A0A087Y339_POEFO Loading...

Hexosyltransferase

AlphaFold DB , UniProt , Accession A0A087Y339, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 766 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	R	43.6	Very low	51.4	Low	292 Å²	292	145.2 Å²	145.2	100%	1.102	75%	0.747	S	S	*	*				0	108.3	0	-90.5	175.6	172.9	170.8	-3.4	108.3
2	S	47.7	Very low	52.1	Low	118 Å²	118	144.3 Å²	144.3	83%	0.825	74%	0.744	S	S	*	*			trans	67.1	48.6	141.8	-39	0	0	0	0	122.5
3	T	49.8	Very low	52.4	Low	142 Å²	142	142.4 Å²	142.4	87%	0.871	73%	0.727	S	S	*	*	S	Bend	trans	-152.6	24.2	162	45.4	0	0	0	0	115.2
4	M	46.7	Very low	52.8	Low	174 Å²	174	147.2 Å²	147.2	86%	0.857	73%	0.731	S	S	*	*	S	Bend	trans	-128.6	27.9	-175	-123.6	177.7	-176.8	0	0	115
5	R	51.4	Low	53.4	Low	215 Å²	215	144.1 Å²	144.1	81%	0.811	73%	0.726	S	S	*	*	S	Bend	trans	-123.9	-3.7	178.3	-77.7	-171.5	177.6	-176.5	-1.2	116.1
6	L	53.2	Low	54.2	Low	143 Å²	143	137.3 Å²	137.3	75%	0.749	70%	0.698	S	S	*	*	S	Bend	trans	-90.1	-29	-179.4	-113.5	95.4	0	0	0	114.2
7	S	52.5	Low	55.2	Low	90 Å²	90	135.1 Å²	135.1	63%	0.629	69%	0.688	S	S	*	*	H	α-helix	trans	-74	-27.6	-176.5	50.8	0	0	0	0	113.3
8	T	53.8	Low	56.4	Low	92 Å²	92	132.3 Å²	132.3	56%	0.564	68%	0.681	S	S	*	*	H	α-helix	trans	-79	-29.1	179.2	-13.1	0	0	0	0	112.9
9	F	54.7	Low	57.5	Low	147 Å²	147	131.4 Å²	131.4	65%	0.645	68%	0.676	S	S	*	*	H	α-helix	trans	-73.9	-34	175.9	-97.4	-85.7	0	0	0	112.6	A11	F9-A11 VanDerWaalsContact C-N 3.33Å; F9-A11 PolarHBondContact O-N 3.48Å
10	L	54.8	Low	58.6	Low	118 Å²	118	129.6 Å²	129.6	62%	0.618	67%	0.667	S	S	*	*	H	α-helix	trans	-73.7	-21.2	178.1	-82.9	158.2	0	0	0	113.7
11	A	57.8	Low	59.7	Low	66 Å²	66	128.4 Å²	128.4	55%	0.545	66%	0.662	S	S	.	*	H	α-helix	trans	-77.2	-31.7	176.9	0	0	0	0	0	112.9	F9	F9-A11 VanDerWaalsContact C-N 3.33Å; F9-A11 PolarHBondContact O-N 3.48Å
12	L	58.7	Low	61.5	Low	135 Å²	135	116.7 Å²	116.7	71%	0.707	63%	0.631	S	S	*	*	H	α-helix	trans	-73.7	-24.7	178.2	-88.9	149.8	0	0	0	113.6
13	F	56	Low	63.2	Low	119 Å²	119	116.1 Å²	116.1	52%	0.522	62%	0.619	S	S	.	*	S	Bend	trans	-92	-8.6	-179	-88.1	-82.7	0	0	0	114.9	A16 L17	F13-A16 HydrophobicContact CD1-CB 4.45Å; F13-A16 PolarHBondContact O-N 3.08Å; F13-L17 PolarHBondContact O-N 3.27Å; F13-L17 VanDerWaalsContact O-N 3.08Å
14	R	59	Low	64.8	Low	210 Å²	210	112.5 Å²	112.5	79%	0.792	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-38.5	179.6	-89.1	-174.8	173.5	178.2	-1.8	115.3	P18	R14-P18 WeakPolarHBondContact O-CD 3.43Å
15	P	61.5	Low	66.6	Low	101 Å²	101	109.3 Å²	109.3	66%	0.656	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-18.8	176.2	29.7	-31.6	0	0	0	113.6
16	A	66.4	Low	68.1	Low	34 Å²	34	100.9 Å²	100.9	28%	0.281	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.4	-26.8	-179.5	0	0	0	0	0	113	F13 L19 I20	F13-A16 HydrophobicContact CD1-CB 4.45Å; F13-A16 PolarHBondContact O-N 3.08Å; A16-L19 PolarHBondContact O-N 3.05Å; A16-I20 HydrophobicContact CB-CD1 4.38Å; A16-I20 WeakPolarHBondContact O-CG1 3.29Å; A16-I20 PolarHBondContact O-N 3.42Å
17	L	71.1	Confident	69.2	Low	100 Å²	100	97.9 Å²	97.9	52%	0.524	56%	0.555	S	S	.	*	H	α-helix	trans	-60	-45.1	-177.5	-141.1	108.6	0	0	0	113.8	F13 L19 I20 L21	F13-L17 PolarHBondContact O-N 3.27Å; F13-L17 VanDerWaalsContact O-N 3.08Å; L17-L19 VanDerWaalsContact C-N 3.26Å; L17-L19 PolarHBondContact O-N 2.68Å; L17-I20 PolarHBondContact O-N 3.14Å; L17-L21 HydrophobicContact CD2-CD1 3.93Å; L17-L21 HydrophobicContact CG-CD1 4.48Å; L17-L21 WeakPolarHBondContact O-CB 3.37Å; L17-L21 PolarHBondContact O-N 3.13Å
18	P	76.3	Confident	70.4	Confident	85 Å²	85	96.2 Å²	96.2	55%	0.552	54%	0.544	S	S	*	.	H	α-helix	trans	-65.2	-31.6	176.9	-17.8	30.7	0	0	0	112.4	R14 G22	R14-P18 WeakPolarHBondContact O-CD 3.43Å; P18-G22 PolarHBondContact O-N 3.27Å
19	L	77.4	Confident	71.4	Confident	115 Å²	115	96.4 Å²	96.4	60%	0.602	54%	0.541	S	S	*	.	H	α-helix	trans	-75.6	-39.3	-178	-157.6	141.3	0	0	0	111.2	A16 L17 G22 L23	A16-L19 PolarHBondContact O-N 3.05Å; L17-L19 VanDerWaalsContact C-N 3.26Å; L17-L19 PolarHBondContact O-N 2.68Å; L19-G22 PolarHBondContact O-N 2.82Å; L19-L23 HydrophobicContact CD2-CD1 3.73Å; L19-L23 WeakPolarHBondContact O-CB 3.33Å; L19-L23 WeakPolarHBondContact O-CG 3.41Å; L19-L23 PolarHBondContact O-N 3.23Å
20	I	79.8	Confident	72.2	Confident	96 Å²	96	92.8 Å²	92.8	49%	0.492	53%	0.534	S	S	.	.	H	α-helix	trans	-68.2	-43	173	-64.4	165.5	0	0	0	110.6	A16 L17 L23 S24	A16-I20 HydrophobicContact CB-CD1 4.38Å; A16-I20 WeakPolarHBondContact O-CG1 3.29Å; A16-I20 PolarHBondContact O-N 3.42Å; L17-I20 PolarHBondContact O-N 3.14Å; I20-L23 PolarHBondContact O-N 3.04Å; I20-S24 WeakPolarHBondContact O-CB 3.38Å; I20-S24 PolarHBondContact O-N 3.48Å; I20-S24 PolarHBondContact O-OG 3.39Å
21	L	81.7	Confident	72.8	Confident	105 Å²	105	93.8 Å²	93.8	55%	0.55	54%	0.539	S	S	.	.	H	α-helix	trans	-62	-45.1	173.9	-87	156.4	0	0	0	111.2	L17 S24 L25	L17-L21 HydrophobicContact CD2-CD1 3.93Å; L17-L21 HydrophobicContact CG-CD1 4.48Å; L17-L21 WeakPolarHBondContact O-CB 3.37Å; L17-L21 PolarHBondContact O-N 3.13Å; L21-S24 PolarHBondContact O-N 2.97Å; L21-S24 PolarHBondContact O-OG 2.95Å; L21-L25 WeakPolarHBondContact O-CB 3.45Å; L21-L25 PolarHBondContact O-N 3.18Å
22	G	81.6	Confident	73.2	Confident	45 Å²	45	97.6 Å²	97.6	46%	0.464	55%	0.549	S	S	.	.	H	α-helix	trans	-62.5	-43	177	0	0	0	0	0	113.5	P18 L19 G26	P18-G22 PolarHBondContact O-N 3.27Å; L19-G22 PolarHBondContact O-N 2.82Å; G22-G26 PolarHBondContact O-N 3.45Å
23	L	83.4	Confident	73.1	Confident	107 Å²	107	98.7 Å²	98.7	56%	0.56	55%	0.553	S	S	*	*	H	α-helix	trans	-66.2	-42.6	175.1	-84.4	165.2	0	0	0	112	L19 I20 G26 C27	L19-L23 HydrophobicContact CD2-CD1 3.73Å; L19-L23 WeakPolarHBondContact O-CB 3.33Å; L19-L23 WeakPolarHBondContact O-CG 3.41Å; L19-L23 PolarHBondContact O-N 3.23Å; I20-L23 PolarHBondContact O-N 3.04Å; L23-G26 PolarHBondContact O-N 3.48Å; L23-C27 WeakPolarHBondContact O-CB 3.32Å; L23-C27 PolarHBondContact O-N 3.49Å
24	S	82.3	Confident	72.7	Confident	66 Å²	66	97.9 Å²	97.9	46%	0.462	56%	0.557	S	S	.	*	H	α-helix	trans	-65.6	-40.7	177.6	69.8	0	0	0	0	112	I20 L21 S28	I20-S24 WeakPolarHBondContact O-CB 3.38Å; I20-S24 PolarHBondContact O-N 3.48Å; I20-S24 PolarHBondContact O-OG 3.39Å; L21-S24 PolarHBondContact O-N 2.97Å; L21-S24 PolarHBondContact O-OG 2.95Å; S24-S28 WeakPolarHBondContact O-CB 3.35Å; S24-S28 PolarHBondContact O-N 2.97Å; S24-S28 PolarHBondContact O-OG 2.85Å; S24-S28 VanDerWaalsContact O-OG 3.13Å
25	L	85.8	Confident	71.7	Confident	106 Å²	106	92 Å²	92	56%	0.555	55%	0.548	S	S	*	.	H	α-helix	trans	-66.5	-43.5	176.3	-156	91.7	0	0	0	110.5	L21 S28 L29	L21-L25 WeakPolarHBondContact O-CB 3.45Å; L21-L25 PolarHBondContact O-N 3.18Å; L25-S28 WeakPolarHBondContact CA-OG 3.44Å; L25-S28 PolarHBondContact O-N 2.88Å; L25-S28 PolarHBondContact O-OG 3.36Å; L25-L29 HydrophobicContact CD2-CD1 4.02Å; L25-L29 HydrophobicContact CG-CD1 4.11Å; L25-L29 WeakPolarHBondContact O-CB 3.03Å; L25-L29 PolarHBondContact O-N 3.26Å
26	G	82.1	Confident	70.7	Confident	39 Å²	39	99.5 Å²	99.5	40%	0.402	56%	0.564	S	S	.	*	H	α-helix	trans	-61.9	-44.5	176.4	0	0	0	0	0	113.2	G22 L23 S30	G22-G26 PolarHBondContact O-N 3.45Å; L23-G26 PolarHBondContact O-N 3.48Å; G26-S30 VanDerWaalsContact O-CB 3.23Å; G26-S30 WeakPolarHBondContact O-CB 3.36Å; G26-S30 PolarHBondContact O-N 3.18Å
27	C	76.9	Confident	69.6	Low	80 Å²	80	103.3 Å²	103.3	54%	0.541	58%	0.583	S	S	.	*	H	α-helix	trans	-64.5	-40	173.7	-78.2	0	0	0	0	112	L23 S30 L31	L23-C27 WeakPolarHBondContact O-CB 3.32Å; L23-C27 PolarHBondContact O-N 3.49Å; C27-S30 PolarHBondContact O-N 2.95Å; C27-L31 WeakPolarHBondContact O-CB 3.49Å; C27-L31 WeakPolarHBondContact O-CG 3.37Å; C27-L31 PolarHBondContact O-N 3.39Å
28	S	77	Confident	67.7	Low	55 Å²	55	107.4 Å²	107.4	39%	0.385	60%	0.6	S	S	.	*	H	α-helix	trans	-69.3	-38.4	178.1	65.4	0	0	0	0	113.3	S24 L25 L31 L32	S24-S28 WeakPolarHBondContact O-CB 3.35Å; S24-S28 PolarHBondContact O-N 2.97Å; S24-S28 PolarHBondContact O-OG 2.85Å; S24-S28 VanDerWaalsContact O-OG 3.13Å; L25-S28 WeakPolarHBondContact CA-OG 3.44Å; L25-S28 PolarHBondContact O-N 2.88Å; L25-S28 PolarHBondContact O-OG 3.36Å; S28-L31 PolarHBondContact O-N 3.48Å; S28-L32 WeakPolarHBondContact O-CG 3.38Å; S28-L32 PolarHBondContact O-N 2.88Å; S28-L32 VanDerWaalsContact O-N 3.08Å
29	L	75.6	Confident	65.5	Low	95 Å²	95	106.7 Å²	106.7	50%	0.497	61%	0.608	S	S	.	*	H	α-helix	trans	-70.1	-35	173.5	-87.1	156.7	0	0	0	112	L25 L32 M33	L25-L29 HydrophobicContact CD2-CD1 4.02Å; L25-L29 HydrophobicContact CG-CD1 4.11Å; L25-L29 WeakPolarHBondContact O-CB 3.03Å; L25-L29 PolarHBondContact O-N 3.26Å; L29-L32 PolarHBondContact O-N 3.48Å; L29-M33 WeakPolarHBondContact O-CB 3.47Å; L29-M33 WeakPolarHBondContact O-CG 3.41Å; L29-M33 PolarHBondContact O-N 2.9Å
30	S	70.3	Confident	63.2	Low	72 Å²	72	109.2 Å²	109.2	50%	0.503	62%	0.622	S	S	.	*	H	α-helix	trans	-64.2	-43.6	172.6	177.3	0	0	0	0	111.3	G26 C27 L32 M33 V34	G26-S30 VanDerWaalsContact O-CB 3.23Å; G26-S30 WeakPolarHBondContact O-CB 3.36Å; G26-S30 PolarHBondContact O-N 3.18Å; C27-S30 PolarHBondContact O-N 2.95Å; S30-L32 VanDerWaalsContact C-N 3.3Å; S30-L32 PolarHBondContact O-N 2.86Å; S30-M33 PolarHBondContact O-N 2.96Å; S30-V34 WeakPolarHBondContact O-CG2 3.43Å; S30-V34 PolarHBondContact O-N 2.9Å
31	L	68.5	Low	61	Low	138 Å²	138	110.5 Å²	110.5	72%	0.723	64%	0.635	S	S	*	*	H	α-helix	trans	-66.2	-29.2	175.6	-74.5	167.7	0	0	0	113.2	C27 S28	C27-L31 WeakPolarHBondContact O-CB 3.49Å; C27-L31 WeakPolarHBondContact O-CG 3.37Å; C27-L31 PolarHBondContact O-N 3.39Å; S28-L31 PolarHBondContact O-N 3.48Å
32	L	66.6	Low	58.8	Low	146 Å²	146	112.7 Å²	112.7	76%	0.764	65%	0.647	S	S	*	*	H	α-helix	trans	-80	-21.2	174	-76.8	166.2	0	0	0	113.6	S28 L29 S30	S28-L32 WeakPolarHBondContact O-CG 3.38Å; S28-L32 PolarHBondContact O-N 2.88Å; S28-L32 VanDerWaalsContact O-N 3.08Å; L29-L32 PolarHBondContact O-N 3.48Å; S30-L32 VanDerWaalsContact C-N 3.3Å; S30-L32 PolarHBondContact O-N 2.86Å
33	M	55.9	Low	56.3	Low	159 Å²	159	118.2 Å²	118.2	78%	0.783	67%	0.666	S	S	*	*	H	α-helix	trans	-97.9	-4.6	178.6	-73.3	-114.1	-92.2	0	0	113.7	L29 S30 S35	L29-M33 WeakPolarHBondContact O-CB 3.47Å; L29-M33 WeakPolarHBondContact O-CG 3.41Å; L29-M33 PolarHBondContact O-N 2.9Å; S30-M33 PolarHBondContact O-N 2.96Å; M33-S35 VanDerWaalsContact C-N 3.26Å; M33-S35 PolarHBondContact O-N 3.18Å
34	V	47.5	Very low	54	Low	102 Å²	102	118.7 Å²	118.7	62%	0.618	68%	0.675	S	S	*	*			trans	-72.3	90.3	164.4	173.9	0	0	0	0	107.6	S30 W36	S30-V34 WeakPolarHBondContact O-CG2 3.43Å; S30-V34 PolarHBondContact O-N 2.9Å; V34-W36 PolarHBondContact O-N 3.28Å
35	S	39.1	Very low	51.4	Low	86 Å²	86	122.4 Å²	122.4	60%	0.601	70%	0.7	S	S	*	*			trans	-53.2	124.4	162.1	49.7	0	0	0	0	108.8	M33 T37	M33-S35 VanDerWaalsContact C-N 3.26Å; M33-S35 PolarHBondContact O-N 3.18Å; S35-T37 PolarHBondContact O-N 3.18Å
36	W	40.4	Very low	48.7	Very low	259 Å²	259	120.7 Å²	120.7	98%	0.981	71%	0.708	S	S	*	*	S	Bend	trans	-69.1	74.3	176.4	-142.8	8.8	0	0	0	109.5	V34	V34-W36 PolarHBondContact O-N 3.28Å
37	T	41.9	Very low	46.7	Very low	113 Å²	113	126.7 Å²	126.7	69%	0.693	73%	0.731	S	S	*	*			trans	-145.8	77	174.1	55.1	0	0	0	0	110.2	S35	S35-T37 PolarHBondContact O-N 3.18Å
38	Q	30.8	Very low	44.5	Very low	187 Å²	187	132 Å²	132	87%	0.874	75%	0.747	S	S	*	*			trans	-161.3	114.1	155.8	-128.4	165.9	-11.7	0	0	103.4
39	G	30.8	Very low	42.3	Very low	70 Å²	70	138.1 Å²	138.1	72%	0.722	78%	0.775	S	S	*	*			cis	94.2	62.3	42.3	0	0	0	0	0	107.7
40	D	29.9	Very low	40.4	Very low	167 Å²	167	137.9 Å²	137.9	89%	0.893	79%	0.786	S	S	*	*			trans	-102.5	121.4	171	-83.9	-21.9	0	0	0	109.3
41	T	33.1	Very low	38.6	Very low	124 Å²	124	144.8 Å²	144.8	76%	0.761	81%	0.808	S	S	*	*			trans	-73.2	142.4	164.6	40.5	0	0	0	0	110.5
42	D	35.5	Very low	36.7	Very low	151 Å²	151	142.3 Å²	142.3	81%	0.807	82%	0.815	S	S	*	*			trans	73	94.2	162.5	-57.9	-23.7	0	0	0	118.4
43	D	28.5	Very low	34.9	Very low	161 Å²	161	138.9 Å²	138.9	86%	0.861	82%	0.815	S	S	*	*			trans	-151.1	149.6	138.4	-113.2	-17.9	0	0	0	111.2
44	P	35.1	Very low	33.5	Very low	116 Å²	116	138.8 Å²	138.8	75%	0.753	82%	0.817	S	S	*	*			trans	-80.8	134.8	-162.9	31.7	-32.6	0	0	0	112.6	G46	P44-G46 PolarHBondContact O-N 3.21Å
45	C	27.4	Very low	32.6	Very low	144 Å²	144	143.6 Å²	143.6	97%	0.973	83%	0.83	S	S	*	*			trans	-65.3	101.8	173.3	-73.8	0	0	0	0	111.4
46	G	30.5	Very low	32.1	Very low	70 Å²	70	147.9 Å²	147.9	72%	0.722	85%	0.845	S	S	*	*			trans	-95.2	136	160	0	0	0	0	0	111	P44 E48	P44-G46 PolarHBondContact O-N 3.21Å; G46-E48 PolarHBondContact O-N 3.02Å
47	D	40	Very low	31.6	Very low	166 Å²	166	139.3 Å²	139.3	89%	0.888	84%	0.837	S	S	*	*			trans	-44.3	113.2	172	-82.7	-45.7	0	0	0	113.5
48	E	30.5	Very low	31	Very low	190 Å²	190	144 Å²	144	89%	0.888	84%	0.843	S	S	*	*			trans	-157.5	81.3	146.9	-81.2	-144.6	149.8	0	0	110.8	G46	G46-E48 PolarHBondContact O-N 3.02Å
49	L	31.4	Very low	30.9	Very low	184 Å²	184	146.9 Å²	146.9	96%	0.963	85%	0.845	S	S	*	*			trans	-142.8	56	160.2	-117	137.6	0	0	0	110.5
50	A	34.8	Very low	30.9	Very low	90 Å²	90	150.1 Å²	150.1	74%	0.744	85%	0.846	S	S	*	*			trans	-130.7	80	165.4	0	0	0	0	0	108.8
51	K	31.5	Very low	31.1	Very low	218 Å²	218	146.9 Å²	146.9	95%	0.948	84%	0.842	S	S	*	*			trans	-179.4	120.2	151.9	-99.2	152	-169	179.2	0	112.5
52	G	28.5	Very low	31.1	Very low	86 Å²	86	149.7 Å²	149.7	89%	0.887	85%	0.847	S	S	*	*			trans	96	101.3	161	0	0	0	0	0	114
53	G	29.1	Very low	30.9	Very low	74 Å²	74	154.2 Å²	154.2	76%	0.763	85%	0.853	S	S	*	*			cis	119.8	105.2	16.8	0	0	0	0	0	108.7
54	L	28	Very low	31	Very low	157 Å²	157	150.7 Å²	150.7	82%	0.822	85%	0.854	S	S	*	*			trans	-162.6	103.3	163	-103.1	156.6	0	0	0	108.6
55	F	27.3	Very low	30.8	Very low	203 Å²	203	148.7 Å²	148.7	89%	0.89	86%	0.855	S	S	*	*			trans	166.9	94.9	132.9	-88.1	-66.8	0	0	0	108.8
56	L	29.7	Very low	31.6	Very low	176 Å²	176	153.5 Å²	153.5	92%	0.921	85%	0.852	S	S	*	*			trans	-87.6	112.2	166.5	-105	152.2	0	0	0	108.1
57	G	28.3	Very low	32.1	Very low	79 Å²	79	158.2 Å²	158.2	81%	0.814	86%	0.861	S	S	*	*			trans	-143.9	80.9	169.7	0	0	0	0	0	109.1
58	R	30	Very low	31.9	Very low	212 Å²	212	153.8 Å²	153.8	80%	0.8	86%	0.855	S	S	*	*			trans	-71.1	125.4	-177.8	-167.9	-179.3	-174.6	176.6	3.6	110.6
59	R	29.1	Very low	32.5	Very low	246 Å²	246	150.3 Å²	150.3	93%	0.928	86%	0.859	S	S	*	*			trans	-140.4	126	150	-100.5	-175.1	178.1	176.9	-0.3	110.1
60	D	30	Very low	33.3	Very low	139 Å²	139	144.2 Å²	144.2	74%	0.743	84%	0.84	S	S	*	*			trans	-59.4	140.1	-174.5	-67.6	-56.6	0	0	0	113.7
61	A	34.4	Very low	33.6	Very low	98 Å²	98	148.2 Å²	148.2	81%	0.81	84%	0.843	S	S	*	*			trans	-83.7	117.3	162.4	0	0	0	0	0	109.6
62	Q	33.9	Very low	34	Very low	184 Å²	184	145 Å²	145	86%	0.86	83%	0.832	S	S	*	*			trans	-168.5	102.9	146.4	-116.4	179	4.1	0	0	111.1
63	R	30.6	Very low	34.8	Very low	246 Å²	246	148.3 Å²	148.3	93%	0.928	83%	0.829	S	S	*	*				170.9	140.2	120.8	-93.6	171.8	178.2	-173.9	-0.4	110.6
64	G	31.8	Very low	35.8	Very low	86 Å²	86	153 Å²	153	89%	0.887	83%	0.829	S	S	*	*			trans	-69	164.3	-167.7	0	0	0	0	0	116.3
65	G	29.5	Very low	36.3	Very low	75 Å²	75	152.6 Å²	152.6	77%	0.773	82%	0.822	S	S	*	*			trans	171.5	114.7	168.9	0	0	0	0	0	108.9	D67	G65-D67 PolarHBondContact O-N 3.36Å
66	R	45	Very low	36.7	Very low	244 Å²	244	149.1 Å²	149.1	92%	0.921	82%	0.821	S	S	*	*			trans	-53	129.5	170.9	-75.1	168.6	166.7	167.4	-6.6	109.7
67	D	41.3	Very low	37.5	Very low	169 Å²	169	150.4 Å²	150.4	90%	0.904	81%	0.813	S	S	*	*			trans	155.9	124.3	143.3	-79.7	-19.1	0	0	0	109.4	G65	G65-D67 PolarHBondContact O-N 3.36Å
68	G	34.8	Very low	38.3	Very low	73 Å²	73	154.3 Å²	154.3	75%	0.753	81%	0.813	S	S	*	*			trans	143.8	53.7	174.8	0	0	0	0	0	115.8	G70	G68-G70 PolarHBondContact O-N 3.29Å; G68-G70 VanDerWaalsContact O-N 3.17Å
69	A	42.6	Very low	39.4	Very low	118 Å²	118	150.3 Å²	150.3	98%	0.975	81%	0.812	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	91.5	161	0	0	0	0	0	107.9
70	G	48.6	Very low	39.8	Very low	55 Å²	55	143.9 Å²	143.9	57%	0.567	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-166	-16.1	-176.9	0	0	0	0	0	118.2	G68	G68-G70 PolarHBondContact O-N 3.29Å; G68-G70 VanDerWaalsContact O-N 3.17Å
71	E	41.4	Very low	40.5	Very low	175 Å²	175	146.6 Å²	146.6	82%	0.818	80%	0.804	S	S	*	*	S	Bend	trans	-127.9	-6	-176.9	-76.6	-167.8	152.3	0	0	115.6
72	E	40	Very low	41.3	Very low	151 Å²	151	150.4 Å²	150.4	71%	0.706	80%	0.804	S	S	*	*	G	3₁₀ helix	trans	-82.5	-13.8	-177.7	-65.3	-169.2	173.4	0	0	114.4	F74	E72-F74 VanDerWaalsContact C-N 3.27Å; E72-F74 PolarHBondContact O-N 3.02Å
73	D	45.9	Very low	41.9	Very low	154 Å²	154	148.4 Å²	148.4	82%	0.824	79%	0.793	S	S	*	*	G	3₁₀ helix	trans	-78.1	-5.4	-176.6	-77.6	-18.8	0	0	0	114.3
74	F	50.3	Low	43.4	Very low	174 Å²	174	141.6 Å²	141.6	76%	0.763	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-100.7	6.8	-178.8	-61.4	-76	0	0	0	114.3	E72	E72-F74 VanDerWaalsContact C-N 3.27Å; E72-F74 PolarHBondContact O-N 3.02Å
75	Q	38.3	Very low	44.9	Very low	147 Å²	147	143.1 Å²	143.1	69%	0.687	77%	0.769	S	S	*	*	S	Bend	trans	-83.9	122.9	173.8	-69.9	-171.9	-0.8	0	0	110.8	R77	Q75-R77 PolarHBondContact O-N 2.79Å
76	P	35.9	Very low	46.5	Very low	131 Å²	131	146.4 Å²	146.4	85%	0.851	77%	0.769	S	S	*	*			trans	-61.5	112.9	174.6	23.9	-31.3	0	0	0	109.6
77	R	45.4	Very low	47	Very low	203 Å²	203	143 Å²	143	77%	0.766	76%	0.761	S	S	*	*			trans	-90.3	120	173.4	-68.5	-173.9	179.8	-177	2.3	109.1	Q75 V79	Q75-R77 PolarHBondContact O-N 2.79Å; R77-V79 PolarHBondContact O-N 3.13Å; R77-V79 VanDerWaalsContact O-N 3.14Å
78	I	46.4	Very low	47.5	Very low	160 Å²	160	140.4 Å²	140.4	82%	0.821	75%	0.753	S	S	*	*			trans	-68.7	111	169	-59.1	172.2	0	0	0	106.7	P80	I78-P80 WeakPolarHBondContact O-CD 3.4Å
79	V	51.3	Low	48.2	Very low	128 Å²	128	145.1 Å²	145.1	78%	0.776	76%	0.755	S	S	*	*			trans	-80.9	109.7	170.4	-175.3	0	0	0	0	107	R77 Y81	R77-V79 PolarHBondContact O-N 3.13Å; R77-V79 VanDerWaalsContact O-N 3.14Å; V79-Y81 PolarHBondContact O-N 2.87Å; V79-Y81 VanDerWaalsContact O-N 3.14Å
80	P	38.8	Very low	48.2	Very low	111 Å²	111	148.6 Å²	148.6	72%	0.721	75%	0.748	S	S	*	*			trans	-65.2	117.6	179.9	25.2	-32.2	0	0	0	109.7	I78 H82	I78-P80 WeakPolarHBondContact O-CD 3.4Å; P80-H82 PolarHBondContact O-N 2.95Å
81	Y	44.8	Very low	47.7	Very low	197 Å²	197	155.5 Å²	155.5	77%	0.773	76%	0.763	S	S	*	*			trans	-76.3	101.7	175.6	-178.4	-100.6	0	0	0	109.6	V79 K83	V79-Y81 PolarHBondContact O-N 2.87Å; V79-Y81 VanDerWaalsContact O-N 3.14Å; Y81-K83 HydrophobicContact CD1-CB 4.27Å; Y81-K83 HydrophobicContact CE1-CB 3.8Å; Y81-K83 HydrophobicContact CE1-CD 4.26Å; Y81-K83 HydrophobicContact CE1-CG 3.91Å; Y81-K83 PolarHBondContact O-N 3.39Å
82	H	49.9	Very low	47.7	Very low	177 Å²	177	153.1 Å²	153.1	82%	0.819	76%	0.76	S	S	*	*			trans	-85.5	107.8	173	-149.5	-60	0	0	0	109.4	P80 D84	P80-H82 PolarHBondContact O-N 2.95Å; H82-D84 PolarHBondContact O-N 2.85Å
83	K	46.7	Very low	47.8	Very low	143 Å²	143	153 Å²	153	62%	0.622	76%	0.764	S	S	*	*			trans	-82.7	115.8	177	-159.2	175.9	-177.3	-177.7	0	108.8	Y81 P85	Y81-K83 HydrophobicContact CD1-CB 4.27Å; Y81-K83 HydrophobicContact CE1-CB 3.8Å; Y81-K83 HydrophobicContact CE1-CD 4.26Å; Y81-K83 HydrophobicContact CE1-CG 3.91Å; Y81-K83 PolarHBondContact O-N 3.39Å; K83-P85 WeakPolarHBondContact O-CD 3.37Å
84	D	62.1	Low	47.6	Very low	103 Å²	103	155.4 Å²	155.4	55%	0.551	76%	0.761	S	S	*	*			trans	-76.5	114.4	175.8	-164.6	-10.2	0	0	0	109.4	H82 N86 K87	H82-D84 PolarHBondContact O-N 2.85Å; D84-N86 PolarHBondContact O-N 3.02Å; D84-N86 VanDerWaalsContact O-N 3.17Å; D84-K87 PolarHBondContact O-N 3.37Å
85	P	63	Low	47.2	Very low	117 Å²	117	149.5 Å²	149.5	76%	0.76	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-13.7	-171.8	25.3	-33.4	0	0	0	114.1	K83	K83-P85 WeakPolarHBondContact O-CD 3.37Å
86	N	64.8	Low	47.8	Very low	144 Å²	144	153.3 Å²	153.3	77%	0.77	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	2.1	-177.2	-71.5	-19.7	0	0	0	114.3	D84 P88	D84-N86 PolarHBondContact O-N 3.02Å; D84-N86 VanDerWaalsContact O-N 3.17Å; N86-P88 WeakPolarHBondContact O-CD 3.45Å
87	K	54.9	Low	48.4	Very low	172 Å²	172	154 Å²	154	75%	0.748	73%	0.734	S	S	*	*	S	Bend	trans	-86.4	117.5	-179.8	-144.6	173	-169.5	173.4	0	109.9	D84 H89	D84-K87 PolarHBondContact O-N 3.37Å; K87-H89 PolarHBondContact O-N 3.37Å
88	P	50.4	Low	48.6	Very low	115 Å²	115	150.2 Å²	150.2	75%	0.747	73%	0.727	S	S	*	*			trans	-61.4	140.4	179.9	24.3	-32.4	0	0	0	110.3	N86 K90	N86-P88 WeakPolarHBondContact O-CD 3.45Å; P88-K90 PolarHBondContact O-N 3.04Å
89	H	49.6	Very low	48.6	Very low	173 Å²	173	147 Å²	147	80%	0.801	71%	0.709	S	S	*	*			trans	-54.3	105.1	175	-92.2	-69.9	0	0	0	109.6	K87 K91	K87-H89 PolarHBondContact O-N 3.37Å; H89-K91 PolarHBondContact O-N 3.4Å
90	K	44	Very low	48.5	Very low	190 Å²	190	144.5 Å²	144.5	83%	0.826	69%	0.694	S	S	*	*			trans	-59	123.1	155.5	-90	-174.6	174	-176.5	0	105.3	P88 V92	P88-K90 PolarHBondContact O-N 3.04Å; K90-V92 PolarHBondContact O-N 3.08Å
91	K	37.4	Very low	49.3	Very low	200 Å²	200	144.1 Å²	144.1	87%	0.87	68%	0.683	S	S	*	*			trans	-43.7	119.6	164.9	-86.1	-177.8	173.8	-179.6	0	106.2	H89 L93	H89-K91 PolarHBondContact O-N 3.4Å; K91-L93 PolarHBondContact O-N 3.05Å
92	V	42.4	Very low	50	Low	125 Å²	125	140.5 Å²	140.5	76%	0.758	68%	0.676	S	S	*	*			trans	-64	96.8	171.8	179.3	0	0	0	0	104.4	K90 R94	K90-V92 PolarHBondContact O-N 3.08Å; V92-R94 PolarHBondContact O-N 2.95Å
93	L	42.3	Very low	50.4	Low	150 Å²	150	134.6 Å²	134.6	79%	0.785	66%	0.663	S	S	*	*			trans	-71.3	90.9	168.6	-152.1	112.4	0	0	0	103.5	K91 T95	K91-L93 PolarHBondContact O-N 3.05Å; L93-T95 PolarHBondContact O-N 3.27Å
94	R	41.2	Very low	51.1	Low	204 Å²	204	132.8 Å²	132.8	77%	0.77	66%	0.659	S	S	*	*			trans	-59.1	105.3	175.9	-158.8	-178.9	-168.5	177.9	2	105.6	V92 R96 E101	V92-R94 PolarHBondContact O-N 2.95Å; R94-R96 PolarHBondContact O-N 3.42Å; R94-E101 VanDerWaalsContact CG-OE1 3.27Å; R94-E101 WeakPolarHBondContact CG-OE1 3.5Å
95	T	42	Very low	51.4	Low	49 Å²	49	133 Å²	133	30%	0.301	65%	0.652	S	S	.	*			trans	-61.2	140.5	177.1	47.5	0	0	0	0	106.7	L93 Y97 T100 E101	L93-T95 PolarHBondContact O-N 3.27Å; T95-Y97 PolarHBondContact O-N 2.99Å; T95-Y97 PolarHBondContact OG1-O 3.35Å; T95-T100 HydrophobicContact CG2-CG2 4.37Å; T95-E101 WeakPolarHBondContact OG1-CG 3.36Å
96	R	50.8	Low	52.1	Low	228 Å²	228	131 Å²	131	86%	0.86	63%	0.633	S	S	*	*	S	Bend	trans	-57.3	-10.9	-174.4	-133.8	179	-167.5	178.5	2.1	113.5	R94	R94-R96 PolarHBondContact O-N 3.42Å
97	Y	48.1	Very low	53	Low	144 Å²	144	131.3 Å²	131.3	57%	0.565	62%	0.623	S	S	*	*	S	Bend	trans	-135.3	142	-174.3	-53.6	-75.4	0	0	0	112.9	T95 H99 T100	T95-Y97 PolarHBondContact O-N 2.99Å; T95-Y97 PolarHBondContact OG1-O 3.35Å; Y97-H99 VanDerWaalsContact C-N 3.31Å; Y97-H99 WeakPolarHBondContact CB-CE1 3.25Å; Y97-H99 WeakPolarHBondContact CB-ND1 3.23Å; Y97-H99 AromaticContact CD2-CE1 3.69Å; Y97-H99 AromaticContact CG-CE1 3.47Å; Y97-H99 VanDerWaalsContact CG-CE1 3.47Å; Y97-H99 AromaticContact CG-ND1 3.88Å; Y97-H99 PolarHBondContact O-N 3.41Å; Y97-T100 PolarHBondContact O-OG1 3.08Å
98	I	50.1	Low	54.7	Low	124 Å²	124	123.3 Å²	123.3	64%	0.636	59%	0.589	S	S	*	*	H	α-helix	trans	-65.2	-30.6	-179	-67.8	165.4	0	0	0	112.4	T100 E101 L102	I98-T100 PolarHBondContact O-N 3.45Å; I98-E101 PolarHBondContact O-N 2.87Å; I98-L102 HydrophobicContact CG2-CD1 3.54Å; I98-L102 HydrophobicContact CG2-CG 4.01Å; I98-L102 PolarHBondContact O-N 3.07Å
99	H	46.6	Very low	56.8	Low	92 Å²	92	117.9 Å²	117.9	43%	0.426	55%	0.553	S	S	.	*	H	α-helix	trans	-60	-35.5	-177.9	66.4	-100.1	0	0	0	112.7	Y97 G103 I104	Y97-H99 VanDerWaalsContact C-N 3.31Å; Y97-H99 WeakPolarHBondContact CB-CE1 3.25Å; Y97-H99 WeakPolarHBondContact CB-ND1 3.23Å; Y97-H99 AromaticContact CD2-CE1 3.69Å; Y97-H99 AromaticContact CG-CE1 3.47Å; Y97-H99 VanDerWaalsContact CG-CE1 3.47Å; Y97-H99 AromaticContact CG-ND1 3.88Å; Y97-H99 PolarHBondContact O-N 3.41Å; H99-G103 PolarHBondContact O-N 3.05Å; H99-I104 HydrophobicContact CB-CB 4.28Å; H99-I104 PolarHBondContact O-N 3.14Å
100	T	49.2	Very low	59	Low	76 Å²	76	109.7 Å²	109.7	47%	0.466	52%	0.515	S	S	.	.	H	α-helix	trans	-76.5	-31.9	-178.3	-13.4	0	0	0	0	111.6	T95 Y97 I98	T95-T100 HydrophobicContact CG2-CG2 4.37Å; Y97-T100 PolarHBondContact O-OG1 3.08Å; I98-T100 PolarHBondContact O-N 3.45Å
101	E	54.7	Low	61.5	Low	104 Å²	104	100.7 Å²	100.7	49%	0.486	48%	0.476	S	S	.	.	H	α-helix	trans	-73.7	-36.5	175.9	-63.1	-167	162.9	0	0	112.3	R94 T95 I98 G103	R94-E101 VanDerWaalsContact CG-OE1 3.27Å; R94-E101 WeakPolarHBondContact CG-OE1 3.5Å; T95-E101 WeakPolarHBondContact OG1-CG 3.36Å; I98-E101 PolarHBondContact O-N 2.87Å; E101-G103 VanDerWaalsContact C-N 3.26Å; E101-G103 PolarHBondContact O-N 3.42Å
102	L	60.3	Low	64.4	Low	121 Å²	121	91.2 Å²	91.2	63%	0.634	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-4.7	177	-66.5	178.7	0	0	0	113.2	I98 I104	I98-L102 HydrophobicContact CG2-CD1 3.54Å; I98-L102 HydrophobicContact CG2-CG 4.01Å; I98-L102 PolarHBondContact O-N 3.07Å; L102-I104 HydrophobicContact CB-CD1 3.88Å; L102-I104 HydrophobicContact CB-CG1 3.72Å; L102-I104 HydrophobicContact CD1-CD1 3.78Å; L102-I104 HydrophobicContact CD1-CG1 4.5Å; L102-I104 HydrophobicContact CG-CD1 4.49Å; L102-I104 PolarHBondContact O-N 3.37Å
103	G	57.8	Low	66.9	Low	53 Å²	53	86.1 Å²	86.1	55%	0.546	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	29.4	-174.6	0	0	0	0	0	112.8	H99 E101 R105	H99-G103 PolarHBondContact O-N 3.05Å; E101-G103 VanDerWaalsContact C-N 3.26Å; E101-G103 PolarHBondContact O-N 3.42Å; G103-R105 PolarHBondContact O-N 2.85Å
104	I	62.3	Low	69.4	Low	105 Å²	105	79.2 Å²	79.2	54%	0.538	37%	0.368	S	S	.	.			trans	-67.5	109.6	178.7	-65.3	171.7	0	0	0	107.2	H99 L102	H99-I104 HydrophobicContact CB-CB 4.28Å; H99-I104 PolarHBondContact O-N 3.14Å; L102-I104 HydrophobicContact CB-CD1 3.88Å; L102-I104 HydrophobicContact CB-CG1 3.72Å; L102-I104 HydrophobicContact CD1-CD1 3.78Å; L102-I104 HydrophobicContact CD1-CG1 4.5Å; L102-I104 HydrophobicContact CG-CD1 4.49Å; L102-I104 PolarHBondContact O-N 3.37Å
105	R	68.6	Low	71.8	Confident	106 Å²	106	71.4 Å²	71.4	40%	0.4	35%	0.345	S	S	.	.			trans	-83.3	149.7	174.5	-70.1	-178.5	-175.7	138.7	9.8	110.4	G103 S179 E180 D182	G103-R105 PolarHBondContact O-N 2.85Å; R105-S179 PolarHBondContact NE-O 2.84Å; R105-E180 VanDerWaalsContact CB-O 3.28Å; R105-E180 WeakPolarHBondContact CB-O 3.46Å; R105-D182 VanDerWaalsContact CD-OD1 3.3Å; R105-D182 WeakPolarHBondContact CD-OD1 3.35Å; R105-D182 IonicContact NH1-OD1 3.58Å
106	E	76.3	Confident	74.1	Confident	75 Å²	75	77.2 Å²	77.2	35%	0.35	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	141.8	167.1	-67.8	-171.9	176.9	0	0	108.9	H135 E180 Y181 D182	E106-H135 IonicContact OE1-ND1 3.52Å; E106-H135 WeakPolarHBondContact OE2-CB 3.23Å; E106-H135 IonicContact OE2-CG 3.93Å; E106-E180 PolarHBondContact N-O 3.13Å; E106-Y181 HydrophobicContact CB-CD1 3.67Å; E106-Y181 HydrophobicContact CB-CE1 3.49Å; E106-Y181 VanDerWaalsContact CB-CE1 3.49Å; E106-Y181 HydrophobicContact CG-CE1 4.38Å; E106-Y181 VanDerWaalsContact O-CA 3.29Å; E106-Y181 WeakPolarHBondContact O-CA 3.37Å; E106-Y181 WeakPolarHBondContact OE2-CE1 3.44Å; E106-Y181 PolarHBondContact OE2-OH 2.95Å; E106-Y181 VanDerWaalsContact OE2-OH 3.07Å; E106-D182 PolarHBondContact O-N 3.35Å
107	R	83.7	Confident	75.9	Confident	151 Å²	151	70.1 Å²	70.1	57%	0.57	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	-39.3	-168.2	-67.3	-172.5	179	-165.3	-3.2	112.9	W183 V202 G203	R107-W183 VanDerWaalsContact O-CB 3.3Å; R107-W183 WeakPolarHBondContact O-CB 3.49Å; R107-W183 PolarHBondContact O-N 2.97Å; R107-V202 HydrophobicContact CB-CG1 4.23Å; R107-G203 VanDerWaalsContact NH1-CA 3.27Å; R107-G203 PolarHBondContact NH1-O 3.46Å
108	L	92	Very high	78.1	Confident	5 Å²	5	64.6 Å²	64.6	3%	0.026	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	129.3	-168.4	176.6	63.6	0	0	0	112.7	F134 W183 L185 L198 V202 L236	L108-F134 HydrophobicContact CD2-CD1 4.05Å; L108-F134 HydrophobicContact CD2-CE1 3.6Å; L108-F134 HydrophobicContact CD2-CZ 4.47Å; L108-W183 WeakPolarHBondContact CA-O 3.49Å; L108-W183 HydrophobicContact CD1-CB 3.97Å; L108-L185 HydrophobicContact CD1-CB 3.8Å; L108-L198 HydrophobicContact CD2-CB 4.48Å; L108-V202 HydrophobicContact CB-CG1 4.31Å; L108-V202 HydrophobicContact CD1-CG2 4.2Å; L108-V202 HydrophobicContact CD2-CG2 4.26Å; L108-L236 HydrophobicContact CD1-CD2 3.92Å
109	L	94.5	Very high	80.2	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133.6	168.5	-177.8	157.2	0	0	0	109.9	F138 L173 Y177 Y181 W183 F184 L185	L109-F138 HydrophobicContact CD1-CD2 3.97Å; L109-F138 HydrophobicContact CD1-CE2 3.74Å; L109-F138 HydrophobicContact CD2-CD2 3.99Å; L109-F138 HydrophobicContact CG-CD2 4.03Å; L109-F138 HydrophobicContact CG-CE2 4.17Å; L109-L173 HydrophobicContact CD1-CD2 4.25Å; L109-L173 HydrophobicContact CD2-CD2 3.49Å; L109-L173 VanDerWaalsContact CD2-CD2 3.49Å; L109-Y177 HydrophobicContact CD1-CD1 4.17Å; L109-Y177 HydrophobicContact CD1-CD2 4Å; L109-Y177 HydrophobicContact CD1-CG 3.69Å; L109-Y181 HydrophobicContact CB-CD1 3.65Å; L109-Y181 HydrophobicContact CB-CD2 4.2Å; L109-Y181 HydrophobicContact CB-CE1 3.98Å; L109-Y181 HydrophobicContact CB-CG 3.76Å; L109-Y181 HydrophobicContact CD1-CD2 3.77Å; L109-Y181 HydrophobicContact CD1-CE2 3.78Å; L109-Y181 HydrophobicContact CD1-CG 4.2Å; L109-W183 PolarHBondContact N-O 2.99Å; L109-F184 HydrophobicContact CB-CD1 4.24Å; L109-F184 HydrophobicContact CD1-CE1 4.35Å; L109-F184 HydrophobicContact CD2-CD1 4.24Å; L109-L185 PolarHBondContact O-N 2.85Å
110	A	95.9	Very high	82.4	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.008	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	122.2	175.4	0	0	0	0	0	111.9	F134 R136 T137 F138 L185	A110-F134 HydrophobicContact CB-CD2 3.58Å; A110-F134 HydrophobicContact CB-CE2 3.78Å; A110-F134 HydrophobicContact CB-CG 4.08Å; A110-F134 HydrophobicContact CB-CZ 4.44Å; A110-R136 PolarHBondContact N-O 3.18Å; A110-T137 HydrophobicContact CB-CG2 4.31Å; A110-T137 CarbonylContact O-C 3.56Å; A110-T137 WeakPolarHBondContact O-CA 3.46Å; A110-F138 PolarHBondContact O-N 2.79Å; A110-L185 HydrophobicContact CB-CD2 4.4Å
111	G	96.3	Very high	84.6	Confident	1 Å²	1	58 Å²	58	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	119.1	174.4	0	0	0	0	0	111.3	F138 L185 L186 A187	G111-F138 WeakPolarHBondContact CA-O 3.37Å; G111-L185 PolarHBondContact N-O 3.35Å; G111-L186 WeakPolarHBondContact O-CA 2.92Å; G111-A187 PolarHBondContact O-N 3.33Å
112	V	96.7	Very high	86.5	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	119.6	-178.3	-176	0	0	0	0	109.5	V126 T137 F138 F139 F140 A187 D189 M193	V112-V126 HydrophobicContact CG1-CG1 4.41Å; V112-V126 HydrophobicContact CG2-CG1 4.06Å; V112-T137 HydrophobicContact CG2-CG2 4.31Å; V112-F138 PolarHBondContact N-O 3.32Å; V112-F139 HydrophobicContact CB-CD1 3.73Å; V112-F139 HydrophobicContact CB-CE1 3.78Å; V112-F139 HydrophobicContact CG1-CD1 3.94Å; V112-F139 HydrophobicContact CG1-CE1 3.87Å; V112-F139 HydrophobicContact CG2-CD1 4.45Å; V112-F139 HydrophobicContact CG2-CE1 4.07Å; V112-F139 HydrophobicContact CG2-CZ 4.49Å; V112-F139 CarbonylContact O-C 3.6Å; V112-F139 WeakPolarHBondContact O-CA 3.3Å; V112-F140 PolarHBondContact O-N 3.47Å; V112-A187 CarbonylContact C-O 3.57Å; V112-A187 WeakPolarHBondContact CA-O 3.44Å; V112-D189 HydrophobicContact CG1-CB 4.01Å; V112-M193 HydrophobicContact CG2-CE 4Å
113	L	95.6	Very high	88.2	Confident	18 Å²	18	48 Å²	48	9%	0.094	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	128.9	175.3	-58.8	177.5	0	0	0	109.6	F140 L165 M166 T169 A187 D189	L113-F140 HydrophobicContact CD2-CB 3.93Å; L113-L165 HydrophobicContact CD2-CG 4.29Å; L113-M166 HydrophobicContact CD1-CE 3.28Å; L113-M166 HydrophobicContact CD1-SD 3.9Å; L113-T169 HydrophobicContact CD2-CG2 3.9Å; L113-T169 WeakPolarHBondContact CD2-OG1 3.41Å; L113-A187 PolarHBondContact N-O 2.93Å; L113-D189 PolarHBondContact O-N 2.92Å; L113-D189 VanDerWaalsContact O-N 3.14Å
114	T	94.4	Very high	90	Very high	5 Å²	5	46.6 Å²	46.6	3%	0.031	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	155.4	-178	-173.7	0	0	0	0	112.6	T118 L119 A123 F139 F140 D189	T114-T118 PolarHBondContact OG1-OG1 2.84Å; T114-L119 HydrophobicContact CG2-CB 4.38Å; T114-L119 HydrophobicContact CG2-CD1 3.63Å; T114-L119 WeakPolarHBondContact OG1-CA 3.33Å; T114-L119 PolarHBondContact OG1-N 3.08Å; T114-A123 HydrophobicContact CG2-CB 4.36Å; T114-F139 HydrophobicContact CG2-CB 4.35Å; T114-F140 WeakPolarHBondContact CG2-O 3.24Å; T114-F140 PolarHBondContact N-O 3.27Å; T114-D189 VanDerWaalsContact CA-OD2 3.29Å; T114-D189 WeakPolarHBondContact CA-OD2 3.48Å; T114-D189 WeakPolarHBondContact CB-OD2 3.29Å; T114-D189 PolarHBondContact OG1-OD2 2.84Å
115	S	92.1	Very high	91.6	Very high	41 Å²	41	41.6 Å²	41.6	29%	0.287	21%	0.214	S	C	.	.			trans	-106.6	170.1	-178.5	80.7	0	0	0	0	112.2	A117 T118 L119	S115-A117 PolarHBondContact O-N 3.38Å; S115-A117 PolarHBondContact OG-N 3.05Å; S115-T118 PolarHBondContact N-OG1 3.15Å; S115-T118 PolarHBondContact O-N 3.23Å; S115-T118 PolarHBondContact OG-N 3.44Å; S115-T118 PolarHBondContact OG-OG1 2.82Å; S115-L119 VanDerWaalsContact O-CB 3.28Å; S115-L119 WeakPolarHBondContact O-CB 3.32Å; S115-L119 PolarHBondContact O-N 3.2Å
116	R	89.4	Confident	92.9	Very high	170 Å²	170	36.6 Å²	36.6	64%	0.642	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-36.9	171.6	179.5	-177.5	-58.3	178.7	1.5	113.3	L143	R116-L143 HydrophobicContact CB-CD1 4.22Å; R116-L143 HydrophobicContact CB-CD2 3.96Å; R116-L143 HydrophobicContact CB-CG 4.22Å; R116-L143 HydrophobicContact CG-CD1 4.41Å; R116-L143 HydrophobicContact CG-CD2 3.92Å
117	A	90.6	Very high	93.8	Very high	79 Å²	79	34 Å²	34	65%	0.653	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-27.4	-175	0	0	0	0	0	112.7	S115	S115-A117 PolarHBondContact O-N 3.38Å; S115-A117 PolarHBondContact OG-N 3.05Å
118	T	93.8	Very high	94.3	Very high	28 Å²	28	34.4 Å²	34.4	17%	0.172	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-13.1	-168.4	51	0	0	0	0	113.7	T114 S115 S120 T121 L122 A123 D189	T114-T118 PolarHBondContact OG1-OG1 2.84Å; S115-T118 PolarHBondContact N-OG1 3.15Å; S115-T118 PolarHBondContact O-N 3.23Å; S115-T118 PolarHBondContact OG-N 3.44Å; S115-T118 PolarHBondContact OG-OG1 2.82Å; T118-S120 VanDerWaalsContact C-N 3.33Å; T118-S120 PolarHBondContact O-N 2.83Å; T118-T121 WeakPolarHBondContact CA-OG1 3.41Å; T118-T121 CarbonylContact O-C 3.57Å; T118-T121 PolarHBondContact O-N 3.43Å; T118-T121 VanDerWaalsContact O-N 3.09Å; T118-T121 PolarHBondContact O-OG1 2.77Å; T118-L122 HydrophobicContact CG2-CD1 3.86Å; T118-L122 PolarHBondContact O-N 2.65Å; T118-A123 PolarHBondContact O-N 3.19Å; T118-A123 VanDerWaalsContact O-N 3.08Å; T118-D189 WeakPolarHBondContact CB-OD2 3.47Å; T118-D189 PolarHBondContact OG1-OD2 2.81Å
119	L	93.3	Very high	94.4	Very high	9 Å²	9	34.3 Å²	34.3	5%	0.047	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-40.2	178.9	177.9	65.8	0	0	0	113.5	T114 S115 T121 A123 L143 P146 V154	T114-L119 HydrophobicContact CG2-CB 4.38Å; T114-L119 HydrophobicContact CG2-CD1 3.63Å; T114-L119 WeakPolarHBondContact OG1-CA 3.33Å; T114-L119 PolarHBondContact OG1-N 3.08Å; S115-L119 VanDerWaalsContact O-CB 3.28Å; S115-L119 WeakPolarHBondContact O-CB 3.32Å; S115-L119 PolarHBondContact O-N 3.2Å; L119-T121 VanDerWaalsContact C-N 3.35Å; L119-A123 HydrophobicContact CD1-CB 4.36Å; L119-L143 HydrophobicContact CD2-CD1 3.84Å; L119-P146 HydrophobicContact CD2-CB 3.67Å; L119-V154 HydrophobicContact CD1-CG1 4.18Å; L119-V154 HydrophobicContact CD1-CG2 4.07Å
120	S	93	Very high	94.3	Very high	86 Å²	86	34.4 Å²	34.4	60%	0.601	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-2.6	-179.6	57.7	0	0	0	0	113.9	T118	T118-S120 VanDerWaalsContact C-N 3.33Å; T118-S120 PolarHBondContact O-N 2.83Å
121	T	94.8	Very high	93.9	Very high	60 Å²	60	36 Å²	36	37%	0.368	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.4	-83.4	-173.5	56.4	0	0	0	0	111.2	T118 L119 V124 A125	T118-T121 WeakPolarHBondContact CA-OG1 3.41Å; T118-T121 CarbonylContact O-C 3.57Å; T118-T121 PolarHBondContact O-N 3.43Å; T118-T121 VanDerWaalsContact O-N 3.09Å; T118-T121 PolarHBondContact O-OG1 2.77Å; L119-T121 VanDerWaalsContact C-N 3.35Å; T121-V124 PolarHBondContact O-N 3.4Å; T121-A125 PolarHBondContact O-N 3.05Å; T121-A125 VanDerWaalsContact O-N 3.16Å
122	L	95.7	Very high	93.5	Very high	13 Å²	13	43.8 Å²	43.8	7%	0.068	23%	0.234	C	C	.	.	H	α-helix	trans	-64.4	-44.2	-177.5	-75	172.7	0	0	0	112.2	T118 V124 A125 V126 D189 D190 P317	T118-L122 HydrophobicContact CG2-CD1 3.86Å; T118-L122 PolarHBondContact O-N 2.65Å; L122-V124 VanDerWaalsContact C-N 3.27Å; L122-V124 PolarHBondContact O-N 3.19Å; L122-A125 WeakPolarHBondContact O-CA 3.35Å; L122-A125 WeakPolarHBondContact O-CB 3.45Å; L122-A125 PolarHBondContact O-N 3.32Å; L122-V126 PolarHBondContact O-N 2.87Å; L122-D189 HydrophobicContact CB-CB 4.32Å; L122-D189 WeakPolarHBondContact CB-O 3.47Å; L122-D190 HydrophobicContact CD1-CB 4.5Å; L122-P317 HydrophobicContact CD2-CG 4.23Å
123	A	95.2	Very high	93	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.4	-34.5	179.3	0	0	0	0	0	112.5	T114 T118 L119 A125 V126 N127 F139 M152 D189	T114-A123 HydrophobicContact CG2-CB 4.36Å; T118-A123 PolarHBondContact O-N 3.19Å; T118-A123 VanDerWaalsContact O-N 3.08Å; L119-A123 HydrophobicContact CD1-CB 4.36Å; A123-A125 VanDerWaalsContact C-N 3.33Å; A123-V126 PolarHBondContact O-N 3.12Å; A123-N127 WeakPolarHBondContact O-CB 3.47Å; A123-N127 PolarHBondContact O-N 3.49Å; A123-F139 HydrophobicContact CB-CD1 3.79Å; A123-F139 HydrophobicContact CB-CE1 3.96Å; A123-F139 WeakPolarHBondContact O-CE1 3.25Å; A123-M152 HydrophobicContact CB-CE 4.02Å; A123-D189 HydrophobicContact CB-CB 4.37Å
124	V	95.5	Very high	92.6	Very high	25 Å²	25	48.1 Å²	48.1	15%	0.152	25%	0.254	C	S	.	.	H	α-helix	trans	-64.6	-40.5	172.5	178.1	0	0	0	0	110.8	T121 L122 N127 R128 P149 M152	T121-V124 PolarHBondContact O-N 3.4Å; L122-V124 VanDerWaalsContact C-N 3.27Å; L122-V124 PolarHBondContact O-N 3.19Å; V124-N127 PolarHBondContact O-N 2.91Å; V124-R128 WeakPolarHBondContact O-CG 3.49Å; V124-R128 PolarHBondContact O-N 3.16Å; V124-P149 HydrophobicContact CG2-CB 3.98Å; V124-P149 HydrophobicContact CG2-CG 3.77Å; V124-M152 HydrophobicContact CB-SD 4.46Å; V124-M152 HydrophobicContact CG2-SD 3.86Å
125	A	96.4	Very high	92	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-65.5	-45.6	177.1	0	0	0	0	0	111.7	T121 L122 A123 N127 R128 T129 P317 M320 Y321	T121-A125 PolarHBondContact O-N 3.05Å; T121-A125 VanDerWaalsContact O-N 3.16Å; L122-A125 WeakPolarHBondContact O-CA 3.35Å; L122-A125 WeakPolarHBondContact O-CB 3.45Å; L122-A125 PolarHBondContact O-N 3.32Å; A123-A125 VanDerWaalsContact C-N 3.33Å; A125-N127 PolarHBondContact O-N 2.92Å; A125-R128 PolarHBondContact O-N 2.93Å; A125-T129 WeakPolarHBondContact O-CG2 3.14Å; A125-T129 PolarHBondContact O-N 3.47Å; A125-T129 VanDerWaalsContact O-N 3.14Å; A125-T129 PolarHBondContact O-OG1 3.3Å; A125-P317 HydrophobicContact CB-CB 4.03Å; A125-M320 HydrophobicContact CB-CB 4.01Å; A125-M320 HydrophobicContact CB-CG 3.89Å; A125-Y321 WeakPolarHBondContact CA-OH 3.27Å; A125-Y321 HydrophobicContact CB-CE1 4.19Å; A125-Y321 HydrophobicContact CB-CE2 4.16Å
126	V	96.1	Very high	91.9	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.006	29%	0.292	C	S	.	.	H	α-helix	trans	-57.5	-47.6	172.6	175.5	0	0	0	0	110.6	V112 L122 A123 R128 T129 V130 F139 M193 M320	V112-V126 HydrophobicContact CG1-CG1 4.41Å; V112-V126 HydrophobicContact CG2-CG1 4.06Å; L122-V126 PolarHBondContact O-N 2.87Å; A123-V126 PolarHBondContact O-N 3.12Å; V126-R128 VanDerWaalsContact C-N 3.33Å; V126-R128 PolarHBondContact O-N 3.12Å; V126-T129 PolarHBondContact O-N 3.5Å; V126-T129 VanDerWaalsContact O-N 3.1Å; V126-T129 PolarHBondContact O-OG1 3.1Å; V126-V130 HydrophobicContact CG1-CG2 3.94Å; V126-V130 WeakPolarHBondContact O-CG2 3.4Å; V126-V130 PolarHBondContact O-N 3.23Å; V126-F139 HydrophobicContact CB-CE1 4.2Å; V126-F139 HydrophobicContact CB-CZ 4.47Å; V126-F139 HydrophobicContact CG1-CE1 4.13Å; V126-F139 HydrophobicContact CG1-CZ 4.24Å; V126-M193 HydrophobicContact CG1-CE 3.67Å; V126-M320 HydrophobicContact CG2-CE 3.49Å; V126-M320 VanDerWaalsContact CG2-CE 3.49Å; V126-M320 HydrophobicContact CG2-SD 4.23Å
127	N	95.3	Very high	92.1	Very high	21 Å²	21	51.2 Å²	51.2	11%	0.112	27%	0.265	C	S	.	.	H	α-helix	trans	-57	-46.8	179.7	-169.8	54.4	0	0	0	112	A123 V124 A125 T129 A131 F139 M152	A123-N127 WeakPolarHBondContact O-CB 3.47Å; A123-N127 PolarHBondContact O-N 3.49Å; V124-N127 PolarHBondContact O-N 2.91Å; A125-N127 PolarHBondContact O-N 2.92Å; N127-T129 VanDerWaalsContact C-N 3.26Å; N127-T129 PolarHBondContact O-N 2.92Å; N127-A131 WeakPolarHBondContact O-CB 2.93Å; N127-A131 PolarHBondContact O-N 3Å; N127-A131 VanDerWaalsContact OD1-CB 3.29Å; N127-A131 WeakPolarHBondContact OD1-CB 3.42Å; N127-F139 HydrophobicContact CB-CE2 3.76Å; N127-F139 HydrophobicContact CB-CZ 3.55Å; N127-F139 WeakPolarHBondContact OD1-CE2 3.2Å; N127-M152 HydrophobicContact CB-CE 4.19Å; N127-M152 HydrophobicContact CB-CG 4.01Å; N127-M152 HydrophobicContact CB-SD 4.18Å; N127-M152 WeakPolarHBondContact ND2-CG 3.31Å
