13Å; W85-L100 HydrophobicContact CG-CG 4.35Å; W85-L100 HydrophobicContact CH2-CB 4.37Å; W85-L100 HydrophobicContact CZ2-CB 3.99Å; W85-L100 HydrophobicContact CZ3-CB 4.38Å; W85-L100 HydrophobicContact CZ3-CD2 4.28Å; W85-C115 HydrophobicContact CD2-CB 3.65Å; W85-C115 HydrophobicContact CE3-CB 3.86Å; W85-C115 HydrophobicContact CG-CB 4.05Å; W85-C115 HydrophobicContact CH2-CB 4.4Å; W85-C115 HydrophobicContact CZ2-CB 4.22Å; W85-C115 HydrophobicContact CZ3-CB 4.23Å
86	Y	92.5	Very high	87.4	Confident	50 Å²	50	50.3 Å²	50.3	20%	0.196	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	144.9	177	-63.7	-97.9	0	0	0	110.6	Q84 T90 L91 Y113 Y114 I116	Q84-Y86 HydrophobicContact CB-CE2 4.31Å; Q84-Y86 HydrophobicContact CG-CE2 3.85Å; Q84-Y86 WeakPolarHBondContact O-CD2 3.11Å; Q84-Y86 WeakPolarHBondContact O-CE2 3.23Å; Y86-T90 CarbonylContact C-O 3.53Å; Y86-T90 VanDerWaalsContact CA-O 3.23Å; Y86-T90 WeakPolarHBondContact CA-O 3.28Å; Y86-L91 HydrophobicContact CD1-CB 4.42Å; Y86-L91 HydrophobicContact CD1-CD1 4.41Å; Y86-L91 HydrophobicContact CE1-CB 4.15Å; Y86-L91 HydrophobicContact CE1-CD1 3.72Å; Y86-L91 HydrophobicContact CE2-CD1 4.49Å; Y86-Y113 WeakPolarHBondContact O-CA 3.42Å; Y86-Y114 VanDerWaalsContact CB-CZ 3.4Å; Y86-Y114 HydrophobicContact CD2-CD2 4.11Å; Y86-Y114 AromaticContact CD2-CE2 3.51Å; Y86-Y114 HydrophobicContact CD2-CE2 3.51Å; Y86-Y114 HydrophobicContact CE2-CE2 4.3Å; Y86-Y114 HydrophobicContact CG-CD2 4.45Å; Y86-Y114 HydrophobicContact CG-CE1 4.44Å; Y86-Y114 AromaticContact CG-CE2 3.66Å; Y86-Y114 HydrophobicContact CG-CE2 3.66Å; Y86-Y114 AromaticContact CG-CZ 3.65Å; Y86-Y114 PolarHBondContact N-O 3.21Å; Y86-Y114 PolarHBondContact O-N 2.84Å; Y86-I116 HydrophobicContact CD2-CD1 4.49Å; Y86-I116 HydrophobicContact CD2-CG1 4.38Å; Y86-I116 HydrophobicContact CE2-CB 4.39Å; Y86-I116 HydrophobicContact CE2-CD1 3.67Å; Y86-I116 HydrophobicContact CE2-CG1 3.84Å
87	C	92	Very high	87.2	Confident	21 Å²	21	49.8 Å²	49.8	14%	0.142	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	120.5	170.5	176	0	0	0	0	108.7	S89 T90 L92 V112 Y113	C87-S89 PolarHBondContact O-N 2.88Å; C87-T90 PolarHBondContact N-O 2.95Å; C87-T90 WeakPolarHBondContact O-CA 3.5Å; C87-T90 VanDerWaalsContact O-CB 3.27Å; C87-T90 WeakPolarHBondContact O-CB 3.29Å; C87-T90 PolarHBondContact O-N 3.02Å; C87-T90 PolarHBondContact O-OG1 2.89Å; C87-L92 HydrophobicContact CB-CD1 4.16Å; C87-L92 HydrophobicContact CB-CD2 3.88Å; C87-L92 HydrophobicContact CB-CG 4.18Å; C87-V112 WeakPolarHBondContact CA-O 3.5Å; C87-Y113 HydrophobicContact CB-CD1 3.96Å; C87-Y113 HydrophobicContact CB-CE1 3.69Å
88	N	88.9	Confident	87.1	Confident	85 Å²	85	50.3 Å²	50.3	46%	0.455	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.3	44.7	-177.7	-61.8	-24.4	0	0	0	112.6	T90 V112	N88-T90 PolarHBondContact O-N 3.46Å; N88-V112 PolarHBondContact N-O 2.83Å; N88-V112 PolarHBondContact OD1-N 3.49Å
89	S	88	Confident	87	Confident	95 Å²	95	50.3 Å²	50.3	66%	0.664	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	4.9	-175.8	-48.9	0	0	0	0	116	C87	C87-S89 PolarHBondContact O-N 2.88Å
90	T	91.2	Very high	86.8	Confident	94 Å²	94	50.1 Å²	50.1	58%	0.577	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	132.8	174.4	-50.3	0	0	0	0	109.6	Y86 C87 N88 L92	Y86-T90 CarbonylContact C-O 3.53Å; Y86-T90 VanDerWaalsContact CA-O 3.23Å; Y86-T90 WeakPolarHBondContact CA-O 3.28Å; C87-T90 PolarHBondContact N-O 2.95Å; C87-T90 WeakPolarHBondContact O-CA 3.5Å; C87-T90 VanDerWaalsContact O-CB 3.27Å; C87-T90 WeakPolarHBondContact O-CB 3.29Å; C87-T90 PolarHBondContact O-N 3.02Å; C87-T90 PolarHBondContact O-OG1 2.89Å; N88-T90 PolarHBondContact O-N 3.46Å; T90-L92 PolarHBondContact O-N 2.86Å
91	L	91.6	Very high	86.8	Confident	76 Å²	76	47.8 Å²	47.8	40%	0.398	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	129.2	177.1	-177.5	71.7	0	0	0	110.8	Q84 Y86 N93	Q84-L91 HydrophobicContact CG-CD1 3.41Å; Q84-L91 VanDerWaalsContact CG-CD1 3.41Å; Q84-L91 VanDerWaalsContact NE2-CD1 3.29Å; Y86-L91 HydrophobicContact CD1-CB 4.42Å; Y86-L91 HydrophobicContact CD1-CD1 4.41Å; Y86-L91 HydrophobicContact CE1-CB 4.15Å; Y86-L91 HydrophobicContact CE1-CD1 3.72Å; Y86-L91 HydrophobicContact CE2-CD1 4.49Å; L91-N93 VanDerWaalsContact CD2-OD1 3.31Å; L91-N93 WeakPolarHBondContact CD2-OD1 3.18Å
92	L	88.7	Confident	86.5	Confident	42 Å²	42	48 Å²	48	22%	0.22	29%	0.287	C	S	.	.			trans	-91.7	99	170.3	-61.7	-178.8	0	0	0	109.4	Q84 W85 C87 T90 G94 E95 L100 Y113	Q84-L92 PolarHBondContact NE2-O 2.93Å; W85-L92 HydrophobicContact CB-CB 4.38Å; W85-L92 HydrophobicContact CB-CD1 4.05Å; W85-L92 PolarHBondContact O-N 3.05Å; C87-L92 HydrophobicContact CB-CD1 4.16Å; C87-L92 HydrophobicContact CB-CD2 3.88Å; C87-L92 HydrophobicContact CB-CG 4.18Å; T90-L92 PolarHBondContact O-N 2.86Å; L92-G94 PolarHBondContact O-N 2.82Å; L92-E95 HydrophobicContact CB-CB 3.91Å; L92-E95 HydrophobicContact CB-CG 3.82Å; L92-E95 PolarHBondContact O-N 3.2Å; L92-L100 HydrophobicContact CD1-CD1 3.88Å; L92-L100 HydrophobicContact CD1-CD2 3.9Å; L92-Y113 HydrophobicContact CD1-CD1 4.35Å; L92-Y113 HydrophobicContact CD1-CE1 4.31Å
93	N	84.6	Confident	85.9	Confident	136 Å²	136	47.6 Å²	47.6	73%	0.727	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	131.3	-177.1	-74.1	-23.7	0	0	0	111.6	L91 E95	L91-N93 VanDerWaalsContact CD2-OD1 3.31Å; L91-N93 WeakPolarHBondContact CD2-OD1 3.18Å; N93-E95 PolarHBondContact O-N 3.07Å
94	G	78.6	Confident	85	Confident	59 Å²	59	49.4 Å²	49.4	61%	0.608	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	-7.4	179	0	0	0	0	0	115	L92 V96	L92-G94 PolarHBondContact O-N 2.82Å; G94-V96 VanDerWaalsContact C-N 3.34Å; G94-V96 PolarHBondContact O-N 2.93Å; G94-V96 VanDerWaalsContact O-N 3.1Å
95	E	85.4	Confident	84	Confident	30 Å²	30	55.3 Å²	55.3	14%	0.14	31%	0.314	C	S	.	.			trans	-87	74.9	176.8	-61.9	-59.4	145.7	0	0	110.6	W85 L92 N93 L100 R525	W85-E95 HydrophobicContact CB-CB 3.99Å; W85-E95 HydrophobicContact CG-CB 4.42Å; W85-E95 PolarHBondContact N-O 2.92Å; W85-E95 VanDerWaalsContact N-O 3.11Å; L92-E95 HydrophobicContact CB-CB 3.91Å; L92-E95 HydrophobicContact CB-CG 3.82Å; L92-E95 PolarHBondContact O-N 3.2Å; N93-E95 PolarHBondContact O-N 3.07Å; E95-L100 HydrophobicContact CB-CD1 3.97Å; E95-L100 HydrophobicContact CG-CD1 3.61Å; E95-L100 WeakPolarHBondContact OE2-CD1 3.4Å; E95-R525 IonicContact OE1-CZ 3.13Å; E95-R525 IonicContact OE1-NE 2.72Å; E95-R525 IonicContact OE1-NH1 2.69Å; E95-R525 PolarHBondContact OE1-NH1 2.94Å; E95-R525 IonicContact OE2-CZ 3.29Å; E95-R525 IonicContact OE2-NH1 2.77Å; E95-R525 PolarHBondContact OE2-NH1 3.47Å; E95-R525 IonicContact OE2-NH2 2.67Å
96	V	86.3	Confident	83.1	Confident	85 Å²	85	62.6 Å²	62.6	52%	0.515	34%	0.341	S	S	.	.			trans	-107.5	-1.4	-175.5	-63.3	0	0	0	0	114.7	Y83 G94	Y83-V96 PolarHBondContact N-O 2.89Å; Y83-V96 CarbonylContact O-C 3.55Å; Y83-V96 WeakPolarHBondContact O-CA 3.36Å; Y83-V96 WeakPolarHBondContact O-CB 3.5Å; G94-V96 VanDerWaalsContact C-N 3.34Å; G94-V96 PolarHBondContact O-N 2.93Å; G94-V96 VanDerWaalsContact O-N 3.1Å
97	A	77.9	Confident	82.1	Confident	25 Å²	25	60.9 Å²	60.9	21%	0.207	34%	0.336	C	S	.	.	S	Bend	trans	-80.5	160.8	175.3	0	0	0	0	0	110.9	Y83 W85 V99 L516	Y83-A97 WeakPolarHBondContact CB-O 3.12Å; W85-A97 PolarHBondContact NE1-O 3.12Å; A97-V99 PolarHBondContact O-N 2.77Å; A97-L516 HydrophobicContact CB-CD2 3.98Å
98	N	80.4	Confident	81.3	Confident	13 Å²	13	63.4 Å²	63.4	7%	0.07	35%	0.354	C	S	.	.	S	Bend	trans	-70.4	-6.4	173.4	80.9	-59.9	0	0	0	113.1	C73 Y83 W498 S514	C73-N98 PolarHBondContact N-O 2.82Å; C73-N98 WeakPolarHBondContact O-CB 3.47Å; C73-N98 PolarHBondContact O-ND2 2.87Å; Y83-N98 HydrophobicContact CD1-CB 4Å; Y83-N98 HydrophobicContact CD2-CB 3.55Å; Y83-N98 HydrophobicContact CE1-CB 3.76Å; Y83-N98 HydrophobicContact CE2-CB 3.34Å; Y83-N98 HydrophobicContact CG-CB 3.91Å; Y83-N98 VanDerWaalsContact CZ-CB 3.42Å; N98-W498 WeakPolarHBondContact ND2-CH2 3.45Å; N98-W498 WeakPolarHBondContact ND2-CZ2 3.46Å; N98-S514 PolarHBondContact OD1-OG 2.89Å
99	V	81.6	Confident	80.4	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.1	175.8	-177.6	0	0	0	0	109.4	L70 I71 A72 A97 L496 W498 L516	L70-V99 HydrophobicContact CB-CG1 4.37Å; L70-V99 HydrophobicContact CD2-CG1 4.37Å; I71-V99 CarbonylContact O-C 3.59Å; I71-V99 WeakPolarHBondContact O-CA 3.24Å; A72-V99 HydrophobicContact CB-CG2 4.02Å; A97-V99 PolarHBondContact O-N 2.77Å; V99-L496 HydrophobicContact CG1-CD2 3.94Å; V99-L496 HydrophobicContact CG2-CD2 4.05Å; V99-W498 HydrophobicContact CG2-CH2 3.75Å; V99-W498 HydrophobicContact CG2-CZ3 3.73Å; V99-L516 HydrophobicContact CB-CD1 4.29Å; V99-L516 HydrophobicContact CG1-CD1 4.45Å
100	L	83.1	Confident	79.8	Confident	1 Å²	1	67 Å²	67	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	126.3	172.5	176.3	63.1	0	0	0	109.4	L70 I71 W85 L92 E95 L102 Y113	L70-L100 WeakPolarHBondContact CA-O 3.45Å; I71-L100 HydrophobicContact CB-CB 4.39Å; I71-L100 HydrophobicContact CD1-CD2 4.42Å; I71-L100 PolarHBondContact N-O 2.72Å; I71-L100 PolarHBondContact O-N 3.48Å; W85-L100 HydrophobicContact CB-CD1 4.33Å; W85-L100 HydrophobicContact CB-CD2 4.26Å; W85-L100 HydrophobicContact CD2-CB 3.6Å; W85-L100 HydrophobicContact CD2-CD2 3.85Å; W85-L100 HydrophobicContact CD2-CG 4.23Å; W85-L100 HydrophobicContact CE3-CB 4.02Å; W85-L100 HydrophobicContact CE3-CD2 3.64Å; W85-L100 HydrophobicContact CE3-CG 4.45Å; W85-L100 HydrophobicContact CG-CB 3.95Å; W85-L100 HydrophobicContact CG-CD1 4.27Å; W85-L100 HydrophobicContact CG-CD2 4.13Å; W85-L100 HydrophobicContact CG-CG 4.35Å; W85-L100 HydrophobicContact CH2-CB 4.37Å; W85-L100 HydrophobicContact CZ2-CB 3.99Å; W85-L100 HydrophobicContact CZ3-CB 4.38Å; W85-L100 HydrophobicContact CZ3-CD2 4.28Å; L92-L100 HydrophobicContact CD1-CD1 3.88Å; L92-L100 HydrophobicContact CD1-CD2 3.9Å; E95-L100 HydrophobicContact CB-CD1 3.97Å; E95-L100 HydrophobicContact CG-CD1 3.61Å; E95-L100 WeakPolarHBondContact OE2-CD1 3.4Å; L100-L102 HydrophobicContact CD1-CD2 4.14Å; L100-L102 HydrophobicContact CD2-CD1 4.08Å; L100-L102 HydrophobicContact CD2-CD2 4.03Å; L100-L102 HydrophobicContact CD2-CG 4.14Å; L100-L102 HydrophobicContact CG-CD1 4.36Å; L100-L102 HydrophobicContact CG-CD2 3.96Å; L100-L102 HydrophobicContact CG-CG 3.95Å; L100-Y113 HydrophobicContact CD2-CD1 3.54Å; L100-Y113 HydrophobicContact CD2-CE1 4.02Å; L100-Y113 HydrophobicContact CD2-CG 4.32Å
101	S	81	Confident	79.5	Confident	25 Å²	25	62.6 Å²	62.6	18%	0.175	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	119.8	176.5	-173.5	0	0	0	0	109.8	R525	S101-R525 VanDerWaalsContact CB-NH2 3.33Å
102	L	79.9	Confident	79.3	Confident	22 Å²	22	60 Å²	60	12%	0.115	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132.8	-177.3	-63.3	170.3	0	0	0	110.2	T68 M69 I71 L100 V107 Y113	T68-L102 CarbonylContact C-O 3.51Å; T68-L102 VanDerWaalsContact CA-O 3.25Å; T68-L102 WeakPolarHBondContact CA-O 3.3Å; M69-L102 HydrophobicContact CE-CB 4.41Å; M69-L102 HydrophobicContact CE-CD1 3.56Å; M69-L102 PolarHBondContact N-O 3.24Å; M69-L102 PolarHBondContact O-N 2.97Å; I71-L102 HydrophobicContact CD1-CD1 3.66Å; I71-L102 HydrophobicContact CG1-CD1 4.28Å; L100-L102 HydrophobicContact CD1-CD2 4.14Å; L100-L102 HydrophobicContact CD2-CD1 4.08Å; L100-L102 HydrophobicContact CD2-CD2 4.03Å; L100-L102 HydrophobicContact CD2-CG 4.14Å; L100-L102 HydrophobicContact CG-CD1 4.36Å; L100-L102 HydrophobicContact CG-CD2 3.96Å; L100-L102 HydrophobicContact CG-CG 3.95Å; L102-V107 HydrophobicContact CB-CG2 3.9Å; L102-V107 HydrophobicContact CD1-CG2 4.29Å; L102-Y113 HydrophobicContact CD1-CD1 4.19Å; L102-Y113 HydrophobicContact CD1-CD2 4.38Å; L102-Y113 HydrophobicContact CD1-CE1 3.65Å; L102-Y113 HydrophobicContact CD1-CE2 3.87Å; L102-Y113 VanDerWaalsContact CD1-CZ 3.47Å; L102-Y113 HydrophobicContact CD2-CE1 3.88Å; L102-Y113 HydrophobicContact CG-CE1 4.42Å
103	R	77.2	Confident	79.4	Confident	78 Å²	78	58.4 Å²	58.4	29%	0.294	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	125.4	164.2	-75.2	-168	-178.6	166.7	6.7	108.9	D67 T68 E105 R106 T520	D67-R103 CarbonylContact O-C 3.46Å; D67-R103 WeakPolarHBondContact O-CA 3.46Å; T68-R103 HydrophobicContact CG2-CG 4.08Å; R103-E105 PolarHBondContact O-N 3.46Å; R103-R106 PolarHBondContact O-N 3Å; R103-T520 PolarHBondContact NH2-O 2.78Å
104	L	72.1	Confident	79.8	Confident	60 Å²	60	52.9 Å²	52.9	31%	0.314	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-55.4	-36.2	-175.4	-80.6	163.8	0	0	0	112.6	P66 D67 M69 R106 V107	P66-L104 WeakPolarHBondContact O-CD1 3.13Å; D67-L104 PolarHBondContact O-N 3.29Å; M69-L104 HydrophobicContact CB-CD2 4.3Å; M69-L104 HydrophobicContact CB-CG 4.48Å; L104-R106 PolarHBondContact O-N 2.75Å; L104-R106 VanDerWaalsContact O-N 3.17Å; L104-V107 PolarHBondContact O-N 2.8Å; L104-V107 VanDerWaalsContact O-N 3.15Å
105	E	72.6	Confident	80.4	Confident	165 Å²	165	50 Å²	50	77%	0.771	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-60	-24.9	176.2	-60.3	-177.4	161.5	0	0	114.3	R103	R103-E105 PolarHBondContact O-N 3.46Å
106	R	72.2	Confident	80.8	Confident	152 Å²	152	50.9 Å²	50.9	57%	0.574	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-100.2	-1.1	-177.6	-60.9	-176.8	-179	-175.9	-1.3	112.6	R103 L104 S108 N522	R103-R106 PolarHBondContact O-N 3Å; L104-R106 PolarHBondContact O-N 2.75Å; L104-R106 VanDerWaalsContact O-N 3.17Å; R106-S108 PolarHBondContact O-N 3.09Å; R106-N522 PolarHBondContact NH2-O 2.9Å
107	V	71.8	Confident	81.1	Confident	14 Å²	14	46.9 Å²	46.9	9%	0.085	23%	0.229	C	C	.	.			trans	-86.4	111.3	179.8	-179.1	0	0	0	0	109.2	L102 L104 A111 Y113 I149	L102-V107 HydrophobicContact CB-CG2 3.9Å; L102-V107 HydrophobicContact CD1-CG2 4.29Å; L104-V107 PolarHBondContact O-N 2.8Å; L104-V107 VanDerWaalsContact O-N 3.15Å; V107-A111 HydrophobicContact CG1-CB 4.45Å; V107-Y113 HydrophobicContact CG1-CE2 4.42Å; V107-I149 HydrophobicContact CG1-CB 4.32Å; V107-I149 HydrophobicContact CG1-CG2 4.02Å
108	S	73.5	Confident	81.8	Confident	75 Å²	75	47.5 Å²	47.5	52%	0.524	23%	0.233	S	C	.	.			trans	-63.2	139.5	171.9	-56.4	0	0	0	0	110.5	R106 E110 A111	R106-S108 PolarHBondContact O-N 3.09Å; S108-E110 PolarHBondContact O-N 2.83Å; S108-A111 WeakPolarHBondContact O-CB 3.46Å; S108-A111 PolarHBondContact O-N 2.99Å
109	Q	70.1	Confident	82.2	Confident	155 Å²	155	47.1 Å²	47.1	72%	0.724	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	133.4	171	-89	-174.5	-20.7	0	0	110.4	A111 S151	Q109-A111 PolarHBondContact O-N 2.88Å; Q109-S151 VanDerWaalsContact CG-OG 3.32Å; Q109-S151 WeakPolarHBondContact CG-OG 3.3Å
110	E	76.4	Confident	82.6	Confident	101 Å²	101	52.4 Å²	52.4	47%	0.472	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	17.6	-177.3	-53.5	-158.7	163.5	0	0	115.8	S108 V112 R148 I149	S108-E110 PolarHBondContact O-N 2.83Å; E110-V112 PolarHBondContact O-N 2.85Å; E110-R148 IonicContact OE2-CZ 3.57Å; E110-R148 IonicContact OE2-NE 3.68Å; E110-R148 IonicContact OE2-NH2 2.77Å; E110-R148 PolarHBondContact OE2-NH2 2.82Å; E110-I149 PolarHBondContact N-O 2.96Å
111	A	83.7	Confident	82.6	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.255	C	S	.	.			trans	-56.8	134	171.4	0	0	0	0	0	111	V107 S108 Q109 Y113 I149	V107-A111 HydrophobicContact CG1-CB 4.45Å; S108-A111 WeakPolarHBondContact O-CB 3.46Å; S108-A111 PolarHBondContact O-N 2.99Å; Q109-A111 PolarHBondContact O-N 2.88Å; A111-Y113 HydrophobicContact CB-CD2 4.39Å; A111-Y113 HydrophobicContact CB-CE2 3.55Å; A111-I149 PolarHBondContact O-N 3.12Å
112	V	89	Confident	82.6	Confident	21 Å²	21	53.6 Å²	53.6	13%	0.127	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	122.7	179.8	-177.1	0	0	0	0	109.2	C87 N88 E110 Q146 I147 R148	C87-V112 WeakPolarHBondContact CA-O 3.5Å; N88-V112 PolarHBondContact N-O 2.83Å; N88-V112 PolarHBondContact OD1-N 3.49Å; E110-V112 PolarHBondContact O-N 2.85Å; V112-Q146 HydrophobicContact CG1-CB 3.58Å; V112-Q146 HydrophobicContact CG1-CG 3.87Å; V112-I147 WeakPolarHBondContact CA-O 3.32Å; V112-R148 HydrophobicContact CG2-CB 4.46Å; V112-R148 HydrophobicContact CG2-CG 4.01Å
113	Y	90.5	Very high	82.5	Confident	9 Å²	9	59.5 Å²	59.5	4%	0.035	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	144.2	179.5	-61.6	-91	0	0	0	110.7	I71 Y86 C87 L92 L100 L102 V107 A111 Q146 I147 I149	I71-Y113 HydrophobicContact CD1-CD2 3.97Å; I71-Y113 HydrophobicContact CD1-CG 3.93Å; Y86-Y113 WeakPolarHBondContact O-CA 3.42Å; C87-Y113 HydrophobicContact CB-CD1 3.96Å; C87-Y113 HydrophobicContact CB-CE1 3.69Å; L92-Y113 HydrophobicContact CD1-CD1 4.35Å; L92-Y113 HydrophobicContact CD1-CE1 4.31Å; L100-Y113 HydrophobicContact CD2-CD1 3.54Å; L100-Y113 HydrophobicContact CD2-CE1 4.02Å; L100-Y113 HydrophobicContact CD2-CG 4.32Å; L102-Y113 HydrophobicContact CD1-CD1 4.19Å; L102-Y113 HydrophobicContact CD1-CD2 4.38Å; L102-Y113 HydrophobicContact CD1-CE1 3.65Å; L102-Y113 HydrophobicContact CD1-CE2 3.87Å; L102-Y113 VanDerWaalsContact CD1-CZ 3.47Å; L102-Y113 HydrophobicContact CD2-CE1 3.88Å; L102-Y113 HydrophobicContact CG-CE1 4.42Å; V107-Y113 HydrophobicContact CG1-CE2 4.42Å; A111-Y113 HydrophobicContact CB-CD2 4.39Å; A111-Y113 HydrophobicContact CB-CE2 3.55Å; Y113-Q146 WeakPolarHBondContact O-CA 3.27Å; Y113-I147 PolarHBondContact N-O 3.42Å; Y113-I147 PolarHBondContact O-N 2.87Å; Y113-I149 HydrophobicContact CD2-CG1 3.65Å; Y113-I149 HydrophobicContact CE2-CB 4.36Å; Y113-I149 HydrophobicContact CE2-CG1 3.78Å
114	Y	92.7	Very high	82.4	Confident	20 Å²	20	62.3 Å²	62.3	8%	0.078	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	163.1	168.6	65.9	-90.5	0	0	0	108.8	Y86 I116 K143 Q146	Y86-Y114 VanDerWaalsContact CB-CZ 3.4Å; Y86-Y114 HydrophobicContact CD2-CD2 4.11Å; Y86-Y114 AromaticContact CD2-CE2 3.51Å; Y86-Y114 HydrophobicContact CD2-CE2 3.51Å; Y86-Y114 HydrophobicContact CE2-CE2 4.3Å; Y86-Y114 HydrophobicContact CG-CD2 4.45Å; Y86-Y114 HydrophobicContact CG-CE1 4.44Å; Y86-Y114 AromaticContact CG-CE2 3.66Å; Y86-Y114 HydrophobicContact CG-CE2 3.66Å; Y86-Y114 AromaticContact CG-CZ 3.65Å; Y86-Y114 PolarHBondContact N-O 3.21Å; Y86-Y114 PolarHBondContact O-N 2.84Å; Y114-I116 HydrophobicContact CE2-CG1 4.38Å; Y114-K143 HydrophobicContact CD2-CD 4.21Å; Y114-K143 HydrophobicContact CD2-CG 3.96Å; Y114-K143 HydrophobicContact CE2-CD 4.16Å; Y114-K143 HydrophobicContact CE2-CG 4.3Å; Y114-Q146 HydrophobicContact CD1-CG 4.14Å; Y114-Q146 HydrophobicContact CG-CG 4.43Å
115	C	92	Very high	82.4	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	159.6	169.5	63.6	0	0	0	0	111.8	C73 Q84 W85 T144	C73-C115 VanDerWaalsContact CB-SG 3.55Å; Q84-C115 CarbonylContact O-C 3.52Å; Q84-C115 VanDerWaalsContact O-CA 3.25Å; Q84-C115 WeakPolarHBondContact O-CA 3.28Å; Q84-C115 WeakPolarHBondContact O-CB 3.49Å; W85-C115 HydrophobicContact CD2-CB 3.65Å; W85-C115 HydrophobicContact CE3-CB 3.86Å; W85-C115 HydrophobicContact CG-CB 4.05Å; W85-C115 HydrophobicContact CH2-CB 4.4Å; W85-C115 HydrophobicContact CZ2-CB 4.22Å; W85-C115 HydrophobicContact CZ3-CB 4.23Å; C115-T144 PolarHBondContact N-OG1 3.14Å; C115-T144 VanDerWaalsContact N-OG1 3.07Å; C115-T144 WeakPolarHBondContact O-CG2 3.46Å; C115-T144 PolarHBondContact O-N 3.23Å; C115-T144 PolarHBondContact O-OG1 3.42Å; C115-T144 VanDerWaalsContact SG-CG2 3.52Å
116	I	93.8	Very high	82.3	Confident	48 Å²	48	59.1 Å²	59.1	25%	0.246	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	120.8	166.5	-60.7	177.7	0	0	0	106.2	Y83 Q84 Y86 Y114 A141 K143	Y83-I116 CarbonylContact C-O 3.42Å; Y83-I116 WeakPolarHBondContact CA-O 3.41Å; Q84-I116 PolarHBondContact N-O 2.83Å; Q84-I116 PolarHBondContact O-N 3.21Å; Y86-I116 HydrophobicContact CD2-CD1 4.49Å; Y86-I116 HydrophobicContact CD2-CG1 4.38Å; Y86-I116 HydrophobicContact CE2-CB 4.39Å; Y86-I116 HydrophobicContact CE2-CD1 3.67Å; Y86-I116 HydrophobicContact CE2-CG1 3.84Å; Y114-I116 HydrophobicContact CE2-CG1 4.38Å; I116-A141 HydrophobicContact CG2-CB 4.14Å; I116-K143 HydrophobicContact CG1-CB 4.43Å
117	A	91.2	Very high	82.3	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	130.5	170.6	0	0	0	0	0	108.5	V51 I53 A75 P81 T82 Y83 A141 V142	V51-A117 HydrophobicContact CG1-CB 3.69Å; I53-A117 HydrophobicContact CD1-CB 3.91Å; A75-A117 HydrophobicContact CB-CB 3.64Å; P81-A117 HydrophobicContact CB-CB 4.32Å; T82-A117 CarbonylContact O-C 3.54Å; T82-A117 VanDerWaalsContact O-CA 3.29Å; T82-A117 WeakPolarHBondContact O-CA 3.16Å; Y83-A117 HydrophobicContact CD1-CB 4.08Å; Y83-A117 HydrophobicContact CE1-CB 3.97Å; A117-A141 CarbonylContact O-C 3.55Å; A117-A141 VanDerWaalsContact O-CA 3.27Å; A117-A141 WeakPolarHBondContact O-CA 3.46Å; A117-V142 PolarHBondContact N-O 3.47Å; A117-V142 PolarHBondContact O-N 2.93Å
118	S	93.2	Very high	82.3	Confident	39 Å²	39	56 Å²	56	27%	0.273	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	146.7	-176.6	53.5	0	0	0	0	112.1	P81 T82 S140	P81-S118 CarbonylContact C-O 3.53Å; P81-S118 VanDerWaalsContact CA-O 3.28Å; P81-S118 WeakPolarHBondContact CA-O 3.39Å; T82-S118 PolarHBondContact N-O 3.07Å; T82-S118 PolarHBondContact O-N 3.45Å; T82-S118 PolarHBondContact OG1-O 3.34Å; T82-S118 VanDerWaalsContact OG1-O 3.12Å; T82-S118 PolarHBondContact OG1-OG 2.77Å; S118-S140 CarbonylContact C-O 3.55Å; S118-S140 WeakPolarHBondContact CA-O 3.35Å
119	N	89.6	Confident	82.5	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.021	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	146.5	165.7	64.9	-1.2	0	0	0	110.6	F48 E49 V51 F78 P79 C139 S140	F48-N119 WeakPolarHBondContact CZ-OD1 3.41Å; E49-N119 PolarHBondContact O-ND2 2.73Å; V51-N119 HydrophobicContact CG2-CB 4.06Å; V51-N119 WeakPolarHBondContact CG2-OD1 3.39Å; F78-N119 PolarHBondContact N-ND2 2.7Å; F78-N119 PolarHBondContact O-ND2 3.42Å; P79-N119 WeakPolarHBondContact O-CB 3.22Å; P79-N119 PolarHBondContact O-ND2 3.29Å; N119-C139 CarbonylContact O-C 3.44Å; N119-C139 VanDerWaalsContact O-CA 3.24Å; N119-C139 WeakPolarHBondContact O-CA 3.42Å; N119-S140 PolarHBondContact N-O 3.08Å; N119-S140 PolarHBondContact O-N 3.37Å; N119-S140 WeakPolarHBondContact OD1-CB 3.44Å
120	E	88.7	Confident	83	Confident	112 Å²	112	51 Å²	51	52%	0.523	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	143.4	-178.9	-177.8	170.7	-164	0	0	109.7	T122 C138 C139	E120-T122 HydrophobicContact CG-CG2 4.46Å; E120-C138 CarbonylContact C-O 3.57Å; E120-C138 VanDerWaalsContact CA-O 3.3Å; E120-C138 WeakPolarHBondContact CA-O 3.36Å; E120-C139 HydrophobicContact CB-CB 4.25Å; E120-C139 HydrophobicContact CG-CB 4.14Å
121	I	83.9	Confident	83	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	24%	0.244	C	C	.	.			trans	-105.1	112.6	165.2	-63.4	178.9	0	0	0	106	F48 P79 Y131 Y132 C138	F48-I121 HydrophobicContact CD2-CD1 3.82Å; F48-I121 HydrophobicContact CD2-CG1 4.11Å; F48-I121 HydrophobicContact CE2-CG1 4.47Å; P79-I121 HydrophobicContact CG-CD1 4.21Å; P79-I121 HydrophobicContact CG-CG1 3.48Å; P79-I121 VanDerWaalsContact CG-CG1 3.48Å; I121-Y131 HydrophobicContact CD1-CD1 3.19Å; I121-Y131 HydrophobicContact CD1-CD2 3.55Å; I121-Y131 HydrophobicContact CD1-CE1 3.38Å; I121-Y131 HydrophobicContact CD1-CE2 3.73Å; I121-Y131 HydrophobicContact CD1-CG 3.27Å; I121-Y131 HydrophobicContact CG1-CG 4.49Å; I121-Y131 HydrophobicContact CG2-CD2 3.9Å; I121-Y131 HydrophobicContact CG2-CG 4.2Å; I121-Y132 WeakPolarHBondContact O-CE2 3.34Å; I121-Y132 PolarHBondContact O-OH 2.79Å; I121-C138 PolarHBondContact N-O 3.38Å
122	T	81.5	Confident	82.7	Confident	50 Å²	50	50 Å²	50	31%	0.307	26%	0.258	S	S	.	.			trans	-76.2	152.2	-176.4	61.7	0	0	0	0	111.4	E120 D124 E125 S128	E120-T122 HydrophobicContact CG-CG2 4.46Å; T122-D124 WeakPolarHBondContact CB-OD1 3.32Å; T122-D124 PolarHBondContact O-N 3.43Å; T122-D124 PolarHBondContact OG1-OD1 3.18Å; T122-E125 PolarHBondContact O-N 3.07Å; T122-S128 VanDerWaalsContact O-CB 3.25Å; T122-S128 WeakPolarHBondContact O-CB 3.3Å
123	E	76.8	Confident	82	Confident	145 Å²	145	56.7 Å²	56.7	68%	0.678	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-25.4	-176.2	-71.9	-171.8	174.3	0	0	113.5	E125 S128 Y132	E123-E125 VanDerWaalsContact C-N 3.35Å; E123-S128 WeakPolarHBondContact O-CB 3.29Å; E123-S128 PolarHBondContact O-OG 2.94Å; E123-Y132 HydrophobicContact CB-CE2 4.5Å; E123-Y132 HydrophobicContact CG-CD1 4.4Å; E123-Y132 HydrophobicContact CG-CD2 4.47Å; E123-Y132 HydrophobicContact CG-CE1 3.68Å; E123-Y132 HydrophobicContact CG-CE2 3.81Å; E123-Y132 WeakPolarHBondContact CG-OH 3.4Å
124	D	75.7	Confident	80.9	Confident	138 Å²	138	63.8 Å²	63.8	74%	0.738	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-9.4	-176.2	60.3	-37.5	0	0	0	114.1	T122	T122-D124 WeakPolarHBondContact CB-OD1 3.32Å; T122-D124 PolarHBondContact O-N 3.43Å; T122-D124 PolarHBondContact OG1-OD1 3.18Å
125	E	70.9	Confident	79.5	Confident	40 Å²	40	66.4 Å²	66.4	19%	0.187	35%	0.352	C	S	.	.	S	Bend	trans	-72.4	140.7	173.8	-72.9	-166.7	-178.4	0	0	111.8	R38 L42 T122 E123 W127 S128	R38-E125 IonicContact CZ-OE1 2.66Å; R38-E125 IonicContact CZ-OE2 2.99Å; R38-E125 IonicContact NH1-OE1 2.76Å; R38-E125 PolarHBondContact NH1-OE1 3.34Å; R38-E125 IonicContact NH2-OE1 3.45Å; R38-E125 PolarHBondContact NH2-OE1 2.99Å; R38-E125 IonicContact NH2-OE2 3.27Å; R38-E125 PolarHBondContact NH2-OE2 3.15Å; L42-E125 WeakPolarHBondContact CD1-OE2 3.35Å; T122-E125 PolarHBondContact O-N 3.07Å; E123-E125 VanDerWaalsContact C-N 3.35Å; E125-W127 PolarHBondContact O-N 2.88Å; E125-S128 WeakPolarHBondContact O-CB 3.25Å; E125-S128 PolarHBondContact O-N 3.16Å; E125-S128 PolarHBondContact O-OG 3.5Å
126	V	70.8	Confident	78.4	Confident	117 Å²	117	71 Å²	71	71%	0.709	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-27.2	-177.5	179	0	0	0	0	112.9
127	W	73	Confident	77.1	Confident	85 Å²	85	74.3 Å²	74.3	32%	0.322	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-3.9	-173.7	-21	95.6	0	0	0	113.2	L42 V43 E125 S129 F130 Y131	L42-W127 HydrophobicContact CB-CG 4Å; V43-W127 HydrophobicContact CG2-CE3 4.45Å; V43-W127 HydrophobicContact CG2-CH2 3.67Å; V43-W127 HydrophobicContact CG2-CZ2 3.87Å; V43-W127 HydrophobicContact CG2-CZ3 3.98Å; E125-W127 PolarHBondContact O-N 2.88Å; W127-S129 PolarHBondContact O-N 3.39Å; W127-S129 VanDerWaalsContact O-N 3.15Å; W127-F130 PolarHBondContact O-N 3.42Å; W127-F130 VanDerWaalsContact O-N 3.09Å; W127-Y131 WeakPolarHBondContact O-CD2 3.23Å
128	S	72.4	Confident	76.6	Confident	17 Å²	17	75.4 Å²	75.4	12%	0.119	39%	0.394	C	S	.	.	H	α-helix	trans	-54.1	-39.3	-173.5	67.4	0	0	0	0	111.7	T122 E123 E125 F130 Y131 Y132	T122-S128 VanDerWaalsContact O-CB 3.25Å; T122-S128 WeakPolarHBondContact O-CB 3.3Å; E123-S128 WeakPolarHBondContact O-CB 3.29Å; E123-S128 PolarHBondContact O-OG 2.94Å; E125-S128 WeakPolarHBondContact O-CB 3.25Å; E125-S128 PolarHBondContact O-N 3.16Å; E125-S128 PolarHBondContact O-OG 3.5Å; S128-F130 PolarHBondContact O-N 3.2Å; S128-Y131 WeakPolarHBondContact O-CA 3.21Å; S128-Y131 PolarHBondContact O-N 3.39Å; S128-Y132 VanDerWaalsContact O-CD2 3.3Å; S128-Y132 WeakPolarHBondContact O-CD2 3.47Å; S128-Y132 PolarHBondContact O-N 2.93Å
129	S	76.4	Confident	76.4	Confident	71 Å²	71	76.9 Å²	76.9	50%	0.497	40%	0.404	S	S	.	.	H	α-helix	trans	-54.5	-26.4	-179.9	70.2	0	0	0	0	115	W127 R133	W127-S129 PolarHBondContact O-N 3.39Å; W127-S129 VanDerWaalsContact O-N 3.15Å; S129-R133 VanDerWaalsContact O-CG 3.25Å; S129-R133 WeakPolarHBondContact O-CG 3.42Å
130	F	79.9	Confident	76.5	Confident	54 Å²	54	77.8 Å²	77.8	24%	0.237	41%	0.41	C	S	.	.	H	α-helix	trans	-69.5	-38.5	173.6	171.4	-98	0	0	0	112.5	H45 W127 S128 K136	H45-F130 HydrophobicContact CB-CD1 3.94Å; H45-F130 HydrophobicContact CB-CD2 4.04Å; H45-F130 HydrophobicContact CB-CE1 3.75Å; H45-F130 HydrophobicContact CB-CE2 3.84Å; H45-F130 HydrophobicContact CB-CG 4.09Å; H45-F130 HydrophobicContact CB-CZ 3.69Å; H45-F130 AromaticContact CD2-CG 3.78Å; H45-F130 AromaticContact CG-CD2 3.85Å; H45-F130 AromaticContact CG-CG 3.92Å; W127-F130 PolarHBondContact O-N 3.42Å; W127-F130 VanDerWaalsContact O-N 3.09Å; S128-F130 PolarHBondContact O-N 3.2Å; F130-K136 PolarHBondContact O-NZ 3.1Å
131	Y	77.5	Confident	76.7	Confident	4 Å²	4	75.6 Å²	75.6	2%	0.016	41%	0.411	C	S	.	.	H	α-helix	trans	-85.3	-30.9	-175.2	-62.7	-81.1	0	0	0	112.6	L42 R46 F48 I121 W127 S128 R133 K136	L42-Y131 HydrophobicContact CD2-CE2 4.09Å; R46-Y131 WeakPolarHBondContact O-CE1 3.47Å; R46-Y131 VanDerWaalsContact O-CZ 3.31Å; R46-Y131 PolarHBondContact O-OH 3.03Å; F48-Y131 HydrophobicContact CB-CD1 4.2Å; F48-Y131 HydrophobicContact CB-CE1 4.39Å; I121-Y131 HydrophobicContact CD1-CD1 3.19Å; I121-Y131 HydrophobicContact CD1-CD2 3.55Å; I121-Y131 HydrophobicContact CD1-CE1 3.38Å; I121-Y131 HydrophobicContact CD1-CE2 3.73Å; I121-Y131 HydrophobicContact CD1-CG 3.27Å; I121-Y131 HydrophobicContact CG1-CG 4.49Å; I121-Y131 HydrophobicContact CG2-CD2 3.9Å; I121-Y131 HydrophobicContact CG2-CG 4.2Å; W127-Y131 WeakPolarHBondContact O-CD2 3.23Å; S128-Y131 WeakPolarHBondContact O-CA 3.21Å; S128-Y131 PolarHBondContact O-N 3.39Å; Y131-R133 VanDerWaalsContact C-N 3.31Å; Y131-R133 PolarHBondContact O-N 3.42Å; Y131-K136 VanDerWaalsContact O-CB 3.26Å; Y131-K136 WeakPolarHBondContact O-CB 3.32Å
132	Y	77.6	Confident	77	Confident	74 Å²	74	78 Å²	78	29%	0.29	43%	0.425	S	S	.	.	S	Bend	trans	-83.1	-4.4	176.7	-75.5	-91.1	0	0	0	113.8	I121 E123 S128 C138	I121-Y132 WeakPolarHBondContact O-CE2 3.34Å; I121-Y132 PolarHBondContact O-OH 2.79Å; E123-Y132 HydrophobicContact CB-CE2 4.5Å; E123-Y132 HydrophobicContact CG-CD1 4.4Å; E123-Y132 HydrophobicContact CG-CD2 4.47Å; E123-Y132 HydrophobicContact CG-CE1 3.68Å; E123-Y132 HydrophobicContact CG-CE2 3.81Å; E123-Y132 WeakPolarHBondContact CG-OH 3.4Å; S128-Y132 VanDerWaalsContact O-CD2 3.3Å; S128-Y132 WeakPolarHBondContact O-CD2 3.47Å; S128-Y132 PolarHBondContact O-N 2.93Å; Y132-C138 HydrophobicContact CD1-CB 4.46Å; Y132-C138 HydrophobicContact CE1-CB 4Å; Y132-C138 WeakPolarHBondContact CE1-SG 3.43Å; Y132-C138 HydrophobicContact CE2-CB 4.05Å
133	R	73.3	Confident	77.5	Confident	162 Å²	162	80.5 Å²	80.5	61%	0.611	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-72	137	175.9	-89.6	173	-172.2	-172.8	4.8	111.9	S129 Y131 G135 K136	S129-R133 VanDerWaalsContact O-CG 3.25Å; S129-R133 WeakPolarHBondContact O-CG 3.42Å; Y131-R133 VanDerWaalsContact C-N 3.31Å; Y131-R133 PolarHBondContact O-N 3.42Å; R133-G135 PolarHBondContact O-N 3.28Å; R133-K136 WeakPolarHBondContact O-CD 3.48Å; R133-K136 VanDerWaalsContact O-CG 3.32Å; R133-K136 WeakPolarHBondContact O-CG 3.38Å
134	N	67.2	Low	78.1	Confident	158 Å²	158	73.9 Å²	73.9	85%	0.845	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	59.2	37.7	169.1	-57.1	-14.6	0	0	0	114.5	K136	N134-K136 PolarHBondContact O-N 3.4Å
135	G	65.1	Low	78.9	Confident	75 Å²	75	72.1 Å²	72.1	77%	0.773	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	65.8	21.7	173.2	0	0	0	0	0	114.8	R133	R133-G135 PolarHBondContact O-N 3.28Å
136	K	68.4	Low	79.8	Confident	98 Å²	98	76 Å²	76	43%	0.426	41%	0.41	S	S	.	.			trans	-65.3	148.3	174.4	-72.1	173.7	-175.7	177.5	0	110.5	F130 Y131 R133 N134 C138	F130-K136 PolarHBondContact O-NZ 3.1Å; Y131-K136 VanDerWaalsContact O-CB 3.26Å; Y131-K136 WeakPolarHBondContact O-CB 3.32Å; R133-K136 WeakPolarHBondContact O-CD 3.48Å; R133-K136 VanDerWaalsContact O-CG 3.32Å; R133-K136 WeakPolarHBondContact O-CG 3.38Å; N134-K136 PolarHBondContact O-N 3.4Å; K136-C138 PolarHBondContact O-N 3Å
137	H	66.7	Low	80.3	Confident	117 Å²	117	71.9 Å²	71.9	54%	0.542	38%	0.384	S	S	.	.			trans	-66.5	124.1	175.4	-62.2	-79.6	0	0	0	110.1	F48	F48-H137 HydrophobicContact CD1-CB 4.1Å; F48-H137 WeakPolarHBondContact CD1-O 3.04Å; F48-H137 HydrophobicContact CE1-CB 4.1Å; F48-H137 VanDerWaalsContact CG-O 3.26Å; F48-H137 WeakPolarHBondContact CG-O 3.06Å
138	C	81.2	Confident	80.9	Confident	23 Å²	23	74.9 Å²	74.9	16%	0.155	40%	0.395	C	S	.	.			trans	-108.8	-5.2	173.4	51.2	0	0	0	0	112.5	F48 E120 I121 Y132 K136	F48-C138 WeakPolarHBondContact CE2-O 3.4Å; E120-C138 CarbonylContact C-O 3.57Å; E120-C138 VanDerWaalsContact CA-O 3.3Å; E120-C138 WeakPolarHBondContact CA-O 3.36Å; I121-C138 PolarHBondContact N-O 3.38Å; Y132-C138 HydrophobicContact CD1-CB 4.46Å; Y132-C138 HydrophobicContact CE1-CB 4Å; Y132-C138 WeakPolarHBondContact CE1-SG 3.43Å; Y132-C138 HydrophobicContact CE2-CB 4.05Å; K136-C138 PolarHBondContact O-N 3Å
139	C	88.6	Confident	81	Confident	70 Å²	70	74.4 Å²	74.4	47%	0.473	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	151.1	175.9	64.4	0	0	0	0	111.9	N119 E120	N119-C139 CarbonylContact O-C 3.44Å; N119-C139 VanDerWaalsContact O-CA 3.24Å; N119-C139 WeakPolarHBondContact O-CA 3.42Å; E120-C139 HydrophobicContact CB-CB 4.25Å; E120-C139 HydrophobicContact CG-CB 4.14Å
140	S	90.7	Very high	80.5	Confident	22 Å²	22	80.1 Å²	80.1	15%	0.154	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	143.8	173.9	176.9	0	0	0	0	109.2	V51 S118 N119	V51-S140 PolarHBondContact N-OG 2.79Å; V51-S140 VanDerWaalsContact N-OG 3.12Å; S118-S140 CarbonylContact C-O 3.55Å; S118-S140 WeakPolarHBondContact CA-O 3.35Å; N119-S140 PolarHBondContact N-O 3.08Å; N119-S140 PolarHBondContact O-N 3.37Å; N119-S140 WeakPolarHBondContact OD1-CB 3.44Å
141	A	93.2	Very high	79.2	Confident	67 Å²	67	80.1 Å²	80.1	55%	0.554	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.6	137.3	175	0	0	0	0	0	110.1	I116 A117	I116-A141 HydrophobicContact CG2-CB 4.14Å; A117-A141 CarbonylContact O-C 3.55Å; A117-A141 VanDerWaalsContact O-CA 3.27Å; A117-A141 WeakPolarHBondContact O-CA 3.46Å
142	V	89.7	Confident	77.5	Confident	50 Å²	50	84.3 Å²	84.3	30%	0.303	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	130.2	178.1	-179.3	0	0	0	0	109.2	V51 I53 A117	V51-V142 HydrophobicContact CB-CG2 4.08Å; V51-V142 HydrophobicContact CG1-CB 4.21Å; V51-V142 HydrophobicContact CG1-CG2 4.26Å; V51-V142 VanDerWaalsContact O-CG2 3.3Å; V51-V142 WeakPolarHBondContact O-CG2 3.5Å; I53-V142 HydrophobicContact CD1-CB 4.37Å; I53-V142 HydrophobicContact CD1-CG1 4.25Å; I53-V142 HydrophobicContact CG1-CB 4.36Å; I53-V142 HydrophobicContact CG1-CG1 3.74Å; A117-V142 PolarHBondContact N-O 3.47Å; A117-V142 PolarHBondContact O-N 2.93Å
143	K	93.5	Very high	75.5	Confident	103 Å²	103	87.7 Å²	87.7	45%	0.448	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	133.2	172.9	179.7	179	173.7	174.6	0	109.2	Y114 I116	Y114-K143 HydrophobicContact CD2-CD 4.21Å; Y114-K143 HydrophobicContact CD2-CG 3.96Å; Y114-K143 HydrophobicContact CE2-CD 4.16Å; Y114-K143 HydrophobicContact CE2-CG 4.3Å; I116-K143 HydrophobicContact CG1-CB 4.43Å
144	T	89.6	Confident	73.6	Confident	6 Å²	6	85 Å²	85	4%	0.037	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-75	169.5	175.8	63.9	0	0	0	0	112.9	I53 P57 C73 C115	I53-T144 HydrophobicContact CD1-CG2 3.75Å; I53-T144 HydrophobicContact CG1-CG2 4.15Å; I53-T144 HydrophobicContact CG2-CG2 4.41Å; P57-T144 VanDerWaalsContact CD-CB 3.48Å; P57-T144 HydrophobicContact CG-CG2 4.04Å; P57-T144 WeakPolarHBondContact CG-OG1 3.04Å; C73-T144 WeakPolarHBondContact SG-CG2 3.44Å; C115-T144 PolarHBondContact N-OG1 3.14Å; C115-T144 VanDerWaalsContact N-OG1 3.07Å; C115-T144 WeakPolarHBondContact O-CG2 3.46Å; C115-T144 PolarHBondContact O-N 3.23Å; C115-T144 PolarHBondContact O-OG1 3.42Å; C115-T144 VanDerWaalsContact SG-CG2 3.52Å
145	D	91.1	Very high	71.6	Confident	101 Å²	101	86.4 Å²	86.4	54%	0.54	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-61.5	162.3	161.4	-66.2	-21.4	0	0	0	110.7	Q56	Q56-D145 HydrophobicContact CB-CB 4.48Å; Q56-D145 VanDerWaalsContact CD-CG 3.44Å; Q56-D145 HydrophobicContact CG-CB 4.17Å; Q56-D145 WeakPolarHBondContact CG-OD2 3.44Å; Q56-D145 PolarHBondContact NE2-OD1 2.86Å; Q56-D145 PolarHBondContact NE2-OD2 2.89Å