128	R	94.1	Very high	92.3	Very high	158 Å²	158	48 Å²	48	60%	0.596	24%	0.236	S	C	*	.	H	α-helix	trans	-65.5	-27.3	179.8	-75	175.2	174	-176.4	0.3	113.5	V124 A125 V126 Y321	V124-R128 WeakPolarHBondContact O-CG 3.49Å; V124-R128 PolarHBondContact O-N 3.16Å; A125-R128 PolarHBondContact O-N 2.93Å; V126-R128 VanDerWaalsContact C-N 3.33Å; V126-R128 PolarHBondContact O-N 3.12Å; R128-Y321 HydrophobicContact CB-CE1 4.13Å; R128-Y321 VanDerWaalsContact CD-OH 3.27Å; R128-Y321 WeakPolarHBondContact CD-OH 3.35Å; R128-Y321 PolarHBondContact NH1-OH 3.44Å
129	T	94	Very high	92.4	Very high	4 Å²	4	46.6 Å²	46.6	3%	0.025	23%	0.228	C	C	.	.	H	α-helix	trans	-89.6	-29.8	-179.8	57.7	0	0	0	0	113.6	A125 V126 N127 H133 M320 Y321 H324	A125-T129 WeakPolarHBondContact O-CG2 3.14Å; A125-T129 PolarHBondContact O-N 3.47Å; A125-T129 VanDerWaalsContact O-N 3.14Å; A125-T129 PolarHBondContact O-OG1 3.3Å; V126-T129 PolarHBondContact O-N 3.5Å; V126-T129 VanDerWaalsContact O-N 3.1Å; V126-T129 PolarHBondContact O-OG1 3.1Å; N127-T129 VanDerWaalsContact C-N 3.26Å; N127-T129 PolarHBondContact O-N 2.92Å; T129-H133 PolarHBondContact O-CD2 2.71Å; T129-H133 VanDerWaalsContact O-CD2 3.32Å; T129-M320 HydrophobicContact CG2-CG 4.41Å; T129-Y321 HydrophobicContact CG2-CD1 4.09Å; T129-Y321 HydrophobicContact CG2-CE1 4.35Å; T129-H324 HydrophobicContact CG2-CB 3.7Å
130	V	92.6	Very high	92.5	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-114.9	-21.1	-174.6	-53	0	0	0	0	115.9	V126 H132 H133 F134 T137 M193 A195	V126-V130 HydrophobicContact CG1-CG2 3.94Å; V126-V130 WeakPolarHBondContact O-CG2 3.4Å; V126-V130 PolarHBondContact O-N 3.23Å; V130-H132 VanDerWaalsContact C-N 3.25Å; V130-H132 PolarHBondContact O-N 3.42Å; V130-H133 PolarHBondContact O-N 2.91Å; V130-F134 HydrophobicContact CB-CD2 3.78Å; V130-F134 HydrophobicContact CB-CE2 3.81Å; V130-F134 HydrophobicContact CG1-CE2 4.26Å; V130-F134 HydrophobicContact CG2-CD2 3.94Å; V130-F134 HydrophobicContact CG2-CE2 4.11Å; V130-F134 PolarHBondContact O-N 3.13Å; V130-F134 VanDerWaalsContact O-N 3.09Å; V130-T137 HydrophobicContact CG2-CG2 4.13Å; V130-M193 HydrophobicContact CG1-CB 4.18Å; V130-M193 HydrophobicContact CG1-CE 4.34Å; V130-M193 HydrophobicContact CG2-CE 4.41Å; V130-A195 HydrophobicContact CB-CB 4.43Å
131	A	87.8	Confident	92.6	Very high	35 Å²	35	42.1 Å²	42.1	29%	0.289	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-24.1	-171.4	0	0	0	0	0	114.4	N127 H133	N127-A131 WeakPolarHBondContact O-CB 2.93Å; N127-A131 PolarHBondContact O-N 3Å; N127-A131 VanDerWaalsContact OD1-CB 3.29Å; N127-A131 WeakPolarHBondContact OD1-CB 3.42Å; A131-H133 VanDerWaalsContact C-N 3.3Å
132	H	87.2	Confident	92.4	Very high	164 Å²	164	39.5 Å²	39.5	76%	0.759	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-10.7	175.6	-58.9	-67.2	0	0	0	113.3	V130	V130-H132 VanDerWaalsContact C-N 3.25Å; V130-H132 PolarHBondContact O-N 3.42Å
133	H	87.1	Confident	92	Very high	101 Å²	101	40 Å²	40	47%	0.468	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-35	-175.5	-64.7	-63.9	0	0	0	113	T129 V130 A131 A195	T129-H133 PolarHBondContact O-CD2 2.71Å; T129-H133 VanDerWaalsContact O-CD2 3.32Å; V130-H133 PolarHBondContact O-N 2.91Å; A131-H133 VanDerWaalsContact C-N 3.3Å; H133-A195 HydrophobicContact CB-CB 3.39Å
134	F	87.5	Confident	91.4	Very high	10 Å²	10	50.3 Å²	50.3	4%	0.044	22%	0.224	C	C	.	.	S	Bend	trans	-85.9	147.4	171.7	-65.7	-49.6	0	0	0	111	L108 A110 V130 R136 L185 A195 L198	L108-F134 HydrophobicContact CD2-CD1 4.05Å; L108-F134 HydrophobicContact CD2-CE1 3.6Å; L108-F134 HydrophobicContact CD2-CZ 4.47Å; A110-F134 HydrophobicContact CB-CD2 3.58Å; A110-F134 HydrophobicContact CB-CE2 3.78Å; A110-F134 HydrophobicContact CB-CG 4.08Å; A110-F134 HydrophobicContact CB-CZ 4.44Å; V130-F134 HydrophobicContact CB-CD2 3.78Å; V130-F134 HydrophobicContact CB-CE2 3.81Å; V130-F134 HydrophobicContact CG1-CE2 4.26Å; V130-F134 HydrophobicContact CG2-CD2 3.94Å; V130-F134 HydrophobicContact CG2-CE2 4.11Å; V130-F134 PolarHBondContact O-N 3.13Å; V130-F134 VanDerWaalsContact O-N 3.09Å; F134-R136 VanDerWaalsContact C-N 3.35Å; F134-L185 HydrophobicContact CE2-CD2 4.37Å; F134-L185 HydrophobicContact CZ-CD2 3.93Å; F134-A195 HydrophobicContact CD1-CB 3.97Å; F134-A195 HydrophobicContact CD2-CB 4.07Å; F134-A195 HydrophobicContact CE1-CB 3.56Å; F134-A195 HydrophobicContact CE2-CB 3.69Å; F134-A195 HydrophobicContact CG-CB 4.21Å; F134-A195 VanDerWaalsContact CZ-CA 3.45Å; F134-A195 HydrophobicContact CZ-CB 3.43Å; F134-A195 VanDerWaalsContact CZ-CB 3.43Å; F134-L198 HydrophobicContact CE1-CB 4.39Å; F134-L198 HydrophobicContact CZ-CB 4.42Å; F134-L198 HydrophobicContact CZ-CD1 4.11Å
135	H	81.1	Confident	90.7	Very high	128 Å²	128	54.2 Å²	54.2	59%	0.593	25%	0.252	S	S	*	.	S	Bend	trans	-61.7	-44.1	175.4	-69.9	-88.5	0	0	0	111.9	E106	E106-H135 IonicContact OE1-ND1 3.52Å; E106-H135 WeakPolarHBondContact OE2-CB 3.23Å; E106-H135 IonicContact OE2-CG 3.93Å
136	R	88.7	Confident	89.9	Confident	139 Å²	139	55.4 Å²	55.4	53%	0.525	26%	0.26	S	S	.	.			trans	-141.8	134.8	174.4	-67.9	-62.2	-176.2	164.1	0.2	111.3	A110 F134 F138 Y181	A110-R136 PolarHBondContact N-O 3.18Å; F134-R136 VanDerWaalsContact C-N 3.35Å; R136-F138 HydrophobicContact CB-CE2 3.94Å; R136-Y181 WeakPolarHBondContact CG-OH 3.31Å
137	T	93.6	Very high	89.4	Confident	13 Å²	13	64.9 Å²	64.9	8%	0.08	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	125.3	174.2	-53	0	0	0	0	109.1	A110 V112 V130 F139	A110-T137 HydrophobicContact CB-CG2 4.31Å; A110-T137 CarbonylContact O-C 3.56Å; A110-T137 WeakPolarHBondContact O-CA 3.46Å; V112-T137 HydrophobicContact CG2-CG2 4.31Å; V130-T137 HydrophobicContact CG2-CG2 4.13Å; T137-F139 HydrophobicContact CG2-CE2 3.78Å; T137-F139 HydrophobicContact CG2-CZ 3.98Å
138	F	95.3	Very high	89	Confident	11 Å²	11	67.3 Å²	67.3	5%	0.048	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	138.9	177.5	-68.1	-80.2	0	0	0	110.8	L109 A110 G111 V112 R136 F140 T153 I155 Y177	L109-F138 HydrophobicContact CD1-CD2 3.97Å; L109-F138 HydrophobicContact CD1-CE2 3.74Å; L109-F138 HydrophobicContact CD2-CD2 3.99Å; L109-F138 HydrophobicContact CG-CD2 4.03Å; L109-F138 HydrophobicContact CG-CE2 4.17Å; A110-F138 PolarHBondContact O-N 2.79Å; G111-F138 WeakPolarHBondContact CA-O 3.37Å; V112-F138 PolarHBondContact N-O 3.32Å; R136-F138 HydrophobicContact CB-CE2 3.94Å; F138-F140 HydrophobicContact CB-CD2 4.41Å; F138-F140 HydrophobicContact CB-CE2 3.64Å; F138-F140 HydrophobicContact CB-CZ 3.76Å; F138-F140 HydrophobicContact CG-CZ 4.48Å; F138-T153 HydrophobicContact CD1-CG2 3.61Å; F138-T153 HydrophobicContact CE1-CG2 3.57Å; F138-I155 HydrophobicContact CB-CD1 4.13Å; F138-I155 HydrophobicContact CD1-CD1 3.48Å; F138-I155 VanDerWaalsContact CD1-CD1 3.48Å; F138-I155 HydrophobicContact CD1-CG1 4.29Å; F138-I155 HydrophobicContact CE1-CD1 4.15Å; F138-I155 HydrophobicContact CG-CD1 4Å; F138-Y177 HydrophobicContact CD2-CE2 4.5Å; F138-Y177 HydrophobicContact CE1-CE2 4.33Å; F138-Y177 AromaticContact CE1-CZ 3.91Å; F138-Y177 VanDerWaalsContact CE1-OH 3.29Å; F138-Y177 WeakPolarHBondContact CE1-OH 3.41Å; F138-Y177 HydrophobicContact CE2-CD2 4.46Å; F138-Y177 HydrophobicContact CE2-CE1 4.11Å; F138-Y177 AromaticContact CE2-CE2 3.96Å; F138-Y177 HydrophobicContact CE2-CE2 3.96Å; F138-Y177 AromaticContact CE2-CZ 3.76Å; F138-Y177 AromaticContact CZ-CE1 3.79Å; F138-Y177 HydrophobicContact CZ-CE1 3.79Å; F138-Y177 AromaticContact CZ-CE2 3.87Å; F138-Y177 HydrophobicContact CZ-CE2 3.87Å; F138-Y177 AromaticContact CZ-CZ 3.31Å; F138-Y177 WeakPolarHBondContact CZ-OH 3.38Å
139	F	96.3	Very high	88.7	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	123.1	174.3	-67.2	-91.4	0	0	0	109.5	V112 T114 A123 V126 N127 T137 M152 T153 V154 I155	V112-F139 HydrophobicContact CB-CD1 3.73Å; V112-F139 HydrophobicContact CB-CE1 3.78Å; V112-F139 HydrophobicContact CG1-CD1 3.94Å; V112-F139 HydrophobicContact CG1-CE1 3.87Å; V112-F139 HydrophobicContact CG2-CD1 4.45Å; V112-F139 HydrophobicContact CG2-CE1 4.07Å; V112-F139 HydrophobicContact CG2-CZ 4.49Å; V112-F139 CarbonylContact O-C 3.6Å; V112-F139 WeakPolarHBondContact O-CA 3.3Å; T114-F139 HydrophobicContact CG2-CB 4.35Å; A123-F139 HydrophobicContact CB-CD1 3.79Å; A123-F139 HydrophobicContact CB-CE1 3.96Å; A123-F139 WeakPolarHBondContact O-CE1 3.25Å; V126-F139 HydrophobicContact CB-CE1 4.2Å; V126-F139 HydrophobicContact CB-CZ 4.47Å; V126-F139 HydrophobicContact CG1-CE1 4.13Å; V126-F139 HydrophobicContact CG1-CZ 4.24Å; N127-F139 HydrophobicContact CB-CE2 3.76Å; N127-F139 HydrophobicContact CB-CZ 3.55Å; N127-F139 WeakPolarHBondContact OD1-CE2 3.2Å; T137-F139 HydrophobicContact CG2-CE2 3.78Å; T137-F139 HydrophobicContact CG2-CZ 3.98Å; F139-M152 HydrophobicContact CB-CE 4.37Å; F139-M152 HydrophobicContact CD1-CE 3.87Å; F139-M152 HydrophobicContact CD2-CE 3.62Å; F139-M152 HydrophobicContact CE1-CE 4.04Å; F139-M152 HydrophobicContact CE2-CE 3.82Å; F139-M152 HydrophobicContact CG-CE 3.66Å; F139-M152 HydrophobicContact CZ-CE 4.03Å; F139-T153 PolarHBondContact N-O 3.43Å; F139-V154 HydrophobicContact CB-CG2 4.13Å; F139-V154 CarbonylContact O-C 3.48Å; F139-V154 VanDerWaalsContact O-CA 3.28Å; F139-V154 WeakPolarHBondContact O-CA 3.49Å; F139-I155 PolarHBondContact O-N 3.07Å
140	F	95.8	Very high	88.2	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129	-176.3	-63.3	-83.9	0	0	0	110.5	V112 L113 T114 F138 I155 H157 L165 T169 H172 L173	V112-F140 PolarHBondContact O-N 3.47Å; L113-F140 HydrophobicContact CD2-CB 3.93Å; T114-F140 WeakPolarHBondContact CG2-O 3.24Å; T114-F140 PolarHBondContact N-O 3.27Å; F138-F140 HydrophobicContact CB-CD2 4.41Å; F138-F140 HydrophobicContact CB-CE2 3.64Å; F138-F140 HydrophobicContact CB-CZ 3.76Å; F138-F140 HydrophobicContact CG-CZ 4.48Å; F140-I155 WeakPolarHBondContact CA-O 3.48Å; F140-I155 HydrophobicContact CD1-CB 3.77Å; F140-I155 HydrophobicContact CD1-CD1 4.13Å; F140-I155 HydrophobicContact CD1-CG2 3.97Å; F140-I155 HydrophobicContact CE1-CB 3.93Å; F140-I155 HydrophobicContact CE1-CD1 3.42Å; F140-I155 VanDerWaalsContact CE1-CD1 3.42Å; F140-I155 HydrophobicContact CE1-CG1 4.27Å; F140-I155 HydrophobicContact CE1-CG2 4.06Å; F140-I155 HydrophobicContact CZ-CD1 3.86Å; F140-H157 AromaticContact CD1-NE2 3.31Å; F140-H157 VanDerWaalsContact CD1-NE2 3.31Å; F140-H157 WeakPolarHBondContact CD1-NE2 3.4Å; F140-H157 AromaticContact CE1-NE2 3.93Å; F140-L165 HydrophobicContact CB-CD1 4.32Å; F140-T169 HydrophobicContact CB-CG2 4.3Å; F140-T169 WeakPolarHBondContact CB-OG1 3.37Å; F140-T169 HydrophobicContact CD1-CG2 3.91Å; F140-T169 HydrophobicContact CD2-CG2 3.53Å; F140-T169 HydrophobicContact CE1-CG2 4.04Å; F140-T169 HydrophobicContact CE2-CG2 3.7Å; F140-T169 HydrophobicContact CG-CG2 3.64Å; F140-T169 HydrophobicContact CZ-CG2 3.95Å; F140-H172 AromaticContact CE1-CD2 3.84Å; F140-L173 HydrophobicContact CE2-CD2 4.28Å; F140-L173 HydrophobicContact CZ-CD2 3.77Å; F140-L173 HydrophobicContact CZ-CG 4.15Å
141	T	94.8	Very high	87.8	Confident	0 Å²	0	74 Å²	74	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	146.2	-178.6	-173.7	0	0	0	0	112.5	L143 P146 V154 I155 A156 H157	T141-L143 HydrophobicContact CG2-CB 3.98Å; T141-L143 HydrophobicContact CG2-CD1 4.49Å; T141-L143 PolarHBondContact O-N 3.04Å; T141-L143 PolarHBondContact OG1-N 3.5Å; T141-P146 HydrophobicContact CG2-CB 4.2Å; T141-P146 HydrophobicContact CG2-CG 4.03Å; T141-V154 HydrophobicContact CG2-CG1 3.63Å; T141-I155 PolarHBondContact N-O 2.96Å; T141-A156 WeakPolarHBondContact O-CA 3.41Å; T141-H157 PolarHBondContact O-N 2.92Å
142	G	90.7	Very high	87.9	Confident	5 Å²	5	73 Å²	73	5%	0.052	37%	0.366	C	S	.	.	S	Bend	trans	-76.3	-1.3	173.1	0	0	0	0	0	114.8	G158 D159	G142-G158 CarbonylContact O-C 3.54Å; G142-G158 WeakPolarHBondContact O-CA 3.5Å; G142-G158 PolarHBondContact O-N 3Å; G142-D159 VanDerWaalsContact CA-C 3.5Å; G142-D159 WeakPolarHBondContact CA-O 3.22Å; G142-D159 CarbonylContact O-C 3.56Å; G142-D159 PolarHBondContact O-N 3.34Å; G142-D159 VanDerWaalsContact O-N 3.15Å
143	L	87.8	Confident	88.1	Confident	24 Å²	24	68.5 Å²	68.5	13%	0.126	35%	0.35	C	S	.	.			trans	-67	137.7	175.5	-73.7	167.5	0	0	0	111.3	R116 L119 T141 P146 A156	R116-L143 HydrophobicContact CB-CD1 4.22Å; R116-L143 HydrophobicContact CB-CD2 3.96Å; R116-L143 HydrophobicContact CB-CG 4.22Å; R116-L143 HydrophobicContact CG-CD1 4.41Å; R116-L143 HydrophobicContact CG-CD2 3.92Å; L119-L143 HydrophobicContact CD2-CD1 3.84Å; T141-L143 HydrophobicContact CG2-CB 3.98Å; T141-L143 HydrophobicContact CG2-CD1 4.49Å; T141-L143 PolarHBondContact O-N 3.04Å; T141-L143 PolarHBondContact OG1-N 3.5Å; L143-P146 HydrophobicContact CB-CB 4.05Å; L143-P146 HydrophobicContact CB-CG 4.42Å; L143-P146 HydrophobicContact CD1-CB 3.84Å; L143-A156 WeakPolarHBondContact O-CB 3.38Å
144	R	82.9	Confident	88.4	Confident	216 Å²	216	64.9 Å²	64.9	82%	0.815	34%	0.335	S	S	*	.	S	Bend	trans	-74.6	-33	173.7	-70.2	-176.7	-179.3	-168.4	-0.5	113.4	G158	R144-G158 PolarHBondContact NE-O 3.3Å
145	S	80.4	Confident	88.7	Confident	108 Å²	108	65.6 Å²	65.6	76%	0.755	34%	0.339	S	S	*	.	S	Bend	trans	-144.2	71.2	-178.2	49.2	0	0	0	0	111
146	P	80	Confident	89.3	Confident	25 Å²	25	61.7 Å²	61.7	16%	0.162	33%	0.329	C	S	.	.			trans	-65.7	139	179.2	27.5	-33.2	0	0	0	111.1	L119 T141 L143 V148 V154 A156	L119-P146 HydrophobicContact CD2-CB 3.67Å; T141-P146 HydrophobicContact CG2-CB 4.2Å; T141-P146 HydrophobicContact CG2-CG 4.03Å; L143-P146 HydrophobicContact CB-CB 4.05Å; L143-P146 HydrophobicContact CB-CG 4.42Å; L143-P146 HydrophobicContact CD1-CB 3.84Å; P146-V148 HydrophobicContact CG-CG2 4.26Å; P146-V148 PolarHBondContact O-N 3.06Å; P146-V148 VanDerWaalsContact O-N 3.11Å; P146-V154 HydrophobicContact CB-CG1 4.48Å; P146-V154 HydrophobicContact CG-CG1 4.09Å; P146-A156 HydrophobicContact CG-CB 4.05Å
147	K	84.1	Confident	89.4	Confident	199 Å²	199	57 Å²	57	87%	0.865	31%	0.313	S	S	*	.			trans	-72.9	100.1	162.4	-71.8	-175.9	179.3	-179.3	0	107.6	P149	K147-P149 WeakPolarHBondContact O-CD 3.36Å
148	V	86.9	Confident	89	Confident	73 Å²	73	57.4 Å²	57.4	44%	0.442	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-73.7	123.9	-174.8	-178.4	0	0	0	0	110.1	P146 M152 V154	P146-V148 HydrophobicContact CG-CG2 4.26Å; P146-V148 PolarHBondContact O-N 3.06Å; P146-V148 VanDerWaalsContact O-N 3.11Å; V148-M152 HydrophobicContact CG1-CB 4.33Å; V148-M152 WeakPolarHBondContact CG1-O 3.44Å; V148-V154 HydrophobicContact CG1-CB 4.2Å; V148-V154 HydrophobicContact CG1-CG2 3.78Å; V148-V154 HydrophobicContact CG2-CB 4.05Å; V148-V154 HydrophobicContact CG2-CG2 4.36Å
149	P	87.7	Confident	88.5	Confident	30 Å²	30	59 Å²	59	20%	0.195	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-63.4	147.4	171.5	-19.8	32.8	0	0	0	111.4	V124 K147 G151 M152	V124-P149 HydrophobicContact CG2-CB 3.98Å; V124-P149 HydrophobicContact CG2-CG 3.77Å; K147-P149 WeakPolarHBondContact O-CD 3.36Å; P149-G151 PolarHBondContact O-N 3.38Å; P149-M152 HydrophobicContact CB-CG 4.42Å; P149-M152 HydrophobicContact CB-SD 3.64Å; P149-M152 HydrophobicContact CG-SD 3.67Å; P149-M152 PolarHBondContact O-N 3.36Å
150	H	84.4	Confident	87.8	Confident	197 Å²	197	62.7 Å²	62.7	91%	0.912	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	132.9	-177.6	-62.7	88.9	0	0	0	111.9	M152	H150-M152 VanDerWaalsContact C-N 3.34Å
151	G	82.7	Confident	87.6	Confident	75 Å²	75	69.9 Å²	69.9	77%	0.773	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	11.4	177	0	0	0	0	0	115.3	P149	P149-G151 PolarHBondContact O-N 3.38Å
152	M	90.4	Very high	87.3	Confident	16 Å²	16	73.3 Å²	73.3	8%	0.079	40%	0.398	C	S	.	.			trans	-104.7	142.4	174.3	-71.4	178.3	69.9	0	0	111.8	A123 V124 N127 F139 V148 P149 H150 V154	A123-M152 HydrophobicContact CB-CE 4.02Å; V124-M152 HydrophobicContact CB-SD 4.46Å; V124-M152 HydrophobicContact CG2-SD 3.86Å; N127-M152 HydrophobicContact CB-CE 4.19Å; N127-M152 HydrophobicContact CB-CG 4.01Å; N127-M152 HydrophobicContact CB-SD 4.18Å; N127-M152 WeakPolarHBondContact ND2-CG 3.31Å; F139-M152 HydrophobicContact CB-CE 4.37Å; F139-M152 HydrophobicContact CD1-CE 3.87Å; F139-M152 HydrophobicContact CD2-CE 3.62Å; F139-M152 HydrophobicContact CE1-CE 4.04Å; F139-M152 HydrophobicContact CE2-CE 3.82Å; F139-M152 HydrophobicContact CG-CE 3.66Å; F139-M152 HydrophobicContact CZ-CE 4.03Å; V148-M152 HydrophobicContact CG1-CB 4.33Å; V148-M152 WeakPolarHBondContact CG1-O 3.44Å; P149-M152 HydrophobicContact CB-CG 4.42Å; P149-M152 HydrophobicContact CB-SD 3.64Å; P149-M152 HydrophobicContact CG-SD 3.67Å; P149-M152 PolarHBondContact O-N 3.36Å; H150-M152 VanDerWaalsContact C-N 3.34Å; M152-V154 HydrophobicContact CB-CG2 4.05Å; M152-V154 HydrophobicContact CE-CG2 4.41Å
153	T	92.1	Very high	87.4	Confident	69 Å²	69	73.6 Å²	73.6	42%	0.423	40%	0.398	S	S	.	.			trans	-99.2	101.2	168.9	-50.2	0	0	0	0	109.4	F138 F139	F138-T153 HydrophobicContact CD1-CG2 3.61Å; F138-T153 HydrophobicContact CE1-CG2 3.57Å; F139-T153 PolarHBondContact N-O 3.43Å
154	V	93.6	Very high	87.6	Confident	24 Å²	24	74.9 Å²	74.9	15%	0.145	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.5	-177.1	-178	0	0	0	0	109.8	L119 F139 T141 P146 V148 M152	L119-V154 HydrophobicContact CD1-CG1 4.18Å; L119-V154 HydrophobicContact CD1-CG2 4.07Å; F139-V154 HydrophobicContact CB-CG2 4.13Å; F139-V154 CarbonylContact O-C 3.48Å; F139-V154 VanDerWaalsContact O-CA 3.28Å; F139-V154 WeakPolarHBondContact O-CA 3.49Å; T141-V154 HydrophobicContact CG2-CG1 3.63Å; P146-V154 HydrophobicContact CB-CG1 4.48Å; P146-V154 HydrophobicContact CG-CG1 4.09Å; V148-V154 HydrophobicContact CG1-CB 4.2Å; V148-V154 HydrophobicContact CG1-CG2 3.78Å; V148-V154 HydrophobicContact CG2-CB 4.05Å; V148-V154 HydrophobicContact CG2-CG2 4.36Å; M152-V154 HydrophobicContact CB-CG2 4.05Å; M152-V154 HydrophobicContact CE-CG2 4.41Å
155	I	93.7	Very high	88.1	Confident	25 Å²	25	65.3 Å²	65.3	13%	0.128	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.7	176.7	-63.8	161.5	0	0	0	108.7	F138 F139 F140 T141 H172	F138-I155 HydrophobicContact CB-CD1 4.13Å; F138-I155 HydrophobicContact CD1-CD1 3.48Å; F138-I155 VanDerWaalsContact CD1-CD1 3.48Å; F138-I155 HydrophobicContact CD1-CG1 4.29Å; F138-I155 HydrophobicContact CE1-CD1 4.15Å; F138-I155 HydrophobicContact CG-CD1 4Å; F139-I155 PolarHBondContact O-N 3.07Å; F140-I155 WeakPolarHBondContact CA-O 3.48Å; F140-I155 HydrophobicContact CD1-CB 3.77Å; F140-I155 HydrophobicContact CD1-CD1 4.13Å; F140-I155 HydrophobicContact CD1-CG2 3.97Å; F140-I155 HydrophobicContact CE1-CB 3.93Å; F140-I155 HydrophobicContact CE1-CD1 3.42Å; F140-I155 VanDerWaalsContact CE1-CD1 3.42Å; F140-I155 HydrophobicContact CE1-CG1 4.27Å; F140-I155 HydrophobicContact CE1-CG2 4.06Å; F140-I155 HydrophobicContact CZ-CD1 3.86Å; T141-I155 PolarHBondContact N-O 2.96Å; I155-H172 WeakPolarHBondContact CD1-NE2 3.06Å
156	A	92.9	Very high	88.7	Confident	46 Å²	46	60.3 Å²	60.3	38%	0.38	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	113	-175.8	0	0	0	0	0	110.5	T141 L143 P146	T141-A156 WeakPolarHBondContact O-CA 3.41Å; L143-A156 WeakPolarHBondContact O-CB 3.38Å; P146-A156 HydrophobicContact CG-CB 4.05Å
157	H	91.9	Very high	89.4	Confident	42 Å²	42	59.2 Å²	59.2	19%	0.194	32%	0.324	C	S	.	.			trans	-91.2	-19.7	178	-68.3	-56.7	0	0	0	113.4	F140 T141 D159 E168	F140-H157 AromaticContact CD1-NE2 3.31Å; F140-H157 VanDerWaalsContact CD1-NE2 3.31Å; F140-H157 WeakPolarHBondContact CD1-NE2 3.4Å; F140-H157 AromaticContact CE1-NE2 3.93Å; T141-H157 PolarHBondContact O-N 2.92Å; H157-D159 PolarHBondContact O-N 2.86Å; H157-E168 HydrophobicContact CB-CB 3.93Å; H157-E168 HydrophobicContact CB-CG 4.3Å; H157-E168 PolarHBondContact CE1-O 3.01Å; H157-E168 WeakPolarHBondContact ND1-CB 3.33Å
158	G	84.5	Confident	89.9	Confident	21 Å²	21	52 Å²	52	22%	0.216	29%	0.294	C	S	.	.	S	Bend	trans	80.8	5	172.6	0	0	0	0	0	116.8	G142 R144	G142-G158 CarbonylContact O-C 3.54Å; G142-G158 WeakPolarHBondContact O-CA 3.5Å; G142-G158 PolarHBondContact O-N 3Å; R144-G158 PolarHBondContact NE-O 3.3Å
159	D	85.7	Confident	90.3	Very high	44 Å²	44	48.6 Å²	48.6	24%	0.235	27%	0.272	C	S	.	.			trans	-126.9	123	168.4	-163.1	-39.9	0	0	0	110.4	G142 H157 R161 W164	G142-D159 VanDerWaalsContact CA-C 3.5Å; G142-D159 WeakPolarHBondContact CA-O 3.22Å; G142-D159 CarbonylContact O-C 3.56Å; G142-D159 PolarHBondContact O-N 3.34Å; G142-D159 VanDerWaalsContact O-N 3.15Å; H157-D159 PolarHBondContact O-N 2.86Å; D159-R161 VanDerWaalsContact OD1-CB 3.29Å; D159-R161 WeakPolarHBondContact OD1-CB 3.3Å; D159-R161 WeakPolarHBondContact OD1-CG 3.32Å; D159-R161 PolarHBondContact OD1-N 2.81Å; D159-R161 IonicContact OD1-NE 3.09Å; D159-R161 PolarHBondContact OD1-NE 3.48Å; D159-R161 VanDerWaalsContact OD1-NE 3.09Å; D159-R161 IonicContact OD2-CZ 3.32Å; D159-R161 VanDerWaalsContact OD2-CZ 3.32Å; D159-R161 IonicContact OD2-NE 3.14Å; D159-R161 PolarHBondContact OD2-NE 3.23Å; D159-R161 VanDerWaalsContact OD2-NE 3.14Å; D159-R161 IonicContact OD2-NH2 2.68Å; D159-R161 PolarHBondContact OD2-NH2 2.88Å; D159-W164 HydrophobicContact CB-CB 4.18Å
160	D	81.7	Confident	90.7	Very high	78 Å²	78	47.1 Å²	47.1	42%	0.417	26%	0.263	S	S	.	.			trans	-90.3	0.2	-174.5	-152.7	27.2	0	0	0	113
161	R	89.8	Confident	91.2	Very high	150 Å²	150	41.6 Å²	41.6	57%	0.566	23%	0.234	S	C	*	.			trans	-67.1	126	174.2	-70	178.1	-76.9	175.7	-2	109.1	D159 V163 W164 L165	D159-R161 VanDerWaalsContact OD1-CB 3.29Å; D159-R161 WeakPolarHBondContact OD1-CB 3.3Å; D159-R161 WeakPolarHBondContact OD1-CG 3.32Å; D159-R161 PolarHBondContact OD1-N 2.81Å; D159-R161 IonicContact OD1-NE 3.09Å; D159-R161 PolarHBondContact OD1-NE 3.48Å; D159-R161 VanDerWaalsContact OD1-NE 3.09Å; D159-R161 IonicContact OD2-CZ 3.32Å; D159-R161 VanDerWaalsContact OD2-CZ 3.32Å; D159-R161 IonicContact OD2-NE 3.14Å; D159-R161 PolarHBondContact OD2-NE 3.23Å; D159-R161 VanDerWaalsContact OD2-NE 3.14Å; D159-R161 IonicContact OD2-NH2 2.68Å; D159-R161 PolarHBondContact OD2-NH2 2.88Å; R161-V163 VanDerWaalsContact C-N 3.35Å; R161-V163 PolarHBondContact O-N 2.83Å; R161-W164 HydrophobicContact CB-CB 4.15Å; R161-W164 VanDerWaalsContact CZ-NE1 3.34Å; R161-W164 VanDerWaalsContact NE-CD1 3.32Å; R161-W164 WeakPolarHBondContact O-CB 3.28Å; R161-W164 PolarHBondContact O-N 2.86Å; R161-L165 PolarHBondContact O-N 2.87Å
162	P	89.8	Confident	91.8	Very high	72 Å²	72	39.5 Å²	39.5	47%	0.468	20%	0.204	S	C	.	.	H	α-helix	trans	-54.8	-43.7	-171.7	-29.7	35.1	0	0	0	114.8	L165 M166 P261	P162-L165 PolarHBondContact O-N 3.1Å; P162-M166 PolarHBondContact O-N 2.85Å; P162-P261 HydrophobicContact CB-CB 4.31Å; P162-P261 HydrophobicContact CB-CG 3.96Å
163	V	92.4	Very high	92	Very high	11 Å²	11	38.9 Å²	38.9	7%	0.067	20%	0.201	C	C	.	.	H	α-helix	trans	-64.8	-39.6	178	174.7	0	0	0	0	111.5	R161 M166 Y167 I256 W264	R161-V163 VanDerWaalsContact C-N 3.35Å; R161-V163 PolarHBondContact O-N 2.83Å; V163-M166 PolarHBondContact O-N 2.89Å; V163-Y167 WeakPolarHBondContact O-CB 3.32Å; V163-Y167 PolarHBondContact O-N 3.07Å; V163-I256 HydrophobicContact CB-CD1 4.49Å; V163-I256 HydrophobicContact CG1-CD1 3.86Å; V163-I256 HydrophobicContact CG1-CG1 4.26Å; V163-I256 HydrophobicContact CG1-CG2 4.33Å; V163-I256 HydrophobicContact CG2-CG2 4.34Å; V163-W264 HydrophobicContact CG1-CB 4.26Å; V163-W264 HydrophobicContact CG1-CD2 3.59Å; V163-W264 HydrophobicContact CG1-CE3 4.15Å; V163-W264 HydrophobicContact CG1-CG 3.59Å; V163-W264 HydrophobicContact CG2-CB 4.24Å; V163-W264 HydrophobicContact CG2-CG 4.44Å
164	W	91.6	Very high	92.1	Very high	52 Å²	52	37.8 Å²	37.8	20%	0.197	19%	0.191	C	C	.	.	H	α-helix	trans	-67.7	-42.1	176.8	-100.1	140.1	0	0	0	112.9	D159 R161 M166 Y167 E168 R253	D159-W164 HydrophobicContact CB-CB 4.18Å; R161-W164 HydrophobicContact CB-CB 4.15Å; R161-W164 VanDerWaalsContact CZ-NE1 3.34Å; R161-W164 VanDerWaalsContact NE-CD1 3.32Å; R161-W164 WeakPolarHBondContact O-CB 3.28Å; R161-W164 PolarHBondContact O-N 2.86Å; W164-M166 VanDerWaalsContact C-N 3.27Å; W164-M166 PolarHBondContact O-N 3.06Å; W164-Y167 AromaticContact CE3-CD1 3.38Å; W164-Y167 HydrophobicContact CE3-CD1 3.38Å; W164-Y167 HydrophobicContact CE3-CE1 4.08Å; W164-Y167 AromaticContact CE3-CG 3.88Å; W164-Y167 HydrophobicContact CE3-CG 3.88Å; W164-Y167 HydrophobicContact CH2-CD1 4.44Å; W164-Y167 HydrophobicContact CH2-CE1 4.36Å; W164-Y167 AromaticContact CZ3-CD1 3.18Å; W164-Y167 HydrophobicContact CZ3-CD1 3.18Å; W164-Y167 AromaticContact CZ3-CE1 3.38Å; W164-Y167 HydrophobicContact CZ3-CE1 3.38Å; W164-Y167 AromaticContact CZ3-CG 3.92Å; W164-Y167 HydrophobicContact CZ3-CG 3.92Å; W164-Y167 PolarHBondContact O-N 3.43Å; W164-E168 HydrophobicContact CE3-CG 4.38Å; W164-E168 HydrophobicContact CZ3-CG 4.49Å; W164-E168 PolarHBondContact O-N 3.49Å; W164-R253 HydrophobicContact CE3-CG 4.22Å; W164-R253 HydrophobicContact CH2-CG 4.05Å; W164-R253 HydrophobicContact CZ2-CG 4.24Å; W164-R253 HydrophobicContact CZ3-CG 3.99Å
165	L	93.1	Very high	92.1	Very high	14 Å²	14	41.6 Å²	41.6	7%	0.073	21%	0.207	C	C	.	.	H	α-helix	trans	-57.4	-45.3	175.1	178.5	58.7	0	0	0	110.3	L113 F140 R161 P162 T169	L113-L165 HydrophobicContact CD2-CG 4.29Å; F140-L165 HydrophobicContact CB-CD1 4.32Å; R161-L165 PolarHBondContact O-N 2.87Å; P162-L165 PolarHBondContact O-N 3.1Å; L165-T169 VanDerWaalsContact O-CB 3.27Å; L165-T169 WeakPolarHBondContact O-CB 3.46Å; L165-T169 PolarHBondContact O-N 3.47Å; L165-T169 PolarHBondContact O-OG1 3.05Å
166	M	94.5	Very high	92	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.02	22%	0.223	C	C	.	.	H	α-helix	trans	-62.8	-49	175.6	-175.9	64.8	80	0	0	112.3	L113 P162 V163 W164 E168 T169 V170 L186 Y235 P261 W264 L265	L113-M166 HydrophobicContact CD1-CE 3.28Å; L113-M166 HydrophobicContact CD1-SD 3.9Å; P162-M166 PolarHBondContact O-N 2.85Å; V163-M166 PolarHBondContact O-N 2.89Å; W164-M166 VanDerWaalsContact C-N 3.27Å; W164-M166 PolarHBondContact O-N 3.06Å; M166-E168 PolarHBondContact O-N 3.24Å; M166-T169 WeakPolarHBondContact O-CB 3.45Å; M166-T169 PolarHBondContact O-N 3.49Å; M166-V170 HydrophobicContact CG-CG2 4.37Å; M166-V170 WeakPolarHBondContact O-CG2 2.94Å; M166-V170 PolarHBondContact O-N 3.26Å; M166-V170 HydrophobicContact SD-CG2 4.11Å; M166-L186 HydrophobicContact SD-CD1 4.11Å; M166-Y235 WeakPolarHBondContact CE-OH 3.48Å; M166-P261 HydrophobicContact CB-CB 3.83Å; M166-P261 HydrophobicContact CE-CB 4.11Å; M166-P261 HydrophobicContact CG-CB 4.34Å; M166-W264 HydrophobicContact CB-CE3 4.35Å; M166-W264 HydrophobicContact CB-CZ3 4.19Å; M166-W264 HydrophobicContact CG-CE3 4.03Å; M166-W264 HydrophobicContact CG-CZ3 3.8Å; M166-L265 HydrophobicContact CG-CB 4.42Å; M166-L265 HydrophobicContact CG-CD2 4.47Å; M166-L265 HydrophobicContact SD-CD2 4.2Å
167	Y	94.8	Very high	91.9	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-55.1	-50.7	178	164.9	-82.9	0	0	0	111.7	V163 W164 T169 V170 R171 L249 D250 R253 W264	V163-Y167 WeakPolarHBondContact O-CB 3.32Å; V163-Y167 PolarHBondContact O-N 3.07Å; W164-Y167 AromaticContact CE3-CD1 3.38Å; W164-Y167 HydrophobicContact CE3-CD1 3.38Å; W164-Y167 HydrophobicContact CE3-CE1 4.08Å; W164-Y167 AromaticContact CE3-CG 3.88Å; W164-Y167 HydrophobicContact CE3-CG 3.88Å; W164-Y167 HydrophobicContact CH2-CD1 4.44Å; W164-Y167 HydrophobicContact CH2-CE1 4.36Å; W164-Y167 AromaticContact CZ3-CD1 3.18Å; W164-Y167 HydrophobicContact CZ3-CD1 3.18Å; W164-Y167 AromaticContact CZ3-CE1 3.38Å; W164-Y167 HydrophobicContact CZ3-CE1 3.38Å; W164-Y167 AromaticContact CZ3-CG 3.92Å; W164-Y167 HydrophobicContact CZ3-CG 3.92Å; W164-Y167 PolarHBondContact O-N 3.43Å; Y167-T169 VanDerWaalsContact C-N 3.3Å; Y167-T169 PolarHBondContact O-N 3.33Å; Y167-V170 PolarHBondContact O-N 3.44Å; Y167-R171 VanDerWaalsContact O-CB 3.32Å; Y167-R171 WeakPolarHBondContact O-CB 3.28Å; Y167-R171 PolarHBondContact O-N 3.38Å; Y167-L249 HydrophobicContact CD2-CB 4.08Å; Y167-L249 HydrophobicContact CE2-CB 3.73Å; Y167-L249 WeakPolarHBondContact CE2-O 3.21Å; Y167-D250 PolarHBondContact OH-OD1 3.05Å; Y167-R253 HydrophobicContact CD2-CB 3.81Å; Y167-R253 HydrophobicContact CD2-CG 4.26Å; Y167-R253 HydrophobicContact CE2-CB 3.96Å; Y167-R253 HydrophobicContact CE2-CG 4.48Å; Y167-R253 PolarHBondContact OH-NH1 2.91Å; Y167-R253 VanDerWaalsContact OH-NH1 3.08Å; Y167-W264 HydrophobicContact CD2-CH2 4.03Å; Y167-W264 HydrophobicContact CD2-CZ2 4.2Å; Y167-W264 HydrophobicContact CG-CH2 4.26Å
168	E	94.6	Very high	91.6	Very high	48 Å²	48	43.8 Å²	43.8	22%	0.224	21%	0.211	C	C	.	.	H	α-helix	trans	-68.7	-33.7	-177.6	-75.8	-62.2	162.2	0	0	111	H157 W164 M166 R171 H172	H157-E168 HydrophobicContact CB-CB 3.93Å; H157-E168 HydrophobicContact CB-CG 4.3Å; H157-E168 PolarHBondContact CE1-O 3.01Å; H157-E168 WeakPolarHBondContact ND1-CB 3.33Å; W164-E168 HydrophobicContact CE3-CG 4.38Å; W164-E168 HydrophobicContact CZ3-CG 4.49Å; W164-E168 PolarHBondContact O-N 3.49Å; M166-E168 PolarHBondContact O-N 3.24Å; E168-R171 IonicContact OE1-NH1 2.8Å; E168-H172 WeakPolarHBondContact O-CB 3.48Å; E168-H172 PolarHBondContact O-N 2.05Å
169	T	95.4	Very high	91.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62	-52.7	174.2	-60.9	0	0	0	0	111	L113 F140 L165 M166 Y167 R171 H172 L173 L186	L113-T169 HydrophobicContact CD2-CG2 3.9Å; L113-T169 WeakPolarHBondContact CD2-OG1 3.41Å; F140-T169 HydrophobicContact CB-CG2 4.3Å; F140-T169 WeakPolarHBondContact CB-OG1 3.37Å; F140-T169 HydrophobicContact CD1-CG2 3.91Å; F140-T169 HydrophobicContact CD2-CG2 3.53Å; F140-T169 HydrophobicContact CE1-CG2 4.04Å; F140-T169 HydrophobicContact CE2-CG2 3.7Å; F140-T169 HydrophobicContact CG-CG2 3.64Å; F140-T169 HydrophobicContact CZ-CG2 3.95Å; L165-T169 VanDerWaalsContact O-CB 3.27Å; L165-T169 WeakPolarHBondContact O-CB 3.46Å; L165-T169 PolarHBondContact O-N 3.47Å; L165-T169 PolarHBondContact O-OG1 3.05Å; M166-T169 WeakPolarHBondContact O-CB 3.45Å; M166-T169 PolarHBondContact O-N 3.49Å; Y167-T169 VanDerWaalsContact C-N 3.3Å; Y167-T169 PolarHBondContact O-N 3.33Å; T169-R171 VanDerWaalsContact C-N 3.32Å; T169-R171 PolarHBondContact O-N 3.43Å; T169-H172 PolarHBondContact O-N 3.23Å; T169-L173 HydrophobicContact CG2-CD1 4.19Å; T169-L173 HydrophobicContact CG2-CG 4.44Å; T169-L173 WeakPolarHBondContact O-CG 3.36Å; T169-L173 PolarHBondContact O-N 3.1Å; T169-L186 HydrophobicContact CG2-CD2 4Å
170	V	95.9	Very high	91.6	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.3	-42.7	-179.9	175	0	0	0	0	110.7	M166 Y167 L173 H174 L186 L242 L245 L249 L265	M166-V170 HydrophobicContact CG-CG2 4.37Å; M166-V170 WeakPolarHBondContact O-CG2 2.94Å; M166-V170 PolarHBondContact O-N 3.26Å; M166-V170 HydrophobicContact SD-CG2 4.11Å; Y167-V170 PolarHBondContact O-N 3.44Å; V170-L173 PolarHBondContact O-N 3.01Å; V170-H174 PolarHBondContact O-N 3.49Å; V170-H174 VanDerWaalsContact O-N 3.12Å; V170-L186 HydrophobicContact CG2-CD1 4.08Å; V170-L242 HydrophobicContact CG1-CD1 3.42Å; V170-L242 VanDerWaalsContact CG1-CD1 3.42Å; V170-L245 HydrophobicContact CG1-CD2 4.38Å; V170-L249 HydrophobicContact CG1-CD1 3.93Å; V170-L249 HydrophobicContact CG1-CD2 4.1Å; V170-L265 HydrophobicContact CG2-CD1 4.21Å; V170-L265 HydrophobicContact CG2-CD2 4.16Å
171	R	94.9	Very high	92.1	Very high	80 Å²	80	46 Å²	46	30%	0.302	22%	0.22	S	C	.	.	H	α-helix	trans	-61	-46.4	175	-178.4	-178.5	179.5	-175.4	6.5	112	Y167 E168 T169 H174 Q175 L249	Y167-R171 VanDerWaalsContact O-CB 3.32Å; Y167-R171 WeakPolarHBondContact O-CB 3.28Å; Y167-R171 PolarHBondContact O-N 3.38Å; E168-R171 IonicContact OE1-NH1 2.8Å; T169-R171 VanDerWaalsContact C-N 3.32Å; T169-R171 PolarHBondContact O-N 3.43Å; R171-H174 PolarHBondContact O-N 2.92Å; R171-Q175 HydrophobicContact CG-CG 4.44Å; R171-Q175 WeakPolarHBondContact O-CB 3.03Å; R171-Q175 VanDerWaalsContact O-CG 3.29Å; R171-Q175 WeakPolarHBondContact O-CG 3.34Å; R171-Q175 PolarHBondContact O-N 3.05Å; R171-L249 HydrophobicContact CB-CD1 4.44Å
172	H	94.8	Very high	92.1	Very high	32 Å²	32	40 Å²	40	15%	0.148	20%	0.2	C	C	.	.	H	α-helix	trans	-63.8	-45.1	179.8	-176.7	88.4	0	0	0	111.8	F140 I155 E168 T169 H174 Q175 H176 Y177	F140-H172 AromaticContact CE1-CD2 3.84Å; I155-H172 WeakPolarHBondContact CD1-NE2 3.06Å; E168-H172 WeakPolarHBondContact O-CB 3.48Å; E168-H172 PolarHBondContact O-N 2.05Å; T169-H172 PolarHBondContact O-N 3.23Å; H172-H174 VanDerWaalsContact C-N 3.31Å; H172-H174 PolarHBondContact O-N 2.03Å; H172-Q175 PolarHBondContact O-N 2.96Å; H172-H176 AromaticContact CE1-CD2 3.18Å; H172-H176 PolarHBondContact CE1-CD2 2.88Å; H172-H176 AromaticContact CE1-CG 3.83Å; H172-H176 AromaticContact CE1-NE2 3.54Å; H172-H176 AromaticContact CG-CD2 3.76Å; H172-H176 AromaticContact ND1-CD2 3.22Å; H172-H176 PolarHBondContact ND1-CD2 3.46Å; H172-H176 AromaticContact ND1-NE2 3.56Å; H172-H176 AromaticContact NE2-CD2 3.7Å; H172-H176 PolarHBondContact O-CD2 2.93Å; H172-H176 PolarHBondContact O-N 2.87Å; H172-Y177 AromaticContact NE2-CE2 3.7Å
173	L	94.9	Very high	92.3	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.01	18%	0.179	C	C	.	.	I	π-helix	trans	-57.5	-44.6	176.4	-72.8	179.8	0	0	0	111.8	L109 F140 T169 V170 Y177 G178 F184 L186 L242	L109-L173 HydrophobicContact CD1-CD2 4.25Å; L109-L173 HydrophobicContact CD2-CD2 3.49Å; L109-L173 VanDerWaalsContact CD2-CD2 3.49Å; F140-L173 HydrophobicContact CE2-CD2 4.28Å; F140-L173 HydrophobicContact CZ-CD2 3.77Å; F140-L173 HydrophobicContact CZ-CG 4.15Å; T169-L173 HydrophobicContact CG2-CD1 4.19Å; T169-L173 HydrophobicContact CG2-CG 4.44Å; T169-L173 WeakPolarHBondContact O-CG 3.36Å; T169-L173 PolarHBondContact O-N 3.1Å; V170-L173 PolarHBondContact O-N 3.01Å; L173-Y177 HydrophobicContact CD2-CD2 4.21Å; L173-Y177 CarbonylContact O-C 3.53Å; L173-Y177 WeakPolarHBondContact O-CA 3.08Å; L173-Y177 WeakPolarHBondContact O-CB 3.5Å; L173-Y177 PolarHBondContact O-N 2.84Å; L173-G178 PolarHBondContact O-N 3.36Å; L173-F184 HydrophobicContact CB-CD1 4.14Å; L173-F184 HydrophobicContact CB-CE1 4.31Å; L173-F184 HydrophobicContact CD1-CD1 4.19Å; L173-F184 HydrophobicContact CD2-CD1 4.21Å; L173-F184 HydrophobicContact CG-CD1 4.42Å; L173-L186 HydrophobicContact CD1-CD2 3.65Å; L173-L186 HydrophobicContact CD1-CG 4.37Å; L173-L242 HydrophobicContact CB-CD2 4.21Å
174	H	93.8	Very high	92.5	Very high	47 Å²	47	36.4 Å²	36.4	22%	0.218	18%	0.176	C	C	.	.	I	π-helix	trans	-63.2	-51.2	176.4	178.1	77	0	0	0	112.1	V170 R171 H172 H176 G178 L242	V170-H174 PolarHBondContact O-N 3.49Å; V170-H174 VanDerWaalsContact O-N 3.12Å; R171-H174 PolarHBondContact O-N 2.92Å; H172-H174 VanDerWaalsContact C-N 3.31Å; H172-H174 PolarHBondContact O-N 2.03Å; H174-H176 PolarHBondContact O-N 3.39Å; H174-G178 WeakPolarHBondContact O-CA 3.02Å; H174-G178 PolarHBondContact O-N 2.95Å; H174-G178 VanDerWaalsContact O-N 3.12Å; H174-L242 HydrophobicContact CB-CD1 4.27Å; H174-L242 HydrophobicContact CB-CD2 4.04Å; H174-L242 HydrophobicContact CB-CG 3.89Å
175	Q	93.5	Very high	92.7	Very high	103 Å²	103	34 Å²	34	48%	0.481	17%	0.167	S	C	.	.	I	π-helix	trans	-66.9	-38.2	-171.9	-73.7	179.6	-15.7	0	0	113.4	R171 H172	R171-Q175 HydrophobicContact CG-CG 4.44Å; R171-Q175 WeakPolarHBondContact O-CB 3.03Å; R171-Q175 VanDerWaalsContact O-CG 3.29Å; R171-Q175 WeakPolarHBondContact O-CG 3.34Å; R171-Q175 PolarHBondContact O-N 3.05Å; H172-Q175 PolarHBondContact O-N 2.96Å
176	H	91.5	Very high	92.9	Very high	100 Å²	100	33.3 Å²	33.3	46%	0.463	16%	0.163	S	C	.	.	I	π-helix	trans	-99.2	-33.9	-174.5	-67.1	-80.6	0	0	0	113.1	H172 H174	H172-H176 AromaticContact CE1-CD2 3.18Å; H172-H176 PolarHBondContact CE1-CD2 2.88Å; H172-H176 AromaticContact CE1-CG 3.83Å; H172-H176 AromaticContact CE1-NE2 3.54Å; H172-H176 AromaticContact CG-CD2 3.76Å; H172-H176 AromaticContact ND1-CD2 3.22Å; H172-H176 PolarHBondContact ND1-CD2 3.46Å; H172-H176 AromaticContact ND1-NE2 3.56Å; H172-H176 AromaticContact NE2-CD2 3.7Å; H172-H176 PolarHBondContact O-CD2 2.93Å; H172-H176 PolarHBondContact O-N 2.87Å; H174-H176 PolarHBondContact O-N 3.39Å
177	Y	90.9	Very high	93	Very high	46 Å²	46	33.2 Å²	33.2	18%	0.18	16%	0.163	C	C	.	.	I	π-helix	trans	-123.6	-4.3	-169.1	-56.1	-67.6	0	0	0	113.9	L109 F138 H172 L173 S179 E180 Y181	L109-Y177 HydrophobicContact CD1-CD1 4.17Å; L109-Y177 HydrophobicContact CD1-CD2 4Å; L109-Y177 HydrophobicContact CD1-CG 3.69Å; F138-Y177 HydrophobicContact CD2-CE2 4.5Å; F138-Y177 HydrophobicContact CE1-CE2 4.33Å; F138-Y177 AromaticContact CE1-CZ 3.91Å; F138-Y177 VanDerWaalsContact CE1-OH 3.29Å; F138-Y177 WeakPolarHBondContact CE1-OH 3.41Å; F138-Y177 HydrophobicContact CE2-CD2 4.46Å; F138-Y177 HydrophobicContact CE2-CE1 4.11Å; F138-Y177 AromaticContact CE2-CE2 3.96Å; F138-Y177 HydrophobicContact CE2-CE2 3.96Å; F138-Y177 AromaticContact CE2-CZ 3.76Å; F138-Y177 AromaticContact CZ-CE1 3.79Å; F138-Y177 HydrophobicContact CZ-CE1 3.79Å; F138-Y177 AromaticContact CZ-CE2 3.87Å; F138-Y177 HydrophobicContact CZ-CE2 3.87Å; F138-Y177 AromaticContact CZ-CZ 3.31Å; F138-Y177 WeakPolarHBondContact CZ-OH 3.38Å; H172-Y177 AromaticContact NE2-CE2 3.7Å; L173-Y177 HydrophobicContact CD2-CD2 4.21Å; L173-Y177 CarbonylContact O-C 3.53Å; L173-Y177 WeakPolarHBondContact O-CA 3.08Å; L173-Y177 WeakPolarHBondContact O-CB 3.5Å; L173-Y177 PolarHBondContact O-N 2.84Å; Y177-S179 PolarHBondContact O-N 3.31Å; Y177-E180 PolarHBondContact O-N 3.17Å; Y177-Y181 HydrophobicContact CD1-CE2 4.04Å; Y177-Y181 PolarHBondContact O-N 2.99Å
178	G	86.3	Confident	93	Very high	13 Å²	13	35.9 Å²	35.9	13%	0.134	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-13.5	-177.7	0	0	0	0	0	115.5	L173 H174 R239	L173-G178 PolarHBondContact O-N 3.36Å; H174-G178 WeakPolarHBondContact O-CA 3.02Å; H174-G178 PolarHBondContact O-N 2.95Å; H174-G178 VanDerWaalsContact O-N 3.12Å; G178-R239 WeakPolarHBondContact O-CD 3.27Å; G178-R239 WeakPolarHBondContact O-CG 3.35Å
179	S	84.4	Confident	93	Very high	83 Å²	83	34.4 Å²	34.4	58%	0.58	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.2	-15.7	176.3	70.2	0	0	0	0	114.2	R105 Y177	R105-S179 PolarHBondContact NE-O 2.84Å; Y177-S179 PolarHBondContact O-N 3.31Å
180	E	86	Confident	93	Very high	98 Å²	98	36.2 Å²	36.2	46%	0.458	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-30.2	-173.1	-65.4	-178.8	-164.4	0	0	112.5	R105 E106 Y177	R105-E180 VanDerWaalsContact CB-O 3.28Å; R105-E180 WeakPolarHBondContact CB-O 3.46Å; E106-E180 PolarHBondContact N-O 3.13Å; Y177-E180 PolarHBondContact O-N 3.17Å
181	Y	90.6	Very high	93	Very high	8 Å²	8	36.2 Å²	36.2	3%	0.031	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	144.2	-175.8	-62.1	-96.7	0	0	0	112.7	E106 L109 R136 Y177 R239	E106-Y181 HydrophobicContact CB-CD1 3.67Å; E106-Y181 HydrophobicContact CB-CE1 3.49Å; E106-Y181 VanDerWaalsContact CB-CE1 3.49Å; E106-Y181 HydrophobicContact CG-CE1 4.38Å; E106-Y181 VanDerWaalsContact O-CA 3.29Å; E106-Y181 WeakPolarHBondContact O-CA 3.37Å; E106-Y181 WeakPolarHBondContact OE2-CE1 3.44Å; E106-Y181 PolarHBondContact OE2-OH 2.95Å; E106-Y181 VanDerWaalsContact OE2-OH 3.07Å; L109-Y181 HydrophobicContact CB-CD1 3.65Å; L109-Y181 HydrophobicContact CB-CD2 4.2Å; L109-Y181 HydrophobicContact CB-CE1 3.98Å; L109-Y181 HydrophobicContact CB-CG 3.76Å; L109-Y181 HydrophobicContact CD1-CD2 3.77Å; L109-Y181 HydrophobicContact CD1-CE2 3.78Å; L109-Y181 HydrophobicContact CD1-CG 4.2Å; R136-Y181 WeakPolarHBondContact CG-OH 3.31Å; Y177-Y181 HydrophobicContact CD1-CE2 4.04Å; Y177-Y181 PolarHBondContact O-N 2.99Å; Y181-R239 VanDerWaalsContact O-CD 3.31Å; Y181-R239 WeakPolarHBondContact O-CD 3.5Å
182	D	90.8	Very high	93.2	Very high	26 Å²	26	32.5 Å²	32.5	14%	0.139	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-30.7	176.7	-69.8	-38.2	0	0	0	113	R105 E106 A207 R239	R105-D182 VanDerWaalsContact CD-OD1 3.3Å; R105-D182 WeakPolarHBondContact CD-OD1 3.35Å; R105-D182 IonicContact NH1-OD1 3.58Å; E106-D182 PolarHBondContact O-N 3.35Å; D182-A207 HydrophobicContact CB-CB 3.8Å; D182-R239 VanDerWaalsContact O-CB 3.3Å; D182-R239 WeakPolarHBondContact O-CB 3.19Å; D182-R239 PolarHBondContact O-N 2.81Å; D182-R239 IonicContact OD1-NE 2.67Å
183	W	93.7	Very high	93.3	Very high	5 Å²	5	31.1 Å²	31.1	2%	0.019	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	144.4	-176.4	-61	87.9	0	0	0	112.8	R107 L108 L109 V202 L205 L211 L236	R107-W183 VanDerWaalsContact O-CB 3.3Å; R107-W183 WeakPolarHBondContact O-CB 3.49Å; R107-W183 PolarHBondContact O-N 2.97Å; L108-W183 WeakPolarHBondContact CA-O 3.49Å; L108-W183 HydrophobicContact CD1-CB 3.97Å; L109-W183 PolarHBondContact N-O 2.99Å; W183-V202 HydrophobicContact CB-CG1 3.88Å; W183-V202 HydrophobicContact CB-CG2 4.3Å; W183-V202 HydrophobicContact CD2-CG1 4.21Å; W183-V202 HydrophobicContact CG-CB 4.49Å; W183-V202 HydrophobicContact CG-CG1 3.46Å; W183-V202 VanDerWaalsContact CG-CG1 3.46Å; W183-V202 HydrophobicContact CG-CG2 4.26Å; W183-L205 HydrophobicContact CH2-CB 3.92Å; W183-L205 HydrophobicContact CH2-CD1 4.12Å; W183-L205 HydrophobicContact CZ2-CB 3.44Å; W183-L205 VanDerWaalsContact CZ2-CB 3.44Å; W183-L205 HydrophobicContact CZ2-CD1 4.3Å; W183-L205 HydrophobicContact CZ2-CG 4.5Å; W183-L205 HydrophobicContact CZ3-CD1 4.36Å; W183-L211 HydrophobicContact CH2-CB 3.79Å; W183-L211 HydrophobicContact CH2-CD2 3.47Å; W183-L211 VanDerWaalsContact CH2-CD2 3.47Å; W183-L211 HydrophobicContact CH2-CG 4.19Å; W183-L211 HydrophobicContact CZ3-CB 3.81Å; W183-L211 HydrophobicContact CZ3-CD2 3.63Å; W183-L211 HydrophobicContact CZ3-CG 4.1Å; W183-L236 HydrophobicContact CE3-CB 4.43Å
184	F	95.5	Very high	93.3	Very high	1 Å²	1	31.7 Å²	31.7	0%	0.004	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	115.1	178.5	-57.9	-91.3	0	0	0	109.2	L109 L173 L236 L237 R239 L242	L109-F184 HydrophobicContact CB-CD1 4.24Å; L109-F184 HydrophobicContact CD1-CE1 4.35Å; L109-F184 HydrophobicContact CD2-CD1 4.24Å; L173-F184 HydrophobicContact CB-CD1 4.14Å; L173-F184 HydrophobicContact CB-CE1 4.31Å; L173-F184 HydrophobicContact CD1-CD1 4.19Å; L173-F184 HydrophobicContact CD2-CD1 4.21Å; L173-F184 HydrophobicContact CG-CD1 4.42Å; F184-L236 WeakPolarHBondContact O-CA 3.27Å; F184-L237 HydrophobicContact CB-CB 4.39Å; F184-L237 PolarHBondContact N-O 2.88Å; F184-L237 PolarHBondContact O-N 3.11Å; F184-R239 HydrophobicContact CE2-CB 4.1Å; F184-R239 HydrophobicContact CE2-CG 4.41Å; F184-L242 HydrophobicContact CD1-CD2 4.33Å; F184-L242 HydrophobicContact CD2-CD2 3.78Å; F184-L242 HydrophobicContact CE1-CD2 4.26Å; F184-L242 HydrophobicContact CE2-CD2 3.72Å; F184-L242 HydrophobicContact CG-CD2 4.11Å; F184-L242 HydrophobicContact CZ-CD2 3.99Å
185	L	96.8	Very high	93.3	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	119.8	171.3	175.2	71.2	0	0	0	108.7	L108 L109 A110 G111 F134 M193 L198 Y235 L236	L108-L185 HydrophobicContact CD1-CB 3.8Å; L109-L185 PolarHBondContact O-N 2.85Å; A110-L185 HydrophobicContact CB-CD2 4.4Å; G111-L185 PolarHBondContact N-O 3.35Å; F134-L185 HydrophobicContact CE2-CD2 4.37Å; F134-L185 HydrophobicContact CZ-CD2 3.93Å; L185-M193 HydrophobicContact CD2-SD 3.79Å; L185-L198 HydrophobicContact CD2-CD1 3.81Å; L185-Y235 WeakPolarHBondContact CA-O 3.4Å; L185-L236 HydrophobicContact CB-CD2 3.88Å; L185-L236 HydrophobicContact CD1-CD2 3.89Å; L185-L236 HydrophobicContact CD1-CG 4.37Å; L185-L236 HydrophobicContact CG-CD2 4.49Å
186	L	97.2	Very high	93.3	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	128.5	171	-71.1	179.4	0	0	0	109.6	G111 M166 T169 V170 L173 G234 Y235 L237	G111-L186 WeakPolarHBondContact O-CA 2.92Å; M166-L186 HydrophobicContact SD-CD1 4.11Å; T169-L186 HydrophobicContact CG2-CD2 4Å; V170-L186 HydrophobicContact CG2-CD1 4.08Å; L173-L186 HydrophobicContact CD1-CD2 3.65Å; L173-L186 HydrophobicContact CD1-CG 4.37Å; L186-G234 CarbonylContact O-C 3.08Å; L186-G234 WeakPolarHBondContact O-CA 3.24Å; L186-Y235 HydrophobicContact CB-CD2 4.31Å; L186-Y235 HydrophobicContact CB-CE1 4.41Å; L186-Y235 HydrophobicContact CB-CE2 3.76Å; L186-Y235 HydrophobicContact CD1-CE2 3.9Å; L186-Y235 HydrophobicContact CG-CE2 4.34Å; L186-Y235 PolarHBondContact N-O 3.41Å; L186-Y235 PolarHBondContact O-N 3.25Å; L186-L237 HydrophobicContact CD1-CD1 3.8Å
187	A	96.1	Very high	93.4	Very high	2 Å²	2	22.3 Å²	22.3	2%	0.017	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	166.6	178.2	0	0	0	0	0	111.5	G111 V112 L113 M193	G111-A187 PolarHBondContact O-N 3.33Å; V112-A187 CarbonylContact C-O 3.57Å; V112-A187 WeakPolarHBondContact CA-O 3.44Å; L113-A187 PolarHBondContact N-O 2.93Å; A187-M193 HydrophobicContact CB-CE 4.29Å; A187-M193 HydrophobicContact CB-SD 3.65Å
188	Q	95.1	Very high	93.6	Very high	58 Å²	58	20.1 Å²	20.1	27%	0.271	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	160.5	172.7	-64.2	-176	-72.2	0	0	110.6	D190 T191 G232	Q188-D190 WeakPolarHBondContact CB-OD1 3.33Å; Q188-D190 PolarHBondContact O-N 2.83Å; Q188-T191 VanDerWaalsContact O-CB 3.28Å; Q188-T191 WeakPolarHBondContact O-CB 3.29Å; Q188-T191 PolarHBondContact O-N 3.11Å; Q188-T191 PolarHBondContact O-OG1 3.22Å; Q188-T191 VanDerWaalsContact O-OG1 3.14Å; Q188-G232 VanDerWaalsContact OE1-CA 3.22Å; Q188-G232 VanDerWaalsContact OE1-N 3.15Å
189	D	94.9	Very high	93.9	Very high	16 Å²	16	21.7 Å²	21.7	9%	0.086	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-9.6	180	58.6	-0.1	0	0	0	114.4	V112 L113 T114 T118 L122 A123 T191	V112-D189 HydrophobicContact CG1-CB 4.01Å; L113-D189 PolarHBondContact O-N 2.92Å; L113-D189 VanDerWaalsContact O-N 3.14Å; T114-D189 VanDerWaalsContact CA-OD2 3.29Å; T114-D189 WeakPolarHBondContact CA-OD2 3.48Å; T114-D189 WeakPolarHBondContact CB-OD2 3.29Å; T114-D189 PolarHBondContact OG1-OD2 2.84Å; T118-D189 WeakPolarHBondContact CB-OD2 3.47Å; T118-D189 PolarHBondContact OG1-OD2 2.81Å; L122-D189 HydrophobicContact CB-CB 4.32Å; L122-D189 WeakPolarHBondContact CB-O 3.47Å; A123-D189 HydrophobicContact CB-CB 4.37Å; D189-T191 VanDerWaalsContact C-N 3.32Å
190	D	95.7	Very high	94.2	Very high	39 Å²	39	23.7 Å²	23.7	21%	0.209	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	12.5	169.4	71	-15.3	0	0	0	113.4	L122 Q188 H312 V314	L122-D190 HydrophobicContact CD1-CB 4.5Å; Q188-D190 WeakPolarHBondContact CB-OD1 3.33Å; Q188-D190 PolarHBondContact O-N 2.83Å; D190-H312 VanDerWaalsContact CG-NE2 3.34Å; D190-H312 IonicContact OD1-CD2 3.12Å; D190-H312 PolarHBondContact OD1-CD2 2.86Å; D190-H312 IonicContact OD1-NE2 3.97Å; D190-H312 PolarHBondContact OD1-NE2 3.2Å; D190-H312 IonicContact OD2-CD2 3.77Å; D190-H312 IonicContact OD2-CE1 2.65Å; D190-H312 IonicContact OD2-NE2 3.5Å; D190-H312 PolarHBondContact OD2-NE2 3.1Å; D190-V314 VanDerWaalsContact O-CB 3.3Å; D190-V314 WeakPolarHBondContact O-CB 3.31Å; D190-V314 WeakPolarHBondContact O-CG2 3.41Å; D190-V314 PolarHBondContact O-N 3.29Å
191	T	96.7	Very high	94.6	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.106	C	C	.	.			trans	-106.4	121.3	179.3	-46.8	0	0	0	0	110.6	Q188 D189 M193 G232 T310	Q188-T191 VanDerWaalsContact O-CB 3.28Å; Q188-T191 WeakPolarHBondContact O-CB 3.29Å; Q188-T191 PolarHBondContact O-N 3.11Å; Q188-T191 PolarHBondContact O-OG1 3.22Å; Q188-T191 VanDerWaalsContact O-OG1 3.14Å; D189-T191 VanDerWaalsContact C-N 3.32Å; T191-M193 HydrophobicContact CG2-CG 4.13Å; T191-G232 VanDerWaalsContact CG2-O 3.22Å; T191-G232 WeakPolarHBondContact CG2-O 3.48Å; T191-G232 PolarHBondContact OG1-O 3.12Å; T191-T310 HydrophobicContact CG2-CG2 4.39Å
192	Y	97.1	Very high	94.6	Very high	1 Å²	1	18.8 Å²	18.8	0%	0.004	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	134.2	165.8	174.1	-97.5	0	0	0	109.6	Q194 T310 V311 M320 L323 H324 F327	Y192-Q194 HydrophobicContact CE1-CB 4.49Å; Y192-T310 CarbonylContact O-C 3.5Å; Y192-T310 WeakPolarHBondContact O-CA 3.43Å; Y192-V311 HydrophobicContact CD1-CB 4.29Å; Y192-V311 HydrophobicContact CD1-CG2 4.11Å; Y192-V311 PolarHBondContact N-O 3.39Å; Y192-V311 PolarHBondContact O-N 3.21Å; Y192-M320 HydrophobicContact CD2-SD 3.68Å; Y192-M320 HydrophobicContact CG-SD 4.2Å; Y192-L323 HydrophobicContact CD1-CB 4.19Å; Y192-L323 HydrophobicContact CD2-CB 3.94Å; Y192-L323 HydrophobicContact CE2-CB 4.29Å; Y192-L323 HydrophobicContact CG-CB 3.91Å; Y192-L323 HydrophobicContact CG-CD1 4.21Å; Y192-H324 HydrophobicContact CE2-CB 3.7Å; Y192-H324 AromaticContact CE2-ND1 3.95Å; Y192-H324 WeakPolarHBondContact OH-CA 3.41Å; Y192-H324 PolarHBondContact OH-ND1 2.93Å; Y192-F327 HydrophobicContact CD1-CD2 4.15Å; Y192-F327 HydrophobicContact CD1-CE2 4.18Å; Y192-F327 HydrophobicContact CE1-CB 4.12Å; Y192-F327 HydrophobicContact CE1-CD1 4.32Å; Y192-F327 AromaticContact CE1-CD2 3.44Å; Y192-F327 HydrophobicContact CE1-CD2 3.44Å; Y192-F327 VanDerWaalsContact CE1-CD2 3.44Å; Y192-F327 AromaticContact CE1-CE2 3.87Å; Y192-F327 HydrophobicContact CE1-CE2 3.87Å; Y192-F327 AromaticContact CE1-CG 3.7Å; Y192-F327 HydrophobicContact CE1-CG 3.7Å; Y192-F327 HydrophobicContact CE1-CZ 4.47Å; Y192-F327 WeakPolarHBondContact OH-CB 3.49Å
193	M	96.8	Very high	94.5	Very high	3 Å²	3	19 Å²	19	2%	0.015	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	128.8	-178.8	-62	174.9	-78.3	0	0	110.1	V112 V126 V130 L185 A187 T191 A195 L198 T310	V112-M193 HydrophobicContact CG2-CE 4Å; V126-M193 HydrophobicContact CG1-CE 3.67Å; V130-M193 HydrophobicContact CG1-CB 4.18Å; V130-M193 HydrophobicContact CG1-CE 4.34Å; V130-M193 HydrophobicContact CG2-CE 4.41Å; L185-M193 HydrophobicContact CD2-SD 3.79Å; A187-M193 HydrophobicContact CB-CE 4.29Å; A187-M193 HydrophobicContact CB-SD 3.65Å; T191-M193 HydrophobicContact CG2-CG 4.13Å; M193-A195 PolarHBondContact O-N 3.28Å; M193-L198 HydrophobicContact CB-CD1 3.99Å; M193-L198 HydrophobicContact CG-CD1 4.42Å; M193-T310 HydrophobicContact CG-CG2 4.03Å
194	Q	96.1	Very high	94.3	Very high	14 Å²	14	24.1 Å²	24.1	7%	0.065	14%	0.137	C	C	.	.			trans	-88.4	94.7	163.5	176.1	42.2	-68.5	0	0	109.3	Y192 G196 R197 L198 F309	Y192-Q194 HydrophobicContact CE1-CB 4.49Å; Q194-G196 VanDerWaalsContact C-N 3.34Å; Q194-G196 PolarHBondContact O-N 2.72Å; Q194-R197 HydrophobicContact CG-CB 4.15Å; Q194-R197 HydrophobicContact CG-CG 3.77Å; Q194-R197 PolarHBondContact O-N 3.31Å; Q194-L198 PolarHBondContact O-N 2.8Å; Q194-F309 PolarHBondContact N-O 3.35Å
195	A	93.6	Very high	94	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-52.9	-41.2	-179.7	0	0	0	0	0	114.8	V130 H133 F134 M193 R197 L198 S199	V130-A195 HydrophobicContact CB-CB 4.43Å; H133-A195 HydrophobicContact CB-CB 3.39Å; F134-A195 HydrophobicContact CD1-CB 3.97Å; F134-A195 HydrophobicContact CD2-CB 4.07Å; F134-A195 HydrophobicContact CE1-CB 3.56Å; F134-A195 HydrophobicContact CE2-CB 3.69Å; F134-A195 HydrophobicContact CG-CB 4.21Å; F134-A195 VanDerWaalsContact CZ-CA 3.45Å; F134-A195 HydrophobicContact CZ-CB 3.43Å; F134-A195 VanDerWaalsContact CZ-CB 3.43Å; M193-A195 PolarHBondContact O-N 3.28Å; A195-R197 PolarHBondContact O-N 2.78Å; A195-L198 PolarHBondContact O-N 3.26Å; A195-S199 WeakPolarHBondContact O-CB 3.42Å; A195-S199 PolarHBondContact O-N 3.29Å; A195-S199 PolarHBondContact O-OG 2.91Å; A195-S199 VanDerWaalsContact O-OG 3.14Å
196	G	92.9	Very high	93.5	Very high	37 Å²	37	27.1 Å²	27.1	38%	0.381	16%	0.158	S	C	.	.	H	α-helix	trans	-59.9	-45.9	-179	0	0	0	0	0	112.8	Q194 S199 E200	Q194-G196 VanDerWaalsContact C-N 3.34Å; Q194-G196 PolarHBondContact O-N 2.72Å; G196-S199 PolarHBondContact O-N 2.9Å; G196-E200 PolarHBondContact O-N 3.35Å
197	R	93.9	Very high	92.4	Very high	16 Å²	16	28.6 Å²	28.6	6%	0.06	17%	0.17	C	C	.	.	H	α-helix	trans	-68.5	-36.3	178.6	-66.2	-179.6	-172.5	-174.8	-0.5	112.7	Q194 A195 E200 L201 K306 N307 A308 F309 E331	Q194-R197 HydrophobicContact CG-CB 4.15Å; Q194-R197 HydrophobicContact CG-CG 3.77Å; Q194-R197 PolarHBondContact O-N 3.31Å; A195-R197 PolarHBondContact O-N 2.78Å; R197-E200 PolarHBondContact O-N 3.31Å; R197-L201 WeakPolarHBondContact O-CB 3.33Å; R197-L201 PolarHBondContact O-N 3.01Å; R197-K306 PolarHBondContact NH1-O 2.85Å; R197-K306 PolarHBondContact NH2-O 3.04Å; R197-N307 VanDerWaalsContact NH1-CA 3.31Å; R197-N307 PolarHBondContact NH1-O 3.11Å; R197-A308 PolarHBondContact NH1-O 3.34Å; R197-F309 HydrophobicContact CB-CD1 3.6Å; R197-F309 HydrophobicContact CB-CE1 3.96Å; R197-F309 HydrophobicContact CB-CG 4.41Å; R197-F309 HydrophobicContact CG-CD1 4.31Å; R197-E331 IonicContact CZ-OE1 3.45Å; R197-E331 IonicContact NE-OE1 2.83Å; R197-E331 PolarHBondContact NE-OE1 3.16Å; R197-E331 IonicContact NH2-OE1 3.45Å; R197-E331 PolarHBondContact NH2-OE1 3.02Å
198	L	94.8	Very high	91.4	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-66.9	-40.5	176.2	-73.5	163.1	0	0	0	111.4	L108 F134 L185 M193 Q194 A195 L201 V202 Y286 F309 T310	L108-L198 HydrophobicContact CD2-CB 4.48Å; F134-L198 HydrophobicContact CE1-CB 4.39Å; F134-L198 HydrophobicContact CZ-CB 4.42Å; F134-L198 HydrophobicContact CZ-CD1 4.11Å; L185-L198 HydrophobicContact CD2-CD1 3.81Å; M193-L198 HydrophobicContact CB-CD1 3.99Å; M193-L198 HydrophobicContact CG-CD1 4.42Å; Q194-L198 PolarHBondContact O-N 2.8Å; A195-L198 PolarHBondContact O-N 3.26Å; L198-L201 PolarHBondContact O-N 3.07Å; L198-V202 WeakPolarHBondContact O-CG2 3.35Å; L198-V202 PolarHBondContact O-N 3.15Å; L198-Y286 HydrophobicContact CD2-CE2 4.03Å; L198-F309 HydrophobicContact CD2-CB 3.94Å; L198-F309 HydrophobicContact CD2-CD2 4.48Å; L198-F309 HydrophobicContact CG-CB 4.15Å; L198-T310 HydrophobicContact CD1-CG2 4.31Å
199	S	92.8	Very high	90.9	Very high	46 Å²	46	32.9 Å²	32.9	32%	0.322	21%	0.207	S	C	.	.	H	α-helix	trans	-64.9	-39.8	174	-65.3	0	0	0	0	112.3	A195 G196 G203	A195-S199 WeakPolarHBondContact O-CB 3.42Å; A195-S199 PolarHBondContact O-N 3.29Å; A195-S199 PolarHBondContact O-OG 2.91Å; A195-S199 VanDerWaalsContact O-OG 3.14Å; G196-S199 PolarHBondContact O-N 2.9Å; S199-G203 PolarHBondContact O-N 3.5Å
200	E	91.7	Very high	90.8	Very high	124 Å²	124	34.6 Å²	34.6	58%	0.579	22%	0.217	S	C	*	.	H	α-helix	trans	-64.4	-46.6	174.2	-173.6	-178.8	-177	0	0	111.5	G196 R197 V202 G203 H204	G196-E200 PolarHBondContact O-N 3.35Å; R197-E200 PolarHBondContact O-N 3.31Å; E200-V202 PolarHBondContact O-N 3.04Å; E200-G203 WeakPolarHBondContact O-CA 3.43Å; E200-G203 PolarHBondContact O-N 3.15Å; E200-H204 PolarHBondContact O-CD2 3.11Å; E200-H204 VanDerWaalsContact O-CD2 3.22Å; E200-H204 PolarHBondContact O-N 2.81Å
201	L	93.1	Very high	90.7	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-52.7	-54.9	174.7	172.3	66.7	0	0	0	110.7	R197 L198 G203 H204 L205 M213 L236 M284 Y286 F309	R197-L201 WeakPolarHBondContact O-CB 3.33Å; R197-L201 PolarHBondContact O-N 3.01Å; L198-L201 PolarHBondContact O-N 3.07Å; L201-G203 PolarHBondContact O-N 3.41Å; L201-H204 PolarHBondContact O-N 2.88Å; L201-H204 VanDerWaalsContact O-N 3.09Å; L201-L205 HydrophobicContact CD1-CD1 4.48Å; L201-L205 HydrophobicContact CG-CD1 4.23Å; L201-L205 WeakPolarHBondContact O-CG 3.46Å; L201-L205 PolarHBondContact O-N 3.19Å; L201-M213 HydrophobicContact CD1-CE 4.3Å; L201-L236 HydrophobicContact CD2-CD1 3.81Å; L201-L236 HydrophobicContact CG-CD1 4.49Å; L201-M284 HydrophobicContact CD1-CB 3.57Å; L201-M284 HydrophobicContact CD1-CE 3.85Å; L201-M284 HydrophobicContact CD1-CG 4.17Å; L201-Y286 HydrophobicContact CD2-CD2 3.94Å; L201-Y286 HydrophobicContact CD2-CE2 4.45Å; L201-F309 HydrophobicContact CB-CE2 4.36Å; L201-F309 HydrophobicContact CD1-CE2 4.3Å; L201-F309 HydrophobicContact CD2-CD2 4Å; L201-F309 HydrophobicContact CD2-CE2 3.78Å; L201-F309 HydrophobicContact CG-CE2 4.37Å
202	V	91.6	Very high	90.7	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-61.2	-32.9	178.8	167.9	0	0	0	0	111.8	R107 L108 W183 L198 E200 H204 L205 L236	R107-V202 HydrophobicContact CB-CG1 4.23Å; L108-V202 HydrophobicContact CB-CG1 4.31Å; L108-V202 HydrophobicContact CD1-CG2 4.2Å; L108-V202 HydrophobicContact CD2-CG2 4.26Å; W183-V202 HydrophobicContact CB-CG1 3.88Å; W183-V202 HydrophobicContact CB-CG2 4.3Å; W183-V202 HydrophobicContact CD2-CG1 4.21Å; W183-V202 HydrophobicContact CG-CB 4.49Å; W183-V202 HydrophobicContact CG-CG1 3.46Å; W183-V202 VanDerWaalsContact CG-CG1 3.46Å; W183-V202 HydrophobicContact CG-CG2 4.26Å; L198-V202 WeakPolarHBondContact O-CG2 3.35Å; L198-V202 PolarHBondContact O-N 3.15Å; E200-V202 PolarHBondContact O-N 3.04Å; V202-H204 PolarHBondContact O-N 3.39Å; V202-L205 PolarHBondContact O-N 2.97Å; V202-L205 VanDerWaalsContact O-N 3.14Å; V202-L236 HydrophobicContact CG2-CD1 3.83Å; V202-L236 HydrophobicContact CG2-CD2 3.9Å
203	G	89	Confident	90.6	Very high	31 Å²	31	33.2 Å²	33.2	32%	0.32	21%	0.209	S	C	.	.	H	α-helix	trans	-64	-22.9	176.6	0	0	0	0	0	114.8	R107 S199 E200 L201	R107-G203 VanDerWaalsContact NH1-CA 3.27Å; R107-G203 PolarHBondContact NH1-O 3.46Å; S199-G203 PolarHBondContact O-N 3.5Å; E200-G203 WeakPolarHBondContact O-CA 3.43Å; E200-G203 PolarHBondContact O-N 3.15Å; L201-G203 PolarHBondContact O-N 3.41Å
204	H	89.4	Confident	90.6	Very high	112 Å²	112	33.1 Å²	33.1	52%	0.519	21%	0.208	S	C	.	.	H	α-helix	trans	-91	-17.5	174.1	-74	-70.7	0	0	0	113.8	E200 L201 V202 M284	E200-H204 PolarHBondContact O-CD2 3.11Å; E200-H204 VanDerWaalsContact O-CD2 3.22Å; E200-H204 PolarHBondContact O-N 2.81Å; L201-H204 PolarHBondContact O-N 2.88Å; L201-H204 VanDerWaalsContact O-N 3.09Å; V202-H204 PolarHBondContact O-N 3.39Å; H204-M284 HydrophobicContact CB-CE 4.16Å; H204-M284 HydrophobicContact CB-CG 4.18Å; H204-M284 HydrophobicContact CB-SD 4.22Å
205	L	89.7	Confident	90.6	Very high	13 Å²	13	34.6 Å²	34.6	7%	0.068	21%	0.213	C	C	.	.	S	Bend	trans	-85.2	142.4	-176	-62.4	173	0	0	0	112	W183 L201 V202 A207 L211 M213 L236	W183-L205 HydrophobicContact CH2-CB 3.92Å; W183-L205 HydrophobicContact CH2-CD1 4.12Å; W183-L205 HydrophobicContact CZ2-CB 3.44Å; W183-L205 VanDerWaalsContact CZ2-CB 3.44Å; W183-L205 HydrophobicContact CZ2-CD1 4.3Å; W183-L205 HydrophobicContact CZ2-CG 4.5Å; W183-L205 HydrophobicContact CZ3-CD1 4.36Å; L201-L205 HydrophobicContact CD1-CD1 4.48Å; L201-L205 HydrophobicContact CG-CD1 4.23Å; L201-L205 WeakPolarHBondContact O-CG 3.46Å; L201-L205 PolarHBondContact O-N 3.19Å; V202-L205 PolarHBondContact O-N 2.97Å; V202-L205 VanDerWaalsContact O-N 3.14Å; L205-A207 PolarHBondContact O-N 2.66Å; L205-L211 HydrophobicContact CD1-CD2 3.95Å; L205-L211 HydrophobicContact CD2-CD2 4.23Å; L205-M213 HydrophobicContact CD1-SD 4.12Å; L205-L236 HydrophobicContact CD1-CD1 4.27Å
206	S	85.4	Confident	90.7	Very high	53 Å²	53	35.4 Å²	35.4	37%	0.371	22%	0.22	S	C	.	.			trans	-77.3	116.3	178.5	-59.5	0	0	0	0	112.4	G208 Q209 Q282	S206-G208 PolarHBondContact O-N 2.72Å; S206-G208 VanDerWaalsContact O-N 3.08Å; S206-Q209 PolarHBondContact O-N 3.24Å; S206-Q282 PolarHBondContact OG-NE2 3.39Å; S206-Q282 PolarHBondContact OG-OE1 3.02Å
207	A	73.6	Confident	90.6	Very high	31 Å²	31	36.2 Å²	36.2	26%	0.256	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-10.3	-176.8	0	0	0	0	0	116	D182 L205	D182-A207 HydrophobicContact CB-CB 3.8Å; L205-A207 PolarHBondContact O-N 2.66Å
208	G	75	Confident	90.5	Very high	66 Å²	66	42 Å²	42	68%	0.68	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-3	-178.2	0	0	0	0	0	115.4	S206	S206-G208 PolarHBondContact O-N 2.72Å; S206-G208 VanDerWaalsContact O-N 3.08Å
209	Q	85.3	Confident	90.1	Very high	85 Å²	85	43.2 Å²	43.2	40%	0.397	25%	0.247	S	C	.	.	S	Bend	trans	-104.7	143.2	-174.3	-66.7	-171.3	-20.1	0	0	112.4	S206 L211 S238 S240 H281	S206-Q209 PolarHBondContact O-N 3.24Å; Q209-L211 PolarHBondContact O-N 2.84Å; Q209-S238 WeakPolarHBondContact O-CB 3.44Å; Q209-S238 PolarHBondContact O-OG 2.92Å; Q209-S240 PolarHBondContact O-OG 2.92Å; Q209-H281 PolarHBondContact OE1-CE1 2.76Å; Q209-H281 PolarHBondContact OE1-NE2 3.23Å
210	D	92.5	Very high	89.2	Confident	52 Å²	52	47 Å²	47	28%	0.278	26%	0.263	S	S	.	.			trans	-72.2	97	173.2	-67.3	-20	0	0	0	110	S240 L241 R244 L275	D210-S240 WeakPolarHBondContact OD1-CB 3.36Å; D210-S240 PolarHBondContact OD1-OG 3.37Å; D210-L241 PolarHBondContact OD1-N 3.19Å; D210-R244 WeakPolarHBondContact OD2-CD 3.34Å; D210-R244 IonicContact OD2-CZ 3.07Å; D210-R244 IonicContact OD2-NE 3.08Å; D210-R244 IonicContact OD2-NH1 3.04Å; D210-R244 PolarHBondContact OD2-NH1 3.33Å; D210-L275 HydrophobicContact CB-CD1 3.75Å; D210-L275 HydrophobicContact CB-CD2 4.44Å
211	L	94.1	Very high	88.1	Confident	7 Å²	7	45.1 Å²	45.1	4%	0.037	28%	0.276	C	S	.	.			trans	-120.8	133.9	-178.6	-173.8	65.7	0	0	0	112	W183 L205 Q209 M213 S238 L241 V278 H281	W183-L211 HydrophobicContact CH2-CB 3.79Å; W183-L211 HydrophobicContact CH2-CD2 3.47Å; W183-L211 VanDerWaalsContact CH2-CD2 3.47Å; W183-L211 HydrophobicContact CH2-CG 4.19Å; W183-L211 HydrophobicContact CZ3-CB 3.81Å; W183-L211 HydrophobicContact CZ3-CD2 3.63Å; W183-L211 HydrophobicContact CZ3-CG 4.1Å; L205-L211 HydrophobicContact CD1-CD2 3.95Å; L205-L211 HydrophobicContact CD2-CD2 4.23Å; Q209-L211 PolarHBondContact O-N 2.84Å; L211-M213 HydrophobicContact CD1-CB 4.25Å; L211-M213 HydrophobicContact CD2-CB 4.06Å; L211-M213 HydrophobicContact CD2-SD 4.06Å; L211-M213 HydrophobicContact CG-CB 3.96Å; L211-S238 PolarHBondContact N-OG 2.92Å; L211-S238 PolarHBondContact O-N 2.86Å; L211-S238 PolarHBondContact O-OG 2.85Å; L211-L241 WeakPolarHBondContact O-CD1 3.45Å; L211-V278 HydrophobicContact CD1-CG2 3.47Å; L211-V278 VanDerWaalsContact CD1-CG2 3.47Å; L211-H281 HydrophobicContact CD1-CB 3.99Å; L211-H281 HydrophobicContact CD2-CB 4.31Å
212	Y	96.1	Very high	86.7	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.016	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	102.4	169	179.3	-146.9	0	0	0	108.5	C229 Y235 L237 I269 C277 V278	Y212-C229 HydrophobicContact CD2-CB 4.39Å; Y212-C229 VanDerWaalsContact CD2-SG 3.57Å; Y212-C229 HydrophobicContact CE1-CB 4.24Å; Y212-C229 HydrophobicContact CE2-CB 3.58Å; Y212-C229 WeakPolarHBondContact CE2-SG 3.48Å; Y212-C229 VanDerWaalsContact CZ-CB 3.49Å; Y212-C229 WeakPolarHBondContact OH-CB 3.12Å; Y212-C229 PolarHBondContact OH-N 3.07Å; Y212-Y235 HydrophobicContact CD2-CD2 4.25Å; Y212-Y235 AromaticContact CE2-CD2 3.59Å; Y212-Y235 HydrophobicContact CE2-CD2 3.59Å; Y212-Y235 HydrophobicContact CE2-CE2 4.01Å; Y212-Y235 HydrophobicContact CE2-CG 4.04Å; Y212-L237 HydrophobicContact CD2-CD2 3.41Å; Y212-L237 VanDerWaalsContact CD2-CD2 3.41Å; Y212-L237 HydrophobicContact CE2-CD2 3.84Å; Y212-L237 HydrophobicContact CG-CD2 4.26Å; Y212-I269 HydrophobicContact CD1-CD1 4.13Å; Y212-I269 HydrophobicContact CD1-CG2 4.31Å; Y212-I269 HydrophobicContact CD2-CD1 4.28Å; Y212-I269 HydrophobicContact CE1-CD1 4.09Å; Y212-I269 HydrophobicContact CE2-CD1 4.22Å; Y212-I269 HydrophobicContact CG-CD1 4.23Å; Y212-C277 HydrophobicContact CD1-CB 3.92Å; Y212-C277 HydrophobicContact CE1-CB 3.81Å; Y212-V278 WeakPolarHBondContact O-CG2 3.49Å; Y212-V278 PolarHBondContact O-N 2.91Å
213	M	95.9	Very high	85	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	131.5	-166.8	-176.4	176.2	-171.6	0	0	112.3	L201 L205 L211 Y235 L236 V278 H281 M284 Y286	L201-M213 HydrophobicContact CD1-CE 4.3Å; L205-M213 HydrophobicContact CD1-SD 4.12Å; L211-M213 HydrophobicContact CD1-CB 4.25Å; L211-M213 HydrophobicContact CD2-CB 4.06Å; L211-M213 HydrophobicContact CD2-SD 4.06Å; L211-M213 HydrophobicContact CG-CB 3.96Å; M213-Y235 CarbonylContact O-C 3.57Å; M213-Y235 VanDerWaalsContact O-CA 3.3Å; M213-Y235 WeakPolarHBondContact O-CA 3.45Å; M213-Y235 WeakPolarHBondContact O-CB 3.19Å; M213-L236 HydrophobicContact CB-CB 4.44Å; M213-L236 PolarHBondContact N-O 2.94Å; M213-L236 PolarHBondContact O-N 2.98Å; M213-V278 VanDerWaalsContact CA-O 3.28Å; M213-V278 WeakPolarHBondContact CA-O 3.22Å; M213-V278 HydrophobicContact CB-CG2 4.29Å; M213-V278 HydrophobicContact CG-CG2 4.48Å; M213-V278 WeakPolarHBondContact CG-O 3.45Å; M213-H281 HydrophobicContact SD-CB 4.35Å; M213-M284 WeakPolarHBondContact CE-O 3.39Å; M213-Y286 HydrophobicContact CG-CD2 4.39Å
214	G	96.6	Very high	83.6	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.7	-167.8	-177.3	0	0	0	0	0	111.2	A216 C229 V278 E279	G214-A216 PolarHBondContact O-N 2.91Å; G214-C229 PolarHBondContact N-SG 3.21Å; G214-V278 PolarHBondContact N-O 3.12Å; G214-V278 VanDerWaalsContact N-O 3.09Å; G214-E279 VanDerWaalsContact O-CG 3.28Å; G214-E279 WeakPolarHBondContact O-CG 3.4Å
215	R	95.9	Very high	82.7	Confident	45 Å²	45	67.2 Å²	67.2	17%	0.17	38%	0.38	C	S	.	.			trans	-70.6	116.4	172	177.5	-179.8	-176.5	-98.4	11.3	110	E217 C229 H230 Y233 Y288 E290	R215-E217 IonicContact CZ-OE2 3.43Å; R215-E217 IonicContact NH1-OE2 3.04Å; R215-E217 PolarHBondContact NH1-OE2 2.53Å; R215-C229 CarbonylContact O-C 3.27Å; R215-C229 WeakPolarHBondContact O-CA 3.45Å; R215-H230 PolarHBondContact O-N 3.4Å; R215-Y233 HydrophobicContact CB-CD2 4.19Å; R215-Y233 HydrophobicContact CB-CG 4.23Å; R215-Y233 HydrophobicContact CG-CD2 4.31Å; R215-Y288 HydrophobicContact CB-CD1 3.8Å; R215-Y288 HydrophobicContact CB-CD2 4.49Å; R215-Y288 HydrophobicContact CB-CE1 3.73Å; R215-Y288 HydrophobicContact CB-CE2 4.46Å; R215-Y288 HydrophobicContact CB-CG 4.2Å; R215-Y288 VanDerWaalsContact CD-CE2 3.41Å; R215-Y288 HydrophobicContact CG-CD1 4.14Å; R215-Y288 HydrophobicContact CG-CD2 4.27Å; R215-Y288 HydrophobicContact CG-CE1 3.65Å; R215-Y288 HydrophobicContact CG-CE2 3.81Å; R215-Y288 HydrophobicContact CG-CG 4.43Å; R215-Y288 VanDerWaalsContact CG-CZ 3.48Å; R215-E290 IonicContact NH2-OE2 3.93Å
216	A	94.7	Very high	82.5	Confident	18 Å²	18	67.4 Å²	67.4	15%	0.149	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	130	-174.3	0	0	0	0	0	111.6	G214 R227 Y228 C277 E279	G214-A216 PolarHBondContact O-N 2.91Å; A216-R227 HydrophobicContact CB-CB 4.05Å; A216-Y228 CarbonylContact C-O 3.6Å; A216-Y228 WeakPolarHBondContact CA-O 2.96Å; A216-C277 HydrophobicContact CB-CB 4.25Å; A216-E279 HydrophobicContact CB-CG 3.94Å; A216-E279 PolarHBondContact N-OE1 3.32Å; A216-E279 VanDerWaalsContact N-OE1 3.1Å
217	E	92.6	Very high	82.8	Confident	54 Å²	54	70 Å²	70	25%	0.252	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	146.7	179.2	-165.9	159.7	143.9	0	0	111	R215 R227 Y228 H230 R260	R215-E217 IonicContact CZ-OE2 3.43Å; R215-E217 IonicContact NH1-OE2 3.04Å; R215-E217 PolarHBondContact NH1-OE2 2.53Å; E217-R227 CarbonylContact O-C 3.51Å; E217-R227 WeakPolarHBondContact O-CA 3.42Å; E217-R227 WeakPolarHBondContact O-CB 3.39Å; E217-Y228 HydrophobicContact CB-CD1 4.41Å; E217-Y228 HydrophobicContact CB-CE1 3.87Å; E217-Y228 HydrophobicContact CB-CE2 4.34Å; E217-Y228 HydrophobicContact CG-CE1 4.09Å; E217-Y228 PolarHBondContact N-O 3.2Å; E217-Y228 VanDerWaalsContact O-CD1 3.26Å; E217-Y228 WeakPolarHBondContact O-CD1 3.07Å; E217-Y228 PolarHBondContact O-N 3.42Å; E217-Y228 PolarHBondContact OE1-OH 3.49Å; E217-H230 IonicContact OE2-CD2 3.97Å; E217-H230 PolarHBondContact OE2-CD2 2.8Å; E217-H230 IonicContact OE2-CG 3.74Å; E217-R260 IonicContact OE1-NH1 3.39Å
218	E	90.3	Very high	83.8	Confident	137 Å²	137	68.5 Å²	68.5	64%	0.64	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	145.9	-178.5	-63.4	-175.1	164.9	0	0	111.5	R227 Y228	E218-R227 HydrophobicContact CG-CG 4.46Å; E218-Y228 WeakPolarHBondContact O-CE1 3.2Å
219	F	85.9	Confident	84.8	Confident	27 Å²	27	65.4 Å²	65.4	12%	0.118	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-69.8	137.6	175.6	-67.2	-78.3	0	0	0	111.7	G221 A226 Y228 E263 R267 I270	F219-G221 PolarHBondContact O-N 2.72Å; F219-A226 HydrophobicContact CD2-CB 4.26Å; F219-A226 VanDerWaalsContact CD2-O 3.23Å; F219-A226 WeakPolarHBondContact CD2-O 3.28Å; F219-A226 HydrophobicContact CE2-CB 3.97Å; F219-Y228 AromaticContact CD1-CD1 3.85Å; F219-Y228 HydrophobicContact CD1-CD1 3.85Å; F219-Y228 HydrophobicContact CD1-CE1 4.42Å; F219-Y228 AromaticContact CE1-CD1 3.64Å; F219-Y228 HydrophobicContact CE1-CD1 3.64Å; F219-Y228 HydrophobicContact CE1-CG 4.03Å; F219-Y228 HydrophobicContact CE2-CD1 4.44Å; F219-Y228 HydrophobicContact CG-CD1 4.33Å; F219-Y228 AromaticContact CZ-CD1 3.98Å; F219-Y228 HydrophobicContact CZ-CD1 3.98Å; F219-Y228 HydrophobicContact CZ-CG 4.24Å; F219-E263 HydrophobicContact CD1-CG 3.58Å; F219-E263 HydrophobicContact CE1-CG 3.73Å; F219-R267 HydrophobicContact CD1-CG 3.82Å; F219-R267 HydrophobicContact CE1-CB 4.45Å; F219-R267 HydrophobicContact CE1-CG 3.39Å; F219-R267 HydrophobicContact CZ-CG 4.1Å; F219-I270 HydrophobicContact CE2-CD1 3.32Å; F219-I270 HydrophobicContact CZ-CD1 3.44Å; F219-I270 VanDerWaalsContact CZ-CD1 3.44Å
220	I	75.1	Confident	85.3	Confident	126 Å²	126	62.4 Å²	62.4	65%	0.646	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	118	173.5	-57.1	172.9	0	0	0	108.1	R267	I220-R267 PolarHBondContact O-NH2 2.9Å
221	G	68.9	Low	85.3	Confident	83 Å²	83	60.1 Å²	60.1	86%	0.856	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	21.6	174.8	0	0	0	0	0	115.9	F219	F219-G221 PolarHBondContact O-N 2.72Å
222	G	62.3	Low	85.3	Confident	44 Å²	44	59.8 Å²	59.8	45%	0.454	31%	0.313	S	S	.	.			trans	-85.9	145.9	175.5	0	0	0	0	0	113.7
223	E	56.2	Low	85.3	Confident	207 Å²	207	59.9 Å²	59.9	97%	0.967	31%	0.313	S	S	*	.	S	Bend	trans	-83.4	-13.2	175.4	-64.5	-168.8	161.2	0	0	113.3
224	E	59.8	Low	85.3	Confident	154 Å²	154	59.9 Å²	59.9	72%	0.72	31%	0.313	S	S	*	.	S	Bend	trans	-110.2	150.6	-174.9	-63.9	-169.8	161.5	0	0	113.4	A226	E224-A226 PolarHBondContact O-N 3.22Å
225	K	71.8	Confident	85.3	Confident	206 Å²	206	60 Å²	60	90%	0.896	31%	0.313	S	S	*	.			trans	-68.9	18.2	176.4	-68.3	-178.5	177.5	176.7	0	114.5
226	A	84.1	Confident	85.3	Confident	16 Å²	16	57.8 Å²	57.8	13%	0.132	31%	0.305	C	S	.	.			trans	-74.2	147.8	-177.6	0	0	0	0	0	110.8	F219 E224 I270	F219-A226 HydrophobicContact CD2-CB 4.26Å; F219-A226 VanDerWaalsContact CD2-O 3.23Å; F219-A226 WeakPolarHBondContact CD2-O 3.28Å; F219-A226 HydrophobicContact CE2-CB 3.97Å; E224-A226 PolarHBondContact O-N 3.22Å; A226-I270 HydrophobicContact CB-CD1 3.7Å; A226-I270 HydrophobicContact CB-CG1 4.44Å; A226-I270 HydrophobicContact CB-CG2 4.1Å
227	R	93	Very high	85.4	Confident	108 Å²	108	57 Å²	57	41%	0.408	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	145.8	-178.9	-57.9	-179.9	-166.8	169.3	2	111.2	A216 E217 E218 S276 C277	A216-R227 HydrophobicContact CB-CB 4.05Å; E217-R227 CarbonylContact O-C 3.51Å; E217-R227 WeakPolarHBondContact O-CA 3.42Å; E217-R227 WeakPolarHBondContact O-CB 3.39Å; E218-R227 HydrophobicContact CG-CG 4.46Å; R227-S276 PolarHBondContact N-OG 2.93Å; R227-S276 PolarHBondContact O-OG 2.99Å; R227-C277 WeakPolarHBondContact O-CB 3.46Å; R227-C277 PolarHBondContact O-N 3.31Å
228	Y	94.3	Very high	85.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	160.2	171.3	69.1	-79.5	0	0	0	110.9	A216 E217 E218 F219 D262 E263	A216-Y228 CarbonylContact C-O 3.6Å; A216-Y228 WeakPolarHBondContact CA-O 2.96Å; E217-Y228 HydrophobicContact CB-CD1 4.41Å; E217-Y228 HydrophobicContact CB-CE1 3.87Å; E217-Y228 HydrophobicContact CB-CE2 4.34Å; E217-Y228 HydrophobicContact CG-CE1 4.09Å; E217-Y228 PolarHBondContact N-O 3.2Å; E217-Y228 VanDerWaalsContact O-CD1 3.26Å; E217-Y228 WeakPolarHBondContact O-CD1 3.07Å; E217-Y228 PolarHBondContact O-N 3.42Å; E217-Y228 PolarHBondContact OE1-OH 3.49Å; E218-Y228 WeakPolarHBondContact O-CE1 3.2Å; F219-Y228 AromaticContact CD1-CD1 3.85Å; F219-Y228 HydrophobicContact CD1-CD1 3.85Å; F219-Y228 HydrophobicContact CD1-CE1 4.42Å; F219-Y228 AromaticContact CE1-CD1 3.64Å; F219-Y228 HydrophobicContact CE1-CD1 3.64Å; F219-Y228 HydrophobicContact CE1-CG 4.03Å; F219-Y228 HydrophobicContact CE2-CD1 4.44Å; F219-Y228 HydrophobicContact CG-CD1 4.33Å; F219-Y228 AromaticContact CZ-CD1 3.98Å; F219-Y228 HydrophobicContact CZ-CD1 3.98Å; F219-Y228 HydrophobicContact CZ-CG 4.24Å; Y228-D262 HydrophobicContact CD2-CB 4.32Å; Y228-D262 HydrophobicContact CE2-CB 4.35Å; Y228-E263 HydrophobicContact CD1-CG 4.21Å; Y228-E263 HydrophobicContact CD2-CB 4.34Å; Y228-E263 HydrophobicContact CE1-CB 4.46Å; Y228-E263 HydrophobicContact CE1-CG 4.13Å; Y228-E263 HydrophobicContact CE2-CB 4.17Å
229	C	96.4	Very high	85.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	124.8	174.6	-59.2	0	0	0	0	110.1	Y212 G214 R215 G231 Y235 C277	Y212-C229 HydrophobicContact CD2-CB 4.39Å; Y212-C229 VanDerWaalsContact CD2-SG 3.57Å; Y212-C229 HydrophobicContact CE1-CB 4.24Å; Y212-C229 HydrophobicContact CE2-CB 3.58Å; Y212-C229 WeakPolarHBondContact CE2-SG 3.48Å; Y212-C229 VanDerWaalsContact CZ-CB 3.49Å; Y212-C229 WeakPolarHBondContact OH-CB 3.12Å; Y212-C229 PolarHBondContact OH-N 3.07Å; G214-C229 PolarHBondContact N-SG 3.21Å; R215-C229 CarbonylContact O-C 3.27Å; R215-C229 WeakPolarHBondContact O-CA 3.45Å; C229-G231 PolarHBondContact O-N 2.77Å; C229-Y235 HydrophobicContact CB-CD1 4.03Å; C229-Y235 HydrophobicContact CB-CG 3.84Å; C229-C277 WeakPolarHBondContact CA-SG 3.41Å; C229-C277 HydrophobicContact CB-CB 4.02Å; C229-C277 WeakPolarHBondContact CB-SG 3.41Å; C229-C277 PolarHBondContact N-SG 3.09Å; C229-C277 WeakPolarHBondContact SG-CB 3.35Å; C229-C277 CovalentContact SG-SG 2.03Å; C229-C277 PolarHBondContact SG-SG 3.45Å
230	H	95.3	Very high	85.9	Confident	23 Å²	23	50.9 Å²	50.9	11%	0.106	27%	0.27	C	S	.	.			trans	-67.8	123.5	-179.5	-172.8	-75.9	0	0	0	111.5	R215 E217 G232 Y233 R260 D262	R215-H230 PolarHBondContact O-N 3.4Å; E217-H230 IonicContact OE2-CD2 3.97Å; E217-H230 PolarHBondContact OE2-CD2 2.8Å; E217-H230 IonicContact OE2-CG 3.74Å; H230-G232 VanDerWaalsContact C-N 3.33Å; H230-G232 PolarHBondContact ND1-N 2.73Å; H230-G232 VanDerWaalsContact ND1-N 3.16Å; H230-G232 PolarHBondContact O-N 2.94Å; H230-Y233 HydrophobicContact CB-CD2 4.12Å; H230-Y233 AromaticContact CG-CD2 3.95Å; H230-Y233 AromaticContact ND1-CD2 3.46Å; H230-Y233 WeakPolarHBondContact ND1-CD2 3.36Å; H230-Y233 AromaticContact ND1-CE2 3.76Å; H230-Y233 PolarHBondContact O-N 3.1Å; H230-R260 PolarHBondContact CD2-NH2 3.35Å; H230-R260 PolarHBondContact NE2-NH2 3.28Å; H230-D262 IonicContact CD2-OD2 2.84Å
231	G	92.8	Very high	86.8	Confident	4 Å²	4	44.9 Å²	44.9	4%	0.041	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-64.3	-32.9	-171.2	0	0	0	0	0	114.9	C229 Y233 G234 D262	C229-G231 PolarHBondContact O-N 2.77Å; G231-Y233 PolarHBondContact O-N 3.18Å; G231-G234 PolarHBondContact O-N 3.31Å; G231-G234 VanDerWaalsContact O-N 3.1Å; G231-D262 PolarHBondContact N-OD2 3.36Å
232	G	92.8	Very high	88	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-65.6	-16.7	179.7	0	0	0	0	0	114.8	Q188 T191 H230 H312	Q188-G232 VanDerWaalsContact OE1-CA 3.22Å; Q188-G232 VanDerWaalsContact OE1-N 3.15Å; T191-G232 VanDerWaalsContact CG2-O 3.22Å; T191-G232 WeakPolarHBondContact CG2-O 3.48Å; T191-G232 PolarHBondContact OG1-O 3.12Å; H230-G232 VanDerWaalsContact C-N 3.33Å; H230-G232 PolarHBondContact ND1-N 2.73Å; H230-G232 VanDerWaalsContact ND1-N 3.16Å; H230-G232 PolarHBondContact O-N 2.94Å; G232-H312 WeakPolarHBondContact O-CB 3.19Å; G232-H312 PolarHBondContact O-CD2 3.27Å
233	Y	95.9	Very high	89.4	Confident	5 Å²	5	40.9 Å²	40.9	2%	0.02	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-100.6	3.1	176.5	-64.9	-85.5	0	0	0	112.7	R215 H230 G231 Y286 Y288 E290 T310 H312	R215-Y233 HydrophobicContact CB-CD2 4.19Å; R215-Y233 HydrophobicContact CB-CG 4.23Å; R215-Y233 HydrophobicContact CG-CD2 4.31Å; H230-Y233 HydrophobicContact CB-CD2 4.12Å; H230-Y233 AromaticContact CG-CD2 3.95Å; H230-Y233 AromaticContact ND1-CD2 3.46Å; H230-Y233 WeakPolarHBondContact ND1-CD2 3.36Å; H230-Y233 AromaticContact ND1-CE2 3.76Å; H230-Y233 PolarHBondContact O-N 3.1Å; G231-Y233 PolarHBondContact O-N 3.18Å; Y233-Y286 PolarHBondContact O-OH 2.92Å; Y233-Y288 AromaticContact CD1-CD2 3.87Å; Y233-Y288 HydrophobicContact CD1-CD2 3.87Å; Y233-Y288 HydrophobicContact CD1-CG 4.1Å; Y233-Y288 AromaticContact CE1-CD2 3.88Å; Y233-Y288 HydrophobicContact CE1-CD2 3.88Å; Y233-Y288 HydrophobicContact CG-CD2 4.44Å; Y233-Y288 HydrophobicContact CG-CG 4.5Å; Y233-E290 HydrophobicContact CE1-CB 4.38Å; Y233-E290 VanDerWaalsContact OH-CB 3.28Å; Y233-E290 WeakPolarHBondContact OH-CB 3.5Å; Y233-E290 WeakPolarHBondContact OH-CG 3.3Å; Y233-E290 PolarHBondContact OH-OE2 2.89Å; Y233-T310 VanDerWaalsContact O-CB 3.24Å; Y233-T310 WeakPolarHBondContact O-CB 3.49Å; Y233-T310 VanDerWaalsContact O-CG2 3.25Å; Y233-T310 WeakPolarHBondContact O-CG2 3.34Å; Y233-T310 PolarHBondContact O-OG1 3.16Å; Y233-H312 HydrophobicContact CD1-CB 3.78Å; Y233-H312 HydrophobicContact CE1-CB 3.73Å; Y233-H312 HydrophobicContact CG-CB 4.29Å
234	G	96.4	Very high	91.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.169	C	C	.	.			trans	65.4	154.8	-167.7	0	0	0	0	0	113.2	L186 G231 Y286	L186-G234 CarbonylContact O-C 3.08Å; L186-G234 WeakPolarHBondContact O-CA 3.24Å; G231-G234 PolarHBondContact O-N 3.31Å; G231-G234 VanDerWaalsContact O-N 3.1Å; G234-Y286 VanDerWaalsContact C-OH 3.29Å; G234-Y286 PolarHBondContact O-OH 3.28Å
235	Y	97.1	Very high	92.9	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.008	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	154	175.4	56	-97.3	0	0	0	111.7	M166 L185 L186 Y212 M213 C229 L237 L265	M166-Y235 WeakPolarHBondContact CE-OH 3.48Å; L185-Y235 WeakPolarHBondContact CA-O 3.4Å; L186-Y235 HydrophobicContact CB-CD2 4.31Å; L186-Y235 HydrophobicContact CB-CE1 4.41Å; L186-Y235 HydrophobicContact CB-CE2 3.76Å; L186-Y235 HydrophobicContact CD1-CE2 3.9Å; L186-Y235 HydrophobicContact CG-CE2 4.34Å; L186-Y235 PolarHBondContact N-O 3.41Å; L186-Y235 PolarHBondContact O-N 3.25Å; Y212-Y235 HydrophobicContact CD2-CD2 4.25Å; Y212-Y235 AromaticContact CE2-CD2 3.59Å; Y212-Y235 HydrophobicContact CE2-CD2 3.59Å; Y212-Y235 HydrophobicContact CE2-CE2 4.01Å; Y212-Y235 HydrophobicContact CE2-CG 4.04Å; M213-Y235 CarbonylContact O-C 3.57Å; M213-Y235 VanDerWaalsContact O-CA 3.3Å; M213-Y235 WeakPolarHBondContact O-CA 3.45Å; M213-Y235 WeakPolarHBondContact O-CB 3.19Å; C229-Y235 HydrophobicContact CB-CD1 4.03Å; C229-Y235 HydrophobicContact CB-CG 3.84Å; Y235-L237 HydrophobicContact CD2-CD2 4.31Å; Y235-L237 HydrophobicContact CD2-CG 4.16Å; Y235-L237 HydrophobicContact CE2-CD1 4.13Å; Y235-L237 HydrophobicContact CE2-CD2 4.33Å; Y235-L237 HydrophobicContact CE2-CG 4.12Å; Y235-L265 HydrophobicContact CE2-CD2 3.96Å; Y235-L265 VanDerWaalsContact OH-CD2 3.29Å; Y235-L265 WeakPolarHBondContact OH-CD2 3.2Å
236	L	96.4	Very high	93.9	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	134.4	-179.1	-66.1	170.6	0	0	0	110.7	L108 W183 F184 L185 L201 V202 L205 M213	L108-L236 HydrophobicContact CD1-CD2 3.92Å; W183-L236 HydrophobicContact CE3-CB 4.43Å; F184-L236 WeakPolarHBondContact O-CA 3.27Å; L185-L236 HydrophobicContact CB-CD2 3.88Å; L185-L236 HydrophobicContact CD1-CD2 3.89Å; L185-L236 HydrophobicContact CD1-CG 4.37Å; L185-L236 HydrophobicContact CG-CD2 4.49Å; L201-L236 HydrophobicContact CD2-CD1 3.81Å; L201-L236 HydrophobicContact CG-CD1 4.49Å; V202-L236 HydrophobicContact CG2-CD1 3.83Å; V202-L236 HydrophobicContact CG2-CD2 3.9Å; L205-L236 HydrophobicContact CD1-CD1 4.27Å; M213-L236 HydrophobicContact CB-CB 4.44Å; M213-L236 PolarHBondContact N-O 2.94Å; M213-L236 PolarHBondContact O-N 2.98Å
237	L	95.8	Very high	94.4	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127.1	169.1	-60.8	172.8	0	0	0	108.9	F184 L186 Y212 Y235 L241 L265 I269	F184-L237 HydrophobicContact CB-CB 4.39Å; F184-L237 PolarHBondContact N-O 2.88Å; F184-L237 PolarHBondContact O-N 3.11Å; L186-L237 HydrophobicContact CD1-CD1 3.8Å; Y212-L237 HydrophobicContact CD2-CD2 3.41Å; Y212-L237 VanDerWaalsContact CD2-CD2 3.41Å; Y212-L237 HydrophobicContact CE2-CD2 3.84Å; Y212-L237 HydrophobicContact CG-CD2 4.26Å; Y235-L237 HydrophobicContact CD2-CD2 4.31Å; Y235-L237 HydrophobicContact CD2-CG 4.16Å; Y235-L237 HydrophobicContact CE2-CD1 4.13Å; Y235-L237 HydrophobicContact CE2-CD2 4.33Å; Y235-L237 HydrophobicContact CE2-CG 4.12Å; L237-L241 HydrophobicContact CD2-CD2 3.95Å; L237-L265 HydrophobicContact CD1-CD2 4.39Å; L237-I269 HydrophobicContact CD2-CD1 4.07Å
238	S	94.9	Very high	94.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	148.8	168.8	59.1	0	0	0	0	111.3	Q209 L211 S240 L241 L242	Q209-S238 WeakPolarHBondContact O-CB 3.44Å; Q209-S238 PolarHBondContact O-OG 2.92Å; L211-S238 PolarHBondContact N-OG 2.92Å; L211-S238 PolarHBondContact O-N 2.86Å; L211-S238 PolarHBondContact O-OG 2.85Å; S238-S240 VanDerWaalsContact C-N 3.29Å; S238-S240 PolarHBondContact O-N 3.3Å; S238-L241 PolarHBondContact O-N 3.24Å; S238-L241 WeakPolarHBondContact OG-CB 3.22Å; S238-L241 PolarHBondContact OG-N 3.35Å; S238-L242 PolarHBondContact O-N 3.39Å
239	R	92.4	Very high	94.4	Very high	67 Å²	67	23.9 Å²	23.9	25%	0.253	12%	0.12	S	C	.	.	H	α-helix	trans	-56.3	-40.8	174.4	-177.7	-171.5	64.2	79.8	6.2	113.1	G178 Y181 D182 F184 L242 A243	G178-R239 WeakPolarHBondContact O-CD 3.27Å; G178-R239 WeakPolarHBondContact O-CG 3.35Å; Y181-R239 VanDerWaalsContact O-CD 3.31Å; Y181-R239 WeakPolarHBondContact O-CD 3.5Å; D182-R239 VanDerWaalsContact O-CB 3.3Å; D182-R239 WeakPolarHBondContact O-CB 3.19Å; D182-R239 PolarHBondContact O-N 2.81Å; D182-R239 IonicContact OD1-NE 2.67Å; F184-R239 HydrophobicContact CE2-CB 4.1Å; F184-R239 HydrophobicContact CE2-CG 4.41Å; R239-L242 PolarHBondContact O-N 2.92Å; R239-A243 WeakPolarHBondContact O-CB 3.41Å; R239-A243 PolarHBondContact O-N 3.26Å
240	S	92.2	Very high	94.2	Very high	21 Å²	21	27 Å²	27	15%	0.147	14%	0.137	C	C	.	.	H	α-helix	trans	-66	-42.3	-179.4	58.9	0	0	0	0	111.4	Q209 D210 S238 A243 R244	Q209-S240 PolarHBondContact O-OG 2.92Å; D210-S240 WeakPolarHBondContact OD1-CB 3.36Å; D210-S240 PolarHBondContact OD1-OG 3.37Å; S238-S240 VanDerWaalsContact C-N 3.29Å; S238-S240 PolarHBondContact O-N 3.3Å; S240-A243 PolarHBondContact O-N 2.9Å; S240-R244 WeakPolarHBondContact O-CG 3.25Å; S240-R244 PolarHBondContact O-N 3.29Å
241	L	94.3	Very high	94.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.6	-49.1	172.6	-177.8	160.9	0	0	0	110.9	D210 L211 L237 S238 A243 R244 L245 I269 L273 L275	D210-L241 PolarHBondContact OD1-N 3.19Å; L211-L241 WeakPolarHBondContact O-CD1 3.45Å; L237-L241 HydrophobicContact CD2-CD2 3.95Å; S238-L241 PolarHBondContact O-N 3.24Å; S238-L241 WeakPolarHBondContact OG-CB 3.22Å; S238-L241 PolarHBondContact OG-N 3.35Å; L241-A243 VanDerWaalsContact C-N 3.27Å; L241-A243 PolarHBondContact O-N 2.86Å; L241-R244 PolarHBondContact O-N 3.44Å; L241-R244 VanDerWaalsContact O-N 3.14Å; L241-L245 HydrophobicContact CD2-CD2 4.47Å; L241-L245 WeakPolarHBondContact O-CB 3.27Å; L241-L245 PolarHBondContact O-N 3.07Å; L241-I269 HydrophobicContact CD1-CG2 4.35Å; L241-I269 HydrophobicContact CD2-CD1 4.19Å; L241-I269 HydrophobicContact CD2-CG1 4.34Å; L241-L273 HydrophobicContact CD2-CD1 4.4Å; L241-L273 HydrophobicContact CG-CD1 4.05Å; L241-L275 HydrophobicContact CD1-CD1 3.7Å; L241-L275 HydrophobicContact CG-CD1 4.06Å
242	L	93.8	Very high	94	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.01	15%	0.153	C	C	.	.	H	α-helix	trans	-59.5	-39.6	179.9	-175.8	62.3	0	0	0	111.9	V170 L173 H174 F184 S238 R239 L245 Q246	V170-L242 HydrophobicContact CG1-CD1 3.42Å; V170-L242 VanDerWaalsContact CG1-CD1 3.42Å; L173-L242 HydrophobicContact CB-CD2 4.21Å; H174-L242 HydrophobicContact CB-CD1 4.27Å; H174-L242 HydrophobicContact CB-CD2 4.04Å; H174-L242 HydrophobicContact CB-CG 3.89Å; F184-L242 HydrophobicContact CD1-CD2 4.33Å; F184-L242 HydrophobicContact CD2-CD2 3.78Å; F184-L242 HydrophobicContact CE1-CD2 4.26Å; F184-L242 HydrophobicContact CE2-CD2 3.72Å; F184-L242 HydrophobicContact CG-CD2 4.11Å; F184-L242 HydrophobicContact CZ-CD2 3.99Å; S238-L242 PolarHBondContact O-N 3.39Å; R239-L242 PolarHBondContact O-N 2.92Å; L242-L245 PolarHBondContact O-N 2.62Å; L242-Q246 PolarHBondContact O-N 2.96Å