146	Q	90.1	Very high	69.8	Low	121 Å²	121	93.4 Å²	93.4	57%	0.565	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-98	127.2	-177.4	-73.2	176.5	29.5	0	0	110.1	V112 Y113 Y114	V112-Q146 HydrophobicContact CG1-CB 3.58Å; V112-Q146 HydrophobicContact CG1-CG 3.87Å; Y113-Q146 WeakPolarHBondContact O-CA 3.27Å; Y114-Q146 HydrophobicContact CD1-CG 4.14Å; Y114-Q146 HydrophobicContact CG-CG 4.43Å
147	I	82.3	Confident	67.7	Low	32 Å²	32	93.9 Å²	93.9	16%	0.164	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	131.3	170.9	-171.7	166	0	0	0	110.1	P57 V59 I71 V112 Y113 I149	P57-I147 HydrophobicContact CB-CB 4.35Å; P57-I147 HydrophobicContact CB-CG2 3.9Å; V59-I147 HydrophobicContact CG2-CD1 3.92Å; I71-I147 HydrophobicContact CD1-CG2 4.21Å; I71-I147 HydrophobicContact CG2-CG2 4.07Å; V112-I147 WeakPolarHBondContact CA-O 3.32Å; Y113-I147 PolarHBondContact N-O 3.42Å; Y113-I147 PolarHBondContact O-N 2.87Å; I147-I149 HydrophobicContact CD1-CD1 4.19Å; I147-I149 HydrophobicContact CG1-CD1 4.13Å
148	R	84.8	Confident	65.6	Low	147 Å²	147	94.2 Å²	94.2	56%	0.555	50%	0.495	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.9	178.3	-162	173.7	-158.2	150.1	-7.9	109.2	E110 V112	E110-R148 IonicContact OE2-CZ 3.57Å; E110-R148 IonicContact OE2-NE 3.68Å; E110-R148 IonicContact OE2-NH2 2.77Å; E110-R148 PolarHBondContact OE2-NH2 2.82Å; V112-R148 HydrophobicContact CG2-CB 4.46Å; V112-R148 HydrophobicContact CG2-CG 4.01Å
149	I	73.6	Confident	62.8	Low	8 Å²	8	98.8 Å²	98.8	4%	0.041	53%	0.526	C	S	.	.			trans	-94	126.1	-176.8	-52.9	-70.5	0	0	0	108.7	V59 M69 I71 V107 E110 A111 Y113 I147	V59-I149 HydrophobicContact CG2-CD1 3.64Å; M69-I149 HydrophobicContact CE-CB 4.28Å; M69-I149 HydrophobicContact CE-CD1 3.48Å; M69-I149 VanDerWaalsContact CE-CD1 3.48Å; M69-I149 HydrophobicContact CE-CG1 3.69Å; M69-I149 HydrophobicContact CE-CG2 3.7Å; M69-I149 HydrophobicContact SD-CD1 3.76Å; M69-I149 HydrophobicContact SD-CG1 4.38Å; M69-I149 HydrophobicContact SD-CG2 3.66Å; I71-I149 HydrophobicContact CD1-CD1 3.82Å; I71-I149 HydrophobicContact CD1-CG1 4.11Å; I71-I149 HydrophobicContact CG1-CD1 4.38Å; V107-I149 HydrophobicContact CG1-CB 4.32Å; V107-I149 HydrophobicContact CG1-CG2 4.02Å; E110-I149 PolarHBondContact N-O 2.96Å; A111-I149 PolarHBondContact O-N 3.12Å; Y113-I149 HydrophobicContact CD2-CG1 3.65Å; Y113-I149 HydrophobicContact CE2-CB 4.36Å; Y113-I149 HydrophobicContact CE2-CG1 3.78Å; I147-I149 HydrophobicContact CD1-CD1 4.19Å; I147-I149 HydrophobicContact CG1-CD1 4.13Å
150	R	66.7	Low	59.7	Low	190 Å²	190	103.6 Å²	103.6	72%	0.717	54%	0.542	S	S	*	.			trans	-102	124.9	168.9	-69.8	-177.7	176	171.3	0.6	107.7	S152	R150-S152 PolarHBondContact O-N 2.81Å
151	S	53	Low	56.5	Low	55 Å²	55	108.3 Å²	108.3	39%	0.385	57%	0.57	S	S	.	*			trans	-72.9	21.9	-174.3	72	0	0	0	0	114.4	Q109	Q109-S151 VanDerWaalsContact CG-OG 3.32Å; Q109-S151 WeakPolarHBondContact CG-OG 3.3Å
152	S	42.1	Very low	53.1	Low	92 Å²	92	112.6 Å²	112.6	64%	0.643	58%	0.581	S	S	*	*			trans	-94.5	109.4	176.5	54.2	0	0	0	0	109	R150	R150-S152 PolarHBondContact O-N 2.81Å
153	L	35.5	Very low	49.9	Very low	144 Å²	144	115.3 Å²	115.3	75%	0.754	60%	0.598	S	S	*	*			trans	-40.6	135.9	162.8	-83.9	132.5	0	0	0	109.8	Q155	L153-Q155 PolarHBondContact O-N 3.26Å
154	P	32.5	Very low	46.6	Very low	105 Å²	105	115.6 Å²	115.6	68%	0.682	61%	0.613	S	S	*	*			trans	-63.4	110.7	168.2	-2.4	16.2	0	0	0	106.7	R156	P154-R156 PolarHBondContact O-N 2.98Å
155	Q	25.6	Very low	43.5	Very low	188 Å²	188	125.5 Å²	125.5	88%	0.879	66%	0.656	S	S	*	*			trans	-60	113.3	158.7	-78.9	-170.7	-23.4	0	0	105.8	L153 S157	L153-Q155 PolarHBondContact O-N 3.26Å; Q155-S157 PolarHBondContact O-N 2.97Å
156	R	26.4	Very low	40.3	Very low	223 Å²	223	125 Å²	125	84%	0.842	66%	0.661	S	S	*	*			trans	-46.1	104.3	167.4	-84.6	179.3	171.4	171.6	-2.7	107.5	P154 T158	P154-R156 PolarHBondContact O-N 2.98Å; R156-T158 PolarHBondContact O-N 2.94Å
157	S	24.7	Very low	37.3	Very low	108 Å²	108	125.9 Å²	125.9	76%	0.755	67%	0.668	S	S	*	*			trans	-69.5	102.8	169.8	56.4	0	0	0	0	106.4	Q155 C159	Q155-S157 PolarHBondContact O-N 2.97Å; S157-C159 PolarHBondContact O-N 2.83Å; S157-C159 VanDerWaalsContact O-N 3.12Å
158	T	22.3	Very low	34.5	Very low	123 Å²	123	132.7 Å²	132.7	76%	0.755	70%	0.697	S	S	*	*			trans	-57.2	109.6	166.5	43.7	0	0	0	0	108.7	R156 E160	R156-T158 PolarHBondContact O-N 2.94Å; T158-E160 PolarHBondContact O-N 3.25Å; T158-E160 VanDerWaalsContact O-N 3.11Å
159	C	23	Very low	31.6	Very low	120 Å²	120	133 Å²	133	81%	0.811	71%	0.71	S	S	*	*			trans	-61.1	110.6	162.7	-79.4	0	0	0	0	107.9	S157 V161	S157-C159 PolarHBondContact O-N 2.83Å; S157-C159 VanDerWaalsContact O-N 3.12Å; C159-V161 PolarHBondContact O-N 2.9Å; C159-V161 VanDerWaalsContact O-N 3.11Å
160	E	23.2	Very low	29.2	Very low	170 Å²	170	142.1 Å²	142.1	79%	0.794	75%	0.752	S	S	*	*			trans	-66.9	108.2	172.1	-76.1	-174.3	157	0	0	109.4	T158 I162	T158-E160 PolarHBondContact O-N 3.25Å; T158-E160 VanDerWaalsContact O-N 3.11Å; E160-I162 PolarHBondContact O-N 2.86Å
161	V	22.8	Very low	27.3	Very low	122 Å²	122	140.6 Å²	140.6	74%	0.739	76%	0.758	S	S	*	*			trans	-70.4	99.3	165.5	176.7	0	0	0	0	107.5	C159 T163	C159-V161 PolarHBondContact O-N 2.9Å; C159-V161 VanDerWaalsContact O-N 3.11Å; V161-T163 HydrophobicContact CG1-CG2 3.85Å; V161-T163 PolarHBondContact O-N 2.91Å
162	I	23.2	Very low	26	Very low	156 Å²	156	147.7 Å²	147.7	80%	0.8	78%	0.783	S	S	*	*			trans	-86.5	107	167.5	-60.5	178.9	0	0	0	107.7	E160	E160-I162 PolarHBondContact O-N 2.86Å
163	T	22.8	Very low	25.3	Very low	107 Å²	107	149.2 Å²	149.2	66%	0.656	79%	0.788	S	S	*	*			trans	-114.3	145.5	169.5	42.7	0	0	0	0	110.9	V161	V161-T163 HydrophobicContact CG1-CG2 3.85Å; V161-T163 PolarHBondContact O-N 2.91Å
164	S	24.3	Very low	24.8	Very low	110 Å²	110	146.4 Å²	146.4	77%	0.769	79%	0.794	S	S	*	*			trans	89.2	117.3	163.8	78.7	0	0	0	0	118.1
165	F	22.9	Very low	24.8	Very low	214 Å²	214	149 Å²	149	94%	0.939	80%	0.802	S	S	*	*				-150.5	143	123.4	-114.1	-83.6	0	0	0	110.9
166	S	24.7	Very low	25.3	Very low	91 Å²	91	144.9 Å²	144.9	64%	0.636	79%	0.791	S	S	*	*			trans	-108.4	145.9	-178.1	-164.3	0	0	0	0	107.9
167	L	26	Very low	25.5	Very low	138 Å²	138	142.1 Å²	142.1	72%	0.723	79%	0.793	S	S	*	*				174.3	151.6	74.3	-90.2	170.3	0	0	0	111.5
168	K	23.4	Very low	25.6	Very low	175 Å²	175	140.6 Å²	140.6	76%	0.761	79%	0.794	S	S	*	*			trans	76.1	112	137.7	-71.3	174.7	179.9	-172.3	0	124.1
169	D	24.3	Very low	25.7	Very low	154 Å²	154	140.9 Å²	140.9	82%	0.824	80%	0.796	S	S	*	*			trans	7.7	135.2	144.4	-54.2	-30.6	0	0	0	122.1
170	E	24.9	Very low	25.8	Very low	200 Å²	200	145.1 Å²	145.1	94%	0.935	80%	0.8	S	S	*	*				-161.7	152.4	118.6	-78.8	-134.6	160.1	0	0	112
171	N	25.5	Very low	25.9	Very low	158 Å²	158	145 Å²	145	85%	0.845	81%	0.805	S	S	*	*			trans	-90.1	144.9	-166.5	-68.2	-48.5	0	0	0	114.8
172	F	26.4	Very low	26.1	Very low	204 Å²	204	149.1 Å²	149.1	90%	0.895	81%	0.812	S	S	*	*			trans	-165.9	151.5	134.3	-136.4	-102.3	0	0	0	113.8
173	T	26.2	Very low	26.1	Very low	124 Å²	124	150.3 Å²	150.3	76%	0.761	82%	0.819	S	S	*	*			trans	-101.2	150.4	-164.8	50.1	0	0	0	0	114.4
174	G	25.6	Very low	26.3	Very low	84 Å²	84	150.2 Å²	150.2	87%	0.866	83%	0.83	S	S	*	*			trans	176.2	114.5	161.9	0	0	0	0	0	115.2
175	D	33	Very low	26.4	Very low	161 Å²	161	148.2 Å²	148.2	86%	0.861	83%	0.826	S	S	*	*			trans	-88.1	176.3	-169.5	-149.4	21.2	0	0	0	113.4
176	P	35.3	Very low	26.5	Very low	100 Å²	100	145.9 Å²	145.9	65%	0.649	82%	0.824	S	S	*	*			trans	-114.4	178.4	-141.3	16.7	14	0	0	0	110
177	N	30.8	Very low	26.5	Very low	166 Å²	166	147.2 Å²	147.2	89%	0.888	83%	0.833	S	S	*	*			trans	-125.5	105.5	165.6	-89.5	-40	0	0	0	110.8
178	G	26.9	Very low	26.5	Very low	75 Å²	75	149.4 Å²	149.4	77%	0.773	84%	0.837	S	S	*	*			trans	-73.3	135.7	164.8	0	0	0	0	0	111.1
179	V	25.4	Very low	26.5	Very low	130 Å²	130	147.1 Å²	147.1	79%	0.788	83%	0.832	S	S	*	*			trans	-100.8	112.4	167.5	179.1	0	0	0	0	107.8
180	K	24.7	Very low	26.5	Very low	208 Å²	208	145.5 Å²	145.5	90%	0.904	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-88.4	118	169.6	-80.9	-179.4	175.1	176.6	0	108.9
181	L	25.2	Very low	26.5	Very low	169 Å²	169	144.6 Å²	144.6	89%	0.885	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-91.5	135.8	167.9	-73.2	165.5	0	0	0	110
182	K	25.7	Very low	26.4	Very low	207 Å²	207	144 Å²	144	90%	0.9	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-100.3	128.7	-179.3	-132.5	178.5	-178.1	-176.7	0	108.3
183	L	24.6	Very low	26.3	Very low	181 Å²	181	141.5 Å²	141.5	95%	0.948	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-69	132.9	171.4	-79.5	150.1	0	0	0	109.7
184	A	27.2	Very low	26.4	Very low	106 Å²	106	144.3 Å²	144.3	88%	0.876	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-102.4	124.5	171.9	0	0	0	0	0	109.6
185	G	25.1	Very low	26.2	Very low	68 Å²	68	146.1 Å²	146.1	70%	0.701	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-103.1	135.7	162.2	0	0	0	0	0	109.8
186	D	24.6	Very low	25.9	Very low	165 Å²	165	143.5 Å²	143.5	88%	0.882	82%	0.815	S	S	*	*			trans	49.6	107.8	157.1	-59.3	-13.3	0	0	0	121
187	S	26.6	Very low	25.5	Very low	118 Å²	118	147.8 Å²	147.8	83%	0.825	83%	0.826	S	S	*	*				-175.6	118.3	115.8	67.6	0	0	0	0	113.9
188	F	24.3	Very low	25.3	Very low	184 Å²	184	148.5 Å²	148.5	81%	0.807	82%	0.821	S	S	*	*				35.5	126	129.8	-128.8	-126.6	0	0	0	123.1
189	L	24.4	Very low	25.3	Very low	127 Å²	127	153.5 Å²	153.5	67%	0.665	82%	0.824	S	S	*	*			trans	72.9	141.7	154.1	-53.7	177.6	0	0	0	118.3
190	T	23.8	Very low	25.6	Very low	121 Å²	121	156.4 Å²	156.4	74%	0.742	83%	0.829	S	S	*	*			cis	-164.8	158.2	8.8	8.6	0	0	0	0	109
191	E	24.6	Very low	25.9	Very low	180 Å²	180	154.5 Å²	154.5	84%	0.841	82%	0.823	S	S	*	*			trans	-33.4	146.1	174.8	-63.1	168.2	162	0	0	118
192	T	24.8	Very low	26.4	Very low	147 Å²	147	155.4 Å²	155.4	90%	0.902	82%	0.823	S	S	*	*				-153.5	135.5	121.3	24.4	0	0	0	0	110.6
193	N	23.9	Very low	27	Very low	150 Å²	150	154 Å²	154	80%	0.802	82%	0.82	S	S	*	*			trans	-61.9	137.8	173.6	-76.4	-34.4	0	0	0	112.2
194	E	27.6	Very low	27.9	Very low	184 Å²	184	154.6 Å²	154.6	86%	0.86	82%	0.818	S	S	*	*			trans	-148.2	101.4	139.7	-111.3	171.9	-166.3	0	0	108	V196	E194-V196 PolarHBondContact O-N 2.84Å; E194-V196 VanDerWaalsContact O-N 3.15Å
195	C	21.7	Very low	29.3	Very low	121 Å²	121	157.1 Å²	157.1	82%	0.818	81%	0.812	S	S	*	*			trans	-70.3	102	168.7	-64.9	0	0	0	0	107.7
196	V	27.5	Very low	31.2	Very low	107 Å²	107	160.8 Å²	160.8	65%	0.648	81%	0.81	S	S	*	*			trans	-87.7	108	159.9	-179.4	0	0	0	0	106	E194 K198	E194-V196 PolarHBondContact O-N 2.84Å; E194-V196 VanDerWaalsContact O-N 3.15Å; V196-K198 HydrophobicContact CG1-CG 3.95Å; V196-K198 PolarHBondContact O-N 3.21Å
197	E	26.1	Very low	33.7	Very low	190 Å²	190	159 Å²	159	89%	0.888	80%	0.797	S	S	*	*			trans	-59.3	91.9	160.1	-68.3	177.9	169.9	0	0	106.8
198	K	26.3	Very low	36.5	Very low	180 Å²	180	154.5 Å²	154.5	78%	0.783	76%	0.763	S	S	*	*			trans	-81.7	115.5	165.6	-80.8	-171.1	172.5	-174	0	106.5	V196 E200	V196-K198 HydrophobicContact CG1-CG 3.95Å; V196-K198 PolarHBondContact O-N 3.21Å; K198-E200 PolarHBondContact O-N 2.8Å
199	E	27.6	Very low	39.4	Very low	180 Å²	180	148.4 Å²	148.4	84%	0.841	74%	0.739	S	S	*	*			trans	-43.9	123.8	162.1	-66.7	174.6	153.6	0	0	108.2	E201	E199-E201 PolarHBondContact O-N 2.81Å
200	E	30.7	Very low	42.3	Very low	191 Å²	191	142.4 Å²	142.4	89%	0.893	71%	0.707	S	S	*	*			trans	-63.7	84.4	171.6	-69.3	175	161.6	0	0	107.4	K198 E202	K198-E200 PolarHBondContact O-N 2.8Å; E200-E202 PolarHBondContact O-N 2.83Å
201	E	32.1	Very low	44.9	Very low	168 Å²	168	138.3 Å²	138.3	79%	0.785	68%	0.682	S	S	*	*			trans	-61.9	112.4	155	-73.7	-176.3	161.1	0	0	105.3	E199 E203	E199-E201 PolarHBondContact O-N 2.81Å; E201-E203 PolarHBondContact O-N 2.9Å
202	E	35.4	Very low	47.6	Very low	189 Å²	189	129.9 Å²	129.9	88%	0.883	64%	0.643	S	S	*	*			trans	-55.4	90	164.4	-72	179.8	159	0	0	106.7	E200 E204	E200-E202 PolarHBondContact O-N 2.83Å; E202-E204 PolarHBondContact O-N 3.03Å
203	E	38.7	Very low	50.7	Low	178 Å²	178	123.1 Å²	123.1	83%	0.832	60%	0.601	S	S	*	*			trans	-58.2	103.8	168.8	-77.1	-173.4	165.3	0	0	105.8	E201 E205	E201-E203 PolarHBondContact O-N 2.9Å; E203-E205 PolarHBondContact O-N 2.9Å
204	E	42.3	Very low	54	Low	193 Å²	193	116.1 Å²	116.1	90%	0.902	56%	0.563	S	S	*	*			trans	-51	105	169	-79	-173.7	155.4	0	0	107	E202 E206	E202-E204 PolarHBondContact O-N 3.03Å; E204-E206 PolarHBondContact O-N 2.81Å
205	E	56.4	Low	57.3	Low	159 Å²	159	107.3 Å²	107.3	74%	0.743	52%	0.522	S	S	*	.			trans	-55	108.7	-176.9	-80	-172	154	0	0	108.7	E203 E207 L451	E203-E205 PolarHBondContact O-N 2.9Å; E205-E207 PolarHBondContact O-N 3.45Å; E205-L451 WeakPolarHBondContact OE1-CD1 3.5Å
206	E	65.7	Low	61	Low	144 Å²	144	101.6 Å²	101.6	67%	0.673	48%	0.484	S	S	*	.			trans	-51.3	110.1	-177.3	-165.2	-174.2	-141.3	0	0	109.3	E204 L208 K450	E204-E206 PolarHBondContact O-N 2.81Å; E206-L208 WeakPolarHBondContact O-CG 3.23Å; E206-L208 PolarHBondContact O-N 2.98Å; E206-K450 IonicContact OE2-NZ 3.51Å; E206-K450 PolarHBondContact OE2-NZ 3.29Å
207	E	77.8	Confident	64.3	Low	128 Å²	128	96.6 Å²	96.6	60%	0.598	45%	0.453	S	S	*	.			trans	-61.6	106.9	-172.9	-167.2	179.4	180	0	0	110.2	E205 R416	E205-E207 PolarHBondContact O-N 3.45Å; E207-R416 VanDerWaalsContact CD-NH2 3.29Å; E207-R416 IonicContact OE1-CZ 3.8Å; E207-R416 IonicContact OE1-NH1 2.79Å; E207-R416 PolarHBondContact OE1-NH1 2.78Å; E207-R416 IonicContact OE1-NH2 3.71Å; E207-R416 PolarHBondContact OE1-NH2 3.01Å
208	L	86	Confident	67.8	Low	23 Å²	23	87.7 Å²	87.7	12%	0.12	41%	0.412	C	S	.	.			trans	-77.2	130.1	-176.3	-59.1	178.3	0	0	0	110.5	E206 K450 R452 D456 P457	E206-L208 WeakPolarHBondContact O-CG 3.23Å; E206-L208 PolarHBondContact O-N 2.98Å; L208-K450 HydrophobicContact CD1-CB 3.84Å; L208-K450 HydrophobicContact CD1-CD 4.32Å; L208-K450 HydrophobicContact CD2-CD 3.84Å; L208-R452 HydrophobicContact CD1-CB 4.41Å; L208-R452 HydrophobicContact CD1-CG 3.53Å; L208-D456 WeakPolarHBondContact O-CB 3.33Å; L208-P457 WeakPolarHBondContact O-CD 3.35Å
209	I	84.4	Confident	71.2	Confident	57 Å²	57	79.1 Å²	79.1	29%	0.292	37%	0.374	S	S	.	.			trans	-111	166.1	177.7	65.4	170.5	0	0	0	110.7	P298 R452 I459	I209-P298 HydrophobicContact CG1-CG 4.33Å; I209-P298 WeakPolarHBondContact O-CG 3.45Å; I209-R452 PolarHBondContact O-NH1 3.18Å; I209-I459 HydrophobicContact CB-CD1 4.15Å; I209-I459 HydrophobicContact CB-CG1 4.34Å; I209-I459 HydrophobicContact CD1-CB 4.35Å; I209-I459 HydrophobicContact CD1-CD1 3.89Å; I209-I459 HydrophobicContact CD1-CG1 4.41Å; I209-I459 HydrophobicContact CG2-CD1 3.66Å; I209-I459 HydrophobicContact CG2-CG1 4.26Å
210	A	84.3	Confident	74.5	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-123.4	144.5	169	0	0	0	0	0	110.1	K213 P298 L300 P457 L458 I459	A210-K213 HydrophobicContact CB-CD 4.47Å; A210-K213 HydrophobicContact CB-CG 3.93Å; A210-P298 CarbonylContact C-O 3.16Å; A210-P298 VanDerWaalsContact CA-O 3.26Å; A210-P298 WeakPolarHBondContact CA-O 3.48Å; A210-L300 HydrophobicContact CB-CD1 3.73Å; A210-L300 HydrophobicContact CB-CD2 4.43Å; A210-L300 HydrophobicContact CB-CG 3.73Å; A210-P457 PolarHBondContact N-O 3.33Å; A210-L458 HydrophobicContact CB-CD1 4.39Å; A210-L458 CarbonylContact O-C 3.58Å; A210-L458 WeakPolarHBondContact O-CA 3.23Å; A210-I459 PolarHBondContact O-N 3.04Å
211	V	79.1	Confident	77.6	Confident	35 Å²	35	61.7 Å²	61.7	21%	0.212	29%	0.293	C	S	.	.	S	Bend	trans	-101.2	-19.3	170.5	-59.4	0	0	0	0	113.2	G297 P298 Y467	V211-G297 VanDerWaalsContact CG1-CA 3.48Å; V211-G297 WeakPolarHBondContact CG2-O 3.44Å; V211-P298 PolarHBondContact N-O 3.08Å; V211-Y467 WeakPolarHBondContact O-CD2 3.32Å
212	D	82	Confident	80.5	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.021	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	151.7	171	-151.1	-9.9	0	0	0	109.1	K249 S299 L300 Y467 H470	D212-K249 WeakPolarHBondContact OD1-CE 3.47Å; D212-K249 IonicContact OD1-NZ 2.71Å; D212-K249 PolarHBondContact OD1-NZ 2.86Å; D212-K249 IonicContact OD2-NZ 2.99Å; D212-K249 PolarHBondContact OD2-NZ 3.33Å; D212-S299 CarbonylContact O-C 3.55Å; D212-S299 WeakPolarHBondContact O-CA 3.29Å; D212-L300 PolarHBondContact O-N 3.28Å; D212-Y467 HydrophobicContact CB-CD2 4.26Å; D212-H470 IonicContact OD2-ND1 2.69Å
213	K	89.9	Confident	83.3	Confident	4 Å²	4	48 Å²	48	2%	0.017	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	116.3	179.8	-66.8	-175.4	-174.6	-172.1	0	107.6	A210 L246 F248 K249 L300 L454 D456 L458	A210-K213 HydrophobicContact CB-CD 4.47Å; A210-K213 HydrophobicContact CB-CG 3.93Å; K213-L246 WeakPolarHBondContact CD-O 3.42Å; K213-L246 PolarHBondContact NZ-O 2.91Å; K213-F248 HydrophobicContact CB-CB 4.28Å; K213-F248 HydrophobicContact CB-CD1 3.65Å; K213-F248 HydrophobicContact CB-CD2 3.98Å; K213-F248 HydrophobicContact CB-CE1 3.87Å; K213-F248 HydrophobicContact CB-CE2 4.2Å; K213-F248 HydrophobicContact CB-CG 3.7Å; K213-F248 HydrophobicContact CB-CZ 4.13Å; K213-F248 HydrophobicContact CD-CD2 3.8Å; K213-F248 HydrophobicContact CD-CE2 3.66Å; K213-F248 HydrophobicContact CD-CG 4.38Å; K213-F248 HydrophobicContact CD-CZ 4.11Å; K213-F248 HydrophobicContact CG-CD2 4.47Å; K213-F248 HydrophobicContact CG-CE1 4.48Å; K213-F248 HydrophobicContact CG-CE2 4.33Å; K213-F248 HydrophobicContact CG-CZ 4.32Å; K213-F248 CarbonylContact O-C 3.44Å; K213-F248 WeakPolarHBondContact O-CA 3.49Å; K213-K249 PolarHBondContact O-N 3.33Å; K213-L300 WeakPolarHBondContact CA-O 3.37Å; K213-L300 HydrophobicContact CD-CD1 4.34Å; K213-L300 HydrophobicContact CG-CB 4.23Å; K213-L300 HydrophobicContact CG-CD1 4.08Å; K213-L300 HydrophobicContact CG-CG 4.28Å; K213-L454 PolarHBondContact NZ-O 3.44Å; K213-D456 WeakPolarHBondContact CE-O 3.28Å; K213-D456 PolarHBondContact NZ-O 2.87Å; K213-L458 HydrophobicContact CG-CD1 4.1Å
214	V	93.4	Very high	85.8	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.018	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	135.5	-177.3	-169.1	0	0	0	0	108.9	K249 Y268 L271 L272 L300 A301 A302	V214-K249 WeakPolarHBondContact CA-O 3.5Å; V214-Y268 HydrophobicContact CB-CE2 4.31Å; V214-Y268 HydrophobicContact CG1-CD2 3.96Å; V214-Y268 HydrophobicContact CG1-CE2 3.81Å; V214-L271 HydrophobicContact CG1-CB 3.98Å; V214-L271 HydrophobicContact CG1-CD1 4.15Å; V214-L272 HydrophobicContact CB-CD2 3.99Å; V214-L272 HydrophobicContact CG2-CD2 4.37Å; V214-L300 PolarHBondContact N-O 3.41Å; V214-A301 WeakPolarHBondContact O-CA 3.44Å; V214-A302 PolarHBondContact O-N 2.81Å
215	A	96.8	Very high	88.3	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	135.3	178	0	0	0	0	0	111.7	L243 F248 K249 T250 V251 A302	A215-L243 HydrophobicContact CB-CD1 3.73Å; A215-F248 HydrophobicContact CB-CB 4.47Å; A215-F248 HydrophobicContact CB-CD1 3.81Å; A215-F248 HydrophobicContact CB-CG 4.47Å; A215-K249 PolarHBondContact N-O 3.45Å; A215-T250 HydrophobicContact CB-CG2 4.19Å; A215-T250 CarbonylContact O-C 3.57Å; A215-T250 WeakPolarHBondContact O-CA 3.05Å; A215-V251 PolarHBondContact O-N 2.85Å; A215-A302 CarbonylContact C-O 3.49Å; A215-A302 VanDerWaalsContact CA-O 3.22Å; A215-A302 WeakPolarHBondContact CA-O 3.14Å; A215-A302 HydrophobicContact CB-CB 4.05Å
216	L	97.7	Very high	89.9	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	125.1	167.6	173	62.7	0	0	0	108.7	I218 V251 L253 Y268 A302 L303 Y304	L216-I218 HydrophobicContact CD1-CG1 4.17Å; L216-I218 HydrophobicContact CD2-CD1 4.17Å; L216-I218 HydrophobicContact CG-CD1 4.31Å; L216-I218 HydrophobicContact CG-CG1 4.18Å; L216-V251 HydrophobicContact CD1-CB 4.29Å; L216-V251 HydrophobicContact CD1-CG1 4.3Å; L216-L253 HydrophobicContact CD1-CD1 4.07Å; L216-Y268 HydrophobicContact CB-CD1 4.02Å; L216-Y268 HydrophobicContact CB-CD2 3.61Å; L216-Y268 HydrophobicContact CB-CE1 4.28Å; L216-Y268 HydrophobicContact CB-CE2 3.92Å; L216-Y268 HydrophobicContact CB-CG 3.66Å; L216-Y268 HydrophobicContact CD2-CD1 3.92Å; L216-Y268 HydrophobicContact CD2-CG 3.87Å; L216-Y268 HydrophobicContact CG-CG 4.37Å; L216-A302 PolarHBondContact N-O 3.46Å; L216-L303 HydrophobicContact CB-CD1 3.96Å; L216-L303 HydrophobicContact CD2-CD1 3.68Å; L216-L303 HydrophobicContact CG-CD1 3.82Å; L216-L303 CarbonylContact O-C 3.48Å; L216-L303 WeakPolarHBondContact O-CA 3.41Å; L216-Y304 PolarHBondContact O-N 3Å
217	I	98.6	Very high	91	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	123.7	178.8	-61.9	164.6	0	0	0	108.4	A236 L239 A240 L243 V251 T252 L253 Y304	I217-A236 HydrophobicContact CG2-CB 3.48Å; I217-A236 VanDerWaalsContact CG2-CB 3.48Å; I217-L239 HydrophobicContact CD1-CB 4.44Å; I217-L239 HydrophobicContact CD1-CD2 4.3Å; I217-L239 HydrophobicContact CD1-CG 4.22Å; I217-L239 HydrophobicContact CG1-CD2 4.24Å; I217-A240 HydrophobicContact CD1-CB 3.64Å; I217-L243 HydrophobicContact CD1-CD1 4.31Å; I217-V251 PolarHBondContact N-O 2.93Å; I217-T252 HydrophobicContact CB-CG2 3.88Å; I217-T252 HydrophobicContact CD1-CG2 4.42Å; I217-T252 HydrophobicContact CG2-CG2 3.68Å; I217-T252 CarbonylContact O-C 3.58Å; I217-T252 WeakPolarHBondContact O-CA 3.46Å; I217-L253 PolarHBondContact O-N 2.74Å; I217-Y304 WeakPolarHBondContact CA-O 3.04Å; I217-Y304 HydrophobicContact CG2-CD1 3.78Å
218	I	98.4	Very high	91.7	Very high	4 Å²	4	30 Å²	30	2%	0.021	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	124.1	177.8	-60	172.7	0	0	0	108.7	L216 L253 L256 M261 Y304 F305 V306	L216-I218 HydrophobicContact CD1-CG1 4.17Å; L216-I218 HydrophobicContact CD2-CD1 4.17Å; L216-I218 HydrophobicContact CG-CD1 4.31Å; L216-I218 HydrophobicContact CG-CG1 4.18Å; I218-L253 WeakPolarHBondContact CA-O 3.27Å; I218-L256 HydrophobicContact CD1-CD1 4.25Å; I218-L256 HydrophobicContact CG1-CD1 4.13Å; I218-L256 HydrophobicContact CG2-CD1 4.03Å; I218-L256 HydrophobicContact CG2-CG 4.37Å; I218-M261 HydrophobicContact CD1-CE 4.44Å; I218-Y304 PolarHBondContact N-O 2.94Å; I218-F305 HydrophobicContact CB-CD2 3.85Å; I218-F305 HydrophobicContact CB-CE2 4.4Å; I218-F305 HydrophobicContact CG2-CD2 3.74Å; I218-F305 HydrophobicContact CG2-CE2 3.77Å; I218-F305 WeakPolarHBondContact O-CA 3.4Å; I218-V306 PolarHBondContact O-N 2.99Å
219	S	97.8	Very high	92	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	112.4	173.2	65.5	0	0	0	0	112	P232 L253 S254 D255 V306 F505	S219-P232 WeakPolarHBondContact CB-O 3.35Å; S219-L253 PolarHBondContact N-O 3.19Å; S219-L253 PolarHBondContact OG-O 3.45Å; S219-S254 CarbonylContact O-C 3.6Å; S219-S254 VanDerWaalsContact O-CA 3.24Å; S219-S254 WeakPolarHBondContact O-CA 3.48Å; S219-S254 PolarHBondContact O-OG 2.84Å; S219-S254 PolarHBondContact OG-OG 3.31Å; S219-D255 PolarHBondContact O-N 3.06Å; S219-V306 WeakPolarHBondContact CA-O 3.39Å; S219-F505 WeakPolarHBondContact OG-CE1 3.4Å
220	N	97.7	Very high	92.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.173	C	C	.	.			trans	-107.3	120.1	177.2	-75.4	-5.8	0	0	0	110.1	Y223 D255 L256 F305 V306 G307 I319 I321	N220-Y223 HydrophobicContact CB-CE1 4.27Å; N220-Y223 HydrophobicContact CB-CE2 4.21Å; N220-Y223 WeakPolarHBondContact CB-OH 3.49Å; N220-Y223 VanDerWaalsContact O-CE2 3.27Å; N220-Y223 WeakPolarHBondContact O-CE2 3.46Å; N220-Y223 PolarHBondContact O-OH 3.28Å; N220-D255 WeakPolarHBondContact OD1-CA 3.26Å; N220-L256 PolarHBondContact ND2-O 3.01Å; N220-L256 PolarHBondContact OD1-N 3.27Å; N220-F305 HydrophobicContact CB-CZ 4.41Å; N220-V306 PolarHBondContact N-O 2.92Å; N220-G307 WeakPolarHBondContact O-CA 3.48Å; N220-I319 PolarHBondContact ND2-O 3.22Å; N220-I319 VanDerWaalsContact ND2-O 3.09Å; N220-I321 HydrophobicContact CB-CG2 3.88Å
221	S	94.6	Very high	92.5	Very high	4 Å²	4	32.6 Å²	32.6	3%	0.028	18%	0.175	C	C	.	.			trans	-130.6	-37.7	-173.5	74.1	0	0	0	0	113.8	Y223 K228 L229 D255	S221-Y223 PolarHBondContact O-N 3.08Å; S221-K228 WeakPolarHBondContact O-CA 3.25Å; S221-L229 PolarHBondContact O-N 2.86Å; S221-D255 WeakPolarHBondContact CA-OD1 3.49Å; S221-D255 PolarHBondContact N-OD1 3.43Å; S221-D255 PolarHBondContact OG-OD1 3.01Å; S221-D255 PolarHBondContact OG-OD2 2.84Å
222	Q	93	Very high	93.2	Very high	65 Å²	65	31 Å²	31	30%	0.304	17%	0.166	S	C	.	.			trans	-97.4	55.6	-173.4	-61	-51.7	-54.8	0	0	112.4	D255	Q222-D255 PolarHBondContact N-OD1 3.39Å
223	Y	94.1	Very high	93.7	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.016	17%	0.174	C	C	.	.			trans	-57.3	139.6	177.3	-62.4	-93.2	0	0	0	112.3	N220 S221 L226 L229 G307 H308 I319 P320 I321	N220-Y223 HydrophobicContact CB-CE1 4.27Å; N220-Y223 HydrophobicContact CB-CE2 4.21Å; N220-Y223 WeakPolarHBondContact CB-OH 3.49Å; N220-Y223 VanDerWaalsContact O-CE2 3.27Å; N220-Y223 WeakPolarHBondContact O-CE2 3.46Å; N220-Y223 PolarHBondContact O-OH 3.28Å; S221-Y223 PolarHBondContact O-N 3.08Å; Y223-L226 HydrophobicContact CD1-CB 4.24Å; Y223-L226 HydrophobicContact CD1-CD1 3.88Å; Y223-L226 HydrophobicContact CD1-CG 4.5Å; Y223-L226 HydrophobicContact CE1-CD1 4.38Å; Y223-L226 HydrophobicContact CG-CB 3.99Å; Y223-L226 HydrophobicContact CG-CD1 4.47Å; Y223-L229 HydrophobicContact CE2-CD1 4.07Å; Y223-L229 HydrophobicContact CE2-CG 4.39Å; Y223-G307 WeakPolarHBondContact OH-CA 3.32Å; Y223-H308 AromaticContact CD2-CD2 3.51Å; Y223-H308 HydrophobicContact CE1-CB 4.15Å; Y223-H308 AromaticContact CE1-CD2 3.93Å; Y223-H308 HydrophobicContact CE2-CB 4.43Å; Y223-H308 AromaticContact CE2-CD2 3.32Å; Y223-H308 WeakPolarHBondContact CE2-CD2 3.47Å; Y223-H308 AromaticContact CG-CD2 3.94Å; Y223-H308 AromaticContact CZ-CD2 3.56Å; Y223-H308 PolarHBondContact OH-N 3.03Å; Y223-I319 HydrophobicContact CD1-CG2 4.47Å; Y223-I319 HydrophobicContact CE1-CB 4.34Å; Y223-I319 HydrophobicContact CE1-CG2 4.02Å; Y223-I319 PolarHBondContact OH-O 2.94Å; Y223-P320 WeakPolarHBondContact CD1-O 3.44Å; Y223-P320 WeakPolarHBondContact CE1-O 3.43Å; Y223-I321 WeakPolarHBondContact CA-O 3.45Å
224	L	92.7	Very high	93.8	Very high	113 Å²	113	38.2 Å²	38.2	59%	0.592	20%	0.197	S	C	*	.	S	Bend	trans	-73.7	-39.2	-179.7	-61.8	-176.7	0	0	0	112	I321 D322	L224-I321 WeakPolarHBondContact CG-O 3.35Å; L224-I321 PolarHBondContact N-O 3.22Å; L224-D322 HydrophobicContact CD1-CB 4.13Å
225	H	93.1	Very high	93.9	Very high	111 Å²	111	38.1 Å²	38.1	51%	0.514	20%	0.196	S	C	.	.	S	Bend	trans	-123.6	-2.3	-172.8	-54.6	-61.1	0	0	0	114.2	A323 E325	H225-A323 WeakPolarHBondContact CB-O 3.38Å; H225-A323 PolarHBondContact CD2-O 3.46Å; H225-E325 HydrophobicContact CB-CB 4.23Å
226	L	90.5	Very high	93.9	Very high	39 Å²	39	38.1 Å²	38.1	20%	0.204	20%	0.196	C	C	.	.	S	Bend	trans	-113.8	170	178.6	-57.9	173.3	0	0	0	111.3	Y223 K228 I319 A323	Y223-L226 HydrophobicContact CD1-CB 4.24Å; Y223-L226 HydrophobicContact CD1-CD1 3.88Å; Y223-L226 HydrophobicContact CD1-CG 4.5Å; Y223-L226 HydrophobicContact CE1-CD1 4.38Å; Y223-L226 HydrophobicContact CG-CB 3.99Å; Y223-L226 HydrophobicContact CG-CD1 4.47Å; L226-K228 PolarHBondContact O-N 2.8Å; L226-I319 HydrophobicContact CD1-CD1 4.49Å; L226-I319 HydrophobicContact CD1-CG2 3.67Å; L226-A323 HydrophobicContact CD1-CB 4.38Å
227	G	89.4	Confident	93.7	Very high	51 Å²	51	40 Å²	40	53%	0.526	21%	0.206	S	C	.	.			trans	-59.5	132.3	174.9	0	0	0	0	0	111.5	H308	G227-H308 PolarHBondContact O-NE2 2.74Å
228	K	92.8	Very high	93.5	Very high	110 Å²	110	41.2 Å²	41.2	48%	0.478	21%	0.214	S	C	.	.			trans	-74.1	146.2	177.2	-64.1	-177.1	170.8	-150.7	0	111.2	S221 L226	S221-K228 WeakPolarHBondContact O-CA 3.25Å; L226-K228 PolarHBondContact O-N 2.8Å
229	L	90.8	Very high	93.5	Very high	33 Å²	33	41.2 Å²	41.2	17%	0.173	21%	0.214	C	C	.	.			trans	-105.7	156.5	176.7	-58.3	174.9	0	0	0	110.6	S221 Y223 P232 E396	S221-L229 PolarHBondContact O-N 2.86Å; Y223-L229 HydrophobicContact CE2-CD1 4.07Å; Y223-L229 HydrophobicContact CE2-CG 4.39Å; L229-P232 HydrophobicContact CB-CG 3.56Å; L229-P232 HydrophobicContact CD1-CG 3.86Å; L229-P232 HydrophobicContact CG-CG 4.37Å; L229-E396 WeakPolarHBondContact CA-OE1 3.34Å
230	L	88.3	Confident	93.4	Very high	94 Å²	94	41.2 Å²	41.2	49%	0.492	21%	0.214	S	C	.	.	S	Bend	trans	-105	-40.5	-171.5	-61.6	172.7	0	0	0	113.4	E396 V398	L230-E396 VanDerWaalsContact N-CD 3.29Å; L230-E396 PolarHBondContact N-OE1 2.88Å; L230-E396 PolarHBondContact N-OE2 2.73Å; L230-V398 HydrophobicContact CD1-CG2 4.27Å
231	T	90.9	Very high	93.2	Very high	8 Å²	8	44.6 Å²	44.6	5%	0.049	23%	0.229	C	C	.	.	S	Bend	trans	-95.6	-20	-170.2	57.7	0	0	0	0	117.2	T233 Y234 D235 E396	T231-T233 VanDerWaalsContact C-N 3.3Å; T231-T233 PolarHBondContact O-N 3.07Å; T231-T233 VanDerWaalsContact O-N 3.11Å; T231-Y234 WeakPolarHBondContact O-CB 3.22Å; T231-Y234 PolarHBondContact O-N 3.21Å; T231-D235 PolarHBondContact O-N 3.03Å; T231-E396 WeakPolarHBondContact CB-OE2 3.33Å; T231-E396 HydrophobicContact CG2-CB 3.89Å; T231-E396 PolarHBondContact N-OE2 2.96Å; T231-E396 VanDerWaalsContact OG1-CB 3.26Å; T231-E396 WeakPolarHBondContact OG1-CB 3.43Å; T231-E396 PolarHBondContact OG1-OE2 3.04Å
232	P	95.1	Very high	93.3	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.013	23%	0.232	C	C	.	.	H	α-helix	trans	-51.2	-43.2	-173.5	-32.6	36.4	0	0	0	115.1	S219 L229 Y234 D235 A236 V306	S219-P232 WeakPolarHBondContact CB-O 3.35Å; L229-P232 HydrophobicContact CB-CG 3.56Å; L229-P232 HydrophobicContact CD1-CG 3.86Å; L229-P232 HydrophobicContact CG-CG 4.37Å; P232-Y234 VanDerWaalsContact C-N 3.34Å; P232-Y234 PolarHBondContact O-N 2.87Å; P232-D235 PolarHBondContact O-N 3.05Å; P232-A236 WeakPolarHBondContact O-CB 3.36Å; P232-A236 PolarHBondContact O-N 2.88Å; P232-V306 HydrophobicContact CB-CB 4.48Å; P232-V306 HydrophobicContact CB-CG1 3.92Å; P232-V306 HydrophobicContact CB-CG2 3.93Å; P232-V306 HydrophobicContact CG-CG2 4.11Å
233	T	91.6	Very high	93.4	Very high	31 Å²	31	42.4 Å²	42.4	19%	0.19	22%	0.219	C	C	.	.	H	α-helix	trans	-64	-39.3	179.7	-50.3	0	0	0	0	111.9	T231 N237 F505	T231-T233 VanDerWaalsContact C-N 3.3Å; T231-T233 PolarHBondContact O-N 3.07Å; T231-T233 VanDerWaalsContact O-N 3.11Å; T233-N237 WeakPolarHBondContact O-CB 3.37Å; T233-N237 PolarHBondContact O-N 2.95Å; T233-N237 VanDerWaalsContact O-N 3.12Å; T233-F505 HydrophobicContact CG2-CD2 4.46Å; T233-F505 HydrophobicContact CG2-CE2 3.52Å; T233-F505 HydrophobicContact CG2-CZ 3.56Å; T233-F505 WeakPolarHBondContact O-CE2 3.29Å; T233-F505 VanDerWaalsContact O-CZ 3.32Å; T233-F505 WeakPolarHBondContact O-CZ 3.3Å
234	Y	92.2	Very high	93.3	Very high	128 Å²	128	45.2 Å²	45.2	50%	0.502	23%	0.234	S	C	.	.	H	α-helix	trans	-69.8	-39.7	176.3	-69.4	-78.1	0	0	0	111.6	T231 P232 N237 V238 L401	T231-Y234 WeakPolarHBondContact O-CB 3.22Å; T231-Y234 PolarHBondContact O-N 3.21Å; P232-Y234 VanDerWaalsContact C-N 3.34Å; P232-Y234 PolarHBondContact O-N 2.87Å; Y234-N237 PolarHBondContact O-N 2.78Å; Y234-V238 WeakPolarHBondContact O-CG2 3.27Å; Y234-V238 PolarHBondContact O-N 3.12Å; Y234-L401 WeakPolarHBondContact CB-O 3.37Å
235	D	96	Very high	93.1	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-66	-46.1	179.9	-69.7	-16.1	0	0	0	111.9	T231 P232 N237 V238 L239 N402 G403 M406	T231-D235 PolarHBondContact O-N 3.03Å; P232-D235 PolarHBondContact O-N 3.05Å; D235-N237 VanDerWaalsContact C-N 3.34Å; D235-N237 PolarHBondContact O-N 2.92Å; D235-V238 PolarHBondContact O-N 3Å; D235-L239 PolarHBondContact O-N 3.32Å; D235-N402 WeakPolarHBondContact OD1-CA 3.45Å; D235-N402 WeakPolarHBondContact OD1-CB 3.4Å; D235-N402 PolarHBondContact OD1-ND2 3.49Å; D235-G403 PolarHBondContact OD1-N 3.12Å; D235-G403 WeakPolarHBondContact OD2-CA 3.4Å; D235-G403 PolarHBondContact OD2-N 3.18Å; D235-M406 HydrophobicContact CB-CB 3.93Å; D235-M406 HydrophobicContact CB-CE 4.44Å; D235-M406 HydrophobicContact CB-CG 3.89Å; D235-M406 VanDerWaalsContact CG-CB 3.47Å; D235-M406 WeakPolarHBondContact OD1-CB 3.4Å
236	A	96.5	Very high	93.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60	-42.9	174	0	0	0	0	0	112.1	I217 P232 V238 L239 A240 T252 V306 F505	I217-A236 HydrophobicContact CG2-CB 3.48Å; I217-A236 VanDerWaalsContact CG2-CB 3.48Å; P232-A236 WeakPolarHBondContact O-CB 3.36Å; P232-A236 PolarHBondContact O-N 2.88Å; A236-V238 PolarHBondContact O-N 3.13Å; A236-L239 PolarHBondContact O-N 3.11Å; A236-A240 VanDerWaalsContact O-CB 3.26Å; A236-A240 WeakPolarHBondContact O-CB 3.42Å; A236-A240 PolarHBondContact O-N 3.11Å; A236-T252 HydrophobicContact CB-CG2 4.01Å; A236-V306 HydrophobicContact CB-CG1 4.49Å; A236-F505 HydrophobicContact CB-CE1 4.1Å; A236-F505 HydrophobicContact CB-CZ 3.83Å
237	N	92.6	Very high	92.8	Very high	41 Å²	41	41 Å²	41	22%	0.219	22%	0.22	C	C	.	.	H	α-helix	trans	-64	-42.6	178.4	-165.1	72	0	0	0	112.2	T233 Y234 D235 A240 E241 G503 Y504 F505	T233-N237 WeakPolarHBondContact O-CB 3.37Å; T233-N237 PolarHBondContact O-N 2.95Å; T233-N237 VanDerWaalsContact O-N 3.12Å; Y234-N237 PolarHBondContact O-N 2.78Å; D235-N237 VanDerWaalsContact C-N 3.34Å; D235-N237 PolarHBondContact O-N 2.92Å; N237-A240 PolarHBondContact O-N 3.06Å; N237-E241 WeakPolarHBondContact O-CB 3.39Å; N237-E241 PolarHBondContact O-N 3.39Å; N237-G503 WeakPolarHBondContact OD1-CA 3.33Å; N237-Y504 WeakPolarHBondContact OD1-CD2 3.49Å; N237-Y504 PolarHBondContact OD1-N 3.49Å; N237-F505 HydrophobicContact CB-CE2 4.05Å
238	V	95.6	Very high	93	Very high	27 Å²	27	39 Å²	39	16%	0.164	20%	0.197	C	C	.	.	H	α-helix	trans	-64.7	-42.7	176.9	168	0	0	0	0	111.2	Y234 D235 A236 N242 M406 K410	Y234-V238 WeakPolarHBondContact O-CG2 3.27Å; Y234-V238 PolarHBondContact O-N 3.12Å; D235-V238 PolarHBondContact O-N 3Å; A236-V238 PolarHBondContact O-N 3.13Å; V238-N242 PolarHBondContact O-N 2.9Å; V238-N242 PolarHBondContact O-ND2 2.84Å; V238-M406 HydrophobicContact CG1-CG 4.37Å; V238-M406 HydrophobicContact CG1-SD 4.24Å; V238-K410 HydrophobicContact CG1-CB 3.74Å; V238-K410 HydrophobicContact CG1-CD 3.9Å; V238-K410 HydrophobicContact CG1-CG 4.49Å
239	L	97.8	Very high	92.8	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.016	18%	0.177	C	C	.	.	H	α-helix	trans	-65.5	-45.7	177.3	-176.8	63.7	0	0	0	111.4	I217 D235 A236 E241 N242 L243 Y304 M406 L413	I217-L239 HydrophobicContact CD1-CB 4.44Å; I217-L239 HydrophobicContact CD1-CD2 4.3Å; I217-L239 HydrophobicContact CD1-CG 4.22Å; I217-L239 HydrophobicContact CG1-CD2 4.24Å; D235-L239 PolarHBondContact O-N 3.32Å; A236-L239 PolarHBondContact O-N 3.11Å; L239-E241 VanDerWaalsContact C-N 3.35Å; L239-E241 PolarHBondContact O-N 2.85Å; L239-N242 PolarHBondContact O-N 2.93Å; L239-L243 HydrophobicContact CD1-CD1 4.17Å; L239-L243 HydrophobicContact CD1-CG 4.09Å; L239-L243 HydrophobicContact CD2-CD1 4.4Å; L239-L243 HydrophobicContact CG-CD1 3.95Å; L239-L243 HydrophobicContact CG-CG 4.23Å; L239-L243 WeakPolarHBondContact O-CG 3.42Å; L239-L243 PolarHBondContact O-N 2.97Å; L239-Y304 HydrophobicContact CB-CD1 4.48Å; L239-Y304 HydrophobicContact CD2-CD1 3.26Å; L239-Y304 HydrophobicContact CD2-CD2 3.89Å; L239-Y304 HydrophobicContact CD2-CE1 3.98Å; L239-Y304 HydrophobicContact CD2-CE2 4.49Å; L239-Y304 HydrophobicContact CD2-CG 3.2Å; L239-Y304 HydrophobicContact CG-CD1 4.48Å; L239-M406 HydrophobicContact CB-CE 3.84Å; L239-M406 HydrophobicContact CB-SD 4.45Å; L239-M406 HydrophobicContact CD1-CE 4.43Å; L239-M406 HydrophobicContact CD2-CE 4.39Å; L239-M406 HydrophobicContact CG-CE 4.44Å; L239-L413 HydrophobicContact CD1-CD1 3.51Å; L239-L413 HydrophobicContact CD1-CD2 3.98Å; L239-L413 HydrophobicContact CD1-CG 4.42Å
240	A	95.3	Very high	92.9	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-56.8	-49.2	178.4	0	0	0	0	0	111	I217 A236 N237 N242 L243 I244 T252 Y504	I217-A240 HydrophobicContact CD1-CB 3.64Å; A236-A240 VanDerWaalsContact O-CB 3.26Å; A236-A240 WeakPolarHBondContact O-CB 3.42Å; A236-A240 PolarHBondContact O-N 3.11Å; N237-A240 PolarHBondContact O-N 3.06Å; A240-N242 VanDerWaalsContact C-N 3.3Å; A240-N242 PolarHBondContact O-N 2.71Å; A240-L243 PolarHBondContact O-N 2.89Å; A240-I244 WeakPolarHBondContact O-CB 3.43Å; A240-I244 WeakPolarHBondContact O-CD1 3.29Å; A240-I244 WeakPolarHBondContact O-CG1 3.45Å; A240-I244 PolarHBondContact O-N 3.16Å; A240-T252 HydrophobicContact CB-CG2 4.21Å; A240-T252 WeakPolarHBondContact CB-OG1 3.38Å; A240-Y504 HydrophobicContact CB-CD2 4.37Å; A240-Y504 HydrophobicContact CB-CG 4.17Å