243	A	93	Very high	93.8	Very high	41 Å²	41	31.9 Å²	31.9	34%	0.339	16%	0.162	S	C	.	.	H	α-helix	trans	-67.7	-37.7	176.3	0	0	0	0	0	113.3	R239 S240 L241	R239-A243 WeakPolarHBondContact O-CB 3.41Å; R239-A243 PolarHBondContact O-N 3.26Å; S240-A243 PolarHBondContact O-N 2.9Å; L241-A243 VanDerWaalsContact C-N 3.27Å; L241-A243 PolarHBondContact O-N 2.86Å
244	R	93.9	Very high	93.5	Very high	124 Å²	124	37.4 Å²	37.4	47%	0.468	19%	0.192	S	C	.	.	H	α-helix	trans	-73.7	-30.2	176.1	-72.3	-174.4	62.5	-170.2	-5.3	113.1	D210 S240 L241 P247 H248 L273	D210-R244 WeakPolarHBondContact OD2-CD 3.34Å; D210-R244 IonicContact OD2-CZ 3.07Å; D210-R244 IonicContact OD2-NE 3.08Å; D210-R244 IonicContact OD2-NH1 3.04Å; D210-R244 PolarHBondContact OD2-NH1 3.33Å; S240-R244 WeakPolarHBondContact O-CG 3.25Å; S240-R244 PolarHBondContact O-N 3.29Å; L241-R244 PolarHBondContact O-N 3.44Å; L241-R244 VanDerWaalsContact O-N 3.14Å; R244-P247 WeakPolarHBondContact O-CD 3.47Å; R244-H248 PolarHBondContact O-CD2 3.31Å; R244-L273 HydrophobicContact CB-CD1 4.24Å; R244-L273 HydrophobicContact CB-CD2 3.77Å
245	L	94.4	Very high	92.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-74.3	-33.6	179.9	-169.2	65.6	0	0	0	112.1	V170 L241 L242 P247 H248 L249 L265 I269 L273	V170-L245 HydrophobicContact CG1-CD2 4.38Å; L241-L245 HydrophobicContact CD2-CD2 4.47Å; L241-L245 WeakPolarHBondContact O-CB 3.27Å; L241-L245 PolarHBondContact O-N 3.07Å; L242-L245 PolarHBondContact O-N 2.62Å; L245-P247 VanDerWaalsContact C-CD 3.48Å; L245-H248 PolarHBondContact O-N 2.92Å; L245-L249 HydrophobicContact CD2-CD2 3.84Å; L245-L249 HydrophobicContact CG-CD2 3.8Å; L245-L249 HydrophobicContact CG-CG 4.29Å; L245-L249 PolarHBondContact O-N 3.06Å; L245-L265 HydrophobicContact CD2-CD1 3.78Å; L245-I269 HydrophobicContact CD1-CG1 3.94Å; L245-I269 HydrophobicContact CD2-CD1 4.42Å; L245-I269 HydrophobicContact CD2-CG1 3.8Å; L245-L273 HydrophobicContact CB-CD1 4.06Å; L245-L273 HydrophobicContact CD1-CD1 4.03Å; L245-L273 HydrophobicContact CD1-CG 4.37Å
246	Q	93.2	Very high	92.2	Very high	67 Å²	67	46.3 Å²	46.3	31%	0.313	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-50	-45.6	-171.9	179.2	-84.5	-29.4	0	0	115.1	L242 H248 L249	L242-Q246 PolarHBondContact O-N 2.96Å; Q246-H248 PolarHBondContact O-N 3.41Å; Q246-H248 VanDerWaalsContact O-N 3.15Å; Q246-L249 PolarHBondContact O-N 3.27Å
247	P	94.6	Very high	91.4	Very high	78 Å²	78	52 Å²	52	51%	0.506	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-62.8	-20.9	-179.9	-23.7	35.1	0	0	0	114.1	R244 L245	R244-P247 WeakPolarHBondContact O-CD 3.47Å; L245-P247 VanDerWaalsContact C-CD 3.48Å
248	H	94.7	Very high	90.7	Very high	63 Å²	63	52.6 Å²	52.6	29%	0.292	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-101.2	-13.6	-174.3	-57.7	-66.5	0	0	0	113.5	R244 L245 Q246 D250 T251 C252 Y272	R244-H248 PolarHBondContact O-CD2 3.31Å; L245-H248 PolarHBondContact O-N 2.92Å; Q246-H248 PolarHBondContact O-N 3.41Å; Q246-H248 VanDerWaalsContact O-N 3.15Å; H248-D250 VanDerWaalsContact C-N 3.29Å; H248-D250 PolarHBondContact O-N 3.05Å; H248-T251 PolarHBondContact O-N 2.83Å; H248-C252 PolarHBondContact O-N 2.95Å; H248-C252 PolarHBondContact O-SG 2.86Å; H248-C252 VanDerWaalsContact O-SG 3.36Å; H248-Y272 HydrophobicContact CB-CD1 3.73Å; H248-Y272 HydrophobicContact CB-CD2 3.96Å; H248-Y272 HydrophobicContact CB-CE1 4.13Å; H248-Y272 HydrophobicContact CB-CE2 4.37Å; H248-Y272 HydrophobicContact CB-CG 3.62Å; H248-Y272 AromaticContact CE1-CD1 3.77Å; H248-Y272 AromaticContact CG-CD1 3.4Å; H248-Y272 AromaticContact CG-CG 3.63Å; H248-Y272 AromaticContact ND1-CD1 3.16Å; H248-Y272 WeakPolarHBondContact ND1-CD1 3.2Å; H248-Y272 AromaticContact ND1-CE1 3.56Å; H248-Y272 AromaticContact ND1-CG 3.91Å
249	L	92.7	Very high	90.3	Very high	3 Å²	3	58.5 Å²	58.5	2%	0.016	31%	0.309	C	S	.	.	H	α-helix	trans	-56.2	-40.8	-176	-72.2	176.5	0	0	0	112.9	Y167 V170 R171 L245 Q246 T251 C252 R253 W264	Y167-L249 HydrophobicContact CD2-CB 4.08Å; Y167-L249 HydrophobicContact CE2-CB 3.73Å; Y167-L249 WeakPolarHBondContact CE2-O 3.21Å; V170-L249 HydrophobicContact CG1-CD1 3.93Å; V170-L249 HydrophobicContact CG1-CD2 4.1Å; R171-L249 HydrophobicContact CB-CD1 4.44Å; L245-L249 HydrophobicContact CD2-CD2 3.84Å; L245-L249 HydrophobicContact CG-CD2 3.8Å; L245-L249 HydrophobicContact CG-CG 4.29Å; L245-L249 PolarHBondContact O-N 3.06Å; Q246-L249 PolarHBondContact O-N 3.27Å; L249-T251 VanDerWaalsContact C-N 3.3Å; L249-T251 PolarHBondContact O-N 2.59Å; L249-C252 PolarHBondContact O-N 2.78Å; L249-R253 WeakPolarHBondContact O-CB 3.44Å; L249-R253 PolarHBondContact O-N 2.88Å; L249-W264 HydrophobicContact CD2-CH2 4.43Å
250	D	92.1	Very high	90.2	Very high	64 Å²	64	59.2 Å²	59.2	34%	0.342	31%	0.312	S	S	.	.	H	α-helix	trans	-64.1	-35.6	179.2	-79.3	-49.1	0	0	0	112.5	Y167 H248 R253 N254	Y167-D250 PolarHBondContact OH-OD1 3.05Å; H248-D250 VanDerWaalsContact C-N 3.29Å; H248-D250 PolarHBondContact O-N 3.05Å; D250-R253 IonicContact OD1-CZ 3.12Å; D250-R253 IonicContact OD1-NH1 2.78Å; D250-R253 PolarHBondContact OD1-NH1 3.28Å; D250-R253 IonicContact OD1-NH2 3.73Å; D250-R253 PolarHBondContact OD1-NH2 3.22Å; D250-N254 VanDerWaalsContact O-CG 3.24Å; D250-N254 PolarHBondContact O-N 3.41Å; D250-N254 PolarHBondContact O-ND2 2.79Å; D250-N254 PolarHBondContact O-OD1 2.82Å
251	T	92.9	Very high	90.2	Very high	70 Å²	70	59.2 Å²	59.2	43%	0.429	31%	0.311	S	S	.	.	H	α-helix	trans	-71.9	-47.5	176.5	-44.4	0	0	0	0	110.4	H248 L249 R253 N254 D255 Y272	H248-T251 PolarHBondContact O-N 2.83Å; L249-T251 VanDerWaalsContact C-N 3.3Å; L249-T251 PolarHBondContact O-N 2.59Å; T251-R253 PolarHBondContact O-N 3.27Å; T251-N254 PolarHBondContact O-N 3.3Å; T251-D255 PolarHBondContact O-N 2.86Å; T251-Y272 WeakPolarHBondContact CB-OH 3.26Å; T251-Y272 WeakPolarHBondContact CG2-OH 3.4Å
252	C	90.9	Very high	90.1	Very high	9 Å²	9	59.6 Å²	59.6	6%	0.061	31%	0.313	C	S	.	.	H	α-helix	trans	-57.7	-33.8	175.9	-63.1	0	0	0	0	112.8	H248 L249 W264 C268 Y272	H248-C252 PolarHBondContact O-N 2.95Å; H248-C252 PolarHBondContact O-SG 2.86Å; H248-C252 VanDerWaalsContact O-SG 3.36Å; L249-C252 PolarHBondContact O-N 2.78Å; C252-W264 HydrophobicContact CB-CZ2 4.08Å; C252-W264 PolarHBondContact O-NE1 2.98Å; C252-C268 HydrophobicContact CB-CB 3.62Å; C252-C268 WeakPolarHBondContact CB-SG 3.4Å; C252-C268 VanDerWaalsContact SG-CA 3.57Å; C252-C268 WeakPolarHBondContact SG-CB 3.35Å; C252-C268 CovalentContact SG-SG 2.02Å; C252-C268 PolarHBondContact SG-SG 3.24Å; C252-Y272 WeakPolarHBondContact SG-CD2 3.48Å; C252-Y272 WeakPolarHBondContact SG-CE2 3.42Å
253	R	89.4	Confident	90.1	Very high	52 Å²	52	59.9 Å²	59.9	20%	0.196	31%	0.314	C	S	.	.	H	α-helix	trans	-67.8	-38.6	175.8	179.7	-159.1	59	-145.1	-1.7	112.3	W164 Y167 L249 D250 T251 D255 I256	W164-R253 HydrophobicContact CE3-CG 4.22Å; W164-R253 HydrophobicContact CH2-CG 4.05Å; W164-R253 HydrophobicContact CZ2-CG 4.24Å; W164-R253 HydrophobicContact CZ3-CG 3.99Å; Y167-R253 HydrophobicContact CD2-CB 3.81Å; Y167-R253 HydrophobicContact CD2-CG 4.26Å; Y167-R253 HydrophobicContact CE2-CB 3.96Å; Y167-R253 HydrophobicContact CE2-CG 4.48Å; Y167-R253 PolarHBondContact OH-NH1 2.91Å; Y167-R253 VanDerWaalsContact OH-NH1 3.08Å; L249-R253 WeakPolarHBondContact O-CB 3.44Å; L249-R253 PolarHBondContact O-N 2.88Å; D250-R253 IonicContact OD1-CZ 3.12Å; D250-R253 IonicContact OD1-NH1 2.78Å; D250-R253 PolarHBondContact OD1-NH1 3.28Å; D250-R253 IonicContact OD1-NH2 3.73Å; D250-R253 PolarHBondContact OD1-NH2 3.22Å; T251-R253 PolarHBondContact O-N 3.27Å; R253-D255 PolarHBondContact O-N 3.24Å; R253-I256 WeakPolarHBondContact O-CG1 3.29Å
254	N	87.9	Confident	90.1	Very high	120 Å²	120	58.3 Å²	58.3	64%	0.642	30%	0.3	S	S	*	.	H	α-helix	trans	-75.4	-17.8	-176.4	-63.7	-20.2	0	0	0	111.9	D250 T251	D250-N254 VanDerWaalsContact O-CG 3.24Å; D250-N254 PolarHBondContact O-N 3.41Å; D250-N254 PolarHBondContact O-ND2 2.79Å; D250-N254 PolarHBondContact O-OD1 2.82Å; T251-N254 PolarHBondContact O-N 3.3Å
255	D	85.1	Confident	90.1	Very high	107 Å²	107	52.4 Å²	52.4	57%	0.572	28%	0.277	S	S	*	.	S	Bend	trans	-114.5	64.9	-179.7	-163	10	0	0	0	111.8	T251 R253 L257	T251-D255 PolarHBondContact O-N 2.86Å; R253-D255 PolarHBondContact O-N 3.24Å; D255-L257 PolarHBondContact O-N 3.22Å
256	I	82.3	Confident	90.1	Very high	83 Å²	83	52.4 Å²	52.4	43%	0.426	28%	0.277	S	S	.	.			trans	-79.1	103.2	-178.7	-54.1	179.5	0	0	0	109.8	V163 R253 S258	V163-I256 HydrophobicContact CB-CD1 4.49Å; V163-I256 HydrophobicContact CG1-CD1 3.86Å; V163-I256 HydrophobicContact CG1-CG1 4.26Å; V163-I256 HydrophobicContact CG1-CG2 4.33Å; V163-I256 HydrophobicContact CG2-CG2 4.34Å; R253-I256 WeakPolarHBondContact O-CG1 3.29Å; I256-S258 WeakPolarHBondContact CG2-O 3.17Å
257	L	79.8	Confident	90	Very high	120 Å²	120	52 Å²	52	63%	0.628	27%	0.273	S	S	*	.			trans	-91.8	-23.5	175.2	-61.3	175.3	0	0	0	113.7	D255	D255-L257 PolarHBondContact O-N 3.22Å
258	S	81.3	Confident	89.9	Confident	13 Å²	13	48.5 Å²	48.5	9%	0.091	25%	0.25	C	S	.	.			trans	-124.6	141.1	178.7	-176.4	0	0	0	0	112	I256 R260 E263	I256-S258 WeakPolarHBondContact CG2-O 3.17Å; S258-R260 VanDerWaalsContact C-N 3.29Å; S258-R260 PolarHBondContact OG-N 2.77Å; S258-R260 VanDerWaalsContact OG-N 3.16Å; S258-E263 WeakPolarHBondContact CB-OE2 3.41Å; S258-E263 VanDerWaalsContact OG-CD 3.32Å; S258-E263 PolarHBondContact OG-OE2 3.37Å
259	V	84.8	Confident	89.9	Confident	125 Å²	125	45.5 Å²	45.5	76%	0.758	24%	0.236	S	C	*	.	S	Bend	trans	-79.2	-18.3	174.6	-173.1	0	0	0	0	111.1
260	R	90.1	Very high	89.9	Confident	81 Å²	81	46.4 Å²	46.4	31%	0.306	24%	0.241	S	C	.	.	S	Bend	trans	-79.8	123	177.8	-71.3	-173.1	64.5	157.7	2.9	110	E217 H230 S258 D262 E263 W264	E217-R260 IonicContact OE1-NH1 3.39Å; H230-R260 PolarHBondContact CD2-NH2 3.35Å; H230-R260 PolarHBondContact NE2-NH2 3.28Å; S258-R260 VanDerWaalsContact C-N 3.29Å; S258-R260 PolarHBondContact OG-N 2.77Å; S258-R260 VanDerWaalsContact OG-N 3.16Å; R260-D262 WeakPolarHBondContact CB-OD1 3.42Å; R260-D262 IonicContact CZ-OD2 3.83Å; R260-D262 IonicContact NE-OD1 3.33Å; R260-D262 PolarHBondContact NE-OD1 2.72Å; R260-D262 IonicContact NH2-OD1 3.35Å; R260-D262 IonicContact NH2-OD2 3.9Å; R260-D262 PolarHBondContact NH2-OD2 3.23Å; R260-D262 VanDerWaalsContact NH2-OD2 3.08Å; R260-D262 PolarHBondContact O-N 2.95Å; R260-E263 HydrophobicContact CB-CB 3.92Å; R260-E263 PolarHBondContact O-N 3.2Å; R260-W264 WeakPolarHBondContact O-CB 3.4Å; R260-W264 PolarHBondContact O-N 3.38Å
261	P	92.6	Very high	89.9	Confident	21 Å²	21	48.8 Å²	48.8	14%	0.136	25%	0.254	C	S	.	.	H	α-helix	trans	-68.5	-32.1	-174.2	26.4	-34.2	0	0	0	113.9	P162 M166 L265	P162-P261 HydrophobicContact CB-CB 4.31Å; P162-P261 HydrophobicContact CB-CG 3.96Å; M166-P261 HydrophobicContact CB-CB 3.83Å; M166-P261 HydrophobicContact CE-CB 4.11Å; M166-P261 HydrophobicContact CG-CB 4.34Å; P261-L265 PolarHBondContact O-N 3.25Å; P261-L265 VanDerWaalsContact O-N 3.1Å
262	D	93.8	Very high	89.9	Confident	8 Å²	8	49.8 Å²	49.8	4%	0.043	25%	0.25	C	S	.	.	H	α-helix	trans	-69.6	-44.4	175.9	52.5	-16.5	0	0	0	111.9	Y228 H230 G231 R260 L265 G266	Y228-D262 HydrophobicContact CD2-CB 4.32Å; Y228-D262 HydrophobicContact CE2-CB 4.35Å; H230-D262 IonicContact CD2-OD2 2.84Å; G231-D262 PolarHBondContact N-OD2 3.36Å; R260-D262 WeakPolarHBondContact CB-OD1 3.42Å; R260-D262 IonicContact CZ-OD2 3.83Å; R260-D262 IonicContact NE-OD1 3.33Å; R260-D262 PolarHBondContact NE-OD1 2.72Å; R260-D262 IonicContact NH2-OD1 3.35Å; R260-D262 IonicContact NH2-OD2 3.9Å; R260-D262 PolarHBondContact NH2-OD2 3.23Å; R260-D262 VanDerWaalsContact NH2-OD2 3.08Å; R260-D262 PolarHBondContact O-N 2.95Å; D262-L265 PolarHBondContact O-N 3.23Å; D262-G266 PolarHBondContact O-N 2.86Å
263	E	92.4	Very high	90	Very high	8 Å²	8	50.2 Å²	50.2	4%	0.037	25%	0.252	C	S	.	.	H	α-helix	trans	-65.4	-42.2	174.3	-166	-168.8	163.6	0	0	111.7	F219 Y228 S258 R260 L265 G266 R267	F219-E263 HydrophobicContact CD1-CG 3.58Å; F219-E263 HydrophobicContact CE1-CG 3.73Å; Y228-E263 HydrophobicContact CD1-CG 4.21Å; Y228-E263 HydrophobicContact CD2-CB 4.34Å; Y228-E263 HydrophobicContact CE1-CB 4.46Å; Y228-E263 HydrophobicContact CE1-CG 4.13Å; Y228-E263 HydrophobicContact CE2-CB 4.17Å; S258-E263 WeakPolarHBondContact CB-OE2 3.41Å; S258-E263 VanDerWaalsContact OG-CD 3.32Å; S258-E263 PolarHBondContact OG-OE2 3.37Å; R260-E263 HydrophobicContact CB-CB 3.92Å; R260-E263 PolarHBondContact O-N 3.2Å; E263-L265 PolarHBondContact O-N 2.83Å; E263-G266 PolarHBondContact O-N 2.97Å; E263-R267 WeakPolarHBondContact O-CG 3.47Å; E263-R267 PolarHBondContact O-N 2.64Å; E263-R267 IonicContact OE1-CZ 2.63Å; E263-R267 IonicContact OE1-NE 2.65Å; E263-R267 PolarHBondContact OE1-NE 3.15Å; E263-R267 VanDerWaalsContact OE1-NE 3.12Å; E263-R267 IonicContact OE1-NH2 3.01Å; E263-R267 PolarHBondContact OE1-NH2 3.23Å
264	W	93.5	Very high	90.1	Very high	8 Å²	8	50.7 Å²	50.7	3%	0.03	27%	0.273	C	S	.	.	H	α-helix	trans	-57.1	-48.8	175.3	166.8	80.7	0	0	0	112	V163 M166 Y167 L249 C252 R260 G266 R267 C268	V163-W264 HydrophobicContact CG1-CB 4.26Å; V163-W264 HydrophobicContact CG1-CD2 3.59Å; V163-W264 HydrophobicContact CG1-CE3 4.15Å; V163-W264 HydrophobicContact CG1-CG 3.59Å; V163-W264 HydrophobicContact CG2-CB 4.24Å; V163-W264 HydrophobicContact CG2-CG 4.44Å; M166-W264 HydrophobicContact CB-CE3 4.35Å; M166-W264 HydrophobicContact CB-CZ3 4.19Å; M166-W264 HydrophobicContact CG-CE3 4.03Å; M166-W264 HydrophobicContact CG-CZ3 3.8Å; Y167-W264 HydrophobicContact CD2-CH2 4.03Å; Y167-W264 HydrophobicContact CD2-CZ2 4.2Å; Y167-W264 HydrophobicContact CG-CH2 4.26Å; L249-W264 HydrophobicContact CD2-CH2 4.43Å; C252-W264 HydrophobicContact CB-CZ2 4.08Å; C252-W264 PolarHBondContact O-NE1 2.98Å; R260-W264 WeakPolarHBondContact O-CB 3.4Å; R260-W264 PolarHBondContact O-N 3.38Å; W264-G266 VanDerWaalsContact C-N 3.33Å; W264-G266 PolarHBondContact O-N 2.77Å; W264-R267 PolarHBondContact O-N 2.9Å; W264-C268 PolarHBondContact O-N 2.59Å; W264-C268 VanDerWaalsContact O-N 3.07Å
265	L	94.8	Very high	90.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.5	-41.5	178.6	-177.5	63.3	0	0	0	110.9	M166 V170 Y235 L237 L245 P261 D262 E263 C268 I269	M166-L265 HydrophobicContact CG-CB 4.42Å; M166-L265 HydrophobicContact CG-CD2 4.47Å; M166-L265 HydrophobicContact SD-CD2 4.2Å; V170-L265 HydrophobicContact CG2-CD1 4.21Å; V170-L265 HydrophobicContact CG2-CD2 4.16Å; Y235-L265 HydrophobicContact CE2-CD2 3.96Å; Y235-L265 VanDerWaalsContact OH-CD2 3.29Å; Y235-L265 WeakPolarHBondContact OH-CD2 3.2Å; L237-L265 HydrophobicContact CD1-CD2 4.39Å; L245-L265 HydrophobicContact CD2-CD1 3.78Å; P261-L265 PolarHBondContact O-N 3.25Å; P261-L265 VanDerWaalsContact O-N 3.1Å; D262-L265 PolarHBondContact O-N 3.23Å; E263-L265 PolarHBondContact O-N 2.83Å; L265-C268 WeakPolarHBondContact O-CB 3.28Å; L265-C268 PolarHBondContact O-N 3.06Å; L265-I269 HydrophobicContact CD1-CD1 4.3Å; L265-I269 HydrophobicContact CD1-CG1 4.45Å; L265-I269 HydrophobicContact CG-CD1 3.93Å; L265-I269 HydrophobicContact CG-CG1 4.49Å; L265-I269 WeakPolarHBondContact O-CG1 3.33Å; L265-I269 PolarHBondContact O-N 2.84Å
266	G	93.8	Very high	90.8	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-58.3	-47	176.3	0	0	0	0	0	113	D262 E263 W264 I269 I270	D262-G266 PolarHBondContact O-N 2.86Å; E263-G266 PolarHBondContact O-N 2.97Å; W264-G266 VanDerWaalsContact C-N 3.33Å; W264-G266 PolarHBondContact O-N 2.77Å; G266-I269 PolarHBondContact O-N 2.72Å; G266-I270 WeakPolarHBondContact O-CD1 3.42Å; G266-I270 WeakPolarHBondContact O-CG1 3.44Å; G266-I270 PolarHBondContact O-N 2.87Å
267	R	91.2	Very high	91.4	Very high	60 Å²	60	40.3 Å²	40.3	23%	0.226	22%	0.222	C	C	.	.	H	α-helix	trans	-59.2	-47.9	175	-70.7	-179.2	-177.2	-99.7	1.7	111.1	F219 I220 E263 W264 I269 I270 D271	F219-R267 HydrophobicContact CD1-CG 3.82Å; F219-R267 HydrophobicContact CE1-CB 4.45Å; F219-R267 HydrophobicContact CE1-CG 3.39Å; F219-R267 HydrophobicContact CZ-CG 4.1Å; I220-R267 PolarHBondContact O-NH2 2.9Å; E263-R267 WeakPolarHBondContact O-CG 3.47Å; E263-R267 PolarHBondContact O-N 2.64Å; E263-R267 IonicContact OE1-CZ 2.63Å; E263-R267 IonicContact OE1-NE 2.65Å; E263-R267 PolarHBondContact OE1-NE 3.15Å; E263-R267 VanDerWaalsContact OE1-NE 3.12Å; E263-R267 IonicContact OE1-NH2 3.01Å; E263-R267 PolarHBondContact OE1-NH2 3.23Å; W264-R267 PolarHBondContact O-N 2.9Å; R267-I269 VanDerWaalsContact C-N 3.32Å; R267-I269 PolarHBondContact O-N 2.83Å; R267-I270 PolarHBondContact O-N 2.91Å; R267-I270 VanDerWaalsContact O-N 3.11Å; R267-D271 WeakPolarHBondContact O-CB 3.43Å; R267-D271 PolarHBondContact O-N 3.34Å
268	C	92.9	Very high	92.1	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.02	21%	0.206	C	C	.	.	H	α-helix	trans	-57.5	-42.5	177.8	-175.2	0	0	0	0	112.9	C252 W264 L265 Y272	C252-C268 HydrophobicContact CB-CB 3.62Å; C252-C268 WeakPolarHBondContact CB-SG 3.4Å; C252-C268 VanDerWaalsContact SG-CA 3.57Å; C252-C268 WeakPolarHBondContact SG-CB 3.35Å; C252-C268 CovalentContact SG-SG 2.02Å; C252-C268 PolarHBondContact SG-SG 3.24Å; W264-C268 PolarHBondContact O-N 2.59Å; W264-C268 VanDerWaalsContact O-N 3.07Å; L265-C268 WeakPolarHBondContact O-CB 3.28Å; L265-C268 PolarHBondContact O-N 3.06Å; C268-Y272 WeakPolarHBondContact O-CD2 3.47Å; C268-Y272 PolarHBondContact O-N 3.14Å
269	I	94.8	Very high	92.8	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.3	-42.4	177.1	-69.1	168.3	0	0	0	110.7	Y212 L237 L241 L245 L265 G266 R267 L273 G274 L275	Y212-I269 HydrophobicContact CD1-CD1 4.13Å; Y212-I269 HydrophobicContact CD1-CG2 4.31Å; Y212-I269 HydrophobicContact CD2-CD1 4.28Å; Y212-I269 HydrophobicContact CE1-CD1 4.09Å; Y212-I269 HydrophobicContact CE2-CD1 4.22Å; Y212-I269 HydrophobicContact CG-CD1 4.23Å; L237-I269 HydrophobicContact CD2-CD1 4.07Å; L241-I269 HydrophobicContact CD1-CG2 4.35Å; L241-I269 HydrophobicContact CD2-CD1 4.19Å; L241-I269 HydrophobicContact CD2-CG1 4.34Å; L245-I269 HydrophobicContact CD1-CG1 3.94Å; L245-I269 HydrophobicContact CD2-CD1 4.42Å; L245-I269 HydrophobicContact CD2-CG1 3.8Å; L265-I269 HydrophobicContact CD1-CD1 4.3Å; L265-I269 HydrophobicContact CD1-CG1 4.45Å; L265-I269 HydrophobicContact CG-CD1 3.93Å; L265-I269 HydrophobicContact CG-CG1 4.49Å; L265-I269 WeakPolarHBondContact O-CG1 3.33Å; L265-I269 PolarHBondContact O-N 2.84Å; G266-I269 PolarHBondContact O-N 2.72Å; R267-I269 VanDerWaalsContact C-N 3.32Å; R267-I269 PolarHBondContact O-N 2.83Å; I269-L273 VanDerWaalsContact O-CA 3.32Å; I269-L273 WeakPolarHBondContact O-CA 3.42Å; I269-L273 WeakPolarHBondContact O-CB 3.48Å; I269-L273 PolarHBondContact O-N 3.28Å; I269-G274 PolarHBondContact O-N 3.21Å; I269-L275 HydrophobicContact CG2-CB 3.79Å; I269-L275 WeakPolarHBondContact CG2-O 3.45Å
270	I	92.1	Very high	93.3	Very high	22 Å²	22	37.2 Å²	37.2	11%	0.113	20%	0.203	C	C	.	.	H	α-helix	trans	-70.3	-49.7	-178.3	-72.6	159.9	0	0	0	111.3	F219 A226 G266 R267 Y272 G274 L275	F219-I270 HydrophobicContact CE2-CD1 3.32Å; F219-I270 HydrophobicContact CZ-CD1 3.44Å; F219-I270 VanDerWaalsContact CZ-CD1 3.44Å; A226-I270 HydrophobicContact CB-CD1 3.7Å; A226-I270 HydrophobicContact CB-CG1 4.44Å; A226-I270 HydrophobicContact CB-CG2 4.1Å; G266-I270 WeakPolarHBondContact O-CD1 3.42Å; G266-I270 WeakPolarHBondContact O-CG1 3.44Å; G266-I270 PolarHBondContact O-N 2.87Å; R267-I270 PolarHBondContact O-N 2.91Å; R267-I270 VanDerWaalsContact O-N 3.11Å; I270-Y272 VanDerWaalsContact C-N 3.29Å; I270-Y272 PolarHBondContact O-N 3.09Å; I270-G274 WeakPolarHBondContact O-CA 3.33Å; I270-G274 PolarHBondContact O-N 2.86Å; I270-L275 WeakPolarHBondContact CG1-O 3.39Å
271	D	91	Very high	93.4	Very high	115 Å²	115	35.7 Å²	35.7	62%	0.615	20%	0.2	S	C	*	.	H	α-helix	trans	-62.6	-35.7	-174.2	-64.8	-20.6	0	0	0	112.2	R267	R267-D271 WeakPolarHBondContact O-CB 3.43Å; R267-D271 PolarHBondContact O-N 3.34Å
272	Y	93.1	Very high	93.2	Very high	90 Å²	90	38.8 Å²	38.8	35%	0.353	21%	0.212	S	C	.	.	H	α-helix	trans	-102.9	-30	-176.2	-69.7	-82.1	0	0	0	114.6	H248 T251 C252 C268 I270	H248-Y272 HydrophobicContact CB-CD1 3.73Å; H248-Y272 HydrophobicContact CB-CD2 3.96Å; H248-Y272 HydrophobicContact CB-CE1 4.13Å; H248-Y272 HydrophobicContact CB-CE2 4.37Å; H248-Y272 HydrophobicContact CB-CG 3.62Å; H248-Y272 AromaticContact CE1-CD1 3.77Å; H248-Y272 AromaticContact CG-CD1 3.4Å; H248-Y272 AromaticContact CG-CG 3.63Å; H248-Y272 AromaticContact ND1-CD1 3.16Å; H248-Y272 WeakPolarHBondContact ND1-CD1 3.2Å; H248-Y272 AromaticContact ND1-CE1 3.56Å; H248-Y272 AromaticContact ND1-CG 3.91Å; T251-Y272 WeakPolarHBondContact CB-OH 3.26Å; T251-Y272 WeakPolarHBondContact CG2-OH 3.4Å; C252-Y272 WeakPolarHBondContact SG-CD2 3.48Å; C252-Y272 WeakPolarHBondContact SG-CE2 3.42Å; C268-Y272 WeakPolarHBondContact O-CD2 3.47Å; C268-Y272 PolarHBondContact O-N 3.14Å; I270-Y272 VanDerWaalsContact C-N 3.29Å; I270-Y272 PolarHBondContact O-N 3.09Å
273	L	93.4	Very high	93	Very high	19 Å²	19	41.9 Å²	41.9	10%	0.099	25%	0.246	C	C	.	.	H	α-helix	trans	-112.2	-15.1	-176	-50	-179.1	0	0	0	113.5	L241 R244 L245 I269 L275	L241-L273 HydrophobicContact CD2-CD1 4.4Å; L241-L273 HydrophobicContact CG-CD1 4.05Å; R244-L273 HydrophobicContact CB-CD1 4.24Å; R244-L273 HydrophobicContact CB-CD2 3.77Å; L245-L273 HydrophobicContact CB-CD1 4.06Å; L245-L273 HydrophobicContact CD1-CD1 4.03Å; L245-L273 HydrophobicContact CD1-CG 4.37Å; I269-L273 VanDerWaalsContact O-CA 3.32Å; I269-L273 WeakPolarHBondContact O-CA 3.42Å; I269-L273 WeakPolarHBondContact O-CB 3.48Å; I269-L273 PolarHBondContact O-N 3.28Å; L273-L275 VanDerWaalsContact C-N 3.26Å; L273-L275 HydrophobicContact CB-CD1 3.93Å; L273-L275 HydrophobicContact CB-CG 4.03Å; L273-L275 HydrophobicContact CD1-CD1 4.27Å; L273-L275 PolarHBondContact O-N 3.27Å
274	G	91.8	Very high	93	Very high	61 Å²	61	44 Å²	44	63%	0.629	26%	0.256	S	S	*	.			trans	68.8	21.3	-177.7	0	0	0	0	0	114	I269 I270	I269-G274 PolarHBondContact O-N 3.21Å; I270-G274 WeakPolarHBondContact O-CA 3.33Å; I270-G274 PolarHBondContact O-N 2.86Å
275	L	92.9	Very high	93.1	Very high	40 Å²	40	46.6 Å²	46.6	21%	0.209	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-102.8	121.2	-175.2	-61.1	171	0	0	0	110.9	D210 L241 I269 I270 L273	D210-L275 HydrophobicContact CB-CD1 3.75Å; D210-L275 HydrophobicContact CB-CD2 4.44Å; L241-L275 HydrophobicContact CD1-CD1 3.7Å; L241-L275 HydrophobicContact CG-CD1 4.06Å; I269-L275 HydrophobicContact CG2-CB 3.79Å; I269-L275 WeakPolarHBondContact CG2-O 3.45Å; I270-L275 WeakPolarHBondContact CG1-O 3.39Å; L273-L275 VanDerWaalsContact C-N 3.26Å; L273-L275 HydrophobicContact CB-CD1 3.93Å; L273-L275 HydrophobicContact CB-CG 4.03Å; L273-L275 HydrophobicContact CD1-CD1 4.27Å; L273-L275 PolarHBondContact O-N 3.27Å
276	S	93.7	Very high	93.1	Very high	47 Å²	47	46.7 Å²	46.7	33%	0.329	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-89.4	152.5	172.6	-175.8	0	0	0	0	111.1	R227 V278	R227-S276 PolarHBondContact N-OG 2.93Å; R227-S276 PolarHBondContact O-OG 2.99Å; S276-V278 PolarHBondContact O-N 3.45Å
277	C	95.6	Very high	93.3	Very high	5 Å²	5	52.1 Å²	52.1	3%	0.034	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-59.7	133.9	169	-178.2	0	0	0	0	110.8	Y212 A216 R227 C229	Y212-C277 HydrophobicContact CD1-CB 3.92Å; Y212-C277 HydrophobicContact CE1-CB 3.81Å; A216-C277 HydrophobicContact CB-CB 4.25Å; R227-C277 WeakPolarHBondContact O-CB 3.46Å; R227-C277 PolarHBondContact O-N 3.31Å; C229-C277 WeakPolarHBondContact CA-SG 3.41Å; C229-C277 HydrophobicContact CB-CB 4.02Å; C229-C277 WeakPolarHBondContact CB-SG 3.41Å; C229-C277 PolarHBondContact N-SG 3.09Å; C229-C277 WeakPolarHBondContact SG-CB 3.35Å; C229-C277 CovalentContact SG-SG 2.03Å; C229-C277 PolarHBondContact SG-SG 3.45Å
278	V	95.2	Very high	93.5	Very high	49 Å²	49	52.9 Å²	52.9	30%	0.297	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-119.3	143.5	177	-61.8	0	0	0	0	112.1	L211 Y212 M213 G214 S276	L211-V278 HydrophobicContact CD1-CG2 3.47Å; L211-V278 VanDerWaalsContact CD1-CG2 3.47Å; Y212-V278 WeakPolarHBondContact O-CG2 3.49Å; Y212-V278 PolarHBondContact O-N 2.91Å; M213-V278 VanDerWaalsContact CA-O 3.28Å; M213-V278 WeakPolarHBondContact CA-O 3.22Å; M213-V278 HydrophobicContact CB-CG2 4.29Å; M213-V278 HydrophobicContact CG-CG2 4.48Å; M213-V278 WeakPolarHBondContact CG-O 3.45Å; G214-V278 PolarHBondContact N-O 3.12Å; G214-V278 VanDerWaalsContact N-O 3.09Å; S276-V278 PolarHBondContact O-N 3.45Å
279	E	95	Very high	93.7	Very high	58 Å²	58	54.1 Å²	54.1	27%	0.271	30%	0.303	S	S	.	.	S	Bend	trans	-96.2	-22.6	175	-70.3	179.2	155.3	0	0	112.4	G214 A216 T285 Y286	G214-E279 VanDerWaalsContact O-CG 3.28Å; G214-E279 WeakPolarHBondContact O-CG 3.4Å; A216-E279 HydrophobicContact CB-CG 3.94Å; A216-E279 PolarHBondContact N-OE1 3.32Å; A216-E279 VanDerWaalsContact N-OE1 3.1Å; E279-T285 CarbonylContact O-C 3.55Å; E279-T285 WeakPolarHBondContact O-CA 3.14Å; E279-Y286 PolarHBondContact O-N 3.27Å
280	V	95	Very high	93.7	Very high	86 Å²	86	59.8 Å²	59.8	52%	0.521	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	126.2	-177.4	-176.5	0	0	0	0	109.5	M284 T285	V280-M284 CarbonylContact C-O 3.03Å; V280-M284 VanDerWaalsContact CA-O 3.27Å; V280-M284 WeakPolarHBondContact CA-O 3.42Å; V280-T285 HydrophobicContact CG2-CG2 4Å
281	H	93.1	Very high	93.7	Very high	49 Å²	49	59.1 Å²	59.1	23%	0.227	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	136	174.1	-168.6	59	0	0	0	110.2	Q209 L211 M213 G283 M284	Q209-H281 PolarHBondContact OE1-CE1 2.76Å; Q209-H281 PolarHBondContact OE1-NE2 3.23Å; L211-H281 HydrophobicContact CD1-CB 3.99Å; L211-H281 HydrophobicContact CD2-CB 4.31Å; M213-H281 HydrophobicContact SD-CB 4.35Å; H281-G283 PolarHBondContact O-N 3.37Å; H281-G283 VanDerWaalsContact O-N 3.14Å; H281-M284 PolarHBondContact N-O 2.94Å; H281-M284 WeakPolarHBondContact O-CA 3.3Å; H281-M284 WeakPolarHBondContact O-CB 3.39Å; H281-M284 PolarHBondContact O-N 3.48Å
282	Q	89.1	Confident	93.7	Very high	87 Å²	87	55.8 Å²	55.8	41%	0.407	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	36	179	-65.8	179.5	-27.4	0	0	114.4	S206 M284	S206-Q282 PolarHBondContact OG-NE2 3.39Å; S206-Q282 PolarHBondContact OG-OE1 3.02Å; Q282-M284 PolarHBondContact O-N 2.96Å
283	G	88.9	Confident	93.1	Very high	73 Å²	73	61.3 Å²	61.3	75%	0.753	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	-1.4	-177.4	0	0	0	0	0	114.8	H281	H281-G283 PolarHBondContact O-N 3.37Å; H281-G283 VanDerWaalsContact O-N 3.14Å
284	M	92.2	Very high	92.5	Very high	51 Å²	51	68.3 Å²	68.3	25%	0.251	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	134.9	174.9	-56.7	-59.5	-73.8	0	0	110.3	L201 H204 M213 V280 H281 Q282	L201-M284 HydrophobicContact CD1-CB 3.57Å; L201-M284 HydrophobicContact CD1-CE 3.85Å; L201-M284 HydrophobicContact CD1-CG 4.17Å; H204-M284 HydrophobicContact CB-CE 4.16Å; H204-M284 HydrophobicContact CB-CG 4.18Å; H204-M284 HydrophobicContact CB-SD 4.22Å; M213-M284 WeakPolarHBondContact CE-O 3.39Å; V280-M284 CarbonylContact C-O 3.03Å; V280-M284 VanDerWaalsContact CA-O 3.27Å; V280-M284 WeakPolarHBondContact CA-O 3.42Å; H281-M284 PolarHBondContact N-O 2.94Å; H281-M284 WeakPolarHBondContact O-CA 3.3Å; H281-M284 WeakPolarHBondContact O-CB 3.39Å; H281-M284 PolarHBondContact O-N 3.48Å; Q282-M284 PolarHBondContact O-N 2.96Å
285	T	95	Very high	92.1	Very high	63 Å²	63	67 Å²	67	39%	0.387	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	132.2	177.2	-52.1	0	0	0	0	110.1	E279 V280 R287 F309	E279-T285 CarbonylContact O-C 3.55Å; E279-T285 WeakPolarHBondContact O-CA 3.14Å; V280-T285 HydrophobicContact CG2-CG2 4Å; T285-R287 PolarHBondContact O-N 2.99Å; T285-R287 VanDerWaalsContact O-N 3.14Å; T285-F309 VanDerWaalsContact O-CE2 3.22Å; T285-F309 WeakPolarHBondContact O-CE2 3.2Å
286	Y	95.8	Very high	91.9	Very high	2 Å²	2	67.5 Å²	67.5	1%	0.008	37%	0.368	C	S	.	.			trans	-73.3	100.8	171.3	-166.5	-92.7	0	0	0	109.3	L198 L201 M213 Y233 G234 E279 Y288 F309 T310	L198-Y286 HydrophobicContact CD2-CE2 4.03Å; L201-Y286 HydrophobicContact CD2-CD2 3.94Å; L201-Y286 HydrophobicContact CD2-CE2 4.45Å; M213-Y286 HydrophobicContact CG-CD2 4.39Å; Y233-Y286 PolarHBondContact O-OH 2.92Å; G234-Y286 VanDerWaalsContact C-OH 3.29Å; G234-Y286 PolarHBondContact O-OH 3.28Å; E279-Y286 PolarHBondContact O-N 3.27Å; Y286-Y288 HydrophobicContact CD1-CD1 4.26Å; Y286-F309 HydrophobicContact CD2-CD2 4.42Å; Y286-T310 WeakPolarHBondContact OH-CG2 3.3Å
287	R	96.6	Very high	91.7	Very high	115 Å²	115	65.2 Å²	65.2	43%	0.434	35%	0.352	S	S	.	.			trans	-88.9	126.3	-175.6	-61.5	-179	-179.1	165.3	-0.2	110.1	T285 N307 F309	T285-R287 PolarHBondContact O-N 2.99Å; T285-R287 VanDerWaalsContact O-N 3.14Å; R287-N307 WeakPolarHBondContact CB-O 3.39Å; R287-N307 WeakPolarHBondContact CD-O 3.28Å; R287-F309 HydrophobicContact CB-CD1 4.26Å; R287-F309 HydrophobicContact CB-CD2 4.24Å; R287-F309 HydrophobicContact CB-CE1 4.25Å; R287-F309 HydrophobicContact CB-CE2 4.21Å; R287-F309 HydrophobicContact CB-CG 4.27Å; R287-F309 HydrophobicContact CB-CZ 4.23Å; R287-F309 HydrophobicContact CG-CE1 4.45Å; R287-F309 HydrophobicContact CG-CE2 4.35Å; R287-F309 HydrophobicContact CG-CZ 4.15Å; R287-F309 VanDerWaalsContact O-CB 3.3Å; R287-F309 WeakPolarHBondContact O-CB 3.45Å; R287-F309 PolarHBondContact O-N 3.49Å
288	Y	95.9	Very high	91.3	Very high	75 Å²	75	68.6 Å²	68.6	29%	0.294	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	162	178.3	61.6	-92.9	0	0	0	110.2	R215 Y233 Y286 T310	R215-Y288 HydrophobicContact CB-CD1 3.8Å; R215-Y288 HydrophobicContact CB-CD2 4.49Å; R215-Y288 HydrophobicContact CB-CE1 3.73Å; R215-Y288 HydrophobicContact CB-CE2 4.46Å; R215-Y288 HydrophobicContact CB-CG 4.2Å; R215-Y288 VanDerWaalsContact CD-CE2 3.41Å; R215-Y288 HydrophobicContact CG-CD1 4.14Å; R215-Y288 HydrophobicContact CG-CD2 4.27Å; R215-Y288 HydrophobicContact CG-CE1 3.65Å; R215-Y288 HydrophobicContact CG-CE2 3.81Å; R215-Y288 HydrophobicContact CG-CG 4.43Å; R215-Y288 VanDerWaalsContact CG-CZ 3.48Å; Y233-Y288 AromaticContact CD1-CD2 3.87Å; Y233-Y288 HydrophobicContact CD1-CD2 3.87Å; Y233-Y288 HydrophobicContact CD1-CG 4.1Å; Y233-Y288 AromaticContact CE1-CD2 3.88Å; Y233-Y288 HydrophobicContact CE1-CD2 3.88Å; Y233-Y288 HydrophobicContact CG-CD2 4.44Å; Y233-Y288 HydrophobicContact CG-CG 4.5Å; Y286-Y288 HydrophobicContact CD1-CD1 4.26Å; Y288-T310 CarbonylContact C-O 3.56Å; Y288-T310 WeakPolarHBondContact CA-O 3.45Å
289	F	96.8	Very high	91	Very high	30 Å²	30	76 Å²	76	13%	0.132	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	129.8	175.8	-173.1	-95.3	0	0	0	111.8	L291 E300 A304 F305 A308 T310 V311 H312	F289-L291 HydrophobicContact CE1-CD1 4.18Å; F289-E300 HydrophobicContact CE1-CG 4.25Å; F289-E300 HydrophobicContact CZ-CG 3.92Å; F289-A304 HydrophobicContact CD2-CB 4.06Å; F289-A304 HydrophobicContact CE2-CB 4.38Å; F289-F305 HydrophobicContact CD1-CB 4.4Å; F289-F305 AromaticContact CD1-CD2 3.6Å; F289-F305 HydrophobicContact CD1-CD2 3.6Å; F289-F305 HydrophobicContact CD1-CE2 4.41Å; F289-F305 HydrophobicContact CD1-CG 4.48Å; F289-F305 HydrophobicContact CD2-CB 3.79Å; F289-F305 HydrophobicContact CD2-CD2 4.45Å; F289-F305 HydrophobicContact CE1-CB 4.33Å; F289-F305 AromaticContact CE1-CD2 3.75Å; F289-F305 HydrophobicContact CE1-CD2 3.75Å; F289-F305 HydrophobicContact CE1-CG 4.45Å; F289-F305 HydrophobicContact CE2-CB 3.72Å; F289-F305 HydrophobicContact CG-CB 4.12Å; F289-F305 AromaticContact CG-CD2 3.95Å; F289-F305 HydrophobicContact CG-CD2 3.95Å; F289-F305 HydrophobicContact CZ-CB 3.99Å; F289-F305 HydrophobicContact CZ-CD2 4.26Å; F289-A308 HydrophobicContact CB-CB 3.74Å; F289-T310 PolarHBondContact N-O 3.28Å; F289-V311 HydrophobicContact CB-CG2 4.27Å; F289-V311 HydrophobicContact CD1-CG1 4.23Å; F289-V311 WeakPolarHBondContact O-CA 3.38Å; F289-H312 PolarHBondContact O-N 3.43Å; F289-H312 VanDerWaalsContact O-N 3.15Å
290	E	95.6	Very high	90.9	Very high	118 Å²	118	75.6 Å²	75.6	55%	0.551	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	115.4	175.5	-173.3	166.8	175	0	0	110.1	R215 Y233 H312	R215-E290 IonicContact NH2-OE2 3.93Å; Y233-E290 HydrophobicContact CE1-CB 4.38Å; Y233-E290 VanDerWaalsContact OH-CB 3.28Å; Y233-E290 WeakPolarHBondContact OH-CB 3.5Å; Y233-E290 WeakPolarHBondContact OH-CG 3.3Å; Y233-E290 PolarHBondContact OH-OE2 2.89Å; E290-H312 CarbonylContact C-O 3.55Å; E290-H312 VanDerWaalsContact CA-O 3.26Å; E290-H312 WeakPolarHBondContact CA-O 3.4Å
291	L	93.1	Very high	90.7	Very high	9 Å²	9	75.9 Å²	75.9	5%	0.047	39%	0.387	C	S	.	.			trans	-84	124	-177.5	-168	67.8	0	0	0	110.9	F289 A295 V311 H312 L319 L323	F289-L291 HydrophobicContact CE1-CD1 4.18Å; L291-A295 HydrophobicContact CD1-CB 3.7Å; L291-A295 HydrophobicContact CG-CB 4.18Å; L291-V311 HydrophobicContact CB-CG1 3.86Å; L291-V311 HydrophobicContact CD1-CG1 4.44Å; L291-V311 HydrophobicContact CD2-CG1 4.41Å; L291-V311 HydrophobicContact CG-CG1 4.47Å; L291-H312 PolarHBondContact N-O 2.93Å; L291-L319 HydrophobicContact CD2-CD1 4.21Å; L291-L319 HydrophobicContact CD2-CD2 3.76Å; L291-L319 HydrophobicContact CD2-CG 4.24Å; L291-L323 HydrophobicContact CD2-CD1 4.35Å
292	G	89.7	Confident	90.7	Very high	44 Å²	44	75.5 Å²	75.5	45%	0.454	39%	0.389	S	S	.	.			trans	-64.1	146.7	174.2	0	0	0	0	0	112.3	N294 A295	G292-N294 PolarHBondContact O-N 3.42Å; G292-A295 WeakPolarHBondContact O-CB 3.29Å; G292-A295 PolarHBondContact O-N 3.32Å
293	K	81.5	Confident	91	Very high	207 Å²	207	76.5 Å²	76.5	90%	0.9	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-22.1	-173.8	-67.1	-177.5	178.6	179.4	0	116
294	N	79.5	Confident	91.2	Very high	165 Å²	165	75.9 Å²	75.9	88%	0.882	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.1	21.8	177.4	-65.2	-35.5	0	0	0	112.1	G292	G292-N294 PolarHBondContact O-N 3.42Å
295	A	83.2	Confident	91.4	Very high	34 Å²	34	73.4 Å²	73.4	28%	0.281	38%	0.377	S	S	.	.			trans	-72.3	132.3	-178.2	0	0	0	0	0	110.3	L291 G292 P297	L291-A295 HydrophobicContact CD1-CB 3.7Å; L291-A295 HydrophobicContact CG-CB 4.18Å; G292-A295 WeakPolarHBondContact O-CB 3.29Å; G292-A295 PolarHBondContact O-N 3.32Å; A295-P297 WeakPolarHBondContact O-CD 3.36Å
296	D	88.4	Confident	91.4	Very high	50 Å²	50	73.2 Å²	73.2	27%	0.267	37%	0.371	S	S	.	.			trans	-90.1	110.8	173.8	-175.5	7.2	0	0	0	109.2	E298 R299 E300 R322	D296-E298 PolarHBondContact O-N 3.33Å; D296-E298 VanDerWaalsContact O-N 3.12Å; D296-E298 PolarHBondContact OD1-N 2.96Å; D296-R299 HydrophobicContact CB-CB 4.37Å; D296-R299 HydrophobicContact CB-CG 4.35Å; D296-R299 PolarHBondContact O-N 3.33Å; D296-R299 IonicContact OD2-NE 3.16Å; D296-E300 PolarHBondContact O-N 2.87Å; D296-R322 IonicContact OD1-CZ 3.77Å; D296-R322 IonicContact OD1-NH1 3.02Å; D296-R322 IonicContact OD1-NH2 2.63Å; D296-R322 PolarHBondContact OD1-NH2 3.44Å; D296-R322 IonicContact OD2-NH2 3.06Å
297	P	89.9	Confident	91.4	Very high	0 Å²	0	75.2 Å²	75.2	0%	0	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-25.4	-176.7	26.5	-36.5	0	0	0	112.7	A295 R299 E300 F305 L319 R322 L323 R326	A295-P297 WeakPolarHBondContact O-CD 3.36Å; P297-R299 VanDerWaalsContact C-N 3.28Å; P297-R299 PolarHBondContact O-N 3.46Å; P297-E300 PolarHBondContact O-N 2.88Å; P297-F305 HydrophobicContact CB-CZ 4.29Å; P297-L319 HydrophobicContact CG-CD1 3.94Å; P297-R322 HydrophobicContact CG-CB 4.04Å; P297-L323 HydrophobicContact CB-CD2 3.59Å; P297-L323 HydrophobicContact CB-CG 4.14Å; P297-L323 HydrophobicContact CG-CD2 4.43Å; P297-L323 HydrophobicContact CG-CG 4.49Å; P297-R326 WeakPolarHBondContact O-CG 3.44Å
298	E	88.1	Confident	91.3	Very high	75 Å²	75	69.7 Å²	69.7	35%	0.35	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-22.4	178.5	-69.2	-178.9	143.4	0	0	112.8	D296 R322 K325	D296-E298 PolarHBondContact O-N 3.33Å; D296-E298 VanDerWaalsContact O-N 3.12Å; D296-E298 PolarHBondContact OD1-N 2.96Å; E298-R322 IonicContact OE2-CZ 2.71Å; E298-R322 IonicContact OE2-NH2 3.9Å; E298-R322 PolarHBondContact OE2-NH2 2.75Å; E298-K325 IonicContact OE1-NZ 3.66Å; E298-K325 PolarHBondContact OE1-NZ 3.23Å
299	R	89.3	Confident	91.3	Very high	206 Å²	206	67 Å²	67	78%	0.777	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-8.2	177.7	-63.5	-177.8	-178.5	-166.9	-2	113.4	D296 P297 D301	D296-R299 HydrophobicContact CB-CB 4.37Å; D296-R299 HydrophobicContact CB-CG 4.35Å; D296-R299 PolarHBondContact O-N 3.33Å; D296-R299 IonicContact OD2-NE 3.16Å; P297-R299 VanDerWaalsContact C-N 3.28Å; P297-R299 PolarHBondContact O-N 3.46Å; R299-D301 PolarHBondContact O-N 3.19Å
300	E	91.9	Very high	91.4	Very high	48 Å²	48	65.6 Å²	65.6	22%	0.224	34%	0.344	C	S	.	.			trans	-75.7	119	178.3	-173.4	54.6	-115.8	0	0	109.7	F289 D296 P297 S302 F305 R326	F289-E300 HydrophobicContact CE1-CG 4.25Å; F289-E300 HydrophobicContact CZ-CG 3.92Å; D296-E300 PolarHBondContact O-N 2.87Å; P297-E300 PolarHBondContact O-N 2.88Å; E300-S302 WeakPolarHBondContact OE1-CB 3.49Å; E300-S302 PolarHBondContact OE1-N 3.14Å; E300-S302 PolarHBondContact OE1-OG 3.28Å; E300-F305 HydrophobicContact CB-CD1 3.95Å; E300-F305 HydrophobicContact CB-CD2 4.44Å; E300-F305 HydrophobicContact CB-CE1 4.07Å; E300-F305 HydrophobicContact CB-CG 4.14Å; E300-F305 HydrophobicContact CB-CZ 4.36Å; E300-F305 HydrophobicContact CG-CB 3.53Å; E300-F305 HydrophobicContact CG-CD1 3.6Å; E300-F305 HydrophobicContact CG-CD2 3.74Å; E300-F305 HydrophobicContact CG-CE1 4.18Å; E300-F305 HydrophobicContact CG-CE2 4.29Å; E300-F305 HydrophobicContact CG-CG 3.34Å; E300-F305 HydrophobicContact CG-CZ 4.49Å; E300-R326 PolarHBondContact O-NH2 3.12Å
301	D	90.4	Very high	91.4	Very high	92 Å²	92	60 Å²	60	49%	0.492	32%	0.318	S	S	.	.			trans	-127.7	3.8	-173.6	-95.5	-40.6	0	0	0	113.3	R299 K306 R326	R299-D301 PolarHBondContact O-N 3.19Å; D301-K306 WeakPolarHBondContact O-CE 3.3Å; D301-K306 PolarHBondContact O-NZ 2.9Å; D301-K306 VanDerWaalsContact O-NZ 3.07Å; D301-K306 WeakPolarHBondContact OD1-CE 3.47Å; D301-K306 IonicContact OD1-NZ 2.88Å; D301-K306 PolarHBondContact OD1-NZ 3.11Å; D301-R326 IonicContact OD1-NH2 2.96Å; D301-R326 PolarHBondContact OD1-NH2 2.83Å
302	S	94.6	Very high	91.6	Very high	41 Å²	41	60.5 Å²	60.5	29%	0.287	32%	0.32	S	S	.	.			trans	-60.4	148.6	178.5	63.9	0	0	0	0	112.5	E300 A304 F305 K306	E300-S302 WeakPolarHBondContact OE1-CB 3.49Å; E300-S302 PolarHBondContact OE1-N 3.14Å; E300-S302 PolarHBondContact OE1-OG 3.28Å; S302-A304 PolarHBondContact O-N 2.84Å; S302-F305 PolarHBondContact O-N 2.96Å; S302-F305 VanDerWaalsContact OG-CB 3.3Å; S302-F305 WeakPolarHBondContact OG-CB 3.49Å; S302-F305 PolarHBondContact OG-N 3.08Å; S302-K306 WeakPolarHBondContact O-CG 3.47Å; S302-K306 PolarHBondContact O-N 3.1Å
303	V	94.6	Very high	91.9	Very high	109 Å²	109	61.1 Å²	61.1	66%	0.661	32%	0.316	S	S	*	.	H	α-helix	trans	-62.4	-34.1	177.9	179.4	0	0	0	0	111	N307	V303-N307 VanDerWaalsContact CG1-ND2 3.31Å; V303-N307 WeakPolarHBondContact CG1-ND2 3.3Å; V303-N307 VanDerWaalsContact O-CB 3.31Å; V303-N307 WeakPolarHBondContact O-CB 3.37Å; V303-N307 PolarHBondContact O-N 3.04Å; V303-N307 VanDerWaalsContact O-N 3.14Å; V303-N307 PolarHBondContact O-ND2 3.36Å
304	A	94.1	Very high	92.5	Very high	59 Å²	59	51.3 Å²	51.3	49%	0.488	27%	0.274	S	S	.	.	H	α-helix	trans	-64.2	-48.6	176.4	0	0	0	0	0	111.5	F289 S302 N307 A308	F289-A304 HydrophobicContact CD2-CB 4.06Å; F289-A304 HydrophobicContact CE2-CB 4.38Å; S302-A304 PolarHBondContact O-N 2.84Å; A304-N307 PolarHBondContact O-N 2.95Å; A304-A308 PolarHBondContact O-N 2.95Å; A304-A308 VanDerWaalsContact O-N 3.07Å
305	F	95.6	Very high	93.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.8	-49.9	177	178.2	-105.5	0	0	0	112	F289 P297 E300 S302 N307 A308 V311 L323 R326 F327 I330	F289-F305 HydrophobicContact CD1-CB 4.4Å; F289-F305 AromaticContact CD1-CD2 3.6Å; F289-F305 HydrophobicContact CD1-CD2 3.6Å; F289-F305 HydrophobicContact CD1-CE2 4.41Å; F289-F305 HydrophobicContact CD1-CG 4.48Å; F289-F305 HydrophobicContact CD2-CB 3.79Å; F289-F305 HydrophobicContact CD2-CD2 4.45Å; F289-F305 HydrophobicContact CE1-CB 4.33Å; F289-F305 AromaticContact CE1-CD2 3.75Å; F289-F305 HydrophobicContact CE1-CD2 3.75Å; F289-F305 HydrophobicContact CE1-CG 4.45Å; F289-F305 HydrophobicContact CE2-CB 3.72Å; F289-F305 HydrophobicContact CG-CB 4.12Å; F289-F305 AromaticContact CG-CD2 3.95Å; F289-F305 HydrophobicContact CG-CD2 3.95Å; F289-F305 HydrophobicContact CZ-CB 3.99Å; F289-F305 HydrophobicContact CZ-CD2 4.26Å; P297-F305 HydrophobicContact CB-CZ 4.29Å; E300-F305 HydrophobicContact CB-CD1 3.95Å; E300-F305 HydrophobicContact CB-CD2 4.44Å; E300-F305 HydrophobicContact CB-CE1 4.07Å; E300-F305 HydrophobicContact CB-CG 4.14Å; E300-F305 HydrophobicContact CB-CZ 4.36Å; E300-F305 HydrophobicContact CG-CB 3.53Å; E300-F305 HydrophobicContact CG-CD1 3.6Å; E300-F305 HydrophobicContact CG-CD2 3.74Å; E300-F305 HydrophobicContact CG-CE1 4.18Å; E300-F305 HydrophobicContact CG-CE2 4.29Å; E300-F305 HydrophobicContact CG-CG 3.34Å; E300-F305 HydrophobicContact CG-CZ 4.49Å; S302-F305 PolarHBondContact O-N 2.96Å; S302-F305 VanDerWaalsContact OG-CB 3.3Å; S302-F305 WeakPolarHBondContact OG-CB 3.49Å; S302-F305 PolarHBondContact OG-N 3.08Å; F305-N307 PolarHBondContact O-N 2.76Å; F305-N307 VanDerWaalsContact O-N 3.15Å; F305-A308 WeakPolarHBondContact O-CB 3.24Å; F305-A308 PolarHBondContact O-N 3.24Å; F305-A308 VanDerWaalsContact O-N 3.12Å; F305-V311 HydrophobicContact CE2-CG2 4.29Å; F305-L323 HydrophobicContact CE2-CD2 3.79Å; F305-L323 HydrophobicContact CZ-CD2 3.94Å; F305-R326 HydrophobicContact CE1-CG 3.91Å; F305-R326 HydrophobicContact CZ-CG 4.18Å; F305-F327 HydrophobicContact CD2-CE2 4.26Å; F305-F327 HydrophobicContact CD2-CZ 4.2Å; F305-F327 HydrophobicContact CE1-CE2 4.11Å; F305-F327 HydrophobicContact CE1-CZ 4.44Å; F305-F327 AromaticContact CE2-CE2 3.55Å; F305-F327 HydrophobicContact CE2-CE2 3.55Å; F305-F327 AromaticContact CE2-CZ 3.95Å; F305-F327 HydrophobicContact CE2-CZ 3.95Å; F305-F327 HydrophobicContact CZ-CD2 4.18Å; F305-F327 AromaticContact CZ-CE2 3.46Å; F305-F327 HydrophobicContact CZ-CE2 3.46Å; F305-F327 VanDerWaalsContact CZ-CE2 3.46Å; F305-F327 HydrophobicContact CZ-CZ 4.08Å; F305-F327 WeakPolarHBondContact O-CZ 3.44Å; F305-I330 HydrophobicContact CE1-CD1 4.25Å
306	K	94.6	Very high	93.7	Very high	59 Å²	59	48.9 Å²	48.9	26%	0.257	26%	0.263	S	S	.	.	H	α-helix	trans	-57.3	-33.9	-179.2	-74.8	177.1	176.4	160.1	0	112.4	R197 D301 S302 I330 W334	R197-K306 PolarHBondContact NH1-O 2.85Å; R197-K306 PolarHBondContact NH2-O 3.04Å; D301-K306 WeakPolarHBondContact O-CE 3.3Å; D301-K306 PolarHBondContact O-NZ 2.9Å; D301-K306 VanDerWaalsContact O-NZ 3.07Å; D301-K306 WeakPolarHBondContact OD1-CE 3.47Å; D301-K306 IonicContact OD1-NZ 2.88Å; D301-K306 PolarHBondContact OD1-NZ 3.11Å; S302-K306 WeakPolarHBondContact O-CG 3.47Å; S302-K306 PolarHBondContact O-N 3.1Å; K306-I330 HydrophobicContact CG-CD1 4.18Å; K306-W334 HydrophobicContact CB-CZ2 4.17Å; K306-W334 WeakPolarHBondContact O-CH2 3.39Å
307	N	94.9	Very high	94	Very high	43 Å²	43	48.3 Å²	48.3	23%	0.23	26%	0.262	C	S	.	.	H	α-helix	trans	-97	0.3	-178	-70.5	-42.8	0	0	0	114.9	R197 R287 V303 A304 F305 W334	R197-N307 VanDerWaalsContact NH1-CA 3.31Å; R197-N307 PolarHBondContact NH1-O 3.11Å; R287-N307 WeakPolarHBondContact CB-O 3.39Å; R287-N307 WeakPolarHBondContact CD-O 3.28Å; V303-N307 VanDerWaalsContact CG1-ND2 3.31Å; V303-N307 WeakPolarHBondContact CG1-ND2 3.3Å; V303-N307 VanDerWaalsContact O-CB 3.31Å; V303-N307 WeakPolarHBondContact O-CB 3.37Å; V303-N307 PolarHBondContact O-N 3.04Å; V303-N307 VanDerWaalsContact O-N 3.14Å; V303-N307 PolarHBondContact O-ND2 3.36Å; A304-N307 PolarHBondContact O-N 2.95Å; F305-N307 PolarHBondContact O-N 2.76Å; F305-N307 VanDerWaalsContact O-N 3.15Å; N307-W334 VanDerWaalsContact OD1-CH2 3.27Å; N307-W334 WeakPolarHBondContact OD1-CH2 3.24Å
308	A	96.4	Very high	94.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.291	C	S	.	.			trans	-69.2	145.6	-177	0	0	0	0	0	113	R197 F289 A304 F305 V311 F327	R197-A308 PolarHBondContact NH1-O 3.34Å; F289-A308 HydrophobicContact CB-CB 3.74Å; A304-A308 PolarHBondContact O-N 2.95Å; A304-A308 VanDerWaalsContact O-N 3.07Å; F305-A308 WeakPolarHBondContact O-CB 3.24Å; F305-A308 PolarHBondContact O-N 3.24Å; F305-A308 VanDerWaalsContact O-N 3.12Å; A308-V311 HydrophobicContact CB-CG2 4.5Å; A308-F327 HydrophobicContact CB-CZ 4.38Å
309	F	95.6	Very high	94.6	Very high	19 Å²	19	51 Å²	51	8%	0.083	28%	0.279	C	S	.	.	S	Bend	trans	-89.9	-36.4	170.8	-54.3	-24.6	0	0	0	110.7	Q194 R197 L198 L201 T285 Y286 R287	Q194-F309 PolarHBondContact N-O 3.35Å; R197-F309 HydrophobicContact CB-CD1 3.6Å; R197-F309 HydrophobicContact CB-CE1 3.96Å; R197-F309 HydrophobicContact CB-CG 4.41Å; R197-F309 HydrophobicContact CG-CD1 4.31Å; L198-F309 HydrophobicContact CD2-CB 3.94Å; L198-F309 HydrophobicContact CD2-CD2 4.48Å; L198-F309 HydrophobicContact CG-CB 4.15Å; L201-F309 HydrophobicContact CB-CE2 4.36Å; L201-F309 HydrophobicContact CD1-CE2 4.3Å; L201-F309 HydrophobicContact CD2-CD2 4Å; L201-F309 HydrophobicContact CD2-CE2 3.78Å; L201-F309 HydrophobicContact CG-CE2 4.37Å; T285-F309 VanDerWaalsContact O-CE2 3.22Å; T285-F309 WeakPolarHBondContact O-CE2 3.2Å; Y286-F309 HydrophobicContact CD2-CD2 4.42Å; R287-F309 HydrophobicContact CB-CD1 4.26Å; R287-F309 HydrophobicContact CB-CD2 4.24Å; R287-F309 HydrophobicContact CB-CE1 4.25Å; R287-F309 HydrophobicContact CB-CE2 4.21Å; R287-F309 HydrophobicContact CB-CG 4.27Å; R287-F309 HydrophobicContact CB-CZ 4.23Å; R287-F309 HydrophobicContact CG-CE1 4.45Å; R287-F309 HydrophobicContact CG-CE2 4.35Å; R287-F309 HydrophobicContact CG-CZ 4.15Å; R287-F309 VanDerWaalsContact O-CB 3.3Å; R287-F309 WeakPolarHBondContact O-CB 3.45Å; R287-F309 PolarHBondContact O-N 3.49Å
310	T	97.3	Very high	94.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	149.1	179.3	61.3	0	0	0	0	111.9	T191 Y192 M193 L198 Y233 Y286 Y288 F289	T191-T310 HydrophobicContact CG2-CG2 4.39Å; Y192-T310 CarbonylContact O-C 3.5Å; Y192-T310 WeakPolarHBondContact O-CA 3.43Å; M193-T310 HydrophobicContact CG-CG2 4.03Å; L198-T310 HydrophobicContact CD1-CG2 4.31Å; Y233-T310 VanDerWaalsContact O-CB 3.24Å; Y233-T310 WeakPolarHBondContact O-CB 3.49Å; Y233-T310 VanDerWaalsContact O-CG2 3.25Å; Y233-T310 WeakPolarHBondContact O-CG2 3.34Å; Y233-T310 PolarHBondContact O-OG1 3.16Å; Y286-T310 WeakPolarHBondContact OH-CG2 3.3Å; Y288-T310 CarbonylContact C-O 3.56Å; Y288-T310 WeakPolarHBondContact CA-O 3.45Å; F289-T310 PolarHBondContact N-O 3.28Å
311	V	97.1	Very high	95.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	129.1	177.3	-177.1	0	0	0	0	109.2	Y192 F289 L291 F305 A308 L323 F327	Y192-V311 HydrophobicContact CD1-CB 4.29Å; Y192-V311 HydrophobicContact CD1-CG2 4.11Å; Y192-V311 PolarHBondContact N-O 3.39Å; Y192-V311 PolarHBondContact O-N 3.21Å; F289-V311 HydrophobicContact CB-CG2 4.27Å; F289-V311 HydrophobicContact CD1-CG1 4.23Å; F289-V311 WeakPolarHBondContact O-CA 3.38Å; L291-V311 HydrophobicContact CB-CG1 3.86Å; L291-V311 HydrophobicContact CD1-CG1 4.44Å; L291-V311 HydrophobicContact CD2-CG1 4.41Å; L291-V311 HydrophobicContact CG-CG1 4.47Å; F305-V311 HydrophobicContact CE2-CG2 4.29Å; A308-V311 HydrophobicContact CB-CG2 4.5Å; V311-L323 HydrophobicContact CB-CD1 4.49Å; V311-L323 HydrophobicContact CG1-CD1 4.22Å; V311-L323 HydrophobicContact CG1-CD2 4.2Å; V311-F327 HydrophobicContact CG2-CE2 3.75Å; V311-F327 HydrophobicContact CG2-CZ 3.7Å
312	H	96.1	Very high	95.4	Very high	20 Å²	20	42.7 Å²	42.7	9%	0.093	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	148.7	-177.9	178.2	-90.5	0	0	0	110.5	D190 G232 Y233 F289 E290 L291	D190-H312 VanDerWaalsContact CG-NE2 3.34Å; D190-H312 IonicContact OD1-CD2 3.12Å; D190-H312 PolarHBondContact OD1-CD2 2.86Å; D190-H312 IonicContact OD1-NE2 3.97Å; D190-H312 PolarHBondContact OD1-NE2 3.2Å; D190-H312 IonicContact OD2-CD2 3.77Å; D190-H312 IonicContact OD2-CE1 2.65Å; D190-H312 IonicContact OD2-NE2 3.5Å; D190-H312 PolarHBondContact OD2-NE2 3.1Å; G232-H312 WeakPolarHBondContact O-CB 3.19Å; G232-H312 PolarHBondContact O-CD2 3.27Å; Y233-H312 HydrophobicContact CD1-CB 3.78Å; Y233-H312 HydrophobicContact CE1-CB 3.73Å; Y233-H312 HydrophobicContact CG-CB 4.29Å; F289-H312 PolarHBondContact O-N 3.43Å; F289-H312 VanDerWaalsContact O-N 3.15Å; E290-H312 CarbonylContact C-O 3.55Å; E290-H312 VanDerWaalsContact CA-O 3.26Å; E290-H312 WeakPolarHBondContact CA-O 3.4Å; L291-H312 PolarHBondContact N-O 2.93Å
313	P	96	Very high	95.5	Very high	56 Å²	56	40.7 Å²	40.7	36%	0.364	23%	0.225	S	C	.	.			cis	-84	148.1	-7.1	31.5	-33.4	0	0	0	113.3
314	V	95.4	Very high	95.5	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.012	20%	0.203	C	C	.	.			trans	-106.1	109.2	170.9	-175	0	0	0	0	109.5	D190 D316 L319 M320 L323	D190-V314 VanDerWaalsContact O-CB 3.3Å; D190-V314 WeakPolarHBondContact O-CB 3.31Å; D190-V314 WeakPolarHBondContact O-CG2 3.41Å; D190-V314 PolarHBondContact O-N 3.29Å; V314-D316 WeakPolarHBondContact CG1-O 3.42Å; V314-L319 HydrophobicContact CG1-CB 4.05Å; V314-L319 HydrophobicContact CG1-CD2 4.16Å; V314-L319 HydrophobicContact CG1-CG 4.06Å; V314-M320 HydrophobicContact CB-CE 4.03Å; V314-M320 HydrophobicContact CG1-CB 4.04Å; V314-M320 HydrophobicContact CG1-CE 3.91Å; V314-M320 HydrophobicContact CG1-SD 4.45Å; V314-M320 HydrophobicContact CG2-CE 4.21Å; V314-L323 HydrophobicContact CG2-CD1 3.76Å
315	S	93.1	Very high	95.6	Very high	92 Å²	92	39.8 Å²	39.8	64%	0.643	20%	0.202	S	C	*	.			trans	-72.8	-30.7	-174	46.6	0	0	0	0	114.9
316	D	94.1	Very high	95.6	Very high	55 Å²	55	41.3 Å²	41.3	29%	0.294	21%	0.208	S	C	.	.	S	Bend	trans	-149.3	157.1	-170.1	66.9	91.3	0	0	0	113.1	V314 N318 L319 M320	V314-D316 WeakPolarHBondContact CG1-O 3.42Å; D316-N318 VanDerWaalsContact C-N 3.28Å; D316-N318 PolarHBondContact O-N 3.47Å; D316-N318 WeakPolarHBondContact OD1-CA 3.32Å; D316-N318 VanDerWaalsContact OD1-CB 3.3Å; D316-N318 WeakPolarHBondContact OD1-CB 3.42Å; D316-N318 PolarHBondContact OD1-N 3.25Å; D316-L319 PolarHBondContact O-N 3.3Å; D316-L319 PolarHBondContact OD1-N 2.63Å; D316-L319 WeakPolarHBondContact OD2-CB 3.33Å; D316-M320 PolarHBondContact O-N 3.28Å
317	P	95.9	Very high	95.7	Very high	38 Å²	38	38.5 Å²	38.5	25%	0.247	20%	0.196	C	C	.	.	H	α-helix	trans	-60.4	-31.5	-180	-27.5	36.7	0	0	0	114.6	L122 A125 M320 Y321	L122-P317 HydrophobicContact CD2-CG 4.23Å; A125-P317 HydrophobicContact CB-CB 4.03Å; P317-M320 WeakPolarHBondContact O-CB 3.48Å; P317-M320 PolarHBondContact O-N 3.32Å; P317-Y321 HydrophobicContact CB-CE2 4.45Å; P317-Y321 WeakPolarHBondContact O-CD2 3.5Å; P317-Y321 PolarHBondContact O-N 3.43Å
318	N	95.3	Very high	95.7	Very high	113 Å²	113	38.7 Å²	38.7	60%	0.604	20%	0.2	S	C	*	.	H	α-helix	trans	-69.8	-40.3	-179.2	-69.7	-22.6	0	0	0	110.5	D316 M320 Y321 R322	D316-N318 VanDerWaalsContact C-N 3.28Å; D316-N318 PolarHBondContact O-N 3.47Å; D316-N318 WeakPolarHBondContact OD1-CA 3.32Å; D316-N318 VanDerWaalsContact OD1-CB 3.3Å; D316-N318 WeakPolarHBondContact OD1-CB 3.42Å; D316-N318 PolarHBondContact OD1-N 3.25Å; N318-M320 VanDerWaalsContact C-N 3.3Å; N318-M320 PolarHBondContact O-N 3.38Å; N318-Y321 PolarHBondContact O-N 2.87Å; N318-R322 WeakPolarHBondContact O-CG 3.49Å; N318-R322 PolarHBondContact O-N 3.2Å
319	L	94.9	Very high	95.6	Very high	20 Å²	20	43 Å²	43	11%	0.105	22%	0.221	C	C	.	.	H	α-helix	trans	-59.6	-40.3	173.4	-176.1	58.9	0	0	0	111.9	L291 P297 V314 D316 Y321 R322 L323	L291-L319 HydrophobicContact CD2-CD1 4.21Å; L291-L319 HydrophobicContact CD2-CD2 3.76Å; L291-L319 HydrophobicContact CD2-CG 4.24Å; P297-L319 HydrophobicContact CG-CD1 3.94Å; V314-L319 HydrophobicContact CG1-CB 4.05Å; V314-L319 HydrophobicContact CG1-CD2 4.16Å; V314-L319 HydrophobicContact CG1-CG 4.06Å; D316-L319 PolarHBondContact O-N 3.3Å; D316-L319 PolarHBondContact OD1-N 2.63Å; D316-L319 WeakPolarHBondContact OD2-CB 3.33Å; L319-Y321 PolarHBondContact O-N 3.44Å; L319-R322 PolarHBondContact O-N 3.02Å; L319-L323 HydrophobicContact CG-CD1 4.26Å; L319-L323 WeakPolarHBondContact O-CB 3.31Å; L319-L323 WeakPolarHBondContact O-CG 3.35Å; L319-L323 PolarHBondContact O-N 2.86Å
320	M	95.8	Very high	95.6	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-56.2	-47.6	173.9	-170.5	70.9	71.9	0	0	111.9	A125 V126 T129 Y192 V314 D316 P317 N318 H324	A125-M320 HydrophobicContact CB-CB 4.01Å; A125-M320 HydrophobicContact CB-CG 3.89Å; V126-M320 HydrophobicContact CG2-CE 3.49Å; V126-M320 VanDerWaalsContact CG2-CE 3.49Å; V126-M320 HydrophobicContact CG2-SD 4.23Å; T129-M320 HydrophobicContact CG2-CG 4.41Å; Y192-M320 HydrophobicContact CD2-SD 3.68Å; Y192-M320 HydrophobicContact CG-SD 4.2Å; V314-M320 HydrophobicContact CB-CE 4.03Å; V314-M320 HydrophobicContact CG1-CB 4.04Å; V314-M320 HydrophobicContact CG1-CE 3.91Å; V314-M320 HydrophobicContact CG1-SD 4.45Å; V314-M320 HydrophobicContact CG2-CE 4.21Å; D316-M320 PolarHBondContact O-N 3.28Å; P317-M320 WeakPolarHBondContact O-CB 3.48Å; P317-M320 PolarHBondContact O-N 3.32Å; N318-M320 VanDerWaalsContact C-N 3.3Å; N318-M320 PolarHBondContact O-N 3.38Å; M320-H324 PolarHBondContact O-N 3.3Å
321	Y	96.4	Very high	95.4	Very high	74 Å²	74	44.6 Å²	44.6	29%	0.29	23%	0.228	S	C	.	.	H	α-helix	trans	-70.1	-35.2	177.9	-61.6	-56.9	0	0	0	113.1	A125 R128 T129 P317 N318 L319 H324 K325	A125-Y321 WeakPolarHBondContact CA-OH 3.27Å; A125-Y321 HydrophobicContact CB-CE1 4.19Å; A125-Y321 HydrophobicContact CB-CE2 4.16Å; R128-Y321 HydrophobicContact CB-CE1 4.13Å; R128-Y321 VanDerWaalsContact CD-OH 3.27Å; R128-Y321 WeakPolarHBondContact CD-OH 3.35Å; R128-Y321 PolarHBondContact NH1-OH 3.44Å; T129-Y321 HydrophobicContact CG2-CD1 4.09Å; T129-Y321 HydrophobicContact CG2-CE1 4.35Å; P317-Y321 HydrophobicContact CB-CE2 4.45Å; P317-Y321 WeakPolarHBondContact O-CD2 3.5Å; P317-Y321 PolarHBondContact O-N 3.43Å; N318-Y321 PolarHBondContact O-N 2.87Å; L319-Y321 PolarHBondContact O-N 3.44Å; Y321-H324 PolarHBondContact O-N 2.96Å; Y321-K325 WeakPolarHBondContact O-CB 3.32Å; Y321-K325 PolarHBondContact O-N 2.86Å
322	R	95.8	Very high	95.3	Very high	95 Å²	95	49 Å²	49	36%	0.358	25%	0.252	S	S	.	.	H	α-helix	trans	-65.6	-41.9	175.4	-70.8	-178.3	77.7	-154.1	-1.2	111.5	D296 P297 E298 N318 L319 K325 R326	D296-R322 IonicContact OD1-CZ 3.77Å; D296-R322 IonicContact OD1-NH1 3.02Å; D296-R322 IonicContact OD1-NH2 2.63Å; D296-R322 PolarHBondContact OD1-NH2 3.44Å; D296-R322 IonicContact OD2-NH2 3.06Å; P297-R322 HydrophobicContact CG-CB 4.04Å; E298-R322 IonicContact OE2-CZ 2.71Å; E298-R322 IonicContact OE2-NH2 3.9Å; E298-R322 PolarHBondContact OE2-NH2 2.75Å; N318-R322 WeakPolarHBondContact O-CG 3.49Å; N318-R322 PolarHBondContact O-N 3.2Å; L319-R322 PolarHBondContact O-N 3.02Å; R322-K325 PolarHBondContact O-N 3.17Å; R322-R326 WeakPolarHBondContact O-CB 3.13Å; R322-R326 PolarHBondContact O-N 3.09Å
323	L	95.9	Very high	95.2	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59.5	-48.6	170.9	-76.9	166.1	0	0	0	110.4	Y192 L291 P297 F305 V311 V314 L319 K325 R326 F327	Y192-L323 HydrophobicContact CD1-CB 4.19Å; Y192-L323 HydrophobicContact CD2-CB 3.94Å; Y192-L323 HydrophobicContact CE2-CB 4.29Å; Y192-L323 HydrophobicContact CG-CB 3.91Å; Y192-L323 HydrophobicContact CG-CD1 4.21Å; L291-L323 HydrophobicContact CD2-CD1 4.35Å; P297-L323 HydrophobicContact CB-CD2 3.59Å; P297-L323 HydrophobicContact CB-CG 4.14Å; P297-L323 HydrophobicContact CG-CD2 4.43Å; P297-L323 HydrophobicContact CG-CG 4.49Å; F305-L323 HydrophobicContact CE2-CD2 3.79Å; F305-L323 HydrophobicContact CZ-CD2 3.94Å; V311-L323 HydrophobicContact CB-CD1 4.49Å; V311-L323 HydrophobicContact CG1-CD1 4.22Å; V311-L323 HydrophobicContact CG1-CD2 4.2Å; V314-L323 HydrophobicContact CG2-CD1 3.76Å; L319-L323 HydrophobicContact CG-CD1 4.26Å; L319-L323 WeakPolarHBondContact O-CB 3.31Å; L319-L323 WeakPolarHBondContact O-CG 3.35Å; L319-L323 PolarHBondContact O-N 2.86Å; L323-K325 PolarHBondContact O-N 2.98Å; L323-R326 PolarHBondContact O-N 3.02Å; L323-R326 VanDerWaalsContact O-N 3.12Å; L323-F327 HydrophobicContact CD2-CE2 4.22Å; L323-F327 WeakPolarHBondContact O-CD2 3.43Å; L323-F327 PolarHBondContact O-N 3.36Å
324	H	96	Very high	95.2	Very high	43 Å²	43	54 Å²	54	20%	0.199	27%	0.267	C	S	.	.	H	α-helix	trans	-57.1	-49.1	178.4	-170.6	61.6	0	0	0	112.7	T129 Y192 M320 Y321 R326 F327 S328	T129-H324 HydrophobicContact CG2-CB 3.7Å; Y192-H324 HydrophobicContact CE2-CB 3.7Å; Y192-H324 AromaticContact CE2-ND1 3.95Å; Y192-H324 WeakPolarHBondContact OH-CA 3.41Å; Y192-H324 PolarHBondContact OH-ND1 2.93Å; M320-H324 PolarHBondContact O-N 3.3Å; Y321-H324 PolarHBondContact O-N 2.96Å; H324-R326 VanDerWaalsContact C-N 3.32Å; H324-R326 PolarHBondContact O-N 3.24Å; H324-F327 PolarHBondContact O-N 3.23Å; H324-S328 WeakPolarHBondContact O-CB 3.38Å; H324-S328 PolarHBondContact O-N 2.99Å; H324-S328 PolarHBondContact O-OG 2.89Å
325	K	95.8	Very high	95.1	Very high	105 Å²	105	56.9 Å²	56.9	46%	0.457	29%	0.285	S	S	.	.	H	α-helix	trans	-54.8	-47.6	174.6	177.7	-168.7	168.5	-159	0	111.5	E298 Y321 R322 L323 S328 Q329	E298-K325 IonicContact OE1-NZ 3.66Å; E298-K325 PolarHBondContact OE1-NZ 3.23Å; Y321-K325 WeakPolarHBondContact O-CB 3.32Å; Y321-K325 PolarHBondContact O-N 2.86Å; R322-K325 PolarHBondContact O-N 3.17Å; L323-K325 PolarHBondContact O-N 2.98Å; K325-S328 PolarHBondContact O-N 3.18Å; K325-Q329 VanDerWaalsContact O-CG 3.32Å; K325-Q329 WeakPolarHBondContact O-CG 3.49Å; K325-Q329 PolarHBondContact O-N 2.92Å
326	R	95.4	Very high	95.1	Very high	32 Å²	32	59.5 Å²	59.5	12%	0.121	28%	0.281	C	S	.	.	H	α-helix	trans	-64.8	-46.9	-178.3	177.9	59.7	168.3	158.1	2.1	112.2	P297 E300 D301 F305 R322 L323 H324 Q329 I330	P297-R326 WeakPolarHBondContact O-CG 3.44Å; E300-R326 PolarHBondContact O-NH2 3.12Å; D301-R326 IonicContact OD1-NH2 2.96Å; D301-R326 PolarHBondContact OD1-NH2 2.83Å; F305-R326 HydrophobicContact CE1-CG 3.91Å; F305-R326 HydrophobicContact CZ-CG 4.18Å; R322-R326 WeakPolarHBondContact O-CB 3.13Å; R322-R326 PolarHBondContact O-N 3.09Å; L323-R326 PolarHBondContact O-N 3.02Å; L323-R326 VanDerWaalsContact O-N 3.12Å; H324-R326 VanDerWaalsContact C-N 3.32Å; H324-R326 PolarHBondContact O-N 3.24Å; R326-Q329 WeakPolarHBondContact O-CB 3.35Å; R326-Q329 PolarHBondContact O-N 2.83Å; R326-I330 HydrophobicContact CG-CD1 4.1Å; R326-I330 WeakPolarHBondContact O-CG1 3.33Å; R326-I330 PolarHBondContact O-N 3Å
327	F	95.8	Very high	95.1	Very high	1 Å²	1	61.1 Å²	61.1	0%	0.004	29%	0.287	C	S	.	.	H	α-helix	trans	-65.1	-40.4	177.2	-87.2	-92.7	0	0	0	111.6	Y192 F305 A308 V311 L323 H324 Q329 I330 E331	Y192-F327 HydrophobicContact CD1-CD2 4.15Å; Y192-F327 HydrophobicContact CD1-CE2 4.18Å; Y192-F327 HydrophobicContact CE1-CB 4.12Å; Y192-F327 HydrophobicContact CE1-CD1 4.32Å; Y192-F327 AromaticContact CE1-CD2 3.44Å; Y192-F327 HydrophobicContact CE1-CD2 3.44Å; Y192-F327 VanDerWaalsContact CE1-CD2 3.44Å; Y192-F327 AromaticContact CE1-CE2 3.87Å; Y192-F327 HydrophobicContact CE1-CE2 3.87Å; Y192-F327 AromaticContact CE1-CG 3.7Å; Y192-F327 HydrophobicContact CE1-CG 3.7Å; Y192-F327 HydrophobicContact CE1-CZ 4.47Å; Y192-F327 WeakPolarHBondContact OH-CB 3.49Å; F305-F327 HydrophobicContact CD2-CE2 4.26Å; F305-F327 HydrophobicContact CD2-CZ 4.2Å; F305-F327 HydrophobicContact CE1-CE2 4.11Å; F305-F327 HydrophobicContact CE1-CZ 4.44Å; F305-F327 AromaticContact CE2-CE2 3.55Å; F305-F327 HydrophobicContact CE2-CE2 3.55Å; F305-F327 AromaticContact CE2-CZ 3.95Å; F305-F327 HydrophobicContact CE2-CZ 3.95Å; F305-F327 HydrophobicContact CZ-CD2 4.18Å; F305-F327 AromaticContact CZ-CE2 3.46Å; F305-F327 HydrophobicContact CZ-CE2 3.46Å; F305-F327 VanDerWaalsContact CZ-CE2 3.46Å; F305-F327 HydrophobicContact CZ-CZ 4.08Å; F305-F327 WeakPolarHBondContact O-CZ 3.44Å; A308-F327 HydrophobicContact CB-CZ 4.38Å; V311-F327 HydrophobicContact CG2-CE2 3.75Å; V311-F327 HydrophobicContact CG2-CZ 3.7Å; L323-F327 HydrophobicContact CD2-CE2 4.22Å; L323-F327 WeakPolarHBondContact O-CD2 3.43Å; L323-F327 PolarHBondContact O-N 3.36Å; H324-F327 PolarHBondContact O-N 3.23Å; F327-Q329 VanDerWaalsContact C-N 3.3Å; F327-Q329 PolarHBondContact O-N 3.49Å; F327-I330 PolarHBondContact O-N 2.97Å; F327-I330 VanDerWaalsContact O-N 3.13Å; F327-E331 WeakPolarHBondContact O-CG 3.27Å; F327-E331 PolarHBondContact O-N 3.23Å
328	S	94.8	Very high	95.1	Very high	47 Å²	47	64.8 Å²	64.8	33%	0.329	30%	0.301	S	S	.	.	H	α-helix	trans	-61.7	-36.5	174.5	-64	0	0	0	0	112.5	H324 K325 L332	H324-S328 WeakPolarHBondContact O-CB 3.38Å; H324-S328 PolarHBondContact O-N 2.99Å; H324-S328 PolarHBondContact O-OG 2.89Å; K325-S328 PolarHBondContact O-N 3.18Å; S328-L332 VanDerWaalsContact O-CB 3.23Å; S328-L332 WeakPolarHBondContact O-CB 3.33Å; S328-L332 PolarHBondContact O-N 3.21Å
329	Q	94.9	Very high	94.9	Very high	91 Å²	91	63 Å²	63	43%	0.425	29%	0.291	S	S	.	.	H	α-helix	trans	-64.8	-42.1	172.1	-74.4	174	-18.6	0	0	112.4	K325 R326 F327 L332 Q333	K325-Q329 VanDerWaalsContact O-CG 3.32Å; K325-Q329 WeakPolarHBondContact O-CG 3.49Å; K325-Q329 PolarHBondContact O-N 2.92Å; R326-Q329 WeakPolarHBondContact O-CB 3.35Å; R326-Q329 PolarHBondContact O-N 2.83Å; F327-Q329 VanDerWaalsContact C-N 3.3Å; F327-Q329 PolarHBondContact O-N 3.49Å; Q329-L332 PolarHBondContact O-N 3.12Å; Q329-Q333 WeakPolarHBondContact O-CB 3.2Å; Q329-Q333 PolarHBondContact O-N 3.32Å
330	I	95.1	Very high	94.7	Very high	5 Å²	5	67.5 Å²	67.5	3%	0.026	31%	0.311	C	S	.	.	H	α-helix	trans	-63.8	-48.4	177.5	-67.3	163	0	0	0	110.3	F305 K306 R326 F327 L332 Q333 W334	F305-I330 HydrophobicContact CE1-CD1 4.25Å; K306-I330 HydrophobicContact CG-CD1 4.18Å; R326-I330 HydrophobicContact CG-CD1 4.1Å; R326-I330 WeakPolarHBondContact O-CG1 3.33Å; R326-I330 PolarHBondContact O-N 3Å; F327-I330 PolarHBondContact O-N 2.97Å; F327-I330 VanDerWaalsContact O-N 3.13Å; I330-L332 VanDerWaalsContact C-N 3.34Å; I330-L332 PolarHBondContact O-N 3.49Å; I330-Q333 PolarHBondContact O-N 2.98Å; I330-W334 HydrophobicContact CG2-CD2 3.95Å; I330-W334 HydrophobicContact CG2-CE3 4.27Å; I330-W334 HydrophobicContact CG2-CH2 4.19Å; I330-W334 HydrophobicContact CG2-CZ2 3.82Å; I330-W334 HydrophobicContact CG2-CZ3 4.42Å; I330-W334 PolarHBondContact O-N 3.39Å
331	E	94.6	Very high	94.7	Very high	47 Å²	47	71.6 Å²	71.6	22%	0.22	33%	0.333	C	S	.	.	H	α-helix	trans	-59.4	-43.8	177	-71.2	-50.8	142.7	0	0	112.3	R197 F327 Q333 W334 T335	R197-E331 IonicContact CZ-OE1 3.45Å; R197-E331 IonicContact NE-OE1 2.83Å; R197-E331 PolarHBondContact NE-OE1 3.16Å; R197-E331 IonicContact NH2-OE1 3.45Å; R197-E331 PolarHBondContact NH2-OE1 3.02Å; F327-E331 WeakPolarHBondContact O-CG 3.27Å; F327-E331 PolarHBondContact O-N 3.23Å; E331-Q333 VanDerWaalsContact C-N 3.34Å; E331-Q333 PolarHBondContact O-N 3.23Å; E331-W334 PolarHBondContact O-N 2.79Å; E331-T335 WeakPolarHBondContact O-CB 3.04Å; E331-T335 PolarHBondContact O-N 3.32Å; E331-T335 PolarHBondContact O-OG1 2.91Å
332	L	94.8	Very high	94.5	Very high	93 Å²	93	72.4 Å²	72.4	49%	0.487	34%	0.342	S	S	.	.	H	α-helix	trans	-61.3	-44.6	177.8	-178.2	64.9	0	0	0	111.2	S328 Q329 I330 T335 Y336	S328-L332 VanDerWaalsContact O-CB 3.23Å; S328-L332 WeakPolarHBondContact O-CB 3.33Å; S328-L332 PolarHBondContact O-N 3.21Å; Q329-L332 PolarHBondContact O-N 3.12Å; I330-L332 VanDerWaalsContact C-N 3.34Å; I330-L332 PolarHBondContact O-N 3.49Å; L332-T335 PolarHBondContact O-N 3.07Å; L332-Y336 HydrophobicContact CD1-CD2 4.05Å; L332-Y336 HydrophobicContact CD1-CE2 3.44Å; L332-Y336 VanDerWaalsContact CD1-CE2 3.44Å; L332-Y336 HydrophobicContact CD2-CE2 4.05Å; L332-Y336 HydrophobicContact CG-CD2 3.89Å; L332-Y336 HydrophobicContact CG-CE2 3.5Å; L332-Y336 VanDerWaalsContact CG-CE2 3.5Å; L332-Y336 WeakPolarHBondContact O-CD2 3.37Å; L332-Y336 PolarHBondContact O-N 3.23Å
333	Q	94.3	Very high	94.3	Very high	111 Å²	111	71.2 Å²	71.2	52%	0.519	34%	0.34	S	S	.	.	H	α-helix	trans	-63.4	-44.9	177.9	-175.8	176.1	4.5	0	0	111.8	Q329 I330 E331 T335 Y336 Q337	Q329-Q333 WeakPolarHBondContact O-CB 3.2Å; Q329-Q333 PolarHBondContact O-N 3.32Å; I330-Q333 PolarHBondContact O-N 2.98Å; E331-Q333 VanDerWaalsContact C-N 3.34Å; E331-Q333 PolarHBondContact O-N 3.23Å; Q333-T335 VanDerWaalsContact C-N 3.35Å; Q333-Y336 PolarHBondContact O-N 3.23Å; Q333-Q337 WeakPolarHBondContact O-CG 3.49Å; Q333-Q337 PolarHBondContact O-N 3.04Å
334	W	94.4	Very high	94.1	Very high	68 Å²	68	75.4 Å²	75.4	26%	0.258	36%	0.362	S	S	.	.	H	α-helix	trans	-62.6	-42.3	175.9	-72.5	-13.4	0	0	0	112.2	K306 N307 I330 E331 Y336 Q337 Q338	K306-W334 HydrophobicContact CB-CZ2 4.17Å; K306-W334 WeakPolarHBondContact O-CH2 3.39Å; N307-W334 VanDerWaalsContact OD1-CH2 3.27Å; N307-W334 WeakPolarHBondContact OD1-CH2 3.24Å; I330-W334 HydrophobicContact CG2-CD2 3.95Å; I330-W334 HydrophobicContact CG2-CE3 4.27Å; I330-W334 HydrophobicContact CG2-CH2 4.19Å; I330-W334 HydrophobicContact CG2-CZ2 3.82Å; I330-W334 HydrophobicContact CG2-CZ3 4.42Å; I330-W334 PolarHBondContact O-N 3.39Å; E331-W334 PolarHBondContact O-N 2.79Å; W334-Y336 VanDerWaalsContact C-N 3.32Å; W334-Y336 PolarHBondContact O-N 2.67Å; W334-Q337 PolarHBondContact O-N 3.22Å; W334-Q338 WeakPolarHBondContact O-CB 3.35Å; W334-Q338 VanDerWaalsContact O-CG 3.31Å; W334-Q338 WeakPolarHBondContact O-CG 3.38Å; W334-Q338 PolarHBondContact O-N 2.84Å
335	T	94.4	Very high	93.9	Very high	63 Å²	63	79 Å²	79	39%	0.387	38%	0.379	S	S	.	.	H	α-helix	trans	-59.1	-45.2	175.7	-57.6	0	0	0	0	110.6	E331 L332 Q333 Q337 Q338 I339	E331-T335 WeakPolarHBondContact O-CB 3.04Å; E331-T335 PolarHBondContact O-N 3.32Å; E331-T335 PolarHBondContact O-OG1 2.91Å; L332-T335 PolarHBondContact O-N 3.07Å; Q333-T335 VanDerWaalsContact C-N 3.35Å; T335-Q337 PolarHBondContact O-N 3.24Å; T335-Q338 PolarHBondContact O-N 2.88Å; T335-I339 HydrophobicContact CG2-CD1 3.91Å; T335-I339 HydrophobicContact CG2-CG1 4.48Å; T335-I339 WeakPolarHBondContact O-CB 3.43Å; T335-I339 WeakPolarHBondContact O-CG1 3.38Å; T335-I339 PolarHBondContact O-N 3.46Å
336	Y	92.6	Very high	93.6	Very high	147 Å²	147	77.2 Å²	77.2	58%	0.576	37%	0.374	S	S	*	.	H	α-helix	trans	-63.2	-40.1	176.1	-77.9	-54.2	0	0	0	113.3	L332 Q333 W334 I339 Q340	L332-Y336 HydrophobicContact CD1-CD2 4.05Å; L332-Y336 HydrophobicContact CD1-CE2 3.44Å; L332-Y336 VanDerWaalsContact CD1-CE2 3.44Å; L332-Y336 HydrophobicContact CD2-CE2 4.05Å; L332-Y336 HydrophobicContact CG-CD2 3.89Å; L332-Y336 HydrophobicContact CG-CE2 3.5Å; L332-Y336 VanDerWaalsContact CG-CE2 3.5Å; L332-Y336 WeakPolarHBondContact O-CD2 3.37Å; L332-Y336 PolarHBondContact O-N 3.23Å; Q333-Y336 PolarHBondContact O-N 3.23Å; W334-Y336 VanDerWaalsContact C-N 3.32Å; W334-Y336 PolarHBondContact O-N 2.67Å; Y336-I339 PolarHBondContact O-N 3.01Å; Y336-Q340 PolarHBondContact O-N 2.71Å
337	Q	94.4	Very high	93.3	Very high	89 Å²	89	78 Å²	78	42%	0.416	38%	0.384	S	S	.	.	H	α-helix	trans	-64	-47	175.5	-73.7	174.6	-20.3	0	0	111.3	Q333 W334 T335 I339 Q340 D341	Q333-Q337 WeakPolarHBondContact O-CG 3.49Å; Q333-Q337 PolarHBondContact O-N 3.04Å; W334-Q337 PolarHBondContact O-N 3.22Å; T335-Q337 PolarHBondContact O-N 3.24Å; Q337-I339 VanDerWaalsContact C-N 3.35Å; Q337-I339 PolarHBondContact O-N 2.65Å; Q337-Q340 WeakPolarHBondContact O-CB 3.49Å; Q337-Q340 PolarHBondContact O-N 3.04Å; Q337-Q340 VanDerWaalsContact O-N 3.14Å; Q337-D341 PolarHBondContact O-N 3.31Å
338	Q	94.9	Very high	93	Very high	116 Å²	116	83.4 Å²	83.4	54%	0.542	41%	0.413	S	S	.	.	H	α-helix	trans	-60.2	-43	176.3	-73.5	176.6	-9	0	0	111.9	W334 T335 Q340 D341 I342	W334-Q338 WeakPolarHBondContact O-CB 3.35Å; W334-Q338 VanDerWaalsContact O-CG 3.31Å; W334-Q338 WeakPolarHBondContact O-CG 3.38Å; W334-Q338 PolarHBondContact O-N 2.84Å; T335-Q338 PolarHBondContact O-N 2.88Å; Q338-Q340 VanDerWaalsContact C-N 3.31Å; Q338-Q340 PolarHBondContact O-N 3.47Å; Q338-D341 PolarHBondContact O-N 2.98Å; Q338-I342 WeakPolarHBondContact O-CB 3.41Å; Q338-I342 WeakPolarHBondContact O-CG1 3.48Å; Q338-I342 PolarHBondContact O-N 3.3Å
339	I	92.1	Very high	92.8	Very high	76 Å²	76	86.1 Å²	86.1	39%	0.39	42%	0.423	S	S	.	.	H	α-helix	trans	-57.8	-47.2	174.4	-71.8	165.6	0	0	0	110.1	T335 Y336 Q337 I342 Q343	T335-I339 HydrophobicContact CG2-CD1 3.91Å; T335-I339 HydrophobicContact CG2-CG1 4.48Å; T335-I339 WeakPolarHBondContact O-CB 3.43Å; T335-I339 WeakPolarHBondContact O-CG1 3.38Å; T335-I339 PolarHBondContact O-N 3.46Å; Y336-I339 PolarHBondContact O-N 3.01Å; Q337-I339 VanDerWaalsContact C-N 3.35Å; Q337-I339 PolarHBondContact O-N 2.65Å; I339-I342 PolarHBondContact O-N 3.27Å; I339-Q343 HydrophobicContact CG2-CG 4.35Å; I339-Q343 WeakPolarHBondContact O-CB 3.35Å; I339-Q343 WeakPolarHBondContact O-CG 3.24Å; I339-Q343 PolarHBondContact O-N 2.93Å
340	Q	90.8	Very high	92.5	Very high	114 Å²	114	82 Å²	82	53%	0.533	41%	0.405	S	S	.	.	H	α-helix	trans	-62.4	-45.1	178.9	-177	176.3	-8	0	0	111.7	Y336 Q337 Q338 Q343 L344	Y336-Q340 PolarHBondContact O-N 2.71Å; Q337-Q340 WeakPolarHBondContact O-CB 3.49Å; Q337-Q340 PolarHBondContact O-N 3.04Å; Q337-Q340 VanDerWaalsContact O-N 3.14Å; Q338-Q340 VanDerWaalsContact C-N 3.31Å; Q338-Q340 PolarHBondContact O-N 3.47Å; Q340-Q343 PolarHBondContact O-N 3.42Å; Q340-L344 HydrophobicContact CG-CD1 4.3Å; Q340-L344 VanDerWaalsContact O-CG 3.31Å; Q340-L344 WeakPolarHBondContact O-CG 3.38Å; Q340-L344 PolarHBondContact O-N 3.06Å
341	D	94.8	Very high	92.1	Very high	87 Å²	87	87 Å²	87	47%	0.465	43%	0.428	S	S	.	.	H	α-helix	trans	-63.3	-45.1	179.5	-72.3	-18.6	0	0	0	111.3	Q337 Q338 Q343 L344 Q345	Q337-D341 PolarHBondContact O-N 3.31Å; Q338-D341 PolarHBondContact O-N 2.98Å; D341-Q343 PolarHBondContact O-N 3.14Å; D341-L344 PolarHBondContact O-N 3.29Å; D341-Q345 VanDerWaalsContact O-CG 3.28Å; D341-Q345 WeakPolarHBondContact O-CG 3.13Å; D341-Q345 PolarHBondContact O-N 3.24Å
342	I	93.8	Very high	91.9	Very high	90 Å²	90	91.8 Å²	91.8	46%	0.462	45%	0.454	S	S	.	.	H	α-helix	trans	-62.9	-42.7	175.9	-69.2	167.2	0	0	0	110.5	Q338 I339 L344 Q345 I346	Q338-I342 WeakPolarHBondContact O-CB 3.41Å; Q338-I342 WeakPolarHBondContact O-CG1 3.48Å; Q338-I342 PolarHBondContact O-N 3.3Å; I339-I342 PolarHBondContact O-N 3.27Å; I342-L344 VanDerWaalsContact C-N 3.32Å; I342-L344 PolarHBondContact O-N 3.36Å; I342-Q345 PolarHBondContact O-N 2.85Å; I342-I346 HydrophobicContact CG2-CD1 3.78Å; I342-I346 HydrophobicContact CG2-CG1 4.36Å; I342-I346 VanDerWaalsContact O-CG1 3.29Å; I342-I346 WeakPolarHBondContact O-CG1 3.31Å; I342-I346 PolarHBondContact O-N 2.95Å
343	Q	91.1	Very high	91.5	Very high	71 Å²	71	90.2 Å²	90.2	33%	0.332	45%	0.448	S	S	.	.	H	α-helix	trans	-61.3	-40.8	176.3	-75.3	175	-13.4	0	0	112.1	I339 Q340 D341 S347 I364	I339-Q343 HydrophobicContact CG2-CG 4.35Å; I339-Q343 WeakPolarHBondContact O-CB 3.35Å; I339-Q343 WeakPolarHBondContact O-CG 3.24Å; I339-Q343 PolarHBondContact O-N 2.93Å; Q340-Q343 PolarHBondContact O-N 3.42Å; D341-Q343 PolarHBondContact O-N 3.14Å; Q343-S347 WeakPolarHBondContact O-CB 3.28Å; Q343-S347 PolarHBondContact O-N 3.39Å; Q343-I364 HydrophobicContact CB-CB 4.49Å; Q343-I364 HydrophobicContact CB-CG2 4.31Å; Q343-I364 HydrophobicContact CG-CB 4.02Å; Q343-I364 HydrophobicContact CG-CG2 3.91Å; Q343-I364 PolarHBondContact NE2-O 3.25Å; Q343-I364 VanDerWaalsContact NE2-O 3.12Å
344	L	90.6	Very high	91.2	Very high	88 Å²	88	91.9 Å²	91.9	46%	0.461	47%	0.469	S	S	.	.	H	α-helix	trans	-66	-42.2	174.8	-71.4	172.5	0	0	0	111.6	Q340 D341 I342 S347 N348	Q340-L344 HydrophobicContact CG-CD1 4.3Å; Q340-L344 VanDerWaalsContact O-CG 3.31Å; Q340-L344 WeakPolarHBondContact O-CG 3.38Å; Q340-L344 PolarHBondContact O-N 3.06Å; D341-L344 PolarHBondContact O-N 3.29Å; I342-L344 VanDerWaalsContact C-N 3.32Å; I342-L344 PolarHBondContact O-N 3.36Å; L344-S347 PolarHBondContact O-N 3.11Å; L344-N348 WeakPolarHBondContact O-CB 3.46Å; L344-N348 VanDerWaalsContact O-CG 3.22Å; L344-N348 PolarHBondContact O-N 3.49Å; L344-N348 PolarHBondContact O-ND2 2.89Å
345	Q	91.7	Very high	90.6	Very high	117 Å²	117	95.3 Å²	95.3	55%	0.547	49%	0.488	S	S	.	.	H	α-helix	trans	-60.9	-46.8	175.5	-72.9	175.8	16.2	0	0	111.4	D341 I342 S347 N348 L349	D341-Q345 VanDerWaalsContact O-CG 3.28Å; D341-Q345 WeakPolarHBondContact O-CG 3.13Å; D341-Q345 PolarHBondContact O-N 3.24Å; I342-Q345 PolarHBondContact O-N 2.85Å; Q345-S347 VanDerWaalsContact C-N 3.33Å; Q345-S347 PolarHBondContact O-N 2.84Å; Q345-N348 PolarHBondContact O-N 3.46Å; Q345-L349 WeakPolarHBondContact O-CB 3.28Å; Q345-L349 VanDerWaalsContact O-CG 3.3Å; Q345-L349 WeakPolarHBondContact O-CG 3.29Å; Q345-L349 PolarHBondContact O-N 3.4Å
346	I	89.7	Confident	90.1	Very high	69 Å²	69	93.2 Å²	93.2	35%	0.354	48%	0.479	S	S	.	.	H	α-helix	trans	-59.1	-45.7	175.6	-68.6	166	0	0	0	110.5	I342 N348 L349 S350 I364	I342-I346 HydrophobicContact CG2-CD1 3.78Å; I342-I346 HydrophobicContact CG2-CG1 4.36Å; I342-I346 VanDerWaalsContact O-CG1 3.29Å; I342-I346 WeakPolarHBondContact O-CG1 3.31Å; I342-I346 PolarHBondContact O-N 2.95Å; I346-N348 VanDerWaalsContact C-N 3.34Å; I346-N348 PolarHBondContact O-N 3.32Å; I346-L349 PolarHBondContact O-N 2.82Å; I346-S350 WeakPolarHBondContact O-CB 3.35Å; I346-S350 PolarHBondContact O-N 3.46Å; I346-I364 HydrophobicContact CB-CG2 3.96Å; I346-I364 HydrophobicContact CD1-CG2 3.56Å; I346-I364 HydrophobicContact CG1-CG2 4.37Å; I346-I364 HydrophobicContact CG2-CG2 3.77Å
347	S	88.8	Confident	89.5	Confident	47 Å²	47	92.8 Å²	92.8	33%	0.329	48%	0.48	S	S	.	.	H	α-helix	trans	-60.9	-41.7	176.9	-179.8	0	0	0	0	112.2	Q343 L344 Q345 S350	Q343-S347 WeakPolarHBondContact O-CB 3.28Å; Q343-S347 PolarHBondContact O-N 3.39Å; L344-S347 PolarHBondContact O-N 3.11Å; Q345-S347 VanDerWaalsContact C-N 3.33Å; Q345-S347 PolarHBondContact O-N 2.84Å; S347-S350 WeakPolarHBondContact O-CB 3.35Å; S347-S350 PolarHBondContact O-OG 3.19Å
348	N	90.6	Very high	88.7	Confident	115 Å²	115	92.9 Å²	92.9	62%	0.615	50%	0.496	S	S	*	.	H	α-helix	trans	-69.8	-42.3	179.8	-72	-16.7	0	0	0	111.9	L344 Q345 I346 S350	L344-N348 WeakPolarHBondContact O-CB 3.46Å; L344-N348 VanDerWaalsContact O-CG 3.22Å; L344-N348 PolarHBondContact O-N 3.49Å; L344-N348 PolarHBondContact O-ND2 2.89Å; Q345-N348 PolarHBondContact O-N 3.46Å; I346-N348 VanDerWaalsContact C-N 3.34Å; I346-N348 PolarHBondContact O-N 3.32Å; N348-S350 VanDerWaalsContact C-N 3.28Å; N348-S350 PolarHBondContact O-N 3.5Å
349	L	90.1	Very high	87.8	Confident	105 Å²	105	88.6 Å²	88.6	55%	0.55	48%	0.483	S	S	.	.	H	α-helix	trans	-71	-23.4	179.2	-70.2	173	0	0	0	113.1	Q345 I346 H351 L352	Q345-L349 WeakPolarHBondContact O-CB 3.28Å; Q345-L349 VanDerWaalsContact O-CG 3.3Å; Q345-L349 WeakPolarHBondContact O-CG 3.29Å; Q345-L349 PolarHBondContact O-N 3.4Å; I346-L349 PolarHBondContact O-N 2.82Å; L349-H351 PolarHBondContact O-N 3.21Å; L349-H351 VanDerWaalsContact O-N 3.07Å; L349-L352 HydrophobicContact CD2-CD1 4.33Å; L349-L352 WeakPolarHBondContact O-CB 3.16Å; L349-L352 PolarHBondContact O-N 3.03Å
350	S	88.4	Confident	87.3	Confident	5 Å²	5	87 Å²	87	4%	0.035	48%	0.476	C	S	.	.	G	3₁₀ helix	trans	-55.1	-29.1	-179.4	71.1	0	0	0	0	115.1	I346 S347 N348 L352 T353 G356	I346-S350 WeakPolarHBondContact O-CB 3.35Å; I346-S350 PolarHBondContact O-N 3.46Å; S347-S350 WeakPolarHBondContact O-CB 3.35Å; S347-S350 PolarHBondContact O-OG 3.19Å; N348-S350 VanDerWaalsContact C-N 3.28Å; N348-S350 PolarHBondContact O-N 3.5Å; S350-L352 PolarHBondContact O-N 3.02Å; S350-T353 PolarHBondContact O-N 2.77Å; S350-T353 PolarHBondContact O-OG1 3.36Å; S350-G356 CarbonylContact O-C 3.53Å; S350-G356 WeakPolarHBondContact O-CA 3.5Å
351	H	87.9	Confident	86.8	Confident	109 Å²	109	85.5 Å²	85.5	51%	0.505	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-67	-22	177.2	-77.8	-79.5	0	0	0	113.8	L349 K357	L349-H351 PolarHBondContact O-N 3.21Å; L349-H351 VanDerWaalsContact O-N 3.07Å; H351-K357 WeakPolarHBondContact CE1-CD 3.48Å; H351-K357 WeakPolarHBondContact CE1-CE 2.99Å; H351-K357 PolarHBondContact CE1-NZ 3.35Å; H351-K357 WeakPolarHBondContact NE2-CE 3.37Å; H351-K357 PolarHBondContact NE2-NZ 3.05Å
352	L	89.9	Confident	86.2	Confident	147 Å²	147	87.6 Å²	87.6	77%	0.77	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-96.7	-6.5	-177.1	-55.7	176.3	0	0	0	112.1	L349 S350	L349-L352 HydrophobicContact CD2-CD1 4.33Å; L349-L352 WeakPolarHBondContact O-CB 3.16Å; L349-L352 PolarHBondContact O-N 3.03Å; S350-L352 PolarHBondContact O-N 3.02Å
353	T	86.8	Confident	85.8	Confident	61 Å²	61	84.5 Å²	84.5	37%	0.374	46%	0.458	S	S	.	.	S	Bend	trans	-80.5	154.2	178.4	66.5	0	0	0	0	110.8	S350 E355 G356	S350-T353 PolarHBondContact O-N 2.77Å; S350-T353 PolarHBondContact O-OG1 3.36Å; T353-E355 PolarHBondContact O-N 2.89Å; T353-G356 WeakPolarHBondContact O-CA 3.49Å; T353-G356 PolarHBondContact O-N 3.06Å; T353-G356 PolarHBondContact OG1-N 3.23Å; T353-G356 PolarHBondContact OG1-O 3.44Å
354	P	86.9	Confident	85.6	Confident	145 Å²	145	82.9 Å²	82.9	94%	0.942	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-33.4	178.2	-25.4	34.5	0	0	0	113.8	G356	P354-G356 VanDerWaalsContact C-N 3.27Å
355	E	82.3	Confident	85.2	Confident	141 Å²	141	82.4 Å²	82.4	66%	0.659	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-6.7	176.6	-59.9	-173.5	171.2	0	0	112.9	T353 A358 G359	T353-E355 PolarHBondContact O-N 2.89Å; E355-A358 PolarHBondContact O-N 3.29Å; E355-G359 PolarHBondContact O-N 3.14Å; E355-G359 WeakPolarHBondContact OE2-CA 3.47Å
356	G	84.9	Confident	84.9	Confident	19 Å²	19	79.5 Å²	79.5	20%	0.196	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	54.8	-149.1	-175.7	0	0	0	0	0	113.1	S350 T353 P354 A358 G359	S350-G356 CarbonylContact O-C 3.53Å; S350-G356 WeakPolarHBondContact O-CA 3.5Å; T353-G356 WeakPolarHBondContact O-CA 3.49Å; T353-G356 PolarHBondContact O-N 3.06Å; T353-G356 PolarHBondContact OG1-N 3.23Å; T353-G356 PolarHBondContact OG1-O 3.44Å; P354-G356 VanDerWaalsContact C-N 3.27Å; G356-A358 PolarHBondContact O-N 3.42Å; G356-A358 VanDerWaalsContact O-N 3.15Å; G356-G359 PolarHBondContact O-N 3.26Å; G356-G359 VanDerWaalsContact O-N 3.15Å
357	K	79.6	Confident	84.7	Confident	138 Å²	138	81.5 Å²	81.5	60%	0.6	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-59.6	-23	175.1	-80.3	-178	141.9	156.3	0	114	H351 G359 V360	H351-K357 WeakPolarHBondContact CE1-CD 3.48Å; H351-K357 WeakPolarHBondContact CE1-CE 2.99Å; H351-K357 PolarHBondContact CE1-NZ 3.35Å; H351-K357 WeakPolarHBondContact NE2-CE 3.37Å; H351-K357 PolarHBondContact NE2-NZ 3.05Å; K357-G359 VanDerWaalsContact C-N 3.29Å; K357-V360 PolarHBondContact O-N 2.86Å
358	A	76.1	Confident	84.5	Confident	91 Å²	91	82.6 Å²	82.6	75%	0.752	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-74	-23.3	-179.5	0	0	0	0	0	112.3	E355 G356 V360	E355-A358 PolarHBondContact O-N 3.29Å; G356-A358 PolarHBondContact O-N 3.42Å; G356-A358 VanDerWaalsContact O-N 3.15Å; A358-V360 VanDerWaalsContact C-N 3.29Å; A358-V360 PolarHBondContact O-N 3.49Å
359	G	76.3	Confident	84.3	Confident	26 Å²	26	78.4 Å²	78.4	27%	0.268	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-75.2	-14.2	174.6	0	0	0	0	0	114.3	E355 G356 K357 M361	E355-G359 PolarHBondContact O-N 3.14Å; E355-G359 WeakPolarHBondContact OE2-CA 3.47Å; G356-G359 PolarHBondContact O-N 3.26Å; G356-G359 VanDerWaalsContact O-N 3.15Å; K357-G359 VanDerWaalsContact C-N 3.29Å; G359-M361 PolarHBondContact O-N 2.85Å
360	V	81.5	Confident	84.3	Confident	42 Å²	42	77 Å²	77	26%	0.255	44%	0.442	S	S	.	.			trans	-80.7	113.7	177.3	-175.5	0	0	0	0	109.8	K357 A358 I364	K357-V360 PolarHBondContact O-N 2.86Å; A358-V360 VanDerWaalsContact C-N 3.29Å; A358-V360 PolarHBondContact O-N 3.49Å; V360-I364 HydrophobicContact CG1-CD1 3.85Å; V360-I364 HydrophobicContact CG1-CG1 3.67Å
361	M	80.7	Confident	84.4	Confident	82 Å²	82	84.2 Å²	84.2	40%	0.404	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-87.7	136	177.6	-62.7	-87	50.8	0	0	111.3	G359 P363 I364 P369	G359-M361 PolarHBondContact O-N 2.85Å; M361-P363 CarbonylContact O-C 3.51Å; M361-P363 VanDerWaalsContact O-C 3.27Å; M361-I364 PolarHBondContact O-N 2.81Å; M361-P369 HydrophobicContact SD-CG 4.03Å
362	W	82.2	Confident	84.5	Confident	131 Å²	131	82 Å²	82	50%	0.496	47%	0.468	S	S	.	.	S	Bend	trans	-95.4	136	177	178.5	88.7	0	0	0	110.7	R446 N473	W362-R446 PolarHBondContact O-NH1 3.43Å; W362-R446 PolarHBondContact O-NH2 3.43Å; W362-N473 HydrophobicContact CH2-CB 3.54Å; W362-N473 WeakPolarHBondContact CH2-O 3.44Å; W362-N473 HydrophobicContact CZ2-CB 4.11Å; W362-N473 WeakPolarHBondContact CZ2-O 3.42Å; W362-N473 HydrophobicContact CZ3-CB 3.78Å
363	P	86.4	Confident	84.5	Confident	26 Å²	26	84.2 Å²	84.2	17%	0.169	47%	0.472	C	S	.	.	S	Bend	cis	-72.8	151.8	-12.9	-17.2	33.4	0	0	0	112.8	M361 I366 L475	M361-P363 CarbonylContact O-C 3.51Å; M361-P363 VanDerWaalsContact O-C 3.27Å; P363-I366 HydrophobicContact CB-CD1 4Å; P363-I366 HydrophobicContact CG-CD1 4.06Å; P363-L475 VanDerWaalsContact CD-CD2 3.47Å; P363-L475 HydrophobicContact CG-CB 4.14Å; P363-L475 HydrophobicContact CG-CD2 3.99Å
364	I	87.2	Confident	84.6	Confident	36 Å²	36	84.4 Å²	84.4	19%	0.185	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	133.7	179.5	-60.7	169.7	0	0	0	109.6	Q343 I346 V360 M361	Q343-I364 HydrophobicContact CB-CB 4.49Å; Q343-I364 HydrophobicContact CB-CG2 4.31Å; Q343-I364 HydrophobicContact CG-CB 4.02Å; Q343-I364 HydrophobicContact CG-CG2 3.91Å; Q343-I364 PolarHBondContact NE2-O 3.25Å; Q343-I364 VanDerWaalsContact NE2-O 3.12Å; I346-I364 HydrophobicContact CB-CG2 3.96Å; I346-I364 HydrophobicContact CD1-CG2 3.56Å; I346-I364 HydrophobicContact CG1-CG2 4.37Å; I346-I364 HydrophobicContact CG2-CG2 3.77Å; V360-I364 HydrophobicContact CG1-CD1 3.85Å; V360-I364 HydrophobicContact CG1-CG1 3.67Å; M361-I364 PolarHBondContact O-N 2.81Å
365	G	81.9	Confident	84.6	Confident	78 Å²	78	87.1 Å²	87.1	80%	0.804	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	91	7.5	-179.8	0	0	0	0	0	114.5
366	I	85.8	Confident	84.6	Confident	57 Å²	57	88.4 Å²	88.4	29%	0.292	47%	0.468	S	S	.	.	S	Bend	trans	-115	150.9	173.6	-58.2	176	0	0	0	108.8	P363 R446 L475 P477	P363-I366 HydrophobicContact CB-CD1 4Å; P363-I366 HydrophobicContact CG-CD1 4.06Å; I366-R446 HydrophobicContact CG2-CB 3.94Å; I366-L475 HydrophobicContact CB-CD2 4.36Å; I366-L475 HydrophobicContact CD1-CD2 3.62Å; I366-L475 HydrophobicContact CG2-CD2 3.83Å; I366-P477 HydrophobicContact CD1-CB 4.38Å
367	N	85.1	Confident	84.6	Confident	111 Å²	111	90.7 Å²	90.7	59%	0.594	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-47.4	142.9	175.8	-67.2	-14.7	0	0	0	112.1	T445 R446	N367-T445 WeakPolarHBondContact CB-O 3.16Å; N367-T445 PolarHBondContact ND2-O 2.99Å; N367-R446 HydrophobicContact CB-CB 4.4Å; N367-R446 PolarHBondContact O-NE 2.84Å