241	E	94.9	Very high	93.2	Very high	71 Å²	71	28.7 Å²	28.7	33%	0.332	15%	0.147	S	C	.	.	H	α-helix	trans	-52.7	-48.4	175.8	-174.9	169.9	-153.5	0	0	112	N237 L239 Q245 Y504	N237-E241 WeakPolarHBondContact O-CB 3.39Å; N237-E241 PolarHBondContact O-N 3.39Å; L239-E241 VanDerWaalsContact C-N 3.35Å; L239-E241 PolarHBondContact O-N 2.85Å; E241-Q245 WeakPolarHBondContact O-CG 3.21Å; E241-Q245 PolarHBondContact O-N 2.98Å; E241-Q245 VanDerWaalsContact O-N 3.15Å; E241-Y504 HydrophobicContact CB-CD2 3.99Å; E241-Y504 HydrophobicContact CB-CE2 3.43Å; E241-Y504 VanDerWaalsContact CB-CE2 3.43Å; E241-Y504 HydrophobicContact CG-CE2 3.78Å
242	N	95.9	Very high	93.4	Very high	17 Å²	17	28.3 Å²	28.3	9%	0.091	15%	0.145	C	C	.	.	H	α-helix	trans	-65.9	-42.6	-179.1	-83.8	-85.8	0	0	0	112.2	V238 L239 A240 Q245 L246 L413 Q414	V238-N242 PolarHBondContact O-N 2.9Å; V238-N242 PolarHBondContact O-ND2 2.84Å; L239-N242 PolarHBondContact O-N 2.93Å; A240-N242 VanDerWaalsContact C-N 3.3Å; A240-N242 PolarHBondContact O-N 2.71Å; N242-Q245 PolarHBondContact O-N 3.21Å; N242-L246 WeakPolarHBondContact O-CG 3.46Å; N242-L246 PolarHBondContact O-N 2.99Å; N242-L413 HydrophobicContact CB-CB 4.12Å; N242-L413 HydrophobicContact CB-CD1 3.69Å; N242-Q414 VanDerWaalsContact CA-NE2 3.26Å; N242-Q414 PolarHBondContact O-NE2 2.9Å; N242-Q414 PolarHBondContact OD1-NE2 2.81Å
243	L	96.4	Very high	93.4	Very high	6 Å²	6	28.7 Å²	28.7	3%	0.031	15%	0.147	C	C	.	.	H	α-helix	trans	-69.1	-38.8	179.7	-68.1	-177.2	0	0	0	111.9	A215 I217 L239 A240 Q245 L246 G247 F248 T250 L454	A215-L243 HydrophobicContact CB-CD1 3.73Å; I217-L243 HydrophobicContact CD1-CD1 4.31Å; L239-L243 HydrophobicContact CD1-CD1 4.17Å; L239-L243 HydrophobicContact CD1-CG 4.09Å; L239-L243 HydrophobicContact CD2-CD1 4.4Å; L239-L243 HydrophobicContact CG-CD1 3.95Å; L239-L243 HydrophobicContact CG-CG 4.23Å; L239-L243 WeakPolarHBondContact O-CG 3.42Å; L239-L243 PolarHBondContact O-N 2.97Å; A240-L243 PolarHBondContact O-N 2.89Å; L243-Q245 VanDerWaalsContact C-N 3.31Å; L243-Q245 PolarHBondContact O-N 2.91Å; L243-L246 CarbonylContact O-C 3.18Å; L243-L246 WeakPolarHBondContact O-CA 3.24Å; L243-L246 WeakPolarHBondContact O-CB 3.43Å; L243-L246 PolarHBondContact O-N 3.35Å; L243-G247 PolarHBondContact O-N 3.17Å; L243-F248 HydrophobicContact CB-CB 3.91Å; L243-F248 HydrophobicContact CB-CD2 4.12Å; L243-F248 HydrophobicContact CB-CG 4.07Å; L243-F248 HydrophobicContact CD2-CD2 4.01Å; L243-F248 HydrophobicContact CD2-CE2 4.02Å; L243-F248 HydrophobicContact CD2-CG 4.41Å; L243-F248 HydrophobicContact CD2-CZ 4.46Å; L243-F248 WeakPolarHBondContact O-CB 3.49Å; L243-F248 WeakPolarHBondContact O-CD2 3.42Å; L243-F248 PolarHBondContact O-N 2.86Å; L243-T250 HydrophobicContact CB-CG2 3.81Å; L243-L454 HydrophobicContact CD2-CD1 4.14Å
244	I	90.1	Very high	93.5	Very high	63 Å²	63	27.3 Å²	27.3	32%	0.323	14%	0.139	S	C	.	.	H	α-helix	trans	-59.1	-44	174.8	-70.6	164.3	0	0	0	110.5	A240 L246 G247 T250 Y504	A240-I244 WeakPolarHBondContact O-CB 3.43Å; A240-I244 WeakPolarHBondContact O-CD1 3.29Å; A240-I244 WeakPolarHBondContact O-CG1 3.45Å; A240-I244 PolarHBondContact O-N 3.16Å; I244-L246 PolarHBondContact O-N 2.85Å; I244-G247 PolarHBondContact O-N 3.42Å; I244-T250 WeakPolarHBondContact CD1-OG1 3.24Å; I244-T250 HydrophobicContact CG1-CG2 3.77Å; I244-T250 VanDerWaalsContact CG1-OG1 3.3Å; I244-T250 WeakPolarHBondContact CG1-OG1 3.18Å; I244-Y504 HydrophobicContact CD1-CD1 3.26Å; I244-Y504 HydrophobicContact CD1-CE1 3.67Å; I244-Y504 HydrophobicContact CD1-CG 3.88Å
245	Q	90.2	Very high	93.7	Very high	120 Å²	120	22.7 Å²	22.7	56%	0.561	12%	0.123	S	C	*	.	H	α-helix	trans	-60.6	-26	176.3	-71.6	174	15.2	0	0	113.1	E241 N242 L243 G247	E241-Q245 WeakPolarHBondContact O-CG 3.21Å; E241-Q245 PolarHBondContact O-N 2.98Å; E241-Q245 VanDerWaalsContact O-N 3.15Å; N242-Q245 PolarHBondContact O-N 3.21Å; L243-Q245 VanDerWaalsContact C-N 3.31Å; L243-Q245 PolarHBondContact O-N 2.91Å; Q245-G247 VanDerWaalsContact C-N 3.32Å
246	L	91.7	Very high	93.6	Very high	23 Å²	23	22.9 Å²	22.9	12%	0.12	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	4.6	175.1	-63.9	175.1	0	0	0	113.7	K213 N242 L243 I244 F248 L413 L454 A455	K213-L246 WeakPolarHBondContact CD-O 3.42Å; K213-L246 PolarHBondContact NZ-O 2.91Å; N242-L246 WeakPolarHBondContact O-CG 3.46Å; N242-L246 PolarHBondContact O-N 2.99Å; L243-L246 CarbonylContact O-C 3.18Å; L243-L246 WeakPolarHBondContact O-CA 3.24Å; L243-L246 WeakPolarHBondContact O-CB 3.43Å; L243-L246 PolarHBondContact O-N 3.35Å; I244-L246 PolarHBondContact O-N 2.85Å; L246-F248 HydrophobicContact CB-CD2 4.06Å; L246-F248 HydrophobicContact CB-CE2 4.32Å; L246-L413 WeakPolarHBondContact CD1-O 3.37Å; L246-L454 HydrophobicContact CD1-CB 3.91Å; L246-A455 HydrophobicContact CD2-CB 3.73Å
247	G	85.8	Confident	93.6	Very high	33 Å²	33	24.5 Å²	24.5	34%	0.34	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.1	18.8	179.1	0	0	0	0	0	114.7	L243 I244 Q245	L243-G247 PolarHBondContact O-N 3.17Å; I244-G247 PolarHBondContact O-N 3.42Å; Q245-G247 VanDerWaalsContact C-N 3.32Å
248	F	92.6	Very high	93.8	Very high	8 Å²	8	24 Å²	24	4%	0.035	13%	0.13	C	C	.	.			trans	-74.4	137.3	171.2	-77.8	-103.8	0	0	0	111.5	K213 A215 L243 L246 T250 L300 A302 L454	K213-F248 HydrophobicContact CB-CB 4.28Å; K213-F248 HydrophobicContact CB-CD1 3.65Å; K213-F248 HydrophobicContact CB-CD2 3.98Å; K213-F248 HydrophobicContact CB-CE1 3.87Å; K213-F248 HydrophobicContact CB-CE2 4.2Å; K213-F248 HydrophobicContact CB-CG 3.7Å; K213-F248 HydrophobicContact CB-CZ 4.13Å; K213-F248 HydrophobicContact CD-CD2 3.8Å; K213-F248 HydrophobicContact CD-CE2 3.66Å; K213-F248 HydrophobicContact CD-CG 4.38Å; K213-F248 HydrophobicContact CD-CZ 4.11Å; K213-F248 HydrophobicContact CG-CD2 4.47Å; K213-F248 HydrophobicContact CG-CE1 4.48Å; K213-F248 HydrophobicContact CG-CE2 4.33Å; K213-F248 HydrophobicContact CG-CZ 4.32Å; K213-F248 CarbonylContact O-C 3.44Å; K213-F248 WeakPolarHBondContact O-CA 3.49Å; A215-F248 HydrophobicContact CB-CB 4.47Å; A215-F248 HydrophobicContact CB-CD1 3.81Å; A215-F248 HydrophobicContact CB-CG 4.47Å; L243-F248 HydrophobicContact CB-CB 3.91Å; L243-F248 HydrophobicContact CB-CD2 4.12Å; L243-F248 HydrophobicContact CB-CG 4.07Å; L243-F248 HydrophobicContact CD2-CD2 4.01Å; L243-F248 HydrophobicContact CD2-CE2 4.02Å; L243-F248 HydrophobicContact CD2-CG 4.41Å; L243-F248 HydrophobicContact CD2-CZ 4.46Å; L243-F248 WeakPolarHBondContact O-CB 3.49Å; L243-F248 WeakPolarHBondContact O-CD2 3.42Å; L243-F248 PolarHBondContact O-N 2.86Å; L246-F248 HydrophobicContact CB-CD2 4.06Å; L246-F248 HydrophobicContact CB-CE2 4.32Å; F248-T250 HydrophobicContact CB-CG2 4.06Å; F248-T250 PolarHBondContact O-N 2.86Å; F248-L300 HydrophobicContact CE1-CB 4.45Å; F248-L300 HydrophobicContact CZ-CB 4.42Å; F248-A302 HydrophobicContact CE1-CB 4.14Å; F248-L454 HydrophobicContact CE2-CB 4.26Å; F248-L454 HydrophobicContact CE2-CD2 4.41Å; F248-L454 WeakPolarHBondContact CE2-O 3.34Å; F248-L454 HydrophobicContact CZ-CD2 3.89Å
249	K	87.8	Confident	93.9	Very high	15 Å²	15	30.5 Å²	30.5	7%	0.065	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	95.4	160.9	-62.2	172.1	-167.9	164	0	107.9	D212 K213 V214 A215 T471 W474	D212-K249 WeakPolarHBondContact OD1-CE 3.47Å; D212-K249 IonicContact OD1-NZ 2.71Å; D212-K249 PolarHBondContact OD1-NZ 2.86Å; D212-K249 IonicContact OD2-NZ 2.99Å; D212-K249 PolarHBondContact OD2-NZ 3.33Å; K213-K249 PolarHBondContact O-N 3.33Å; V214-K249 WeakPolarHBondContact CA-O 3.5Å; A215-K249 PolarHBondContact N-O 3.45Å; K249-T471 VanDerWaalsContact CE-OG1 3.29Å; K249-T471 WeakPolarHBondContact CE-OG1 3.35Å; K249-T471 PolarHBondContact NZ-OG1 2.81Å; K249-W474 HydrophobicContact CB-CD2 4.01Å; K249-W474 HydrophobicContact CB-CG 3.88Å; K249-W474 HydrophobicContact CG-CD2 4.23Å; K249-W474 HydrophobicContact CG-CG 4.34Å
250	T	94.2	Very high	93.7	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.018	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	139.1	-178.1	56.7	0	0	0	0	111.2	A215 L243 I244 F248 W474 H478	A215-T250 HydrophobicContact CB-CG2 4.19Å; A215-T250 CarbonylContact O-C 3.57Å; A215-T250 WeakPolarHBondContact O-CA 3.05Å; L243-T250 HydrophobicContact CB-CG2 3.81Å; I244-T250 WeakPolarHBondContact CD1-OG1 3.24Å; I244-T250 HydrophobicContact CG1-CG2 3.77Å; I244-T250 VanDerWaalsContact CG1-OG1 3.3Å; I244-T250 WeakPolarHBondContact CG1-OG1 3.18Å; F248-T250 HydrophobicContact CB-CG2 4.06Å; F248-T250 PolarHBondContact O-N 2.86Å; T250-W474 PolarHBondContact O-NE1 3.36Å; T250-H478 PolarHBondContact O-CE1 3.4Å; T250-H478 PolarHBondContact O-NE2 3.2Å
251	V	93.4	Very high	93.8	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.018	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	110.4	162.1	180	0	0	0	0	106.4	A215 L216 I217 L253 M264 L271 L477	A215-V251 PolarHBondContact O-N 2.85Å; L216-V251 HydrophobicContact CD1-CB 4.29Å; L216-V251 HydrophobicContact CD1-CG1 4.3Å; I217-V251 PolarHBondContact N-O 2.93Å; V251-L253 HydrophobicContact CG1-CD1 4.11Å; V251-L253 HydrophobicContact CG1-CD2 4.25Å; V251-L253 HydrophobicContact CG1-CG 4.03Å; V251-M264 HydrophobicContact CG1-CE 3.99Å; V251-L271 HydrophobicContact CG2-CD1 4.33Å; V251-L477 HydrophobicContact CG2-CD1 4.09Å
252	T	95.7	Very high	93.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	125	-175.8	-40.7	0	0	0	0	108.8	I217 A236 A240 Y504 F505 S506	I217-T252 HydrophobicContact CB-CG2 3.88Å; I217-T252 HydrophobicContact CD1-CG2 4.42Å; I217-T252 HydrophobicContact CG2-CG2 3.68Å; I217-T252 CarbonylContact O-C 3.58Å; I217-T252 WeakPolarHBondContact O-CA 3.46Å; A236-T252 HydrophobicContact CB-CG2 4.01Å; A240-T252 HydrophobicContact CB-CG2 4.21Å; A240-T252 WeakPolarHBondContact CB-OG1 3.38Å; T252-Y504 WeakPolarHBondContact CB-O 3.34Å; T252-Y504 PolarHBondContact OG1-O 2.84Å; T252-Y504 VanDerWaalsContact OG1-O 3.08Å; T252-F505 HydrophobicContact CG2-CD1 3.74Å; T252-F505 HydrophobicContact CG2-CE1 3.62Å; T252-F505 HydrophobicContact CG2-CG 4.32Å; T252-F505 HydrophobicContact CG2-CZ 4.13Å; T252-F505 CarbonylContact O-C 3.5Å; T252-F505 WeakPolarHBondContact O-CA 3.43Å; T252-S506 PolarHBondContact N-OG 3.17Å; T252-S506 PolarHBondContact O-N 2.8Å
253	L	95.6	Very high	93.7	Very high	9 Å²	9	36.1 Å²	36.1	5%	0.047	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	139.3	-171.7	-61.5	169.9	0	0	0	110.3	L216 I217 I218 S219 V251 L256 M264 N507	L216-L253 HydrophobicContact CD1-CD1 4.07Å; I217-L253 PolarHBondContact O-N 2.74Å; I218-L253 WeakPolarHBondContact CA-O 3.27Å; S219-L253 PolarHBondContact N-O 3.19Å; S219-L253 PolarHBondContact OG-O 3.45Å; V251-L253 HydrophobicContact CG1-CD1 4.11Å; V251-L253 HydrophobicContact CG1-CD2 4.25Å; V251-L253 HydrophobicContact CG1-CG 4.03Å; L253-L256 HydrophobicContact CB-CD1 3.78Å; L253-L256 HydrophobicContact CB-CD2 4.06Å; L253-L256 HydrophobicContact CB-CG 4.06Å; L253-L256 HydrophobicContact CD1-CD1 3.71Å; L253-L256 HydrophobicContact CG-CD1 4.4Å; L253-M264 HydrophobicContact CD1-CB 3.82Å; L253-M264 HydrophobicContact CD1-CE 4.08Å; L253-M264 HydrophobicContact CD1-CG 3.54Å; L253-M264 HydrophobicContact CD1-SD 4.24Å; L253-N507 WeakPolarHBondContact CA-OD1 3.32Å; L253-N507 HydrophobicContact CD2-CB 3.71Å
254	S	93.7	Very high	93.5	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.021	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	141.4	177	-167.8	0	0	0	0	111.6	S219 N507 M508	S219-S254 CarbonylContact O-C 3.6Å; S219-S254 VanDerWaalsContact O-CA 3.24Å; S219-S254 WeakPolarHBondContact O-CA 3.48Å; S219-S254 PolarHBondContact O-OG 2.84Å; S219-S254 PolarHBondContact OG-OG 3.31Å; S254-N507 PolarHBondContact N-OD1 3.38Å; S254-N507 PolarHBondContact O-ND2 3.04Å; S254-M508 WeakPolarHBondContact OG-CE 3.47Å
255	D	95	Very high	93.6	Very high	31 Å²	31	34.9 Å²	34.9	17%	0.166	19%	0.185	C	C	.	.	S	Bend	trans	55.2	62	168.8	-58	-52	0	0	0	114	S219 N220 S221 Q222 I321	S219-D255 PolarHBondContact O-N 3.06Å; N220-D255 WeakPolarHBondContact OD1-CA 3.26Å; S221-D255 WeakPolarHBondContact CA-OD1 3.49Å; S221-D255 PolarHBondContact N-OD1 3.43Å; S221-D255 PolarHBondContact OG-OD1 3.01Å; S221-D255 PolarHBondContact OG-OD2 2.84Å; Q222-D255 PolarHBondContact N-OD1 3.39Å; D255-I321 HydrophobicContact CB-CD1 4.25Å; D255-I321 HydrophobicContact CB-CG2 3.93Å; D255-I321 VanDerWaalsContact O-CD1 3.27Å; D255-I321 WeakPolarHBondContact O-CD1 3.36Å
256	L	95.4	Very high	93.7	Very high	5 Å²	5	33 Å²	33	3%	0.026	18%	0.181	C	C	.	.			trans	-92.6	137.2	-178.2	-59.1	-173.9	0	0	0	113	I218 N220 L253 E260 M261 I321	I218-L256 HydrophobicContact CD1-CD1 4.25Å; I218-L256 HydrophobicContact CG1-CD1 4.13Å; I218-L256 HydrophobicContact CG2-CD1 4.03Å; I218-L256 HydrophobicContact CG2-CG 4.37Å; N220-L256 PolarHBondContact ND2-O 3.01Å; N220-L256 PolarHBondContact OD1-N 3.27Å; L253-L256 HydrophobicContact CB-CD1 3.78Å; L253-L256 HydrophobicContact CB-CD2 4.06Å; L253-L256 HydrophobicContact CB-CG 4.06Å; L253-L256 HydrophobicContact CD1-CD1 3.71Å; L253-L256 HydrophobicContact CG-CD1 4.4Å; L256-E260 HydrophobicContact CB-CB 4.18Å; L256-E260 HydrophobicContact CD2-CB 4.16Å; L256-M261 HydrophobicContact CB-CG 3.57Å; L256-M261 HydrophobicContact CD1-CG 4.06Å; L256-M261 HydrophobicContact CG-CG 4.49Å; L256-I321 VanDerWaalsContact C-CG1 3.49Å; L256-I321 WeakPolarHBondContact O-CG1 3.29Å; L256-I321 PolarHBondContact O-N 3.27Å
257	T	96.2	Very high	93.4	Very high	33 Å²	33	35.7 Å²	35.7	20%	0.202	19%	0.193	C	C	.	.			trans	-69.4	167	165.1	61.9	0	0	0	0	111.3	E259 E260 M261 I321 D322	T257-E259 VanDerWaalsContact C-N 3.3Å; T257-E259 PolarHBondContact O-N 3.31Å; T257-E260 WeakPolarHBondContact CB-OE2 3.36Å; T257-E260 WeakPolarHBondContact CG2-OE2 3.5Å; T257-E260 PolarHBondContact N-OE2 3.17Å; T257-E260 PolarHBondContact O-N 3.33Å; T257-E260 WeakPolarHBondContact OG1-CB 3.42Å; T257-E260 WeakPolarHBondContact OG1-CG 3.35Å; T257-E260 PolarHBondContact OG1-N 3.48Å; T257-E260 PolarHBondContact OG1-OE2 3.17Å; T257-M261 VanDerWaalsContact O-CG 3.32Å; T257-M261 WeakPolarHBondContact O-CG 3.4Å; T257-M261 PolarHBondContact O-N 2.88Å; T257-I321 HydrophobicContact CG2-CD1 4.38Å; T257-I321 HydrophobicContact CG2-CG1 4.26Å; T257-D322 VanDerWaalsContact CA-OD1 3.23Å; T257-D322 WeakPolarHBondContact CA-OD1 3.21Å; T257-D322 HydrophobicContact CG2-CB 4.08Å
258	L	97	Very high	93.6	Very high	31 Å²	31	34.3 Å²	34.3	16%	0.162	18%	0.178	C	C	.	.	H	α-helix	trans	-59.3	-42.9	178.2	-173.3	60.3	0	0	0	112.5	M261 R262 P320 D322 N331	L258-M261 PolarHBondContact O-N 3Å; L258-R262 WeakPolarHBondContact O-CG 3.42Å; L258-R262 PolarHBondContact O-N 2.82Å; L258-P320 HydrophobicContact CB-CB 4.05Å; L258-P320 HydrophobicContact CB-CG 3.86Å; L258-P320 HydrophobicContact CD1-CG 4.23Å; L258-P320 VanDerWaalsContact N-CB 3.3Å; L258-D322 PolarHBondContact N-OD1 2.89Å; L258-N331 VanDerWaalsContact CD2-O 3.26Å; L258-N331 WeakPolarHBondContact CD2-O 3.43Å
259	E	96.2	Very high	93.4	Very high	164 Å²	164	34.2 Å²	34.2	77%	0.766	18%	0.178	S	C	*	.	H	α-helix	trans	-62.2	-46.2	179.7	-175	176.2	177.1	0	0	110.6	T257 R262 G263	T257-E259 VanDerWaalsContact C-N 3.3Å; T257-E259 PolarHBondContact O-N 3.31Å; E259-R262 PolarHBondContact O-N 3.43Å; E259-G263 PolarHBondContact O-N 2.89Å
260	E	95.3	Very high	93.2	Very high	93 Å²	93	34.9 Å²	34.9	44%	0.435	18%	0.184	S	C	.	.	H	α-helix	trans	-64.5	-41.7	177.3	-69.3	164.4	147.4	0	0	112	L256 T257 R262 G263 M264	L256-E260 HydrophobicContact CB-CB 4.18Å; L256-E260 HydrophobicContact CD2-CB 4.16Å; T257-E260 WeakPolarHBondContact CB-OE2 3.36Å; T257-E260 WeakPolarHBondContact CG2-OE2 3.5Å; T257-E260 PolarHBondContact N-OE2 3.17Å; T257-E260 PolarHBondContact O-N 3.33Å; T257-E260 WeakPolarHBondContact OG1-CB 3.42Å; T257-E260 WeakPolarHBondContact OG1-CG 3.35Å; T257-E260 PolarHBondContact OG1-N 3.48Å; T257-E260 PolarHBondContact OG1-OE2 3.17Å; E260-R262 VanDerWaalsContact C-N 3.34Å; E260-R262 PolarHBondContact O-N 3.26Å; E260-G263 PolarHBondContact O-N 2.86Å; E260-M264 WeakPolarHBondContact O-CB 3.46Å; E260-M264 WeakPolarHBondContact O-CG 3.26Å; E260-M264 PolarHBondContact O-N 3.11Å
261	M	96.8	Very high	92.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-58.4	-45.6	175.1	-73.7	-178.5	66.1	0	0	111.4	I218 L256 T257 L258 L265 F305 L318 P320 L334	I218-M261 HydrophobicContact CD1-CE 4.44Å; L256-M261 HydrophobicContact CB-CG 3.57Å; L256-M261 HydrophobicContact CD1-CG 4.06Å; L256-M261 HydrophobicContact CG-CG 4.49Å; T257-M261 VanDerWaalsContact O-CG 3.32Å; T257-M261 WeakPolarHBondContact O-CG 3.4Å; T257-M261 PolarHBondContact O-N 2.88Å; L258-M261 PolarHBondContact O-N 3Å; M261-L265 VanDerWaalsContact O-CB 3.31Å; M261-L265 WeakPolarHBondContact O-CB 3.19Å; M261-L265 PolarHBondContact O-N 3.38Å; M261-F305 HydrophobicContact CE-CD2 4Å; M261-F305 HydrophobicContact CE-CE2 3.54Å; M261-F305 HydrophobicContact CE-CZ 4.47Å; M261-F305 HydrophobicContact SD-CE2 4.29Å; M261-L318 HydrophobicContact CE-CB 3.91Å; M261-L318 HydrophobicContact CE-CD1 4.38Å; M261-P320 HydrophobicContact SD-CB 3.8Å; M261-L334 HydrophobicContact CB-CD2 4.39Å; M261-L334 HydrophobicContact CE-CB 4.01Å; M261-L334 HydrophobicContact CE-CD2 3.81Å
262	R	95.7	Very high	92	Very high	79 Å²	79	34.9 Å²	34.9	30%	0.298	19%	0.185	S	C	.	.	H	α-helix	trans	-68.1	-41.4	178.3	-73.7	-174.4	170.7	-76.9	-7.1	112.4	L258 E259 E260 L265 T266 L334 E338	L258-R262 WeakPolarHBondContact O-CG 3.42Å; L258-R262 PolarHBondContact O-N 2.82Å; E259-R262 PolarHBondContact O-N 3.43Å; E260-R262 VanDerWaalsContact C-N 3.34Å; E260-R262 PolarHBondContact O-N 3.26Å; R262-L265 PolarHBondContact O-N 2.8Å; R262-T266 PolarHBondContact O-N 2.72Å; R262-T266 VanDerWaalsContact O-N 3.15Å; R262-T266 PolarHBondContact O-OG1 2.9Å; R262-L334 HydrophobicContact CG-CD1 4.32Å; R262-E338 IonicContact CZ-OE1 2.65Å; R262-E338 IonicContact CZ-OE2 3.71Å; R262-E338 IonicContact NH1-OE1 2.76Å; R262-E338 PolarHBondContact NH1-OE1 2.91Å; R262-E338 IonicContact NH1-OE2 3.5Å; R262-E338 IonicContact NH2-OE1 2.79Å; R262-E338 IonicContact NH2-OE2 3.55Å; R262-E338 PolarHBondContact NH2-OE2 3.32Å
263	G	93.6	Very high	90.7	Very high	37 Å²	37	35.2 Å²	35.2	38%	0.381	19%	0.187	S	C	.	.	H	α-helix	trans	-60	-49	175.1	0	0	0	0	0	111.6	E259 E260 L265 T266 E267	E259-G263 PolarHBondContact O-N 2.89Å; E260-G263 PolarHBondContact O-N 2.86Å; G263-L265 PolarHBondContact O-N 3.21Å; G263-T266 WeakPolarHBondContact O-CB 3.46Å; G263-T266 PolarHBondContact O-N 3.3Å; G263-T266 VanDerWaalsContact O-N 3.14Å; G263-E267 PolarHBondContact O-N 3.38Å
264	M	91.9	Very high	88.8	Confident	39 Å²	39	38.6 Å²	38.6	19%	0.192	21%	0.205	C	C	.	.	H	α-helix	trans	-70.6	-30.6	-179.2	-71.2	-56.7	-37.2	0	0	113.6	V251 L253 E260 T266 E267 Y268	V251-M264 HydrophobicContact CG1-CE 3.99Å; L253-M264 HydrophobicContact CD1-CB 3.82Å; L253-M264 HydrophobicContact CD1-CE 4.08Å; L253-M264 HydrophobicContact CD1-CG 3.54Å; L253-M264 HydrophobicContact CD1-SD 4.24Å; E260-M264 WeakPolarHBondContact O-CB 3.46Å; E260-M264 WeakPolarHBondContact O-CG 3.26Å; E260-M264 PolarHBondContact O-N 3.11Å; M264-T266 VanDerWaalsContact C-N 3.29Å; M264-T266 PolarHBondContact O-N 3.34Å; M264-E267 HydrophobicContact CE-CB 4.01Å; M264-E267 PolarHBondContact O-N 3.15Å; M264-Y268 VanDerWaalsContact O-CB 3.28Å; M264-Y268 WeakPolarHBondContact O-CB 2.98Å; M264-Y268 PolarHBondContact O-N 3.4Å
265	L	92.6	Very high	86.3	Confident	4 Å²	4	40.6 Å²	40.6	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-40.2	170.2	177.8	63.3	0	0	0	111.6	M261 R262 G263 Y268 C269 L334 V339 M342	M261-L265 VanDerWaalsContact O-CB 3.31Å; M261-L265 WeakPolarHBondContact O-CB 3.19Å; M261-L265 PolarHBondContact O-N 3.38Å; R262-L265 PolarHBondContact O-N 2.8Å; G263-L265 PolarHBondContact O-N 3.21Å; L265-Y268 HydrophobicContact CD1-CD1 4.27Å; L265-Y268 PolarHBondContact O-N 3.35Å; L265-C269 WeakPolarHBondContact O-CB 3.44Å; L265-C269 PolarHBondContact O-N 3.29Å; L265-C269 PolarHBondContact O-SG 2.81Å; L265-L334 HydrophobicContact CD2-CD1 4.14Å; L265-L334 HydrophobicContact CD2-CD2 4.33Å; L265-V339 HydrophobicContact CD1-CB 4.32Å; L265-V339 HydrophobicContact CD1-CG1 3.66Å; L265-V339 HydrophobicContact CD1-CG2 4.11Å; L265-V339 HydrophobicContact CD2-CB 4.49Å; L265-V339 HydrophobicContact CD2-CG2 3.75Å; L265-M342 HydrophobicContact CD2-CE 4.14Å; L265-M342 HydrophobicContact CD2-SD 3.46Å; L265-M342 WeakPolarHBondContact CD2-SD 3.25Å; L265-M342 HydrophobicContact CG-CE 4.1Å; L265-M342 HydrophobicContact CG-SD 4Å
266	T	90.6	Very high	83.2	Confident	80 Å²	80	43.9 Å²	43.9	49%	0.491	25%	0.247	S	C	.	.	H	α-helix	trans	-64.5	-46.1	176.9	-56.5	0	0	0	0	110.6	R262 G263 M264 C269 S270	R262-T266 PolarHBondContact O-N 2.72Å; R262-T266 VanDerWaalsContact O-N 3.15Å; R262-T266 PolarHBondContact O-OG1 2.9Å; G263-T266 WeakPolarHBondContact O-CB 3.46Å; G263-T266 PolarHBondContact O-N 3.3Å; G263-T266 VanDerWaalsContact O-N 3.14Å; M264-T266 VanDerWaalsContact C-N 3.29Å; M264-T266 PolarHBondContact O-N 3.34Å; T266-C269 PolarHBondContact O-N 2.87Å; T266-S270 PolarHBondContact O-N 3.3Å
267	E	87.3	Confident	80.2	Confident	80 Å²	80	50 Å²	50	37%	0.374	27%	0.271	S	S	.	.	H	α-helix	trans	-61.7	-45.8	175.6	-74.1	-55.5	141	0	0	112.1	G263 M264 C269 S270 L271	G263-E267 PolarHBondContact O-N 3.38Å; M264-E267 HydrophobicContact CE-CB 4.01Å; M264-E267 PolarHBondContact O-N 3.15Å; E267-C269 PolarHBondContact O-N 3.45Å; E267-S270 WeakPolarHBondContact O-CA 3.42Å; E267-S270 VanDerWaalsContact O-CB 3.24Å; E267-S270 WeakPolarHBondContact O-CB 3.4Å; E267-S270 PolarHBondContact O-N 2.84Å; E267-S270 PolarHBondContact O-OG 2.77Å; E267-L271 PolarHBondContact O-N 3.08Å
268	Y	90	Very high	77	Confident	3 Å²	3	50.5 Å²	50.5	1%	0.012	28%	0.282	C	S	.	.	H	α-helix	trans	-58.3	-47	175.6	167.2	-116.2	0	0	0	112.1	V214 L216 M264 L265 S270 L271 L272 A301 A302 M343	V214-Y268 HydrophobicContact CB-CE2 4.31Å; V214-Y268 HydrophobicContact CG1-CD2 3.96Å; V214-Y268 HydrophobicContact CG1-CE2 3.81Å; L216-Y268 HydrophobicContact CB-CD1 4.02Å; L216-Y268 HydrophobicContact CB-CD2 3.61Å; L216-Y268 HydrophobicContact CB-CE1 4.28Å; L216-Y268 HydrophobicContact CB-CE2 3.92Å; L216-Y268 HydrophobicContact CB-CG 3.66Å; L216-Y268 HydrophobicContact CD2-CD1 3.92Å; L216-Y268 HydrophobicContact CD2-CG 3.87Å; L216-Y268 HydrophobicContact CG-CG 4.37Å; M264-Y268 VanDerWaalsContact O-CB 3.28Å; M264-Y268 WeakPolarHBondContact O-CB 2.98Å; M264-Y268 PolarHBondContact O-N 3.4Å; L265-Y268 HydrophobicContact CD1-CD1 4.27Å; L265-Y268 PolarHBondContact O-N 3.35Å; Y268-S270 PolarHBondContact O-N 2.94Å; Y268-L271 WeakPolarHBondContact O-CB 3.25Å; Y268-L271 PolarHBondContact O-N 2.86Å; Y268-L272 HydrophobicContact CE1-CD1 4.17Å; Y268-L272 HydrophobicContact CE2-CD2 4.15Å; Y268-L272 HydrophobicContact CE2-CG 4.48Å; Y268-L272 PolarHBondContact O-N 3.37Å; Y268-A301 WeakPolarHBondContact OH-CB 3.39Å; Y268-A302 PolarHBondContact OH-N 2.98Å; Y268-A302 VanDerWaalsContact OH-N 3.12Å; Y268-A302 PolarHBondContact OH-O 2.93Å; Y268-A302 VanDerWaalsContact OH-O 3.05Å; Y268-M343 HydrophobicContact CE1-CE 4.43Å; Y268-M343 HydrophobicContact CE1-CG 3.88Å; Y268-M343 HydrophobicContact CE1-SD 4.04Å
269	C	88	Confident	73.9	Confident	7 Å²	7	59.4 Å²	59.4	5%	0.047	32%	0.315	C	S	.	.	H	α-helix	trans	-64	-23.2	175.8	-67.6	0	0	0	0	112.4	L265 T266 E267 L272 K346	L265-C269 WeakPolarHBondContact O-CB 3.44Å; L265-C269 PolarHBondContact O-N 3.29Å; L265-C269 PolarHBondContact O-SG 2.81Å; T266-C269 PolarHBondContact O-N 2.87Å; E267-C269 PolarHBondContact O-N 3.45Å; C269-L272 PolarHBondContact O-N 3.5Å; C269-K346 WeakPolarHBondContact O-CD 3.42Å; C269-K346 WeakPolarHBondContact O-CE 3.33Å; C269-K346 PolarHBondContact O-NZ 2.92Å
270	S	82.8	Confident	70.8	Confident	28 Å²	28	62.2 Å²	62.2	20%	0.196	32%	0.32	C	S	.	.	H	α-helix	trans	-74.9	-25.5	173.8	95.8	0	0	0	0	113.3	T266 E267 Y268 L272 R473	T266-S270 PolarHBondContact O-N 3.3Å; E267-S270 WeakPolarHBondContact O-CA 3.42Å; E267-S270 VanDerWaalsContact O-CB 3.24Å; E267-S270 WeakPolarHBondContact O-CB 3.4Å; E267-S270 PolarHBondContact O-N 2.84Å; E267-S270 PolarHBondContact O-OG 2.77Å; Y268-S270 PolarHBondContact O-N 2.94Å; S270-L272 VanDerWaalsContact C-N 3.31Å; S270-R473 PolarHBondContact OG-NH1 2.95Å
271	L	81.1	Confident	67.7	Low	4 Å²	4	61.6 Å²	61.6	2%	0.021	33%	0.325	C	S	.	.	H	α-helix	trans	-78.9	-16.1	173.4	-62.1	175	0	0	0	112.6	V214 V251 E267 Y268 H470 R473 W474 L477	V214-L271 HydrophobicContact CG1-CB 3.98Å; V214-L271 HydrophobicContact CG1-CD1 4.15Å; V251-L271 HydrophobicContact CG2-CD1 4.33Å; E267-L271 PolarHBondContact O-N 3.08Å; Y268-L271 WeakPolarHBondContact O-CB 3.25Å; Y268-L271 PolarHBondContact O-N 2.86Å; L271-H470 PolarHBondContact O-CE1 3.15Å; L271-H470 PolarHBondContact O-ND1 3.05Å; L271-H470 VanDerWaalsContact O-ND1 3.1Å; L271-R473 HydrophobicContact CD2-CB 3.61Å; L271-W474 HydrophobicContact CD2-CB 4.44Å; L271-L477 HydrophobicContact CD1-CD1 4.26Å
272	L	81.6	Confident	64.6	Low	3 Å²	3	73 Å²	73	2%	0.016	37%	0.369	C	S	.	.	S	Bend	trans	-81.8	124.2	173.9	-58.8	-178.8	0	0	0	109.2	V214 Y268 C269 S270 N274 A301 M343 K346	V214-L272 HydrophobicContact CB-CD2 3.99Å; V214-L272 HydrophobicContact CG2-CD2 4.37Å; Y268-L272 HydrophobicContact CE1-CD1 4.17Å; Y268-L272 HydrophobicContact CE2-CD2 4.15Å; Y268-L272 HydrophobicContact CE2-CG 4.48Å; Y268-L272 PolarHBondContact O-N 3.37Å; C269-L272 PolarHBondContact O-N 3.5Å; S270-L272 VanDerWaalsContact C-N 3.31Å; L272-N274 PolarHBondContact O-N 3.11Å; L272-A301 HydrophobicContact CD1-CB 3.96Å; L272-A301 HydrophobicContact CD2-CB 3.56Å; L272-A301 HydrophobicContact CG-CB 4.43Å; L272-M343 HydrophobicContact CD1-CB 4.4Å; L272-M343 HydrophobicContact CD1-CG 4.23Å; L272-K346 HydrophobicContact CB-CB 3.68Å; L272-K346 HydrophobicContact CB-CD 4.48Å; L272-K346 HydrophobicContact CB-CG 3.79Å; L272-K346 HydrophobicContact CD1-CB 4.32Å; L272-K346 HydrophobicContact CD1-CG 4.28Å
273	S	67.5	Low	61.4	Low	7 Å²	7	73.2 Å²	73.2	5%	0.049	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-52.6	126	175.9	-53.1	0	0	0	0	110.8	G275 H470	S273-G275 PolarHBondContact O-N 3.34Å; S273-H470 VanDerWaalsContact CA-CE1 3.47Å; S273-H470 WeakPolarHBondContact CA-CE1 3.42Å; S273-H470 PolarHBondContact N-CE1 3.15Å; S273-H470 PolarHBondContact OG-CE1 3.18Å; S273-H470 VanDerWaalsContact OG-CE1 3.28Å
274	N	55.7	Low	58.4	Low	80 Å²	80	78.2 Å²	78.2	43%	0.428	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-65.4	116.3	158.4	-74	-20.2	0	0	0	106	L272 V276 I296 K346	L272-N274 PolarHBondContact O-N 3.11Å; N274-V276 WeakPolarHBondContact CB-O 3.35Å; N274-V276 PolarHBondContact O-N 3.19Å; N274-I296 WeakPolarHBondContact O-CD1 3.46Å; N274-K346 WeakPolarHBondContact OD1-CD 3.46Å; N274-K346 PolarHBondContact OD1-NZ 3.31Å
275	G	41.2	Very low	55.7	Low	45 Å²	45	81.4 Å²	81.4	46%	0.464	43%	0.426	S	S	.	.	S	Bend	trans	-57.6	4.3	170.3	0	0	0	0	0	114.8	S273 K346	S273-G275 PolarHBondContact O-N 3.34Å; G275-K346 PolarHBondContact N-O 3.05Å
276	V	31.4	Very low	52.9	Low	99 Å²	99	86.8 Å²	86.8	60%	0.6	46%	0.464	S	S	*	.	S	Bend	trans	-123.5	119.8	176.3	-174.9	0	0	0	0	107	N274 G278	N274-V276 WeakPolarHBondContact CB-O 3.35Å; N274-V276 PolarHBondContact O-N 3.19Å; V276-G278 PolarHBondContact O-N 2.86Å
277	Y	32.4	Very low	50.2	Low	135 Å²	135	91.2 Å²	91.2	53%	0.529	48%	0.484	S	S	.	.			trans	-57.1	92.6	161	-138.3	-70.5	0	0	0	107.6	Y279 C281	Y277-Y279 PolarHBondContact O-N 3.48Å; Y277-C281 HydrophobicContact CD1-CB 3.99Å; Y277-C281 HydrophobicContact CE1-CB 3.16Å; Y277-C281 WeakPolarHBondContact CE1-SG 3.39Å; Y277-C281 PolarHBondContact OH-SG 3.3Å
278	G	27.9	Very low	47.6	Very low	43 Å²	43	92.8 Å²	92.8	44%	0.443	50%	0.499	S	S	.	.			trans	-71.7	94.2	-178.7	0	0	0	0	0	109.9	V276 Y280	V276-G278 PolarHBondContact O-N 2.86Å; G278-Y280 VanDerWaalsContact C-N 3.26Å; G278-Y280 PolarHBondContact O-N 3.45Å
279	Y	32.7	Very low	44.9	Very low	218 Å²	218	95.6 Å²	95.6	86%	0.855	52%	0.516	S	S	*	.	S	Bend	trans	58.6	-0.4	151	-72.5	-86	0	0	0	120.8	Y277	Y277-Y279 PolarHBondContact O-N 3.48Å
280	Y	30.3	Very low	42.3	Very low	222 Å²	222	104.5 Å²	104.5	87%	0.871	56%	0.557	S	S	*	*	S	Bend	trans	-116.5	-5.2	180	-89	-82.8	0	0	0	117.8	G278	G278-Y280 VanDerWaalsContact C-N 3.26Å; G278-Y280 PolarHBondContact O-N 3.45Å
281	C	30.8	Very low	40	Very low	81 Å²	81	110.3 Å²	110.3	55%	0.547	59%	0.586	S	S	.	*			trans	-127.2	66.1	161.1	-52.7	0	0	0	0	112.1	Y277	Y277-C281 HydrophobicContact CD1-CB 3.99Å; Y277-C281 HydrophobicContact CE1-CB 3.16Å; Y277-C281 WeakPolarHBondContact CE1-SG 3.39Å; Y277-C281 PolarHBondContact OH-SG 3.3Å
282	R	31.3	Very low	37.8	Very low	240 Å²	240	114.1 Å²	114.1	91%	0.906	61%	0.605	S	S	*	*			trans	-117.5	54.3	161.7	-157.5	176	178.1	166.4	1.1	110.5
283	A	29.6	Very low	35.5	Very low	82 Å²	82	123.2 Å²	123.2	68%	0.678	65%	0.647	S	S	*	*	S	Bend	trans	-140.9	131.2	161.4	0	0	0	0	0	107.2
284	V	30.5	Very low	34	Very low	142 Å²	142	133.6 Å²	133.6	86%	0.861	69%	0.686	S	S	*	*	S	Bend	trans	100.4	4.5	177.7	-165.9	0	0	0	0	118.2
285	I	34.1	Very low	33.2	Very low	107 Å²	107	133 Å²	133	55%	0.549	69%	0.688	S	S	.	*			trans	-132	83.5	164.3	-26.7	179.6	0	0	0	112.6	V289 I292	I285-V289 HydrophobicContact CB-CG2 3.59Å; I285-V289 HydrophobicContact CG2-CG2 3.08Å; I285-I292 HydrophobicContact CD1-CD1 4.37Å
286	S	34.5	Very low	33.7	Very low	117 Å²	117	133.3 Å²	133.3	82%	0.818	68%	0.678	S	S	*	*			trans	-139.1	89.6	160.7	-155.2	0	0	0	0	108.7
287	L	34.4	Very low	34.7	Very low	172 Å²	172	129.5 Å²	129.5	90%	0.901	66%	0.66	S	S	*	*	S	Bend	trans	-170.1	1.8	147.5	-97.5	164	0	0	0	112
288	T	31.9	Very low	36.5	Very low	114 Å²	114	124.8 Å²	124.8	70%	0.699	65%	0.645	S	S	*	*	S	Bend	trans	-141	18.4	173.8	43.1	0	0	0	0	115.4	E290	T288-E290 PolarHBondContact O-N 2.93Å
289	V	33.5	Very low	39.2	Very low	61 Å²	61	123 Å²	123	37%	0.37	63%	0.626	S	S	.	*			trans	-108	73.6	-172.8	-168.8	0	0	0	0	113	I285 I292	I285-V289 HydrophobicContact CB-CG2 3.59Å; I285-V289 HydrophobicContact CG2-CG2 3.08Å; V289-I292 HydrophobicContact CG1-CB 3.76Å; V289-I292 HydrophobicContact CG1-CD1 4.5Å; V289-I292 HydrophobicContact CG1-CG1 4.13Å; V289-I292 HydrophobicContact CG2-CD1 3.94Å; V289-I292 HydrophobicContact CG2-CG1 4.37Å
290	E	32.5	Very low	42	Very low	194 Å²	194	112.7 Å²	112.7	91%	0.907	59%	0.586	S	S	*	*	S	Bend	trans	-109.7	11.2	152.8	-139.8	166.9	-167.8	0	0	110.4	T288	T288-E290 PolarHBondContact O-N 2.93Å
291	L	34.9	Very low	45	Very low	151 Å²	151	102.1 Å²	102.1	79%	0.791	55%	0.545	S	S	*	.	S	Bend	trans	-130.9	-1	-173.3	-79.6	164.3	0	0	0	115.9
292	I	35.7	Very low	48.1	Very low	84 Å²	84	98.7 Å²	98.7	43%	0.431	52%	0.522	S	S	.	.			trans	-105	-2.8	-176.6	-49.5	-179.4	0	0	0	113.1	I285 V289 R294 S295	I285-I292 HydrophobicContact CD1-CD1 4.37Å; V289-I292 HydrophobicContact CG1-CB 3.76Å; V289-I292 HydrophobicContact CG1-CD1 4.5Å; V289-I292 HydrophobicContact CG1-CG1 4.13Å; V289-I292 HydrophobicContact CG2-CD1 3.94Å; V289-I292 HydrophobicContact CG2-CG1 4.37Å; I292-R294 PolarHBondContact O-N 3.33Å; I292-S295 PolarHBondContact O-N 2.92Å
293	E	33.1	Very low	51.3	Low	193 Å²	193	87.5 Å²	87.5	90%	0.902	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	2	172.5	-72.4	-170.2	157	0	0	113.8
294	R	35.9	Very low	54.6	Low	225 Å²	225	83.7 Å²	83.7	85%	0.849	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	-2	178.5	-86	-179.4	167.2	-178.5	-4.7	115.5	I292 I296	I292-R294 PolarHBondContact O-N 3.33Å; R294-I296 VanDerWaalsContact C-N 3.33Å; R294-I296 PolarHBondContact O-N 3.45Å
295	S	38.9	Very low	57.9	Low	69 Å²	69	76.9 Å²	76.9	48%	0.483	41%	0.407	S	S	.	.			trans	-88.2	17.1	-167.5	-66.9	0	0	0	0	116	I292	I292-S295 PolarHBondContact O-N 2.92Å
296	I	50.6	Low	60.9	Low	50 Å²	50	72.1 Å²	72.1	26%	0.256	38%	0.383	S	S	.	.	S	Bend	trans	-101	92.2	155	-54	179	0	0	0	104.9	N274 R294	N274-I296 WeakPolarHBondContact O-CD1 3.46Å; R294-I296 VanDerWaalsContact C-N 3.33Å; R294-I296 PolarHBondContact O-N 3.45Å
297	G	54.1	Low	63.9	Low	20 Å²	20	66.9 Å²	66.9	21%	0.206	35%	0.347	C	S	.	.			trans	-63.9	174.7	-179.8	0	0	0	0	0	112.2	V211 S299	V211-G297 VanDerWaalsContact CG1-CA 3.48Å; V211-G297 WeakPolarHBondContact CG2-O 3.44Å; G297-S299 PolarHBondContact O-N 3.01Å; G297-S299 VanDerWaalsContact O-N 3.08Å
298	P	69.3	Low	66.8	Low	35 Å²	35	60.8 Å²	60.8	23%	0.227	31%	0.314	C	S	.	.			trans	-63.4	111	-172.4	24.9	-35.6	0	0	0	112.4	I209 A210 V211 A349 R452	I209-P298 HydrophobicContact CG1-CG 4.33Å; I209-P298 WeakPolarHBondContact O-CG 3.45Å; A210-P298 CarbonylContact C-O 3.16Å; A210-P298 VanDerWaalsContact CA-O 3.26Å; A210-P298 WeakPolarHBondContact CA-O 3.48Å; V211-P298 PolarHBondContact N-O 3.08Å; P298-A349 VanDerWaalsContact CA-CB 3.48Å; P298-A349 HydrophobicContact CB-CB 3.15Å; P298-R452 VanDerWaalsContact CB-NH2 3.3Å
299	S	84	Confident	69.8	Low	7 Å²	7	55.6 Å²	55.6	5%	0.049	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	140.8	170	60.3	0	0	0	0	111.1	D212 G297 P348 A349 M350	D212-S299 CarbonylContact O-C 3.55Å; D212-S299 WeakPolarHBondContact O-CA 3.29Å; G297-S299 PolarHBondContact O-N 3.01Å; G297-S299 VanDerWaalsContact O-N 3.08Å; S299-P348 CarbonylContact O-C 3.56Å; S299-P348 WeakPolarHBondContact O-CB 3.49Å; S299-A349 PolarHBondContact O-N 2.84Å; S299-M350 PolarHBondContact O-N 3.31Å
300	L	91.2	Very high	72.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	129.1	174.7	-48.5	-176.7	0	0	0	109.3	A210 D212 K213 V214 F248 M350 D456	A210-L300 HydrophobicContact CB-CD1 3.73Å; A210-L300 HydrophobicContact CB-CD2 4.43Å; A210-L300 HydrophobicContact CB-CG 3.73Å; D212-L300 PolarHBondContact O-N 3.28Å; K213-L300 WeakPolarHBondContact CA-O 3.37Å; K213-L300 HydrophobicContact CD-CD1 4.34Å; K213-L300 HydrophobicContact CG-CB 4.23Å; K213-L300 HydrophobicContact CG-CD1 4.08Å; K213-L300 HydrophobicContact CG-CG 4.28Å; V214-L300 PolarHBondContact N-O 3.41Å; F248-L300 HydrophobicContact CE1-CB 4.45Å; F248-L300 HydrophobicContact CZ-CB 4.42Å; L300-M350 HydrophobicContact CB-CB 4.46Å; L300-M350 HydrophobicContact CB-CE 4.05Å; L300-M350 HydrophobicContact CD1-CE 3.83Å; L300-M350 HydrophobicContact CD2-CB 3.51Å; L300-M350 HydrophobicContact CD2-CE 4.03Å; L300-M350 HydrophobicContact CG-CE 4.17Å; L300-D456 HydrophobicContact CD1-CB 4.18Å
301	A	94.2	Very high	75.6	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.008	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	126.1	-177.9	0	0	0	0	0	109.4	V214 Y268 L272 M343 P348 M350 S351 V352	V214-A301 WeakPolarHBondContact O-CA 3.44Å; Y268-A301 WeakPolarHBondContact OH-CB 3.39Å; L272-A301 HydrophobicContact CD1-CB 3.96Å; L272-A301 HydrophobicContact CD2-CB 3.56Å; L272-A301 HydrophobicContact CG-CB 4.43Å; A301-M343 HydrophobicContact CB-CE 3.73Å; A301-P348 HydrophobicContact CB-CB 3.95Å; A301-P348 HydrophobicContact CB-CG 4.11Å; A301-M350 PolarHBondContact N-O 3.15Å; A301-S351 WeakPolarHBondContact O-CA 3.11Å; A301-V352 PolarHBondContact O-N 3Å
302	A	97	Very high	78.2	Confident	8 Å²	8	37.7 Å²	37.7	7%	0.066	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	135.2	178.1	0	0	0	0	0	111.8	V214 A215 L216 F248 Y268 V352	V214-A302 PolarHBondContact O-N 2.81Å; A215-A302 CarbonylContact C-O 3.49Å; A215-A302 VanDerWaalsContact CA-O 3.22Å; A215-A302 WeakPolarHBondContact CA-O 3.14Å; A215-A302 HydrophobicContact CB-CB 4.05Å; L216-A302 PolarHBondContact N-O 3.46Å; F248-A302 HydrophobicContact CE1-CB 4.14Å; Y268-A302 PolarHBondContact OH-N 2.98Å; Y268-A302 VanDerWaalsContact OH-N 3.12Å; Y268-A302 PolarHBondContact OH-O 2.93Å; Y268-A302 VanDerWaalsContact OH-O 3.05Å; A302-V352 CarbonylContact C-O 3.59Å; A302-V352 VanDerWaalsContact CA-O 3.32Å; A302-V352 WeakPolarHBondContact CA-O 3.35Å; A302-V352 HydrophobicContact CB-CB 4.31Å