368	S	84.3	Confident	85.1	Confident	70 Å²	70	87.6 Å²	87.6	49%	0.49	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-63.9	145.1	176.4	58.2	0	0	0	0	111	T445	S368-T445 PolarHBondContact O-OG1 3.49Å; S368-T445 VanDerWaalsContact O-OG1 3.05Å
369	P	87.1	Confident	85.8	Confident	27 Å²	27	85.7 Å²	85.7	18%	0.175	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-59.5	150.5	177.6	26.9	-34.9	0	0	0	111.8	M361 K371 D443	M361-P369 HydrophobicContact SD-CG 4.03Å; P369-K371 PolarHBondContact O-N 3.11Å; P369-D443 VanDerWaalsContact CA-OD2 3.26Å; P369-D443 WeakPolarHBondContact CA-OD2 3.46Å
370	F	89.9	Confident	86.5	Confident	75 Å²	75	90.1 Å²	90.1	33%	0.329	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-58.7	127	175.5	176.4	-100.4	0	0	0	110.4	P372 E377 I379 D443 T445	F370-P372 HydrophobicContact CE1-CB 4.07Å; F370-P372 WeakPolarHBondContact O-CD 3.36Å; F370-E377 HydrophobicContact CE1-CB 3.95Å; F370-E377 WeakPolarHBondContact CE1-O 3.34Å; F370-E377 HydrophobicContact CZ-CB 4.14Å; F370-E377 HydrophobicContact CZ-CG 4.48Å; F370-I379 HydrophobicContact CB-CD1 4.2Å; F370-I379 HydrophobicContact CD1-CD1 3.88Å; F370-I379 HydrophobicContact CD1-CG1 4.28Å; F370-I379 HydrophobicContact CG-CD1 4.33Å; F370-D443 WeakPolarHBondContact CB-OD1 3.31Å; F370-D443 PolarHBondContact N-OD2 3.49Å; F370-T445 HydrophobicContact CB-CG2 4.01Å; F370-T445 HydrophobicContact CD2-CG2 4.42Å; F370-T445 PolarHBondContact N-OG1 2.84Å
371	K	88.7	Confident	87	Confident	157 Å²	157	92.4 Å²	92.4	68%	0.683	46%	0.464	S	S	*	.			trans	-100.9	106.2	178.2	-68.4	-176.1	-178.2	178.3	0	109	P369 K373	P369-K371 PolarHBondContact O-N 3.11Å; K371-K373 PolarHBondContact O-N 3.25Å
372	P	90.1	Very high	87.5	Confident	62 Å²	62	91 Å²	91	40%	0.403	46%	0.459	S	S	.	.			trans	-66.4	132.2	179.7	27.3	-33.8	0	0	0	110.4	F370 E377 V378	F370-P372 HydrophobicContact CE1-CB 4.07Å; F370-P372 WeakPolarHBondContact O-CD 3.36Å; P372-E377 HydrophobicContact CB-CB 3.7Å; P372-V378 HydrophobicContact CB-CG2 4.11Å; P372-V378 HydrophobicContact CG-CG2 4.04Å
373	K	90.5	Very high	88.1	Confident	193 Å²	193	87.9 Å²	87.9	84%	0.839	45%	0.447	S	S	*	.	S	Bend	trans	-84.2	-31.8	173.7	-64.5	-178.6	-179.5	178.3	0	111.6	K371 E377	K371-K373 PolarHBondContact O-N 3.25Å; K373-E377 PolarHBondContact N-OE2 3.46Å
374	T	89.4	Confident	88.5	Confident	65 Å²	65	86.7 Å²	86.7	40%	0.399	44%	0.439	S	S	.	.	S	Bend	trans	-123.3	160.4	-179.4	69.2	0	0	0	0	111.3	F376 E377	T374-F376 PolarHBondContact O-N 3.49Å; T374-F376 VanDerWaalsContact O-N 3.12Å; T374-E377 PolarHBondContact O-N 3.29Å; T374-E377 VanDerWaalsContact O-N 3.12Å; T374-E377 WeakPolarHBondContact OG1-CG 3.49Å; T374-E377 PolarHBondContact OG1-OE1 2.89Å
375	R	87.3	Confident	88.8	Confident	203 Å²	203	86.5 Å²	86.5	77%	0.766	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-21.1	174.7	62.2	178.1	-98.2	-164.5	-5.7	113.8
376	F	82.4	Confident	89.2	Confident	168 Å²	168	86.4 Å²	86.4	74%	0.737	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-14.9	-178.5	-57.6	-71.2	0	0	0	112.7	T374	T374-F376 PolarHBondContact O-N 3.49Å; T374-F376 VanDerWaalsContact O-N 3.12Å
377	E	84.9	Confident	89.5	Confident	67 Å²	67	90.2 Å²	90.2	31%	0.313	44%	0.435	S	S	.	.	S	Bend	trans	-92.1	-2.3	176.7	-70.6	163.3	-134.6	0	0	112.4	F370 P372 K373 T374 I379	F370-E377 HydrophobicContact CE1-CB 3.95Å; F370-E377 WeakPolarHBondContact CE1-O 3.34Å; F370-E377 HydrophobicContact CZ-CB 4.14Å; F370-E377 HydrophobicContact CZ-CG 4.48Å; P372-E377 HydrophobicContact CB-CB 3.7Å; K373-E377 PolarHBondContact N-OE2 3.46Å; T374-E377 PolarHBondContact O-N 3.29Å; T374-E377 VanDerWaalsContact O-N 3.12Å; T374-E377 WeakPolarHBondContact OG1-CG 3.49Å; T374-E377 PolarHBondContact OG1-OE1 2.89Å; E377-I379 PolarHBondContact O-N 3.31Å
378	V	90.3	Very high	89.8	Confident	73 Å²	73	86.2 Å²	86.2	44%	0.442	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-67.8	117.8	-179.1	178.4	0	0	0	0	109.6	P372 N380	P372-V378 HydrophobicContact CB-CG2 4.11Å; P372-V378 HydrophobicContact CG-CG2 4.04Å; V378-N380 PolarHBondContact O-N 2.86Å
379	I	90.8	Very high	90.2	Very high	50 Å²	50	83.2 Å²	83.2	26%	0.256	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-78.2	120.1	176	-55.3	175.1	0	0	0	108.8	F370 E377 R441 F442	F370-I379 HydrophobicContact CB-CD1 4.2Å; F370-I379 HydrophobicContact CD1-CD1 3.88Å; F370-I379 HydrophobicContact CD1-CG1 4.28Å; F370-I379 HydrophobicContact CG-CD1 4.33Å; E377-I379 PolarHBondContact O-N 3.31Å; I379-R441 HydrophobicContact CG2-CB 4.23Å; I379-F442 WeakPolarHBondContact CG2-O 3.42Å
380	N	89.6	Confident	90.2	Very high	120 Å²	120	86.6 Å²	86.6	64%	0.642	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-77.9	153.4	-178.9	-66.3	-28.7	0	0	0	112.1	V378 R441	V378-N380 PolarHBondContact O-N 2.86Å; N380-R441 WeakPolarHBondContact O-CB 3.35Å
381	W	92.4	Very high	89.9	Confident	89 Å²	89	85.2 Å²	85.2	34%	0.337	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-91.9	129	169.4	-76.7	93.5	0	0	0	110.1	R440 R441 E449 I451	W381-R440 VanDerWaalsContact CE3-C 3.47Å; W381-R441 HydrophobicContact CD2-CB 4.19Å; W381-R441 HydrophobicContact CD2-CG 3.97Å; W381-R441 VanDerWaalsContact CE2-CD 3.43Å; W381-R441 HydrophobicContact CE3-CB 4.04Å; W381-R441 HydrophobicContact CE3-CG 3.89Å; W381-R441 HydrophobicContact CH2-CG 3.86Å; W381-R441 HydrophobicContact CZ2-CG 3.93Å; W381-R441 HydrophobicContact CZ3-CB 4.39Å; W381-R441 HydrophobicContact CZ3-CG 3.84Å; W381-E449 HydrophobicContact CH2-CB 3.8Å; W381-E449 HydrophobicContact CZ3-CB 4.31Å; W381-I451 HydrophobicContact CH2-CD1 3.57Å; W381-I451 HydrophobicContact CH2-CG1 3.64Å; W381-I451 HydrophobicContact CZ2-CD1 3.64Å; W381-I451 HydrophobicContact CZ2-CG1 4.23Å; W381-I451 HydrophobicContact CZ3-CD1 4.06Å; W381-I451 HydrophobicContact CZ3-CG1 3.95Å
382	D	92.1	Very high	89.6	Confident	53 Å²	53	78.5 Å²	78.5	28%	0.283	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	121	175.3	-68.4	-20	0	0	0	109.8	S391 Y439 R440	D382-S391 VanDerWaalsContact CB-OG 3.3Å; D382-S391 WeakPolarHBondContact CB-OG 3.41Å; D382-S391 WeakPolarHBondContact OD1-CB 3.42Å; D382-S391 PolarHBondContact OD1-OG 3.14Å; D382-S391 VanDerWaalsContact OD1-OG 3.13Å; D382-S391 PolarHBondContact OD2-OG 3.02Å; D382-Y439 CarbonylContact O-C 3.57Å; D382-Y439 WeakPolarHBondContact O-CA 3.47Å; D382-R440 HydrophobicContact CB-CG 3.95Å; D382-R440 PolarHBondContact N-O 2.85Å; D382-R440 PolarHBondContact O-N 3.44Å
383	Y	94.6	Very high	88.7	Confident	66 Å²	66	83.1 Å²	83.1	26%	0.259	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	136.6	175.3	178.1	-106.3	0	0	0	111	T385 Y390 N437 G438 Y439	Y383-T385 HydrophobicContact CE1-CG2 4.08Å; Y383-Y390 AromaticContact CD1-CD2 3.43Å; Y383-Y390 HydrophobicContact CD1-CD2 3.43Å; Y383-Y390 VanDerWaalsContact CD1-CD2 3.43Å; Y383-Y390 AromaticContact CD1-CE2 3.85Å; Y383-Y390 HydrophobicContact CD1-CE2 3.85Å; Y383-Y390 AromaticContact CD1-CG 3.89Å; Y383-Y390 HydrophobicContact CD1-CG 3.89Å; Y383-Y390 AromaticContact CE1-CD2 3.84Å; Y383-Y390 HydrophobicContact CE1-CD2 3.84Å; Y383-Y390 AromaticContact CE1-CE2 3.74Å; Y383-Y390 HydrophobicContact CE1-CE2 3.74Å; Y383-Y390 PolarHBondContact O-N 3.06Å; Y383-N437 HydrophobicContact CE2-CB 3.94Å; Y383-G438 WeakPolarHBondContact CA-O 3.3Å; Y383-G438 VanDerWaalsContact CD2-O 3.24Å; Y383-G438 WeakPolarHBondContact CD2-O 3.41Å; Y383-Y439 AromaticContact CD2-CD1 3.96Å; Y383-Y439 HydrophobicContact CD2-CD1 3.96Å; Y383-Y439 AromaticContact CD2-CE1 3.54Å; Y383-Y439 HydrophobicContact CD2-CE1 3.54Å; Y383-Y439 AromaticContact CD2-CZ 3.89Å; Y383-Y439 HydrophobicContact CE2-CE1 4.36Å; Y383-Y439 HydrophobicContact CG-CE1 4.34Å
384	F	94.5	Very high	87.6	Confident	0 Å²	0	79 Å²	79	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	155.1	177.4	71.2	-90.3	0	0	0	112.8	H388 I389 M401 V409 L435 G438 R440 Y450 L452	F384-H388 CarbonylContact C-O 3.33Å; F384-H388 VanDerWaalsContact CA-O 3.31Å; F384-H388 WeakPolarHBondContact CA-O 3.2Å; F384-H388 WeakPolarHBondContact CB-O 3.44Å; F384-I389 HydrophobicContact CB-CG1 4Å; F384-M401 HydrophobicContact CB-CE 4Å; F384-M401 HydrophobicContact CD2-CE 3.93Å; F384-M401 HydrophobicContact CG-CE 4.31Å; F384-V409 HydrophobicContact CD2-CG1 4.06Å; F384-V409 HydrophobicContact CD2-CG2 3.82Å; F384-V409 HydrophobicContact CE2-CB 4.29Å; F384-V409 HydrophobicContact CE2-CG1 3.65Å; F384-V409 HydrophobicContact CE2-CG2 3.63Å; F384-V409 HydrophobicContact CG-CG2 4.49Å; F384-V409 HydrophobicContact CZ-CG2 4.16Å; F384-L435 HydrophobicContact CD2-CD2 4.07Å; F384-L435 HydrophobicContact CE2-CD2 3.72Å; F384-G438 VanDerWaalsContact CD1-C 3.5Å; F384-G438 WeakPolarHBondContact CD1-O 3.4Å; F384-G438 VanDerWaalsContact CE1-C 3.44Å; F384-G438 PolarHBondContact N-O 2.95Å; F384-G438 WeakPolarHBondContact O-CA 3.29Å; F384-G438 PolarHBondContact O-N 3.34Å; F384-G438 VanDerWaalsContact O-N 3.1Å; F384-R440 HydrophobicContact CD1-CB 4.23Å; F384-R440 HydrophobicContact CD1-CG 3.98Å; F384-R440 HydrophobicContact CE1-CB 3.86Å; F384-R440 HydrophobicContact CE1-CG 4.12Å; F384-Y450 HydrophobicContact CE1-CD1 4.46Å; F384-Y450 HydrophobicContact CZ-CD1 4.48Å; F384-L452 HydrophobicContact CE1-CD2 4.48Å; F384-L452 HydrophobicContact CE2-CD2 4.35Å; F384-L452 HydrophobicContact CZ-CD2 3.63Å
385	T	93.4	Very high	86.7	Confident	33 Å²	33	79.1 Å²	79.1	20%	0.202	40%	0.402	C	S	.	.			trans	-114.8	-179.4	168.4	66.3	0	0	0	0	109.5	Y383 E387 H388 Y390 M401	Y383-T385 HydrophobicContact CE1-CG2 4.08Å; T385-E387 PolarHBondContact O-N 3.42Å; T385-E387 VanDerWaalsContact O-N 3.1Å; T385-H388 PolarHBondContact N-O 2.96Å; T385-H388 PolarHBondContact OG1-N 3.21Å; T385-Y390 HydrophobicContact CG2-CE2 4.14Å; T385-M401 WeakPolarHBondContact O-CE 3.37Å
386	E	90.2	Very high	86.2	Confident	76 Å²	76	71.6 Å²	71.6	36%	0.355	38%	0.381	S	S	.	.	S	Bend	trans	-64.1	-16	178.4	-54.6	-164.2	179.5	0	0	113.4	K432 L435	E386-K432 IonicContact OE1-NZ 3.97Å; E386-K432 PolarHBondContact OE1-NZ 3.41Å; E386-K432 IonicContact OE2-NZ 2.89Å; E386-K432 PolarHBondContact OE2-NZ 3.14Å; E386-L435 HydrophobicContact CG-CB 3.67Å; E386-L435 HydrophobicContact CG-CD2 4.2Å; E386-L435 WeakPolarHBondContact OE1-CB 3.46Å; E386-L435 PolarHBondContact OE1-N 3.46Å
387	E	91.6	Very high	86.2	Confident	136 Å²	136	69 Å²	69	64%	0.636	38%	0.38	S	S	*	.	S	Bend	trans	-119.9	-20.3	-173.3	-66.3	175.5	-178.4	0	0	113.4	T385 M401	T385-E387 PolarHBondContact O-N 3.42Å; T385-E387 VanDerWaalsContact O-N 3.1Å; E387-M401 WeakPolarHBondContact O-CB 3.06Å; E387-M401 PolarHBondContact O-N 3.21Å
388	H	92.4	Very high	86.3	Confident	28 Å²	28	70.5 Å²	70.5	13%	0.13	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	153.4	-167.9	-56.8	93.9	0	0	0	113.6	F384 T385 Y390 K398 C399	F384-H388 CarbonylContact C-O 3.33Å; F384-H388 VanDerWaalsContact CA-O 3.31Å; F384-H388 WeakPolarHBondContact CA-O 3.2Å; F384-H388 WeakPolarHBondContact CB-O 3.44Å; T385-H388 PolarHBondContact N-O 2.96Å; T385-H388 PolarHBondContact OG1-N 3.21Å; H388-Y390 HydrophobicContact CB-CE2 4.21Å; H388-K398 HydrophobicContact CB-CD 4.47Å; H388-K398 HydrophobicContact CB-CG 4.03Å; H388-K398 WeakPolarHBondContact CD2-CE 3.21Å; H388-K398 PolarHBondContact CE1-NZ 2.93Å; H388-K398 VanDerWaalsContact CE1-NZ 3.32Å; H388-K398 WeakPolarHBondContact ND1-CE 3.35Å; H388-K398 WeakPolarHBondContact NE2-CE 3.48Å; H388-K398 PolarHBondContact NE2-NZ 2.81Å; H388-K398 VanDerWaalsContact NE2-NZ 3.19Å; H388-C399 CarbonylContact C-O 3.6Å; H388-C399 WeakPolarHBondContact CA-O 3.15Å; H388-C399 WeakPolarHBondContact CB-O 3.43Å
389	I	91.3	Very high	86.2	Confident	6 Å²	6	68.8 Å²	68.8	3%	0.031	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	146	172	-65.7	157.5	0	0	0	108.3	F384 S391 C392 K398 C399 M401 D405 R440	F384-I389 HydrophobicContact CB-CG1 4Å; I389-S391 WeakPolarHBondContact CG2-OG 3.42Å; I389-C392 PolarHBondContact O-SG 2.92Å; I389-K398 WeakPolarHBondContact O-CA 3.46Å; I389-C399 PolarHBondContact N-O 3.01Å; I389-C399 PolarHBondContact O-N 3.32Å; I389-C399 PolarHBondContact O-SG 3.06Å; I389-C399 VanDerWaalsContact O-SG 3.39Å; I389-M401 HydrophobicContact CD1-CE 4.18Å; I389-M401 HydrophobicContact CD1-CG 4.24Å; I389-M401 HydrophobicContact CG1-CE 3.78Å; I389-D405 HydrophobicContact CD1-CB 3.76Å; I389-R440 VanDerWaalsContact CD1-NH2 3.32Å
390	Y	88.8	Confident	86.1	Confident	99 Å²	99	71.7 Å²	71.7	39%	0.388	39%	0.389	S	S	.	.	S	Bend	trans	-111.4	18.2	-174.9	-69.5	-100.7	0	0	0	113.1	Y383 T385 H388 P397 K398	Y383-Y390 AromaticContact CD1-CD2 3.43Å; Y383-Y390 HydrophobicContact CD1-CD2 3.43Å; Y383-Y390 VanDerWaalsContact CD1-CD2 3.43Å; Y383-Y390 AromaticContact CD1-CE2 3.85Å; Y383-Y390 HydrophobicContact CD1-CE2 3.85Å; Y383-Y390 AromaticContact CD1-CG 3.89Å; Y383-Y390 HydrophobicContact CD1-CG 3.89Å; Y383-Y390 AromaticContact CE1-CD2 3.84Å; Y383-Y390 HydrophobicContact CE1-CD2 3.84Å; Y383-Y390 AromaticContact CE1-CE2 3.74Å; Y383-Y390 HydrophobicContact CE1-CE2 3.74Å; Y383-Y390 PolarHBondContact O-N 3.06Å; T385-Y390 HydrophobicContact CG2-CE2 4.14Å; H388-Y390 HydrophobicContact CB-CE2 4.21Å; Y390-P397 WeakPolarHBondContact CD1-O 3.43Å; Y390-K398 HydrophobicContact CD1-CB 4.24Å; Y390-K398 HydrophobicContact CD1-CG 4.47Å; Y390-K398 HydrophobicContact CE1-CB 4.13Å; Y390-K398 HydrophobicContact CE1-CD 4.15Å; Y390-K398 HydrophobicContact CE1-CG 4.05Å
391	S	83.8	Confident	86	Confident	46 Å²	46	66.5 Å²	66.5	32%	0.322	36%	0.361	S	S	.	.	S	Bend	trans	-131.9	64.4	178.1	55	0	0	0	0	110.4	D382 I389	D382-S391 VanDerWaalsContact CB-OG 3.3Å; D382-S391 WeakPolarHBondContact CB-OG 3.41Å; D382-S391 WeakPolarHBondContact OD1-CB 3.42Å; D382-S391 PolarHBondContact OD1-OG 3.14Å; D382-S391 VanDerWaalsContact OD1-OG 3.13Å; D382-S391 PolarHBondContact OD2-OG 3.02Å; I389-S391 WeakPolarHBondContact CG2-OG 3.42Å
392	C	80.3	Confident	85.7	Confident	16 Å²	16	70.5 Å²	70.5	11%	0.108	38%	0.376	C	S	.	.			trans	-81.3	142.3	-170.4	-48.6	0	0	0	0	112	I389 D394 G395 S396 C399	I389-C392 PolarHBondContact O-SG 2.92Å; C392-D394 WeakPolarHBondContact CB-OD1 3.41Å; C392-D394 PolarHBondContact O-N 2.84Å; C392-G395 PolarHBondContact O-N 3.49Å; C392-G395 VanDerWaalsContact O-N 3.07Å; C392-S396 WeakPolarHBondContact CB-O 3.2Å; C392-S396 PolarHBondContact SG-O 3.42Å; C392-S396 VanDerWaalsContact SG-O 3.38Å; C392-C399 VanDerWaalsContact CA-SG 3.59Å; C392-C399 HydrophobicContact CB-CB 3.8Å; C392-C399 WeakPolarHBondContact CB-SG 3.29Å; C392-C399 VanDerWaalsContact SG-CA 3.56Å; C392-C399 WeakPolarHBondContact SG-CB 3.31Å; C392-C399 PolarHBondContact SG-N 3.23Å; C392-C399 CovalentContact SG-SG 2.03Å; C392-C399 PolarHBondContact SG-SG 2.79Å
393	T	71.2	Confident	85.5	Confident	158 Å²	158	71 Å²	71	97%	0.969	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-27.2	-177.7	47.8	0	0	0	0	113.4	G395	T393-G395 PolarHBondContact O-N 2.99Å
394	D	67.4	Low	85.2	Confident	108 Å²	108	71.8 Å²	71.8	58%	0.578	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-1.7	176.1	64.8	-19.9	0	0	0	112.9	C392 S396	C392-D394 WeakPolarHBondContact CB-OD1 3.41Å; C392-D394 PolarHBondContact O-N 2.84Å; D394-S396 VanDerWaalsContact CG-OG 3.24Å; D394-S396 PolarHBondContact O-N 2.83Å; D394-S396 VanDerWaalsContact OD1-CB 3.28Å; D394-S396 WeakPolarHBondContact OD1-CB 3.16Å; D394-S396 PolarHBondContact OD1-N 2.83Å; D394-S396 PolarHBondContact OD1-OG 2.92Å; D394-S396 VanDerWaalsContact OD2-CB 3.31Å; D394-S396 WeakPolarHBondContact OD2-CB 3.44Å; D394-S396 PolarHBondContact OD2-OG 2.78Å
395	G	71.6	Confident	84.9	Confident	67 Å²	67	74.8 Å²	74.8	69%	0.691	43%	0.43	S	S	*	.			trans	78.9	3.7	-176	0	0	0	0	0	114.1	C392 T393	C392-G395 PolarHBondContact O-N 3.49Å; C392-G395 VanDerWaalsContact O-N 3.07Å; T393-G395 PolarHBondContact O-N 2.99Å
396	S	76.1	Confident	84.9	Confident	45 Å²	45	81.2 Å²	81.2	32%	0.315	45%	0.45	S	S	.	.			trans	-63.8	143.4	173.7	-70.3	0	0	0	0	110.7	C392 D394 K398	C392-S396 WeakPolarHBondContact CB-O 3.2Å; C392-S396 PolarHBondContact SG-O 3.42Å; C392-S396 VanDerWaalsContact SG-O 3.38Å; D394-S396 VanDerWaalsContact CG-OG 3.24Å; D394-S396 PolarHBondContact O-N 2.83Å; D394-S396 VanDerWaalsContact OD1-CB 3.28Å; D394-S396 WeakPolarHBondContact OD1-CB 3.16Å; D394-S396 PolarHBondContact OD1-N 2.83Å; D394-S396 PolarHBondContact OD1-OG 2.92Å; D394-S396 VanDerWaalsContact OD2-CB 3.31Å; D394-S396 WeakPolarHBondContact OD2-CB 3.44Å; D394-S396 PolarHBondContact OD2-OG 2.78Å; S396-K398 PolarHBondContact O-N 2.87Å
397	P	82.1	Confident	85	Confident	112 Å²	112	80.2 Å²	80.2	73%	0.727	46%	0.455	S	S	*	.	S	Bend	trans	-68	-19.7	179.9	27.5	-35	0	0	0	113.1	Y390	Y390-P397 WeakPolarHBondContact CD1-O 3.43Å
398	K	87.7	Confident	85.1	Confident	100 Å²	100	74.9 Å²	74.9	44%	0.435	43%	0.431	S	S	.	.			trans	-155.4	132.4	-176.8	-179.5	-174.1	167	-165.9	0	110.2	H388 I389 Y390 S396	H388-K398 HydrophobicContact CB-CD 4.47Å; H388-K398 HydrophobicContact CB-CG 4.03Å; H388-K398 WeakPolarHBondContact CD2-CE 3.21Å; H388-K398 PolarHBondContact CE1-NZ 2.93Å; H388-K398 VanDerWaalsContact CE1-NZ 3.32Å; H388-K398 WeakPolarHBondContact ND1-CE 3.35Å; H388-K398 WeakPolarHBondContact NE2-CE 3.48Å; H388-K398 PolarHBondContact NE2-NZ 2.81Å; H388-K398 VanDerWaalsContact NE2-NZ 3.19Å; I389-K398 WeakPolarHBondContact O-CA 3.46Å; Y390-K398 HydrophobicContact CD1-CB 4.24Å; Y390-K398 HydrophobicContact CD1-CG 4.47Å; Y390-K398 HydrophobicContact CE1-CB 4.13Å; Y390-K398 HydrophobicContact CE1-CD 4.15Å; Y390-K398 HydrophobicContact CE1-CG 4.05Å; S396-K398 PolarHBondContact O-N 2.87Å
399	C	88.1	Confident	85.1	Confident	37 Å²	37	73.7 Å²	73.7	25%	0.25	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	149.3	177.5	39.7	0	0	0	0	109.8	H388 I389 C392	H388-C399 CarbonylContact C-O 3.6Å; H388-C399 WeakPolarHBondContact CA-O 3.15Å; H388-C399 WeakPolarHBondContact CB-O 3.43Å; I389-C399 PolarHBondContact N-O 3.01Å; I389-C399 PolarHBondContact O-N 3.32Å; I389-C399 PolarHBondContact O-SG 3.06Å; I389-C399 VanDerWaalsContact O-SG 3.39Å; C392-C399 VanDerWaalsContact CA-SG 3.59Å; C392-C399 HydrophobicContact CB-CB 3.8Å; C392-C399 WeakPolarHBondContact CB-SG 3.29Å; C392-C399 VanDerWaalsContact SG-CA 3.56Å; C392-C399 WeakPolarHBondContact SG-CB 3.31Å; C392-C399 PolarHBondContact SG-N 3.23Å; C392-C399 CovalentContact SG-SG 2.03Å; C392-C399 PolarHBondContact SG-SG 2.79Å
400	E	89.8	Confident	85.2	Confident	111 Å²	111	76.1 Å²	76.1	52%	0.519	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	142.4	175.7	-71.1	-174.8	166.6	0	0	111.5	R402	E400-R402 HydrophobicContact CB-CG 4.34Å; E400-R402 PolarHBondContact O-N 3.14Å; E400-R402 IonicContact OE2-CZ 3.86Å; E400-R402 IonicContact OE2-NE 3.95Å; E400-R402 PolarHBondContact OE2-NE 3.43Å; E400-R402 IonicContact OE2-NH2 3.82Å; E400-R402 PolarHBondContact OE2-NH2 3.28Å
401	M	86.4	Confident	85.5	Confident	10 Å²	10	73.4 Å²	73.4	5%	0.049	44%	0.441	C	S	.	.			trans	-77.6	111.7	177.5	-165.8	177.8	-74.8	0	0	110.1	F384 T385 E387 I389 D405 R406 V409	F384-M401 HydrophobicContact CB-CE 4Å; F384-M401 HydrophobicContact CD2-CE 3.93Å; F384-M401 HydrophobicContact CG-CE 4.31Å; T385-M401 WeakPolarHBondContact O-CE 3.37Å; E387-M401 WeakPolarHBondContact O-CB 3.06Å; E387-M401 PolarHBondContact O-N 3.21Å; I389-M401 HydrophobicContact CD1-CE 4.18Å; I389-M401 HydrophobicContact CD1-CG 4.24Å; I389-M401 HydrophobicContact CG1-CE 3.78Å; M401-D405 HydrophobicContact CG-CB 4.02Å; M401-R406 HydrophobicContact CG-CB 3.88Å; M401-R406 HydrophobicContact CG-CG 4.49Å; M401-R406 HydrophobicContact SD-CB 4.43Å; M401-V409 HydrophobicContact CE-CB 4.16Å; M401-V409 HydrophobicContact CE-CG1 4.21Å; M401-V409 HydrophobicContact CE-CG2 3.67Å; M401-V409 HydrophobicContact SD-CB 3.59Å; M401-V409 VanDerWaalsContact SD-CB 3.59Å; M401-V409 HydrophobicContact SD-CG1 3.89Å; M401-V409 HydrophobicContact SD-CG2 3.68Å
402	R	86	Confident	86	Confident	174 Å²	174	71.9 Å²	71.9	66%	0.657	43%	0.429	S	S	*	.			trans	-129.4	159.9	-175.5	-63.8	-178.3	179.9	-177.3	1.1	111.5	E400 A404 D405	E400-R402 HydrophobicContact CB-CG 4.34Å; E400-R402 PolarHBondContact O-N 3.14Å; E400-R402 IonicContact OE2-CZ 3.86Å; E400-R402 IonicContact OE2-NE 3.95Å; E400-R402 PolarHBondContact OE2-NE 3.43Å; E400-R402 IonicContact OE2-NH2 3.82Å; E400-R402 PolarHBondContact OE2-NH2 3.28Å; R402-A404 PolarHBondContact O-N 3.48Å; R402-D405 PolarHBondContact O-N 3.05Å
403	G	88.6	Confident	86.7	Confident	62 Å²	62	71.7 Å²	71.7	64%	0.639	43%	0.427	S	S	*	.	H	α-helix	trans	54.5	-127.1	172.6	0	0	0	0	0	114.2	D405 R406 A407	G403-D405 VanDerWaalsContact C-N 3.34Å; G403-D405 PolarHBondContact O-N 2.88Å; G403-R406 PolarHBondContact O-N 2.68Å; G403-A407 PolarHBondContact O-N 3.12Å
404	A	87.9	Confident	87.9	Confident	83 Å²	83	70.8 Å²	70.8	69%	0.686	41%	0.412	S	S	*	.	H	α-helix	trans	-62.4	-36.5	-175.8	0	0	0	0	0	113.2	R402 R406 A407 D408	R402-A404 PolarHBondContact O-N 3.48Å; A404-R406 PolarHBondContact O-N 2.57Å; A404-A407 PolarHBondContact O-N 3.33Å; A404-D408 WeakPolarHBondContact O-CB 3.23Å; A404-D408 PolarHBondContact O-N 3.48Å
405	D	89.3	Confident	89.3	Confident	63 Å²	63	69 Å²	69	34%	0.337	40%	0.404	S	S	.	.	H	α-helix	trans	-63.3	-42.2	178.9	-75.7	-44.9	0	0	0	112.1	I389 M401 R402 G403 D408 V409 R440	I389-D405 HydrophobicContact CD1-CB 3.76Å; M401-D405 HydrophobicContact CG-CB 4.02Å; R402-D405 PolarHBondContact O-N 3.05Å; G403-D405 VanDerWaalsContact C-N 3.34Å; G403-D405 PolarHBondContact O-N 2.88Å; D405-D408 PolarHBondContact O-N 3.41Å; D405-V409 WeakPolarHBondContact O-CG2 3.3Å; D405-V409 PolarHBondContact O-N 3.24Å; D405-R440 IonicContact OD1-CZ 2.84Å; D405-R440 IonicContact OD1-NH1 3.1Å; D405-R440 PolarHBondContact OD1-NH1 3.49Å; D405-R440 IonicContact OD1-NH2 2.72Å; D405-R440 PolarHBondContact OD1-NH2 3.05Å; D405-R440 IonicContact OD2-NH2 2.66Å
406	R	92.2	Very high	90.4	Very high	169 Å²	169	65.8 Å²	65.8	64%	0.638	37%	0.372	S	S	*	.	H	α-helix	trans	-65.3	-43	177.8	-172.1	175.8	174.6	172.5	-0.4	111.4	M401 G403 A404 S410	M401-R406 HydrophobicContact CG-CB 3.88Å; M401-R406 HydrophobicContact CG-CG 4.49Å; M401-R406 HydrophobicContact SD-CB 4.43Å; G403-R406 PolarHBondContact O-N 2.68Å; A404-R406 PolarHBondContact O-N 2.57Å; R406-S410 PolarHBondContact O-N 3.07Å; R406-S410 PolarHBondContact O-OG 3.46Å; R406-S410 VanDerWaalsContact O-OG 3.11Å
407	A	93.5	Very high	91.3	Very high	55 Å²	55	64.6 Å²	64.6	46%	0.455	36%	0.362	S	S	.	.	H	α-helix	trans	-63.1	-44.5	177.5	0	0	0	0	0	111.5	G403 A404 S410 A411	G403-A407 PolarHBondContact O-N 3.12Å; A404-A407 PolarHBondContact O-N 3.33Å; A407-S410 WeakPolarHBondContact CA-OG 3.43Å; A407-S410 PolarHBondContact O-N 3.04Å; A407-S410 PolarHBondContact O-OG 3.36Å; A407-A411 WeakPolarHBondContact O-CB 3.45Å; A407-A411 PolarHBondContact O-N 3.01Å
408	D	92.5	Very high	91.9	Very high	23 Å²	23	64.8 Å²	64.8	12%	0.123	35%	0.354	C	S	.	.	H	α-helix	trans	-60.6	-47.6	177.4	-174.9	60.5	0	0	0	111.8	A404 D405 S410 A411 I412 Y450 R476	A404-D408 WeakPolarHBondContact O-CB 3.23Å; A404-D408 PolarHBondContact O-N 3.48Å; D405-D408 PolarHBondContact O-N 3.41Å; D408-S410 PolarHBondContact O-N 3.01Å; D408-A411 PolarHBondContact O-N 3.05Å; D408-I412 PolarHBondContact O-N 3.37Å; D408-Y450 PolarHBondContact OD1-OH 3.15Å; D408-Y450 VanDerWaalsContact OD1-OH 3.06Å; D408-Y450 WeakPolarHBondContact OD2-CE1 3.34Å; D408-Y450 PolarHBondContact OD2-OH 2.82Å; D408-R476 IonicContact OD1-NH1 2.78Å; D408-R476 PolarHBondContact OD1-NH1 2.99Å
409	V	92.9	Very high	92.2	Very high	3 Å²	3	67.9 Å²	67.9	2%	0.018	36%	0.362	C	S	.	.	H	α-helix	trans	-66.3	-38.2	178.2	170.3	0	0	0	0	112.1	F384 M401 D405 I412 L413	F384-V409 HydrophobicContact CD2-CG1 4.06Å; F384-V409 HydrophobicContact CD2-CG2 3.82Å; F384-V409 HydrophobicContact CE2-CB 4.29Å; F384-V409 HydrophobicContact CE2-CG1 3.65Å; F384-V409 HydrophobicContact CE2-CG2 3.63Å; F384-V409 HydrophobicContact CG-CG2 4.49Å; F384-V409 HydrophobicContact CZ-CG2 4.16Å; M401-V409 HydrophobicContact CE-CB 4.16Å; M401-V409 HydrophobicContact CE-CG1 4.21Å; M401-V409 HydrophobicContact CE-CG2 3.67Å; M401-V409 HydrophobicContact SD-CB 3.59Å; M401-V409 VanDerWaalsContact SD-CB 3.59Å; M401-V409 HydrophobicContact SD-CG1 3.89Å; M401-V409 HydrophobicContact SD-CG2 3.68Å; D405-V409 WeakPolarHBondContact O-CG2 3.3Å; D405-V409 PolarHBondContact O-N 3.24Å; V409-I412 WeakPolarHBondContact O-CG2 3.17Å; V409-L413 HydrophobicContact CG1-CD1 3.96Å; V409-L413 HydrophobicContact CG1-CG 4.48Å; V409-L413 WeakPolarHBondContact O-CB 3.32Å; V409-L413 WeakPolarHBondContact O-CD1 3.47Å; V409-L413 WeakPolarHBondContact O-CG 3.27Å; V409-L413 PolarHBondContact O-N 3.41Å
410	S	93.5	Very high	92.5	Very high	57 Å²	57	66.9 Å²	66.9	40%	0.399	36%	0.355	S	S	.	.	H	α-helix	trans	-62.9	-45.3	173.2	53.5	0	0	0	0	112.1	R406 A407 D408 L413 E414	R406-S410 PolarHBondContact O-N 3.07Å; R406-S410 PolarHBondContact O-OG 3.46Å; R406-S410 VanDerWaalsContact O-OG 3.11Å; A407-S410 WeakPolarHBondContact CA-OG 3.43Å; A407-S410 PolarHBondContact O-N 3.04Å; A407-S410 PolarHBondContact O-OG 3.36Å; D408-S410 PolarHBondContact O-N 3.01Å; S410-L413 PolarHBondContact O-N 2.87Å; S410-E414 WeakPolarHBondContact O-CG 3.47Å; S410-E414 PolarHBondContact O-N 2.96Å; S410-E414 VanDerWaalsContact O-N 3.11Å
411	A	94.9	Very high	92.7	Very high	43 Å²	43	62.5 Å²	62.5	36%	0.355	34%	0.335	S	S	.	.	H	α-helix	trans	-64.7	-44.1	-178.1	0	0	0	0	0	111.6	A407 D408 L413 E414 V415	A407-A411 WeakPolarHBondContact O-CB 3.45Å; A407-A411 PolarHBondContact O-N 3.01Å; D408-A411 PolarHBondContact O-N 3.05Å; A411-L413 VanDerWaalsContact C-N 3.31Å; A411-L413 PolarHBondContact O-N 3.5Å; A411-E414 PolarHBondContact O-N 3.13Å; A411-V415 WeakPolarHBondContact O-CB 3.25Å; A411-V415 VanDerWaalsContact O-CG2 3.29Å; A411-V415 WeakPolarHBondContact O-CG2 3.21Å; A411-V415 PolarHBondContact O-N 3.13Å
412	I	95.2	Very high	93	Very high	14 Å²	14	66.9 Å²	66.9	7%	0.072	36%	0.355	C	S	.	.	H	α-helix	trans	-67	-33.3	-178.9	-158.3	65	0	0	0	112.2	D408 V409 A416 Y450 L452 L474	D408-I412 PolarHBondContact O-N 3.37Å; V409-I412 WeakPolarHBondContact O-CG2 3.17Å; I412-A416 VanDerWaalsContact O-CB 3.29Å; I412-A416 WeakPolarHBondContact O-CB 3.28Å; I412-A416 PolarHBondContact O-N 3.04Å; I412-Y450 HydrophobicContact CD1-CD2 3.85Å; I412-Y450 HydrophobicContact CD1-CE2 4.06Å; I412-Y450 HydrophobicContact CD1-CG 4.3Å; I412-Y450 HydrophobicContact CG1-CD1 4.12Å; I412-Y450 HydrophobicContact CG1-CD2 3.91Å; I412-Y450 HydrophobicContact CG1-CE1 4.44Å; I412-Y450 HydrophobicContact CG1-CE2 4.26Å; I412-Y450 HydrophobicContact CG1-CG 3.84Å; I412-Y450 HydrophobicContact CG2-CD1 4.33Å; I412-Y450 HydrophobicContact CG2-CE1 4.47Å; I412-L452 HydrophobicContact CG1-CD1 4.25Å; I412-L452 HydrophobicContact CG2-CD1 4.22Å; I412-L474 HydrophobicContact CD1-CB 3.9Å; I412-L474 HydrophobicContact CD1-CD1 3.67Å; I412-L474 HydrophobicContact CD1-CG 4.35Å; I412-L474 HydrophobicContact CG1-CB 4.39Å; I412-L474 HydrophobicContact CG1-CD1 3.63Å
413	L	94.8	Very high	93.2	Very high	11 Å²	11	68 Å²	68	6%	0.058	36%	0.359	C	S	.	.	H	α-helix	trans	-69	-39.9	175.5	-71.1	171.8	0	0	0	112	V409 S410 A411 V417 K432 L435 L452 L454	V409-L413 HydrophobicContact CG1-CD1 3.96Å; V409-L413 HydrophobicContact CG1-CG 4.48Å; V409-L413 WeakPolarHBondContact O-CB 3.32Å; V409-L413 WeakPolarHBondContact O-CD1 3.47Å; V409-L413 WeakPolarHBondContact O-CG 3.27Å; V409-L413 PolarHBondContact O-N 3.41Å; S410-L413 PolarHBondContact O-N 2.87Å; A411-L413 VanDerWaalsContact C-N 3.31Å; A411-L413 PolarHBondContact O-N 3.5Å; L413-V417 WeakPolarHBondContact O-CG2 3.35Å; L413-V417 PolarHBondContact O-N 3.46Å; L413-K432 HydrophobicContact CB-CD 4.43Å; L413-K432 HydrophobicContact CD1-CD 4.46Å; L413-K432 HydrophobicContact CD2-CD 4.49Å; L413-L435 HydrophobicContact CD2-CB 4.43Å; L413-L435 HydrophobicContact CD2-CD1 4.11Å; L413-L435 HydrophobicContact CD2-CD2 4.49Å; L413-L452 HydrophobicContact CD2-CD1 4.22Å; L413-L454 HydrophobicContact CD2-CD2 3.51Å
414	E	95.4	Very high	93.3	Very high	140 Å²	140	68.4 Å²	68.4	65%	0.654	34%	0.342	S	S	*	.	H	α-helix	trans	-64.5	-50.4	175.2	-73.1	179.3	178	0	0	111.1	S410 A411 A416 V417 E418	S410-E414 WeakPolarHBondContact O-CG 3.47Å; S410-E414 PolarHBondContact O-N 2.96Å; S410-E414 VanDerWaalsContact O-N 3.11Å; A411-E414 PolarHBondContact O-N 3.13Å; E414-A416 VanDerWaalsContact C-N 3.28Å; E414-A416 PolarHBondContact O-N 3.35Å; E414-V417 PolarHBondContact O-N 3.4Å; E414-V417 VanDerWaalsContact O-N 3.12Å; E414-E418 WeakPolarHBondContact O-CB 3.39Å; E414-E418 PolarHBondContact O-N 2.91Å
415	V	95.9	Very high	93.3	Very high	69 Å²	69	70.1 Å²	70.1	42%	0.418	34%	0.336	S	S	.	.	H	α-helix	trans	-58.9	-39.1	177.1	171.9	0	0	0	0	111.4	A411 V417 E418 R419	A411-V415 WeakPolarHBondContact O-CB 3.25Å; A411-V415 VanDerWaalsContact O-CG2 3.29Å; A411-V415 WeakPolarHBondContact O-CG2 3.21Å; A411-V415 PolarHBondContact O-N 3.13Å; V415-V417 PolarHBondContact O-N 3.28Å; V415-E418 PolarHBondContact O-N 2.63Å; V415-R419 VanDerWaalsContact O-CB 3.28Å; V415-R419 WeakPolarHBondContact O-CB 3.29Å; V415-R419 PolarHBondContact O-N 3.32Å
416	A	95.5	Very high	93.1	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-58.7	-46.7	176.4	0	0	0	0	0	112	I412 E414 L420 L452 L454 V472 L474	I412-A416 VanDerWaalsContact O-CB 3.29Å; I412-A416 WeakPolarHBondContact O-CB 3.28Å; I412-A416 PolarHBondContact O-N 3.04Å; E414-A416 VanDerWaalsContact C-N 3.28Å; E414-A416 PolarHBondContact O-N 3.35Å; A416-L420 WeakPolarHBondContact O-CB 2.98Å; A416-L420 WeakPolarHBondContact O-CG 3.46Å; A416-L420 PolarHBondContact O-N 3.37Å; A416-L420 VanDerWaalsContact O-N 3.09Å; A416-L452 HydrophobicContact CB-CD1 4.09Å; A416-L454 HydrophobicContact CB-CD1 3.91Å; A416-V472 HydrophobicContact CB-CG1 4.42Å; A416-L474 HydrophobicContact CB-CD1 3.77Å
417	V	95	Very high	93	Very high	20 Å²	20	70.4 Å²	70.4	12%	0.121	35%	0.351	C	S	.	.	H	α-helix	trans	-73	-40.2	-177.8	174.8	0	0	0	0	111.1	L413 E414 V415 L420 N421 K432 L456	L413-V417 WeakPolarHBondContact O-CG2 3.35Å; L413-V417 PolarHBondContact O-N 3.46Å; E414-V417 PolarHBondContact O-N 3.4Å; E414-V417 VanDerWaalsContact O-N 3.12Å; V415-V417 PolarHBondContact O-N 3.28Å; V417-L420 PolarHBondContact O-N 2.63Å; V417-N421 WeakPolarHBondContact O-CB 3.31Å; V417-N421 PolarHBondContact O-N 2.93Å; V417-N421 PolarHBondContact O-ND2 3.1Å; V417-K432 HydrophobicContact CG2-CB 4.04Å; V417-L456 HydrophobicContact CG2-CD2 4.18Å
418	E	95.5	Very high	92.8	Very high	116 Å²	116	70.4 Å²	70.4	54%	0.542	34%	0.343	S	S	.	.	H	α-helix	trans	-58.2	-52.4	174.1	-176.7	174.5	-156.6	0	0	110.6	E414 V415 L420 N421 E422	E414-E418 WeakPolarHBondContact O-CB 3.39Å; E414-E418 PolarHBondContact O-N 2.91Å; V415-E418 PolarHBondContact O-N 2.63Å; E418-L420 VanDerWaalsContact C-N 3.3Å; E418-L420 PolarHBondContact O-N 2.95Å; E418-N421 CarbonylContact O-C 3.51Å; E418-N421 WeakPolarHBondContact O-CA 3.4Å; E418-N421 WeakPolarHBondContact O-CB 3.39Å; E418-N421 PolarHBondContact O-N 2.92Å; E418-E422 WeakPolarHBondContact O-CG 3.41Å; E418-E422 PolarHBondContact O-N 3.35Å
419	R	93.4	Very high	92.8	Very high	165 Å²	165	77.4 Å²	77.4	62%	0.623	37%	0.368	S	S	*	.	H	α-helix	trans	-66.4	-31.3	-177.8	-158.2	56.3	165.7	173.3	-0.1	113.2	V415 E422 R423	V415-R419 VanDerWaalsContact O-CB 3.28Å; V415-R419 WeakPolarHBondContact O-CB 3.29Å; V415-R419 PolarHBondContact O-N 3.32Å; R419-E422 WeakPolarHBondContact CD-OE2 3.02Å; R419-E422 IonicContact CZ-OE2 3.06Å; R419-E422 IonicContact NE-OE2 3.68Å; R419-E422 IonicContact NH1-OE2 3.27Å; R419-E422 PolarHBondContact NH1-OE2 3.07Å; R419-R423 WeakPolarHBondContact O-CB 3.42Å; R419-R423 PolarHBondContact O-N 3.14Å
420	L	93.5	Very high	92.8	Very high	16 Å²	16	77.8 Å²	77.8	8%	0.084	37%	0.369	C	S	.	.	H	α-helix	trans	-66.1	-45	169.4	-76	172.7	0	0	0	111.2	A416 V417 E418 R423 Y424 F430 L456 V472	A416-L420 WeakPolarHBondContact O-CB 2.98Å; A416-L420 WeakPolarHBondContact O-CG 3.46Å; A416-L420 PolarHBondContact O-N 3.37Å; A416-L420 VanDerWaalsContact O-N 3.09Å; V417-L420 PolarHBondContact O-N 2.63Å; E418-L420 VanDerWaalsContact C-N 3.3Å; E418-L420 PolarHBondContact O-N 2.95Å; L420-R423 PolarHBondContact O-N 3.01Å; L420-Y424 HydrophobicContact CD2-CD2 4.46Å; L420-Y424 HydrophobicContact CD2-CE2 3.95Å; L420-Y424 VanDerWaalsContact O-CD2 3.25Å; L420-Y424 WeakPolarHBondContact O-CD2 3.25Å; L420-Y424 PolarHBondContact O-N 2.96Å; L420-Y424 VanDerWaalsContact O-N 3.14Å; L420-F430 HydrophobicContact CB-CD2 3.9Å; L420-F430 HydrophobicContact CB-CE2 4.39Å; L420-L456 HydrophobicContact CD1-CD1 3.5Å; L420-V472 HydrophobicContact CD1-CG2 3.86Å; L420-V472 HydrophobicContact CD2-CG2 4.42Å; L420-V472 HydrophobicContact CG-CG2 4.36Å
421	N	94.1	Very high	92.8	Very high	20 Å²	20	83.1 Å²	83.1	11%	0.107	38%	0.38	C	S	.	.	H	α-helix	trans	-62.2	-45.9	177.8	-79.6	-45.6	0	0	0	111.8	V417 E418 R423 Y424 Q425 R429 F430	V417-N421 WeakPolarHBondContact O-CB 3.31Å; V417-N421 PolarHBondContact O-N 2.93Å; V417-N421 PolarHBondContact O-ND2 3.1Å; E418-N421 CarbonylContact O-C 3.51Å; E418-N421 WeakPolarHBondContact O-CA 3.4Å; E418-N421 WeakPolarHBondContact O-CB 3.39Å; E418-N421 PolarHBondContact O-N 2.92Å; N421-R423 PolarHBondContact O-N 3.38Å; N421-Y424 PolarHBondContact O-N 3.34Å; N421-Q425 WeakPolarHBondContact O-CB 3.43Å; N421-Q425 WeakPolarHBondContact O-CG 3.14Å; N421-Q425 PolarHBondContact O-N 3.47Å; N421-R429 WeakPolarHBondContact OD1-CA 3.41Å; N421-F430 PolarHBondContact ND2-O 3.37Å; N421-F430 VanDerWaalsContact ND2-O 3.1Å; N421-F430 PolarHBondContact OD1-N 2.82Å
422	E	93.1	Very high	92.7	Very high	101 Å²	101	84.5 Å²	84.5	47%	0.472	38%	0.378	S	S	.	.	H	α-helix	trans	-57.6	-38.1	176.1	-69.6	179	148.2	0	0	112.4	E418 R419	E418-E422 WeakPolarHBondContact O-CG 3.41Å; E418-E422 PolarHBondContact O-N 3.35Å; R419-E422 WeakPolarHBondContact CD-OE2 3.02Å; R419-E422 IonicContact CZ-OE2 3.06Å; R419-E422 IonicContact NE-OE2 3.68Å; R419-E422 IonicContact NH1-OE2 3.27Å; R419-E422 PolarHBondContact NH1-OE2 3.07Å
423	R	91.1	Very high	92.6	Very high	197 Å²	197	91.9 Å²	91.9	74%	0.743	41%	0.405	S	S	*	.	H	α-helix	trans	-73.8	-34.5	-177.8	-174.6	172.6	-175.1	170.8	3.8	114.1	R419 L420 N421	R419-R423 WeakPolarHBondContact O-CB 3.42Å; R419-R423 PolarHBondContact O-N 3.14Å; L420-R423 PolarHBondContact O-N 3.01Å; N421-R423 PolarHBondContact O-N 3.38Å
424	Y	89.9	Confident	92.6	Very high	71 Å²	71	98.8 Å²	98.8	28%	0.278	43%	0.431	S	S	.	.	H	α-helix	trans	-111.2	-2.3	-173.1	-64.2	-80.9	0	0	0	113.8	L420 N421 Q427 L428 F430	L420-Y424 HydrophobicContact CD2-CD2 4.46Å; L420-Y424 HydrophobicContact CD2-CE2 3.95Å; L420-Y424 VanDerWaalsContact O-CD2 3.25Å; L420-Y424 WeakPolarHBondContact O-CD2 3.25Å; L420-Y424 PolarHBondContact O-N 2.96Å; L420-Y424 VanDerWaalsContact O-N 3.14Å; N421-Y424 PolarHBondContact O-N 3.34Å; Y424-Q427 WeakPolarHBondContact O-CB 3.27Å; Y424-Q427 PolarHBondContact O-N 3.03Å; Y424-L428 PolarHBondContact O-N 3.43Å; Y424-L428 VanDerWaalsContact O-N 3.09Å; Y424-F430 AromaticContact CD2-CE2 3.5Å; Y424-F430 HydrophobicContact CD2-CE2 3.5Å; Y424-F430 VanDerWaalsContact CD2-CE2 3.5Å; Y424-F430 HydrophobicContact CD2-CZ 4.04Å; Y424-F430 HydrophobicContact CE2-CE2 4.31Å; Y424-F430 AromaticContact CG-CE2 3.86Å; Y424-F430 HydrophobicContact CG-CE2 3.86Å; Y424-F430 HydrophobicContact CG-CZ 4.24Å
425	Q	87.3	Confident	92.5	Very high	119 Å²	119	92.9 Å²	92.9	56%	0.556	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	144.7	170	-87.5	-178.2	11.1	0	0	111.2	N421	N421-Q425 WeakPolarHBondContact O-CB 3.43Å; N421-Q425 WeakPolarHBondContact O-CG 3.14Å; N421-Q425 PolarHBondContact O-N 3.47Å
426	P	85.4	Confident	92.5	Very high	97 Å²	97	92.4 Å²	92.4	63%	0.63	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	cis	-89.2	6.1	0.9	35.8	-36	0	0	0	114	Q461	P426-Q461 WeakPolarHBondContact O-CG 3.4Å; P426-Q461 PolarHBondContact O-NE2 3.38Å
427	Q	89.8	Confident	92.5	Very high	141 Å²	141	94.9 Å²	94.9	66%	0.659	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-43.3	-168.7	-60.7	173	7.9	0	0	112.7	Y424	Y424-Q427 WeakPolarHBondContact O-CB 3.27Å; Y424-Q427 PolarHBondContact O-N 3.03Å
428	L	90.3	Very high	92.6	Very high	55 Å²	55	93.9 Å²	93.9	29%	0.288	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	141.1	179.8	-66.3	172.2	0	0	0	110.4	Y424 F430 F459 T460	Y424-L428 PolarHBondContact O-N 3.43Å; Y424-L428 VanDerWaalsContact O-N 3.09Å; L428-F430 HydrophobicContact CB-CE1 4.39Å; L428-F430 HydrophobicContact CB-CE2 4.1Å; L428-F430 HydrophobicContact CB-CZ 3.83Å; L428-F430 HydrophobicContact CD1-CE1 4.39Å; L428-F430 HydrophobicContact CD1-CZ 3.88Å; L428-F459 WeakPolarHBondContact CA-O 3.48Å; L428-T460 HydrophobicContact CD2-CG2 4Å
429	R	92.1	Very high	92.6	Very high	170 Å²	170	91.8 Å²	91.8	64%	0.642	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.5	126.4	168.4	-175.9	179.8	-179.6	179.6	1.2	109.3	N421 A458 F459	N421-R429 WeakPolarHBondContact OD1-CA 3.41Å; R429-A458 CarbonylContact O-C 3.58Å; R429-A458 WeakPolarHBondContact O-CA 3.23Å; R429-F459 HydrophobicContact CB-CB 4.42Å; R429-F459 PolarHBondContact N-O 2.82Å; R429-F459 PolarHBondContact O-N 2.87Å
430	F	93.3	Very high	92.7	Very high	11 Å²	11	85.1 Å²	85.1	5%	0.048	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	138.7	179.1	-56.5	-74.9	0	0	0	111.2	L420 N421 Y424 L428 L456 E457 A458 I468	L420-F430 HydrophobicContact CB-CD2 3.9Å; L420-F430 HydrophobicContact CB-CE2 4.39Å; N421-F430 PolarHBondContact ND2-O 3.37Å; N421-F430 VanDerWaalsContact ND2-O 3.1Å; N421-F430 PolarHBondContact OD1-N 2.82Å; Y424-F430 AromaticContact CD2-CE2 3.5Å; Y424-F430 HydrophobicContact CD2-CE2 3.5Å; Y424-F430 VanDerWaalsContact CD2-CE2 3.5Å; Y424-F430 HydrophobicContact CD2-CZ 4.04Å; Y424-F430 HydrophobicContact CE2-CE2 4.31Å; Y424-F430 AromaticContact CG-CE2 3.86Å; Y424-F430 HydrophobicContact CG-CE2 3.86Å; Y424-F430 HydrophobicContact CG-CZ 4.24Å; L428-F430 HydrophobicContact CB-CE1 4.39Å; L428-F430 HydrophobicContact CB-CE2 4.1Å; L428-F430 HydrophobicContact CB-CZ 3.83Å; L428-F430 HydrophobicContact CD1-CE1 4.39Å; L428-F430 HydrophobicContact CD1-CZ 3.88Å; F430-L456 HydrophobicContact CB-CB 4.49Å; F430-L456 HydrophobicContact CB-CD1 4.38Å; F430-L456 HydrophobicContact CD1-CB 4.23Å; F430-L456 HydrophobicContact CD1-CD1 4.18Å; F430-L456 HydrophobicContact CG-CD1 4.34Å; F430-E457 CarbonylContact C-O 3.56Å; F430-E457 WeakPolarHBondContact CA-O 3.46Å; F430-A458 HydrophobicContact CD1-CB 3.76Å; F430-A458 HydrophobicContact CE1-CB 3.64Å; F430-I468 HydrophobicContact CD1-CD1 4.04Å; F430-I468 HydrophobicContact CE1-CD1 3.47Å; F430-I468 VanDerWaalsContact CE1-CD1 3.47Å; F430-I468 HydrophobicContact CE1-CG1 4.5Å; F430-I468 HydrophobicContact CZ-CD1 4.45Å
431	R	93	Very high	92.6	Very high	169 Å²	169	87.2 Å²	87.2	64%	0.638	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.5	133	167.2	-173.2	179.4	-177.9	176.1	1.4	109.3	R433 L456 E457 F459	R431-R433 PolarHBondContact O-N 3.28Å; R431-L456 CarbonylContact O-C 3.6Å; R431-L456 WeakPolarHBondContact O-CA 3.26Å; R431-E457 PolarHBondContact N-O 3.22Å; R431-E457 PolarHBondContact O-N 3.32Å; R431-F459 HydrophobicContact CB-CE2 3.94Å
432	K	93.4	Very high	92.6	Very high	72 Å²	72	91.5 Å²	91.5	31%	0.313	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	127.8	173.4	-166.3	-170.6	73.9	145.5	0	109.6	E386 L413 V417	E386-K432 IonicContact OE1-NZ 3.97Å; E386-K432 PolarHBondContact OE1-NZ 3.41Å; E386-K432 IonicContact OE2-NZ 2.89Å; E386-K432 PolarHBondContact OE2-NZ 3.14Å; L413-K432 HydrophobicContact CB-CD 4.43Å; L413-K432 HydrophobicContact CD1-CD 4.46Å; L413-K432 HydrophobicContact CD2-CD 4.49Å; V417-K432 HydrophobicContact CG2-CB 4.04Å
433	R	93.1	Very high	92.5	Very high	170 Å²	170	86.9 Å²	86.9	64%	0.642	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	-51.9	166.6	-169.2	176.3	-179.2	-172.9	1.5	110.9	R431 A455	R431-R433 PolarHBondContact O-N 3.28Å; R433-A455 WeakPolarHBondContact CB-O 3.35Å; R433-A455 PolarHBondContact N-O 2.9Å
434	R	93.8	Very high	92.4	Very high	155 Å²	155	81 Å²	81	59%	0.585	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-162.6	155.4	174.1	62.9	177.2	-175	175.6	4.5	111.7	L436 A455	R434-L436 HydrophobicContact CG-CD2 4.27Å; R434-A455 HydrophobicContact CG-CB 3.86Å; R434-A455 PolarHBondContact N-O 3.08Å; R434-A455 PolarHBondContact O-N 3.19Å
435	L	94.9	Very high	92.3	Very high	17 Å²	17	79.8 Å²	79.8	9%	0.089	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	130.8	160.8	-178.2	63.3	0	0	0	109.8	F384 E386 L413 N437 L452 L454	F384-L435 HydrophobicContact CD2-CD2 4.07Å; F384-L435 HydrophobicContact CE2-CD2 3.72Å; E386-L435 HydrophobicContact CG-CB 3.67Å; E386-L435 HydrophobicContact CG-CD2 4.2Å; E386-L435 WeakPolarHBondContact OE1-CB 3.46Å; E386-L435 PolarHBondContact OE1-N 3.46Å; L413-L435 HydrophobicContact CD2-CB 4.43Å; L413-L435 HydrophobicContact CD2-CD1 4.11Å; L413-L435 HydrophobicContact CD2-CD2 4.49Å; L435-N437 WeakPolarHBondContact CD1-O 3.36Å; L435-L452 HydrophobicContact CD1-CB 4.32Å; L435-L452 HydrophobicContact CD1-CD2 4.3Å; L435-L454 HydrophobicContact CB-CD2 4.46Å; L435-L454 HydrophobicContact CD1-CD2 3.63Å