303	L	98.1	Very high	80.7	Confident	5 Å²	5	38.8 Å²	38.8	3%	0.026	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	134	166.2	-175.3	81.6	0	0	0	108.5	L216 V339 M343 V352 I353 L354	L216-L303 HydrophobicContact CB-CD1 3.96Å; L216-L303 HydrophobicContact CD2-CD1 3.68Å; L216-L303 HydrophobicContact CG-CD1 3.82Å; L216-L303 CarbonylContact O-C 3.48Å; L216-L303 WeakPolarHBondContact O-CA 3.41Å; L303-V339 HydrophobicContact CD1-CG1 4.46Å; L303-V339 HydrophobicContact CD2-CB 4.41Å; L303-V339 HydrophobicContact CD2-CG1 3.59Å; L303-M343 HydrophobicContact CB-SD 4.33Å; L303-V352 PolarHBondContact N-O 2.87Å; L303-I353 HydrophobicContact CB-CG1 4.16Å; L303-I353 HydrophobicContact CB-CG2 4.49Å; L303-I353 HydrophobicContact CD2-CG1 4.48Å; L303-I353 HydrophobicContact CD2-CG2 4Å; L303-I353 CarbonylContact O-C 3.55Å; L303-I353 WeakPolarHBondContact O-CA 3.47Å; L303-L354 PolarHBondContact O-N 3.27Å
304	Y	98.7	Very high	83.3	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.008	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	130.4	162.8	176.4	-119.5	0	0	0	109.6	L216 I217 I218 L239 V306 L354 D356 M406	L216-Y304 PolarHBondContact O-N 3Å; I217-Y304 WeakPolarHBondContact CA-O 3.04Å; I217-Y304 HydrophobicContact CG2-CD1 3.78Å; I218-Y304 PolarHBondContact N-O 2.94Å; L239-Y304 HydrophobicContact CB-CD1 4.48Å; L239-Y304 HydrophobicContact CD2-CD1 3.26Å; L239-Y304 HydrophobicContact CD2-CD2 3.89Å; L239-Y304 HydrophobicContact CD2-CE1 3.98Å; L239-Y304 HydrophobicContact CD2-CE2 4.49Å; L239-Y304 HydrophobicContact CD2-CG 3.2Å; L239-Y304 HydrophobicContact CG-CD1 4.48Å; Y304-V306 HydrophobicContact CD1-CG1 4.32Å; Y304-V306 HydrophobicContact CE1-CB 3.79Å; Y304-V306 HydrophobicContact CE1-CG1 3.55Å; Y304-V306 HydrophobicContact CE2-CB 4.46Å; Y304-L354 WeakPolarHBondContact CA-O 3.44Å; Y304-L354 HydrophobicContact CD2-CB 3.63Å; Y304-L354 WeakPolarHBondContact CD2-O 3.47Å; Y304-L354 HydrophobicContact CE2-CB 4.42Å; Y304-D356 HydrophobicContact CE2-CB 3.71Å; Y304-D356 PolarHBondContact OH-OD2 3.49Å; Y304-M406 HydrophobicContact CE1-CE 3.94Å; Y304-M406 HydrophobicContact CE2-CE 4.06Å; Y304-M406 WeakPolarHBondContact OH-CE 3.43Å
305	F	98.7	Very high	86	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	129.2	170.9	-178.5	-84.7	0	0	0	109.2	I218 N220 M261 H308 L318 L354 L355 D356 I357	I218-F305 HydrophobicContact CB-CD2 3.85Å; I218-F305 HydrophobicContact CB-CE2 4.4Å; I218-F305 HydrophobicContact CG2-CD2 3.74Å; I218-F305 HydrophobicContact CG2-CE2 3.77Å; I218-F305 WeakPolarHBondContact O-CA 3.4Å; N220-F305 HydrophobicContact CB-CZ 4.41Å; M261-F305 HydrophobicContact CE-CD2 4Å; M261-F305 HydrophobicContact CE-CE2 3.54Å; M261-F305 HydrophobicContact CE-CZ 4.47Å; M261-F305 HydrophobicContact SD-CE2 4.29Å; F305-H308 WeakPolarHBondContact CE1-O 3.3Å; F305-L318 HydrophobicContact CB-CD1 3.98Å; F305-L318 HydrophobicContact CB-CD2 4.17Å; F305-L318 HydrophobicContact CD1-CB 4.14Å; F305-L318 HydrophobicContact CD1-CD1 4.44Å; F305-L318 HydrophobicContact CD1-CD2 3.7Å; F305-L318 HydrophobicContact CD1-CG 4.29Å; F305-L318 HydrophobicContact CD2-CB 4Å; F305-L318 HydrophobicContact CD2-CD1 3.82Å; F305-L318 HydrophobicContact CD2-CG 4.32Å; F305-L318 HydrophobicContact CE1-CB 3.95Å; F305-L318 HydrophobicContact CE1-CD2 4.21Å; F305-L318 HydrophobicContact CE2-CB 3.83Å; F305-L318 HydrophobicContact CE2-CD1 4.47Å; F305-L318 HydrophobicContact CG-CB 4.16Å; F305-L318 HydrophobicContact CG-CD1 3.81Å; F305-L318 HydrophobicContact CG-CD2 3.88Å; F305-L318 HydrophobicContact CG-CG 4.15Å; F305-L318 HydrophobicContact CZ-CB 3.79Å; F305-L354 PolarHBondContact N-O 3.11Å; F305-L355 HydrophobicContact CB-CD2 4.24Å; F305-D356 PolarHBondContact O-N 2.94Å; F305-I357 HydrophobicContact CD1-CG2 3.41Å; F305-I357 VanDerWaalsContact CD1-CG2 3.41Å; F305-I357 HydrophobicContact CE1-CG2 3.55Å
306	V	98.1	Very high	88.7	Confident	6 Å²	6	17.9 Å²	17.9	4%	0.036	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	126.1	173.4	56	0	0	0	0	110.1	I218 S219 N220 P232 A236 Y304 D356	I218-V306 PolarHBondContact O-N 2.99Å; S219-V306 WeakPolarHBondContact CA-O 3.39Å; N220-V306 PolarHBondContact N-O 2.92Å; P232-V306 HydrophobicContact CB-CB 4.48Å; P232-V306 HydrophobicContact CB-CG1 3.92Å; P232-V306 HydrophobicContact CB-CG2 3.93Å; P232-V306 HydrophobicContact CG-CG2 4.11Å; A236-V306 HydrophobicContact CB-CG1 4.49Å; Y304-V306 HydrophobicContact CD1-CG1 4.32Å; Y304-V306 HydrophobicContact CE1-CB 3.79Å; Y304-V306 HydrophobicContact CE1-CG1 3.55Å; Y304-V306 HydrophobicContact CE2-CB 4.46Å; V306-D356 WeakPolarHBondContact CA-O 3.38Å; V306-D356 HydrophobicContact CB-CB 3.95Å; V306-D356 HydrophobicContact CG2-CB 3.93Å
307	G	97.2	Very high	90.8	Very high	7 Å²	7	15.7 Å²	15.7	7%	0.072	10%	0.104	C	C	.	.	S	Bend	trans	161.3	-159.9	-173.5	0	0	0	0	0	113.1	N220 Y223 D356	N220-G307 WeakPolarHBondContact O-CA 3.48Å; Y223-G307 WeakPolarHBondContact OH-CA 3.32Å; G307-D356 PolarHBondContact N-O 2.83Å
308	H	95.6	Very high	92.9	Very high	44 Å²	44	14.8 Å²	14.8	20%	0.204	10%	0.095	C	C	.	.			trans	-75.8	145.5	167.4	-71.4	-53.7	0	0	0	110.2	Y223 G227 F305 I319	Y223-H308 AromaticContact CD2-CD2 3.51Å; Y223-H308 HydrophobicContact CE1-CB 4.15Å; Y223-H308 AromaticContact CE1-CD2 3.93Å; Y223-H308 HydrophobicContact CE2-CB 4.43Å; Y223-H308 AromaticContact CE2-CD2 3.32Å; Y223-H308 WeakPolarHBondContact CE2-CD2 3.47Å; Y223-H308 AromaticContact CG-CD2 3.94Å; Y223-H308 AromaticContact CZ-CD2 3.56Å; Y223-H308 PolarHBondContact OH-N 3.03Å; G227-H308 PolarHBondContact O-NE2 2.74Å; F305-H308 WeakPolarHBondContact CE1-O 3.3Å; H308-I319 HydrophobicContact CB-CB 4.07Å; H308-I319 HydrophobicContact CB-CD1 3.93Å; H308-I319 HydrophobicContact CB-CG1 4.38Å; H308-I319 WeakPolarHBondContact O-CB 3.42Å; H308-I319 PolarHBondContact O-N 3.46Å; H308-I319 VanDerWaalsContact O-N 3.09Å
309	G	95.5	Very high	94.2	Very high	5 Å²	5	13.2 Å²	13.2	5%	0.052	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	170.4	177.1	0	0	0	0	0	109.7	Y317 C358	G309-Y317 WeakPolarHBondContact CA-O 3.32Å; G309-C358 CarbonylContact C-O 3.55Å
310	F	94.3	Very high	94.8	Very high	1 Å²	1	13 Å²	13	0%	0.004	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	165.9	174.9	67.3	-84.4	0	0	0	110.4	A312 Y317 I319 I327 F330 C333 C358 R360 F364	F310-A312 HydrophobicContact CD2-CB 4.23Å; F310-A312 HydrophobicContact CE2-CB 4.05Å; F310-Y317 HydrophobicContact CD2-CD2 4.18Å; F310-Y317 VanDerWaalsContact CE1-CB 3.44Å; F310-Y317 HydrophobicContact CE1-CG 4.15Å; F310-Y317 AromaticContact CE2-CD2 3.66Å; F310-Y317 HydrophobicContact CE2-CD2 3.66Å; F310-Y317 HydrophobicContact CE2-CE2 4.4Å; F310-Y317 AromaticContact CE2-CG 3.93Å; F310-Y317 HydrophobicContact CE2-CG 3.93Å; F310-Y317 HydrophobicContact CZ-CD1 4.38Å; F310-Y317 AromaticContact CZ-CD2 3.93Å; F310-Y317 HydrophobicContact CZ-CD2 3.93Å; F310-Y317 AromaticContact CZ-CG 3.69Å; F310-Y317 HydrophobicContact CZ-CG 3.69Å; F310-Y317 PolarHBondContact N-O 2.97Å; F310-Y317 VanDerWaalsContact N-O 3.08Å; F310-Y317 PolarHBondContact O-N 3.28Å; F310-I319 HydrophobicContact CD1-CD1 3.94Å; F310-I319 HydrophobicContact CD1-CG1 4.08Å; F310-I319 HydrophobicContact CE1-CD1 4.43Å; F310-I319 HydrophobicContact CE1-CG1 4.31Å; F310-I327 HydrophobicContact CE1-CD1 4.15Å; F310-F330 HydrophobicContact CE2-CD1 4.26Å; F310-F330 AromaticContact CE2-CE1 3.96Å; F310-F330 HydrophobicContact CE2-CE1 3.96Å; F310-F330 HydrophobicContact CZ-CD1 4.25Å; F310-F330 HydrophobicContact CZ-CE1 4.38Å; F310-C333 HydrophobicContact CE1-CB 4.44Å; F310-C358 PolarHBondContact N-O 3.34Å; F310-R360 VanDerWaalsContact CB-O 3.23Å; F310-R360 WeakPolarHBondContact CB-O 3.42Å; F310-F364 HydrophobicContact CB-CD2 3.62Å; F310-F364 HydrophobicContact CB-CE2 3.29Å; F310-F364 HydrophobicContact CB-CZ 4.01Å; F310-F364 HydrophobicContact CD1-CD1 4.38Å; F310-F364 HydrophobicContact CD1-CD2 4.12Å; F310-F364 HydrophobicContact CD1-CE1 4.23Å; F310-F364 AromaticContact CD1-CE2 3.97Å; F310-F364 HydrophobicContact CD1-CE2 3.97Å; F310-F364 HydrophobicContact CD1-CG 4.32Å; F310-F364 AromaticContact CD1-CZ 4Å; F310-F364 HydrophobicContact CD1-CZ 4Å; F310-F364 AromaticContact CD2-CD2 3.92Å; F310-F364 HydrophobicContact CD2-CD2 3.92Å; F310-F364 HydrophobicContact CD2-CE2 4.4Å; F310-F364 HydrophobicContact CD2-CG 4.27Å; F310-F364 HydrophobicContact CE1-CD1 4.48Å; F310-F364 AromaticContact CG-CD2 3.64Å; F310-F364 HydrophobicContact CG-CD2 3.64Å; F310-F364 AromaticContact CG-CE2 3.67Å; F310-F364 HydrophobicContact CG-CE2 3.67Å; F310-F364 HydrophobicContact CG-CG 4.16Å; F310-F364 HydrophobicContact CG-CZ 4.19Å
311	E	92.5	Very high	95.1	Very high	14 Å²	14	14 Å²	14	7%	0.065	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	134.6	172.9	-170	171.1	142.7	0	0	110.1	G314 Q315 R359 S361 F390	E311-G314 WeakPolarHBondContact OE1-CA 3.15Å; E311-Q315 WeakPolarHBondContact CA-O 3.28Å; E311-Q315 WeakPolarHBondContact CG-O 3.47Å; E311-R359 HydrophobicContact CB-CB 4.14Å; E311-R359 IonicContact OE1-NH2 3.83Å; E311-R359 IonicContact OE2-CZ 2.79Å; E311-R359 IonicContact OE2-NE 3.69Å; E311-R359 PolarHBondContact OE2-NE 3.2Å; E311-R359 IonicContact OE2-NH2 3.88Å; E311-R359 PolarHBondContact OE2-NH2 2.72Å; E311-S361 WeakPolarHBondContact O-CB 3.49Å; E311-F390 VanDerWaalsContact CD-CD2 3.45Å; E311-F390 HydrophobicContact CG-CD2 4.41Å; E311-F390 HydrophobicContact CG-CE2 4.14Å; E311-F390 WeakPolarHBondContact OE1-CD2 3.34Å; E311-F390 WeakPolarHBondContact OE1-CE2 3.37Å
312	A	90.5	Very high	95.2	Very high	16 Å²	16	17 Å²	17	13%	0.132	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	130.2	175	0	0	0	0	0	110	F310 G314 Q315 Y317 F330	F310-A312 HydrophobicContact CD2-CB 4.23Å; F310-A312 HydrophobicContact CE2-CB 4.05Å; A312-G314 PolarHBondContact O-N 3.28Å; A312-Q315 PolarHBondContact N-O 3.31Å; A312-Q315 PolarHBondContact O-N 2.92Å; A312-Y317 HydrophobicContact CB-CD2 4.4Å; A312-Y317 HydrophobicContact CB-CE2 4.07Å; A312-F330 HydrophobicContact CB-CE1 3.61Å; A312-F330 HydrophobicContact CB-CZ 3.96Å
313	N	87	Confident	95	Very high	106 Å²	106	16.9 Å²	16.9	57%	0.567	10%	0.103	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.6	37.8	180	-55.4	-42.3	0	0	0	113.6	Q315 F371	N313-Q315 VanDerWaalsContact C-N 3.29Å; N313-Q315 PolarHBondContact O-N 3.2Å; N313-F371 HydrophobicContact CB-CD2 4.18Å; N313-F371 HydrophobicContact CB-CE1 4Å; N313-F371 HydrophobicContact CB-CE2 3.51Å; N313-F371 HydrophobicContact CB-CZ 3.4Å; N313-F371 WeakPolarHBondContact ND2-CD2 3.46Å
314	G	87.8	Confident	94.7	Very high	40 Å²	40	18.5 Å²	18.5	41%	0.412	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.1	12.4	179.2	0	0	0	0	0	115.2	E311 A312	E311-G314 WeakPolarHBondContact OE1-CA 3.15Å; A312-G314 PolarHBondContact O-N 3.28Å
315	Q	92.5	Very high	94.1	Very high	8 Å²	8	25.8 Å²	25.8	4%	0.037	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	137.1	173.6	-66.3	-169	123.4	0	0	110.6	E311 A312 N313 Y317 E337 F371 V372	E311-Q315 WeakPolarHBondContact CA-O 3.28Å; E311-Q315 WeakPolarHBondContact CG-O 3.47Å; A312-Q315 PolarHBondContact N-O 3.31Å; A312-Q315 PolarHBondContact O-N 2.92Å; N313-Q315 VanDerWaalsContact C-N 3.29Å; N313-Q315 PolarHBondContact O-N 3.2Å; Q315-Y317 HydrophobicContact CB-CE2 4.06Å; Q315-Y317 WeakPolarHBondContact O-CD2 3.34Å; Q315-E337 VanDerWaalsContact CA-OE2 3.22Å; Q315-E337 WeakPolarHBondContact CA-OE2 3.3Å; Q315-E337 HydrophobicContact CB-CG 4.45Å; Q315-E337 VanDerWaalsContact CB-OE2 3.24Å; Q315-E337 WeakPolarHBondContact CB-OE2 3.37Å; Q315-E337 HydrophobicContact CG-CB 4.37Å; Q315-E337 HydrophobicContact CG-CG 3.96Å; Q315-F371 HydrophobicContact CB-CE2 4.42Å; Q315-F371 HydrophobicContact CG-CE2 4.4Å; Q315-F371 HydrophobicContact CG-CZ 4.19Å; Q315-V372 PolarHBondContact NE2-O 2.94Å
316	S	95.2	Very high	93.6	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	139.3	179.7	-67.1	0	0	0	0	110.9	C335 A336 E337	S316-C335 CarbonylContact O-C 3.47Å; S316-C335 WeakPolarHBondContact O-CA 3.48Å; S316-A336 PolarHBondContact O-N 2.91Å; S316-E337 PolarHBondContact N-OE2 2.91Å
317	Y	95.9	Very high	93.1	Very high	5 Å²	5	33 Å²	33	2%	0.02	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	129	-179.8	-68.4	-90.9	0	0	0	110.3	G309 F310 A312 Q315 F330 C333 L334 C335 F371	G309-Y317 WeakPolarHBondContact CA-O 3.32Å; F310-Y317 HydrophobicContact CD2-CD2 4.18Å; F310-Y317 VanDerWaalsContact CE1-CB 3.44Å; F310-Y317 HydrophobicContact CE1-CG 4.15Å; F310-Y317 AromaticContact CE2-CD2 3.66Å; F310-Y317 HydrophobicContact CE2-CD2 3.66Å; F310-Y317 HydrophobicContact CE2-CE2 4.4Å; F310-Y317 AromaticContact CE2-CG 3.93Å; F310-Y317 HydrophobicContact CE2-CG 3.93Å; F310-Y317 HydrophobicContact CZ-CD1 4.38Å; F310-Y317 AromaticContact CZ-CD2 3.93Å; F310-Y317 HydrophobicContact CZ-CD2 3.93Å; F310-Y317 AromaticContact CZ-CG 3.69Å; F310-Y317 HydrophobicContact CZ-CG 3.69Å; F310-Y317 PolarHBondContact N-O 2.97Å; F310-Y317 VanDerWaalsContact N-O 3.08Å; F310-Y317 PolarHBondContact O-N 3.28Å; A312-Y317 HydrophobicContact CB-CD2 4.4Å; A312-Y317 HydrophobicContact CB-CE2 4.07Å; Q315-Y317 HydrophobicContact CB-CE2 4.06Å; Q315-Y317 WeakPolarHBondContact O-CD2 3.34Å; Y317-F330 HydrophobicContact CD1-CD1 4.12Å; Y317-F330 HydrophobicContact CD2-CD1 4.21Å; Y317-F330 HydrophobicContact CD2-CE1 4.36Å; Y317-F330 HydrophobicContact CE1-CB 3.89Å; Y317-F330 AromaticContact CE1-CD1 3.55Å; Y317-F330 HydrophobicContact CE1-CD1 3.55Å; Y317-F330 HydrophobicContact CE1-CE1 4.47Å; Y317-F330 HydrophobicContact CE1-CG 4.05Å; Y317-F330 AromaticContact CE2-CD1 3.66Å; Y317-F330 HydrophobicContact CE2-CD1 3.66Å; Y317-F330 AromaticContact CE2-CE1 3.76Å; Y317-F330 HydrophobicContact CE2-CE1 3.76Å; Y317-F330 HydrophobicContact CG-CD1 4.42Å; Y317-F330 AromaticContact CZ-CD1 3.29Å; Y317-F330 AromaticContact CZ-CE1 3.81Å; Y317-F330 AromaticContact CZ-CG 3.93Å; Y317-F330 WeakPolarHBondContact OH-CD1 3.14Å; Y317-C333 HydrophobicContact CD1-CB 4.16Å; Y317-L334 CarbonylContact C-O 3.6Å; Y317-L334 WeakPolarHBondContact CA-O 3.05Å; Y317-C335 HydrophobicContact CD1-CB 4.09Å; Y317-C335 HydrophobicContact CE1-CB 3.84Å; Y317-F371 WeakPolarHBondContact OH-CD2 3.39Å; Y317-F371 WeakPolarHBondContact OH-CE2 3.26Å
318	L	97.3	Very high	92.6	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	124.7	-179.4	-43.4	-179.3	0	0	0	108.3	M261 F305 C333 L334 L355 I357	M261-L318 HydrophobicContact CE-CB 3.91Å; M261-L318 HydrophobicContact CE-CD1 4.38Å; F305-L318 HydrophobicContact CB-CD1 3.98Å; F305-L318 HydrophobicContact CB-CD2 4.17Å; F305-L318 HydrophobicContact CD1-CB 4.14Å; F305-L318 HydrophobicContact CD1-CD1 4.44Å; F305-L318 HydrophobicContact CD1-CD2 3.7Å; F305-L318 HydrophobicContact CD1-CG 4.29Å; F305-L318 HydrophobicContact CD2-CB 4Å; F305-L318 HydrophobicContact CD2-CD1 3.82Å; F305-L318 HydrophobicContact CD2-CG 4.32Å; F305-L318 HydrophobicContact CE1-CB 3.95Å; F305-L318 HydrophobicContact CE1-CD2 4.21Å; F305-L318 HydrophobicContact CE2-CB 3.83Å; F305-L318 HydrophobicContact CE2-CD1 4.47Å; F305-L318 HydrophobicContact CG-CB 4.16Å; F305-L318 HydrophobicContact CG-CD1 3.81Å; F305-L318 HydrophobicContact CG-CD2 3.88Å; F305-L318 HydrophobicContact CG-CG 4.15Å; F305-L318 HydrophobicContact CZ-CB 3.79Å; L318-C333 WeakPolarHBondContact O-CB 3.11Å; L318-L334 HydrophobicContact CB-CB 4.35Å; L318-L334 HydrophobicContact CD1-CD2 4.34Å; L318-L334 PolarHBondContact N-O 2.93Å; L318-L334 PolarHBondContact O-N 3.21Å; L318-L355 HydrophobicContact CD2-CD2 3.77Å; L318-I357 HydrophobicContact CD2-CD1 4.1Å
319	I	96.9	Very high	92.3	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-92.8	125.6	-174	-57.3	-178.2	0	0	0	110	N220 Y223 L226 H308 F310 A323 I327 F364	N220-I319 PolarHBondContact ND2-O 3.22Å; N220-I319 VanDerWaalsContact ND2-O 3.09Å; Y223-I319 HydrophobicContact CD1-CG2 4.47Å; Y223-I319 HydrophobicContact CE1-CB 4.34Å; Y223-I319 HydrophobicContact CE1-CG2 4.02Å; Y223-I319 PolarHBondContact OH-O 2.94Å; L226-I319 HydrophobicContact CD1-CD1 4.49Å; L226-I319 HydrophobicContact CD1-CG2 3.67Å; H308-I319 HydrophobicContact CB-CB 4.07Å; H308-I319 HydrophobicContact CB-CD1 3.93Å; H308-I319 HydrophobicContact CB-CG1 4.38Å; H308-I319 WeakPolarHBondContact O-CB 3.42Å; H308-I319 PolarHBondContact O-N 3.46Å; H308-I319 VanDerWaalsContact O-N 3.09Å; F310-I319 HydrophobicContact CD1-CD1 3.94Å; F310-I319 HydrophobicContact CD1-CG1 4.08Å; F310-I319 HydrophobicContact CE1-CD1 4.43Å; F310-I319 HydrophobicContact CE1-CG1 4.31Å; I319-A323 HydrophobicContact CG2-CB 3.38Å; I319-I327 HydrophobicContact CD1-CD1 3.79Å; I319-I327 HydrophobicContact CG1-CD1 4.09Å; I319-I327 HydrophobicContact CG2-CD1 4.24Å; I319-F364 HydrophobicContact CD1-CE1 4.05Å; I319-F364 HydrophobicContact CD1-CZ 3.93Å
320	P	97.8	Very high	92.1	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.006	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-77.3	163.6	175.7	35.7	-39.1	0	0	0	111.9	Y223 L258 M261 D322 A323 E332	Y223-P320 WeakPolarHBondContact CD1-O 3.44Å; Y223-P320 WeakPolarHBondContact CE1-O 3.43Å; L258-P320 HydrophobicContact CB-CB 4.05Å; L258-P320 HydrophobicContact CB-CG 3.86Å; L258-P320 HydrophobicContact CD1-CG 4.23Å; L258-P320 VanDerWaalsContact N-CB 3.3Å; M261-P320 HydrophobicContact SD-CB 3.8Å; P320-D322 VanDerWaalsContact CB-OD1 3.27Å; P320-D322 WeakPolarHBondContact CB-OD1 3.32Å; P320-D322 WeakPolarHBondContact CG-OD1 3.35Å; P320-D322 PolarHBondContact O-N 3.4Å; P320-A323 HydrophobicContact CG-CB 4.14Å; P320-A323 WeakPolarHBondContact O-CB 3.41Å; P320-A323 PolarHBondContact O-N 2.8Å; P320-E332 WeakPolarHBondContact CD-O 3.35Å; P320-E332 WeakPolarHBondContact CG-O 3.48Å
321	I	96.4	Very high	91.9	Very high	22 Å²	22	43.1 Å²	43.1	11%	0.113	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-23.2	-177	58.9	146.5	0	0	0	114.2	N220 Y223 L224 D255 L256 T257	N220-I321 HydrophobicContact CB-CG2 3.88Å; Y223-I321 WeakPolarHBondContact CA-O 3.45Å; L224-I321 WeakPolarHBondContact CG-O 3.35Å; L224-I321 PolarHBondContact N-O 3.22Å; D255-I321 HydrophobicContact CB-CD1 4.25Å; D255-I321 HydrophobicContact CB-CG2 3.93Å; D255-I321 VanDerWaalsContact O-CD1 3.27Å; D255-I321 WeakPolarHBondContact O-CD1 3.36Å; L256-I321 VanDerWaalsContact C-CG1 3.49Å; L256-I321 WeakPolarHBondContact O-CG1 3.29Å; L256-I321 PolarHBondContact O-N 3.27Å; T257-I321 HydrophobicContact CG2-CD1 4.38Å; T257-I321 HydrophobicContact CG2-CG1 4.26Å
322	D	95.7	Very high	91.9	Very high	65 Å²	65	45.1 Å²	45.1	35%	0.348	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	4.9	-179.2	64	-33.1	0	0	0	113.6	L224 T257 L258 P320	L224-D322 HydrophobicContact CD1-CB 4.13Å; T257-D322 VanDerWaalsContact CA-OD1 3.23Å; T257-D322 WeakPolarHBondContact CA-OD1 3.21Å; T257-D322 HydrophobicContact CG2-CB 4.08Å; L258-D322 PolarHBondContact N-OD1 2.89Å; P320-D322 VanDerWaalsContact CB-OD1 3.27Å; P320-D322 WeakPolarHBondContact CB-OD1 3.32Å; P320-D322 WeakPolarHBondContact CG-OD1 3.35Å; P320-D322 PolarHBondContact O-N 3.4Å
323	A	93.6	Very high	92.1	Very high	5 Å²	5	44.4 Å²	44.4	4%	0.041	24%	0.235	C	C	.	.			trans	-57.4	141.2	174.7	0	0	0	0	0	111.6	H225 L226 I319 P320	H225-A323 WeakPolarHBondContact CB-O 3.38Å; H225-A323 PolarHBondContact CD2-O 3.46Å; L226-A323 HydrophobicContact CD1-CB 4.38Å; I319-A323 HydrophobicContact CG2-CB 3.38Å; P320-A323 HydrophobicContact CG-CB 4.14Å; P320-A323 WeakPolarHBondContact O-CB 3.41Å; P320-A323 PolarHBondContact O-N 2.8Å
324	A	91.3	Very high	92.5	Very high	38 Å²	38	39.5 Å²	39.5	31%	0.314	21%	0.208	S	C	.	.			trans	-64.2	160.3	173.7	0	0	0	0	0	111.6	K326	A324-K326 WeakPolarHBondContact CB-O 3.37Å; A324-K326 PolarHBondContact O-N 2.9Å
325	E	87.4	Confident	92.9	Very high	155 Å²	155	37.8 Å²	37.8	72%	0.724	19%	0.19	S	C	*	.	S	Bend	trans	-59.4	-33.2	175.6	-174.4	178.7	-176.1	0	0	111.7	H225	H225-E325 HydrophobicContact CB-CB 4.23Å
326	K	87.6	Confident	93.1	Very high	152 Å²	152	37.6 Å²	37.6	66%	0.661	19%	0.19	S	C	*	.	S	Bend	trans	-120.1	118.8	171.1	-67.6	-172.3	177.6	-169	0	109	A324	A324-K326 WeakPolarHBondContact CB-O 3.37Å; A324-K326 PolarHBondContact O-N 2.9Å
327	I	87.7	Confident	93	Very high	5 Å²	5	38.5 Å²	38.5	3%	0.026	19%	0.194	C	C	.	.			trans	-81.7	120.2	173.7	-66.1	163.5	0	0	0	108	F310 I319 S329 E332 C333 F364 V366	F310-I327 HydrophobicContact CE1-CD1 4.15Å; I319-I327 HydrophobicContact CD1-CD1 3.79Å; I319-I327 HydrophobicContact CG1-CD1 4.09Å; I319-I327 HydrophobicContact CG2-CD1 4.24Å; I327-S329 VanDerWaalsContact CG2-O 3.27Å; I327-S329 WeakPolarHBondContact CG2-O 3.35Å; I327-E332 HydrophobicContact CG2-CB 4.22Å; I327-C333 VanDerWaalsContact CD1-SG 3.58Å; I327-F364 HydrophobicContact CB-CD1 4.13Å; I327-F364 HydrophobicContact CD1-CD1 3.95Å; I327-F364 HydrophobicContact CD1-CE1 3.73Å; I327-F364 HydrophobicContact CG1-CD1 4.45Å; I327-V366 HydrophobicContact CG2-CG2 4.13Å
328	E	86.5	Confident	92.9	Very high	143 Å²	143	39.6 Å²	39.6	67%	0.668	20%	0.199	S	C	*	.			trans	-102.1	-19.7	-178	-63.3	-172.3	166.3	0	0	111.9	E332 P367	E328-E332 PolarHBondContact N-OE1 3.18Å; E328-P367 WeakPolarHBondContact O-CD 3.47Å
329	S	89.9	Confident	92.8	Very high	21 Å²	21	39.6 Å²	39.6	15%	0.147	20%	0.199	C	C	.	.			trans	-134	144.6	177.7	-169.6	0	0	0	0	113	I327 N331 E332 D370	I327-S329 VanDerWaalsContact CG2-O 3.27Å; I327-S329 WeakPolarHBondContact CG2-O 3.35Å; S329-N331 PolarHBondContact O-N 2.7Å; S329-N331 VanDerWaalsContact O-N 3.16Å; S329-N331 PolarHBondContact OG-N 3.11Å; S329-E332 PolarHBondContact N-OE1 3.25Å; S329-E332 WeakPolarHBondContact O-CB 3.46Å; S329-E332 PolarHBondContact O-N 3.45Å; S329-E332 VanDerWaalsContact O-N 3.13Å; S329-D370 WeakPolarHBondContact CB-OD2 3.29Å; S329-D370 PolarHBondContact OG-OD2 3.18Å
330	F	90.6	Very high	92.6	Very high	13 Å²	13	40.1 Å²	40.1	6%	0.057	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-61.8	-22.7	172.9	-71	-65.1	0	0	0	112.5	F310 A312 Y317 E332 C333 V366 D370 F371	F310-F330 HydrophobicContact CE2-CD1 4.26Å; F310-F330 AromaticContact CE2-CE1 3.96Å; F310-F330 HydrophobicContact CE2-CE1 3.96Å; F310-F330 HydrophobicContact CZ-CD1 4.25Å; F310-F330 HydrophobicContact CZ-CE1 4.38Å; A312-F330 HydrophobicContact CB-CE1 3.61Å; A312-F330 HydrophobicContact CB-CZ 3.96Å; Y317-F330 HydrophobicContact CD1-CD1 4.12Å; Y317-F330 HydrophobicContact CD2-CD1 4.21Å; Y317-F330 HydrophobicContact CD2-CE1 4.36Å; Y317-F330 HydrophobicContact CE1-CB 3.89Å; Y317-F330 AromaticContact CE1-CD1 3.55Å; Y317-F330 HydrophobicContact CE1-CD1 3.55Å; Y317-F330 HydrophobicContact CE1-CE1 4.47Å; Y317-F330 HydrophobicContact CE1-CG 4.05Å; Y317-F330 AromaticContact CE2-CD1 3.66Å; Y317-F330 HydrophobicContact CE2-CD1 3.66Å; Y317-F330 AromaticContact CE2-CE1 3.76Å; Y317-F330 HydrophobicContact CE2-CE1 3.76Å; Y317-F330 HydrophobicContact CG-CD1 4.42Å; Y317-F330 AromaticContact CZ-CD1 3.29Å; Y317-F330 AromaticContact CZ-CE1 3.81Å; Y317-F330 AromaticContact CZ-CG 3.93Å; Y317-F330 WeakPolarHBondContact OH-CD1 3.14Å; F330-E332 PolarHBondContact O-N 2.95Å; F330-C333 PolarHBondContact O-N 2.88Å; F330-V366 HydrophobicContact CB-CG1 4.38Å; F330-V366 HydrophobicContact CD1-CB 4.4Å; F330-V366 HydrophobicContact CD1-CG1 4.02Å; F330-V366 HydrophobicContact CD2-CB 4.22Å; F330-V366 HydrophobicContact CD2-CG1 3.28Å; F330-V366 HydrophobicContact CE1-CB 4.05Å; F330-V366 HydrophobicContact CE1-CG1 4.07Å; F330-V366 HydrophobicContact CE1-CG2 4.34Å; F330-V366 HydrophobicContact CE2-CB 3.84Å; F330-V366 HydrophobicContact CE2-CG1 3.34Å; F330-V366 HydrophobicContact CG-CB 4.48Å; F330-V366 HydrophobicContact CG-CG1 3.64Å; F330-V366 HydrophobicContact CZ-CB 3.75Å; F330-V366 HydrophobicContact CZ-CG1 3.75Å; F330-D370 HydrophobicContact CD2-CB 4.03Å; F330-F371 HydrophobicContact CD2-CB 4.08Å; F330-F371 HydrophobicContact CD2-CD2 4.38Å; F330-F371 HydrophobicContact CE2-CB 3.75Å; F330-F371 AromaticContact CE2-CD2 3.99Å; F330-F371 HydrophobicContact CE2-CD2 3.99Å; F330-F371 HydrophobicContact CE2-CG 4.38Å; F330-F371 HydrophobicContact CZ-CD2 4.08Å
331	N	90.6	Very high	92.3	Very high	94 Å²	94	41.3 Å²	41.3	50%	0.503	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-72.5	-12.6	178.9	-66.8	-36.8	0	0	0	113.5	L258 S329 C333	L258-N331 VanDerWaalsContact CD2-O 3.26Å; L258-N331 WeakPolarHBondContact CD2-O 3.43Å; S329-N331 PolarHBondContact O-N 2.7Å; S329-N331 VanDerWaalsContact O-N 3.16Å; S329-N331 PolarHBondContact OG-N 3.11Å; N331-C333 PolarHBondContact O-N 3.12Å
332	E	92.1	Very high	92.1	Very high	56 Å²	56	42.5 Å²	42.5	26%	0.262	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-78.3	-3.3	173.5	-62.2	175.1	-119.5	0	0	112.5	P320 I327 E328 S329 F330	P320-E332 WeakPolarHBondContact CD-O 3.35Å; P320-E332 WeakPolarHBondContact CG-O 3.48Å; I327-E332 HydrophobicContact CG2-CB 4.22Å; E328-E332 PolarHBondContact N-OE1 3.18Å; S329-E332 PolarHBondContact N-OE1 3.25Å; S329-E332 WeakPolarHBondContact O-CB 3.46Å; S329-E332 PolarHBondContact O-N 3.45Å; S329-E332 VanDerWaalsContact O-N 3.13Å; F330-E332 PolarHBondContact O-N 2.95Å
333	C	94.6	Very high	91.8	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.007	20%	0.2	C	C	.	.	S	Bend	trans	-128.8	168.8	-179.5	-67	0	0	0	0	111	F310 Y317 L318 I327 F330 N331	F310-C333 HydrophobicContact CE1-CB 4.44Å; Y317-C333 HydrophobicContact CD1-CB 4.16Å; L318-C333 WeakPolarHBondContact O-CB 3.11Å; I327-C333 VanDerWaalsContact CD1-SG 3.58Å; F330-C333 PolarHBondContact O-N 2.88Å; N331-C333 PolarHBondContact O-N 3.12Å
334	L	95.9	Very high	91.5	Very high	3 Å²	3	39.2 Å²	39.2	2%	0.016	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	126.3	173	-175.5	64.3	0	0	0	110.1	M261 R262 L265 Y317 L318 V339	M261-L334 HydrophobicContact CB-CD2 4.39Å; M261-L334 HydrophobicContact CE-CB 4.01Å; M261-L334 HydrophobicContact CE-CD2 3.81Å; R262-L334 HydrophobicContact CG-CD1 4.32Å; L265-L334 HydrophobicContact CD2-CD1 4.14Å; L265-L334 HydrophobicContact CD2-CD2 4.33Å; Y317-L334 CarbonylContact C-O 3.6Å; Y317-L334 WeakPolarHBondContact CA-O 3.05Å; L318-L334 HydrophobicContact CB-CB 4.35Å; L318-L334 HydrophobicContact CD1-CD2 4.34Å; L318-L334 PolarHBondContact N-O 2.93Å; L318-L334 PolarHBondContact O-N 3.21Å; L334-V339 HydrophobicContact CD1-CG2 4.26Å; L334-V339 HydrophobicContact CD2-CG2 3.77Å; L334-V339 HydrophobicContact CG-CG2 3.88Å
335	C	95.4	Very high	91.3	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.02	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	129.8	178.4	179.8	0	0	0	0	111.1	S316 Y317 E337 E338 V339 Y374	S316-C335 CarbonylContact O-C 3.47Å; S316-C335 WeakPolarHBondContact O-CA 3.48Å; Y317-C335 HydrophobicContact CD1-CB 4.09Å; Y317-C335 HydrophobicContact CE1-CB 3.84Å; C335-E337 VanDerWaalsContact C-N 3.29Å; C335-E337 PolarHBondContact O-N 3.48Å; C335-E337 PolarHBondContact SG-OE2 3.36Å; C335-E338 HydrophobicContact CB-CB 3.91Å; C335-E338 WeakPolarHBondContact O-CB 3.04Å; C335-E338 PolarHBondContact O-N 3.5Å; C335-V339 WeakPolarHBondContact O-CG2 3.29Å; C335-V339 PolarHBondContact O-N 3.13Å; C335-V339 VanDerWaalsContact O-N 3.12Å; C335-Y374 HydrophobicContact CB-CD2 4.12Å; C335-Y374 HydrophobicContact CB-CE2 3.79Å; C335-Y374 VanDerWaalsContact SG-CD2 3.57Å
336	A	96	Very high	91.2	Very high	4 Å²	4	37.3 Å²	37.3	3%	0.033	18%	0.182	C	C	.	.	H	α-helix	trans	-65	-33	178.6	0	0	0	0	0	112.3	S316 V339 L340 L355	S316-A336 PolarHBondContact O-N 2.91Å; A336-V339 WeakPolarHBondContact O-CB 3.49Å; A336-V339 PolarHBondContact O-N 3.04Å; A336-L340 PolarHBondContact O-N 3.49Å; A336-L355 HydrophobicContact CB-CD1 3.89Å
337	E	93.8	Very high	91.1	Very high	19 Å²	19	33.1 Å²	33.1	9%	0.089	17%	0.172	C	C	.	.	H	α-helix	trans	-71.4	-31.3	175.5	-72.1	69.8	-160.1	0	0	112.7	Q315 S316 C335 S341	Q315-E337 VanDerWaalsContact CA-OE2 3.22Å; Q315-E337 WeakPolarHBondContact CA-OE2 3.3Å; Q315-E337 HydrophobicContact CB-CG 4.45Å; Q315-E337 VanDerWaalsContact CB-OE2 3.24Å; Q315-E337 WeakPolarHBondContact CB-OE2 3.37Å; Q315-E337 HydrophobicContact CG-CB 4.37Å; Q315-E337 HydrophobicContact CG-CG 3.96Å; S316-E337 PolarHBondContact N-OE2 2.91Å; C335-E337 VanDerWaalsContact C-N 3.29Å; C335-E337 PolarHBondContact O-N 3.48Å; C335-E337 PolarHBondContact SG-OE2 3.36Å; E337-S341 PolarHBondContact O-N 3.22Å
338	E	93.9	Very high	91.1	Very high	28 Å²	28	33 Å²	33	13%	0.131	17%	0.171	C	C	.	.	H	α-helix	trans	-61.2	-49.7	168.6	-177	-174.7	178.3	0	0	109.8	R262 C335 L340 S341 M342 Y374	R262-E338 IonicContact CZ-OE1 2.65Å; R262-E338 IonicContact CZ-OE2 3.71Å; R262-E338 IonicContact NH1-OE1 2.76Å; R262-E338 PolarHBondContact NH1-OE1 2.91Å; R262-E338 IonicContact NH1-OE2 3.5Å; R262-E338 IonicContact NH2-OE1 2.79Å; R262-E338 IonicContact NH2-OE2 3.55Å; R262-E338 PolarHBondContact NH2-OE2 3.32Å; C335-E338 HydrophobicContact CB-CB 3.91Å; C335-E338 WeakPolarHBondContact O-CB 3.04Å; C335-E338 PolarHBondContact O-N 3.5Å; E338-L340 VanDerWaalsContact C-N 3.34Å; E338-L340 PolarHBondContact O-N 3.25Å; E338-S341 WeakPolarHBondContact O-CB 3.46Å; E338-S341 PolarHBondContact O-N 3.47Å; E338-S341 VanDerWaalsContact O-N 3.13Å; E338-M342 WeakPolarHBondContact O-CG 3.48Å; E338-M342 PolarHBondContact O-N 2.8Å; E338-Y374 HydrophobicContact CB-CD1 3.82Å; E338-Y374 HydrophobicContact CB-CD2 4.04Å; E338-Y374 HydrophobicContact CB-CE1 3.65Å; E338-Y374 HydrophobicContact CB-CE2 3.88Å; E338-Y374 HydrophobicContact CB-CG 4.01Å; E338-Y374 HydrophobicContact CG-CD1 4.12Å; E338-Y374 HydrophobicContact CG-CE1 3.6Å; E338-Y374 PolarHBondContact OE2-OH 2.81Å
339	V	94.7	Very high	91.3	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.006	15%	0.151	C	C	.	.	H	α-helix	trans	-57.5	-47.1	177.1	175.9	0	0	0	0	111.2	L265 L303 L334 C335 A336 S341 M342 M343 I353	L265-V339 HydrophobicContact CD1-CB 4.32Å; L265-V339 HydrophobicContact CD1-CG1 3.66Å; L265-V339 HydrophobicContact CD1-CG2 4.11Å; L265-V339 HydrophobicContact CD2-CB 4.49Å; L265-V339 HydrophobicContact CD2-CG2 3.75Å; L303-V339 HydrophobicContact CD1-CG1 4.46Å; L303-V339 HydrophobicContact CD2-CB 4.41Å; L303-V339 HydrophobicContact CD2-CG1 3.59Å; L334-V339 HydrophobicContact CD1-CG2 4.26Å; L334-V339 HydrophobicContact CD2-CG2 3.77Å; L334-V339 HydrophobicContact CG-CG2 3.88Å; C335-V339 WeakPolarHBondContact O-CG2 3.29Å; C335-V339 PolarHBondContact O-N 3.13Å; C335-V339 VanDerWaalsContact O-N 3.12Å; A336-V339 WeakPolarHBondContact O-CB 3.49Å; A336-V339 PolarHBondContact O-N 3.04Å; V339-S341 VanDerWaalsContact C-N 3.3Å; V339-S341 PolarHBondContact O-N 3.07Å; V339-M342 PolarHBondContact O-N 2.84Å; V339-M343 HydrophobicContact CG1-CG 4.41Å; V339-M343 HydrophobicContact CG1-SD 3.97Å; V339-M343 WeakPolarHBondContact O-CG 3.26Å; V339-M343 PolarHBondContact O-N 2.91Å; V339-I353 HydrophobicContact CG1-CD1 4.47Å
340	L	93.6	Very high	91.4	Very high	14 Å²	14	26.6 Å²	26.6	7%	0.073	14%	0.144	C	C	.	.	H	α-helix	trans	-59.8	-41.8	177.4	-179.5	58.9	0	0	0	111.7	A336 E338 M343 Q344 I353 T382	A336-L340 PolarHBondContact O-N 3.49Å; E338-L340 VanDerWaalsContact C-N 3.34Å; E338-L340 PolarHBondContact O-N 3.25Å; L340-M343 PolarHBondContact O-N 3.12Å; L340-Q344 HydrophobicContact CD1-CG 4.08Å; L340-Q344 HydrophobicContact CG-CG 4.4Å; L340-Q344 WeakPolarHBondContact O-CB 3.32Å; L340-Q344 VanDerWaalsContact O-CG 3.27Å; L340-Q344 WeakPolarHBondContact O-CG 3.43Å; L340-Q344 PolarHBondContact O-N 3.02Å; L340-I353 HydrophobicContact CB-CD1 3.71Å; L340-I353 HydrophobicContact CD1-CD1 4.06Å; L340-I353 HydrophobicContact CG-CD1 4.39Å; L340-T382 HydrophobicContact CD1-CG2 3.61Å; L340-T382 HydrophobicContact CD2-CG2 3.9Å; L340-T382 HydrophobicContact CG-CG2 4.41Å
341	S	91.7	Very high	91.6	Very high	26 Å²	26	26 Å²	26	18%	0.182	14%	0.141	C	C	.	.	H	α-helix	trans	-59.6	-47.6	176.1	-172.5	0	0	0	0	111.2	E337 E338 V339 M343 Q344 E345	E337-S341 PolarHBondContact O-N 3.22Å; E338-S341 WeakPolarHBondContact O-CB 3.46Å; E338-S341 PolarHBondContact O-N 3.47Å; E338-S341 VanDerWaalsContact O-N 3.13Å; V339-S341 VanDerWaalsContact C-N 3.3Å; V339-S341 PolarHBondContact O-N 3.07Å; S341-M343 PolarHBondContact O-N 2.96Å; S341-Q344 PolarHBondContact O-N 3.32Å; S341-E345 WeakPolarHBondContact O-CG 3.16Å; S341-E345 PolarHBondContact O-N 3.43Å
342	M	91.2	Very high	91.8	Very high	47 Å²	47	21.6 Å²	21.6	23%	0.232	12%	0.118	C	C	.	.	H	α-helix	trans	-62.2	-42.5	178.5	-66.5	179.6	70.1	0	0	112.2	L265 E338 V339 Q344 E345	L265-M342 HydrophobicContact CD2-CE 4.14Å; L265-M342 HydrophobicContact CD2-SD 3.46Å; L265-M342 WeakPolarHBondContact CD2-SD 3.25Å; L265-M342 HydrophobicContact CG-CE 4.1Å; L265-M342 HydrophobicContact CG-SD 4Å; E338-M342 WeakPolarHBondContact O-CG 3.48Å; E338-M342 PolarHBondContact O-N 2.8Å; V339-M342 PolarHBondContact O-N 2.84Å; M342-Q344 VanDerWaalsContact C-N 3.33Å; M342-Q344 PolarHBondContact O-N 3.45Å; M342-E345 PolarHBondContact O-N 2.77Å
343	M	90.7	Very high	92.1	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.8	-43.2	174.2	-71.5	173.3	63.2	0	0	111.5	Y268 L272 A301 L303 V339 L340 S341 E345 K346 P348 I353	Y268-M343 HydrophobicContact CE1-CE 4.43Å; Y268-M343 HydrophobicContact CE1-CG 3.88Å; Y268-M343 HydrophobicContact CE1-SD 4.04Å; L272-M343 HydrophobicContact CD1-CB 4.4Å; L272-M343 HydrophobicContact CD1-CG 4.23Å; A301-M343 HydrophobicContact CB-CE 3.73Å; L303-M343 HydrophobicContact CB-SD 4.33Å; V339-M343 HydrophobicContact CG1-CG 4.41Å; V339-M343 HydrophobicContact CG1-SD 3.97Å; V339-M343 WeakPolarHBondContact O-CG 3.26Å; V339-M343 PolarHBondContact O-N 2.91Å; L340-M343 PolarHBondContact O-N 3.12Å; S341-M343 PolarHBondContact O-N 2.96Å; M343-E345 VanDerWaalsContact C-N 3.32Å; M343-E345 PolarHBondContact O-N 2.78Å; M343-K346 WeakPolarHBondContact O-CB 3.39Å; M343-K346 PolarHBondContact O-N 3.4Å; M343-P348 WeakPolarHBondContact O-CD 3.11Å; M343-I353 HydrophobicContact SD-CD1 4.17Å; M343-I353 HydrophobicContact SD-CG1 4.14Å
344	Q	87.5	Confident	92.3	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-70.9	-24.8	-177.8	-77	-178.9	-18.8	0	0	113.8	L340 S341 M342 K346 S347 S376 R377 T382	L340-Q344 HydrophobicContact CD1-CG 4.08Å; L340-Q344 HydrophobicContact CG-CG 4.4Å; L340-Q344 WeakPolarHBondContact O-CB 3.32Å; L340-Q344 VanDerWaalsContact O-CG 3.27Å; L340-Q344 WeakPolarHBondContact O-CG 3.43Å; L340-Q344 PolarHBondContact O-N 3.02Å; S341-Q344 PolarHBondContact O-N 3.32Å; M342-Q344 VanDerWaalsContact C-N 3.33Å; M342-Q344 PolarHBondContact O-N 3.45Å; Q344-K346 PolarHBondContact O-N 3Å; Q344-S347 PolarHBondContact O-N 3.19Å; Q344-S376 PolarHBondContact NE2-OG 2.92Å; Q344-S376 PolarHBondContact OE1-OG 2.66Å; Q344-R377 PolarHBondContact NE2-O 3.4Å; Q344-R377 PolarHBondContact OE1-O 2.67Å; Q344-T382 PolarHBondContact NE2-OG1 3.45Å
345	E	86.7	Confident	92.4	Very high	110 Å²	110	19.4 Å²	19.4	51%	0.514	11%	0.108	S	C	.	.	H	α-helix	trans	-60.3	-28.6	171.6	-74.6	175.8	-175.9	0	0	112.1	S341 M342 M343 S347	S341-E345 WeakPolarHBondContact O-CG 3.16Å; S341-E345 PolarHBondContact O-N 3.43Å; M342-E345 PolarHBondContact O-N 2.77Å; M343-E345 VanDerWaalsContact C-N 3.32Å; M343-E345 PolarHBondContact O-N 2.78Å; E345-S347 VanDerWaalsContact C-N 3.26Å; E345-S347 PolarHBondContact O-N 3.29Å