436	L	94.9	Very high	92.4	Very high	58 Å²	58	74.5 Å²	74.5	30%	0.304	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-57.2	172.5	-59.4	174.4	0	0	0	109.9	R434 D453 A455 A469	R434-L436 HydrophobicContact CG-CD2 4.27Å; L436-D453 WeakPolarHBondContact CA-O 3.44Å; L436-D453 HydrophobicContact CB-CB 4.1Å; L436-D453 VanDerWaalsContact CB-O 3.27Å; L436-D453 WeakPolarHBondContact CB-O 3.22Å; L436-D453 PolarHBondContact N-O 3.33Å; L436-A455 HydrophobicContact CD1-CB 4.35Å; L436-A455 HydrophobicContact CD2-CB 4.14Å; L436-A455 HydrophobicContact CG-CB 4.15Å; L436-A469 HydrophobicContact CD1-CB 4.19Å
437	N	95.7	Very high	92.7	Very high	52 Å²	52	70 Å²	70	28%	0.278	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	133.1	177.9	-54.2	-51.3	0	0	0	109.4	Y383 L435 Y439 D453	Y383-N437 HydrophobicContact CE2-CB 3.94Å; L435-N437 WeakPolarHBondContact CD1-O 3.36Å; N437-Y439 HydrophobicContact CB-CE2 3.72Å; N437-D453 HydrophobicContact CB-CB 4Å; N437-D453 PolarHBondContact N-O 2.82Å; N437-D453 PolarHBondContact ND2-OD2 2.87Å; N437-D453 VanDerWaalsContact ND2-OD2 3.08Å; N437-D453 PolarHBondContact O-N 2.85Å
438	G	96.4	Very high	92.9	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	132.3	168.7	0	0	0	0	0	110.2	Y383 F384	Y383-G438 WeakPolarHBondContact CA-O 3.3Å; Y383-G438 VanDerWaalsContact CD2-O 3.24Å; Y383-G438 WeakPolarHBondContact CD2-O 3.41Å; F384-G438 VanDerWaalsContact CD1-C 3.5Å; F384-G438 WeakPolarHBondContact CD1-O 3.4Å; F384-G438 VanDerWaalsContact CE1-C 3.44Å; F384-G438 PolarHBondContact N-O 2.95Å; F384-G438 WeakPolarHBondContact O-CA 3.29Å; F384-G438 PolarHBondContact O-N 3.34Å; F384-G438 VanDerWaalsContact O-N 3.1Å
439	Y	96.5	Very high	93.1	Very high	72 Å²	72	63.4 Å²	63.4	28%	0.282	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	134.2	169.2	-53.3	-89	0	0	0	108.7	D382 Y383 N437 Y450 I451	D382-Y439 CarbonylContact O-C 3.57Å; D382-Y439 WeakPolarHBondContact O-CA 3.47Å; Y383-Y439 AromaticContact CD2-CD1 3.96Å; Y383-Y439 HydrophobicContact CD2-CD1 3.96Å; Y383-Y439 AromaticContact CD2-CE1 3.54Å; Y383-Y439 HydrophobicContact CD2-CE1 3.54Å; Y383-Y439 AromaticContact CD2-CZ 3.89Å; Y383-Y439 HydrophobicContact CE2-CE1 4.36Å; Y383-Y439 HydrophobicContact CG-CE1 4.34Å; N437-Y439 HydrophobicContact CB-CE2 3.72Å; Y439-Y450 CarbonylContact O-C 3.52Å; Y439-Y450 VanDerWaalsContact O-CA 3.3Å; Y439-Y450 WeakPolarHBondContact O-CA 3.44Å; Y439-I451 HydrophobicContact CD2-CB 4.25Å; Y439-I451 HydrophobicContact CD2-CG2 4.3Å; Y439-I451 PolarHBondContact N-O 2.79Å; Y439-I451 PolarHBondContact O-N 2.75Å
440	R	94.6	Very high	93.3	Very high	24 Å²	24	55.4 Å²	55.4	9%	0.091	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	151.9	173.5	67.4	-175.3	-172.4	170.8	5.6	111.6	W381 D382 F384 I389 D405 M448 E449 Y450	W381-R440 VanDerWaalsContact CE3-C 3.47Å; D382-R440 HydrophobicContact CB-CG 3.95Å; D382-R440 PolarHBondContact N-O 2.85Å; D382-R440 PolarHBondContact O-N 3.44Å; F384-R440 HydrophobicContact CD1-CB 4.23Å; F384-R440 HydrophobicContact CD1-CG 3.98Å; F384-R440 HydrophobicContact CE1-CB 3.86Å; F384-R440 HydrophobicContact CE1-CG 4.12Å; I389-R440 VanDerWaalsContact CD1-NH2 3.32Å; D405-R440 IonicContact OD1-CZ 2.84Å; D405-R440 IonicContact OD1-NH1 3.1Å; D405-R440 PolarHBondContact OD1-NH1 3.49Å; D405-R440 IonicContact OD1-NH2 2.72Å; D405-R440 PolarHBondContact OD1-NH2 3.05Å; D405-R440 IonicContact OD2-NH2 2.66Å; R440-M448 HydrophobicContact CB-CE 4.24Å; R440-M448 HydrophobicContact CG-CE 4.46Å; R440-E449 CarbonylContact C-O 3.47Å; R440-E449 VanDerWaalsContact CA-O 3.24Å; R440-E449 WeakPolarHBondContact CA-O 3.36Å; R440-Y450 HydrophobicContact CB-CD1 3.75Å; R440-Y450 HydrophobicContact CB-CE1 3.87Å
441	R	92.9	Very high	93.4	Very high	60 Å²	60	56.7 Å²	56.7	23%	0.226	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	151.3	167	66.5	176.3	178.3	179.6	4	110.7	I379 N380 W381 E449	I379-R441 HydrophobicContact CG2-CB 4.23Å; N380-R441 WeakPolarHBondContact O-CB 3.35Å; W381-R441 HydrophobicContact CD2-CB 4.19Å; W381-R441 HydrophobicContact CD2-CG 3.97Å; W381-R441 VanDerWaalsContact CE2-CD 3.43Å; W381-R441 HydrophobicContact CE3-CB 4.04Å; W381-R441 HydrophobicContact CE3-CG 3.89Å; W381-R441 HydrophobicContact CH2-CG 3.86Å; W381-R441 HydrophobicContact CZ2-CG 3.93Å; W381-R441 HydrophobicContact CZ3-CB 4.39Å; W381-R441 HydrophobicContact CZ3-CG 3.84Å; R441-E449 HydrophobicContact CG-CB 3.97Å; R441-E449 IonicContact CZ-OE2 2.68Å; R441-E449 PolarHBondContact N-O 2.77Å; R441-E449 IonicContact NE-OE2 3.55Å; R441-E449 PolarHBondContact NE-OE2 2.03Å; R441-E449 IonicContact NH2-OE1 3.43Å; R441-E449 IonicContact NH2-OE2 3.4Å; R441-E449 PolarHBondContact NH2-OE2 2.9Å; R441-E449 PolarHBondContact O-N 3.3Å
442	F	92.8	Very high	93.6	Very high	111 Å²	111	48.6 Å²	48.6	49%	0.487	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	116.3	172.2	-177.1	-110.1	0	0	0	110	I379 P444 M448 L478	I379-F442 WeakPolarHBondContact CG2-O 3.42Å; F442-P444 HydrophobicContact CE1-CB 4.49Å; F442-M448 HydrophobicContact CB-SD 3.53Å; F442-M448 VanDerWaalsContact CB-SD 3.53Å; F442-M448 HydrophobicContact CD2-CG 3.96Å; F442-M448 HydrophobicContact CD2-SD 3.53Å; F442-M448 VanDerWaalsContact CD2-SD 3.53Å; F442-M448 HydrophobicContact CG-SD 3.99Å; F442-L478 HydrophobicContact CE2-CD2 3.9Å; F442-L478 HydrophobicContact CZ-CD2 4.1Å
443	D	91.8	Very high	93.8	Very high	3 Å²	3	46 Å²	46	2%	0.016	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	119.1	171.3	-175	-33.6	0	0	0	109.2	P369 F370 T445 R446 G447	P369-D443 VanDerWaalsContact CA-OD2 3.26Å; P369-D443 WeakPolarHBondContact CA-OD2 3.46Å; F370-D443 WeakPolarHBondContact CB-OD1 3.31Å; F370-D443 PolarHBondContact N-OD2 3.49Å; D443-T445 PolarHBondContact O-N 3.2Å; D443-T445 VanDerWaalsContact O-N 3.09Å; D443-T445 WeakPolarHBondContact OD1-CB 3.44Å; D443-T445 PolarHBondContact OD1-N 3.33Å; D443-T445 PolarHBondContact OD1-OG1 3.03Å; D443-R446 HydrophobicContact CB-CG 3.9Å; D443-R446 PolarHBondContact O-N 2.98Å; D443-G447 PolarHBondContact N-O 3.31Å; D443-G447 WeakPolarHBondContact O-CA 3.27Å; D443-G447 PolarHBondContact O-N 3.25Å
444	P	88.5	Confident	93.9	Very high	73 Å²	73	38 Å²	38	47%	0.474	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-18.3	-175.8	27.7	-36	0	0	0	113.7	F442 L478	F442-P444 HydrophobicContact CE1-CB 4.49Å; P444-L478 WeakPolarHBondContact O-CD1 3.31Å
445	T	88.2	Confident	94	Very high	46 Å²	46	31 Å²	31	28%	0.282	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-27.2	-178.8	62.5	0	0	0	0	113.2	N367 S368 F370 D443	N367-T445 WeakPolarHBondContact CB-O 3.16Å; N367-T445 PolarHBondContact ND2-O 2.99Å; S368-T445 PolarHBondContact O-OG1 3.49Å; S368-T445 VanDerWaalsContact O-OG1 3.05Å; F370-T445 HydrophobicContact CB-CG2 4.01Å; F370-T445 HydrophobicContact CD2-CG2 4.42Å; F370-T445 PolarHBondContact N-OG1 2.84Å; D443-T445 PolarHBondContact O-N 3.2Å; D443-T445 VanDerWaalsContact O-N 3.09Å; D443-T445 WeakPolarHBondContact OD1-CB 3.44Å; D443-T445 PolarHBondContact OD1-N 3.33Å; D443-T445 PolarHBondContact OD1-OG1 3.03Å
446	R	89	Confident	94	Very high	9 Å²	9	30.2 Å²	30.2	3%	0.034	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.8	-24.3	-170.2	68.8	-171.6	-42.3	-150.2	13.2	115.4	W362 I366 N367 D443 E449 L475 P477 L478	W362-R446 PolarHBondContact O-NH1 3.43Å; W362-R446 PolarHBondContact O-NH2 3.43Å; I366-R446 HydrophobicContact CG2-CB 3.94Å; N367-R446 HydrophobicContact CB-CB 4.4Å; N367-R446 PolarHBondContact O-NE 2.84Å; D443-R446 HydrophobicContact CB-CG 3.9Å; D443-R446 PolarHBondContact O-N 2.98Å; R446-E449 WeakPolarHBondContact CD-OE1 3.38Å; R446-E449 IonicContact CZ-OE1 3.66Å; R446-E449 IonicContact NE-OE1 3.77Å; R446-E449 IonicContact NH1-OE1 3.54Å; R446-E449 PolarHBondContact NH1-OE1 3.03Å; R446-L475 HydrophobicContact CG-CD1 3.95Å; R446-L475 VanDerWaalsContact CZ-CD2 3.42Å; R446-P477 CarbonylContact O-C 3.58Å; R446-P477 WeakPolarHBondContact O-CA 3.14Å; R446-L478 PolarHBondContact O-N 3.46Å
447	G	92.4	Very high	94	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.01	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	121.7	-151.8	176.7	0	0	0	0	0	114.2	D443	D443-G447 PolarHBondContact N-O 3.31Å; D443-G447 WeakPolarHBondContact O-CA 3.27Å; D443-G447 PolarHBondContact O-N 3.25Å
448	M	93.1	Very high	93.9	Very high	42 Å²	42	27.8 Å²	27.8	21%	0.207	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	121.5	-175.5	-72.2	-66.6	-65.8	0	0	111.5	R440 F442 Y450 L475 R476	R440-M448 HydrophobicContact CB-CE 4.24Å; R440-M448 HydrophobicContact CG-CE 4.46Å; F442-M448 HydrophobicContact CB-SD 3.53Å; F442-M448 VanDerWaalsContact CB-SD 3.53Å; F442-M448 HydrophobicContact CD2-CG 3.96Å; F442-M448 HydrophobicContact CD2-SD 3.53Å; F442-M448 VanDerWaalsContact CD2-SD 3.53Å; F442-M448 HydrophobicContact CG-SD 3.99Å; M448-Y450 HydrophobicContact CB-CE2 3.53Å; M448-Y450 WeakPolarHBondContact CB-OH 3.33Å; M448-Y450 HydrophobicContact CE-CE1 4.3Å; M448-L475 WeakPolarHBondContact O-CA 3.21Å; M448-R476 HydrophobicContact CB-CB 4.22Å; M448-R476 PolarHBondContact N-O 2.98Å; M448-R476 PolarHBondContact O-N 3.09Å
449	E	94.3	Very high	93.7	Very high	16 Å²	16	30.7 Å²	30.7	8%	0.075	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	140.5	174.7	-69.9	-172.7	165.4	0	0	111.3	W381 R440 R441 R446 L475	W381-E449 HydrophobicContact CH2-CB 3.8Å; W381-E449 HydrophobicContact CZ3-CB 4.31Å; R440-E449 CarbonylContact C-O 3.47Å; R440-E449 VanDerWaalsContact CA-O 3.24Å; R440-E449 WeakPolarHBondContact CA-O 3.36Å; R441-E449 HydrophobicContact CG-CB 3.97Å; R441-E449 IonicContact CZ-OE2 2.68Å; R441-E449 PolarHBondContact N-O 2.77Å; R441-E449 IonicContact NE-OE2 3.55Å; R441-E449 PolarHBondContact NE-OE2 2.03Å; R441-E449 IonicContact NH2-OE1 3.43Å; R441-E449 IonicContact NH2-OE2 3.4Å; R441-E449 PolarHBondContact NH2-OE2 2.9Å; R441-E449 PolarHBondContact O-N 3.3Å; R446-E449 WeakPolarHBondContact CD-OE1 3.38Å; R446-E449 IonicContact CZ-OE1 3.66Å; R446-E449 IonicContact NE-OE1 3.77Å; R446-E449 IonicContact NH1-OE1 3.54Å; R446-E449 PolarHBondContact NH1-OE1 3.03Å; E449-L475 HydrophobicContact CG-CD1 3.46Å; E449-L475 VanDerWaalsContact CG-CD1 3.46Å
450	Y	95.8	Very high	93.4	Very high	2 Å²	2	30 Å²	30	1%	0.008	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	138.7	179.4	-55.1	-96.7	0	0	0	111.4	F384 D408 I412 Y439 R440 M448 N473 L474 R476	F384-Y450 HydrophobicContact CE1-CD1 4.46Å; F384-Y450 HydrophobicContact CZ-CD1 4.48Å; D408-Y450 PolarHBondContact OD1-OH 3.15Å; D408-Y450 VanDerWaalsContact OD1-OH 3.06Å; D408-Y450 WeakPolarHBondContact OD2-CE1 3.34Å; D408-Y450 PolarHBondContact OD2-OH 2.82Å; I412-Y450 HydrophobicContact CD1-CD2 3.85Å; I412-Y450 HydrophobicContact CD1-CE2 4.06Å; I412-Y450 HydrophobicContact CD1-CG 4.3Å; I412-Y450 HydrophobicContact CG1-CD1 4.12Å; I412-Y450 HydrophobicContact CG1-CD2 3.91Å; I412-Y450 HydrophobicContact CG1-CE1 4.44Å; I412-Y450 HydrophobicContact CG1-CE2 4.26Å; I412-Y450 HydrophobicContact CG1-CG 3.84Å; I412-Y450 HydrophobicContact CG2-CD1 4.33Å; I412-Y450 HydrophobicContact CG2-CE1 4.47Å; Y439-Y450 CarbonylContact O-C 3.52Å; Y439-Y450 VanDerWaalsContact O-CA 3.3Å; Y439-Y450 WeakPolarHBondContact O-CA 3.44Å; R440-Y450 HydrophobicContact CB-CD1 3.75Å; R440-Y450 HydrophobicContact CB-CE1 3.87Å; M448-Y450 HydrophobicContact CB-CE2 3.53Å; M448-Y450 WeakPolarHBondContact CB-OH 3.33Å; M448-Y450 HydrophobicContact CE-CE1 4.3Å; Y450-N473 WeakPolarHBondContact O-CA 3.3Å; Y450-L474 PolarHBondContact N-O 2.79Å; Y450-L474 PolarHBondContact O-N 3.28Å; Y450-R476 HydrophobicContact CE2-CB 4.24Å
451	I	96.4	Very high	92.9	Very high	38 Å²	38	35.7 Å²	35.7	20%	0.195	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	115.9	167.6	-58.2	171.5	0	0	0	107.1	W381 Y439 R471	W381-I451 HydrophobicContact CH2-CD1 3.57Å; W381-I451 HydrophobicContact CH2-CG1 3.64Å; W381-I451 HydrophobicContact CZ2-CD1 3.64Å; W381-I451 HydrophobicContact CZ2-CG1 4.23Å; W381-I451 HydrophobicContact CZ3-CD1 4.06Å; W381-I451 HydrophobicContact CZ3-CG1 3.95Å; Y439-I451 HydrophobicContact CD2-CB 4.25Å; Y439-I451 HydrophobicContact CD2-CG2 4.3Å; Y439-I451 PolarHBondContact N-O 2.79Å; Y439-I451 PolarHBondContact O-N 2.75Å; I451-R471 HydrophobicContact CG2-CG 3.91Å
452	L	96.9	Very high	92.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	118.8	-175.8	-53.1	178.2	0	0	0	110.1	F384 I412 L413 A416 L435 L454 R471 V472 L474	F384-L452 HydrophobicContact CE1-CD2 4.48Å; F384-L452 HydrophobicContact CE2-CD2 4.35Å; F384-L452 HydrophobicContact CZ-CD2 3.63Å; I412-L452 HydrophobicContact CG1-CD1 4.25Å; I412-L452 HydrophobicContact CG2-CD1 4.22Å; L413-L452 HydrophobicContact CD2-CD1 4.22Å; A416-L452 HydrophobicContact CB-CD1 4.09Å; L435-L452 HydrophobicContact CD1-CB 4.32Å; L435-L452 HydrophobicContact CD1-CD2 4.3Å; L452-L454 HydrophobicContact CB-CD2 4.23Å; L452-L454 HydrophobicContact CB-CG 4.13Å; L452-R471 CarbonylContact O-C 3.57Å; L452-R471 VanDerWaalsContact O-CA 3.28Å; L452-R471 WeakPolarHBondContact O-CA 3.28Å; L452-V472 PolarHBondContact N-O 2.97Å; L452-V472 PolarHBondContact O-N 3.5Å; L452-L474 HydrophobicContact CD1-CD1 3.78Å
453	D	96.9	Very high	92	Very high	18 Å²	18	39 Å²	39	10%	0.096	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	103.7	168	-68.3	-30.1	0	0	0	108.7	L436 N437 R471	L436-D453 WeakPolarHBondContact CA-O 3.44Å; L436-D453 HydrophobicContact CB-CB 4.1Å; L436-D453 VanDerWaalsContact CB-O 3.27Å; L436-D453 WeakPolarHBondContact CB-O 3.22Å; L436-D453 PolarHBondContact N-O 3.33Å; N437-D453 HydrophobicContact CB-CB 4Å; N437-D453 PolarHBondContact N-O 2.82Å; N437-D453 PolarHBondContact ND2-OD2 2.87Å; N437-D453 VanDerWaalsContact ND2-OD2 3.08Å; N437-D453 PolarHBondContact O-N 2.85Å; D453-R471 WeakPolarHBondContact OD1-CB 3.34Å; D453-R471 WeakPolarHBondContact OD1-CG 3.48Å; D453-R471 IonicContact OD1-CZ 3.42Å; D453-R471 IonicContact OD1-NE 2.71Å; D453-R471 PolarHBondContact OD1-NE 3.32Å; D453-R471 IonicContact OD1-NH2 3.27Å; D453-R471 PolarHBondContact OD1-NH2 2.98Å; D453-R471 IonicContact OD2-CZ 3.74Å; D453-R471 IonicContact OD2-NE 3.78Å; D453-R471 IonicContact OD2-NH2 2.84Å; D453-R471 PolarHBondContact OD2-NH2 3.45Å
454	L	96.3	Very high	91.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	134.5	-174.4	-59.7	176.3	0	0	0	111.5	L413 A416 L435 L452 L456 A469 K470 V472	L413-L454 HydrophobicContact CD2-CD2 3.51Å; A416-L454 HydrophobicContact CB-CD1 3.91Å; L435-L454 HydrophobicContact CB-CD2 4.46Å; L435-L454 HydrophobicContact CD1-CD2 3.63Å; L452-L454 HydrophobicContact CB-CD2 4.23Å; L452-L454 HydrophobicContact CB-CG 4.13Å; L454-L456 HydrophobicContact CB-CD1 4.41Å; L454-L456 HydrophobicContact CB-CD2 3.91Å; L454-L456 HydrophobicContact CB-CG 3.93Å; L454-L456 HydrophobicContact CD1-CD2 4.26Å; L454-A469 CarbonylContact O-C 3.6Å; L454-A469 WeakPolarHBondContact O-CA 3.43Å; L454-K470 PolarHBondContact N-O 2.75Å; L454-K470 PolarHBondContact O-N 3.3Å; L454-V472 HydrophobicContact CD1-CG2 4.13Å
455	A	96.4	Very high	92	Very high	8 Å²	8	44.8 Å²	44.8	7%	0.066	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	112.1	161.4	0	0	0	0	0	108.7	R433 R434 L436	R433-A455 WeakPolarHBondContact CB-O 3.35Å; R433-A455 PolarHBondContact N-O 2.9Å; R434-A455 HydrophobicContact CG-CB 3.86Å; R434-A455 PolarHBondContact N-O 3.08Å; R434-A455 PolarHBondContact O-N 3.19Å; L436-A455 HydrophobicContact CD1-CB 4.35Å; L436-A455 HydrophobicContact CD2-CB 4.14Å; L436-A455 HydrophobicContact CG-CB 4.15Å
456	L	95.1	Very high	92.2	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	139.7	-175.1	-58.5	170.9	0	0	0	109.8	V417 L420 F430 R431 L454 V467 I468 K470	V417-L456 HydrophobicContact CG2-CD2 4.18Å; L420-L456 HydrophobicContact CD1-CD1 3.5Å; F430-L456 HydrophobicContact CB-CB 4.49Å; F430-L456 HydrophobicContact CB-CD1 4.38Å; F430-L456 HydrophobicContact CD1-CB 4.23Å; F430-L456 HydrophobicContact CD1-CD1 4.18Å; F430-L456 HydrophobicContact CG-CD1 4.34Å; R431-L456 CarbonylContact O-C 3.6Å; R431-L456 WeakPolarHBondContact O-CA 3.26Å; L454-L456 HydrophobicContact CB-CD1 4.41Å; L454-L456 HydrophobicContact CB-CD2 3.91Å; L454-L456 HydrophobicContact CB-CG 3.93Å; L454-L456 HydrophobicContact CD1-CD2 4.26Å; L456-V467 CarbonylContact O-C 3.47Å; L456-V467 WeakPolarHBondContact O-CA 3.32Å; L456-I468 HydrophobicContact CB-CG1 4.1Å; L456-I468 PolarHBondContact N-O 2.99Å; L456-I468 PolarHBondContact O-N 3.3Å; L456-K470 HydrophobicContact CD1-CB 4.05Å
457	E	94.8	Very high	92.4	Very high	52 Å²	52	52 Å²	52	24%	0.243	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	114.1	164.8	-170.1	174.7	-162.9	0	0	108.5	F430 R431 F459 S465	F430-E457 CarbonylContact C-O 3.56Å; F430-E457 WeakPolarHBondContact CA-O 3.46Å; R431-E457 PolarHBondContact N-O 3.22Å; R431-E457 PolarHBondContact O-N 3.32Å; E457-F459 HydrophobicContact CB-CE2 4.13Å; E457-F459 HydrophobicContact CB-CZ 4.45Å; E457-F459 HydrophobicContact CG-CE1 4.39Å; E457-F459 HydrophobicContact CG-CE2 3.77Å; E457-F459 HydrophobicContact CG-CZ 3.7Å; E457-F459 WeakPolarHBondContact OE2-CZ 3.27Å; E457-S465 WeakPolarHBondContact OE1-CB 3.46Å; E457-S465 PolarHBondContact OE1-OG 2.92Å
458	A	92.9	Very high	92.5	Very high	8 Å²	8	54.6 Å²	54.6	7%	0.066	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	120.3	-179.4	0	0	0	0	0	109.9	R429 F430 S465 Q466 I468	R429-A458 CarbonylContact O-C 3.58Å; R429-A458 WeakPolarHBondContact O-CA 3.23Å; F430-A458 HydrophobicContact CD1-CB 3.76Å; F430-A458 HydrophobicContact CE1-CB 3.64Å; A458-S465 VanDerWaalsContact O-CA 3.29Å; A458-S465 WeakPolarHBondContact O-CA 3.44Å; A458-Q466 PolarHBondContact N-O 2.83Å; A458-Q466 PolarHBondContact O-N 2.76Å; A458-I468 HydrophobicContact CB-CD1 4.16Å; A458-I468 HydrophobicContact CB-CG1 4.31Å
459	F	92.7	Very high	92.6	Very high	61 Å²	61	56.2 Å²	56.2	27%	0.268	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.7	176.1	-62.1	-89.1	0	0	0	109.9	L428 R429 R431 E457 H464	L428-F459 WeakPolarHBondContact CA-O 3.48Å; R429-F459 HydrophobicContact CB-CB 4.42Å; R429-F459 PolarHBondContact N-O 2.82Å; R429-F459 PolarHBondContact O-N 2.87Å; R431-F459 HydrophobicContact CB-CE2 3.94Å; E457-F459 HydrophobicContact CB-CE2 4.13Å; E457-F459 HydrophobicContact CB-CZ 4.45Å; E457-F459 HydrophobicContact CG-CE1 4.39Å; E457-F459 HydrophobicContact CG-CE2 3.77Å; E457-F459 HydrophobicContact CG-CZ 3.7Å; E457-F459 WeakPolarHBondContact OE2-CZ 3.27Å; F459-H464 WeakPolarHBondContact CA-O 3.37Å
460	T	90.1	Very high	92.6	Very high	56 Å²	56	59.8 Å²	59.8	34%	0.344	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	162.5	170.3	62	0	0	0	0	110.8	L428 K462 G463 H464	L428-T460 HydrophobicContact CD2-CG2 4Å; T460-K462 PolarHBondContact O-N 3.27Å; T460-K462 VanDerWaalsContact O-N 3.11Å; T460-G463 PolarHBondContact O-N 3.27Å; T460-H464 PolarHBondContact N-O 3.41Å; T460-H464 WeakPolarHBondContact OG1-CB 3.19Å; T460-H464 PolarHBondContact OG1-N 2.97Å; T460-H464 VanDerWaalsContact OG1-N 3.12Å; T460-H464 PolarHBondContact OG1-O 3.37Å
461	Q	84.8	Confident	92.6	Very high	144 Å²	144	66.6 Å²	66.6	67%	0.673	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-27.3	172.3	-65.6	-176.5	-10.2	0	0	113.5	P426 G463	P426-Q461 WeakPolarHBondContact O-CG 3.4Å; P426-Q461 PolarHBondContact O-NE2 3.38Å; Q461-G463 PolarHBondContact O-N 3.01Å
462	K	83.8	Confident	92.5	Very high	182 Å²	182	65.7 Å²	65.7	79%	0.791	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	10.8	177.8	-61.5	-176.7	179.3	179.9	0	113.2	T460 H464	T460-K462 PolarHBondContact O-N 3.27Å; T460-K462 VanDerWaalsContact O-N 3.11Å; K462-H464 VanDerWaalsContact C-N 3.27Å; K462-H464 PolarHBondContact O-N 3.37Å; K462-H464 PolarHBondContact O-ND1 2.98Å; K462-H464 VanDerWaalsContact O-ND1 3.11Å
463	G	82.4	Confident	92.4	Very high	60 Å²	60	69.2 Å²	69.2	62%	0.619	37%	0.365	S	S	*	.	S	Bend	trans	76.1	3.8	177	0	0	0	0	0	115.8	T460 Q461	T460-G463 PolarHBondContact O-N 3.27Å; Q461-G463 PolarHBondContact O-N 3.01Å
464	H	88.4	Confident	92.3	Very high	134 Å²	134	69.5 Å²	69.5	62%	0.62	37%	0.366	S	S	*	.			trans	-75.5	133.1	175.5	-63.3	58.4	0	0	0	109.5	F459 T460 K462	F459-H464 WeakPolarHBondContact CA-O 3.37Å; T460-H464 PolarHBondContact N-O 3.41Å; T460-H464 WeakPolarHBondContact OG1-CB 3.19Å; T460-H464 PolarHBondContact OG1-N 2.97Å; T460-H464 VanDerWaalsContact OG1-N 3.12Å; T460-H464 PolarHBondContact OG1-O 3.37Å; K462-H464 VanDerWaalsContact C-N 3.27Å; K462-H464 PolarHBondContact O-N 3.37Å; K462-H464 PolarHBondContact O-ND1 2.98Å; K462-H464 VanDerWaalsContact O-ND1 3.11Å
465	S	90.4	Very high	92.1	Very high	63 Å²	63	70.8 Å²	70.8	44%	0.441	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	139.2	175.3	80.6	0	0	0	0	111.9	E457 A458	E457-S465 WeakPolarHBondContact OE1-CB 3.46Å; E457-S465 PolarHBondContact OE1-OG 2.92Å; A458-S465 VanDerWaalsContact O-CA 3.29Å; A458-S465 WeakPolarHBondContact O-CA 3.44Å
466	Q	93.5	Very high	91.9	Very high	137 Å²	137	77.3 Å²	77.3	64%	0.64	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.9	140.2	173.2	-174.3	176.1	5.4	0	0	110	A458 I468	A458-Q466 PolarHBondContact N-O 2.83Å; A458-Q466 PolarHBondContact O-N 2.76Å; Q466-I468 HydrophobicContact CG-CG2 4.45Å
467	V	93.9	Very high	91.7	Very high	68 Å²	68	80.8 Å²	80.8	41%	0.412	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	123.9	175	-176.4	0	0	0	0	109.1	L456	L456-V467 CarbonylContact O-C 3.47Å; L456-V467 WeakPolarHBondContact O-CA 3.32Å
468	I	94.4	Very high	91.4	Very high	56 Å²	56	82.6 Å²	82.6	29%	0.287	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	146.8	177.7	65.1	168	0	0	0	110.2	F430 L456 A458 Q466	F430-I468 HydrophobicContact CD1-CD1 4.04Å; F430-I468 HydrophobicContact CE1-CD1 3.47Å; F430-I468 VanDerWaalsContact CE1-CD1 3.47Å; F430-I468 HydrophobicContact CE1-CG1 4.5Å; F430-I468 HydrophobicContact CZ-CD1 4.45Å; L456-I468 HydrophobicContact CB-CG1 4.1Å; L456-I468 PolarHBondContact N-O 2.99Å; L456-I468 PolarHBondContact O-N 3.3Å; A458-I468 HydrophobicContact CB-CD1 4.16Å; A458-I468 HydrophobicContact CB-CG1 4.31Å; Q466-I468 HydrophobicContact CG-CG2 4.45Å
469	A	94.9	Very high	90.8	Very high	77 Å²	77	86.9 Å²	86.9	64%	0.636	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	130.2	169.1	0	0	0	0	0	109.1	L436 L454	L436-A469 HydrophobicContact CD1-CB 4.19Å; L454-A469 CarbonylContact O-C 3.6Å; L454-A469 WeakPolarHBondContact O-CA 3.43Å
470	K	94.1	Very high	90	Very high	91 Å²	91	88 Å²	88	40%	0.396	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	128.5	-180	-170.4	66.3	175.9	-176.1	0	111.1	L454 L456 V472	L454-K470 PolarHBondContact N-O 2.75Å; L454-K470 PolarHBondContact O-N 3.3Å; L456-K470 HydrophobicContact CD1-CB 4.05Å; K470-V472 HydrophobicContact CG-CG2 4.47Å
471	R	96	Very high	89.3	Confident	144 Å²	144	92.1 Å²	92.1	54%	0.543	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	130	167.7	-176.7	167	-70.8	-174.4	-4.4	110.4	I451 L452 D453	I451-R471 HydrophobicContact CG2-CG 3.91Å; L452-R471 CarbonylContact O-C 3.57Å; L452-R471 VanDerWaalsContact O-CA 3.28Å; L452-R471 WeakPolarHBondContact O-CA 3.28Å; D453-R471 WeakPolarHBondContact OD1-CB 3.34Å; D453-R471 WeakPolarHBondContact OD1-CG 3.48Å; D453-R471 IonicContact OD1-CZ 3.42Å; D453-R471 IonicContact OD1-NE 2.71Å; D453-R471 PolarHBondContact OD1-NE 3.32Å; D453-R471 IonicContact OD1-NH2 3.27Å; D453-R471 PolarHBondContact OD1-NH2 2.98Å; D453-R471 IonicContact OD2-CZ 3.74Å; D453-R471 IonicContact OD2-NE 3.78Å; D453-R471 IonicContact OD2-NH2 2.84Å; D453-R471 PolarHBondContact OD2-NH2 3.45Å
472	V	94.8	Very high	88.6	Confident	19 Å²	19	92.8 Å²	92.8	12%	0.115	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	127.2	175.9	-171.5	0	0	0	0	108.1	A416 L420 L452 L454 K470 L474	A416-V472 HydrophobicContact CB-CG1 4.42Å; L420-V472 HydrophobicContact CD1-CG2 3.86Å; L420-V472 HydrophobicContact CD2-CG2 4.42Å; L420-V472 HydrophobicContact CG-CG2 4.36Å; L452-V472 PolarHBondContact N-O 2.97Å; L452-V472 PolarHBondContact O-N 3.5Å; L454-V472 HydrophobicContact CD1-CG2 4.13Å; K470-V472 HydrophobicContact CG-CG2 4.47Å; V472-L474 HydrophobicContact CG1-CD1 4.27Å; V472-L474 HydrophobicContact CG1-CD2 4.19Å; V472-L474 HydrophobicContact CG1-CG 4Å
473	N	94.3	Very high	88	Confident	75 Å²	75	91.8 Å²	91.8	40%	0.401	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	134.1	171.7	-59.3	-23.7	0	0	0	108.1	W362 Y450	W362-N473 HydrophobicContact CH2-CB 3.54Å; W362-N473 WeakPolarHBondContact CH2-O 3.44Å; W362-N473 HydrophobicContact CZ2-CB 4.11Å; W362-N473 WeakPolarHBondContact CZ2-O 3.42Å; W362-N473 HydrophobicContact CZ3-CB 3.78Å; Y450-N473 WeakPolarHBondContact O-CA 3.3Å
474	L	93.9	Very high	87.3	Confident	24 Å²	24	94.4 Å²	94.4	13%	0.126	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	148.2	178.4	-63.6	161.1	0	0	0	109.3	I412 A416 Y450 L452 V472	I412-L474 HydrophobicContact CD1-CB 3.9Å; I412-L474 HydrophobicContact CD1-CD1 3.67Å; I412-L474 HydrophobicContact CD1-CG 4.35Å; I412-L474 HydrophobicContact CG1-CB 4.39Å; I412-L474 HydrophobicContact CG1-CD1 3.63Å; A416-L474 HydrophobicContact CB-CD1 3.77Å; Y450-L474 PolarHBondContact N-O 2.79Å; Y450-L474 PolarHBondContact O-N 3.28Å; L452-L474 HydrophobicContact CD1-CD1 3.78Å; V472-L474 HydrophobicContact CG1-CD1 4.27Å; V472-L474 HydrophobicContact CG1-CD2 4.19Å; V472-L474 HydrophobicContact CG1-CG 4Å
475	L	92.8	Very high	86.4	Confident	26 Å²	26	93.5 Å²	93.5	14%	0.136	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	125	172.4	174.6	72.4	0	0	0	107.5	P363 I366 R446 M448 E449 P477	P363-L475 VanDerWaalsContact CD-CD2 3.47Å; P363-L475 HydrophobicContact CG-CB 4.14Å; P363-L475 HydrophobicContact CG-CD2 3.99Å; I366-L475 HydrophobicContact CB-CD2 4.36Å; I366-L475 HydrophobicContact CD1-CD2 3.62Å; I366-L475 HydrophobicContact CG2-CD2 3.83Å; R446-L475 HydrophobicContact CG-CD1 3.95Å; R446-L475 VanDerWaalsContact CZ-CD2 3.42Å; M448-L475 WeakPolarHBondContact O-CA 3.21Å; E449-L475 HydrophobicContact CG-CD1 3.46Å; E449-L475 VanDerWaalsContact CG-CD1 3.46Å; L475-P477 WeakPolarHBondContact O-CD 3.32Å
476	R	92.5	Very high	85.4	Confident	146 Å²	146	95.9 Å²	95.9	55%	0.551	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	101.5	168.5	178.5	179.8	-177.9	173.6	1	107.4	D408 M448 Y450	D408-R476 IonicContact OD1-NH1 2.78Å; D408-R476 PolarHBondContact OD1-NH1 2.99Å; M448-R476 HydrophobicContact CB-CB 4.22Å; M448-R476 PolarHBondContact N-O 2.98Å; M448-R476 PolarHBondContact O-N 3.09Å; Y450-R476 HydrophobicContact CE2-CB 4.24Å
477	P	90.8	Very high	84.9	Confident	73 Å²	73	92 Å²	92	47%	0.474	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	154.2	-174.6	27.5	-33.6	0	0	0	112	I366 R446 L475	I366-P477 HydrophobicContact CD1-CB 4.38Å; R446-P477 CarbonylContact O-C 3.58Å; R446-P477 WeakPolarHBondContact O-CA 3.14Å; L475-P477 WeakPolarHBondContact O-CD 3.32Å
478	L	87.4	Confident	84	Confident	91 Å²	91	98.7 Å²	98.7	48%	0.476	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-61.6	136	167.7	-67.7	172.3	0	0	0	109.7	F442 P444 R446	F442-L478 HydrophobicContact CE2-CD2 3.9Å; F442-L478 HydrophobicContact CZ-CD2 4.1Å; P444-L478 WeakPolarHBondContact O-CD1 3.31Å; R446-L478 PolarHBondContact O-N 3.46Å
479	S	80.2	Confident	83.3	Confident	97 Å²	97	97.6 Å²	97.6	68%	0.678	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-69.9	166.6	171.4	58.1	0	0	0	0	110.7
480	A	77	Confident	82.5	Confident	84 Å²	84	95.9 Å²	95.9	69%	0.694	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-55.7	148	166.2	0	0	0	0	0	109.8	E482	A480-E482 PolarHBondContact O-N 3.47Å; A480-E482 VanDerWaalsContact O-N 3.09Å
481	V	74.2	Confident	81.9	Confident	143 Å²	143	97.4 Å²	97.4	87%	0.867	51%	0.511	S	S	*	.			trans	-63.2	114.9	175.6	179.8	0	0	0	0	108
482	E	70.6	Confident	81.3	Confident	159 Å²	159	94 Å²	94	74%	0.743	51%	0.514	S	S	*	.			trans	-92.4	125.7	174.6	-67.9	-175.7	177.6	0	0	109.2	A480 I484	A480-E482 PolarHBondContact O-N 3.47Å; A480-E482 VanDerWaalsContact O-N 3.09Å; E482-I484 PolarHBondContact O-N 3.11Å
483	I	70.8	Confident	81	Confident	160 Å²	160	94.9 Å²	94.9	82%	0.821	52%	0.519	S	S	*	.			trans	-81.2	105.9	172.5	-58.6	175.8	0	0	0	106.9	P485	I483-P485 WeakPolarHBondContact O-CD 3.27Å
484	I	68.9	Low	81	Confident	116 Å²	116	98 Å²	98	60%	0.595	53%	0.525	S	S	*	.			trans	-76.1	116.6	173.1	-58.1	176.2	0	0	0	107.5	E482 M486	E482-I484 PolarHBondContact O-N 3.11Å; I484-M486 PolarHBondContact O-N 3.44Å; I484-M486 VanDerWaalsContact O-N 3.1Å
485	P	70.1	Confident	81	Confident	114 Å²	114	96.9 Å²	96.9	74%	0.74	52%	0.519	S	S	*	.			trans	-67.3	112.6	177.9	27.7	-32.7	0	0	0	109.1	I483	I483-P485 WeakPolarHBondContact O-CD 3.27Å
486	M	68.8	Low	81.2	Confident	114 Å²	114	96.2 Å²	96.2	56%	0.562	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-91.5	148.6	174.5	-66.9	-177.9	178.3	0	0	110.4	I484 I619	I484-M486 PolarHBondContact O-N 3.44Å; I484-M486 VanDerWaalsContact O-N 3.1Å; M486-I619 HydrophobicContact CB-CD1 4.41Å
487	P	81.9	Confident	81.4	Confident	55 Å²	55	89.3 Å²	89.3	36%	0.357	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-54.4	149.2	169.9	-23.6	33.9	0	0	0	111.5	V489 I619 W622	P487-V489 PolarHBondContact O-N 3.18Å; P487-I619 HydrophobicContact CB-CG2 3.8Å; P487-I619 HydrophobicContact CG-CG2 3.9Å; P487-W622 HydrophobicContact CG-CB 4.26Å; P487-W622 HydrophobicContact CG-CD2 4.14Å; P487-W622 HydrophobicContact CG-CE3 4.48Å; P487-W622 HydrophobicContact CG-CG 4.01Å
488	Y	76.2	Confident	81.7	Confident	208 Å²	208	86 Å²	86	82%	0.816	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-63.5	127.7	179.7	179.1	-104.3	0	0	0	111.1	T490	Y488-T490 HydrophobicContact CD1-CG2 3.92Å; Y488-T490 HydrophobicContact CE1-CG2 3.13Å
489	V	79.7	Confident	82.1	Confident	34 Å²	34	81.6 Å²	81.6	21%	0.206	45%	0.445	C	S	.	.			trans	-121.7	153.1	176.1	-98.6	0	0	0	0	110.1	P487 M616 I619	P487-V489 PolarHBondContact O-N 3.18Å; V489-M616 HydrophobicContact CB-SD 4.08Å; V489-M616 HydrophobicContact CG2-CE 3.98Å; V489-M616 HydrophobicContact CG2-SD 4.07Å; V489-I619 HydrophobicContact CG1-CG1 3.9Å
490	T	78.6	Confident	82.7	Confident	40 Å²	40	79 Å²	79	25%	0.245	43%	0.426	C	S	.	.			trans	-133.7	142	-177.5	70.3	0	0	0	0	111.8	Y488 A492 T493	Y488-T490 HydrophobicContact CD1-CG2 3.92Å; Y488-T490 HydrophobicContact CE1-CG2 3.13Å; T490-A492 PolarHBondContact O-N 3.23Å; T490-T493 PolarHBondContact O-N 3.42Å; T490-T493 PolarHBondContact O-OG1 3Å
491	E	80.4	Confident	83.4	Confident	124 Å²	124	75 Å²	75	58%	0.579	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-11.3	172.3	-63.7	172.1	-178	0	0	113.1	T493 R615 M616	E491-T493 VanDerWaalsContact C-N 3.32Å; E491-T493 PolarHBondContact O-N 2.82Å; E491-R615 WeakPolarHBondContact O-CD 3.24Å; E491-R615 PolarHBondContact O-NE 3.28Å; E491-M616 HydrophobicContact CG-SD 4.26Å
492	A	83.4	Confident	84.2	Confident	73 Å²	73	70.2 Å²	70.2	60%	0.603	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-11.9	-179.7	0	0	0	0	0	114.2	T490 R494 N526	T490-A492 PolarHBondContact O-N 3.23Å; A492-R494 PolarHBondContact O-N 2.79Å; A492-N526 PolarHBondContact O-ND2 3.07Å
493	T	89.5	Confident	85	Confident	36 Å²	36	64.3 Å²	64.3	22%	0.221	34%	0.342	C	S	.	.	S	Bend	trans	-65.2	131.6	-178.8	50.3	0	0	0	0	111	T490 E491 V495 R615	T490-T493 PolarHBondContact O-N 3.42Å; T490-T493 PolarHBondContact O-OG1 3Å; E491-T493 VanDerWaalsContact C-N 3.32Å; E491-T493 PolarHBondContact O-N 2.82Å; T493-V495 PolarHBondContact O-N 3.04Å; T493-R615 WeakPolarHBondContact O-CD 3.16Å; T493-R615 PolarHBondContact O-NE 2.86Å; T493-R615 WeakPolarHBondContact OG1-CG 3.25Å
494	R	92.7	Very high	85.7	Confident	141 Å²	141	63.8 Å²	63.8	53%	0.532	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-72.2	128.5	178	-170.1	168.7	69.4	-175.5	0.2	110.8	A492 N526 L528	A492-R494 PolarHBondContact O-N 2.79Å; R494-N526 WeakPolarHBondContact CA-O 3.31Å; R494-N526 WeakPolarHBondContact CB-OD1 3.32Å; R494-N526 WeakPolarHBondContact CD-OD1 3.06Å; R494-N526 WeakPolarHBondContact CG-OD1 3.3Å; R494-L528 VanDerWaalsContact CZ-CD1 3.44Å
495	V	95.4	Very high	86.6	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	129.8	176.4	-178.4	0	0	0	0	109.5	T493 V497 N526 V527 L528 L596 F598 L611 R615	T493-V495 PolarHBondContact O-N 3.04Å; V495-V497 HydrophobicContact CG1-CG2 4.39Å; V495-N526 PolarHBondContact N-O 3.05Å; V495-V527 WeakPolarHBondContact O-CA 3.45Å; V495-L528 PolarHBondContact O-N 3.13Å; V495-L596 HydrophobicContact CG2-CD2 3.96Å; V495-F598 HydrophobicContact CG1-CB 3.67Å; V495-L611 HydrophobicContact CB-CD2 4.19Å; V495-L611 HydrophobicContact CG1-CD2 3.93Å; V495-L611 HydrophobicContact CG2-CD2 4.42Å; V495-R615 HydrophobicContact CG2-CG 3.62Å
496	Q	96.6	Very high	87.4	Confident	13 Å²	13	56.2 Å²	56.2	6%	0.061	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	101.2	174.1	-170.7	66.2	52.8	0	0	109.5	I498 L528 T530 T595 L596 F597 F598	Q496-I498 HydrophobicContact CG-CD1 3.92Å; Q496-I498 PolarHBondContact O-N 3.29Å; Q496-L528 CarbonylContact C-O 3.51Å; Q496-L528 PolarHBondContact NE2-O 2.99Å; Q496-L528 VanDerWaalsContact NE2-O 3.15Å; Q496-T530 PolarHBondContact NE2-OG1 3.48Å; Q496-T595 HydrophobicContact CB-CG2 3.5Å; Q496-T595 HydrophobicContact CG-CG2 4.03Å; Q496-L596 PolarHBondContact N-O 2.99Å; Q496-F597 HydrophobicContact CB-CD1 4.06Å; Q496-F597 HydrophobicContact CB-CE1 4.48Å; Q496-F597 HydrophobicContact CG-CD1 4.14Å; Q496-F597 HydrophobicContact CG-CE1 4.23Å; Q496-F597 WeakPolarHBondContact O-CA 3.12Å; Q496-F598 PolarHBondContact O-N 3.26Å
497	V	96.3	Very high	88.3	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	120.9	177.3	-172.8	0	0	0	0	108.9	V495 V527 L528 L529 T530 F598 L611	V495-V497 HydrophobicContact CG1-CG2 4.39Å; V497-V527 HydrophobicContact CG2-CG1 3.51Å; V497-L528 PolarHBondContact N-O 3.47Å; V497-L529 HydrophobicContact CB-CD1 4.02Å; V497-L529 HydrophobicContact CG1-CD1 3.92Å; V497-T530 PolarHBondContact O-N 2.82Å; V497-F598 WeakPolarHBondContact CA-O 3.27Å; V497-F598 HydrophobicContact CB-CD1 4.43Å; V497-F598 HydrophobicContact CG1-CD1 3.91Å; V497-F598 HydrophobicContact CG1-CE1 4.35Å; V497-F598 HydrophobicContact CG2-CD1 4.02Å; V497-L611 HydrophobicContact CG2-CD2 4.41Å
498	I	96.4	Very high	88.6	Confident	3 Å²	3	59.7 Å²	59.7	2%	0.015	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	120.3	176.7	-56.7	-57.1	0	0	0	108.2	Q496 P500 T530 I587 F597 F598 L599 S600	Q496-I498 HydrophobicContact CG-CD1 3.92Å; Q496-I498 PolarHBondContact O-N 3.29Å; I498-P500 WeakPolarHBondContact O-CD 3.43Å; I498-T530 HydrophobicContact CD1-CG2 4.44Å; I498-I587 HydrophobicContact CD1-CG2 3.82Å; I498-I587 HydrophobicContact CG1-CG2 4.14Å; I498-I587 HydrophobicContact CG2-CD1 3.5Å; I498-I587 VanDerWaalsContact CG2-CD1 3.5Å; I498-I587 HydrophobicContact CG2-CG1 4.35Å; I498-F597 HydrophobicContact CD1-CD1 4.04Å; I498-F597 HydrophobicContact CD1-CE1 4.16Å; I498-F597 HydrophobicContact CG1-CD1 3.85Å; I498-F597 HydrophobicContact CG1-CE1 4.38Å; I498-F598 PolarHBondContact N-O 2.87Å; I498-L599 HydrophobicContact CB-CD2 3.9Å; I498-L599 HydrophobicContact CG1-CD2 4.2Å; I498-L599 HydrophobicContact CG2-CD2 4.17Å; I498-S600 PolarHBondContact O-N 3.14Å
499	L	95.6	Very high	89.4	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	96.3	179.5	-170.4	68.4	0	0	0	110.8	V501 F512 L529 T530 F531 L532 S601 V602	L499-V501 HydrophobicContact CD2-CG2 4.12Å; L499-V501 HydrophobicContact CG-CG2 3.96Å; L499-F512 HydrophobicContact CD1-CE1 4.5Å; L499-F512 HydrophobicContact CD1-CE2 4.16Å; L499-F512 HydrophobicContact CD1-CZ 4.13Å; L499-F512 HydrophobicContact CD2-CD1 3.65Å; L499-F512 HydrophobicContact CD2-CE1 3.54Å; L499-F512 HydrophobicContact CD2-CG 4.23Å; L499-F512 HydrophobicContact CD2-CZ 4Å; L499-L529 HydrophobicContact CB-CD1 4.07Å; L499-T530 PolarHBondContact N-O 3.48Å; L499-F531 HydrophobicContact CD2-CD1 4.09Å; L499-F531 HydrophobicContact CD2-CE1 3.54Å; L499-F531 HydrophobicContact CD2-CZ 3.85Å; L499-L532 PolarHBondContact O-N 3Å; L499-S601 WeakPolarHBondContact CD1-O 3.34Å; L499-V602 HydrophobicContact CD1-CG2 4.05Å; L499-V602 HydrophobicContact CD2-CG2 4.43Å; L499-V602 HydrophobicContact CG-CG2 4.3Å
500	P	93.6	Very high	89.9	Confident	43 Å²	43	49 Å²	49	28%	0.279	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	130.1	166.4	28.5	-31.3	0	0	0	110.5	I498 L532 I534 S600	I498-P500 WeakPolarHBondContact O-CD 3.43Å; P500-L532 WeakPolarHBondContact CA-O 3.36Å; P500-L532 HydrophobicContact CB-CD2 4.25Å; P500-I534 HydrophobicContact CB-CD1 4.03Å; P500-S600 WeakPolarHBondContact CD-O 3.44Å
501	V	92.6	Very high	90.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	123.6	178.8	-173.5	0	0	0	0	109	L499 D505 V509 F531 L532 F533 I534 F549 V602	L499-V501 HydrophobicContact CD2-CG2 4.12Å; L499-V501 HydrophobicContact CG-CG2 3.96Å; V501-D505 HydrophobicContact CG1-CB 3.97Å; V501-V509 HydrophobicContact CG1-CG2 3.72Å; V501-V509 HydrophobicContact CG2-CG2 4.32Å; V501-F531 HydrophobicContact CG2-CD1 3.75Å; V501-F531 HydrophobicContact CG2-CE1 4.05Å; V501-L532 PolarHBondContact N-O 3.38Å; V501-F533 HydrophobicContact CB-CD1 4.26Å; V501-I534 PolarHBondContact O-N 3.19Å; V501-F549 HydrophobicContact CB-CE1 4.46Å; V501-F549 HydrophobicContact CG1-CD1 4.46Å; V501-F549 HydrophobicContact CG1-CE1 3.89Å; V501-V602 HydrophobicContact CG2-CG2 4.1Å
502	T	90.1	Very high	91	Very high	42 Å²	42	46.1 Å²	46.1	26%	0.258	25%	0.247	S	C	.	.			trans	-96.8	171.4	171.6	72.6	0	0	0	0	110.8	Q504 D505 I534	T502-Q504 PolarHBondContact O-N 2.94Å; T502-Q504 PolarHBondContact OG1-N 2.78Å; T502-D505 WeakPolarHBondContact CB-OD2 3.45Å; T502-D505 PolarHBondContact N-OD2 2.95Å; T502-D505 PolarHBondContact O-N 3.38Å; T502-D505 VanDerWaalsContact O-N 3.15Å; T502-D505 PolarHBondContact OG1-OD2 3.37Å; T502-I534 HydrophobicContact CG2-CB 4.5Å; T502-I534 HydrophobicContact CG2-CD1 4.23Å
503	A	86.4	Confident	91.5	Very high	35 Å²	35	42.9 Å²	42.9	29%	0.289	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-60.2	-25.5	176.4	0	0	0	0	0	113.4	D505 Q506 V548	A503-D505 VanDerWaalsContact C-N 3.34Å; A503-Q506 WeakPolarHBondContact O-CG 3.1Å; A503-V548 HydrophobicContact CB-CG1 4.29Å
504	Q	85.5	Confident	91.5	Very high	149 Å²	149	46.1 Å²	46.1	70%	0.696	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-77.3	-21.7	179.5	-61	-178	9.4	0	0	112.9	T502	T502-Q504 PolarHBondContact O-N 2.94Å; T502-Q504 PolarHBondContact OG1-N 2.78Å
505	D	88.3	Confident	91.3	Very high	28 Å²	28	42.3 Å²	42.3	15%	0.15	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-88.2	-6.8	-173.5	-55.8	-53.6	0	0	0	112.9	V501 T502 A503 D507 Y508 V509 V602	V501-D505 HydrophobicContact CG1-CB 3.97Å; T502-D505 WeakPolarHBondContact CB-OD2 3.45Å; T502-D505 PolarHBondContact N-OD2 2.95Å; T502-D505 PolarHBondContact O-N 3.38Å; T502-D505 VanDerWaalsContact O-N 3.15Å; T502-D505 PolarHBondContact OG1-OD2 3.37Å; A503-D505 VanDerWaalsContact C-N 3.34Å; D505-D507 VanDerWaalsContact C-N 3.32Å; D505-D507 PolarHBondContact O-N 2.85Å; D505-Y508 PolarHBondContact O-N 3.47Å; D505-V509 PolarHBondContact O-N 3.44Å; D505-V602 HydrophobicContact CB-CG2 4Å
506	Q	86.8	Confident	91.1	Very high	42 Å²	42	42.4 Å²	42.4	20%	0.196	23%	0.225	C	C	.	.	H	α-helix	trans	-56.1	-42.2	-167.4	-68.4	-176	-7.3	0	0	114	A503 Y508 V509 V548 F549 V552	A503-Q506 WeakPolarHBondContact O-CG 3.1Å; Q506-Y508 PolarHBondContact O-N 3.1Å; Q506-V509 PolarHBondContact O-N 3.49Å; Q506-V548 VanDerWaalsContact NE2-C 3.26Å; Q506-V548 PolarHBondContact NE2-O 2.76Å; Q506-V548 PolarHBondContact OE1-O 2.82Å; Q506-F549 HydrophobicContact CG-CD1 4.06Å; Q506-F549 HydrophobicContact CG-CE1 3.98Å; Q506-F549 VanDerWaalsContact NE2-CD1 3.29Å; Q506-V552 HydrophobicContact CB-CG2 4.45Å; Q506-V552 HydrophobicContact CG-CG2 4.39Å
507	D	87.4	Confident	90.8	Very high	140 Å²	140	42.3 Å²	42.3	75%	0.749	22%	0.224	S	C	*	.	H	α-helix	trans	-66.7	-21.5	-178.6	-64	-32.3	0	0	0	112.5	D505	D505-D507 VanDerWaalsContact C-N 3.32Å; D505-D507 PolarHBondContact O-N 2.85Å
508	Y	89.3	Confident	90.5	Very high	103 Å²	103	46.1 Å²	46.1	40%	0.404	25%	0.248	S	C	.	.	H	α-helix	trans	-95.9	-16.3	-175.8	-56.3	-79.4	0	0	0	113.2	D505 Q506 G510 N511 F512 W603	D505-Y508 PolarHBondContact O-N 3.47Å; Q506-Y508 PolarHBondContact O-N 3.1Å; Y508-G510 VanDerWaalsContact C-N 3.27Å; Y508-G510 PolarHBondContact O-N 2.83Å; Y508-N511 PolarHBondContact O-N 3.24Å; Y508-F512 PolarHBondContact O-N 3.02Å; Y508-W603 HydrophobicContact CD1-CE3 4.35Å; Y508-W603 AromaticContact CD1-CH2 3.39Å; Y508-W603 HydrophobicContact CD1-CH2 3.39Å; Y508-W603 HydrophobicContact CD1-CZ2 4.45Å; Y508-W603 AromaticContact CD1-CZ3 3.29Å; Y508-W603 HydrophobicContact CD1-CZ3 3.29Å; Y508-W603 AromaticContact CD2-CH2 3.28Å; Y508-W603 HydrophobicContact CD2-CH2 3.28Å; Y508-W603 AromaticContact CD2-CZ2 3.71Å; Y508-W603 HydrophobicContact CD2-CZ2 3.71Å; Y508-W603 HydrophobicContact CD2-CZ3 4.06Å; Y508-W603 AromaticContact CE1-CH2 3.45Å; Y508-W603 HydrophobicContact CE1-CH2 3.45Å; Y508-W603 VanDerWaalsContact CE1-CH2 3.45Å; Y508-W603 AromaticContact CE1-CZ3 3.54Å; Y508-W603 HydrophobicContact CE1-CZ3 3.54Å; Y508-W603 AromaticContact CE2-CH2 3.36Å; Y508-W603 HydrophobicContact CE2-CH2 3.36Å; Y508-W603 AromaticContact CE2-CZ2 3.99Å; Y508-W603 HydrophobicContact CE2-CZ2 3.99Å; Y508-W603 HydrophobicContact CE2-CZ3 4.28Å; Y508-W603 HydrophobicContact CG-CE3 4.47Å; Y508-W603 AromaticContact CG-CH2 3.29Å; Y508-W603 HydrophobicContact CG-CH2 3.29Å; Y508-W603 AromaticContact CG-CZ2 3.96Å; Y508-W603 HydrophobicContact CG-CZ2 3.96Å; Y508-W603 AromaticContact CG-CZ3 3.56Å; Y508-W603 HydrophobicContact CG-CZ3 3.56Å; Y508-W603 AromaticContact CZ-CH2 3.43Å; Y508-W603 VanDerWaalsContact CZ-CH2 3.43Å