346	K	85.1	Confident	92.5	Very high	43 Å²	43	19.8 Å²	19.8	19%	0.187	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-10.8	175.6	-53.2	-66.1	174.9	166.4	0	113.1	C269 L272 N274 G275 M343 Q344 P348	C269-K346 WeakPolarHBondContact O-CD 3.42Å; C269-K346 WeakPolarHBondContact O-CE 3.33Å; C269-K346 PolarHBondContact O-NZ 2.92Å; L272-K346 HydrophobicContact CB-CB 3.68Å; L272-K346 HydrophobicContact CB-CD 4.48Å; L272-K346 HydrophobicContact CB-CG 3.79Å; L272-K346 HydrophobicContact CD1-CB 4.32Å; L272-K346 HydrophobicContact CD1-CG 4.28Å; N274-K346 WeakPolarHBondContact OD1-CD 3.46Å; N274-K346 PolarHBondContact OD1-NZ 3.31Å; G275-K346 PolarHBondContact N-O 3.05Å; M343-K346 WeakPolarHBondContact O-CB 3.39Å; M343-K346 PolarHBondContact O-N 3.4Å; Q344-K346 PolarHBondContact O-N 3Å; K346-P348 VanDerWaalsContact C-CD 3.5Å
347	S	84.8	Confident	92.6	Very high	65 Å²	65	19.6 Å²	19.6	46%	0.455	11%	0.108	S	C	.	.			trans	55.1	46.1	179.4	-53	0	0	0	0	114.2	Q344 E345	Q344-S347 PolarHBondContact O-N 3.19Å; E345-S347 VanDerWaalsContact C-N 3.26Å; E345-S347 PolarHBondContact O-N 3.29Å
348	P	88.6	Confident	92.6	Very high	3 Å²	3	20.5 Å²	20.5	2%	0.019	12%	0.116	C	C	.	.			trans	-62.2	154.9	174.5	31.5	-37.8	0	0	0	110.3	S299 A301 M343 K346 M350 S351 N381	S299-P348 CarbonylContact O-C 3.56Å; S299-P348 WeakPolarHBondContact O-CB 3.49Å; A301-P348 HydrophobicContact CB-CB 3.95Å; A301-P348 HydrophobicContact CB-CG 4.11Å; M343-P348 WeakPolarHBondContact O-CD 3.11Å; K346-P348 VanDerWaalsContact C-CD 3.5Å; P348-M350 PolarHBondContact O-N 3.43Å; P348-S351 WeakPolarHBondContact CG-OG 3.49Å; P348-N381 PolarHBondContact O-ND2 3.03Å
349	A	89.1	Confident	92.6	Very high	28 Å²	28	19.6 Å²	19.6	23%	0.231	11%	0.111	C	C	.	.	S	Bend	trans	-72.6	-19	175.5	0	0	0	0	0	113.1	P298 S299 N381 R452	P298-A349 VanDerWaalsContact CA-CB 3.48Å; P298-A349 HydrophobicContact CB-CB 3.15Å; S299-A349 PolarHBondContact O-N 2.84Å; A349-N381 WeakPolarHBondContact O-CB 3.35Å; A349-R452 WeakPolarHBondContact O-CD 3.46Å; A349-R452 PolarHBondContact O-NE 3.36Å
350	M	92.3	Very high	92.5	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	133.2	171.9	-170	168.8	66.3	0	0	110.4	S299 L300 A301 P348 V352 N381 V419 M448 R452 L454	S299-M350 PolarHBondContact O-N 3.31Å; L300-M350 HydrophobicContact CB-CB 4.46Å; L300-M350 HydrophobicContact CB-CE 4.05Å; L300-M350 HydrophobicContact CD1-CE 3.83Å; L300-M350 HydrophobicContact CD2-CB 3.51Å; L300-M350 HydrophobicContact CD2-CE 4.03Å; L300-M350 HydrophobicContact CG-CE 4.17Å; A301-M350 PolarHBondContact N-O 3.15Å; P348-M350 PolarHBondContact O-N 3.43Å; M350-V352 HydrophobicContact CE-CG2 3.85Å; M350-V352 HydrophobicContact CG-CG2 3.84Å; M350-V352 HydrophobicContact SD-CG2 3.9Å; M350-N381 CarbonylContact C-O 3.5Å; M350-N381 WeakPolarHBondContact CA-O 3.32Å; M350-V419 HydrophobicContact CE-CG2 4.18Å; M350-V419 HydrophobicContact SD-CG2 3.85Å; M350-M448 HydrophobicContact CG-CE 3.44Å; M350-M448 VanDerWaalsContact CG-CE 3.44Å; M350-M448 HydrophobicContact CG-SD 4.26Å; M350-M448 HydrophobicContact SD-CE 3.68Å; M350-M448 HydrophobicContact SD-SD 4.07Å; M350-R452 HydrophobicContact CG-CB 4.47Å; M350-R452 HydrophobicContact SD-CB 3.49Å; M350-R452 WeakPolarHBondContact SD-CB 3.18Å; M350-L454 HydrophobicContact CE-CD2 3.98Å
351	S	94.3	Very high	92	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	113.9	169.3	-64.5	0	0	0	0	108.9	A301 P348 N381 T382 V383	A301-S351 WeakPolarHBondContact O-CA 3.11Å; P348-S351 WeakPolarHBondContact CG-OG 3.49Å; S351-N381 PolarHBondContact N-O 3.42Å; S351-T382 CarbonylContact O-C 3.6Å; S351-T382 VanDerWaalsContact O-CA 3.29Å; S351-T382 WeakPolarHBondContact O-CA 3.37Å; S351-V383 PolarHBondContact O-N 2.99Å
352	V	96.3	Very high	91.1	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.012	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.9	174.9	-177.4	0	0	0	0	108.8	A301 A302 L303 M350 L354 V383 V419 L454	A301-V352 PolarHBondContact O-N 3Å; A302-V352 CarbonylContact C-O 3.59Å; A302-V352 VanDerWaalsContact CA-O 3.32Å; A302-V352 WeakPolarHBondContact CA-O 3.35Å; A302-V352 HydrophobicContact CB-CB 4.31Å; L303-V352 PolarHBondContact N-O 2.87Å; M350-V352 HydrophobicContact CE-CG2 3.85Å; M350-V352 HydrophobicContact CG-CG2 3.84Å; M350-V352 HydrophobicContact SD-CG2 3.9Å; V352-L354 HydrophobicContact CG1-CD2 4.12Å; V352-L354 HydrophobicContact CG1-CG 3.99Å; V352-V383 CarbonylContact C-O 3.55Å; V352-V383 VanDerWaalsContact CA-O 3.3Å; V352-V383 WeakPolarHBondContact CA-O 3.47Å; V352-V419 HydrophobicContact CG1-CG1 4.05Å; V352-V419 HydrophobicContact CG2-CG1 4.29Å; V352-V419 HydrophobicContact CG2-CG2 4.1Å; V352-L454 HydrophobicContact CG2-CD2 4.37Å
353	I	97.5	Very high	90.1	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	123.4	167.8	-60.7	-174.8	0	0	0	107.9	L303 V339 L340 M343 L355 V383 V384 G385	L303-I353 HydrophobicContact CB-CG1 4.16Å; L303-I353 HydrophobicContact CB-CG2 4.49Å; L303-I353 HydrophobicContact CD2-CG1 4.48Å; L303-I353 HydrophobicContact CD2-CG2 4Å; L303-I353 CarbonylContact O-C 3.55Å; L303-I353 WeakPolarHBondContact O-CA 3.47Å; V339-I353 HydrophobicContact CG1-CD1 4.47Å; L340-I353 HydrophobicContact CB-CD1 3.71Å; L340-I353 HydrophobicContact CD1-CD1 4.06Å; L340-I353 HydrophobicContact CG-CD1 4.39Å; M343-I353 HydrophobicContact SD-CD1 4.17Å; M343-I353 HydrophobicContact SD-CG1 4.14Å; I353-L355 HydrophobicContact CG2-CD1 4.38Å; I353-L355 HydrophobicContact CG2-CD2 3.56Å; I353-L355 HydrophobicContact CG2-CG 3.79Å; I353-V383 PolarHBondContact N-O 3.21Å; I353-V384 HydrophobicContact CB-CG1 4.21Å; I353-V384 HydrophobicContact CB-CG2 4.36Å; I353-V384 HydrophobicContact CG2-CG1 4.32Å; I353-V384 CarbonylContact O-C 3.12Å; I353-V384 VanDerWaalsContact O-CA 3.23Å; I353-V384 WeakPolarHBondContact O-CA 3.47Å; I353-G385 PolarHBondContact O-N 2.91Å
354	L	98.6	Very high	89.3	Confident	11 Å²	11	36 Å²	36	6%	0.058	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	120.1	174.9	-63.4	-178.6	0	0	0	108.4	L303 Y304 F305 V352 G385 L409 L423	L303-L354 PolarHBondContact O-N 3.27Å; Y304-L354 WeakPolarHBondContact CA-O 3.44Å; Y304-L354 HydrophobicContact CD2-CB 3.63Å; Y304-L354 WeakPolarHBondContact CD2-O 3.47Å; Y304-L354 HydrophobicContact CE2-CB 4.42Å; F305-L354 PolarHBondContact N-O 3.11Å; V352-L354 HydrophobicContact CG1-CD2 4.12Å; V352-L354 HydrophobicContact CG1-CG 3.99Å; L354-G385 CarbonylContact C-O 3.56Å; L354-G385 WeakPolarHBondContact CA-O 3.07Å; L354-L409 HydrophobicContact CD1-CD2 4.03Å; L354-L423 HydrophobicContact CD2-CD1 4.14Å; L354-L423 HydrophobicContact CD2-CD2 4.08Å
355	L	98.5	Very high	88.6	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	108.2	-175.6	-60.2	-176.4	0	0	0	110.2	F305 L318 A336 I353 I357 V384 G385 Y386 A387	F305-L355 HydrophobicContact CB-CD2 4.24Å; L318-L355 HydrophobicContact CD2-CD2 3.77Å; A336-L355 HydrophobicContact CB-CD1 3.89Å; I353-L355 HydrophobicContact CG2-CD1 4.38Å; I353-L355 HydrophobicContact CG2-CD2 3.56Å; I353-L355 HydrophobicContact CG2-CG 3.79Å; L355-I357 HydrophobicContact CB-CD1 4.33Å; L355-I357 HydrophobicContact CB-CG1 4.16Å; L355-I357 HydrophobicContact CD1-CD1 4.46Å; L355-V384 HydrophobicContact CD1-CG1 4.45Å; L355-G385 PolarHBondContact N-O 3.2Å; L355-Y386 HydrophobicContact CB-CD1 4.29Å; L355-Y386 HydrophobicContact CD1-CD1 4Å; L355-Y386 HydrophobicContact CD1-CE1 3.72Å; L355-A387 WeakPolarHBondContact O-CB 3.22Å; L355-A387 PolarHBondContact O-N 3.32Å
356	D	98.1	Very high	88.1	Confident	10 Å²	10	40.4 Å²	40.4	5%	0.053	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	71.7	176.3	-155.3	-9.1	0	0	0	110.1	Y304 F305 V306 G307 A387 F405	Y304-D356 HydrophobicContact CE2-CB 3.71Å; Y304-D356 PolarHBondContact OH-OD2 3.49Å; F305-D356 PolarHBondContact O-N 2.94Å; V306-D356 WeakPolarHBondContact CA-O 3.38Å; V306-D356 HydrophobicContact CB-CB 3.95Å; V306-D356 HydrophobicContact CG2-CB 3.93Å; G307-D356 PolarHBondContact N-O 2.83Å; D356-A387 HydrophobicContact CB-CB 4.15Å; D356-A387 WeakPolarHBondContact OD1-CB 3.38Å; D356-F405 HydrophobicContact CB-CD1 4.28Å
357	I	96.8	Very high	87.8	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	23%	0.227	C	C	.	.	S	Bend	trans	-139	158.1	-173.2	62.6	174.9	0	0	0	110.6	F305 L318 L355 A394	F305-I357 HydrophobicContact CD1-CG2 3.41Å; F305-I357 VanDerWaalsContact CD1-CG2 3.41Å; F305-I357 HydrophobicContact CE1-CG2 3.55Å; L318-I357 HydrophobicContact CD2-CD1 4.1Å; L355-I357 HydrophobicContact CB-CD1 4.33Å; L355-I357 HydrophobicContact CB-CG1 4.16Å; L355-I357 HydrophobicContact CD1-CD1 4.46Å; I357-A394 VanDerWaalsContact O-CB 3.3Å; I357-A394 WeakPolarHBondContact O-CB 3.44Å
358	C	94.7	Very high	87.5	Confident	38 Å²	38	43.6 Å²	43.6	26%	0.257	24%	0.239	S	C	.	.			trans	-64.3	151.2	160.3	-67.6	0	0	0	0	110.8	G309 F310 A394	G309-C358 CarbonylContact C-O 3.55Å; F310-C358 PolarHBondContact N-O 3.34Å; C358-A394 PolarHBondContact SG-N 2.84Å; C358-A394 VanDerWaalsContact SG-N 3.37Å
359	R	94.8	Very high	87.2	Confident	8 Å²	8	48.4 Å²	48.4	3%	0.03	27%	0.272	C	S	.	.			trans	-122.8	24.2	177.9	-64.8	174.3	68	-163	-1.7	112	E311 T388 S389 F390 G391 E392 E443	E311-R359 HydrophobicContact CB-CB 4.14Å; E311-R359 IonicContact OE1-NH2 3.83Å; E311-R359 IonicContact OE2-CZ 2.79Å; E311-R359 IonicContact OE2-NE 3.69Å; E311-R359 PolarHBondContact OE2-NE 3.2Å; E311-R359 IonicContact OE2-NH2 3.88Å; E311-R359 PolarHBondContact OE2-NH2 2.72Å; R359-T388 HydrophobicContact CB-CG2 4.3Å; R359-T388 VanDerWaalsContact CD-O 3.29Å; R359-T388 WeakPolarHBondContact CD-O 3.45Å; R359-T388 HydrophobicContact CG-CG2 4.02Å; R359-T388 PolarHBondContact NH1-O 2.69Å; R359-S389 VanDerWaalsContact NH1-C 3.31Å; R359-F390 VanDerWaalsContact NH1-N 3.11Å; R359-G391 WeakPolarHBondContact O-CA 3.4Å; R359-G391 PolarHBondContact O-N 2.96Å; R359-E392 PolarHBondContact N-O 3.48Å; R359-E443 IonicContact CZ-OE2 3.72Å; R359-E443 IonicContact NH1-OE2 3.62Å; R359-E443 PolarHBondContact NH1-OE2 2.77Å; R359-E443 IonicContact NH2-OE2 3.23Å
360	R	91.3	Very high	86.9	Confident	82 Å²	82	49.7 Å²	49.7	31%	0.309	28%	0.275	S	S	.	.			trans	-89.7	140.5	176.6	-62.9	-174.8	176	155.8	8.8	110.6	F310 D362 G391 E392 Y395	F310-R360 VanDerWaalsContact CB-O 3.23Å; F310-R360 WeakPolarHBondContact CB-O 3.42Å; R360-D362 WeakPolarHBondContact CB-OD1 3.32Å; R360-G391 VanDerWaalsContact CG-O 3.28Å; R360-G391 WeakPolarHBondContact CG-O 3.39Å; R360-E392 IonicContact CZ-OE2 3.57Å; R360-E392 IonicContact NE-OE2 3.1Å; R360-E392 IonicContact NH2-OE2 2.69Å; R360-E392 PolarHBondContact NH2-OE2 2.77Å; R360-Y395 PolarHBondContact NH2-OH 3.25Å
361	S	83.7	Confident	86.5	Confident	72 Å²	72	51.7 Å²	51.7	50%	0.503	28%	0.284	S	S	.	.			trans	-104.9	4.2	-179.6	72.1	0	0	0	0	113.5	E311 N363 F364	E311-S361 WeakPolarHBondContact O-CB 3.49Å; S361-N363 VanDerWaalsContact C-N 3.26Å; S361-N363 PolarHBondContact O-N 2.83Å; S361-F364 PolarHBondContact O-N 3.31Å
362	D	73.3	Confident	86.1	Confident	113 Å²	113	54.8 Å²	54.8	60%	0.604	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-22.2	-166.6	51.8	-24.7	0	0	0	114.3	R360	R360-D362 WeakPolarHBondContact CB-OD1 3.32Å
363	N	69.7	Low	85.5	Confident	120 Å²	120	59.1 Å²	59.1	64%	0.642	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	6.3	-179	-63.3	-40	0	0	0	114.3	S361	S361-N363 VanDerWaalsContact C-N 3.26Å; S361-N363 PolarHBondContact O-N 2.83Å
364	F	73.9	Confident	84.8	Confident	45 Å²	45	62 Å²	62	20%	0.197	34%	0.341	C	S	.	.			trans	-125.1	115.6	-170.1	-48.1	-72.8	0	0	0	111.1	F310 I319 I327 S361 V366	F310-F364 HydrophobicContact CB-CD2 3.62Å; F310-F364 HydrophobicContact CB-CE2 3.29Å; F310-F364 HydrophobicContact CB-CZ 4.01Å; F310-F364 HydrophobicContact CD1-CD1 4.38Å; F310-F364 HydrophobicContact CD1-CD2 4.12Å; F310-F364 HydrophobicContact CD1-CE1 4.23Å; F310-F364 AromaticContact CD1-CE2 3.97Å; F310-F364 HydrophobicContact CD1-CE2 3.97Å; F310-F364 HydrophobicContact CD1-CG 4.32Å; F310-F364 AromaticContact CD1-CZ 4Å; F310-F364 HydrophobicContact CD1-CZ 4Å; F310-F364 AromaticContact CD2-CD2 3.92Å; F310-F364 HydrophobicContact CD2-CD2 3.92Å; F310-F364 HydrophobicContact CD2-CE2 4.4Å; F310-F364 HydrophobicContact CD2-CG 4.27Å; F310-F364 HydrophobicContact CE1-CD1 4.48Å; F310-F364 AromaticContact CG-CD2 3.64Å; F310-F364 HydrophobicContact CG-CD2 3.64Å; F310-F364 AromaticContact CG-CE2 3.67Å; F310-F364 HydrophobicContact CG-CE2 3.67Å; F310-F364 HydrophobicContact CG-CG 4.16Å; F310-F364 HydrophobicContact CG-CZ 4.19Å; I319-F364 HydrophobicContact CD1-CE1 4.05Å; I319-F364 HydrophobicContact CD1-CZ 3.93Å; I327-F364 HydrophobicContact CB-CD1 4.13Å; I327-F364 HydrophobicContact CD1-CD1 3.95Å; I327-F364 HydrophobicContact CD1-CE1 3.73Å; I327-F364 HydrophobicContact CG1-CD1 4.45Å; S361-F364 PolarHBondContact O-N 3.31Å; F364-V366 HydrophobicContact CB-CG2 4.31Å
365	E	72.6	Confident	83.6	Confident	182 Å²	182	70.1 Å²	70.1	85%	0.85	38%	0.376	S	S	*	.			trans	-103.7	59.1	177.3	-70.4	-173.5	163.9	0	0	110.5
366	V	75.8	Confident	82.2	Confident	22 Å²	22	72.3 Å²	72.3	13%	0.133	39%	0.391	C	S	.	.			trans	-84.4	129.1	-177.7	-170.9	0	0	0	0	110.7	I327 F330 F364 V368	I327-V366 HydrophobicContact CG2-CG2 4.13Å; F330-V366 HydrophobicContact CB-CG1 4.38Å; F330-V366 HydrophobicContact CD1-CB 4.4Å; F330-V366 HydrophobicContact CD1-CG1 4.02Å; F330-V366 HydrophobicContact CD2-CB 4.22Å; F330-V366 HydrophobicContact CD2-CG1 3.28Å; F330-V366 HydrophobicContact CE1-CB 4.05Å; F330-V366 HydrophobicContact CE1-CG1 4.07Å; F330-V366 HydrophobicContact CE1-CG2 4.34Å; F330-V366 HydrophobicContact CE2-CB 3.84Å; F330-V366 HydrophobicContact CE2-CG1 3.34Å; F330-V366 HydrophobicContact CG-CB 4.48Å; F330-V366 HydrophobicContact CG-CG1 3.64Å; F330-V366 HydrophobicContact CZ-CB 3.75Å; F330-V366 HydrophobicContact CZ-CG1 3.75Å; F364-V366 HydrophobicContact CB-CG2 4.31Å; V366-V368 PolarHBondContact O-N 3.42Å
367	P	79.2	Confident	81	Confident	60 Å²	60	78.6 Å²	78.6	39%	0.39	41%	0.414	S	S	.	.			trans	-58.5	132.8	176.5	-23.6	33.5	0	0	0	112.1	E328 S369 D370	E328-P367 WeakPolarHBondContact O-CD 3.47Å; P367-S369 WeakPolarHBondContact CB-OG 3.35Å; P367-S369 PolarHBondContact O-N 2.92Å; P367-D370 PolarHBondContact O-N 2.99Å
368	V	78.6	Confident	79.6	Confident	115 Å²	115	85 Å²	85	70%	0.697	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-59.3	-23.5	175.8	-176.3	0	0	0	0	111.9	V366 D370 F371	V366-V368 PolarHBondContact O-N 3.42Å; V368-D370 PolarHBondContact O-N 3.47Å; V368-F371 VanDerWaalsContact O-CB 3.29Å; V368-F371 WeakPolarHBondContact O-CB 3.23Å; V368-F371 PolarHBondContact O-N 3.45Å
369	S	82.4	Confident	78.7	Confident	104 Å²	104	85.2 Å²	85.2	73%	0.727	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-61.3	-28.6	175.5	52.9	0	0	0	0	113.8	P367 F371	P367-S369 WeakPolarHBondContact CB-OG 3.35Å; P367-S369 PolarHBondContact O-N 2.92Å; S369-F371 VanDerWaalsContact C-N 3.3Å
370	D	81.8	Confident	78.3	Confident	55 Å²	55	93.5 Å²	93.5	29%	0.294	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-87.1	-7.2	-177.8	-73.8	22.1	0	0	0	111.7	S329 F330 P367 V368 V372	S329-D370 WeakPolarHBondContact CB-OD2 3.29Å; S329-D370 PolarHBondContact OG-OD2 3.18Å; F330-D370 HydrophobicContact CD2-CB 4.03Å; P367-D370 PolarHBondContact O-N 2.99Å; V368-D370 PolarHBondContact O-N 3.47Å; D370-V372 PolarHBondContact O-N 3.18Å
371	F	84.4	Confident	78.3	Confident	42 Å²	42	90.2 Å²	90.2	18%	0.184	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-70.9	120	-176.3	-178.1	-104.2	0	0	0	111.4	N313 Q315 Y317 F330 V368 S369 T373	N313-F371 HydrophobicContact CB-CD2 4.18Å; N313-F371 HydrophobicContact CB-CE1 4Å; N313-F371 HydrophobicContact CB-CE2 3.51Å; N313-F371 HydrophobicContact CB-CZ 3.4Å; N313-F371 WeakPolarHBondContact ND2-CD2 3.46Å; Q315-F371 HydrophobicContact CB-CE2 4.42Å; Q315-F371 HydrophobicContact CG-CE2 4.4Å; Q315-F371 HydrophobicContact CG-CZ 4.19Å; Y317-F371 WeakPolarHBondContact OH-CD2 3.39Å; Y317-F371 WeakPolarHBondContact OH-CE2 3.26Å; F330-F371 HydrophobicContact CD2-CB 4.08Å; F330-F371 HydrophobicContact CD2-CD2 4.38Å; F330-F371 HydrophobicContact CE2-CB 3.75Å; F330-F371 AromaticContact CE2-CD2 3.99Å; F330-F371 HydrophobicContact CE2-CD2 3.99Å; F330-F371 HydrophobicContact CE2-CG 4.38Å; F330-F371 HydrophobicContact CZ-CD2 4.08Å; V368-F371 VanDerWaalsContact O-CB 3.29Å; V368-F371 WeakPolarHBondContact O-CB 3.23Å; V368-F371 PolarHBondContact O-N 3.45Å; S369-F371 VanDerWaalsContact C-N 3.3Å; F371-T373 VanDerWaalsContact CE1-OG1 3.27Å; F371-T373 WeakPolarHBondContact CE1-OG1 3.34Å
372	V	85.3	Confident	78.8	Confident	66 Å²	66	87.2 Å²	87.2	40%	0.4	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-103.2	123.3	173.1	-179.4	0	0	0	0	108.9	Q315 D370 Y374	Q315-V372 PolarHBondContact NE2-O 2.94Å; D370-V372 PolarHBondContact O-N 3.18Å; V372-Y374 HydrophobicContact CB-CE2 4Å; V372-Y374 HydrophobicContact CG1-CD2 4.44Å; V372-Y374 HydrophobicContact CG1-CE1 4.02Å; V372-Y374 HydrophobicContact CG1-CE2 3.92Å
373	T	84.2	Confident	79.9	Confident	93 Å²	93	81.8 Å²	81.8	57%	0.571	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-85.5	119.1	173.5	-51.5	0	0	0	0	110.4	F371	F371-T373 VanDerWaalsContact CE1-OG1 3.27Å; F371-T373 WeakPolarHBondContact CE1-OG1 3.34Å
374	Y	83.3	Confident	81.1	Confident	62 Å²	62	76.6 Å²	76.6	24%	0.243	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-92.5	122.3	173	-62.9	-82.9	0	0	0	109.8	C335 E338 V372	C335-Y374 HydrophobicContact CB-CD2 4.12Å; C335-Y374 HydrophobicContact CB-CE2 3.79Å; C335-Y374 VanDerWaalsContact SG-CD2 3.57Å; E338-Y374 HydrophobicContact CB-CD1 3.82Å; E338-Y374 HydrophobicContact CB-CD2 4.04Å; E338-Y374 HydrophobicContact CB-CE1 3.65Å; E338-Y374 HydrophobicContact CB-CE2 3.88Å; E338-Y374 HydrophobicContact CB-CG 4.01Å; E338-Y374 HydrophobicContact CG-CD1 4.12Å; E338-Y374 HydrophobicContact CG-CE1 3.6Å; E338-Y374 PolarHBondContact OE2-OH 2.81Å; V372-Y374 HydrophobicContact CB-CE2 4Å; V372-Y374 HydrophobicContact CG1-CD2 4.44Å; V372-Y374 HydrophobicContact CG1-CE1 4.02Å; V372-Y374 HydrophobicContact CG1-CE2 3.92Å
375	K	72.6	Confident	82.3	Confident	182 Å²	182	74.5 Å²	74.5	79%	0.791	38%	0.384	S	S	*	.			trans	-96.6	102.8	175.1	-73.3	-173	179.9	179.4	0	109.5
376	S	69.9	Low	83.5	Confident	47 Å²	47	66.1 Å²	66.1	33%	0.329	35%	0.345	S	S	.	.			trans	-61	140.7	168.4	173.5	0	0	0	0	110.5	Q344	Q344-S376 PolarHBondContact NE2-OG 2.92Å; Q344-S376 PolarHBondContact OE1-OG 2.66Å
377	R	72.7	Confident	84.5	Confident	142 Å²	142	65.1 Å²	65.1	54%	0.536	34%	0.339	S	S	.	.			trans	-66.7	147.3	172.3	-68.2	-175.1	-177.8	-167.2	3.2	108.6	Q344 N379	Q344-R377 PolarHBondContact NE2-O 3.4Å; Q344-R377 PolarHBondContact OE1-O 2.67Å; R377-N379 PolarHBondContact O-N 3.44Å
378	V	68.1	Low	85.3	Confident	134 Å²	134	62.2 Å²	62.2	81%	0.812	32%	0.32	S	S	*	.			trans	-76.1	68	172.2	-169.5	0	0	0	0	109
379	N	74.6	Confident	86	Confident	43 Å²	43	58.7 Å²	58.7	23%	0.23	30%	0.3	C	S	.	.			trans	-92.5	118.3	169.9	-69.5	-8.8	0	0	0	106.3	R377 N381 N447	R377-N379 PolarHBondContact O-N 3.44Å; N379-N381 WeakPolarHBondContact CB-OD1 3.44Å; N379-N381 PolarHBondContact O-N 2.8Å; N379-N381 PolarHBondContact O-OD1 3.12Å; N379-N447 VanDerWaalsContact O-CG 3.26Å; N379-N447 PolarHBondContact O-ND2 3.02Å; N379-N447 PolarHBondContact O-OD1 2.83Å
380	R	87.2	Confident	86.5	Confident	182 Å²	182	60.2 Å²	60.2	69%	0.687	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	48.2	-176	-62.1	176.5	-68.2	-129.2	-3.3	112.2	N447 M448 S449	R380-N447 CarbonylContact C-O 3.35Å; R380-N447 WeakPolarHBondContact CA-O 3.47Å; R380-M448 WeakPolarHBondContact O-CA 3.4Å; R380-S449 PolarHBondContact O-N 2.61Å; R380-S449 PolarHBondContact O-OG 2.99Å
381	N	91.4	Very high	86.8	Confident	14 Å²	14	59 Å²	59	8%	0.075	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-141.3	8.5	-164.5	71.4	-16	0	0	0	113.4	P348 A349 M350 S351 N379 N447	P348-N381 PolarHBondContact O-ND2 3.03Å; A349-N381 WeakPolarHBondContact O-CB 3.35Å; M350-N381 CarbonylContact C-O 3.5Å; M350-N381 WeakPolarHBondContact CA-O 3.32Å; S351-N381 PolarHBondContact N-O 3.42Å; N379-N381 WeakPolarHBondContact CB-OD1 3.44Å; N379-N381 PolarHBondContact O-N 2.8Å; N379-N381 PolarHBondContact O-OD1 3.12Å; N381-N447 PolarHBondContact N-OD1 2.79Å
382	T	93.7	Very high	87.2	Confident	8 Å²	8	61 Å²	61	5%	0.049	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	135	-169.1	-57.4	0	0	0	0	111.8	L340 Q344 S351 V384 T446 N447	L340-T382 HydrophobicContact CD1-CG2 3.61Å; L340-T382 HydrophobicContact CD2-CG2 3.9Å; L340-T382 HydrophobicContact CG-CG2 4.41Å; Q344-T382 PolarHBondContact NE2-OG1 3.45Å; S351-T382 CarbonylContact O-C 3.6Å; S351-T382 VanDerWaalsContact O-CA 3.29Å; S351-T382 WeakPolarHBondContact O-CA 3.37Å; T382-V384 HydrophobicContact CG2-CG2 4.07Å; T382-T446 WeakPolarHBondContact O-CA 3.36Å; T382-T446 PolarHBondContact O-OG1 2.98Å; T382-N447 WeakPolarHBondContact CA-OD1 3.08Å; T382-N447 VanDerWaalsContact CB-OD1 3.3Å; T382-N447 WeakPolarHBondContact CB-OD1 3.49Å; T382-N447 PolarHBondContact N-OD1 3.38Å; T382-N447 PolarHBondContact O-N 2.79Å; T382-N447 PolarHBondContact O-OD1 2.79Å
383	V	95.8	Very high	87.4	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.6	163.8	162.4	0	0	0	0	108.6	S351 V352 I353 V419 A420 L423 T446 M448	S351-V383 PolarHBondContact O-N 2.99Å; V352-V383 CarbonylContact C-O 3.55Å; V352-V383 VanDerWaalsContact CA-O 3.3Å; V352-V383 WeakPolarHBondContact CA-O 3.47Å; I353-V383 PolarHBondContact N-O 3.21Å; V383-V419 HydrophobicContact CB-CG1 4.48Å; V383-V419 HydrophobicContact CG1-CB 4.31Å; V383-V419 HydrophobicContact CG1-CG1 3.83Å; V383-A420 HydrophobicContact CG2-CB 4.45Å; V383-L423 HydrophobicContact CG1-CD1 3.86Å; V383-T446 VanDerWaalsContact CG2-OG1 3.25Å; V383-T446 WeakPolarHBondContact CG2-OG1 3.44Å; V383-M448 HydrophobicContact CB-CE 3.92Å; V383-M448 HydrophobicContact CG2-CB 4.28Å; V383-M448 HydrophobicContact CG2-CE 3.4Å; V383-M448 HydrophobicContact CG2-SD 4.41Å
384	V	96.6	Very high	87.6	Confident	11 Å²	11	54.4 Å²	54.4	7%	0.067	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	120.9	168.3	-170.2	0	0	0	0	108.1	I353 L355 T382 Y386 R445	I353-V384 HydrophobicContact CB-CG1 4.21Å; I353-V384 HydrophobicContact CB-CG2 4.36Å; I353-V384 HydrophobicContact CG2-CG1 4.32Å; I353-V384 CarbonylContact O-C 3.12Å; I353-V384 VanDerWaalsContact O-CA 3.23Å; I353-V384 WeakPolarHBondContact O-CA 3.47Å; L355-V384 HydrophobicContact CD1-CG1 4.45Å; T382-V384 HydrophobicContact CG2-CG2 4.07Å; V384-Y386 HydrophobicContact CB-CE2 4.08Å; V384-Y386 HydrophobicContact CG1-CD2 4.31Å; V384-Y386 HydrophobicContact CG1-CE1 4.01Å; V384-Y386 HydrophobicContact CG1-CE2 3.65Å; V384-Y386 VanDerWaalsContact CG1-CZ 3.48Å; V384-R445 HydrophobicContact CB-CB 4.46Å; V384-R445 PolarHBondContact N-O 3.17Å; V384-R445 PolarHBondContact O-N 3.27Å
385	G	97.6	Very high	87.9	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	123	174.4	0	0	0	0	0	110.2	I353 L354 L355	I353-G385 PolarHBondContact O-N 2.91Å; L354-G385 CarbonylContact C-O 3.56Å; L354-G385 WeakPolarHBondContact CA-O 3.07Å; L355-G385 PolarHBondContact N-O 3.2Å
386	Y	98	Very high	88.5	Confident	7 Å²	7	49.4 Å²	49.4	3%	0.027	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	133.2	175.3	-55.3	-92.7	0	0	0	108.9	L355 V384 T388 P442 E443 R445	L355-Y386 HydrophobicContact CB-CD1 4.29Å; L355-Y386 HydrophobicContact CD1-CD1 4Å; L355-Y386 HydrophobicContact CD1-CE1 3.72Å; V384-Y386 HydrophobicContact CB-CE2 4.08Å; V384-Y386 HydrophobicContact CG1-CD2 4.31Å; V384-Y386 HydrophobicContact CG1-CE1 4.01Å; V384-Y386 HydrophobicContact CG1-CE2 3.65Å; V384-Y386 VanDerWaalsContact CG1-CZ 3.48Å; Y386-T388 WeakPolarHBondContact CB-O 3.34Å; Y386-T388 PolarHBondContact O-N 3.41Å; Y386-P442 CarbonylContact O-C 3.51Å; Y386-P442 WeakPolarHBondContact O-CA 3.36Å; Y386-P442 VanDerWaalsContact O-CB 3.29Å; Y386-P442 WeakPolarHBondContact O-CB 3.45Å; Y386-E443 HydrophobicContact CD2-CB 4.2Å; Y386-E443 PolarHBondContact N-O 3.03Å; Y386-E443 PolarHBondContact O-N 3.24Å; Y386-R445 HydrophobicContact CE2-CB 4.13Å
387	A	97.2	Very high	89	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.248	C	C	.	.	S	Bend	trans	-64.1	-20.8	176.5	0	0	0	0	0	113.3	L355 D356 A394 F405 Q440	L355-A387 WeakPolarHBondContact O-CB 3.22Å; L355-A387 PolarHBondContact O-N 3.32Å; D356-A387 HydrophobicContact CB-CB 4.15Å; D356-A387 WeakPolarHBondContact OD1-CB 3.38Å; A387-A394 HydrophobicContact CB-CB 4.28Å; A387-F405 HydrophobicContact CB-CB 3.67Å; A387-F405 HydrophobicContact CB-CD1 3.87Å; A387-F405 HydrophobicContact CB-CD2 4.1Å; A387-F405 HydrophobicContact CB-CG 3.62Å; A387-Q440 VanDerWaalsContact O-CG 3.24Å; A387-Q440 WeakPolarHBondContact O-CG 3.09Å; A387-Q440 PolarHBondContact O-NE2 3.24Å
388	T	95.7	Very high	89	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.26	C	S	.	.	S	Bend	trans	-142.8	162.4	-179.7	-160.2	0	0	0	0	112.1	R359 Y386 E392 G393 A394 F441	R359-T388 HydrophobicContact CB-CG2 4.3Å; R359-T388 VanDerWaalsContact CD-O 3.29Å; R359-T388 WeakPolarHBondContact CD-O 3.45Å; R359-T388 HydrophobicContact CG-CG2 4.02Å; R359-T388 PolarHBondContact NH1-O 2.69Å; Y386-T388 WeakPolarHBondContact CB-O 3.34Å; Y386-T388 PolarHBondContact O-N 3.41Å; T388-E392 HydrophobicContact CG2-CB 4.47Å; T388-E392 WeakPolarHBondContact CG2-O 3.49Å; T388-E392 WeakPolarHBondContact OG1-CB 3.4Å; T388-G393 VanDerWaalsContact CB-O 3.23Å; T388-G393 WeakPolarHBondContact CB-O 3.49Å; T388-G393 PolarHBondContact OG1-O 2.72Å; T388-A394 HydrophobicContact CG2-CB 4.3Å; T388-F441 CarbonylContact C-O 3.58Å; T388-F441 VanDerWaalsContact CA-O 3.23Å; T388-F441 WeakPolarHBondContact CA-O 3.16Å
389	S	93.8	Very high	89.1	Confident	41 Å²	41	47 Å²	47	29%	0.287	26%	0.26	S	S	.	.			trans	-69.3	160.7	178	-67.8	0	0	0	0	111.8	R359 G391 E392 F441	R359-S389 VanDerWaalsContact NH1-C 3.31Å; S389-G391 PolarHBondContact O-N 3.14Å; S389-E392 PolarHBondContact O-N 2.96Å; S389-E392 VanDerWaalsContact O-N 3.11Å; S389-F441 PolarHBondContact N-O 2.98Å; S389-F441 PolarHBondContact OG-O 2.87Å; S389-F441 VanDerWaalsContact OG-O 3.07Å
390	F	91.9	Very high	89.2	Confident	135 Å²	135	49 Å²	49	59%	0.592	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	129.7	173.4	177.1	-101.4	0	0	0	111.8	E311 R359 E392 E443	E311-F390 VanDerWaalsContact CD-CD2 3.45Å; E311-F390 HydrophobicContact CG-CD2 4.41Å; E311-F390 HydrophobicContact CG-CE2 4.14Å; E311-F390 WeakPolarHBondContact OE1-CD2 3.34Å; E311-F390 WeakPolarHBondContact OE1-CE2 3.37Å; R359-F390 VanDerWaalsContact NH1-N 3.11Å; F390-E392 VanDerWaalsContact C-N 3.28Å; F390-E392 PolarHBondContact O-N 2.91Å; F390-E443 PolarHBondContact N-OE2 3.03Å
391	G	89.5	Confident	88.9	Confident	30 Å²	30	46 Å²	46	31%	0.309	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	10.8	178.5	0	0	0	0	0	115	R359 R360 S389	R359-G391 WeakPolarHBondContact O-CA 3.4Å; R359-G391 PolarHBondContact O-N 2.96Å; R360-G391 VanDerWaalsContact CG-O 3.28Å; R360-G391 WeakPolarHBondContact CG-O 3.39Å; S389-G391 PolarHBondContact O-N 3.14Å
392	E	91.9	Very high	88.8	Confident	83 Å²	83	45.7 Å²	45.7	39%	0.388	26%	0.263	S	S	.	.			trans	-114.6	167.7	-179	-68.3	-59.3	161.9	0	0	114	R359 R360 T388 S389 F390	R359-E392 PolarHBondContact N-O 3.48Å; R360-E392 IonicContact CZ-OE2 3.57Å; R360-E392 IonicContact NE-OE2 3.1Å; R360-E392 IonicContact NH2-OE2 2.69Å; R360-E392 PolarHBondContact NH2-OE2 2.77Å; T388-E392 HydrophobicContact CG2-CB 4.47Å; T388-E392 WeakPolarHBondContact CG2-O 3.49Å; T388-E392 WeakPolarHBondContact OG1-CB 3.4Å; S389-E392 PolarHBondContact O-N 2.96Å; S389-E392 VanDerWaalsContact O-N 3.11Å; F390-E392 VanDerWaalsContact C-N 3.28Å; F390-E392 PolarHBondContact O-N 2.91Å
393	G	89.3	Confident	88.6	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.01	26%	0.262	C	S	.	.			trans	-87.5	152	177.3	0	0	0	0	0	112.5	T388 Y395	T388-G393 VanDerWaalsContact CB-O 3.23Å; T388-G393 WeakPolarHBondContact CB-O 3.49Å; T388-G393 PolarHBondContact OG1-O 2.72Å; G393-Y395 WeakPolarHBondContact O-CE2 3.44Å
394	A	89.3	Confident	88.5	Confident	20 Å²	20	46 Å²	46	17%	0.165	27%	0.265	C	S	.	.			trans	-107.8	136.9	163.4	0	0	0	0	0	108.4	I357 C358 A387 T388	I357-A394 VanDerWaalsContact O-CB 3.3Å; I357-A394 WeakPolarHBondContact O-CB 3.44Å; C358-A394 PolarHBondContact SG-N 2.84Å; C358-A394 VanDerWaalsContact SG-N 3.37Å; A387-A394 HydrophobicContact CB-CB 4.28Å; T388-A394 HydrophobicContact CG2-CB 4.3Å
395	Y	88.7	Confident	88.5	Confident	87 Å²	87	45.5 Å²	45.5	34%	0.341	26%	0.263	S	S	.	.			trans	-122	146.5	-164.6	-64.5	-92.2	0	0	0	112.6	R360 G393 V404 V439 Q440	R360-Y395 PolarHBondContact NH2-OH 3.25Å; G393-Y395 WeakPolarHBondContact O-CE2 3.44Å; Y395-V404 WeakPolarHBondContact O-CB 3.43Å; Y395-V404 VanDerWaalsContact O-CG2 3.29Å; Y395-V404 WeakPolarHBondContact O-CG2 3.36Å; Y395-V404 PolarHBondContact O-N 2.98Å; Y395-V404 VanDerWaalsContact O-N 3.11Å; Y395-V439 HydrophobicContact CD2-CB 4.21Å; Y395-V439 HydrophobicContact CD2-CG2 4.07Å; Y395-V439 HydrophobicContact CE2-CB 3.85Å; Y395-V439 HydrophobicContact CE2-CG2 4.24Å; Y395-V439 VanDerWaalsContact CE2-O 3.32Å; Y395-V439 WeakPolarHBondContact CE2-O 3.33Å; Y395-Q440 HydrophobicContact CD2-CB 4.1Å
396	E	85.8	Confident	88.4	Confident	53 Å²	53	45.5 Å²	45.5	25%	0.248	26%	0.263	C	S	.	.			trans	-112.6	149.1	164.5	60	179.8	-168.2	0	0	110	L229 L230 T231	L229-E396 WeakPolarHBondContact CA-OE1 3.34Å; L230-E396 VanDerWaalsContact N-CD 3.29Å; L230-E396 PolarHBondContact N-OE1 2.88Å; L230-E396 PolarHBondContact N-OE2 2.73Å; T231-E396 WeakPolarHBondContact CB-OE2 3.33Å; T231-E396 HydrophobicContact CG2-CB 3.89Å; T231-E396 PolarHBondContact N-OE2 2.96Å; T231-E396 VanDerWaalsContact OG1-CB 3.26Å; T231-E396 WeakPolarHBondContact OG1-CB 3.43Å; T231-E396 PolarHBondContact OG1-OE2 3.04Å
397	V	79.5	Confident	88.2	Confident	63 Å²	63	48.1 Å²	48.1	38%	0.382	27%	0.274	S	S	.	.			trans	-110.8	124.5	-177.4	-179.6	0	0	0	0	109	G399 E400 V404	V397-G399 PolarHBondContact O-N 2.62Å; V397-E400 HydrophobicContact CB-CB 4.08Å; V397-E400 HydrophobicContact CB-CG 3.82Å; V397-E400 HydrophobicContact CG1-CG 3.88Å; V397-E400 WeakPolarHBondContact O-CB 3.34Å; V397-E400 PolarHBondContact O-N 2.76Å; V397-V404 HydrophobicContact CG2-CG2 3.99Å
398	V	73.7	Confident	88.2	Confident	130 Å²	130	48.7 Å²	48.7	79%	0.788	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	122.1	177.9	-179.5	0	0	0	0	109.9	L230	L230-V398 HydrophobicContact CD1-CG2 4.27Å
399	G	69.8	Low	88.3	Confident	79 Å²	79	48.8 Å²	48.8	81%	0.814	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.1	-9.4	-179.9	0	0	0	0	0	114.8	V397	V397-G399 PolarHBondContact O-N 2.62Å
400	E	77.4	Confident	88.4	Confident	85 Å²	85	50.6 Å²	50.6	40%	0.397	28%	0.279	S	S	.	.			trans	-82.8	148.4	165.5	-71.6	-81.7	-163.8	0	0	110	V397 K407	V397-E400 HydrophobicContact CB-CB 4.08Å; V397-E400 HydrophobicContact CB-CG 3.82Å; V397-E400 HydrophobicContact CG1-CG 3.88Å; V397-E400 WeakPolarHBondContact O-CB 3.34Å; V397-E400 PolarHBondContact O-N 2.76Å; E400-K407 IonicContact OE1-NZ 2.93Å; E400-K407 PolarHBondContact OE1-NZ 3.41Å
401	L	80.1	Confident	88.6	Confident	118 Å²	118	49.5 Å²	49.5	62%	0.618	27%	0.274	S	S	*	.	S	Bend	trans	-76.2	-28.1	179.3	-71.8	170.4	0	0	0	112.7	Y234	Y234-L401 WeakPolarHBondContact CB-O 3.37Å
402	N	88.9	Confident	89	Confident	9 Å²	9	49.3 Å²	49.3	5%	0.048	27%	0.265	C	S	.	.	S	Bend	trans	-125.4	153	-174.5	-68.3	119.6	0	0	0	111	D235 M406 K407 K410	D235-N402 WeakPolarHBondContact OD1-CA 3.45Å; D235-N402 WeakPolarHBondContact OD1-CB 3.4Å; D235-N402 PolarHBondContact OD1-ND2 3.49Å; N402-M406 HydrophobicContact CB-CB 4.32Å; N402-M406 HydrophobicContact CB-CG 4.47Å; N402-K407 HydrophobicContact CB-CB 4.44Å; N402-K410 PolarHBondContact OD1-NZ 2.77Å
403	G	90.5	Very high	89.2	Confident	2 Å²	2	45.4 Å²	45.4	2%	0.021	25%	0.246	C	C	.	.			trans	-60	161	167.2	0	0	0	0	0	111.7	D235 F405 M406 K407	D235-G403 PolarHBondContact OD1-N 3.12Å; D235-G403 WeakPolarHBondContact OD2-CA 3.4Å; D235-G403 PolarHBondContact OD2-N 3.18Å; G403-F405 VanDerWaalsContact C-N 3.28Å; G403-F405 PolarHBondContact O-N 2.97Å; G403-M406 PolarHBondContact O-N 3.49Å; G403-K407 VanDerWaalsContact O-CB 3.3Å; G403-K407 WeakPolarHBondContact O-CB 3.5Å; G403-K407 PolarHBondContact O-N 3.37Å
404	V	93.7	Very high	89.4	Confident	12 Å²	12	48.8 Å²	48.8	7%	0.073	26%	0.262	C	S	.	.	H	α-helix	trans	-56.9	-43.5	-175	169.6	0	0	0	0	111.1	Y395 V397 K407 Y408 L430 A436	Y395-V404 WeakPolarHBondContact O-CB 3.43Å; Y395-V404 VanDerWaalsContact O-CG2 3.29Å; Y395-V404 WeakPolarHBondContact O-CG2 3.36Å; Y395-V404 PolarHBondContact O-N 2.98Å; Y395-V404 VanDerWaalsContact O-N 3.11Å; V397-V404 HydrophobicContact CG2-CG2 3.99Å; V404-K407 WeakPolarHBondContact O-CB 3.45Å; V404-Y408 HydrophobicContact CG1-CE2 4.24Å; V404-Y408 WeakPolarHBondContact O-CD2 3.45Å; V404-Y408 WeakPolarHBondContact O-CE2 3.32Å; V404-L430 HydrophobicContact CG1-CD2 3.65Å; V404-A436 HydrophobicContact CG1-CB 3.75Å
405	F	96.5	Very high	89.7	Confident	1 Å²	1	51.2 Å²	51.2	0%	0.004	27%	0.272	C	S	.	.	H	α-helix	trans	-65.9	-52.3	-179.8	-180	-120.4	0	0	0	112.3	D356 A387 G403 K407 Y408 L409 L423 V426 P442	D356-F405 HydrophobicContact CB-CD1 4.28Å; A387-F405 HydrophobicContact CB-CB 3.67Å; A387-F405 HydrophobicContact CB-CD1 3.87Å; A387-F405 HydrophobicContact CB-CD2 4.1Å; A387-F405 HydrophobicContact CB-CG 3.62Å; G403-F405 VanDerWaalsContact C-N 3.28Å; G403-F405 PolarHBondContact O-N 2.97Å; F405-K407 VanDerWaalsContact C-N 3.27Å; F405-K407 PolarHBondContact O-N 3.13Å; F405-Y408 PolarHBondContact O-N 3.49Å; F405-L409 HydrophobicContact CD1-CD2 4.35Å; F405-L409 HydrophobicContact CE1-CD2 3.69Å; F405-L409 HydrophobicContact CZ-CD2 3.96Å; F405-L409 WeakPolarHBondContact O-CB 3.34Å; F405-L409 PolarHBondContact O-N 3.01Å; F405-L423 HydrophobicContact CE2-CD2 4.16Å; F405-L423 HydrophobicContact CZ-CD2 3.83Å; F405-V426 HydrophobicContact CD2-CG1 4.09Å; F405-V426 HydrophobicContact CE2-CG1 4.02Å; F405-P442 HydrophobicContact CD2-CG 4.12Å; F405-P442 HydrophobicContact CE2-CB 4.3Å; F405-P442 HydrophobicContact CE2-CG 4.3Å
406	M	96.5	Very high	89.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.8	-31.9	-178.8	-171.2	55.1	64.2	0	0	113.1	D235 V238 L239 Y304 N402 G403 Y408 L409 K410	D235-M406 HydrophobicContact CB-CB 3.93Å; D235-M406 HydrophobicContact CB-CE 4.44Å; D235-M406 HydrophobicContact CB-CG 3.89Å; D235-M406 VanDerWaalsContact CG-CB 3.47Å; D235-M406 WeakPolarHBondContact OD1-CB 3.4Å; V238-M406 HydrophobicContact CG1-CG 4.37Å; V238-M406 HydrophobicContact CG1-SD 4.24Å; L239-M406 HydrophobicContact CB-CE 3.84Å; L239-M406 HydrophobicContact CB-SD 4.45Å; L239-M406 HydrophobicContact CD1-CE 4.43Å; L239-M406 HydrophobicContact CD2-CE 4.39Å; L239-M406 HydrophobicContact CG-CE 4.44Å; Y304-M406 HydrophobicContact CE1-CE 3.94Å; Y304-M406 HydrophobicContact CE2-CE 4.06Å; Y304-M406 WeakPolarHBondContact OH-CE 3.43Å; N402-M406 HydrophobicContact CB-CB 4.32Å; N402-M406 HydrophobicContact CB-CG 4.47Å; G403-M406 PolarHBondContact O-N 3.49Å; M406-Y408 PolarHBondContact O-N 2.9Å; M406-L409 HydrophobicContact CE-CD2 4.04Å; M406-L409 PolarHBondContact O-N 2.88Å; M406-L409 HydrophobicContact SD-CB 4.4Å; M406-L409 HydrophobicContact SD-CD2 4.31Å; M406-K410 WeakPolarHBondContact O-CG 3.3Å; M406-K410 PolarHBondContact O-N 2.98Å; M406-K410 VanDerWaalsContact O-N 3.17Å; M406-K410 HydrophobicContact SD-CB 4.37Å
407	K	93.8	Very high	90.4	Very high	61 Å²	61	54 Å²	54	27%	0.265	28%	0.281	S	S	.	.	H	α-helix	trans	-52	-38.5	174.8	177.8	175.6	176.1	172.2	0	112.7	E400 N402 G403 V404 F405	E400-K407 IonicContact OE1-NZ 2.93Å; E400-K407 PolarHBondContact OE1-NZ 3.41Å; N402-K407 HydrophobicContact CB-CB 4.44Å; G403-K407 VanDerWaalsContact O-CB 3.3Å; G403-K407 WeakPolarHBondContact O-CB 3.5Å; G403-K407 PolarHBondContact O-N 3.37Å; V404-K407 WeakPolarHBondContact O-CB 3.45Å; F405-K407 VanDerWaalsContact C-N 3.27Å; F405-K407 PolarHBondContact O-N 3.13Å
408	Y	95.8	Very high	91.1	Very high	13 Å²	13	52.2 Å²	52.2	5%	0.051	27%	0.271	C	S	.	.	H	α-helix	trans	-96.2	-39.2	177.7	-55.2	-82.9	0	0	0	112.5	V404 F405 M406 K410 K411 D429 L430 D433	V404-Y408 HydrophobicContact CG1-CE2 4.24Å; V404-Y408 WeakPolarHBondContact O-CD2 3.45Å; V404-Y408 WeakPolarHBondContact O-CE2 3.32Å; F405-Y408 PolarHBondContact O-N 3.49Å; M406-Y408 PolarHBondContact O-N 2.9Å; Y408-K410 VanDerWaalsContact C-N 3.3Å; Y408-K410 PolarHBondContact O-N 3.26Å; Y408-K411 WeakPolarHBondContact O-CB 3.21Å; Y408-K411 WeakPolarHBondContact O-CG 3.49Å; Y408-K411 PolarHBondContact O-N 3.04Å; Y408-K411 VanDerWaalsContact O-N 3.14Å; Y408-D429 HydrophobicContact CD1-CB 3.69Å; Y408-D429 HydrophobicContact CE1-CB 4.43Å; Y408-D429 HydrophobicContact CG-CB 4.25Å; Y408-L430 HydrophobicContact CD2-CD1 4.12Å; Y408-L430 HydrophobicContact CD2-CD2 3.73Å; Y408-L430 HydrophobicContact CD2-CG 3.66Å; Y408-L430 HydrophobicContact CE2-CD2 3.49Å; Y408-L430 VanDerWaalsContact CE2-CD2 3.49Å; Y408-L430 HydrophobicContact CE2-CG 3.89Å; Y408-L430 HydrophobicContact CG-CG 4.24Å; Y408-D433 WeakPolarHBondContact OH-CB 3.21Å; Y408-D433 VanDerWaalsContact OH-CG 3.24Å; Y408-D433 PolarHBondContact OH-OD2 3.08Å
409	L	97.6	Very high	92.2	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-54.6	-44.7	-178.4	179.5	62.8	0	0	0	112.4	L354 F405 M406 K411 Y412 L413 I422 L423 V426	L354-L409 HydrophobicContact CD1-CD2 4.03Å; F405-L409 HydrophobicContact CD1-CD2 4.35Å; F405-L409 HydrophobicContact CE1-CD2 3.69Å; F405-L409 HydrophobicContact CZ-CD2 3.96Å; F405-L409 WeakPolarHBondContact O-CB 3.34Å; F405-L409 PolarHBondContact O-N 3.01Å; M406-L409 HydrophobicContact CE-CD2 4.04Å; M406-L409 PolarHBondContact O-N 2.88Å; M406-L409 HydrophobicContact SD-CB 4.4Å; M406-L409 HydrophobicContact SD-CD2 4.31Å; L409-K411 PolarHBondContact O-N 3.49Å; L409-Y412 PolarHBondContact O-N 3.5Å; L409-L413 HydrophobicContact CD1-CD2 3.96Å; L409-L413 HydrophobicContact CD1-CG 4.39Å; L409-L413 HydrophobicContact CD2-CD2 4.31Å; L409-L413 HydrophobicContact CG-CD1 4.38Å; L409-L413 HydrophobicContact CG-CD2 3.94Å; L409-L413 HydrophobicContact CG-CG 4.09Å; L409-L413 PolarHBondContact O-N 3.23Å; L409-I422 HydrophobicContact CD1-CG2 3.95Å; L409-L423 HydrophobicContact CD1-CD2 4.25Å; L409-V426 HydrophobicContact CB-CG2 4.17Å; L409-V426 HydrophobicContact CD1-CG2 3.96Å
410	K	95.8	Very high	93.4	Very high	80 Å²	80	43.7 Å²	43.7	35%	0.348	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-20.7	-177.6	72.6	-175.4	179.7	-179.4	0	114.9	V238 N402 M406 Y408 Y412	V238-K410 HydrophobicContact CG1-CB 3.74Å; V238-K410 HydrophobicContact CG1-CD 3.9Å; V238-K410 HydrophobicContact CG1-CG 4.49Å; N402-K410 PolarHBondContact OD1-NZ 2.77Å; M406-K410 WeakPolarHBondContact O-CG 3.3Å; M406-K410 PolarHBondContact O-N 2.98Å; M406-K410 VanDerWaalsContact O-N 3.17Å; M406-K410 HydrophobicContact SD-CB 4.37Å; Y408-K410 VanDerWaalsContact C-N 3.3Å; Y408-K410 PolarHBondContact O-N 3.26Å; K410-Y412 PolarHBondContact O-N 2.85Å
411	K	96.6	Very high	94.3	Very high	111 Å²	111	43 Å²	43	48%	0.483	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-21.8	178.8	-58.2	179.7	-170.3	174.3	0	113	Y408 L409 D429	Y408-K411 WeakPolarHBondContact O-CB 3.21Å; Y408-K411 WeakPolarHBondContact O-CG 3.49Å; Y408-K411 PolarHBondContact O-N 3.04Å; Y408-K411 VanDerWaalsContact O-N 3.14Å; L409-K411 PolarHBondContact O-N 3.49Å; K411-D429 IonicContact NZ-OD2 2.74Å; K411-D429 PolarHBondContact NZ-OD2 3.18Å
412	Y	97.8	Very high	95.1	Very high	27 Å²	27	37.5 Å²	37.5	11%	0.106	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121	-11.4	-167.1	-54.8	-58	0	0	0	114	L409 K410 Q414 L415 L425 V426 D429	L409-Y412 PolarHBondContact O-N 3.5Å; K410-Y412 PolarHBondContact O-N 2.85Å; Y412-Q414 PolarHBondContact O-N 3.27Å; Y412-L415 HydrophobicContact CD1-CD1 3.79Å; Y412-L415 WeakPolarHBondContact O-CB 3.35Å; Y412-L415 PolarHBondContact O-N 3.38Å; Y412-L425 HydrophobicContact CD1-CB 4.36Å; Y412-L425 HydrophobicContact CD1-CD1 4.11Å; Y412-L425 HydrophobicContact CD2-CB 4Å; Y412-L425 HydrophobicContact CE1-CB 4.29Å; Y412-L425 HydrophobicContact CE1-CD1 4.43Å; Y412-L425 HydrophobicContact CE2-CB 3.91Å; Y412-L425 HydrophobicContact CG-CB 4.21Å; Y412-L425 HydrophobicContact CG-CD1 4.39Å; Y412-V426 HydrophobicContact CD2-CG2 3.8Å; Y412-V426 HydrophobicContact CE2-CG2 4.25Å; Y412-D429 PolarHBondContact OH-OD1 3.2Å; Y412-D429 PolarHBondContact OH-OD2 3.08Å
413	L	95.3	Very high	95.5	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-36.3	-176.6	-73.3	170.9	0	0	0	113.4	L239 N242 L246 L409 L415 L454	L239-L413 HydrophobicContact CD1-CD1 3.51Å; L239-L413 HydrophobicContact CD1-CD2 3.98Å; L239-L413 HydrophobicContact CD1-CG 4.42Å; N242-L413 HydrophobicContact CB-CB 4.12Å; N242-L413 HydrophobicContact CB-CD1 3.69Å; L246-L413 WeakPolarHBondContact CD1-O 3.37Å; L409-L413 HydrophobicContact CD1-CD2 3.96Å; L409-L413 HydrophobicContact CD1-CG 4.39Å; L409-L413 HydrophobicContact CD2-CD2 4.31Å; L409-L413 HydrophobicContact CG-CD1 4.38Å; L409-L413 HydrophobicContact CG-CD2 3.94Å; L409-L413 HydrophobicContact CG-CG 4.09Å; L409-L413 PolarHBondContact O-N 3.23Å; L413-L415 VanDerWaalsContact C-N 3.29Å; L413-L415 PolarHBondContact O-N 2.83Å; L413-L454 HydrophobicContact CD2-CD1 3.84Å
414	Q	94.3	Very high	95.8	Very high	72 Å²	72	41 Å²	41	34%	0.336	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-9.3	179.7	-61.1	-58.8	-37.1	0	0	113.7	N242 Y412	N242-Q414 VanDerWaalsContact CA-NE2 3.26Å; N242-Q414 PolarHBondContact O-NE2 2.9Å; N242-Q414 PolarHBondContact OD1-NE2 2.81Å; Y412-Q414 PolarHBondContact O-N 3.27Å
415	L	95.3	Very high	96	Very high	71 Å²	71	41.6 Å²	41.6	37%	0.372	20%	0.198	S	C	.	.	S	Bend	trans	-73.5	137.1	-179.6	-63.6	-177	0	0	0	110.2	Y412 L413 K417 L425 S453	Y412-L415 HydrophobicContact CD1-CD1 3.79Å; Y412-L415 WeakPolarHBondContact O-CB 3.35Å; Y412-L415 PolarHBondContact O-N 3.38Å; L413-L415 VanDerWaalsContact C-N 3.29Å; L413-L415 PolarHBondContact O-N 2.83Å; L415-K417 HydrophobicContact CB-CB 4.5Å; L415-K417 HydrophobicContact CB-CG 4.34Å; L415-K417 HydrophobicContact CD1-CD 4.32Å; L415-K417 PolarHBondContact O-N 2.79Å; L415-L425 HydrophobicContact CD1-CD1 4.38Å; L415-S453 PolarHBondContact O-OG 3.16Å
416	R	93.8	Very high	96	Very high	127 Å²	127	41.5 Å²	41.5	48%	0.479	20%	0.197	S	C	.	.	S	Bend	trans	-76.8	69.8	170.5	-164.6	174.3	179.9	165.7	1.7	110.9	E207 A455 P457	E207-R416 VanDerWaalsContact CD-NH2 3.29Å; E207-R416 IonicContact OE1-CZ 3.8Å; E207-R416 IonicContact OE1-NH1 2.79Å; E207-R416 PolarHBondContact OE1-NH1 2.78Å; E207-R416 IonicContact OE1-NH2 3.71Å; E207-R416 PolarHBondContact OE1-NH2 3.01Å; R416-A455 HydrophobicContact CB-CB 4.24Å; R416-A455 HydrophobicContact CG-CB 4.4Å; R416-P457 VanDerWaalsContact CZ-CD 3.46Å; R416-P457 VanDerWaalsContact NH2-CG 3.34Å
417	K	95.2	Very high	96	Very high	72 Å²	72	43 Å²	43	31%	0.313	21%	0.205	S	C	.	.	S	Bend	trans	-131.9	154.1	178.6	-74.3	-173.8	163.4	-69.6	0	111.3	L415 E421 I422 L425 S453	L415-K417 HydrophobicContact CB-CB 4.5Å; L415-K417 HydrophobicContact CB-CG 4.34Å; L415-K417 HydrophobicContact CD1-CD 4.32Å; L415-K417 PolarHBondContact O-N 2.79Å; K417-E421 WeakPolarHBondContact CD-OE1 3.31Å; K417-E421 WeakPolarHBondContact CE-OE1 3.36Å; K417-E421 IonicContact NZ-OE1 3.72Å; K417-E421 PolarHBondContact NZ-OE1 2.66Å; K417-E421 IonicContact NZ-OE2 3.94Å; K417-E421 PolarHBondContact NZ-OE2 3.38Å; K417-I422 HydrophobicContact CB-CG1 4.07Å; K417-L425 HydrophobicContact CD-CD1 4.02Å; K417-S453 PolarHBondContact N-OG 2.86Å; K417-S453 WeakPolarHBondContact O-CA 3.37Å; K417-S453 WeakPolarHBondContact O-CB 3.37Å; K417-S453 PolarHBondContact O-OG 3.17Å
418	P	95.1	Very high	96.1	Very high	24 Å²	24	47.3 Å²	47.3	16%	0.156	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-56.4	142.4	174.7	-25	36.6	0	0	0	111.4	A420 E421 I422 L451 R452	P418-A420 PolarHBondContact O-N 3.27Å; P418-E421 HydrophobicContact CB-CB 4.34Å; P418-E421 WeakPolarHBondContact CD-OE2 3.48Å; P418-E421 WeakPolarHBondContact O-CA 3.28Å; P418-E421 WeakPolarHBondContact O-CB 3.47Å; P418-E421 PolarHBondContact O-N 2.99Å; P418-I422 PolarHBondContact O-N 2.95Å; P418-L451 HydrophobicContact CB-CB 4.46Å; P418-L451 HydrophobicContact CB-CD2 4.29Å; P418-L451 HydrophobicContact CG-CB 3.77Å; P418-L451 HydrophobicContact CG-CD2 3.92Å; P418-L451 HydrophobicContact CG-CG 4.31Å; P418-R452 WeakPolarHBondContact CA-O 3.2Å
419	V	96.3	Very high	96.1	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.018	23%	0.225	C	C	.	.	H	α-helix	trans	-57.7	-38.8	-176.6	-173.5	0	0	0	0	112	M350 V352 V383 E421 I422 L423 R452 L454	M350-V419 HydrophobicContact CE-CG2 4.18Å; M350-V419 HydrophobicContact SD-CG2 3.85Å; V352-V419 HydrophobicContact CG1-CG1 4.05Å; V352-V419 HydrophobicContact CG2-CG1 4.29Å; V352-V419 HydrophobicContact CG2-CG2 4.1Å; V383-V419 HydrophobicContact CB-CG1 4.48Å; V383-V419 HydrophobicContact CG1-CB 4.31Å; V383-V419 HydrophobicContact CG1-CG1 3.83Å; V419-E421 VanDerWaalsContact C-N 3.33Å; V419-E421 PolarHBondContact O-N 2.78Å; V419-I422 PolarHBondContact O-N 2.83Å; V419-L423 HydrophobicContact CG1-CD1 4.24Å; V419-L423 WeakPolarHBondContact O-CG 3.4Å; V419-L423 PolarHBondContact O-N 2.91Å; V419-L423 VanDerWaalsContact O-N 3.08Å; V419-R452 PolarHBondContact N-O 2.55Å; V419-L454 HydrophobicContact CG2-CD2 4.14Å; V419-L454 HydrophobicContact CG2-CG 4.02Å
420	A	95.5	Very high	95.8	Very high	27 Å²	27	48.2 Å²	48.2	22%	0.223	23%	0.225	C	C	.	.	H	α-helix	trans	-61.6	-40.2	175.4	0	0	0	0	0	112.2	V383 P418 L423 T424 V444 T446	V383-A420 HydrophobicContact CG2-CB 4.45Å; P418-A420 PolarHBondContact O-N 3.27Å; A420-L423 PolarHBondContact O-N 2.78Å; A420-T424 PolarHBondContact O-N 2.86Å; A420-T424 PolarHBondContact O-OG1 2.85Å; A420-V444 HydrophobicContact CB-CG1 4.4Å; A420-T446 HydrophobicContact CB-CG2 4.48Å
421	E	96.4	Very high	95.7	Very high	72 Å²	72	49.3 Å²	49.3	34%	0.336	23%	0.231	S	C	.	.	H	α-helix	trans	-68.6	-40.6	177.4	-165.2	-167.5	159.4	0	0	111.4	K417 P418 V419 L423 T424 L425	K417-E421 WeakPolarHBondContact CD-OE1 3.31Å; K417-E421 WeakPolarHBondContact CE-OE1 3.36Å; K417-E421 IonicContact NZ-OE1 3.72Å; K417-E421 PolarHBondContact NZ-OE1 2.66Å; K417-E421 IonicContact NZ-OE2 3.94Å; K417-E421 PolarHBondContact NZ-OE2 3.38Å; P418-E421 HydrophobicContact CB-CB 4.34Å; P418-E421 WeakPolarHBondContact CD-OE2 3.48Å; P418-E421 WeakPolarHBondContact O-CA 3.28Å; P418-E421 WeakPolarHBondContact O-CB 3.47Å; P418-E421 PolarHBondContact O-N 2.99Å; V419-E421 VanDerWaalsContact C-N 3.33Å; V419-E421 PolarHBondContact O-N 2.78Å; E421-L423 VanDerWaalsContact C-N 3.26Å; E421-L423 PolarHBondContact O-N 2.89Å; E421-T424 CarbonylContact O-C 3.5Å; E421-T424 WeakPolarHBondContact O-CB 3.46Å; E421-T424 PolarHBondContact O-N 3.46Å; E421-T424 VanDerWaalsContact O-N 3.11Å; E421-L425 WeakPolarHBondContact O-CG 3.31Å; E421-L425 PolarHBondContact O-N 3.4Å
422	I	97.5	Very high	95.5	Very high	2 Å²	2	50 Å²	50	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-54	-46.6	172.9	-72.3	174.4	0	0	0	110.2	L409 K417 P418 V419 L425 V426	L409-I422 HydrophobicContact CD1-CG2 3.95Å; K417-I422 HydrophobicContact CB-CG1 4.07Å; P418-I422 PolarHBondContact O-N 2.95Å; V419-I422 PolarHBondContact O-N 2.83Å; I422-L425 WeakPolarHBondContact O-CB 3.42Å; I422-L425 PolarHBondContact O-N 2.94Å; I422-V426 WeakPolarHBondContact O-CG2 2.98Å; I422-V426 PolarHBondContact O-N 3.29Å
423	L	97.2	Very high	95.2	Very high	3 Å²	3	50.8 Å²	50.8	2%	0.016	25%	0.246	C	C	.	.	H	α-helix	trans	-68.5	-34.2	179.4	-66	167.5	0	0	0	112	L354 V383 F405 L409 V419 A420 E421 L425 V426 M427 V444	L354-L423 HydrophobicContact CD2-CD1 4.14Å; L354-L423 HydrophobicContact CD2-CD2 4.08Å; V383-L423 HydrophobicContact CG1-CD1 3.86Å; F405-L423 HydrophobicContact CE2-CD2 4.16Å; F405-L423 HydrophobicContact CZ-CD2 3.83Å; L409-L423 HydrophobicContact CD1-CD2 4.25Å; V419-L423 HydrophobicContact CG1-CD1 4.24Å; V419-L423 WeakPolarHBondContact O-CG 3.4Å; V419-L423 PolarHBondContact O-N 2.91Å; V419-L423 VanDerWaalsContact O-N 3.08Å; A420-L423 PolarHBondContact O-N 2.78Å; E421-L423 VanDerWaalsContact C-N 3.26Å; E421-L423 PolarHBondContact O-N 2.89Å; L423-L425 VanDerWaalsContact C-N 3.35Å; L423-V426 WeakPolarHBondContact O-CB 3.22Å; L423-V426 PolarHBondContact O-N 2.96Å; L423-M427 WeakPolarHBondContact O-CG 2.92Å; L423-M427 PolarHBondContact O-N 3.14Å; L423-V444 HydrophobicContact CB-CG2 3.3Å; L423-V444 HydrophobicContact CD1-CG2 3.6Å; L423-V444 HydrophobicContact CG-CG2 4.03Å
424	T	96.5	Very high	94.8	Very high	81 Å²	81	54.4 Å²	54.4	50%	0.497	28%	0.276	S	S	.	.	H	α-helix	trans	-64	-37.5	170.2	-54.6	0	0	0	0	112.4	A420 E421 V426 M427 R428	A420-T424 PolarHBondContact O-N 2.86Å; A420-T424 PolarHBondContact O-OG1 2.85Å; E421-T424 CarbonylContact O-C 3.5Å; E421-T424 WeakPolarHBondContact O-CB 3.46Å; E421-T424 PolarHBondContact O-N 3.46Å; E421-T424 VanDerWaalsContact O-N 3.11Å; T424-V426 VanDerWaalsContact C-N 3.33Å; T424-M427 WeakPolarHBondContact O-CB 3.42Å; T424-M427 PolarHBondContact O-N 3.34Å; T424-R428 PolarHBondContact O-N 2.89Å
425	L	97.6	Very high	94.4	Very high	24 Å²	24	58.3 Å²	58.3	13%	0.126	30%	0.295	C	S	.	.	H	α-helix	trans	-64.3	-39.3	174	-68.8	171.9	0	0	0	111.5	Y412 L415 K417 E421 I422 L423 R428 D429	Y412-L425 HydrophobicContact CD1-CB 4.36Å; Y412-L425 HydrophobicContact CD1-CD1 4.11Å; Y412-L425 HydrophobicContact CD2-CB 4Å; Y412-L425 HydrophobicContact CE1-CB 4.29Å; Y412-L425 HydrophobicContact CE1-CD1 4.43Å; Y412-L425 HydrophobicContact CE2-CB 3.91Å; Y412-L425 HydrophobicContact CG-CB 4.21Å; Y412-L425 HydrophobicContact CG-CD1 4.39Å; L415-L425 HydrophobicContact CD1-CD1 4.38Å; K417-L425 HydrophobicContact CD-CD1 4.02Å; E421-L425 WeakPolarHBondContact O-CG 3.31Å; E421-L425 PolarHBondContact O-N 3.4Å; I422-L425 WeakPolarHBondContact O-CB 3.42Å; I422-L425 PolarHBondContact O-N 2.94Å; L423-L425 VanDerWaalsContact C-N 3.35Å; L425-R428 PolarHBondContact O-N 3.5Å; L425-D429 PolarHBondContact O-N 3.37Å
426	V	96.8	Very high	94	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-46.3	173	173.3	0	0	0	0	111.3	F405 L409 Y412 I422 L423 T424 R428 D429 L430 P442	F405-V426 HydrophobicContact CD2-CG1 4.09Å; F405-V426 HydrophobicContact CE2-CG1 4.02Å; L409-V426 HydrophobicContact CB-CG2 4.17Å; L409-V426 HydrophobicContact CD1-CG2 3.96Å; Y412-V426 HydrophobicContact CD2-CG2 3.8Å; Y412-V426 HydrophobicContact CE2-CG2 4.25Å; I422-V426 WeakPolarHBondContact O-CG2 2.98Å; I422-V426 PolarHBondContact O-N 3.29Å; L423-V426 WeakPolarHBondContact O-CB 3.22Å; L423-V426 PolarHBondContact O-N 2.96Å; T424-V426 VanDerWaalsContact C-N 3.33Å; V426-R428 VanDerWaalsContact C-N 3.3Å; V426-R428 PolarHBondContact O-N 3.18Å; V426-D429 PolarHBondContact O-N 3.19Å; V426-L430 HydrophobicContact CG1-CD1 3.72Å; V426-L430 PolarHBondContact O-N 3.37Å; V426-P442 HydrophobicContact CG1-CG 4.21Å
427	M	96.3	Very high	93.7	Very high	32 Å²	32	53.6 Å²	53.6	16%	0.158	28%	0.276	C	S	.	.	H	α-helix	trans	-58.4	-42.5	175.3	-66.4	168.7	-166	0	0	111.8	L423 T424 D429 L430 E431 F441 P442 V444	L423-M427 WeakPolarHBondContact O-CG 2.92Å; L423-M427 PolarHBondContact O-N 3.14Å; T424-M427 WeakPolarHBondContact O-CB 3.42Å; T424-M427 PolarHBondContact O-N 3.34Å; M427-D429 VanDerWaalsContact C-N 3.33Å; M427-D429 PolarHBondContact O-N 2.97Å; M427-L430 PolarHBondContact O-N 3.26Å; M427-E431 PolarHBondContact O-N 3.47Å; M427-F441 HydrophobicContact CB-CE1 3.9Å; M427-F441 HydrophobicContact CB-CZ 3.92Å; M427-F441 HydrophobicContact CG-CE1 3.99Å; M427-F441 HydrophobicContact CG-CZ 4.49Å; M427-F441 HydrophobicContact SD-CE1 4.44Å; M427-P442 HydrophobicContact CE-CB 4.32Å; M427-P442 WeakPolarHBondContact CE-O 3.5Å; M427-P442 HydrophobicContact CG-CB 4.07Å; M427-P442 HydrophobicContact CG-CG 4.35Å; M427-V444 HydrophobicContact CE-CB 3.96Å; M427-V444 HydrophobicContact CE-CG2 3.36Å
428	R	95.5	Very high	93.2	Very high	151 Å²	151	55.2 Å²	55.2	57%	0.57	29%	0.292	S	S	*	.	H	α-helix	trans	-63.8	-38.6	178.1	-169.2	-177	71.6	175.8	1.5	112.3	T424 L425 V426 N432	T424-R428 PolarHBondContact O-N 2.89Å; L425-R428 PolarHBondContact O-N 3.5Å; V426-R428 VanDerWaalsContact C-N 3.3Å; V426-R428 PolarHBondContact O-N 3.18Å; R428-N432 PolarHBondContact O-ND2 3.37Å
429	D	95.2	Very high	92.8	Very high	32 Å²	32	57 Å²	57	17%	0.171	30%	0.302	C	S	.	.	H	α-helix	trans	-68.1	-39.7	176.1	-108.3	30.1	0	0	0	111.5	Y408 K411 Y412 L425 V426 M427 N432	Y408-D429 HydrophobicContact CD1-CB 3.69Å; Y408-D429 HydrophobicContact CE1-CB 4.43Å; Y408-D429 HydrophobicContact CG-CB 4.25Å; K411-D429 IonicContact NZ-OD2 2.74Å; K411-D429 PolarHBondContact NZ-OD2 3.18Å; Y412-D429 PolarHBondContact OH-OD1 3.2Å; Y412-D429 PolarHBondContact OH-OD2 3.08Å; L425-D429 PolarHBondContact O-N 3.37Å; V426-D429 PolarHBondContact O-N 3.19Å; M427-D429 VanDerWaalsContact C-N 3.33Å; M427-D429 PolarHBondContact O-N 2.97Å; D429-N432 PolarHBondContact O-N 3.42Å
430	L	92.9	Very high	92.6	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-66.1	-37.1	176.2	-84.3	153.1	0	0	0	113.1	V404 Y408 V426 M427 N432 D433 A436 K437 P442	V404-L430 HydrophobicContact CG1-CD2 3.65Å; Y408-L430 HydrophobicContact CD2-CD1 4.12Å; Y408-L430 HydrophobicContact CD2-CD2 3.73Å; Y408-L430 HydrophobicContact CD2-CG 3.66Å; Y408-L430 HydrophobicContact CE2-CD2 3.49Å; Y408-L430 VanDerWaalsContact CE2-CD2 3.49Å; Y408-L430 HydrophobicContact CE2-CG 3.89Å; Y408-L430 HydrophobicContact CG-CG 4.24Å; V426-L430 HydrophobicContact CG1-CD1 3.72Å; V426-L430 PolarHBondContact O-N 3.37Å; M427-L430 PolarHBondContact O-N 3.26Å; L430-N432 PolarHBondContact O-N 2.86Å; L430-D433 PolarHBondContact O-N 3.3Å; L430-A436 HydrophobicContact CD2-CB 3.5Å; L430-K437 WeakPolarHBondContact O-CB 3.24Å; L430-P442 VanDerWaalsContact CD1-CD 3.47Å; L430-P442 HydrophobicContact CD1-CG 3.34Å
431	E	92.9	Very high	92.5	Very high	103 Å²	103	58.7 Å²	58.7	48%	0.481	31%	0.305	S	S	.	.	H	α-helix	trans	-56.6	-32.1	174	-177.4	58.4	-148.5	0	0	112.4	M427 D433 K437 F441	M427-E431 PolarHBondContact O-N 3.47Å; E431-D433 VanDerWaalsContact C-N 3.34Å; E431-K437 WeakPolarHBondContact O-CD 3.38Å; E431-F441 HydrophobicContact CB-CE2 4.3Å
432	N	92.7	Very high	92.5	Very high	127 Å²	127	55.6 Å²	55.6	68%	0.679	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-9.4	178.6	-66.7	-55.8	0	0	0	113.4	R428 D429 L430	R428-N432 PolarHBondContact O-ND2 3.37Å; D429-N432 PolarHBondContact O-N 3.42Å; L430-N432 PolarHBondContact O-N 2.86Å
433	D	91.4	Very high	92.4	Very high	42 Å²	42	58.7 Å²	58.7	23%	0.225	31%	0.305	C	S	.	.			trans	-89.4	113.3	176	-167.2	-64.6	0	0	0	111	Y408 L430 E431 Q435 A436 K437	Y408-D433 WeakPolarHBondContact OH-CB 3.21Å; Y408-D433 VanDerWaalsContact OH-CG 3.24Å; Y408-D433 PolarHBondContact OH-OD2 3.08Å; L430-D433 PolarHBondContact O-N 3.3Å; E431-D433 VanDerWaalsContact C-N 3.34Å; D433-Q435 PolarHBondContact O-N 3.13Å; D433-Q435 PolarHBondContact OD1-N 3.26Å; D433-A436 HydrophobicContact CB-CB 3.96Å; D433-A436 PolarHBondContact OD1-N 3.45Å; D433-K437 VanDerWaalsContact O-CB 3.25Å; D433-K437 WeakPolarHBondContact O-CB 3.18Å; D433-K437 WeakPolarHBondContact O-CD 3.34Å; D433-K437 WeakPolarHBondContact O-CG 3.07Å; D433-K437 PolarHBondContact O-N 3.26Å; D433-K437 VanDerWaalsContact O-N 3.12Å
434	A	87.4	Confident	92.3	Very high	77 Å²	77	60.5 Å²	60.5	64%	0.636	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-25.8	-174.5	0	0	0	0	0	114.3
435	Q	86.2	Confident	92.2	Very high	154 Å²	154	63.6 Å²	63.6	72%	0.72	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-49.5	178.6	-73.4	-173	-14.6	0	0	111.3	D433 K437 T438	D433-Q435 PolarHBondContact O-N 3.13Å; D433-Q435 PolarHBondContact OD1-N 3.26Å; Q435-K437 PolarHBondContact O-N 2.8Å; Q435-T438 PolarHBondContact O-N 3.42Å; Q435-T438 PolarHBondContact O-OG1 2.83Å
436	A	85.3	Confident	92	Very high	7 Å²	7	65.9 Å²	65.9	6%	0.058	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-66.2	-39.6	-174.2	0	0	0	0	0	111.9	V404 L430 D433 T438 V439 Q440	V404-A436 HydrophobicContact CG1-CB 3.75Å; L430-A436 HydrophobicContact CD2-CB 3.5Å; D433-A436 HydrophobicContact CB-CB 3.96Å; D433-A436 PolarHBondContact OD1-N 3.45Å; A436-T438 PolarHBondContact O-N 2.98Å; A436-V439 WeakPolarHBondContact O-CG2 3.45Å; A436-V439 PolarHBondContact O-N 3.2Å; A436-Q440 PolarHBondContact O-N 2.82Å
437	K	87.4	Confident	91.8	Very high	93 Å²	93	68.9 Å²	68.9	40%	0.404	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-59	-23.8	-176.6	76.9	-173.6	-174.6	174.3	0	115.3	L430 E431 D433 Q435	L430-K437 WeakPolarHBondContact O-CB 3.24Å; E431-K437 WeakPolarHBondContact O-CD 3.38Å; D433-K437 VanDerWaalsContact O-CB 3.25Å; D433-K437 WeakPolarHBondContact O-CB 3.18Å; D433-K437 WeakPolarHBondContact O-CD 3.34Å; D433-K437 WeakPolarHBondContact O-CG 3.07Å; D433-K437 PolarHBondContact O-N 3.26Å; D433-K437 VanDerWaalsContact O-N 3.12Å; Q435-K437 PolarHBondContact O-N 2.8Å
438	T	85.9	Confident	91.4	Very high	106 Å²	106	69 Å²	69	65%	0.65	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-89	-15.6	-177.3	59.9	0	0	0	0	112.9	Q435 A436	Q435-T438 PolarHBondContact O-N 3.42Å; Q435-T438 PolarHBondContact O-OG1 2.83Å; A436-T438 PolarHBondContact O-N 2.98Å
439	V	85.5	Confident	90.9	Very high	60 Å²	60	65.8 Å²	65.8	36%	0.364	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.5	-26.8	-173.4	-62.2	0	0	0	0	113.3	Y395 A436	Y395-V439 HydrophobicContact CD2-CB 4.21Å; Y395-V439 HydrophobicContact CD2-CG2 4.07Å; Y395-V439 HydrophobicContact CE2-CB 3.85Å; Y395-V439 HydrophobicContact CE2-CG2 4.24Å; Y395-V439 VanDerWaalsContact CE2-O 3.32Å; Y395-V439 WeakPolarHBondContact CE2-O 3.33Å; A436-V439 WeakPolarHBondContact O-CG2 3.45Å; A436-V439 PolarHBondContact O-N 3.2Å
440	Q	92.7	Very high	90.6	Very high	2 Å²	2	68.6 Å²	68.6	1%	0.009	36%	0.361	C	S	.	.			trans	-146.3	124.7	-175	-178.5	172	-11.5	0	0	110.3	A387 Y395 A436	A387-Q440 VanDerWaalsContact O-CG 3.24Å; A387-Q440 WeakPolarHBondContact O-CG 3.09Å; A387-Q440 PolarHBondContact O-NE2 3.24Å; Y395-Q440 HydrophobicContact CD2-CB 4.1Å; A436-Q440 PolarHBondContact O-N 2.82Å
441	F	93.2	Very high	90.4	Very high	65 Å²	65	73.5 Å²	73.5	29%	0.285	39%	0.387	S	S	.	.			trans	-135.7	124.9	173.4	-152.8	-91.8	0	0	0	109.8	T388 S389 M427 E431	T388-F441 CarbonylContact C-O 3.58Å; T388-F441 VanDerWaalsContact CA-O 3.23Å; T388-F441 WeakPolarHBondContact CA-O 3.16Å; S389-F441 PolarHBondContact N-O 2.98Å; S389-F441 PolarHBondContact OG-O 2.87Å; S389-F441 VanDerWaalsContact OG-O 3.07Å; M427-F441 HydrophobicContact CB-CE1 3.9Å; M427-F441 HydrophobicContact CB-CZ 3.92Å; M427-F441 HydrophobicContact CG-CE1 3.99Å; M427-F441 HydrophobicContact CG-CZ 4.49Å; M427-F441 HydrophobicContact SD-CE1 4.44Å; E431-F441 HydrophobicContact CB-CE2 4.3Å
442	P	95.7	Very high	90.4	Very high	6 Å²	6	69.6 Å²	69.6	4%	0.039	37%	0.368	C	S	.	.			trans	-67.3	156.3	-176.7	-22.7	34.3	0	0	0	113	Y386 F405 V426 M427 L430	Y386-P442 CarbonylContact O-C 3.51Å; Y386-P442 WeakPolarHBondContact O-CA 3.36Å; Y386-P442 VanDerWaalsContact O-CB 3.29Å; Y386-P442 WeakPolarHBondContact O-CB 3.45Å; F405-P442 HydrophobicContact CD2-CG 4.12Å; F405-P442 HydrophobicContact CE2-CB 4.3Å; F405-P442 HydrophobicContact CE2-CG 4.3Å; V426-P442 HydrophobicContact CG1-CG 4.21Å; M427-P442 HydrophobicContact CE-CB 4.32Å; M427-P442 WeakPolarHBondContact CE-O 3.5Å; M427-P442 HydrophobicContact CG-CB 4.07Å; M427-P442 HydrophobicContact CG-CG 4.35Å; L430-P442 VanDerWaalsContact CD1-CD 3.47Å; L430-P442 HydrophobicContact CD1-CG 3.34Å
443	E	95.9	Very high	90.5	Very high	67 Å²	67	63.7 Å²	63.7	31%	0.313	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	145.6	174.6	-170.3	-174.7	144.9	0	0	110.2	R359 Y386 F390	R359-E443 IonicContact CZ-OE2 3.72Å; R359-E443 IonicContact NH1-OE2 3.62Å; R359-E443 PolarHBondContact NH1-OE2 2.77Å; R359-E443 IonicContact NH2-OE2 3.23Å; Y386-E443 HydrophobicContact CD2-CB 4.2Å; Y386-E443 PolarHBondContact N-O 3.03Å; Y386-E443 PolarHBondContact O-N 3.24Å; F390-E443 PolarHBondContact N-OE2 3.03Å
444	V	96.1	Very high	90.6	Very high	41 Å²	41	62 Å²	62	25%	0.248	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	129.1	176.2	169.2	0	0	0	0	109.9	A420 L423 M427 T446	A420-V444 HydrophobicContact CB-CG1 4.4Å; L423-V444 HydrophobicContact CB-CG2 3.3Å; L423-V444 HydrophobicContact CD1-CG2 3.6Å; L423-V444 HydrophobicContact CG-CG2 4.03Å; M427-V444 HydrophobicContact CE-CB 3.96Å; M427-V444 HydrophobicContact CE-CG2 3.36Å; V444-T446 HydrophobicContact CG1-CG2 4.34Å
445	R	94.2	Very high	91	Very high	147 Å²	147	59.1 Å²	59.1	56%	0.555	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	121.6	169.2	-177.4	178.7	174.4	-174.2	-2.2	109	V384 Y386	V384-R445 HydrophobicContact CB-CB 4.46Å; V384-R445 PolarHBondContact N-O 3.17Å; V384-R445 PolarHBondContact O-N 3.27Å; Y386-R445 HydrophobicContact CE2-CB 4.13Å
446	T	94.1	Very high	91.2	Very high	71 Å²	71	52 Å²	52	44%	0.436	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	145.5	-178.3	179.6	0	0	0	0	111.9	T382 V383 A420 V444 M448	T382-T446 WeakPolarHBondContact O-CA 3.36Å; T382-T446 PolarHBondContact O-OG1 2.98Å; V383-T446 VanDerWaalsContact CG2-OG1 3.25Å; V383-T446 WeakPolarHBondContact CG2-OG1 3.44Å; A420-T446 HydrophobicContact CB-CG2 4.48Å; V444-T446 HydrophobicContact CG1-CG2 4.34Å; T446-M448 WeakPolarHBondContact OG1-CB 3.33Å; T446-M448 PolarHBondContact OG1-N 3.27Å; T446-M448 VanDerWaalsContact OG1-N 3.07Å
447	N	90.7	Very high	91.2	Very high	64 Å²	64	53.6 Å²	53.6	34%	0.342	28%	0.28	S	S	.	.			trans	-124.7	14.6	164.7	71.7	-0.1	0	0	0	111.4	N379 R380 N381 T382 S449	N379-N447 VanDerWaalsContact O-CG 3.26Å; N379-N447 PolarHBondContact O-ND2 3.02Å; N379-N447 PolarHBondContact O-OD1 2.83Å; R380-N447 CarbonylContact C-O 3.35Å; R380-N447 WeakPolarHBondContact CA-O 3.47Å; N381-N447 PolarHBondContact N-OD1 2.79Å; T382-N447 WeakPolarHBondContact CA-OD1 3.08Å; T382-N447 VanDerWaalsContact CB-OD1 3.3Å; T382-N447 WeakPolarHBondContact CB-OD1 3.49Å; T382-N447 PolarHBondContact N-OD1 3.38Å; T382-N447 PolarHBondContact O-N 2.79Å; T382-N447 PolarHBondContact O-OD1 2.79Å; N447-S449 PolarHBondContact O-N 2.92Å
448	M	88.1	Confident	90.7	Very high	35 Å²	35	51.3 Å²	51.3	17%	0.172	27%	0.272	C	S	.	.			trans	-68.7	120.3	-174.8	-161.6	-178.3	-64.2	0	0	110.4	M350 R380 V383 T446 K450 R452	M350-M448 HydrophobicContact CG-CE 3.44Å; M350-M448 VanDerWaalsContact CG-CE 3.44Å; M350-M448 HydrophobicContact CG-SD 4.26Å; M350-M448 HydrophobicContact SD-CE 3.68Å; M350-M448 HydrophobicContact SD-SD 4.07Å; R380-M448 WeakPolarHBondContact O-CA 3.4Å; V383-M448 HydrophobicContact CB-CE 3.92Å; V383-M448 HydrophobicContact CG2-CB 4.28Å; V383-M448 HydrophobicContact CG2-CE 3.4Å; V383-M448 HydrophobicContact CG2-SD 4.41Å; T446-M448 WeakPolarHBondContact OG1-CB 3.33Å; T446-M448 PolarHBondContact OG1-N 3.27Å; T446-M448 VanDerWaalsContact OG1-N 3.07Å; M448-K450 VanDerWaalsContact CG-O 3.22Å; M448-K450 WeakPolarHBondContact CG-O 3.1Å; M448-K450 VanDerWaalsContact SD-O 3.33Å; M448-R452 HydrophobicContact SD-CB 3.96Å
449	S	85.9	Confident	89.9	Confident	82 Å²	82	49.3 Å²	49.3	57%	0.573	26%	0.257	S	S	*	.			trans	-89.2	-20.1	-179.5	62.9	0	0	0	0	113.7	R380 N447	R380-S449 PolarHBondContact O-N 2.61Å; R380-S449 PolarHBondContact O-OG 2.99Å; N447-S449 PolarHBondContact O-N 2.92Å
450	K	88	Confident	88.8	Confident	91 Å²	91	50.7 Å²	50.7	40%	0.396	26%	0.258	S	S	.	.	S	Bend	trans	-105.3	145.3	177.1	-71.4	-159.8	168.4	-145.8	0	109.9	E206 L208 M448 R452	E206-K450 IonicContact OE2-NZ 3.51Å; E206-K450 PolarHBondContact OE2-NZ 3.29Å; L208-K450 HydrophobicContact CD1-CB 3.84Å; L208-K450 HydrophobicContact CD1-CD 4.32Å; L208-K450 HydrophobicContact CD2-CD 3.84Å; M448-K450 VanDerWaalsContact CG-O 3.22Å; M448-K450 WeakPolarHBondContact CG-O 3.1Å; M448-K450 VanDerWaalsContact SD-O 3.33Å; K450-R452 HydrophobicContact CB-CG 4.35Å; K450-R452 PolarHBondContact O-N 3.44Å
451	L	90	Very high	86.6	Confident	103 Å²	103	57 Å²	57	54%	0.539	29%	0.292	S	S	.	.			trans	-79.7	54.8	-177.3	-66.8	-178.6	0	0	0	112.6	E205 P418	E205-L451 WeakPolarHBondContact OE1-CD1 3.5Å; P418-L451 HydrophobicContact CB-CB 4.46Å; P418-L451 HydrophobicContact CB-CD2 4.29Å; P418-L451 HydrophobicContact CG-CB 3.77Å; P418-L451 HydrophobicContact CG-CD2 3.92Å; P418-L451 HydrophobicContact CG-CG 4.31Å
452	R	92.2	Very high	84.5	Confident	21 Å²	21	58.4 Å²	58.4	8%	0.079	31%	0.31	C	S	.	.			trans	-72.7	138.2	-176.7	-71.2	-170.5	172.2	-75.8	0.5	112.8	L208 I209 P298 A349 M350 P418 V419 M448 K450 D456	L208-R452 HydrophobicContact CD1-CB 4.41Å; L208-R452 HydrophobicContact CD1-CG 3.53Å; I209-R452 PolarHBondContact O-NH1 3.18Å; P298-R452 VanDerWaalsContact CB-NH2 3.3Å; A349-R452 WeakPolarHBondContact O-CD 3.46Å; A349-R452 PolarHBondContact O-NE 3.36Å; M350-R452 HydrophobicContact CG-CB 4.47Å; M350-R452 HydrophobicContact SD-CB 3.49Å; M350-R452 WeakPolarHBondContact SD-CB 3.18Å; P418-R452 WeakPolarHBondContact CA-O 3.2Å; V419-R452 PolarHBondContact N-O 2.55Å; M448-R452 HydrophobicContact SD-CB 3.96Å; K450-R452 HydrophobicContact CB-CG 4.35Å; K450-R452 PolarHBondContact O-N 3.44Å; R452-D456 IonicContact NH1-OD2 2.73Å; R452-D456 PolarHBondContact NH1-OD2 3.46Å; R452-D456 VanDerWaalsContact NH1-OD2 3.12Å
453	S	94.1	Very high	82.3	Confident	3 Å²	3	63.3 Å²	63.3	2%	0.021	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-106.6	155.4	175	-170.9	0	0	0	0	111.5	L415 K417 A455 D456	L415-S453 PolarHBondContact O-OG 3.16Å; K417-S453 PolarHBondContact N-OG 2.86Å; K417-S453 WeakPolarHBondContact O-CA 3.37Å; K417-S453 WeakPolarHBondContact O-CB 3.37Å; K417-S453 PolarHBondContact O-OG 3.17Å; S453-A455 PolarHBondContact O-N 3.31Å; S453-A455 PolarHBondContact OG-N 2.77Å; S453-A455 VanDerWaalsContact OG-N 3.11Å; S453-D456 WeakPolarHBondContact CA-OD1 3.43Å; S453-D456 VanDerWaalsContact CB-OD1 3.29Å; S453-D456 WeakPolarHBondContact CB-OD1 3.25Å; S453-D456 PolarHBondContact N-OD1 2.94Å; S453-D456 VanDerWaalsContact O-CG 3.25Å; S453-D456 PolarHBondContact O-N 3.26Å
454	L	95.2	Very high	80.5	Confident	6 Å²	6	62.3 Å²	62.3	3%	0.031	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-28	163.5	-60.7	175.8	0	0	0	111	K213 L243 L246 F248 M350 V352 L413 V419	K213-L454 PolarHBondContact NZ-O 3.44Å; L243-L454 HydrophobicContact CD2-CD1 4.14Å; L246-L454 HydrophobicContact CD1-CB 3.91Å; F248-L454 HydrophobicContact CE2-CB 4.26Å; F248-L454 HydrophobicContact CE2-CD2 4.41Å; F248-L454 WeakPolarHBondContact CE2-O 3.34Å; F248-L454 HydrophobicContact CZ-CD2 3.89Å; M350-L454 HydrophobicContact CE-CD2 3.98Å; V352-L454 HydrophobicContact CG2-CD2 4.37Å; L413-L454 HydrophobicContact CD2-CD1 3.84Å; V419-L454 HydrophobicContact CG2-CD2 4.14Å; V419-L454 HydrophobicContact CG2-CG 4.02Å
455	A	94.2	Very high	78.7	Confident	17 Å²	17	63.7 Å²	63.7	14%	0.14	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	14.7	179.4	0	0	0	0	0	114.1	L246 R416 S453	L246-A455 HydrophobicContact CD2-CB 3.73Å; R416-A455 HydrophobicContact CB-CB 4.24Å; R416-A455 HydrophobicContact CG-CB 4.4Å; S453-A455 PolarHBondContact O-N 3.31Å; S453-A455 PolarHBondContact OG-N 2.77Å; S453-A455 VanDerWaalsContact OG-N 3.11Å
456	D	90.2	Very high	77.2	Confident	5 Å²	5	58.2 Å²	58.2	3%	0.027	33%	0.329	C	S	.	.			trans	-52	130.9	168.7	-76	4	0	0	0	109.1	L208 K213 L300 R452 S453 L458	L208-D456 WeakPolarHBondContact O-CB 3.33Å; K213-D456 WeakPolarHBondContact CE-O 3.28Å; K213-D456 PolarHBondContact NZ-O 2.87Å; L300-D456 HydrophobicContact CD1-CB 4.18Å; R452-D456 IonicContact NH1-OD2 2.73Å; R452-D456 PolarHBondContact NH1-OD2 3.46Å; R452-D456 VanDerWaalsContact NH1-OD2 3.12Å; S453-D456 WeakPolarHBondContact CA-OD1 3.43Å; S453-D456 VanDerWaalsContact CB-OD1 3.29Å; S453-D456 WeakPolarHBondContact CB-OD1 3.25Å; S453-D456 PolarHBondContact N-OD1 2.94Å; S453-D456 VanDerWaalsContact O-CG 3.25Å; S453-D456 PolarHBondContact O-N 3.26Å; D456-L458 PolarHBondContact O-N 3.27Å
457	P	85.2	Confident	75.9	Confident	40 Å²	40	56.5 Å²	56.5	26%	0.26	32%	0.315	S	S	.	.			trans	-56.7	137.5	-177.7	-27.5	34.3	0	0	0	112.2	L208 A210 R416	L208-P457 WeakPolarHBondContact O-CD 3.35Å; A210-P457 PolarHBondContact N-O 3.33Å; R416-P457 VanDerWaalsContact CZ-CD 3.46Å; R416-P457 VanDerWaalsContact NH2-CG 3.34Å
458	L	77.4	Confident	74.8	Confident	45 Å²	45	56.9 Å²	56.9	24%	0.236	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-87.9	115.9	174.1	-173.3	73.6	0	0	0	109.2	A210 K213 D456 F460	A210-L458 HydrophobicContact CB-CD1 4.39Å; A210-L458 CarbonylContact O-C 3.58Å; A210-L458 WeakPolarHBondContact O-CA 3.23Å; K213-L458 HydrophobicContact CG-CD1 4.1Å; D456-L458 PolarHBondContact O-N 3.27Å; L458-F460 HydrophobicContact CD2-CD1 3.96Å; L458-F460 HydrophobicContact CD2-CE1 4.36Å; L458-F460 HydrophobicContact CG-CD1 3.99Å
459	I	70.4	Confident	73.9	Confident	65 Å²	65	59.5 Å²	59.5	33%	0.333	33%	0.331	S	S	.	.			trans	-113.5	114.1	176.5	-59.7	-170	0	0	0	107.8	I209 A210 D461	I209-I459 HydrophobicContact CB-CD1 4.15Å; I209-I459 HydrophobicContact CB-CG1 4.34Å; I209-I459 HydrophobicContact CD1-CB 4.35Å; I209-I459 HydrophobicContact CD1-CD1 3.89Å; I209-I459 HydrophobicContact CD1-CG1 4.41Å; I209-I459 HydrophobicContact CG2-CD1 3.66Å; I209-I459 HydrophobicContact CG2-CG1 4.26Å; A210-I459 PolarHBondContact O-N 3.04Å; I459-D461 WeakPolarHBondContact CG2-OD1 3.43Å
460	F	62.4	Low	73.2	Confident	89 Å²	89	56.1 Å²	56.1	39%	0.39	31%	0.306	S	S	.	.			trans	-131.5	9	-174.2	60.5	-90.9	0	0	0	113	L458 S462 H463 Y467	L458-F460 HydrophobicContact CD2-CD1 3.96Å; L458-F460 HydrophobicContact CD2-CE1 4.36Å; L458-F460 HydrophobicContact CG-CD1 3.99Å; F460-S462 CarbonylContact O-C 3.49Å; F460-S462 PolarHBondContact O-N 2.79Å; F460-H463 AromaticContact CD2-CE1 3.81Å; F460-H463 AromaticContact CD2-NE2 3.86Å; F460-H463 PolarHBondContact O-N 3.04Å; F460-Y467 HydrophobicContact CB-CE1 4.45Å; F460-Y467 HydrophobicContact CB-CE2 4.31Å
461	D	46.2	Very low	72.5	Confident	135 Å²	135	52.9 Å²	52.9	72%	0.722	30%	0.295	S	S	*	.	S	Bend	trans	-66.3	2.1	-176.2	20.8	-46.4	0	0	0	113.7	I459	I459-D461 WeakPolarHBondContact CG2-OD1 3.43Å
462	S	49.3	Very low	71.7	Confident	94 Å²	94	54 Å²	54	66%	0.657	29%	0.293	S	S	*	.	S	Bend	trans	-123.9	68.7	161.6	50.3	0	0	0	0	109.2	F460 T464	F460-S462 CarbonylContact O-C 3.49Å; F460-S462 PolarHBondContact O-N 2.79Å; S462-T464 WeakPolarHBondContact O-CG2 3.43Å; S462-T464 PolarHBondContact O-N 3.1Å
463	H	49.1	Very low	70.9	Confident	108 Å²	108	57.8 Å²	57.8	50%	0.5	31%	0.307	S	S	.	.			trans	-39.5	103	176.8	-76.2	-85.1	0	0	0	110.1	F460 Y467 D468	F460-H463 AromaticContact CD2-CE1 3.81Å; F460-H463 AromaticContact CD2-NE2 3.86Å; F460-H463 PolarHBondContact O-N 3.04Å; H463-Y467 AromaticContact ND1-CD1 3.84Å; H463-Y467 AromaticContact ND1-CE1 3.99Å; H463-D468 IonicContact CE1-OD1 3.94Å; H463-D468 IonicContact CG-OD1 3.17Å; H463-D468 IonicContact ND1-OD1 2.78Å; H463-D468 PolarHBondContact ND1-OD1 2.97Å
464	T	58.2	Low	70.2	Confident	46 Å²	46	60.5 Å²	60.5	28%	0.282	32%	0.316	S	S	.	.			trans	-80.3	140.9	174	59.6	0	0	0	0	106.2	S462 T466 Y467 D468	S462-T464 WeakPolarHBondContact O-CG2 3.43Å; S462-T464 PolarHBondContact O-N 3.1Å; T464-T466 PolarHBondContact O-N 2.65Å; T464-Y467 PolarHBondContact O-N 2.85Å; T464-Y467 WeakPolarHBondContact OG1-CB 3.44Å; T464-Y467 PolarHBondContact OG1-N 2.82Å; T464-D468 PolarHBondContact O-N 3.24Å; T464-D468 VanDerWaalsContact O-N 3.16Å
465	A	57.4	Low	69.3	Low	70 Å²	70	65.2 Å²	65.2	58%	0.579	34%	0.338	S	S	*	.	H	α-helix	trans	-50.4	-28.8	174.5	0	0	0	0	0	112.1	L469	A465-L469 VanDerWaalsContact O-CB 3.28Å; A465-L469 WeakPolarHBondContact O-CB 3.39Å; A465-L469 PolarHBondContact O-N 2.76Å
466	T	63	Low	68.4	Low	32 Å²	32	68.9 Å²	68.9	20%	0.196	35%	0.353	C	S	.	.	H	α-helix	trans	-66.3	-47.8	173.8	-22.9	0	0	0	0	113	T464 L469 H470	T464-T466 PolarHBondContact O-N 2.65Å; T466-L469 PolarHBondContact O-N 3.18Å; T466-H470 VanDerWaalsContact O-CG 3.23Å; T466-H470 PolarHBondContact O-N 2.79Å; T466-H470 PolarHBondContact O-ND1 3Å
467	Y	67.6	Low	67.7	Low	35 Å²	35	71.3 Å²	71.3	14%	0.137	37%	0.365	C	S	.	.	H	α-helix	trans	-61.3	-44.9	177.2	174.8	-90.8	0	0	0	111.5	V211 D212 F460 H463 T464 L469 H470 T471	V211-Y467 WeakPolarHBondContact O-CD2 3.32Å; D212-Y467 HydrophobicContact CB-CD2 4.26Å; F460-Y467 HydrophobicContact CB-CE1 4.45Å; F460-Y467 HydrophobicContact CB-CE2 4.31Å; H463-Y467 AromaticContact ND1-CD1 3.84Å; H463-Y467 AromaticContact ND1-CE1 3.99Å; T464-Y467 PolarHBondContact O-N 2.85Å; T464-Y467 WeakPolarHBondContact OG1-CB 3.44Å; T464-Y467 PolarHBondContact OG1-N 2.82Å; Y467-L469 PolarHBondContact O-N 3.05Å; Y467-H470 PolarHBondContact O-N 2.85Å; Y467-T471 WeakPolarHBondContact CE1-OG1 3.44Å; Y467-T471 WeakPolarHBondContact O-CB 3.47Å; Y467-T471 PolarHBondContact O-N 2.86Å; Y467-T471 PolarHBondContact O-OG1 2.87Å
468	D	66.1	Low	67.3	Low	72 Å²	72	71.3 Å²	71.3	39%	0.385	36%	0.362	S	S	.	.	H	α-helix	trans	-65.4	-40.9	-179.8	-64.8	-23.1	0	0	0	111	H463 T464 T471 Y472	H463-D468 IonicContact CE1-OD1 3.94Å; H463-D468 IonicContact CG-OD1 3.17Å; H463-D468 IonicContact ND1-OD1 2.78Å; H463-D468 PolarHBondContact ND1-OD1 2.97Å; T464-D468 PolarHBondContact O-N 3.24Å; T464-D468 VanDerWaalsContact O-N 3.16Å; D468-T471 PolarHBondContact O-N 2.87Å; D468-Y472 WeakPolarHBondContact O-CB 3.42Å; D468-Y472 PolarHBondContact O-N 2.66Å
469	L	69.1	Low	67.2	Low	90 Å²	90	75.8 Å²	75.8	47%	0.471	38%	0.382	S	S	.	.	H	α-helix	trans	-62.2	-45.2	175.6	-179	65.3	0	0	0	112.4	A465 T466 Y467 T471 Y472 R473	A465-L469 VanDerWaalsContact O-CB 3.28Å; A465-L469 WeakPolarHBondContact O-CB 3.39Å; A465-L469 PolarHBondContact O-N 2.76Å; T466-L469 PolarHBondContact O-N 3.18Å; Y467-L469 PolarHBondContact O-N 3.05Å; L469-T471 VanDerWaalsContact C-N 3.33Å; L469-Y472 PolarHBondContact O-N 2.83Å; L469-R473 PolarHBondContact O-N 3.17Å
470	H	72.6	Confident	67.3	Low	11 Å²	11	74.6 Å²	74.6	5%	0.051	38%	0.376	C	S	.	.	H	α-helix	trans	-66.2	-38.7	176.9	-61	160.7	0	0	0	111.8	D212 L271 S273 T466 Y467 Y472 R473 W474	D212-H470 IonicContact OD2-ND1 2.69Å; L271-H470 PolarHBondContact O-CE1 3.15Å; L271-H470 PolarHBondContact O-ND1 3.05Å; L271-H470 VanDerWaalsContact O-ND1 3.1Å; S273-H470 VanDerWaalsContact CA-CE1 3.47Å; S273-H470 WeakPolarHBondContact CA-CE1 3.42Å; S273-H470 PolarHBondContact N-CE1 3.15Å; S273-H470 PolarHBondContact OG-CE1 3.18Å; S273-H470 VanDerWaalsContact OG-CE1 3.28Å; T466-H470 VanDerWaalsContact O-CG 3.23Å; T466-H470 PolarHBondContact O-N 2.79Å; T466-H470 PolarHBondContact O-ND1 3Å; Y467-H470 PolarHBondContact O-N 2.85Å; H470-Y472 VanDerWaalsContact C-N 3.34Å; H470-R473 PolarHBondContact O-N 2.8Å; H470-W474 VanDerWaalsContact O-CB 3.27Å; H470-W474 WeakPolarHBondContact O-CB 3.47Å; H470-W474 PolarHBondContact O-N 3.36Å
471	T	73.3	Confident	67.9	Low	24 Å²	24	73.6 Å²	73.6	15%	0.147	38%	0.378	C	S	.	.	H	α-helix	trans	-62.4	-44.8	175.9	-55.4	0	0	0	0	110.4	K249 Y467 D468 L469 W474 Q475	K249-T471 VanDerWaalsContact CE-OG1 3.29Å; K249-T471 WeakPolarHBondContact CE-OG1 3.35Å; K249-T471 PolarHBondContact NZ-OG1 2.81Å; Y467-T471 WeakPolarHBondContact CE1-OG1 3.44Å; Y467-T471 WeakPolarHBondContact O-CB 3.47Å; Y467-T471 PolarHBondContact O-N 2.86Å; Y467-T471 PolarHBondContact O-OG1 2.87Å; D468-T471 PolarHBondContact O-N 2.87Å; L469-T471 VanDerWaalsContact C-N 3.33Å; T471-W474 PolarHBondContact O-N 2.88Å; T471-Q475 WeakPolarHBondContact O-CB 3.47Å; T471-Q475 VanDerWaalsContact O-CG 3.26Å; T471-Q475 WeakPolarHBondContact O-CG 3.41Å; T471-Q475 PolarHBondContact O-N 2.87Å
472	Y	71.8	Confident	69.3	Low	127 Å²	127	72.4 Å²	72.4	50%	0.498	37%	0.368	S	S	.	.	H	α-helix	trans	-61.7	-47.7	175.9	179	-103.4	0	0	0	112.1	D468 L469 H470 W474 Q475 Q476	D468-Y472 WeakPolarHBondContact O-CB 3.42Å; D468-Y472 PolarHBondContact O-N 2.66Å; L469-Y472 PolarHBondContact O-N 2.83Å; H470-Y472 VanDerWaalsContact C-N 3.34Å; Y472-W474 VanDerWaalsContact C-N 3.33Å; Y472-W474 PolarHBondContact O-N 2.97Å; Y472-Q475 WeakPolarHBondContact O-CB 3.35Å; Y472-Q475 PolarHBondContact O-N 3.42Å; Y472-Q475 VanDerWaalsContact O-N 3.17Å; Y472-Q476 HydrophobicContact CD1-CG 4.37Å; Y472-Q476 HydrophobicContact CE1-CG 3.99Å; Y472-Q476 HydrophobicContact CE2-CG 4.46Å; Y472-Q476 WeakPolarHBondContact O-CG 3.37Å; Y472-Q476 PolarHBondContact O-N 2.76Å; Y472-Q476 PolarHBondContact OH-NE2 2.82Å; Y472-Q476 VanDerWaalsContact OH-NE2 3.12Å
473	R	75.3	Confident	70.7	Confident	99 Å²	99	68.9 Å²	68.9	37%	0.374	34%	0.343	S	S	.	.	H	α-helix	trans	-59.6	-43.4	175.2	-77.5	-171.9	176.7	-158.3	-4.1	112.3	S270 L271 L469 H470 Q475 Q476 L477	S270-R473 PolarHBondContact OG-NH1 2.95Å; L271-R473 HydrophobicContact CD2-CB 3.61Å; L469-R473 PolarHBondContact O-N 3.17Å; H470-R473 PolarHBondContact O-N 2.8Å; R473-Q475 VanDerWaalsContact C-N 3.32Å; R473-Q475 PolarHBondContact O-N 3.34Å; R473-Q476 WeakPolarHBondContact O-CB 3.23Å; R473-Q476 PolarHBondContact O-N 3.47Å; R473-L477 PolarHBondContact O-N 2.84Å; R473-L477 VanDerWaalsContact O-N 3.14Å
474	W	80.7	Confident	72.3	Confident	60 Å²	60	64.1 Å²	64.1	23%	0.227	32%	0.321	C	S	.	.	H	α-helix	trans	-63.1	-38.7	176.4	176.9	80.1	0	0	0	111.9	K249 T250 L271 H470 T471 Y472 L477 H478	K249-W474 HydrophobicContact CB-CD2 4.01Å; K249-W474 HydrophobicContact CB-CG 3.88Å; K249-W474 HydrophobicContact CG-CD2 4.23Å; K249-W474 HydrophobicContact CG-CG 4.34Å; T250-W474 PolarHBondContact O-NE1 3.36Å; L271-W474 HydrophobicContact CD2-CB 4.44Å; H470-W474 VanDerWaalsContact O-CB 3.27Å; H470-W474 WeakPolarHBondContact O-CB 3.47Å; H470-W474 PolarHBondContact O-N 3.36Å; T471-W474 PolarHBondContact O-N 2.88Å; Y472-W474 VanDerWaalsContact C-N 3.33Å; Y472-W474 PolarHBondContact O-N 2.97Å; W474-L477 PolarHBondContact O-N 3.27Å; W474-H478 AromaticContact CD1-CE1 3.75Å; W474-H478 AromaticContact CD1-ND1 3.88Å; W474-H478 AromaticContact CD2-ND1 3.99Å; W474-H478 AromaticContact CE2-CE1 3.59Å; W474-H478 AromaticContact CE2-ND1 3.58Å; W474-H478 AromaticContact CZ2-CE1 3.98Å; W474-H478 AromaticContact CZ2-ND1 3.99Å; W474-H478 AromaticContact NE1-CE1 3.17Å; W474-H478 PolarHBondContact NE1-CE1 3.09Å; W474-H478 AromaticContact NE1-ND1 3.52Å; W474-H478 PolarHBondContact O-N 3.28Å; W474-H478 PolarHBondContact O-ND1 2.99Å
475	Q	76	Confident	73.5	Confident	106 Å²	106	63 Å²	63	50%	0.495	31%	0.312	S	S	.	.	H	α-helix	trans	-64.3	-39.3	173.5	-75	171.2	-13	0	0	112.1	T471 Y472 R473 L477 H478 Q479	T471-Q475 WeakPolarHBondContact O-CB 3.47Å; T471-Q475 VanDerWaalsContact O-CG 3.26Å; T471-Q475 WeakPolarHBondContact O-CG 3.41Å; T471-Q475 PolarHBondContact O-N 2.87Å; Y472-Q475 WeakPolarHBondContact O-CB 3.35Å; Y472-Q475 PolarHBondContact O-N 3.42Å; Y472-Q475 VanDerWaalsContact O-N 3.17Å; R473-Q475 VanDerWaalsContact C-N 3.32Å; R473-Q475 PolarHBondContact O-N 3.34Å; Q475-L477 VanDerWaalsContact C-N 3.3Å; Q475-L477 PolarHBondContact O-N 2.99Å; Q475-H478 CarbonylContact O-C 3.59Å; Q475-H478 VanDerWaalsContact O-C 3.27Å; Q475-H478 WeakPolarHBondContact O-CA 3.48Å; Q475-H478 PolarHBondContact O-N 2.93Å; Q475-Q479 PolarHBondContact O-N 3.12Å
476	Q	75.5	Confident	74.9	Confident	93 Å²	93	60.2 Å²	60.2	44%	0.435	29%	0.287	S	S	.	.	H	α-helix	trans	-61.2	-39.4	175.3	-70.9	-177.8	-49.2	0	0	111.9	Y472 R473 H478 Q479	Y472-Q476 HydrophobicContact CD1-CG 4.37Å; Y472-Q476 HydrophobicContact CE1-CG 3.99Å; Y472-Q476 HydrophobicContact CE2-CG 4.46Å; Y472-Q476 WeakPolarHBondContact O-CG 3.37Å; Y472-Q476 PolarHBondContact O-N 2.76Å; Y472-Q476 PolarHBondContact OH-NE2 2.82Å; Y472-Q476 VanDerWaalsContact OH-NE2 3.12Å; R473-Q476 WeakPolarHBondContact O-CB 3.23Å; R473-Q476 PolarHBondContact O-N 3.47Å; Q476-H478 PolarHBondContact O-N 3.19Å; Q476-Q479 PolarHBondContact O-N 2.96Å
477	L	75.7	Confident	76	Confident	56 Å²	56	62.4 Å²	62.4	29%	0.293	30%	0.297	S	S	.	.	H	α-helix	trans	-66.1	-19.6	174.1	-66.6	172.9	0	0	0	113.2	V251 L271 R473 W474 Q475	V251-L477 HydrophobicContact CG2-CD1 4.09Å; L271-L477 HydrophobicContact CD1-CD1 4.26Å; R473-L477 PolarHBondContact O-N 2.84Å; R473-L477 VanDerWaalsContact O-N 3.14Å; W474-L477 PolarHBondContact O-N 3.27Å; Q475-L477 VanDerWaalsContact C-N 3.3Å; Q475-L477 PolarHBondContact O-N 2.99Å
478	H	76.7	Confident	77	Confident	40 Å²	40	61.3 Å²	61.3	19%	0.185	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	16.9	178.9	-67.9	83.9	0	0	0	112.7	T250 W474 Q475 Q476 L480 F501 S506	T250-H478 PolarHBondContact O-CE1 3.4Å; T250-H478 PolarHBondContact O-NE2 3.2Å; W474-H478 AromaticContact CD1-CE1 3.75Å; W474-H478 AromaticContact CD1-ND1 3.88Å; W474-H478 AromaticContact CD2-ND1 3.99Å; W474-H478 AromaticContact CE2-CE1 3.59Å; W474-H478 AromaticContact CE2-ND1 3.58Å; W474-H478 AromaticContact CZ2-CE1 3.98Å; W474-H478 AromaticContact CZ2-ND1 3.99Å; W474-H478 AromaticContact NE1-CE1 3.17Å; W474-H478 PolarHBondContact NE1-CE1 3.09Å; W474-H478 AromaticContact NE1-ND1 3.52Å; W474-H478 PolarHBondContact O-N 3.28Å; W474-H478 PolarHBondContact O-ND1 2.99Å; Q475-H478 CarbonylContact O-C 3.59Å; Q475-H478 VanDerWaalsContact O-C 3.27Å; Q475-H478 WeakPolarHBondContact O-CA 3.48Å; Q475-H478 PolarHBondContact O-N 2.93Å; Q476-H478 PolarHBondContact O-N 3.19Å; H478-L480 PolarHBondContact O-N 2.64Å; H478-F501 HydrophobicContact CB-CE2 4.27Å; H478-F501 HydrophobicContact CB-CZ 4.37Å; H478-F501 WeakPolarHBondContact O-CE2 3.17Å; H478-S506 PolarHBondContact CE1-OG 3.1Å; H478-S506 PolarHBondContact NE2-OG 3.07Å
479	Q	75	Confident	77.8	Confident	140 Å²	140	62.3 Å²	62.3	65%	0.654	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-81.5	116.7	177.3	-169.7	171.5	14.1	0	0	109.7	Q475 Q476	Q475-Q479 PolarHBondContact O-N 3.12Å; Q476-Q479 PolarHBondContact O-N 2.96Å
480	L	73.3	Confident	78.5	Confident	40 Å²	40	65.9 Å²	65.9	21%	0.209	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-82.8	152.2	171.6	-70.3	170.9	0	0	0	110.5	H478 F499 F501 V509	H478-L480 PolarHBondContact O-N 2.64Å; L480-F499 HydrophobicContact CB-CB 4.35Å; L480-F499 HydrophobicContact CD2-CB 4.13Å; L480-F501 HydrophobicContact CD1-CD2 3.92Å; L480-F501 HydrophobicContact CD1-CE2 3.85Å; L480-F501 HydrophobicContact CD1-CZ 4.41Å; L480-F501 HydrophobicContact CD2-CD1 3.98Å; L480-F501 HydrophobicContact CD2-CD2 4.14Å; L480-F501 HydrophobicContact CD2-CE1 3.58Å; L480-F501 HydrophobicContact CD2-CE2 3.76Å; L480-F501 HydrophobicContact CD2-CG 4.25Å; L480-F501 HydrophobicContact CD2-CZ 3.46Å; L480-F501 VanDerWaalsContact CD2-CZ 3.46Å; L480-F501 HydrophobicContact CG-CD2 4.06Å; L480-F501 HydrophobicContact CG-CE1 4.28Å; L480-F501 HydrophobicContact CG-CE2 3.52Å; L480-F501 HydrophobicContact CG-CZ 3.65Å; L480-V509 HydrophobicContact CD2-CG1 4.17Å; L480-V509 HydrophobicContact CD2-CG2 4Å
481	P	74.1	Confident	79.1	Confident	67 Å²	67	67.2 Å²	67.2	44%	0.435	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-60.9	143.7	171.6	-18.2	29.9	0	0	0	111.4	F499	P481-F499 HydrophobicContact CB-CD2 3.82Å; P481-F499 HydrophobicContact CB-CE2 3.75Å; P481-F499 HydrophobicContact CB-CZ 4.4Å; P481-F499 HydrophobicContact CG-CD2 4.06Å; P481-F499 HydrophobicContact CG-CE2 4.14Å; P481-F499 HydrophobicContact CG-CG 4.3Å; P481-F499 HydrophobicContact CG-CZ 4.43Å; P481-F499 WeakPolarHBondContact O-CD2 3.37Å
482	E	75.2	Confident	79.7	Confident	111 Å²	111	72.4 Å²	72.4	52%	0.519	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-60.4	143	173.7	-69.4	-58.3	148.4	0	0	111.4	M484	E482-M484 PolarHBondContact O-N 2.86Å
483	P	79.4	Confident	80.4	Confident	19 Å²	19	66.6 Å²	66.6	12%	0.123	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-55	134.8	178.2	-34.3	45	0	0	0	113.3	V60 H62 L496 I497 W498	V60-P483 HydrophobicContact CG1-CB 3.67Å; V60-P483 HydrophobicContact CG1-CG 3.48Å; V60-P483 VanDerWaalsContact CG1-CG 3.48Å; H62-P483 PolarHBondContact CD2-O 3.32Å; H62-P483 VanDerWaalsContact CD2-O 3.23Å; H62-P483 PolarHBondContact NE2-O 3.26Å; H62-P483 VanDerWaalsContact NE2-O 3.08Å; P483-L496 HydrophobicContact CB-CD1 4.42Å; P483-I497 CarbonylContact C-O 3.6Å; P483-I497 WeakPolarHBondContact CA-O 3.41Å; P483-W498 HydrophobicContact CB-CB 3.92Å; P483-W498 HydrophobicContact CG-CB 3.73Å
484	M	81.5	Confident	81	Confident	8 Å²	8	62 Å²	62	4%	0.039	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	130.6	-176.5	-61.9	-175.5	-70.6	0	0	110.3	E482 L496 I497 F499 L566 L570	E482-M484 PolarHBondContact O-N 2.86Å; M484-L496 CarbonylContact O-C 3.55Å; M484-L496 WeakPolarHBondContact O-CA 3.31Å; M484-I497 HydrophobicContact CB-CB 4.28Å; M484-I497 HydrophobicContact CE-CB 4.3Å; M484-I497 HydrophobicContact CE-CD1 4.18Å; M484-I497 HydrophobicContact CE-CG2 4.13Å; M484-I497 PolarHBondContact N-O 3.29Å; M484-I497 PolarHBondContact O-N 3.36Å; M484-F499 HydrophobicContact CE-CE2 3.84Å; M484-F499 HydrophobicContact CE-CZ 3.56Å; M484-L566 HydrophobicContact CE-CD2 4.34Å; M484-L570 HydrophobicContact SD-CG 4.41Å
485	K	84.9	Confident	81.3	Confident	23 Å²	23	59.2 Å²	59.2	10%	0.1	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	119	171.9	-178.5	179.9	-173.2	-179.1	0	107.8	H62 E65 I487 F494 L496	H62-K485 WeakPolarHBondContact CE1-CB 3.16Å; H62-K485 VanDerWaalsContact NE2-CB 3.32Å; H62-K485 WeakPolarHBondContact NE2-CB 3.2Å; H62-K485 PolarHBondContact NE2-N 2.71Å; E65-K485 IonicContact OE1-NZ 2.86Å; E65-K485 PolarHBondContact OE1-NZ 3.41Å; E65-K485 IonicContact OE2-NZ 3.71Å; E65-K485 PolarHBondContact OE2-NZ 2.98Å; K485-I487 HydrophobicContact CD-CG1 4.47Å; K485-I487 HydrophobicContact CG-CG1 4.28Å; K485-F494 HydrophobicContact CD-CD2 4.12Å; K485-F494 HydrophobicContact CD-CE2 4.48Å; K485-F494 HydrophobicContact CD-CG 4.4Å; K485-F494 HydrophobicContact CG-CB 4.09Å; K485-F494 HydrophobicContact CG-CD2 3.7Å; K485-F494 HydrophobicContact CG-CE2 4.39Å; K485-F494 HydrophobicContact CG-CG 4.12Å; K485-L496 HydrophobicContact CB-CD1 4.39Å
486	I	85.6	Confident	81.8	Confident	11 Å²	11	54.2 Å²	54.2	6%	0.056	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	111.7	176.3	-57.2	-170.6	0	0	0	107.8	F488 F494 A495 I497 L548 V564 L566 V569	I486-F488 HydrophobicContact CB-CE2 4.19Å; I486-F488 HydrophobicContact CG2-CD2 4.35Å; I486-F488 HydrophobicContact CG2-CE2 3.69Å; I486-F488 HydrophobicContact CG2-CZ 3.9Å; I486-F488 WeakPolarHBondContact O-CD2 3.37Å; I486-F494 CarbonylContact O-C 3.57Å; I486-F494 WeakPolarHBondContact O-CA 3.39Å; I486-A495 PolarHBondContact N-O 3.35Å; I486-A495 PolarHBondContact O-N 2.89Å; I486-I497 HydrophobicContact CD1-CD1 3.66Å; I486-I497 HydrophobicContact CG1-CD1 4.36Å; I486-L548 HydrophobicContact CB-CD2 4.19Å; I486-L548 HydrophobicContact CD1-CB 4.41Å; I486-L548 HydrophobicContact CD1-CD2 3.86Å; I486-L548 HydrophobicContact CG1-CD2 4.46Å; I486-L548 HydrophobicContact CG2-CD2 4.36Å; I486-V564 HydrophobicContact CD1-CG1 4.36Å; I486-V564 HydrophobicContact CG2-CB 4.33Å; I486-V564 HydrophobicContact CG2-CG1 4.21Å; I486-V564 HydrophobicContact CG2-CG2 4Å; I486-L566 HydrophobicContact CD1-CD2 3.24Å; I486-V569 HydrophobicContact CD1-CG2 4.24Å
487	I	87.5	Confident	82.1	Confident	79 Å²	79	49.8 Å²	49.8	41%	0.405	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	135.2	-177.6	-57.5	176.8	0	0	0	108.6	K485 P489 F494 M518	K485-I487 HydrophobicContact CD-CG1 4.47Å; K485-I487 HydrophobicContact CG-CG1 4.28Å; I487-P489 HydrophobicContact CG2-CG 4.02Å; I487-P489 WeakPolarHBondContact O-CD 3.45Å; I487-F494 HydrophobicContact CG1-CB 4.39Å; I487-M518 HydrophobicContact CD1-CE 4.28Å; I487-M518 HydrophobicContact CG2-CE 4.11Å; I487-M518 HydrophobicContact CG2-SD 4.3Å
488	F	87.1	Confident	82.3	Confident	11 Å²	11	48.1 Å²	48.1	5%	0.048	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	82.6	173.3	-70.6	-88.3	0	0	0	108.6	I486 L490 F491 H492 V493 A495 L548 L550 A562 V564	I486-F488 HydrophobicContact CB-CE2 4.19Å; I486-F488 HydrophobicContact CG2-CD2 4.35Å; I486-F488 HydrophobicContact CG2-CE2 3.69Å; I486-F488 HydrophobicContact CG2-CZ 3.9Å; I486-F488 WeakPolarHBondContact O-CD2 3.37Å; F488-L490 VanDerWaalsContact C-N 3.29Å; F488-L490 PolarHBondContact O-N 3.3Å; F488-F491 HydrophobicContact CB-CB 4.4Å; F488-F491 HydrophobicContact CB-CD2 4.04Å; F488-F491 PolarHBondContact O-N 3.19Å; F488-H492 PolarHBondContact O-N 3.15Å; F488-V493 WeakPolarHBondContact CA-O 3.46Å; F488-V493 HydrophobicContact CB-CG2 4.03Å; F488-V493 PolarHBondContact N-O 3.22Å; F488-A495 HydrophobicContact CE2-CB 3.92Å; F488-L548 HydrophobicContact CE2-CD2 3.87Å; F488-L548 HydrophobicContact CZ-CD2 3.88Å; F488-L550 HydrophobicContact CB-CD2 3.78Å; F488-L550 HydrophobicContact CD1-CB 4.08Å; F488-L550 HydrophobicContact CD1-CD2 3.72Å; F488-L550 HydrophobicContact CD2-CB 4.44Å; F488-L550 HydrophobicContact CD2-CD2 3.82Å; F488-L550 HydrophobicContact CE1-CB 3.69Å; F488-L550 HydrophobicContact CE1-CD2 4.22Å; F488-L550 HydrophobicContact CE2-CB 4.08Å; F488-L550 HydrophobicContact CE2-CD2 4.31Å; F488-L550 HydrophobicContact CG-CB 4.44Å; F488-L550 HydrophobicContact CG-CD2 3.5Å; F488-L550 VanDerWaalsContact CG-CD2 3.5Å; F488-L550 HydrophobicContact CZ-CB 3.7Å; F488-L550 HydrophobicContact CZ-CD2 4.49Å; F488-A562 HydrophobicContact CD1-CB 3.86Å; F488-A562 HydrophobicContact CE1-CB 3.8Å; F488-V564 HydrophobicContact CE1-CG2 3.81Å; F488-V564 HydrophobicContact CZ-CG2 3.94Å
489	P	84	Confident	82.4	Confident	94 Å²	94	47.6 Å²	47.6	61%	0.61	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-60.1	-38.5	-168.1	-22.7	32.5	0	0	0	113.1	I487 F491 H492	I487-P489 HydrophobicContact CG2-CG 4.02Å; I487-P489 WeakPolarHBondContact O-CD 3.45Å; P489-F491 PolarHBondContact O-N 3.04Å; P489-F491 VanDerWaalsContact O-N 3.15Å; P489-H492 PolarHBondContact O-N 3.17Å; P489-H492 VanDerWaalsContact O-N 3.15Å
490	L	83.9	Confident	82.4	Confident	164 Å²	164	42 Å²	42	86%	0.859	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-58.9	-26.7	179.3	-70	171.1	0	0	0	113.2	F488	F488-L490 VanDerWaalsContact C-N 3.29Å; F488-L490 PolarHBondContact O-N 3.3Å
491	F	83.9	Confident	82.5	Confident	39 Å²	39	41.8 Å²	41.8	17%	0.171	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-105.9	-2.9	-176	-60.9	-75.5	0	0	0	112.3	F488 P489 V493 Y533 L550 E552 S560 A562	F488-F491 HydrophobicContact CB-CB 4.4Å; F488-F491 HydrophobicContact CB-CD2 4.04Å; F488-F491 PolarHBondContact O-N 3.19Å; P489-F491 PolarHBondContact O-N 3.04Å; P489-F491 VanDerWaalsContact O-N 3.15Å; F491-V493 HydrophobicContact CB-CG2 3.83Å; F491-V493 PolarHBondContact O-N 2.86Å; F491-Y533 HydrophobicContact CB-CE1 3.87Å; F491-Y533 AromaticContact CD1-CE1 3.76Å; F491-Y533 HydrophobicContact CD1-CE1 3.76Å; F491-Y533 HydrophobicContact CG-CE1 4.07Å; F491-L550 HydrophobicContact CB-CD2 4.35Å; F491-L550 HydrophobicContact CD2-CD2 3.97Å; F491-L550 HydrophobicContact CG-CD2 4.18Å; F491-E552 HydrophobicContact CE1-CB 4.46Å; F491-E552 WeakPolarHBondContact CE1-OE2 3.4Å; F491-S560 WeakPolarHBondContact CE1-OG 3.27Å; F491-S560 WeakPolarHBondContact CZ-OG 3.46Å; F491-A562 HydrophobicContact CE2-CB 3.83Å
492	H	85.8	Confident	82.8	Confident	133 Å²	133	42.9 Å²	42.9	62%	0.616	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.7	36.2	-170.8	-84.7	-47	0	0	0	113.6	F488 P489 M518	F488-H492 PolarHBondContact O-N 3.15Å; P489-H492 PolarHBondContact O-N 3.17Å; P489-H492 VanDerWaalsContact O-N 3.15Å; H492-M518 WeakPolarHBondContact O-CB 3.26Å; H492-M518 PolarHBondContact O-N 3.42Å
493	V	87.2	Confident	83.2	Confident	6 Å²	6	39.7 Å²	39.7	4%	0.036	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	163.4	173.6	-57.6	0	0	0	0	110.8	F488 F491 V515 L516 Y533 L550	F488-V493 WeakPolarHBondContact CA-O 3.46Å; F488-V493 HydrophobicContact CB-CG2 4.03Å; F488-V493 PolarHBondContact N-O 3.22Å; F491-V493 HydrophobicContact CB-CG2 3.83Å; F491-V493 PolarHBondContact O-N 2.86Å; V493-V515 HydrophobicContact CB-CG1 3.84Å; V493-V515 HydrophobicContact CG1-CG1 4.28Å; V493-V515 HydrophobicContact CG2-CG1 3.88Å; V493-L516 CarbonylContact C-O 3.55Å; V493-L516 VanDerWaalsContact CA-O 3.23Å; V493-L516 WeakPolarHBondContact CA-O 3.5Å; V493-L516 WeakPolarHBondContact CB-O 3.4Å; V493-Y533 HydrophobicContact CG1-CD2 3.89Å; V493-Y533 HydrophobicContact CG1-CE2 3.87Å; V493-Y533 HydrophobicContact CG1-CG 4.27Å; V493-Y533 HydrophobicContact CG2-CD1 4.37Å; V493-L550 HydrophobicContact CG2-CD1 4.38Å; V493-L550 HydrophobicContact CG2-CD2 3.62Å
494	F	88.5	Confident	83.7	Confident	3 Å²	3	42.9 Å²	42.9	1%	0.013	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	146.4	164.6	68	-85.9	0	0	0	109.8	K485 I486 I487 L496 V515 L516 M518	K485-F494 HydrophobicContact CD-CD2 4.12Å; K485-F494 HydrophobicContact CD-CE2 4.48Å; K485-F494 HydrophobicContact CD-CG 4.4Å; K485-F494 HydrophobicContact CG-CB 4.09Å; K485-F494 HydrophobicContact CG-CD2 3.7Å; K485-F494 HydrophobicContact CG-CE2 4.39Å; K485-F494 HydrophobicContact CG-CG 4.12Å; I486-F494 CarbonylContact O-C 3.57Å; I486-F494 WeakPolarHBondContact O-CA 3.39Å; I487-F494 HydrophobicContact CG1-CB 4.39Å; F494-L496 HydrophobicContact CD2-CB 4.5Å; F494-L496 HydrophobicContact CE2-CB 4.29Å; F494-V515 WeakPolarHBondContact O-CA 3.36Å; F494-L516 HydrophobicContact CD1-CB 4.04Å; F494-L516 WeakPolarHBondContact CD1-O 3.16Å; F494-L516 HydrophobicContact CD2-CB 4.38Å; F494-L516 HydrophobicContact CD2-CD1 4.38Å; F494-L516 HydrophobicContact CE1-CB 3.5Å; F494-L516 VanDerWaalsContact CE1-CB 3.5Å; F494-L516 HydrophobicContact CE2-CB 3.9Å; F494-L516 HydrophobicContact CE2-CD1 3.54Å; F494-L516 HydrophobicContact CE2-CG 4.34Å; F494-L516 HydrophobicContact CG-CB 4.49Å; F494-L516 HydrophobicContact CZ-CB 3.44Å; F494-L516 VanDerWaalsContact CZ-CB 3.44Å; F494-L516 HydrophobicContact CZ-CD1 3.68Å; F494-L516 HydrophobicContact CZ-CG 4.1Å; F494-L516 PolarHBondContact N-O 2.93Å; F494-L516 PolarHBondContact O-N 2.83Å; F494-M518 HydrophobicContact CB-SD 3.91Å; F494-M518 HydrophobicContact CD1-CG 4.33Å; F494-M518 HydrophobicContact CD1-SD 3.47Å; F494-M518 WeakPolarHBondContact CD1-SD 3.41Å; F494-M518 HydrophobicContact CE1-SD 4.37Å; F494-M518 HydrophobicContact CG-SD 4.08Å
495	A	87.5	Confident	84	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.9	167.6	0	0	0	0	0	108.9	I486 F488 S514 A535 L548	I486-A495 PolarHBondContact N-O 3.35Å; I486-A495 PolarHBondContact O-N 2.89Å; F488-A495 HydrophobicContact CE2-CB 3.92Å; A495-S514 CarbonylContact C-O 3.5Å; A495-S514 WeakPolarHBondContact CA-O 3.23Å; A495-A535 HydrophobicContact CB-CB 4.25Å; A495-L548 HydrophobicContact CB-CD2 3.52Å
496	L	84.7	Confident	84.1	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	117.7	167.4	-168.6	73.5	0	0	0	108.4	L70 V99 P483 M484 K485 F494 W498 T513 S514 L516	L70-L496 HydrophobicContact CD1-CD1 3.81Å; L70-L496 HydrophobicContact CD1-CD2 3.95Å; V99-L496 HydrophobicContact CG1-CD2 3.94Å; V99-L496 HydrophobicContact CG2-CD2 4.05Å; P483-L496 HydrophobicContact CB-CD1 4.42Å; M484-L496 CarbonylContact O-C 3.55Å; M484-L496 WeakPolarHBondContact O-CA 3.31Å; K485-L496 HydrophobicContact CB-CD1 4.39Å; F494-L496 HydrophobicContact CD2-CB 4.5Å; F494-L496 HydrophobicContact CE2-CB 4.29Å; L496-W498 HydrophobicContact CB-CE3 4.29Å; L496-W498 HydrophobicContact CB-CZ3 4.19Å; L496-W498 HydrophobicContact CD2-CE3 3.81Å; L496-W498 HydrophobicContact CD2-CZ3 3.97Å; L496-W498 HydrophobicContact CG-CE3 3.9Å; L496-W498 HydrophobicContact CG-CZ3 4.23Å; L496-W498 WeakPolarHBondContact O-CZ3 3.35Å; L496-T513 CarbonylContact O-C 3.59Å; L496-T513 WeakPolarHBondContact O-CA 3.32Å; L496-S514 PolarHBondContact N-O 3.12Å; L496-S514 PolarHBondContact O-N 3.11Å; L496-L516 HydrophobicContact CB-CD1 4.26Å
497	I	82.5	Confident	84.2	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	128.3	173.7	-51.3	178.9	0	0	0	107.6	P483 M484 I486 F499 V511 Y512 T513 L537 L548 L566	P483-I497 CarbonylContact C-O 3.6Å; P483-I497 WeakPolarHBondContact CA-O 3.41Å; M484-I497 HydrophobicContact CB-CB 4.28Å; M484-I497 HydrophobicContact CE-CB 4.3Å; M484-I497 HydrophobicContact CE-CD1 4.18Å; M484-I497 HydrophobicContact CE-CG2 4.13Å; M484-I497 PolarHBondContact N-O 3.29Å; M484-I497 PolarHBondContact O-N 3.36Å; I486-I497 HydrophobicContact CD1-CD1 3.66Å; I486-I497 HydrophobicContact CG1-CD1 4.36Å; I497-F499 HydrophobicContact CG2-CE2 4.32Å; I497-F499 HydrophobicContact CG2-CZ 4.06Å; I497-V511 HydrophobicContact CG2-CG1 3.42Å; I497-V511 VanDerWaalsContact CG2-CG1 3.42Å; I497-Y512 VanDerWaalsContact CA-O 3.3Å; I497-Y512 WeakPolarHBondContact CA-O 3.14Å; I497-T513 HydrophobicContact CG1-CG2 4.19Å; I497-T513 HydrophobicContact CG2-CG2 4.48Å; I497-L537 HydrophobicContact CD1-CD2 4.44Å; I497-L548 HydrophobicContact CD1-CB 4.43Å; I497-L548 HydrophobicContact CD1-CD1 3.99Å; I497-L548 HydrophobicContact CD1-CD2 4.08Å; I497-L548 HydrophobicContact CD1-CG 4.38Å; I497-L548 HydrophobicContact CG1-CD1 4.33Å; I497-L548 HydrophobicContact CG1-CD2 4.46Å; I497-L566 HydrophobicContact CD1-CD1 4.05Å; I497-L566 HydrophobicContact CD1-CD2 3.61Å
498	W	79.3	Confident	84	Confident	20 Å²	20	43.8 Å²	43.8	8%	0.076	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	164.6	169.4	67.5	87	0	0	0	111	N98 V99 P483 L496 Y512 S514	N98-W498 WeakPolarHBondContact ND2-CH2 3.45Å; N98-W498 WeakPolarHBondContact ND2-CZ2 3.46Å; V99-W498 HydrophobicContact CG2-CH2 3.75Å; V99-W498 HydrophobicContact CG2-CZ3 3.73Å; P483-W498 HydrophobicContact CB-CB 3.92Å; P483-W498 HydrophobicContact CG-CB 3.73Å; L496-W498 HydrophobicContact CB-CE3 4.29Å; L496-W498 HydrophobicContact CB-CZ3 4.19Å; L496-W498 HydrophobicContact CD2-CE3 3.81Å; L496-W498 HydrophobicContact CD2-CZ3 3.97Å; L496-W498 HydrophobicContact CG-CE3 3.9Å; L496-W498 HydrophobicContact CG-CZ3 4.23Å; L496-W498 WeakPolarHBondContact O-CZ3 3.35Å; W498-Y512 AromaticContact CD1-CD2 3.66Å; W498-Y512 AromaticContact CE2-CG 3.84Å; W498-Y512 VanDerWaalsContact CZ2-CB 3.44Å; W498-Y512 HydrophobicContact CZ2-CG 4.07Å; W498-Y512 PolarHBondContact N-O 3.41Å; W498-Y512 VanDerWaalsContact NE1-CB 3.3Å; W498-Y512 AromaticContact NE1-CD2 3.28Å; W498-Y512 VanDerWaalsContact NE1-CD2 3.28Å; W498-Y512 AromaticContact NE1-CG 3.43Å; W498-Y512 PolarHBondContact O-N 3.49Å; W498-S514 VanDerWaalsContact CH2-OG 3.24Å; W498-S514 WeakPolarHBondContact CH2-OG 3.44Å
499	F	79.2	Confident	83.4	Confident	29 Å²	29	46.3 Å²	46.3	13%	0.127	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	151.5	-169.2	-57.3	-88.3	0	0	0	110.2	L480 P481 M484 I497 V509 I510 V511	L480-F499 HydrophobicContact CB-CB 4.35Å; L480-F499 HydrophobicContact CD2-CB 4.13Å; P481-F499 HydrophobicContact CB-CD2 3.82Å; P481-F499 HydrophobicContact CB-CE2 3.75Å; P481-F499 HydrophobicContact CB-CZ 4.4Å; P481-F499 HydrophobicContact CG-CD2 4.06Å; P481-F499 HydrophobicContact CG-CE2 4.14Å; P481-F499 HydrophobicContact CG-CG 4.3Å; P481-F499 HydrophobicContact CG-CZ 4.43Å; P481-F499 WeakPolarHBondContact O-CD2 3.37Å; M484-F499 HydrophobicContact CE-CE2 3.84Å; M484-F499 HydrophobicContact CE-CZ 3.56Å; I497-F499 HydrophobicContact CG2-CE2 4.32Å; I497-F499 HydrophobicContact CG2-CZ 4.06Å; F499-V509 HydrophobicContact CB-CG1 3.76Å; F499-V509 HydrophobicContact CD1-CG1 3.72Å; F499-V509 HydrophobicContact CG-CG1 4.22Å; F499-I510 WeakPolarHBondContact CA-O 3.42Å; F499-V511 HydrophobicContact CD1-CB 4.34Å; F499-V511 HydrophobicContact CD1-CG1 3.92Å; F499-V511 HydrophobicContact CD1-CG2 3.83Å; F499-V511 HydrophobicContact CE1-CB 4.37Å; F499-V511 HydrophobicContact CE1-CG1 3.67Å; F499-V511 HydrophobicContact CE1-CG2 3.83Å; F499-V511 HydrophobicContact CZ-CG1 4.32Å
500	D	74.4	Confident	82.9	Confident	22 Å²	22	44.3 Å²	44.3	12%	0.118	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	155.6	167.9	-159.6	7.8	0	0	0	109.9	K55 V509 I510 Y512	K55-D500 WeakPolarHBondContact CE-OD1 3.36Å; K55-D500 WeakPolarHBondContact CE-OD2 3.42Å; K55-D500 IonicContact NZ-OD1 3.32Å; K55-D500 PolarHBondContact NZ-OD1 2.9Å; K55-D500 IonicContact NZ-OD2 2.89Å; K55-D500 PolarHBondContact NZ-OD2 3.37Å; D500-V509 CarbonylContact O-C 3.53Å; D500-V509 VanDerWaalsContact O-CA 3.23Å; D500-V509 WeakPolarHBondContact O-CA 3.38Å; D500-V509 VanDerWaalsContact O-CG1 3.29Å; D500-V509 WeakPolarHBondContact O-CG1 3.33Å; D500-I510 PolarHBondContact N-O 2.86Å; D500-I510 PolarHBondContact O-N 3.12Å; D500-Y512 HydrophobicContact CB-CD2 4.35Å; D500-Y512 HydrophobicContact CB-CE2 3.64Å
501	F	75.9	Confident	82.6	Confident	37 Å²	37	38.9 Å²	38.9	16%	0.162	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	142.9	170.6	-67.9	-67.1	0	0	0	110.5	H478 L480 G503 F505 S506 M508 V509	H478-F501 HydrophobicContact CB-CE2 4.27Å; H478-F501 HydrophobicContact CB-CZ 4.37Å; H478-F501 WeakPolarHBondContact O-CE2 3.17Å; L480-F501 HydrophobicContact CD1-CD2 3.92Å; L480-F501 HydrophobicContact CD1-CE2 3.85Å; L480-F501 HydrophobicContact CD1-CZ 4.41Å; L480-F501 HydrophobicContact CD2-CD1 3.98Å; L480-F501 HydrophobicContact CD2-CD2 4.14Å; L480-F501 HydrophobicContact CD2-CE1 3.58Å; L480-F501 HydrophobicContact CD2-CE2 3.76Å; L480-F501 HydrophobicContact CD2-CG 4.25Å; L480-F501 HydrophobicContact CD2-CZ 3.46Å; L480-F501 VanDerWaalsContact CD2-CZ 3.46Å; L480-F501 HydrophobicContact CG-CD2 4.06Å; L480-F501 HydrophobicContact CG-CE1 4.28Å; L480-F501 HydrophobicContact CG-CE2 3.52Å; L480-F501 HydrophobicContact CG-CZ 3.65Å; F501-G503 PolarHBondContact O-N 2.85Å; F501-F505 WeakPolarHBondContact CD1-O 3.3Å; F501-S506 WeakPolarHBondContact CE1-O 3.28Å; F501-M508 WeakPolarHBondContact CA-O 3.34Å; F501-V509 HydrophobicContact CD1-CG2 4.16Å; F501-V509 HydrophobicContact CE1-CG2 4.25Å
502	H	80.1	Confident	82.3	Confident	90 Å²	90	39.2 Å²	39.2	42%	0.417	20%	0.203	S	C	.	.	S	Bend	trans	-78.3	104.5	169.2	-174.4	64	0	0	0	108.4	Y504 F505 M508 I510	H502-Y504 PolarHBondContact O-N 2.69Å; H502-F505 WeakPolarHBondContact O-CB 3.31Å; H502-F505 WeakPolarHBondContact O-CD2 3.44Å; H502-F505 PolarHBondContact O-N 2.99Å; H502-M508 HydrophobicContact CB-CB 3.74Å; H502-M508 PolarHBondContact N-O 2.77Å; H502-I510 HydrophobicContact CB-CD1 4.3Å; H502-I510 HydrophobicContact CB-CG1 3.89Å
503	G	85	Confident	82.1	Confident	44 Å²	44	34.9 Å²	34.9	45%	0.454	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	-133	-173.3	0	0	0	0	0	111	N237 F501	N237-G503 WeakPolarHBondContact OD1-CA 3.33Å; F501-G503 PolarHBondContact O-N 2.85Å
504	Y	89.6	Confident	81.9	Confident	86 Å²	86	35.6 Å²	35.6	34%	0.337	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	16.2	178.6	-61.9	-73.3	0	0	0	113.6	N237 A240 E241 I244 T252 H502	N237-Y504 WeakPolarHBondContact OD1-CD2 3.49Å; N237-Y504 PolarHBondContact OD1-N 3.49Å; A240-Y504 HydrophobicContact CB-CD2 4.37Å; A240-Y504 HydrophobicContact CB-CG 4.17Å; E241-Y504 HydrophobicContact CB-CD2 3.99Å; E241-Y504 HydrophobicContact CB-CE2 3.43Å; E241-Y504 VanDerWaalsContact CB-CE2 3.43Å; E241-Y504 HydrophobicContact CG-CE2 3.78Å; I244-Y504 HydrophobicContact CD1-CD1 3.26Å; I244-Y504 HydrophobicContact CD1-CE1 3.67Å; I244-Y504 HydrophobicContact CD1-CG 3.88Å; T252-Y504 WeakPolarHBondContact CB-O 3.34Å; T252-Y504 PolarHBondContact OG1-O 2.84Å; T252-Y504 VanDerWaalsContact OG1-O 3.08Å; H502-Y504 PolarHBondContact O-N 2.69Å
505	F	88	Confident	81.8	Confident	3 Å²	3	37.1 Å²	37.1	1%	0.013	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-83.1	124.5	-177.9	-72.2	-84.2	0	0	0	112.6	S219 T233 A236 N237 T252 F501 H502 N507 M508	S219-F505 WeakPolarHBondContact OG-CE1 3.4Å; T233-F505 HydrophobicContact CG2-CD2 4.46Å; T233-F505 HydrophobicContact CG2-CE2 3.52Å; T233-F505 HydrophobicContact CG2-CZ 3.56Å; T233-F505 WeakPolarHBondContact O-CE2 3.29Å; T233-F505 VanDerWaalsContact O-CZ 3.32Å; T233-F505 WeakPolarHBondContact O-CZ 3.3Å; A236-F505 HydrophobicContact CB-CE1 4.1Å; A236-F505 HydrophobicContact CB-CZ 3.83Å; N237-F505 HydrophobicContact CB-CE2 4.05Å; T252-F505 HydrophobicContact CG2-CD1 3.74Å; T252-F505 HydrophobicContact CG2-CE1 3.62Å; T252-F505 HydrophobicContact CG2-CG 4.32Å; T252-F505 HydrophobicContact CG2-CZ 4.13Å; T252-F505 CarbonylContact O-C 3.5Å; T252-F505 WeakPolarHBondContact O-CA 3.43Å; F501-F505 WeakPolarHBondContact CD1-O 3.3Å; H502-F505 WeakPolarHBondContact O-CB 3.31Å; H502-F505 WeakPolarHBondContact O-CD2 3.44Å; H502-F505 PolarHBondContact O-N 2.99Å; F505-N507 VanDerWaalsContact C-N 3.34Å; F505-M508 HydrophobicContact CB-CB 3.75Å; F505-M508 HydrophobicContact CB-CG 4.01Å; F505-M508 HydrophobicContact CB-SD 4.19Å; F505-M508 HydrophobicContact CD1-SD 4.26Å; F505-M508 HydrophobicContact CD2-SD 4.11Å; F505-M508 HydrophobicContact CG-CB 4.48Å; F505-M508 HydrophobicContact CG-CG 4.35Å; F505-M508 HydrophobicContact CG-SD 3.92Å
506	S	87.3	Confident	81.6	Confident	18 Å²	18	37.4 Å²	37.4	13%	0.126	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-21.2	179	-41.5	0	0	0	0	112.8	T252 H478 F501	T252-S506 PolarHBondContact N-OG 3.17Å; T252-S506 PolarHBondContact O-N 2.8Å; H478-S506 PolarHBondContact CE1-OG 3.1Å; H478-S506 PolarHBondContact NE2-OG 3.07Å; F501-S506 WeakPolarHBondContact CE1-O 3.28Å
507	N	86.1	Confident	81.5	Confident	68 Å²	68	38 Å²	38	36%	0.364	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110	6.6	178.9	75	-32.7	0	0	0	114.3	L253 S254 F505	L253-N507 WeakPolarHBondContact CA-OD1 3.32Å; L253-N507 HydrophobicContact CD2-CB 3.71Å; S254-N507 PolarHBondContact N-OD1 3.38Å; S254-N507 PolarHBondContact O-ND2 3.04Å; F505-N507 VanDerWaalsContact C-N 3.34Å
508	M	83.1	Confident	81.2	Confident	50 Å²	50	39.8 Å²	39.8	25%	0.246	22%	0.215	C	C	.	.			trans	-117.4	121	173.4	-65	-179.4	149.2	0	0	109.5	S254 F501 H502 F505	S254-M508 WeakPolarHBondContact OG-CE 3.47Å; F501-M508 WeakPolarHBondContact CA-O 3.34Å; H502-M508 HydrophobicContact CB-CB 3.74Å; H502-M508 PolarHBondContact N-O 2.77Å; F505-M508 HydrophobicContact CB-CB 3.75Å; F505-M508 HydrophobicContact CB-CG 4.01Å; F505-M508 HydrophobicContact CB-SD 4.19Å; F505-M508 HydrophobicContact CD1-SD 4.26Å; F505-M508 HydrophobicContact CD2-SD 4.11Å; F505-M508 HydrophobicContact CG-CB 4.48Å; F505-M508 HydrophobicContact CG-CG 4.35Å; F505-M508 HydrophobicContact CG-SD 3.92Å
509	V	75	Confident	80.7	Confident	64 Å²	64	41 Å²	41	39%	0.388	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	129.3	-176.5	179.8	0	0	0	0	109.5	L480 F499 D500 F501	L480-V509 HydrophobicContact CD2-CG1 4.17Å; L480-V509 HydrophobicContact CD2-CG2 4Å; F499-V509 HydrophobicContact CB-CG1 3.76Å; F499-V509 HydrophobicContact CD1-CG1 3.72Å; F499-V509 HydrophobicContact CG-CG1 4.22Å; D500-V509 CarbonylContact O-C 3.53Å; D500-V509 VanDerWaalsContact O-CA 3.23Å; D500-V509 WeakPolarHBondContact O-CA 3.38Å; D500-V509 VanDerWaalsContact O-CG1 3.29Å; D500-V509 WeakPolarHBondContact O-CG1 3.33Å; F501-V509 HydrophobicContact CD1-CG2 4.16Å; F501-V509 HydrophobicContact CE1-CG2 4.25Å
510	I	74.7	Confident	80	Confident	53 Å²	53	41.9 Å²	41.9	27%	0.272	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	126.8	165.6	-52.8	173.5	0	0	0	107.5	F499 D500 H502 Y512	F499-I510 WeakPolarHBondContact CA-O 3.42Å; D500-I510 PolarHBondContact N-O 2.86Å; D500-I510 PolarHBondContact O-N 3.12Å; H502-I510 HydrophobicContact CB-CD1 4.3Å; H502-I510 HydrophobicContact CB-CG1 3.89Å; I510-Y512 HydrophobicContact CB-CE2 3.98Å; I510-Y512 HydrophobicContact CG2-CD1 4.45Å; I510-Y512 HydrophobicContact CG2-CD2 4.27Å; I510-Y512 HydrophobicContact CG2-CE1 3.87Å; I510-Y512 HydrophobicContact CG2-CE2 3.68Å; I510-Y512 VanDerWaalsContact CG2-CZ 3.44Å
511	V	76.4	Confident	79.5	Confident	50 Å²	50	49.8 Å²	49.8	30%	0.303	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	123.8	174	-162.5	0	0	0	0	108.9	I497 F499 L537	I497-V511 HydrophobicContact CG2-CG1 3.42Å; I497-V511 VanDerWaalsContact CG2-CG1 3.42Å; F499-V511 HydrophobicContact CD1-CB 4.34Å; F499-V511 HydrophobicContact CD1-CG1 3.92Å; F499-V511 HydrophobicContact CD1-CG2 3.83Å; F499-V511 HydrophobicContact CE1-CB 4.37Å; F499-V511 HydrophobicContact CE1-CG1 3.67Å; F499-V511 HydrophobicContact CE1-CG2 3.83Å; F499-V511 HydrophobicContact CZ-CG1 4.32Å; V511-L537 HydrophobicContact CB-CD1 3.48Å; V511-L537 VanDerWaalsContact CB-CD1 3.48Å; V511-L537 HydrophobicContact CG1-CD1 3.19Å; V511-L537 HydrophobicContact CG2-CD1 4.33Å
512	Y	78	Confident	78.6	Confident	46 Å²	46	54.1 Å²	54.1	18%	0.18	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	146.8	175.6	-62.7	-80.1	0	0	0	110.2	L74 I497 W498 D500 I510	L74-Y512 HydrophobicContact CD1-CD1 3.97Å; L74-Y512 HydrophobicContact CD1-CE1 3.66Å; L74-Y512 HydrophobicContact CD2-CE1 3.86Å; L74-Y512 HydrophobicContact CD2-CE2 3.78Å; L74-Y512 WeakPolarHBondContact CD2-OH 3.13Å; L74-Y512 HydrophobicContact CG-CE1 4.4Å; I497-Y512 VanDerWaalsContact CA-O 3.3Å; I497-Y512 WeakPolarHBondContact CA-O 3.14Å; W498-Y512 AromaticContact CD1-CD2 3.66Å; W498-Y512 AromaticContact CE2-CG 3.84Å; W498-Y512 VanDerWaalsContact CZ2-CB 3.44Å; W498-Y512 HydrophobicContact CZ2-CG 4.07Å; W498-Y512 PolarHBondContact N-O 3.41Å; W498-Y512 VanDerWaalsContact NE1-CB 3.3Å; W498-Y512 AromaticContact NE1-CD2 3.28Å; W498-Y512 VanDerWaalsContact NE1-CD2 3.28Å; W498-Y512 AromaticContact NE1-CG 3.43Å; W498-Y512 PolarHBondContact O-N 3.49Å; D500-Y512 HydrophobicContact CB-CD2 4.35Å; D500-Y512 HydrophobicContact CB-CE2 3.64Å; I510-Y512 HydrophobicContact CB-CE2 3.98Å; I510-Y512 HydrophobicContact CG2-CD1 4.45Å; I510-Y512 HydrophobicContact CG2-CD2 4.27Å; I510-Y512 HydrophobicContact CG2-CE1 3.87Å; I510-Y512 HydrophobicContact CG2-CE2 3.68Å; I510-Y512 VanDerWaalsContact CG2-CZ 3.44Å
513	T	81.3	Confident	77.3	Confident	42 Å²	42	51 Å²	51	26%	0.258	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	125.2	175.7	59.6	0	0	0	0	109.7	L496 I497 A535 L537 L548	L496-T513 CarbonylContact O-C 3.59Å; L496-T513 WeakPolarHBondContact O-CA 3.32Å; I497-T513 HydrophobicContact CG1-CG2 4.19Å; I497-T513 HydrophobicContact CG2-CG2 4.48Å; T513-A535 PolarHBondContact OG1-O 3.31Å; T513-L537 HydrophobicContact CG2-CD1 3.69Å; T513-L537 HydrophobicContact CG2-CG 3.97Å; T513-L548 HydrophobicContact CG2-CD1 3.89Å
514	S	83.8	Confident	75.8	Confident	21 Å²	21	55.7 Å²	55.7	15%	0.147	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	134.6	167.6	-76.3	0	0	0	0	111.3	N98 A495 L496 W498	N98-S514 PolarHBondContact OD1-OG 2.89Å; A495-S514 CarbonylContact C-O 3.5Å; A495-S514 WeakPolarHBondContact CA-O 3.23Å; L496-S514 PolarHBondContact N-O 3.12Å; L496-S514 PolarHBondContact O-N 3.11Å; W498-S514 VanDerWaalsContact CH2-OG 3.24Å; W498-S514 WeakPolarHBondContact CH2-OG 3.44Å
515	V	86.5	Confident	74.1	Confident	34 Å²	34	54.4 Å²	54.4	21%	0.206	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	127.2	174.5	-172.5	0	0	0	0	109	V493 F494 Y533 A535 L550	V493-V515 HydrophobicContact CB-CG1 3.84Å; V493-V515 HydrophobicContact CG1-CG1 4.28Å; V493-V515 HydrophobicContact CG2-CG1 3.88Å; F494-V515 WeakPolarHBondContact O-CA 3.36Å; V515-Y533 HydrophobicContact CG1-CG 4.38Å; V515-A535 HydrophobicContact CG2-CB 3.51Å; V515-L550 HydrophobicContact CG1-CD1 3.95Å; V515-L550 HydrophobicContact CG2-CD1 3.75Å
516	L	83.4	Confident	72.4	Confident	6 Å²	6	58.7 Å²	58.7	3%	0.031	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	143.1	-178	-69	131.3	0	0	0	109.2	A97 V99 V493 F494 L496	A97-L516 HydrophobicContact CB-CD2 3.98Å; V99-L516 HydrophobicContact CB-CD1 4.29Å; V99-L516 HydrophobicContact CG1-CD1 4.45Å; V493-L516 CarbonylContact C-O 3.55Å; V493-L516 VanDerWaalsContact CA-O 3.23Å; V493-L516 WeakPolarHBondContact CA-O 3.5Å; V493-L516 WeakPolarHBondContact CB-O 3.4Å; F494-L516 HydrophobicContact CD1-CB 4.04Å; F494-L516 WeakPolarHBondContact CD1-O 3.16Å; F494-L516 HydrophobicContact CD2-CB 4.38Å; F494-L516 HydrophobicContact CD2-CD1 4.38Å; F494-L516 HydrophobicContact CE1-CB 3.5Å; F494-L516 VanDerWaalsContact CE1-CB 3.5Å; F494-L516 HydrophobicContact CE2-CB 3.9Å; F494-L516 HydrophobicContact CE2-CD1 3.54Å; F494-L516 HydrophobicContact CE2-CG 4.34Å; F494-L516 HydrophobicContact CG-CB 4.49Å; F494-L516 HydrophobicContact CZ-CB 3.44Å; F494-L516 VanDerWaalsContact CZ-CB 3.44Å; F494-L516 HydrophobicContact CZ-CD1 3.68Å; F494-L516 HydrophobicContact CZ-CG 4.1Å; F494-L516 PolarHBondContact N-O 2.93Å; F494-L516 PolarHBondContact O-N 2.83Å; L496-L516 HydrophobicContact CB-CD1 4.26Å
517	S	81.7	Confident	70.8	Confident	14 Å²	14	62.7 Å²	62.7	10%	0.098	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	142.3	172.3	48.2	0	0	0	0	111.2	R525	S517-R525 WeakPolarHBondContact OG-CB 3.41Å; S517-R525 WeakPolarHBondContact OG-CD 3.4Å; S517-R525 VanDerWaalsContact OG-CG 3.3Å; S517-R525 WeakPolarHBondContact OG-CG 3.33Å
518	M	77.3	Confident	69.4	Low	38 Å²	38	65.6 Å²	65.6	19%	0.187	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-67.4	136.3	173.6	-67.4	-69	-75.5	0	0	109	I487 H492 F494 T520	I487-M518 HydrophobicContact CD1-CE 4.28Å; I487-M518 HydrophobicContact CG2-CE 4.11Å; I487-M518 HydrophobicContact CG2-SD 4.3Å; H492-M518 WeakPolarHBondContact O-CB 3.26Å; H492-M518 PolarHBondContact O-N 3.42Å; F494-M518 HydrophobicContact CB-SD 3.91Å; F494-M518 HydrophobicContact CD1-CG 4.33Å; F494-M518 HydrophobicContact CD1-SD 3.47Å; F494-M518 WeakPolarHBondContact CD1-SD 3.41Å; F494-M518 HydrophobicContact CE1-SD 4.37Å; F494-M518 HydrophobicContact CG-SD 4.08Å; M518-T520 PolarHBondContact O-N 2.87Å
519	P	67.4	Low	68.2	Low	46 Å²	46	68.2 Å²	68.2	30%	0.299	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-66.1	130.3	176.3	25.3	-30.9	0	0	0	110.2
520	T	65.9	Low	67.8	Low	48 Å²	48	71.2 Å²	71.2	29%	0.294	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-67.7	168.3	170	60.5	0	0	0	0	110.8	R103 M518 N522 G523 E524 T526	R103-T520 PolarHBondContact NH2-O 2.78Å; M518-T520 PolarHBondContact O-N 2.87Å; T520-N522 PolarHBondContact O-N 2.74Å; T520-N522 VanDerWaalsContact O-N 3.11Å; T520-G523 WeakPolarHBondContact O-CA 3.49Å; T520-G523 PolarHBondContact O-N 3.32Å; T520-E524 WeakPolarHBondContact CB-O 3.2Å; T520-E524 WeakPolarHBondContact CG2-O 3.45Å; T520-E524 PolarHBondContact N-O 3.26Å; T520-E524 PolarHBondContact OG1-N 3.48Å; T520-E524 PolarHBondContact OG1-O 2.77Å; T520-T526 HydrophobicContact CG2-CG2 3.97Å
521	E	62	Low	67.6	Low	188 Å²	188	69.9 Å²	69.9	88%	0.879	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-34.7	177.9	-71.1	-174.9	161.4	0	0	112.4	G523	E521-G523 VanDerWaalsContact C-N 3.32Å; E521-G523 PolarHBondContact O-N 3.02Å
522	N	57	Low	67.8	Low	127 Å²	127	73.8 Å²	73.8	68%	0.679	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-11.5	177.4	-64.4	-17.4	0	0	0	113.9	R106 T520 E524	R106-N522 PolarHBondContact NH2-O 2.9Å; T520-N522 PolarHBondContact O-N 2.74Å; T520-N522 VanDerWaalsContact O-N 3.11Å; N522-E524 VanDerWaalsContact C-N 3.34Å
523	G	54.8	Low	68.1	Low	26 Å²	26	74.6 Å²	74.6	27%	0.268	41%	0.409	S	S	.	.	S	Bend	trans	80.4	11.7	-176	0	0	0	0	0	114.2	T520 E521	T520-G523 WeakPolarHBondContact O-CA 3.49Å; T520-G523 PolarHBondContact O-N 3.32Å; E521-G523 VanDerWaalsContact C-N 3.32Å; E521-G523 PolarHBondContact O-N 3.02Å
524	E	52.4	Low	68.2	Low	142 Å²	142	75.5 Å²	75.5	66%	0.664	42%	0.415	S	S	*	.			trans	-85.8	133.4	168.7	-73.7	-178.4	163.7	0	0	109.6	T520 N522	T520-E524 WeakPolarHBondContact CB-O 3.2Å; T520-E524 WeakPolarHBondContact CG2-O 3.45Å; T520-E524 PolarHBondContact N-O 3.26Å; T520-E524 PolarHBondContact OG1-N 3.48Å; T520-E524 PolarHBondContact OG1-O 2.77Å; N522-E524 VanDerWaalsContact C-N 3.34Å
525	R	54.7	Low	68.2	Low	59 Å²	59	74.9 Å²	74.9	22%	0.223	41%	0.411	C	S	.	.			trans	-83.6	114.3	174.1	-81.1	178.9	169.8	166.8	3.5	109	E95 S101 S517 T527	E95-R525 IonicContact OE1-CZ 3.13Å; E95-R525 IonicContact OE1-NE 2.72Å; E95-R525 IonicContact OE1-NH1 2.69Å; E95-R525 PolarHBondContact OE1-NH1 2.94Å; E95-R525 IonicContact OE2-CZ 3.29Å; E95-R525 IonicContact OE2-NH1 2.77Å; E95-R525 PolarHBondContact OE2-NH1 3.47Å; E95-R525 IonicContact OE2-NH2 2.67Å; S101-R525 VanDerWaalsContact CB-NH2 3.33Å; S517-R525 WeakPolarHBondContact OG-CB 3.41Å; S517-R525 WeakPolarHBondContact OG-CD 3.4Å; S517-R525 VanDerWaalsContact OG-CG 3.3Å; S517-R525 WeakPolarHBondContact OG-CG 3.33Å; R525-T527 PolarHBondContact O-N 3.3Å
526	T	52.3	Low	67.8	Low	92 Å²	92	75.9 Å²	75.9	56%	0.564	41%	0.414	S	S	*	.			trans	-82.1	94.3	170.9	50.8	0	0	0	0	108.7	T520	T520-T526 HydrophobicContact CG2-CG2 3.97Å
527	T	52.8	Low	67.5	Low	103 Å²	103	77.8 Å²	77.8	63%	0.632	42%	0.424	S	S	*	.			trans	-91.6	116.3	161.9	50.6	0	0	0	0	107.4	R525 A529	R525-T527 PolarHBondContact O-N 3.3Å; T527-A529 PolarHBondContact O-N 3.45Å
528	N	56.5	Low	67.2	Low	128 Å²	128	81 Å²	81	68%	0.684	44%	0.438	S	S	*	.			trans	-65.3	107.1	161.4	-91.2	-15	0	0	0	105.9	E530 T531	N528-E530 PolarHBondContact O-N 3.03Å; N528-T531 VanDerWaalsContact CB-OG1 3.29Å; N528-T531 WeakPolarHBondContact CB-OG1 3.38Å; N528-T531 PolarHBondContact O-N 3.38Å; N528-T531 PolarHBondContact O-OG1 3.32Å
529	A	58	Low	66.9	Low	106 Å²	106	84.5 Å²	84.5	88%	0.876	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-15.7	-172.4	0	0	0	0	0	114.4	T527	T527-A529 PolarHBondContact O-N 3.45Å
530	E	66	Low	67	Low	126 Å²	126	84.3 Å²	84.3	59%	0.589	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-6.4	177.2	-65.6	-175	175.1	0	0	114.5	N528 K554	N528-E530 PolarHBondContact O-N 3.03Å; E530-K554 WeakPolarHBondContact OE2-CE 3.25Å; E530-K554 IonicContact OE2-NZ 2.74Å; E530-K554 PolarHBondContact OE2-NZ 2.97Å
531	T	71.7	Confident	66.8	Low	26 Å²	26	88.2 Å²	88.2	16%	0.16	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	116.8	-171.1	-12.1	0	0	0	0	110.3	N528 E552 L553 I559	N528-T531 VanDerWaalsContact CB-OG1 3.29Å; N528-T531 WeakPolarHBondContact CB-OG1 3.38Å; N528-T531 PolarHBondContact O-N 3.38Å; N528-T531 PolarHBondContact O-OG1 3.32Å; T531-E552 HydrophobicContact CG2-CG 3.62Å; T531-E552 WeakPolarHBondContact CG2-OE1 3.3Å; T531-L553 WeakPolarHBondContact CA-O 3.25Å; T531-L553 WeakPolarHBondContact CG2-O 3.41Å; T531-I559 HydrophobicContact CG2-CD1 4.26Å
532	E	80.7	Confident	66.7	Low	132 Å²	132	83.6 Å²	83.6	62%	0.617	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	150.2	177.4	-68.3	-178	167.6	0	0	109.9	L553	E532-L553 HydrophobicContact CB-CB 4.31Å; E532-L553 PolarHBondContact N-O 3.04Å; E532-L553 PolarHBondContact O-N 2.86Å
533	Y	84.7	Confident	66.7	Low	62 Å²	62	80.3 Å²	80.3	24%	0.243	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	130.9	175.7	-66.2	-86.8	0	0	0	110	F491 V493 V515 L550 R551 E552	F491-Y533 HydrophobicContact CB-CE1 3.87Å; F491-Y533 AromaticContact CD1-CE1 3.76Å; F491-Y533 HydrophobicContact CD1-CE1 3.76Å; F491-Y533 HydrophobicContact CG-CE1 4.07Å; V493-Y533 HydrophobicContact CG1-CD2 3.89Å; V493-Y533 HydrophobicContact CG1-CE2 3.87Å; V493-Y533 HydrophobicContact CG1-CG 4.27Å; V493-Y533 HydrophobicContact CG2-CD1 4.37Å; V515-Y533 HydrophobicContact CG1-CG 4.38Å; Y533-L550 HydrophobicContact CD1-CD1 4.38Å; Y533-L550 HydrophobicContact CD1-CD2 4.2Å; Y533-L550 HydrophobicContact CD1-CG 4.33Å; Y533-R551 WeakPolarHBondContact CA-O 3.42Å; Y533-E552 HydrophobicContact CD1-CB 4.04Å; Y533-E552 HydrophobicContact CD1-CG 4.21Å; Y533-E552 HydrophobicContact CE1-CB 3.76Å; Y533-E552 HydrophobicContact CE1-CG 3.6Å
534	V	83.5	Confident	67.1	Low	62 Å²	62	88.2 Å²	88.2	38%	0.376	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	123.6	175.9	177.8	0	0	0	0	108.1	M536 R551 L553	V534-M536 HydrophobicContact CG1-CG 4.12Å; V534-R551 PolarHBondContact N-O 2.9Å; V534-R551 PolarHBondContact O-N 2.95Å; V534-L553 HydrophobicContact CB-CD1 3.93Å; V534-L553 HydrophobicContact CG2-CD1 3.62Å
535	A	83	Confident	68	Low	8 Å²	8	85.4 Å²	85.4	7%	0.066	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	136	169	0	0	0	0	0	109.2	A495 T513 V515 L548 Q549 L550	A495-A535 HydrophobicContact CB-CB 4.25Å; T513-A535 PolarHBondContact OG1-O 3.31Å; V515-A535 HydrophobicContact CG2-CB 3.51Å; A535-L548 HydrophobicContact CB-CD1 4.01Å; A535-L548 HydrophobicContact CB-CG 4.48Å; A535-Q549 CarbonylContact C-O 3.56Å; A535-Q549 WeakPolarHBondContact CA-O 3.27Å; A535-L550 HydrophobicContact CB-CD1 4.32Å
536	M	79.1	Confident	68.9	Low	55 Å²	55	85 Å²	85	27%	0.271	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	139.1	175.2	-76.4	-172.3	-70.1	0	0	110.7	V534 Q549 R551	V534-M536 HydrophobicContact CG1-CG 4.12Å; M536-Q549 PolarHBondContact N-O 2.98Å; M536-Q549 PolarHBondContact O-N 3.1Å; M536-R551 HydrophobicContact CE-CG 4.43Å
537	L	76	Confident	70.4	Confident	46 Å²	46	83 Å²	83	24%	0.241	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	134.6	170.9	-71.9	159.2	0	0	0	109.7	I497 V511 T513 L546 Q547 L548 L566	I497-L537 HydrophobicContact CD1-CD2 4.44Å; V511-L537 HydrophobicContact CB-CD1 3.48Å; V511-L537 VanDerWaalsContact CB-CD1 3.48Å; V511-L537 HydrophobicContact CG1-CD1 3.19Å; V511-L537 HydrophobicContact CG2-CD1 4.33Å; T513-L537 HydrophobicContact CG2-CD1 3.69Å; T513-L537 HydrophobicContact CG2-CG 3.97Å; L537-L546 HydrophobicContact CB-CD1 4.48Å; L537-L546 HydrophobicContact CD2-CD2 3.94Å; L537-L546 HydrophobicContact CD2-CG 3.99Å; L537-Q547 CarbonylContact C-O 3.5Å; L537-Q547 WeakPolarHBondContact CA-O 3.21Å; L537-L548 HydrophobicContact CD2-CB 4.4Å; L537-L548 HydrophobicContact CD2-CD1 3.88Å; L537-L548 HydrophobicContact CG-CD1 4.06Å; L537-L566 HydrophobicContact CD2-CD1 3.41Å; L537-L566 VanDerWaalsContact CD2-CD1 3.41Å
538	M	74.6	Confident	71.9	Confident	80 Å²	80	78.1 Å²	78.1	39%	0.394	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	139.1	-176.7	-61.8	-69.3	-63.6	0	0	108.7	Q547 Q549	M538-Q547 HydrophobicContact CB-CB 4.48Å; M538-Q547 PolarHBondContact N-O 3.22Å; M538-Q547 PolarHBondContact O-N 2.96Å; M538-Q549 HydrophobicContact CG-CB 4.45Å
539	L	71.4	Confident	73.4	Confident	113 Å²	113	73.8 Å²	73.8	59%	0.592	41%	0.414	S	S	*	.			trans	-110.2	96.5	162.7	-95.3	129.3	0	0	0	106.9	D541 L546	L539-D541 PolarHBondContact O-N 3.27Å; L539-L546 HydrophobicContact CD1-CD1 3.48Å; L539-L546 VanDerWaalsContact CD1-CD1 3.48Å; L539-L546 HydrophobicContact CG-CD1 3.76Å
540	P	69.6	Low	74.9	Confident	41 Å²	41	68.9 Å²	68.9	27%	0.266	37%	0.372	S	S	.	.			trans	-61.1	136.6	179	-16.2	27.7	0	0	0	111	G542 T543 E545 Q547	P540-G542 PolarHBondContact O-N 2.62Å; P540-T543 WeakPolarHBondContact CD-OG1 3.45Å; P540-T543 PolarHBondContact O-N 3.22Å; P540-T543 VanDerWaalsContact O-N 3.08Å; P540-T543 PolarHBondContact O-OG1 3.37Å; P540-E545 WeakPolarHBondContact CD-O 3.11Å; P540-Q547 VanDerWaalsContact CG-CD 3.42Å; P540-Q547 HydrophobicContact CG-CG 3.99Å
541	D	62.4	Low	75.9	Confident	131 Å²	131	66.5 Å²	66.5	70%	0.701	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	128.8	179.2	-84.3	-31.1	0	0	0	111.1	L539 T543	L539-D541 PolarHBondContact O-N 3.27Å; D541-T543 VanDerWaalsContact C-N 3.34Å
542	G	58.7	Low	76.7	Confident	90 Å²	90	67.1 Å²	67.1	93%	0.928	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.4	1.7	177.8	0	0	0	0	0	115.3	P540	P540-G542 PolarHBondContact O-N 2.62Å
543	T	58.7	Low	76.9	Confident	59 Å²	59	62 Å²	62	36%	0.362	34%	0.336	S	S	.	.			trans	-119.4	139	172.7	64	0	0	0	0	110.2	P540 D541 E545	P540-T543 WeakPolarHBondContact CD-OG1 3.45Å; P540-T543 PolarHBondContact O-N 3.22Å; P540-T543 VanDerWaalsContact O-N 3.08Å; P540-T543 PolarHBondContact O-OG1 3.37Å; D541-T543 VanDerWaalsContact C-N 3.34Å; T543-E545 PolarHBondContact O-N 2.9Å
544	M	62.6	Low	76.9	Confident	192 Å²	192	63 Å²	63	95%	0.946	34%	0.342	S	S	*	.			trans	-86.2	19	168.1	-62.2	-159.9	85	0	0	111.6
545	E	70.3	Confident	76.8	Confident	82 Å²	82	66.7 Å²	66.7	38%	0.383	36%	0.359	S	S	.	.			trans	-103	117.1	-174.9	-62.4	-164.2	133.8	0	0	110.7	P540 T543 T565 S567	P540-E545 WeakPolarHBondContact CD-O 3.11Å; T543-E545 PolarHBondContact O-N 2.9Å; E545-T565 HydrophobicContact CB-CG2 3.89Å; E545-T565 HydrophobicContact CG-CG2 4.47Å; E545-S567 VanDerWaalsContact CD-OG 3.23Å; E545-S567 PolarHBondContact OE1-OG 3.02Å
546	L	74.4	Confident	76.4	Confident	52 Å²	52	69.1 Å²	69.1	27%	0.272	39%	0.385	S	S	.	.			trans	-72	128.7	174.7	-164.4	70.6	0	0	0	109.2	L537 L539 L566	L537-L546 HydrophobicContact CB-CD1 4.48Å; L537-L546 HydrophobicContact CD2-CD2 3.94Å; L537-L546 HydrophobicContact CD2-CG 3.99Å; L539-L546 HydrophobicContact CD1-CD1 3.48Å; L539-L546 VanDerWaalsContact CD1-CD1 3.48Å; L539-L546 HydrophobicContact CG-CD1 3.76Å; L546-L566 HydrophobicContact CB-CB 4.42Å; L546-L566 HydrophobicContact CB-CD1 4.09Å; L546-L566 HydrophobicContact CD2-CD1 3.54Å; L546-L566 HydrophobicContact CG-CD1 3.74Å; L546-L566 VanDerWaalsContact O-CB 3.28Å; L546-L566 WeakPolarHBondContact O-CB 3.29Å; L546-L566 PolarHBondContact O-N 3.11Å
547	Q	82.9	Confident	76.4	Confident	49 Å²	49	74 Å²	74	23%	0.229	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	136.6	178.3	-66.3	-174.6	-10.6	0	0	110.6	L537 M538 P540 T563 V564 T565	L537-Q547 CarbonylContact C-O 3.5Å; L537-Q547 WeakPolarHBondContact CA-O 3.21Å; M538-Q547 HydrophobicContact CB-CB 4.48Å; M538-Q547 PolarHBondContact N-O 3.22Å; M538-Q547 PolarHBondContact O-N 2.96Å; P540-Q547 VanDerWaalsContact CG-CD 3.42Å; P540-Q547 HydrophobicContact CG-CG 3.99Å; Q547-T563 HydrophobicContact CB-CG2 3.95Å; Q547-T563 HydrophobicContact CG-CG2 4.36Å; Q547-V564 CarbonylContact C-O 3.58Å; Q547-V564 WeakPolarHBondContact CA-O 3.32Å; Q547-T565 HydrophobicContact CG-CG2 4.41Å
548	L	85.5	Confident	76.8	Confident	0 Å²	0	75 Å²	75	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	118.8	167.5	-173.6	77.9	0	0	0	109.3	I486 F488 A495 I497 T513 A535 L537 T563 V564 L566	I486-L548 HydrophobicContact CB-CD2 4.19Å; I486-L548 HydrophobicContact CD1-CB 4.41Å; I486-L548 HydrophobicContact CD1-CD2 3.86Å; I486-L548 HydrophobicContact CG1-CD2 4.46Å; I486-L548 HydrophobicContact CG2-CD2 4.36Å; F488-L548 HydrophobicContact CE2-CD2 3.87Å; F488-L548 HydrophobicContact CZ-CD2 3.88Å; A495-L548 HydrophobicContact CB-CD2 3.52Å; I497-L548 HydrophobicContact CD1-CB 4.43Å; I497-L548 HydrophobicContact CD1-CD1 3.99Å; I497-L548 HydrophobicContact CD1-CD2 4.08Å; I497-L548 HydrophobicContact CD1-CG 4.38Å; I497-L548 HydrophobicContact CG1-CD1 4.33Å; I497-L548 HydrophobicContact CG1-CD2 4.46Å; T513-L548 HydrophobicContact CG2-CD1 3.89Å; A535-L548 HydrophobicContact CB-CD1 4.01Å; A535-L548 HydrophobicContact CB-CG 4.48Å; L537-L548 HydrophobicContact CD2-CB 4.4Å; L537-L548 HydrophobicContact CD2-CD1 3.88Å; L537-L548 HydrophobicContact CG-CD1 4.06Å; L548-T563 CarbonylContact O-C 3.55Å; L548-T563 WeakPolarHBondContact O-CA 3.44Å; L548-V564 PolarHBondContact N-O 3.36Å; L548-V564 PolarHBondContact O-N 2.83Å; L548-L566 HydrophobicContact CB-CD2 4.3Å
549	Q	87.3	Confident	77.5	Confident	38 Å²	38	75.8 Å²	75.8	18%	0.178	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	112.8	175	-172.7	173.3	74.7	0	0	110.5	A535 M536 M538 R551 V561 A562	A535-Q549 CarbonylContact C-O 3.56Å; A535-Q549 WeakPolarHBondContact CA-O 3.27Å; M536-Q549 PolarHBondContact N-O 2.98Å; M536-Q549 PolarHBondContact O-N 3.1Å; M538-Q549 HydrophobicContact CG-CB 4.45Å; Q549-R551 HydrophobicContact CG-CG 4.27Å; Q549-R551 VanDerWaalsContact OE1-CZ 3.27Å; Q549-V561 VanDerWaalsContact CD-CG1 3.43Å; Q549-V561 HydrophobicContact CG-CG1 3.34Å; Q549-V561 VanDerWaalsContact NE2-CG1 3.32Å; Q549-A562 CarbonylContact C-O 3.56Å; Q549-A562 VanDerWaalsContact CA-O 3.31Å; Q549-A562 WeakPolarHBondContact CA-O 3.26Å
550	L	88.7	Confident	78.2	Confident	2 Å²	2	71.9 Å²	71.9	1%	0.01	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	125.8	168.7	-175.1	75.3	0	0	0	109.2	F488 F491 V493 V515 Y533 A535 V561 A562	F488-L550 HydrophobicContact CB-CD2 3.78Å; F488-L550 HydrophobicContact CD1-CB 4.08Å; F488-L550 HydrophobicContact CD1-CD2 3.72Å; F488-L550 HydrophobicContact CD2-CB 4.44Å; F488-L550 HydrophobicContact CD2-CD2 3.82Å; F488-L550 HydrophobicContact CE1-CB 3.69Å; F488-L550 HydrophobicContact CE1-CD2 4.22Å; F488-L550 HydrophobicContact CE2-CB 4.08Å; F488-L550 HydrophobicContact CE2-CD2 4.31Å; F488-L550 HydrophobicContact CG-CB 4.44Å; F488-L550 HydrophobicContact CG-CD2 3.5Å; F488-L550 VanDerWaalsContact CG-CD2 3.5Å; F488-L550 HydrophobicContact CZ-CB 3.7Å; F488-L550 HydrophobicContact CZ-CD2 4.49Å; F491-L550 HydrophobicContact CB-CD2 4.35Å; F491-L550 HydrophobicContact CD2-CD2 3.97Å; F491-L550 HydrophobicContact CG-CD2 4.18Å; V493-L550 HydrophobicContact CG2-CD1 4.38Å; V493-L550 HydrophobicContact CG2-CD2 3.62Å; V515-L550 HydrophobicContact CG1-CD1 3.95Å; V515-L550 HydrophobicContact CG2-CD1 3.75Å; Y533-L550 HydrophobicContact CD1-CD1 4.38Å; Y533-L550 HydrophobicContact CD1-CD2 4.2Å; Y533-L550 HydrophobicContact CD1-CG 4.33Å; A535-L550 HydrophobicContact CB-CD1 4.32Å; L550-V561 CarbonylContact O-C 3.55Å; L550-V561 WeakPolarHBondContact O-CA 3.2Å; L550-A562 HydrophobicContact CB-CB 4.46Å; L550-A562 PolarHBondContact N-O 2.85Å; L550-A562 PolarHBondContact O-N 2.61Å
551	R	88.2	Confident	79.1	Confident	76 Å²	76	73.5 Å²	73.5	29%	0.287	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.9	173.5	-59.3	-170.7	180	176.9	3.7	109.3	Y533 V534 M536 Q549 L553 V558 V561	Y533-R551 WeakPolarHBondContact CA-O 3.42Å; V534-R551 PolarHBondContact N-O 2.9Å; V534-R551 PolarHBondContact O-N 2.95Å; M536-R551 HydrophobicContact CE-CG 4.43Å; Q549-R551 HydrophobicContact CG-CG 4.27Å; Q549-R551 VanDerWaalsContact OE1-CZ 3.27Å; R551-L553 HydrophobicContact CB-CD1 4.3Å; R551-L553 WeakPolarHBondContact O-CD1 3.32Å; R551-V558 HydrophobicContact CB-CG1 4.24Å; R551-V558 HydrophobicContact CB-CG2 4.46Å; R551-V558 HydrophobicContact CG-CG1 4.45Å; R551-V561 HydrophobicContact CG-CG1 4.48Å; R551-V561 HydrophobicContact CG-CG2 4.25Å
552	E	88.4	Confident	80.3	Confident	39 Å²	39	68.3 Å²	68.3	18%	0.182	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	126.4	167.9	-173.4	-174.3	-169.5	0	0	108.2	F491 T531 Y533 V558 I559 S560	F491-E552 HydrophobicContact CE1-CB 4.46Å; F491-E552 WeakPolarHBondContact CE1-OE2 3.4Å; T531-E552 HydrophobicContact CG2-CG 3.62Å; T531-E552 WeakPolarHBondContact CG2-OE1 3.3Å; Y533-E552 HydrophobicContact CD1-CB 4.04Å; Y533-E552 HydrophobicContact CD1-CG 4.21Å; Y533-E552 HydrophobicContact CE1-CB 3.76Å; Y533-E552 HydrophobicContact CE1-CG 3.6Å; E552-V558 CarbonylContact O-C 3.49Å; E552-V558 WeakPolarHBondContact O-CA 3.24Å; E552-I559 HydrophobicContact CB-CG1 4.04Å; E552-I559 VanDerWaalsContact CD-CD1 3.5Å; E552-I559 HydrophobicContact CG-CD1 3.77Å; E552-I559 HydrophobicContact CG-CG1 3.76Å; E552-I559 WeakPolarHBondContact O-CG1 3.3Å; E552-I559 PolarHBondContact O-N 2.97Å; E552-S560 WeakPolarHBondContact CB-OG 3.36Å; E552-S560 PolarHBondContact N-O 2.74Å; E552-S560 WeakPolarHBondContact OE2-CB 3.48Å; E552-S560 PolarHBondContact OE2-OG 2.93Å
553	L	84.2	Confident	81.7	Confident	26 Å²	26	67.2 Å²	67.2	14%	0.136	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	136.6	179.1	-59.7	96.7	0	0	0	110.3	T531 E532 V534 R551 K557 V558	T531-L553 WeakPolarHBondContact CA-O 3.25Å; T531-L553 WeakPolarHBondContact CG2-O 3.41Å; E532-L553 HydrophobicContact CB-CB 4.31Å; E532-L553 PolarHBondContact N-O 3.04Å; E532-L553 PolarHBondContact O-N 2.86Å; V534-L553 HydrophobicContact CB-CD1 3.93Å; V534-L553 HydrophobicContact CG2-CD1 3.62Å; R551-L553 HydrophobicContact CB-CD1 4.3Å; R551-L553 WeakPolarHBondContact O-CD1 3.32Å; L553-K557 VanDerWaalsContact CA-O 3.27Å; L553-K557 WeakPolarHBondContact CA-O 3.39Å; L553-V558 HydrophobicContact CD2-CG2 4.39Å; L553-V558 HydrophobicContact CG-CG2 4.4Å
554	K	84.6	Confident	82.9	Confident	81 Å²	81	66.3 Å²	66.3	35%	0.352	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	125	166.2	-176.4	166.6	-174.4	155.5	0	108.4	E530 G556 K557 I559	E530-K554 WeakPolarHBondContact OE2-CE 3.25Å; E530-K554 IonicContact OE2-NZ 2.74Å; E530-K554 PolarHBondContact OE2-NZ 2.97Å; K554-G556 PolarHBondContact O-N 2.91Å; K554-K557 PolarHBondContact N-O 3.18Å; K554-K557 PolarHBondContact O-N 2.91Å; K554-I559 HydrophobicContact CB-CD1 3.94Å; K554-I559 HydrophobicContact CB-CG1 4.45Å; K554-I559 HydrophobicContact CB-CG2 4.16Å
555	D	82.2	Confident	83.9	Confident	140 Å²	140	58.4 Å²	58.4	75%	0.749	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	42.6	-175.5	-54	-47.3	0	0	0	112.8	K557	D555-K557 PolarHBondContact O-N 3.48Å
556	G	74.1	Confident	84.2	Confident	59 Å²	59	54.7 Å²	54.7	61%	0.608	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	0.1	-178.3	0	0	0	0	0	115.7	K554	K554-G556 PolarHBondContact O-N 2.91Å
557	K	78.8	Confident	84	Confident	157 Å²	157	53.8 Å²	53.8	68%	0.683	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.5	132.2	177.1	-69.5	-178.9	-178.9	174.2	0	111.3	L553 K554 D555 I559	L553-K557 VanDerWaalsContact CA-O 3.27Å; L553-K557 WeakPolarHBondContact CA-O 3.39Å; K554-K557 PolarHBondContact N-O 3.18Å; K554-K557 PolarHBondContact O-N 2.91Å; D555-K557 PolarHBondContact O-N 3.48Å; K557-I559 PolarHBondContact O-N 2.88Å
558	V	84.9	Confident	83	Confident	69 Å²	69	56.3 Å²	56.3	42%	0.418	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	119.1	173.5	-178	0	0	0	0	109.2	R551 E552 L553 V561	R551-V558 HydrophobicContact CB-CG1 4.24Å; R551-V558 HydrophobicContact CB-CG2 4.46Å; R551-V558 HydrophobicContact CG-CG1 4.45Å; E552-V558 CarbonylContact O-C 3.49Å; E552-V558 WeakPolarHBondContact O-CA 3.24Å; L553-V558 HydrophobicContact CD2-CG2 4.39Å; L553-V558 HydrophobicContact CG-CG2 4.4Å; V558-V561 HydrophobicContact CG1-CG2 3.5Å; V558-V561 VanDerWaalsContact CG1-CG2 3.5Å
559	I	88.9	Confident	81.7	Confident	96 Å²	96	57.4 Å²	57.4	49%	0.492	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	-26.6	178.6	53.4	166.7	0	0	0	112.7	T531 E552 K554 K557	T531-I559 HydrophobicContact CG2-CD1 4.26Å; E552-I559 HydrophobicContact CB-CG1 4.04Å; E552-I559 VanDerWaalsContact CD-CD1 3.5Å; E552-I559 HydrophobicContact CG-CD1 3.77Å; E552-I559 HydrophobicContact CG-CG1 3.76Å; E552-I559 WeakPolarHBondContact O-CG1 3.3Å; E552-I559 PolarHBondContact O-N 2.97Å; K554-I559 HydrophobicContact CB-CD1 3.94Å; K554-I559 HydrophobicContact CB-CG1 4.45Å; K554-I559 HydrophobicContact CB-CG2 4.16Å; K557-I559 PolarHBondContact O-N 2.88Å
560	S	87.2	Confident	80.1	Confident	31 Å²	31	59.7 Å²	59.7	22%	0.217	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	156.9	174.6	80	0	0	0	0	111.1	F491 E552	F491-S560 WeakPolarHBondContact CE1-OG 3.27Å; F491-S560 WeakPolarHBondContact CZ-OG 3.46Å; E552-S560 WeakPolarHBondContact CB-OG 3.36Å; E552-S560 PolarHBondContact N-O 2.74Å; E552-S560 WeakPolarHBondContact OE2-CB 3.48Å; E552-S560 PolarHBondContact OE2-OG 2.93Å
561	V	87.8	Confident	78.1	Confident	74 Å²	74	63.4 Å²	63.4	45%	0.448	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	130	-178.6	-176.9	0	0	0	0	109.1	Q549 L550 R551 V558	Q549-V561 VanDerWaalsContact CD-CG1 3.43Å; Q549-V561 HydrophobicContact CG-CG1 3.34Å; Q549-V561 VanDerWaalsContact NE2-CG1 3.32Å; L550-V561 CarbonylContact O-C 3.55Å; L550-V561 WeakPolarHBondContact O-CA 3.2Å; R551-V561 HydrophobicContact CG-CG1 4.48Å; R551-V561 HydrophobicContact CG-CG2 4.25Å; V558-V561 HydrophobicContact CG1-CG2 3.5Å; V558-V561 VanDerWaalsContact CG1-CG2 3.5Å
562	A	87.9	Confident	75.9	Confident	23 Å²	23	62.3 Å²	62.3	19%	0.19	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	141.1	168.8	0	0	0	0	0	109.5	F488 F491 Q549 L550	F488-A562 HydrophobicContact CD1-CB 3.86Å; F488-A562 HydrophobicContact CE1-CB 3.8Å; F491-A562 HydrophobicContact CE2-CB 3.83Å; Q549-A562 CarbonylContact C-O 3.56Å; Q549-A562 VanDerWaalsContact CA-O 3.31Å; Q549-A562 WeakPolarHBondContact CA-O 3.26Å; L550-A562 HydrophobicContact CB-CB 4.46Å; L550-A562 PolarHBondContact N-O 2.85Å; L550-A562 PolarHBondContact O-N 2.61Å
563	T	87.2	Confident	73.7	Confident	67 Å²	67	63.7 Å²	63.7	41%	0.411	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	135.8	-178.8	-52.6	0	0	0	0	109.4	Q547 L548	Q547-T563 HydrophobicContact CB-CG2 3.95Å; Q547-T563 HydrophobicContact CG-CG2 4.36Å; L548-T563 CarbonylContact O-C 3.55Å; L548-T563 WeakPolarHBondContact O-CA 3.44Å
564	V	85.2	Confident	71.2	Confident	39 Å²	39	68.2 Å²	68.2	24%	0.236	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	128.3	176.5	176.9	0	0	0	0	108.1	I486 F488 Q547 L548 V569	I486-V564 HydrophobicContact CD1-CG1 4.36Å; I486-V564 HydrophobicContact CG2-CB 4.33Å; I486-V564 HydrophobicContact CG2-CG1 4.21Å; I486-V564 HydrophobicContact CG2-CG2 4Å; F488-V564 HydrophobicContact CE1-CG2 3.81Å; F488-V564 HydrophobicContact CZ-CG2 3.94Å; Q547-V564 CarbonylContact C-O 3.58Å; Q547-V564 WeakPolarHBondContact CA-O 3.32Å; L548-V564 PolarHBondContact N-O 3.36Å; L548-V564 PolarHBondContact O-N 2.83Å; V564-V569 HydrophobicContact CG1-CG2 3.6Å
565	T	82.9	Confident	68.9	Low	27 Å²	27	69.4 Å²	69.4	17%	0.166	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	127.5	172.3	-51.4	0	0	0	0	109.3	E545 Q547 S567 D568	E545-T565 HydrophobicContact CB-CG2 3.89Å; E545-T565 HydrophobicContact CG-CG2 4.47Å; Q547-T565 HydrophobicContact CG-CG2 4.41Å; T565-S567 WeakPolarHBondContact CG2-OG 3.25Å; T565-D568 WeakPolarHBondContact CB-OD2 3.23Å
566	L	76.6	Confident	66.6	Low	4 Å²	4	69.7 Å²	69.7	2%	0.021	40%	0.399	C	S	.	.	H	α-helix	trans	-79.6	-25	-174.6	-66.6	174.5	0	0	0	113.6	M484 I486 I497 L537 L546 L548 D568 V569 L570	M484-L566 HydrophobicContact CE-CD2 4.34Å; I486-L566 HydrophobicContact CD1-CD2 3.24Å; I497-L566 HydrophobicContact CD1-CD1 4.05Å; I497-L566 HydrophobicContact CD1-CD2 3.61Å; L537-L566 HydrophobicContact CD2-CD1 3.41Å; L537-L566 VanDerWaalsContact CD2-CD1 3.41Å; L546-L566 HydrophobicContact CB-CB 4.42Å; L546-L566 HydrophobicContact CB-CD1 4.09Å; L546-L566 HydrophobicContact CD2-CD1 3.54Å; L546-L566 HydrophobicContact CG-CD1 3.74Å; L546-L566 VanDerWaalsContact O-CB 3.28Å; L546-L566 WeakPolarHBondContact O-CB 3.29Å; L546-L566 PolarHBondContact O-N 3.11Å; L548-L566 HydrophobicContact CB-CD2 4.3Å; L566-D568 VanDerWaalsContact C-N 3.26Å; L566-D568 PolarHBondContact O-N 3.44Å; L566-V569 HydrophobicContact CD2-CG2 4.49Å; L566-V569 PolarHBondContact O-N 3.31Å; L566-V569 VanDerWaalsContact O-N 3.15Å; L566-L570 PolarHBondContact O-N 2.99Å
567	S	70.2	Confident	64.6	Low	33 Å²	33	71.9 Å²	71.9	23%	0.231	40%	0.401	C	S	.	.	H	α-helix	trans	-57.5	-43.9	170.1	44.8	0	0	0	0	110.3	E545 T565 V569 L570 V571	E545-S567 VanDerWaalsContact CD-OG 3.23Å; E545-S567 PolarHBondContact OE1-OG 3.02Å; T565-S567 WeakPolarHBondContact CG2-OG 3.25Å; S567-V569 VanDerWaalsContact C-N 3.3Å; S567-V569 PolarHBondContact O-N 2.98Å; S567-L570 PolarHBondContact O-N 2.84Å; S567-V571 WeakPolarHBondContact O-CB 3.27Å; S567-V571 VanDerWaalsContact O-CG2 3.25Å; S567-V571 WeakPolarHBondContact O-CG2 3.31Å; S567-V571 PolarHBondContact O-N 3.49Å
568	D	63.1	Low	62.1	Low	101 Å²	101	71 Å²	71	54%	0.54	42%	0.423	S	S	.	.	H	α-helix	trans	-61.7	-37.8	175.5	-65	-31.2	0	0	0	112.3	T565 L566 S572	T565-D568 WeakPolarHBondContact CB-OD2 3.23Å; L566-D568 VanDerWaalsContact C-N 3.26Å; L566-D568 PolarHBondContact O-N 3.44Å; D568-S572 VanDerWaalsContact O-CB 3.25Å; D568-S572 WeakPolarHBondContact O-CB 2.97Å; D568-S572 PolarHBondContact O-N 3.21Å; D568-S572 PolarHBondContact O-OG 2.99Å
569	V	58.1	Low	61	Low	23 Å²	23	71.1 Å²	71.1	14%	0.139	42%	0.423	C	S	.	.	H	α-helix	trans	-68.4	-44.1	177.7	179.4	0	0	0	0	111.1	I486 V564 L566 S567 S572 K573	I486-V569 HydrophobicContact CD1-CG2 4.24Å; V564-V569 HydrophobicContact CG1-CG2 3.6Å; L566-V569 HydrophobicContact CD2-CG2 4.49Å; L566-V569 PolarHBondContact O-N 3.31Å; L566-V569 VanDerWaalsContact O-N 3.15Å; S567-V569 VanDerWaalsContact C-N 3.3Å; S567-V569 PolarHBondContact O-N 2.98Å; V569-S572 WeakPolarHBondContact CA-OG 3.33Å; V569-S572 PolarHBondContact O-N 3.41Å; V569-S572 PolarHBondContact O-OG 2.9Å; V569-K573 PolarHBondContact O-N 2.92Å
570	L	53	Low	59.5	Low	87 Å²	87	69.8 Å²	69.8	46%	0.455	42%	0.42	S	S	.	.	H	α-helix	trans	-63.7	-43.7	175.8	-85.1	155.6	0	0	0	111.8	M484 L566 S567 K573 L574	M484-L570 HydrophobicContact SD-CG 4.41Å; L566-L570 PolarHBondContact O-N 2.99Å; S567-L570 PolarHBondContact O-N 2.84Å; L570-K573 PolarHBondContact O-N 3.09Å; L570-L574 WeakPolarHBondContact O-CG 3.46Å; L570-L574 PolarHBondContact O-N 3.15Å
571	V	46.3	Very low	58	Low	80 Å²	80	71.9 Å²	71.9	49%	0.485	43%	0.431	S	S	.	.	H	α-helix	trans	-66.2	-39.7	176.1	172.9	0	0	0	0	111.3	S567 L574 N575	S567-V571 WeakPolarHBondContact O-CB 3.27Å; S567-V571 VanDerWaalsContact O-CG2 3.25Å; S567-V571 WeakPolarHBondContact O-CG2 3.31Å; S567-V571 PolarHBondContact O-N 3.49Å; V571-L574 PolarHBondContact O-N 2.9Å; V571-N575 PolarHBondContact O-N 3.17Å
572	S	43.4	Very low	56.2	Low	53 Å²	53	71.8 Å²	71.8	37%	0.371	43%	0.43	S	S	.	.	H	α-helix	trans	-63.6	-41.8	176.2	72.7	0	0	0	0	112.2	D568 V569 L574 N575 D576	D568-S572 VanDerWaalsContact O-CB 3.25Å; D568-S572 WeakPolarHBondContact O-CB 2.97Å; D568-S572 PolarHBondContact O-N 3.21Å; D568-S572 PolarHBondContact O-OG 2.99Å; V569-S572 WeakPolarHBondContact CA-OG 3.33Å; V569-S572 PolarHBondContact O-N 3.41Å; V569-S572 PolarHBondContact O-OG 2.9Å; S572-L574 VanDerWaalsContact C-N 3.34Å; S572-L574 PolarHBondContact O-N 3.49Å; S572-N575 PolarHBondContact O-N 2.83Å; S572-D576 PolarHBondContact O-N 3.48Å
573	K	41.4	Very low	54.3	Low	67 Å²	67	74.9 Å²	74.9	29%	0.291	45%	0.445	S	S	.	.	H	α-helix	trans	-65.9	-34	175.7	-82.3	-171.4	166.3	-161.3	0	113.1	V569 L570 T577	V569-K573 PolarHBondContact O-N 2.92Å; L570-K573 PolarHBondContact O-N 3.09Å; K573-T577 PolarHBondContact O-OG1 2.93Å
574	L	32.4	Very low	52.1	Low	121 Å²	121	75.4 Å²	75.4	63%	0.634	45%	0.447	S	S	*	.	H	α-helix	trans	-72.3	-29.9	174.2	-75.4	166.7	0	0	0	112.6	L570 V571 S572 T577	L570-L574 WeakPolarHBondContact O-CG 3.46Å; L570-L574 PolarHBondContact O-N 3.15Å; V571-L574 PolarHBondContact O-N 2.9Å; S572-L574 VanDerWaalsContact C-N 3.34Å; S572-L574 PolarHBondContact O-N 3.49Å; L574-T577 WeakPolarHBondContact CA-OG1 3.44Å; L574-T577 PolarHBondContact O-OG1 3.39Å
575	N	34.9	Very low	49.7	Very low	107 Å²	107	78 Å²	78	57%	0.572	46%	0.462	S	S	*	.	H	α-helix	trans	-79.4	-29.5	175.3	-77.8	-26.1	0	0	0	113	V571 S572 T577 A578	V571-N575 PolarHBondContact O-N 3.17Å; S572-N575 PolarHBondContact O-N 2.83Å; N575-T577 PolarHBondContact O-N 3.19Å; N575-A578 PolarHBondContact O-N 2.73Å
576	D	34.7	Very low	47.2	Very low	145 Å²	145	81.9 Å²	81.9	78%	0.775	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-11	174.4	-78.6	-19.6	0	0	0	113	S572	S572-D576 PolarHBondContact O-N 3.48Å
577	T	32.9	Very low	44.7	Very low	106 Å²	106	88.4 Å²	88.4	65%	0.65	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-0.9	175.3	33.7	0	0	0	0	114.2	K573 L574 N575	K573-T577 PolarHBondContact O-OG1 2.93Å; L574-T577 WeakPolarHBondContact CA-OG1 3.44Å; L574-T577 PolarHBondContact O-OG1 3.39Å; N575-T577 PolarHBondContact O-N 3.19Å
578	A	26.2	Very low	42.4	Very low	138 Å²	138	93.5 Å²	93.5	100%	1.141	55%	0.55	S	S	*	*			trans	-105.4	0	174.1	0	0	0	0	0	111.3	N575	N575-A578 PolarHBondContact O-N 2.73Å

Retrieved 578 of 578 residues in 580.9 ms (Link to these results)

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