509	V	91.8	Very high	90	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.8	-34.5	-178.7	178.7	0	0	0	0	112.3	V501 D505 Q506 N511 F512 L513 F531 V552 V602	V501-V509 HydrophobicContact CG1-CG2 3.72Å; V501-V509 HydrophobicContact CG2-CG2 4.32Å; D505-V509 PolarHBondContact O-N 3.44Å; Q506-V509 PolarHBondContact O-N 3.49Å; V509-N511 PolarHBondContact O-N 2.87Å; V509-F512 WeakPolarHBondContact O-CB 3.35Å; V509-F512 PolarHBondContact O-N 3.41Å; V509-L513 HydrophobicContact CG1-CD1 4.08Å; V509-L513 HydrophobicContact CG1-CG 4.18Å; V509-L513 WeakPolarHBondContact O-CG 3.32Å; V509-L513 PolarHBondContact O-N 2.98Å; V509-F531 HydrophobicContact CG1-CE1 3.65Å; V509-F531 HydrophobicContact CG1-CZ 3.99Å; V509-V552 HydrophobicContact CB-CG1 4.4Å; V509-V552 HydrophobicContact CB-CG2 4.42Å; V509-V552 HydrophobicContact CG1-CG1 3.73Å; V509-V552 HydrophobicContact CG2-CG2 4.38Å; V509-V602 HydrophobicContact CG2-CG1 4.2Å; V509-V602 HydrophobicContact CG2-CG2 4.45Å
510	G	90.5	Very high	89.6	Confident	18 Å²	18	48 Å²	48	19%	0.186	26%	0.258	C	S	.	.	H	α-helix	trans	-58.5	-49.3	177.4	0	0	0	0	0	112	Y508 F512 L513 D514	Y508-G510 VanDerWaalsContact C-N 3.27Å; Y508-G510 PolarHBondContact O-N 2.83Å; G510-F512 VanDerWaalsContact C-N 3.3Å; G510-F512 PolarHBondContact O-N 2.76Å; G510-L513 PolarHBondContact O-N 3.38Å; G510-D514 PolarHBondContact O-N 3Å
511	N	90	Very high	89.3	Confident	94 Å²	94	46.8 Å²	46.8	50%	0.503	25%	0.249	S	C	.	.	H	α-helix	trans	-61.7	-38.5	177	-67.6	-25.5	0	0	0	112.1	Y508 V509 M515	Y508-N511 PolarHBondContact O-N 3.24Å; V509-N511 PolarHBondContact O-N 2.87Å; N511-M515 VanDerWaalsContact O-CG 3.31Å; N511-M515 WeakPolarHBondContact O-CG 3.43Å; N511-M515 PolarHBondContact O-N 3.12Å; N511-M515 VanDerWaalsContact O-N 3.14Å
512	F	93	Very high	89	Confident	9 Å²	9	50.6 Å²	50.6	4%	0.039	27%	0.27	C	S	.	.	H	α-helix	trans	-63.4	-46	175.3	176.3	-86.3	0	0	0	111.5	L499 Y508 V509 G510 D514 M515 Y516 L529 V602 V606	L499-F512 HydrophobicContact CD1-CE1 4.5Å; L499-F512 HydrophobicContact CD1-CE2 4.16Å; L499-F512 HydrophobicContact CD1-CZ 4.13Å; L499-F512 HydrophobicContact CD2-CD1 3.65Å; L499-F512 HydrophobicContact CD2-CE1 3.54Å; L499-F512 HydrophobicContact CD2-CG 4.23Å; L499-F512 HydrophobicContact CD2-CZ 4Å; Y508-F512 PolarHBondContact O-N 3.02Å; V509-F512 WeakPolarHBondContact O-CB 3.35Å; V509-F512 PolarHBondContact O-N 3.41Å; G510-F512 VanDerWaalsContact C-N 3.3Å; G510-F512 PolarHBondContact O-N 2.76Å; F512-D514 PolarHBondContact O-N 3.48Å; F512-M515 PolarHBondContact O-N 3.24Å; F512-Y516 WeakPolarHBondContact O-CB 3.46Å; F512-Y516 PolarHBondContact O-N 2.86Å; F512-L529 HydrophobicContact CE1-CD1 4.08Å; F512-L529 HydrophobicContact CE1-CD2 3.94Å; F512-L529 HydrophobicContact CZ-CD1 4.33Å; F512-V602 HydrophobicContact CB-CG1 4.15Å; F512-V606 HydrophobicContact CE2-CG2 4.02Å; F512-V606 HydrophobicContact CZ-CG2 4.16Å
513	L	92.8	Very high	88.7	Confident	5 Å²	5	52.3 Å²	52.3	3%	0.026	28%	0.28	C	S	.	.	H	α-helix	trans	-61.7	-43.3	179.1	-77.7	175.3	0	0	0	111.5	V509 G510 M515 Y516 V517 L529 F531 M555 I556	V509-L513 HydrophobicContact CG1-CD1 4.08Å; V509-L513 HydrophobicContact CG1-CG 4.18Å; V509-L513 WeakPolarHBondContact O-CG 3.32Å; V509-L513 PolarHBondContact O-N 2.98Å; G510-L513 PolarHBondContact O-N 3.38Å; L513-M515 VanDerWaalsContact C-N 3.33Å; L513-M515 PolarHBondContact O-N 2.85Å; L513-Y516 PolarHBondContact O-N 2.94Å; L513-V517 WeakPolarHBondContact O-CB 3.47Å; L513-V517 WeakPolarHBondContact O-CG2 3.43Å; L513-V517 PolarHBondContact O-N 2.88Å; L513-L529 HydrophobicContact CD2-CD2 4.14Å; L513-F531 HydrophobicContact CD2-CE2 4.05Å; L513-F531 HydrophobicContact CD2-CZ 3.78Å; L513-F531 HydrophobicContact CG-CZ 4.25Å; L513-M555 HydrophobicContact CD1-CB 3.91Å; L513-I556 HydrophobicContact CD1-CG1 4.46Å
514	D	91.1	Very high	88.6	Confident	104 Å²	104	58.6 Å²	58.6	56%	0.556	30%	0.303	S	S	*	.	H	α-helix	trans	-60.8	-42.4	176.8	-73	-23.3	0	0	0	111.9	G510 F512 T518	G510-D514 PolarHBondContact O-N 3Å; F512-D514 PolarHBondContact O-N 3.48Å; D514-T518 WeakPolarHBondContact O-CB 3.29Å; D514-T518 PolarHBondContact O-N 3.27Å; D514-T518 PolarHBondContact O-OG1 3.49Å
515	M	88.1	Confident	88.6	Confident	60 Å²	60	53.6 Å²	53.6	30%	0.296	28%	0.281	S	S	.	.	H	α-helix	trans	-65.6	-43.7	175.1	-72.1	-61.1	-55.3	0	0	111.9	N511 F512 L513 T518 N519	N511-M515 VanDerWaalsContact O-CG 3.31Å; N511-M515 WeakPolarHBondContact O-CG 3.43Å; N511-M515 PolarHBondContact O-N 3.12Å; N511-M515 VanDerWaalsContact O-N 3.14Å; F512-M515 PolarHBondContact O-N 3.24Å; L513-M515 VanDerWaalsContact C-N 3.33Å; L513-M515 PolarHBondContact O-N 2.85Å; M515-T518 PolarHBondContact O-N 3.46Å; M515-N519 VanDerWaalsContact O-CB 3.28Å; M515-N519 WeakPolarHBondContact O-CB 3.27Å; M515-N519 PolarHBondContact O-N 3.32Å
516	Y	90.7	Very high	88.6	Confident	3 Å²	3	55.8 Å²	55.8	1%	0.012	29%	0.293	C	S	.	.	H	α-helix	trans	-62.9	-42.8	177.9	179.1	-97.5	0	0	0	111.7	F512 L513 T520 L521 V527 L529	F512-Y516 WeakPolarHBondContact O-CB 3.46Å; F512-Y516 PolarHBondContact O-N 2.86Å; L513-Y516 PolarHBondContact O-N 2.94Å; Y516-T520 HydrophobicContact CD2-CG2 4.13Å; Y516-T520 VanDerWaalsContact CD2-OG1 3.32Å; Y516-T520 WeakPolarHBondContact CD2-OG1 3.09Å; Y516-T520 HydrophobicContact CE2-CG2 4.13Å; Y516-T520 WeakPolarHBondContact CE2-OG1 3.1Å; Y516-T520 VanDerWaalsContact CZ-OG1 3.29Å; Y516-T520 WeakPolarHBondContact O-CB 3.15Å; Y516-T520 PolarHBondContact O-N 3.45Å; Y516-T520 PolarHBondContact O-OG1 3.43Å; Y516-L521 HydrophobicContact CD1-CD1 4.21Å; Y516-L521 HydrophobicContact CD1-CG 4.06Å; Y516-L521 HydrophobicContact CE1-CD1 4.02Å; Y516-L521 HydrophobicContact CE1-CD2 3.7Å; Y516-L521 HydrophobicContact CE1-CG 3.72Å; Y516-L521 PolarHBondContact O-N 2.82Å; Y516-V527 HydrophobicContact CE2-CG1 4.15Å; Y516-L529 HydrophobicContact CD1-CD2 3.97Å; Y516-L529 HydrophobicContact CD2-CD2 4.39Å; Y516-L529 HydrophobicContact CE1-CB 3.99Å; Y516-L529 HydrophobicContact CE1-CD2 4.04Å; Y516-L529 HydrophobicContact CE2-CB 4.05Å; Y516-L529 HydrophobicContact CE2-CD2 4.44Å; Y516-L529 HydrophobicContact CG-CD2 4.16Å; Y516-L529 PolarHBondContact OH-N 3.13Å
517	V	90.9	Very high	88.9	Confident	10 Å²	10	54.4 Å²	54.4	6%	0.061	29%	0.287	C	S	.	.	I	π-helix	trans	-58.5	-52.3	175.2	170.2	0	0	0	0	110	L513 N519 L521 D522 V559 Y563	L513-V517 WeakPolarHBondContact O-CB 3.47Å; L513-V517 WeakPolarHBondContact O-CG2 3.43Å; L513-V517 PolarHBondContact O-N 2.88Å; V517-N519 PolarHBondContact O-N 3.18Å; V517-L521 HydrophobicContact CG2-CD1 3.99Å; V517-L521 PolarHBondContact O-N 3.09Å; V517-L521 VanDerWaalsContact O-N 3.13Å; V517-D522 PolarHBondContact O-N 3.34Å; V517-V559 HydrophobicContact CG2-CG1 4.06Å; V517-V559 HydrophobicContact CG2-CG2 4.33Å; V517-Y563 HydrophobicContact CG1-CE2 3.73Å; V517-Y563 WeakPolarHBondContact CG1-OH 3.3Å; V517-Y563 HydrophobicContact CG2-CE2 4.5Å
518	T	89.5	Confident	89.2	Confident	80 Å²	80	49.9 Å²	49.9	49%	0.491	26%	0.263	S	S	.	.	I	π-helix	trans	-64.6	-43.1	-176.4	-51.9	0	0	0	0	112.4	D514 M515	D514-T518 WeakPolarHBondContact O-CB 3.29Å; D514-T518 PolarHBondContact O-N 3.27Å; D514-T518 PolarHBondContact O-OG1 3.49Å; M515-T518 PolarHBondContact O-N 3.46Å
519	N	86.4	Confident	89.5	Confident	41 Å²	41	45.1 Å²	45.1	22%	0.219	24%	0.244	C	C	.	.	I	π-helix	trans	-88.4	-25.6	-171.5	-70.7	-6.8	0	0	0	114.4	M515 V517 T523 V606	M515-N519 VanDerWaalsContact O-CB 3.28Å; M515-N519 WeakPolarHBondContact O-CB 3.27Å; M515-N519 PolarHBondContact O-N 3.32Å; V517-N519 PolarHBondContact O-N 3.18Å; N519-T523 PolarHBondContact O-OG1 3.47Å; N519-V606 VanDerWaalsContact CB-O 3.31Å; N519-V606 WeakPolarHBondContact CB-O 3.43Å; N519-V606 PolarHBondContact ND2-O 3.19Å
520	T	86.9	Confident	89.6	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.012	25%	0.245	C	C	.	.	I	π-helix	trans	-124.4	-40	-173	69.2	0	0	0	0	114.4	Y516 T523 H524 D525 V606 L611	Y516-T520 HydrophobicContact CD2-CG2 4.13Å; Y516-T520 VanDerWaalsContact CD2-OG1 3.32Å; Y516-T520 WeakPolarHBondContact CD2-OG1 3.09Å; Y516-T520 HydrophobicContact CE2-CG2 4.13Å; Y516-T520 WeakPolarHBondContact CE2-OG1 3.1Å; Y516-T520 VanDerWaalsContact CZ-OG1 3.29Å; Y516-T520 WeakPolarHBondContact O-CB 3.15Å; Y516-T520 PolarHBondContact O-N 3.45Å; Y516-T520 PolarHBondContact O-OG1 3.43Å; T520-T523 VanDerWaalsContact CA-OG1 3.27Å; T520-T523 WeakPolarHBondContact CA-OG1 3.49Å; T520-T523 PolarHBondContact O-OG1 2.63Å; T520-T523 VanDerWaalsContact O-OG1 3.11Å; T520-H524 PolarHBondContact O-N 3.34Å; T520-D525 PolarHBondContact O-N 2.8Å; T520-D525 VanDerWaalsContact O-N 3.07Å; T520-V606 HydrophobicContact CG2-CG1 4.27Å; T520-L611 HydrophobicContact CG2-CD1 3.96Å
521	L	86.8	Confident	89.9	Confident	17 Å²	17	44.4 Å²	44.4	9%	0.089	24%	0.236	C	C	.	.	I	π-helix	trans	-79.5	-43.8	-176.6	-62.4	-172.8	0	0	0	110.8	Y516 V517 T523 H524 V559 Y563 V566	Y516-L521 HydrophobicContact CD1-CD1 4.21Å; Y516-L521 HydrophobicContact CD1-CG 4.06Å; Y516-L521 HydrophobicContact CE1-CD1 4.02Å; Y516-L521 HydrophobicContact CE1-CD2 3.7Å; Y516-L521 HydrophobicContact CE1-CG 3.72Å; Y516-L521 PolarHBondContact O-N 2.82Å; V517-L521 HydrophobicContact CG2-CD1 3.99Å; V517-L521 PolarHBondContact O-N 3.09Å; V517-L521 VanDerWaalsContact O-N 3.13Å; L521-T523 VanDerWaalsContact C-N 3.28Å; L521-T523 PolarHBondContact O-N 2.72Å; L521-H524 PolarHBondContact O-N 3.07Å; L521-V559 HydrophobicContact CD1-CG1 3.99Å; L521-Y563 HydrophobicContact CB-CD1 4.45Å; L521-Y563 HydrophobicContact CB-CE1 4.29Å; L521-Y563 HydrophobicContact CD1-CD2 4.21Å; L521-Y563 HydrophobicContact CD1-CG 4.38Å; L521-V566 HydrophobicContact CD1-CG1 4.42Å; L521-V566 HydrophobicContact CD2-CG1 4.06Å; L521-V566 HydrophobicContact CD2-CG2 3.91Å
522	D	85.9	Confident	90.1	Very high	81 Å²	81	40 Å²	40	43%	0.433	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-32.8	177.3	-71.8	-16.9	0	0	0	111.8	V517 H524 Y563	V517-D522 PolarHBondContact O-N 3.34Å; D522-H524 VanDerWaalsContact C-N 3.31Å; D522-H524 PolarHBondContact O-ND1 3.03Å; D522-Y563 PolarHBondContact OD1-OH 3.35Å
523	T	83.9	Confident	90.1	Very high	77 Å²	77	39.6 Å²	39.6	47%	0.472	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-8.1	176.3	55.5	0	0	0	0	113.9	N519 T520 L521 D525	N519-T523 PolarHBondContact O-OG1 3.47Å; T520-T523 VanDerWaalsContact CA-OG1 3.27Å; T520-T523 WeakPolarHBondContact CA-OG1 3.49Å; T520-T523 PolarHBondContact O-OG1 2.63Å; T520-T523 VanDerWaalsContact O-OG1 3.11Å; L521-T523 VanDerWaalsContact C-N 3.28Å; L521-T523 PolarHBondContact O-N 2.72Å; T523-D525 VanDerWaalsContact C-N 3.29Å; T523-D525 PolarHBondContact O-N 2.78Å; T523-D525 PolarHBondContact OG1-OD2 2.65Å
524	H	84.3	Confident	90.1	Very high	167 Å²	167	40 Å²	40	77%	0.773	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.4	37.3	-177.7	-60.8	64.4	0	0	0	113.7	T520 L521 D522	T520-H524 PolarHBondContact O-N 3.34Å; L521-H524 PolarHBondContact O-N 3.07Å; D522-H524 VanDerWaalsContact C-N 3.31Å; D522-H524 PolarHBondContact O-ND1 3.03Å
525	D	85.3	Confident	90	Very high	45 Å²	45	35.4 Å²	35.4	24%	0.241	19%	0.188	C	C	.	.			trans	-67.2	145.1	176.7	-83.9	-29.8	0	0	0	111.8	T520 T523 V527 A608	T520-D525 PolarHBondContact O-N 2.8Å; T520-D525 VanDerWaalsContact O-N 3.07Å; T523-D525 VanDerWaalsContact C-N 3.29Å; T523-D525 PolarHBondContact O-N 2.78Å; T523-D525 PolarHBondContact OG1-OD2 2.65Å; D525-V527 VanDerWaalsContact C-N 3.26Å; D525-V527 HydrophobicContact CB-CG2 3.95Å; D525-V527 PolarHBondContact O-N 2.87Å; D525-A608 VanDerWaalsContact OD2-CB 3.31Å; D525-A608 WeakPolarHBondContact OD2-CB 3.31Å
526	N	89.6	Confident	89.8	Confident	74 Å²	74	36.4 Å²	36.4	40%	0.396	20%	0.195	S	C	.	.	S	Bend	trans	-75.8	78	178.8	-166.4	12.7	0	0	0	111.1	A492 R494 V495 R615	A492-N526 PolarHBondContact O-ND2 3.07Å; R494-N526 WeakPolarHBondContact CA-O 3.31Å; R494-N526 WeakPolarHBondContact CB-OD1 3.32Å; R494-N526 WeakPolarHBondContact CD-OD1 3.06Å; R494-N526 WeakPolarHBondContact CG-OD1 3.3Å; V495-N526 PolarHBondContact N-O 3.05Å; N526-R615 PolarHBondContact O-NH2 3.28Å
527	V	92.6	Very high	89.4	Confident	13 Å²	13	37.9 Å²	37.9	8%	0.079	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	144.7	-173.3	-175.9	0	0	0	0	109.8	V495 V497 Y516 D525 L611	V495-V527 WeakPolarHBondContact O-CA 3.45Å; V497-V527 HydrophobicContact CG2-CG1 3.51Å; Y516-V527 HydrophobicContact CE2-CG1 4.15Å; D525-V527 VanDerWaalsContact C-N 3.26Å; D525-V527 HydrophobicContact CB-CG2 3.95Å; D525-V527 PolarHBondContact O-N 2.87Å; V527-L611 HydrophobicContact CG2-CD1 3.57Å; V527-L611 HydrophobicContact CG2-CD2 4.25Å; V527-L611 HydrophobicContact CG2-CG 4.45Å
528	L	93.6	Very high	89.1	Confident	45 Å²	45	42.8 Å²	42.8	24%	0.236	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	134.6	168.9	-72.8	174.5	0	0	0	110	R494 V495 Q496 V497	R494-L528 VanDerWaalsContact CZ-CD1 3.44Å; V495-L528 PolarHBondContact O-N 3.13Å; Q496-L528 CarbonylContact C-O 3.51Å; Q496-L528 PolarHBondContact NE2-O 2.99Å; Q496-L528 VanDerWaalsContact NE2-O 3.15Å; V497-L528 PolarHBondContact N-O 3.47Å
529	L	95.1	Very high	88.7	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	133.2	175	-179.1	61.9	0	0	0	110	V497 L499 F512 L513 Y516 F531 I568 P569	V497-L529 HydrophobicContact CB-CD1 4.02Å; V497-L529 HydrophobicContact CG1-CD1 3.92Å; L499-L529 HydrophobicContact CB-CD1 4.07Å; F512-L529 HydrophobicContact CE1-CD1 4.08Å; F512-L529 HydrophobicContact CE1-CD2 3.94Å; F512-L529 HydrophobicContact CZ-CD1 4.33Å; L513-L529 HydrophobicContact CD2-CD2 4.14Å; Y516-L529 HydrophobicContact CD1-CD2 3.97Å; Y516-L529 HydrophobicContact CD2-CD2 4.39Å; Y516-L529 HydrophobicContact CE1-CB 3.99Å; Y516-L529 HydrophobicContact CE1-CD2 4.04Å; Y516-L529 HydrophobicContact CE2-CB 4.05Å; Y516-L529 HydrophobicContact CE2-CD2 4.44Å; Y516-L529 HydrophobicContact CG-CD2 4.16Å; Y516-L529 PolarHBondContact OH-N 3.13Å; L529-F531 HydrophobicContact CD2-CD2 4.34Å; L529-F531 HydrophobicContact CD2-CE2 3.52Å; L529-F531 HydrophobicContact CD2-CZ 4.11Å; L529-F531 HydrophobicContact CG-CD2 4.25Å; L529-F531 HydrophobicContact CG-CE2 3.93Å; L529-I568 HydrophobicContact CB-CG2 4.4Å; L529-I568 HydrophobicContact CD2-CG2 4.37Å; L529-I568 HydrophobicContact CG-CG2 4.29Å; L529-P569 WeakPolarHBondContact O-CD 3.37Å
530	T	95.4	Very high	88.4	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.018	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	125.6	171	-65.3	0	0	0	0	110.4	Q496 V497 I498 L499 P569 I571	Q496-T530 PolarHBondContact NE2-OG1 3.48Å; V497-T530 PolarHBondContact O-N 2.82Å; I498-T530 HydrophobicContact CD1-CG2 4.44Å; L499-T530 PolarHBondContact N-O 3.48Å; T530-P569 VanDerWaalsContact CA-O 3.31Å; T530-P569 WeakPolarHBondContact CA-O 3.13Å; T530-P569 HydrophobicContact CG2-CG 4.33Å; T530-P569 WeakPolarHBondContact OG1-CG 3.22Å; T530-I571 HydrophobicContact CG2-CD1 4.12Å
531	F	95.8	Very high	88.1	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	140.2	174.9	-80.4	-99	0	0	0	110.9	L499 V501 V509 L513 L529 F533 V552 I556 I568 P569 W570 I571	L499-F531 HydrophobicContact CD2-CD1 4.09Å; L499-F531 HydrophobicContact CD2-CE1 3.54Å; L499-F531 HydrophobicContact CD2-CZ 3.85Å; V501-F531 HydrophobicContact CG2-CD1 3.75Å; V501-F531 HydrophobicContact CG2-CE1 4.05Å; V509-F531 HydrophobicContact CG1-CE1 3.65Å; V509-F531 HydrophobicContact CG1-CZ 3.99Å; L513-F531 HydrophobicContact CD2-CE2 4.05Å; L513-F531 HydrophobicContact CD2-CZ 3.78Å; L513-F531 HydrophobicContact CG-CZ 4.25Å; L529-F531 HydrophobicContact CD2-CD2 4.34Å; L529-F531 HydrophobicContact CD2-CE2 3.52Å; L529-F531 HydrophobicContact CD2-CZ 4.11Å; L529-F531 HydrophobicContact CG-CD2 4.25Å; L529-F531 HydrophobicContact CG-CE2 3.93Å; F531-F533 HydrophobicContact CB-CE1 4.06Å; F531-F533 HydrophobicContact CB-CE2 4.48Å; F531-F533 HydrophobicContact CB-CZ 4.01Å; F531-F533 AromaticContact CD1-CE1 3.77Å; F531-F533 HydrophobicContact CD1-CE1 3.77Å; F531-F533 HydrophobicContact CD1-CZ 4.16Å; F531-F533 HydrophobicContact CG-CE1 4.25Å; F531-F533 HydrophobicContact CG-CZ 4.26Å; F531-V552 HydrophobicContact CE1-CG1 4.21Å; F531-I556 HydrophobicContact CB-CD1 4.5Å; F531-I556 HydrophobicContact CD1-CD1 4.19Å; F531-I556 HydrophobicContact CD2-CD1 3.58Å; F531-I556 HydrophobicContact CD2-CG1 4.25Å; F531-I556 HydrophobicContact CE1-CD1 4.31Å; F531-I556 HydrophobicContact CE2-CD1 3.72Å; F531-I556 HydrophobicContact CE2-CG1 3.91Å; F531-I556 HydrophobicContact CG-CD1 3.83Å; F531-I556 HydrophobicContact CZ-CD1 4.1Å; F531-I556 HydrophobicContact CZ-CG1 4.23Å; F531-I568 HydrophobicContact CD2-CG2 3.56Å; F531-I568 HydrophobicContact CE2-CG2 3.68Å; F531-P569 PolarHBondContact N-O 2.88Å; F531-W570 HydrophobicContact CB-CB 3.75Å; F531-W570 CarbonylContact O-C 3.59Å; F531-W570 WeakPolarHBondContact O-CA 3.38Å; F531-I571 PolarHBondContact O-N 3.38Å
532	L	94.3	Very high	87.8	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.016	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	99	171.3	179	76	0	0	0	108.2	L499 P500 V501 I534 I571 V573 L583 I587	L499-L532 PolarHBondContact O-N 3Å; P500-L532 WeakPolarHBondContact CA-O 3.36Å; P500-L532 HydrophobicContact CB-CD2 4.25Å; V501-L532 PolarHBondContact N-O 3.38Å; L532-I534 HydrophobicContact CG-CG1 4.47Å; L532-I534 PolarHBondContact O-N 2.78Å; L532-I571 CarbonylContact C-O 3.59Å; L532-I571 WeakPolarHBondContact CA-O 3.36Å; L532-I571 HydrophobicContact CD1-CB 3.96Å; L532-I571 HydrophobicContact CD1-CG2 3.87Å; L532-V573 HydrophobicContact CD1-CB 4.47Å; L532-V573 HydrophobicContact CD1-CG2 3.51Å; L532-V573 HydrophobicContact CG-CG2 4.49Å; L532-L583 HydrophobicContact CD2-CB 3.91Å; L532-L583 HydrophobicContact CD2-CD1 3.99Å; L532-L583 HydrophobicContact CD2-CD2 4.08Å; L532-L583 HydrophobicContact CD2-CG 4.18Å; L532-I587 HydrophobicContact CD1-CG1 4.33Å; L532-I587 HydrophobicContact CD2-CD1 3.89Å; L532-I587 HydrophobicContact CD2-CG1 4.43Å
533	F	93.9	Very high	87.6	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	114.6	179.3	-64.5	-43.1	0	0	0	110.4	V501 F531 Y535 F549 V552 K553 I556 W570 I571 S572 V573	V501-F533 HydrophobicContact CB-CD1 4.26Å; F531-F533 HydrophobicContact CB-CE1 4.06Å; F531-F533 HydrophobicContact CB-CE2 4.48Å; F531-F533 HydrophobicContact CB-CZ 4.01Å; F531-F533 AromaticContact CD1-CE1 3.77Å; F531-F533 HydrophobicContact CD1-CE1 3.77Å; F531-F533 HydrophobicContact CD1-CZ 4.16Å; F531-F533 HydrophobicContact CG-CE1 4.25Å; F531-F533 HydrophobicContact CG-CZ 4.26Å; F533-Y535 HydrophobicContact CB-CD2 4.29Å; F533-Y535 HydrophobicContact CB-CE2 3.71Å; F533-F549 HydrophobicContact CB-CD2 3.9Å; F533-F549 HydrophobicContact CB-CE2 3.96Å; F533-F549 HydrophobicContact CB-CG 4.31Å; F533-F549 HydrophobicContact CB-CZ 4.44Å; F533-F549 HydrophobicContact CD1-CB 4.2Å; F533-F549 AromaticContact CD1-CD1 3.71Å; F533-F549 HydrophobicContact CD1-CD1 3.71Å; F533-F549 HydrophobicContact CD1-CD2 4.23Å; F533-F549 HydrophobicContact CD1-CE1 4.09Å; F533-F549 AromaticContact CD1-CG 3.78Å; F533-F549 HydrophobicContact CD1-CG 3.78Å; F533-F549 HydrophobicContact CD1-CZ 4.48Å; F533-F549 HydrophobicContact CD2-CB 4.46Å; F533-F549 HydrophobicContact CE1-CB 4.31Å; F533-F549 HydrophobicContact CE1-CD1 4.09Å; F533-F549 HydrophobicContact CE1-CG 4.27Å; F533-F549 HydrophobicContact CG-CB 4.3Å; F533-F549 HydrophobicContact CG-CD1 4.38Å; F533-F549 HydrophobicContact CG-CD2 4.09Å; F533-F549 HydrophobicContact CG-CG 4Å; F533-F549 HydrophobicContact CZ-CB 4.48Å; F533-V552 HydrophobicContact CE1-CB 4.34Å; F533-V552 HydrophobicContact CE1-CG1 3.77Å; F533-V552 HydrophobicContact CZ-CB 4.43Å; F533-V552 HydrophobicContact CZ-CG1 3.9Å; F533-K553 HydrophobicContact CE2-CD 4.37Å; F533-K553 HydrophobicContact CE2-CG 3.81Å; F533-K553 HydrophobicContact CZ-CG 4.18Å; F533-I556 HydrophobicContact CZ-CD1 3.89Å; F533-W570 HydrophobicContact CD2-CB 3.91Å; F533-W570 AromaticContact CD2-CD1 3.86Å; F533-W570 AromaticContact CD2-CG 4Å; F533-W570 HydrophobicContact CD2-CG 4Å; F533-W570 HydrophobicContact CE2-CB 3.53Å; F533-W570 AromaticContact CE2-CD1 3.75Å; F533-W570 HydrophobicContact CE2-CD2 4.23Å; F533-W570 AromaticContact CE2-CG 3.54Å; F533-W570 HydrophobicContact CE2-CG 3.54Å; F533-W570 HydrophobicContact CZ-CB 4.25Å; F533-I571 PolarHBondContact N-O 3.01Å; F533-S572 WeakPolarHBondContact O-CA 3.46Å; F533-V573 PolarHBondContact O-N 2.65Å
534	I	90.9	Very high	87.2	Confident	12 Å²	12	52 Å²	52	6%	0.062	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	109.5	-179.1	-56.3	172.9	0	0	0	107.8	P500 V501 T502 L532 T575 P578 L583	P500-I534 HydrophobicContact CB-CD1 4.03Å; V501-I534 PolarHBondContact O-N 3.19Å; T502-I534 HydrophobicContact CG2-CB 4.5Å; T502-I534 HydrophobicContact CG2-CD1 4.23Å; L532-I534 HydrophobicContact CG-CG1 4.47Å; L532-I534 PolarHBondContact O-N 2.78Å; I534-T575 HydrophobicContact CG2-CG2 3.77Å; I534-P578 HydrophobicContact CD1-CB 4.16Å; I534-P578 HydrophobicContact CG2-CB 4.13Å; I534-L583 HydrophobicContact CD1-CD1 3.66Å; I534-L583 HydrophobicContact CD1-CD2 4.39Å; I534-L583 HydrophobicContact CG1-CD2 4.44Å
535	Y	89.1	Confident	86.9	Confident	8 Å²	8	51.6 Å²	51.6	3%	0.031	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	127.4	177.7	-69.5	-96.4	0	0	0	110.4	F533 D539 V543 D547 F549 K553 V573 T575	F533-Y535 HydrophobicContact CB-CD2 4.29Å; F533-Y535 HydrophobicContact CB-CE2 3.71Å; Y535-D539 HydrophobicContact CD1-CB 4.39Å; Y535-V543 HydrophobicContact CD1-CG2 3.72Å; Y535-V543 HydrophobicContact CE1-CG1 4.37Å; Y535-V543 HydrophobicContact CE1-CG2 3.54Å; Y535-D547 WeakPolarHBondContact CE1-OD1 3.41Å; Y535-D547 PolarHBondContact OH-OD1 3.33Å; Y535-F549 HydrophobicContact CD1-CD2 4.21Å; Y535-F549 HydrophobicContact CD1-CE2 4.13Å; Y535-F549 HydrophobicContact CD2-CD2 4.45Å; Y535-F549 HydrophobicContact CD2-CE2 4.24Å; Y535-F549 AromaticContact CE1-CD2 3.62Å; Y535-F549 HydrophobicContact CE1-CD2 3.62Å; Y535-F549 HydrophobicContact CE1-CE2 4.02Å; Y535-F549 AromaticContact CE2-CD2 3.89Å; Y535-F549 HydrophobicContact CE2-CD2 3.89Å; Y535-F549 HydrophobicContact CE2-CE2 4.11Å; Y535-F549 HydrophobicContact CG-CE2 4.26Å; Y535-F549 AromaticContact CZ-CD2 3.47Å; Y535-F549 VanDerWaalsContact CZ-CD2 3.47Å; Y535-K553 PolarHBondContact OH-NZ 3.39Å; Y535-V573 PolarHBondContact N-O 3.33Å; Y535-T575 PolarHBondContact O-N 2.86Å
536	D	84.8	Confident	86.8	Confident	82 Å²	82	53.9 Å²	53.9	44%	0.439	28%	0.283	S	S	.	.			trans	-63	151.9	165	-75.3	-37.1	0	0	0	110	F538 D539 A540	D536-F538 PolarHBondContact O-N 3.28Å; D536-F538 VanDerWaalsContact O-N 3.08Å; D536-D539 PolarHBondContact O-N 3.37Å; D536-D539 VanDerWaalsContact O-N 3.1Å; D536-A540 WeakPolarHBondContact O-CB 3.2Å; D536-A540 PolarHBondContact O-N 2.84Å
537	P	83.1	Confident	86.6	Confident	33 Å²	33	52.2 Å²	52.2	21%	0.214	28%	0.275	C	S	.	.	H	α-helix	trans	-56.9	-32	-174.6	-21.8	27.6	0	0	0	114.2	Q541 E576	P537-Q541 WeakPolarHBondContact O-CG 3.44Å; P537-E576 HydrophobicContact CG-CB 4.4Å; P537-E576 HydrophobicContact CG-CG 3.32Å
538	F	82.9	Confident	86.3	Confident	114 Å²	114	53.9 Å²	53.9	50%	0.5	29%	0.285	S	S	.	.	H	α-helix	trans	-71.2	-46.6	178.3	-175.2	-99.8	0	0	0	111.6	D536 A540 Q541 R542	D536-F538 PolarHBondContact O-N 3.28Å; D536-F538 VanDerWaalsContact O-N 3.08Å; F538-A540 VanDerWaalsContact C-N 3.35Å; F538-Q541 PolarHBondContact O-N 3Å; F538-R542 VanDerWaalsContact CZ-NH2 3.29Å
539	D	82.4	Confident	86.2	Confident	39 Å²	39	51.9 Å²	51.9	21%	0.209	27%	0.274	C	S	.	.	H	α-helix	trans	-68.5	-37.2	178.8	-64.1	-30.1	0	0	0	111.3	Y535 D536 Q541 R542 V543 V548	Y535-D539 HydrophobicContact CD1-CB 4.39Å; D536-D539 PolarHBondContact O-N 3.37Å; D536-D539 VanDerWaalsContact O-N 3.1Å; D539-Q541 PolarHBondContact O-N 3.12Å; D539-R542 PolarHBondContact O-N 3.01Å; D539-V543 VanDerWaalsContact O-CG2 3.24Å; D539-V543 WeakPolarHBondContact O-CG2 3.35Å; D539-V543 PolarHBondContact O-N 3.01Å; D539-V543 VanDerWaalsContact O-N 3.14Å; D539-V548 HydrophobicContact CB-CG2 3.8Å
540	A	80.3	Confident	85.9	Confident	29 Å²	29	54.2 Å²	54.2	24%	0.24	29%	0.294	C	S	.	.	H	α-helix	trans	-57.5	-30.9	175.5	0	0	0	0	0	113.1	D536 F538 K574	D536-A540 WeakPolarHBondContact O-CB 3.2Å; D536-A540 PolarHBondContact O-N 2.84Å; F538-A540 VanDerWaalsContact C-N 3.35Å; A540-K574 HydrophobicContact CB-CB 4.26Å; A540-K574 HydrophobicContact CB-CD 3.84Å; A540-K574 HydrophobicContact CB-CG 3.77Å
541	Q	79.9	Confident	85.7	Confident	143 Å²	143	56.4 Å²	56.4	67%	0.668	32%	0.317	S	S	*	.	H	α-helix	trans	-76.7	-24.2	176.7	-71.2	176.4	1.3	0	0	112.9	P537 F538 D539	P537-Q541 WeakPolarHBondContact O-CG 3.44Å; F538-Q541 PolarHBondContact O-N 3Å; D539-Q541 PolarHBondContact O-N 3.12Å
542	R	81.4	Confident	85.5	Confident	119 Å²	119	56.6 Å²	56.6	45%	0.449	32%	0.318	S	S	.	.	H	α-helix	trans	-103.1	0.8	-174.8	-66.5	-176.7	177.1	-164.4	-2.5	114.1	F538 D539 S544 Q545 T546	F538-R542 VanDerWaalsContact CZ-NH2 3.29Å; D539-R542 PolarHBondContact O-N 3.01Å; R542-S544 PolarHBondContact O-N 2.89Å; R542-Q545 PolarHBondContact O-N 3.41Å; R542-T546 CarbonylContact O-C 3.59Å; R542-T546 PolarHBondContact O-N 3.26Å
543	V	81.5	Confident	85.4	Confident	50 Å²	50	58.6 Å²	58.6	30%	0.303	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-33.4	-178.1	-176.9	0	0	0	0	113.1	Y535 D539 Q545 D547	Y535-V543 HydrophobicContact CD1-CG2 3.72Å; Y535-V543 HydrophobicContact CE1-CG1 4.37Å; Y535-V543 HydrophobicContact CE1-CG2 3.54Å; D539-V543 VanDerWaalsContact O-CG2 3.24Å; D539-V543 WeakPolarHBondContact O-CG2 3.35Å; D539-V543 PolarHBondContact O-N 3.01Å; D539-V543 VanDerWaalsContact O-N 3.14Å; V543-Q545 VanDerWaalsContact C-N 3.31Å; V543-Q545 PolarHBondContact O-N 3.2Å; V543-D547 HydrophobicContact CG1-CB 4.26Å
544	S	74.1	Confident	85.3	Confident	111 Å²	111	61.8 Å²	61.8	78%	0.776	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-20.4	177.9	58	0	0	0	0	114.3	R542	R542-S544 PolarHBondContact O-N 2.89Å
545	Q	77.9	Confident	85.3	Confident	159 Å²	159	64 Å²	64	74%	0.743	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-48	-179.1	-63.6	179.6	1.8	0	0	111.3	R542 V543	R542-Q545 PolarHBondContact O-N 3.41Å; V543-Q545 VanDerWaalsContact C-N 3.31Å; V543-Q545 PolarHBondContact O-N 3.2Å
546	T	84	Confident	85.5	Confident	92 Å²	92	63.6 Å²	63.6	56%	0.564	36%	0.358	S	S	*	.			trans	-144.6	101.4	-177.5	53.1	0	0	0	0	108.8	R542	R542-T546 CarbonylContact O-C 3.59Å; R542-T546 PolarHBondContact O-N 3.26Å
547	D	85.2	Confident	85.8	Confident	39 Å²	39	61.3 Å²	61.3	21%	0.209	35%	0.354	C	S	.	.			trans	-86.9	116.1	177.2	-178.5	15.2	0	0	0	110.3	Y535 V543 F549 A550 K553	Y535-D547 WeakPolarHBondContact CE1-OD1 3.41Å; Y535-D547 PolarHBondContact OH-OD1 3.33Å; V543-D547 HydrophobicContact CG1-CB 4.26Å; D547-F549 PolarHBondContact O-N 3.28Å; D547-F549 PolarHBondContact OD1-N 3.24Å; D547-A550 HydrophobicContact CB-CB 4.22Å; D547-A550 VanDerWaalsContact O-CB 3.24Å; D547-A550 WeakPolarHBondContact O-CB 3.41Å; D547-A550 PolarHBondContact O-N 3.32Å; D547-A550 VanDerWaalsContact O-N 3.07Å; D547-K553 IonicContact OD1-NZ 3.94Å; D547-K553 WeakPolarHBondContact OD2-CE 3.37Å; D547-K553 IonicContact OD2-NZ 2.76Å; D547-K553 PolarHBondContact OD2-NZ 3.26Å
548	V	87.1	Confident	86.2	Confident	49 Å²	49	66 Å²	66	30%	0.297	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-33.2	-178.4	-157.6	0	0	0	0	110.8	A503 Q506 D539	A503-V548 HydrophobicContact CB-CG1 4.29Å; Q506-V548 VanDerWaalsContact NE2-C 3.26Å; Q506-V548 PolarHBondContact NE2-O 2.76Å; Q506-V548 PolarHBondContact OE1-O 2.82Å; D539-V548 HydrophobicContact CB-CG2 3.8Å
549	F	91.3	Very high	86.6	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.009	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	12.5	-179.7	-61.4	-73.8	0	0	0	113.8	V501 Q506 F533 Y535 D547 G551 V552 K553	V501-F549 HydrophobicContact CB-CE1 4.46Å; V501-F549 HydrophobicContact CG1-CD1 4.46Å; V501-F549 HydrophobicContact CG1-CE1 3.89Å; Q506-F549 HydrophobicContact CG-CD1 4.06Å; Q506-F549 HydrophobicContact CG-CE1 3.98Å; Q506-F549 VanDerWaalsContact NE2-CD1 3.29Å; F533-F549 HydrophobicContact CB-CD2 3.9Å; F533-F549 HydrophobicContact CB-CE2 3.96Å; F533-F549 HydrophobicContact CB-CG 4.31Å; F533-F549 HydrophobicContact CB-CZ 4.44Å; F533-F549 HydrophobicContact CD1-CB 4.2Å; F533-F549 AromaticContact CD1-CD1 3.71Å; F533-F549 HydrophobicContact CD1-CD1 3.71Å; F533-F549 HydrophobicContact CD1-CD2 4.23Å; F533-F549 HydrophobicContact CD1-CE1 4.09Å; F533-F549 AromaticContact CD1-CG 3.78Å; F533-F549 HydrophobicContact CD1-CG 3.78Å; F533-F549 HydrophobicContact CD1-CZ 4.48Å; F533-F549 HydrophobicContact CD2-CB 4.46Å; F533-F549 HydrophobicContact CE1-CB 4.31Å; F533-F549 HydrophobicContact CE1-CD1 4.09Å; F533-F549 HydrophobicContact CE1-CG 4.27Å; F533-F549 HydrophobicContact CG-CB 4.3Å; F533-F549 HydrophobicContact CG-CD1 4.38Å; F533-F549 HydrophobicContact CG-CD2 4.09Å; F533-F549 HydrophobicContact CG-CG 4Å; F533-F549 HydrophobicContact CZ-CB 4.48Å; Y535-F549 HydrophobicContact CD1-CD2 4.21Å; Y535-F549 HydrophobicContact CD1-CE2 4.13Å; Y535-F549 HydrophobicContact CD2-CD2 4.45Å; Y535-F549 HydrophobicContact CD2-CE2 4.24Å; Y535-F549 AromaticContact CE1-CD2 3.62Å; Y535-F549 HydrophobicContact CE1-CD2 3.62Å; Y535-F549 HydrophobicContact CE1-CE2 4.02Å; Y535-F549 AromaticContact CE2-CD2 3.89Å; Y535-F549 HydrophobicContact CE2-CD2 3.89Å; Y535-F549 HydrophobicContact CE2-CE2 4.11Å; Y535-F549 HydrophobicContact CG-CE2 4.26Å; Y535-F549 AromaticContact CZ-CD2 3.47Å; Y535-F549 VanDerWaalsContact CZ-CD2 3.47Å; D547-F549 PolarHBondContact O-N 3.28Å; D547-F549 PolarHBondContact OD1-N 3.24Å; F549-G551 VanDerWaalsContact C-N 3.29Å; F549-G551 PolarHBondContact O-N 2.91Å; F549-V552 HydrophobicContact CD1-CG2 4.4Å; F549-V552 PolarHBondContact O-N 2.89Å; F549-V552 VanDerWaalsContact O-N 3.16Å; F549-K553 WeakPolarHBondContact O-CG 3.49Å; F549-K553 PolarHBondContact O-N 3.09Å
550	A	89	Confident	87	Confident	52 Å²	52	62.5 Å²	62.5	43%	0.43	36%	0.358	S	S	.	.	H	α-helix	trans	-57.2	-41.6	179.9	0	0	0	0	0	112.5	D547 K553 S554	D547-A550 HydrophobicContact CB-CB 4.22Å; D547-A550 VanDerWaalsContact O-CB 3.24Å; D547-A550 WeakPolarHBondContact O-CB 3.41Å; D547-A550 PolarHBondContact O-N 3.32Å; D547-A550 VanDerWaalsContact O-N 3.07Å; A550-K553 PolarHBondContact O-N 3.22Å; A550-S554 PolarHBondContact O-N 3.04Å
551	G	90.4	Very high	87.6	Confident	48 Å²	48	70.1 Å²	70.1	50%	0.495	39%	0.386	S	S	.	.	H	α-helix	trans	-61.8	-44.7	176.2	0	0	0	0	0	112.3	F549 S554 M555	F549-G551 VanDerWaalsContact C-N 3.29Å; F549-G551 PolarHBondContact O-N 2.91Å; G551-S554 WeakPolarHBondContact O-CB 3.29Å; G551-S554 PolarHBondContact O-N 3.29Å; G551-M555 WeakPolarHBondContact O-CG 3.27Å; G551-M555 PolarHBondContact O-N 3.45Å
552	V	91.5	Very high	88.1	Confident	4 Å²	4	72 Å²	72	2%	0.024	39%	0.387	C	S	.	.	H	α-helix	trans	-64.5	-42.3	177.7	-177.6	0	0	0	0	111.7	Q506 V509 F531 F533 F549 S554 M555 I556	Q506-V552 HydrophobicContact CB-CG2 4.45Å; Q506-V552 HydrophobicContact CG-CG2 4.39Å; V509-V552 HydrophobicContact CB-CG1 4.4Å; V509-V552 HydrophobicContact CB-CG2 4.42Å; V509-V552 HydrophobicContact CG1-CG1 3.73Å; V509-V552 HydrophobicContact CG2-CG2 4.38Å; F531-V552 HydrophobicContact CE1-CG1 4.21Å; F533-V552 HydrophobicContact CE1-CB 4.34Å; F533-V552 HydrophobicContact CE1-CG1 3.77Å; F533-V552 HydrophobicContact CZ-CB 4.43Å; F533-V552 HydrophobicContact CZ-CG1 3.9Å; F549-V552 HydrophobicContact CD1-CG2 4.4Å; F549-V552 PolarHBondContact O-N 2.89Å; F549-V552 VanDerWaalsContact O-N 3.16Å; V552-S554 VanDerWaalsContact C-N 3.29Å; V552-S554 PolarHBondContact O-N 3.42Å; V552-M555 HydrophobicContact CB-CE 4.26Å; V552-M555 HydrophobicContact CG2-CE 3.97Å; V552-M555 PolarHBondContact O-N 3.43Å; V552-I556 HydrophobicContact CG1-CD1 4.13Å; V552-I556 WeakPolarHBondContact O-CG1 3.47Å; V552-I556 PolarHBondContact O-N 3.43Å
553	K	92.7	Very high	88.4	Confident	45 Å²	45	68.5 Å²	68.5	20%	0.196	37%	0.374	C	S	.	.	H	α-helix	trans	-62.4	-36.2	175.1	-70.2	172.2	-175.4	171.5	0	112.2	F533 Y535 D547 F549 A550 G557	F533-K553 HydrophobicContact CE2-CD 4.37Å; F533-K553 HydrophobicContact CE2-CG 3.81Å; F533-K553 HydrophobicContact CZ-CG 4.18Å; Y535-K553 PolarHBondContact OH-NZ 3.39Å; D547-K553 IonicContact OD1-NZ 3.94Å; D547-K553 WeakPolarHBondContact OD2-CE 3.37Å; D547-K553 IonicContact OD2-NZ 2.76Å; D547-K553 PolarHBondContact OD2-NZ 3.26Å; F549-K553 WeakPolarHBondContact O-CG 3.49Å; F549-K553 PolarHBondContact O-N 3.09Å; A550-K553 PolarHBondContact O-N 3.22Å; K553-G557 PolarHBondContact O-N 3Å
554	S	92.3	Very high	88.3	Confident	67 Å²	67	69.4 Å²	69.4	47%	0.469	39%	0.394	S	S	.	.	H	α-helix	trans	-63.4	-47	173.1	-166.3	0	0	0	0	111.4	A550 G551 V552 I556 G557 E558	A550-S554 PolarHBondContact O-N 3.04Å; G551-S554 WeakPolarHBondContact O-CB 3.29Å; G551-S554 PolarHBondContact O-N 3.29Å; V552-S554 VanDerWaalsContact C-N 3.29Å; V552-S554 PolarHBondContact O-N 3.42Å; S554-I556 VanDerWaalsContact C-N 3.33Å; S554-I556 PolarHBondContact O-N 3.34Å; S554-G557 PolarHBondContact O-N 3.39Å; S554-G557 VanDerWaalsContact O-N 3.14Å; S554-E558 WeakPolarHBondContact O-CG 3.4Å; S554-E558 PolarHBondContact O-N 3.14Å
555	M	91.2	Very high	88.8	Confident	59 Å²	59	72.2 Å²	72.2	29%	0.291	40%	0.4	S	S	.	.	H	α-helix	trans	-59.8	-42.2	177.3	-68.4	-173.6	-75.6	0	0	111.9	L513 G551 V552 G557 E558 V559	L513-M555 HydrophobicContact CD1-CB 3.91Å; G551-M555 WeakPolarHBondContact O-CG 3.27Å; G551-M555 PolarHBondContact O-N 3.45Å; V552-M555 HydrophobicContact CB-CE 4.26Å; V552-M555 HydrophobicContact CG2-CE 3.97Å; V552-M555 PolarHBondContact O-N 3.43Å; M555-G557 PolarHBondContact O-N 2.95Å; M555-E558 WeakPolarHBondContact O-CB 3.28Å; M555-E558 PolarHBondContact O-N 3.3Å; M555-V559 WeakPolarHBondContact O-CG2 3.36Å; M555-V559 PolarHBondContact O-N 3.27Å; M555-V559 VanDerWaalsContact O-N 3.11Å
556	I	91.7	Very high	89.2	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-60.6	-46.1	174.7	-66.9	166.4	0	0	0	110.7	L513 F531 F533 V552 S554 E558 V559 E560 I568 W570	L513-I556 HydrophobicContact CD1-CG1 4.46Å; F531-I556 HydrophobicContact CB-CD1 4.5Å; F531-I556 HydrophobicContact CD1-CD1 4.19Å; F531-I556 HydrophobicContact CD2-CD1 3.58Å; F531-I556 HydrophobicContact CD2-CG1 4.25Å; F531-I556 HydrophobicContact CE1-CD1 4.31Å; F531-I556 HydrophobicContact CE2-CD1 3.72Å; F531-I556 HydrophobicContact CE2-CG1 3.91Å; F531-I556 HydrophobicContact CG-CD1 3.83Å; F531-I556 HydrophobicContact CZ-CD1 4.1Å; F531-I556 HydrophobicContact CZ-CG1 4.23Å; F533-I556 HydrophobicContact CZ-CD1 3.89Å; V552-I556 HydrophobicContact CG1-CD1 4.13Å; V552-I556 WeakPolarHBondContact O-CG1 3.47Å; V552-I556 PolarHBondContact O-N 3.43Å; S554-I556 VanDerWaalsContact C-N 3.33Å; S554-I556 PolarHBondContact O-N 3.34Å; I556-E558 VanDerWaalsContact C-N 3.27Å; I556-E558 PolarHBondContact O-N 3.12Å; I556-V559 PolarHBondContact O-N 3.15Å; I556-V559 VanDerWaalsContact O-N 3.14Å; I556-E560 HydrophobicContact CG2-CG 4.4Å; I556-E560 PolarHBondContact O-N 3.4Å; I556-I568 HydrophobicContact CG2-CB 3.78Å; I556-I568 HydrophobicContact CG2-CD1 4.45Å; I556-I568 HydrophobicContact CG2-CG2 3.92Å; I556-W570 HydrophobicContact CD1-CE3 4.43Å; I556-W570 HydrophobicContact CG2-CE3 4.28Å; I556-W570 HydrophobicContact CG2-CZ3 4.07Å
557	G	91.9	Very high	89.5	Confident	34 Å²	34	69.5 Å²	69.5	35%	0.351	38%	0.38	S	S	.	.	H	α-helix	trans	-62.3	-32.1	177.8	0	0	0	0	0	113.5	K553 S554 M555 K561	K553-G557 PolarHBondContact O-N 3Å; S554-G557 PolarHBondContact O-N 3.39Å; S554-G557 VanDerWaalsContact O-N 3.14Å; M555-G557 PolarHBondContact O-N 2.95Å; G557-K561 VanDerWaalsContact O-CB 3.3Å; G557-K561 WeakPolarHBondContact O-CB 3.39Å; G557-K561 PolarHBondContact O-N 3.14Å
558	E	91.6	Very high	89.9	Confident	130 Å²	130	67.7 Å²	67.7	61%	0.607	37%	0.371	S	S	*	.	H	α-helix	trans	-67.4	-41.7	172.9	-72.9	177.5	-173.2	0	0	112	S554 M555 I556 K561 R562	S554-E558 WeakPolarHBondContact O-CG 3.4Å; S554-E558 PolarHBondContact O-N 3.14Å; M555-E558 WeakPolarHBondContact O-CB 3.28Å; M555-E558 PolarHBondContact O-N 3.3Å; I556-E558 VanDerWaalsContact C-N 3.27Å; I556-E558 PolarHBondContact O-N 3.12Å; E558-K561 PolarHBondContact O-N 3.07Å; E558-R562 WeakPolarHBondContact O-CB 3.47Å; E558-R562 PolarHBondContact O-N 3.4Å
559	V	90.7	Very high	90.2	Very high	19 Å²	19	68.5 Å²	68.5	12%	0.115	38%	0.377	C	S	.	.	H	α-helix	trans	-65.2	-46.4	175.7	176.4	0	0	0	0	111.1	V517 L521 M555 I556 K561 R562 Y563 I568	V517-V559 HydrophobicContact CG2-CG1 4.06Å; V517-V559 HydrophobicContact CG2-CG2 4.33Å; L521-V559 HydrophobicContact CD1-CG1 3.99Å; M555-V559 WeakPolarHBondContact O-CG2 3.36Å; M555-V559 PolarHBondContact O-N 3.27Å; M555-V559 VanDerWaalsContact O-N 3.11Å; I556-V559 PolarHBondContact O-N 3.15Å; I556-V559 VanDerWaalsContact O-N 3.14Å; V559-K561 VanDerWaalsContact C-N 3.27Å; V559-K561 PolarHBondContact O-N 3.37Å; V559-R562 PolarHBondContact O-N 2.76Å; V559-R562 VanDerWaalsContact O-N 3.1Å; V559-Y563 HydrophobicContact CG1-CD2 4.26Å; V559-Y563 PolarHBondContact O-N 3.33Å; V559-I568 HydrophobicContact CB-CD1 4.38Å; V559-I568 HydrophobicContact CG1-CD1 3.88Å
560	E	92.3	Very high	90.3	Very high	61 Å²	61	73.4 Å²	73.4	29%	0.285	40%	0.395	S	S	.	.	H	α-helix	trans	-61.4	-35.6	176.5	-69.9	-171.1	145.2	0	0	112.1	I556 Y563 K567 I568	I556-E560 HydrophobicContact CG2-CG 4.4Å; I556-E560 PolarHBondContact O-N 3.4Å; E560-Y563 CarbonylContact O-C 3.6Å; E560-K567 WeakPolarHBondContact OE1-CA 3.22Å; E560-I568 HydrophobicContact CG-CB 4.5Å; E560-I568 HydrophobicContact CG-CG1 4.44Å; E560-I568 PolarHBondContact OE1-N 3.32Å
561	K	91.3	Very high	90.5	Very high	189 Å²	189	71.5 Å²	71.5	82%	0.822	38%	0.378	S	S	*	.	H	α-helix	trans	-70.1	-33.3	175.8	-169.5	179.2	-178	-177.7	0	112.3	G557 E558 V559	G557-K561 VanDerWaalsContact O-CB 3.3Å; G557-K561 WeakPolarHBondContact O-CB 3.39Å; G557-K561 PolarHBondContact O-N 3.14Å; E558-K561 PolarHBondContact O-N 3.07Å; V559-K561 VanDerWaalsContact C-N 3.27Å; V559-K561 PolarHBondContact O-N 3.37Å
562	R	90.4	Very high	90.6	Very high	184 Å²	184	72.3 Å²	72.3	69%	0.694	38%	0.376	S	S	*	.	H	α-helix	trans	-74.7	-35.6	177.5	-174	174.3	175.5	-177.7	-3.6	111.9	E558 V559	E558-R562 WeakPolarHBondContact O-CB 3.47Å; E558-R562 PolarHBondContact O-N 3.4Å; V559-R562 PolarHBondContact O-N 2.76Å; V559-R562 VanDerWaalsContact O-N 3.1Å
563	Y	87.4	Confident	90.5	Very high	45 Å²	45	72.6 Å²	72.6	18%	0.176	38%	0.378	C	S	.	.	S	Bend	trans	-119.7	86.7	-179.5	-63.1	-92.5	0	0	0	110.4	V517 L521 D522 V559 E560 D565 V566	V517-Y563 HydrophobicContact CG1-CE2 3.73Å; V517-Y563 WeakPolarHBondContact CG1-OH 3.3Å; V517-Y563 HydrophobicContact CG2-CE2 4.5Å; L521-Y563 HydrophobicContact CB-CD1 4.45Å; L521-Y563 HydrophobicContact CB-CE1 4.29Å; L521-Y563 HydrophobicContact CD1-CD2 4.21Å; L521-Y563 HydrophobicContact CD1-CG 4.38Å; D522-Y563 PolarHBondContact OD1-OH 3.35Å; V559-Y563 HydrophobicContact CG1-CD2 4.26Å; V559-Y563 PolarHBondContact O-N 3.33Å; E560-Y563 CarbonylContact O-C 3.6Å; Y563-D565 PolarHBondContact O-N 3Å; Y563-V566 PolarHBondContact O-N 3.21Å
564	G	80.4	Confident	90.2	Very high	69 Å²	69	76.8 Å²	76.8	71%	0.711	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-16.9	-171.6	0	0	0	0	0	116.3
565	D	83.9	Confident	89.7	Confident	170 Å²	170	74.8 Å²	74.8	91%	0.909	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-5.8	178	-64.2	-33.8	0	0	0	113.2	Y563	Y563-D565 PolarHBondContact O-N 3Å
566	V	87.2	Confident	88.9	Confident	31 Å²	31	78.7 Å²	78.7	19%	0.188	40%	0.398	C	S	.	.			trans	-105.5	130.3	-176	-176.8	0	0	0	0	109.8	L521 Y563 I568	L521-V566 HydrophobicContact CD1-CG1 4.42Å; L521-V566 HydrophobicContact CD2-CG1 4.06Å; L521-V566 HydrophobicContact CD2-CG2 3.91Å; Y563-V566 PolarHBondContact O-N 3.21Å; V566-I568 HydrophobicContact CG1-CD1 4.47Å; V566-I568 HydrophobicContact CG1-CG1 3.99Å
567	K	90.6	Very high	88	Confident	163 Å²	163	79.4 Å²	79.4	71%	0.709	40%	0.402	S	S	*	.			trans	-119.5	129	169.7	-66.5	-172.4	179.2	-176.8	0	109.4	E560 P569	E560-K567 WeakPolarHBondContact OE1-CA 3.22Å; K567-P569 VanDerWaalsContact O-CD 3.26Å; K567-P569 WeakPolarHBondContact O-CD 3.43Å
568	I	92.8	Very high	87.3	Confident	1 Å²	1	80 Å²	80	1%	0.005	40%	0.4	C	S	.	.			trans	-114.1	88.1	-177.5	-57	178.7	0	0	0	107.8	L529 F531 I556 V559 E560 V566	L529-I568 HydrophobicContact CB-CG2 4.4Å; L529-I568 HydrophobicContact CD2-CG2 4.37Å; L529-I568 HydrophobicContact CG-CG2 4.29Å; F531-I568 HydrophobicContact CD2-CG2 3.56Å; F531-I568 HydrophobicContact CE2-CG2 3.68Å; I556-I568 HydrophobicContact CG2-CB 3.78Å; I556-I568 HydrophobicContact CG2-CD1 4.45Å; I556-I568 HydrophobicContact CG2-CG2 3.92Å; V559-I568 HydrophobicContact CB-CD1 4.38Å; V559-I568 HydrophobicContact CG1-CD1 3.88Å; E560-I568 HydrophobicContact CG-CB 4.5Å; E560-I568 HydrophobicContact CG-CG1 4.44Å; E560-I568 PolarHBondContact OE1-N 3.32Å; V566-I568 HydrophobicContact CG1-CD1 4.47Å; V566-I568 HydrophobicContact CG1-CG1 3.99Å
569	P	93.7	Very high	86.9	Confident	65 Å²	65	74.1 Å²	74.1	42%	0.422	37%	0.373	S	S	.	.			trans	-69	153.3	179.1	29.3	-35.9	0	0	0	111.5	L529 T530 F531 K567	L529-P569 WeakPolarHBondContact O-CD 3.37Å; T530-P569 VanDerWaalsContact CA-O 3.31Å; T530-P569 WeakPolarHBondContact CA-O 3.13Å; T530-P569 HydrophobicContact CG2-CG 4.33Å; T530-P569 WeakPolarHBondContact OG1-CG 3.22Å; F531-P569 PolarHBondContact N-O 2.88Å; K567-P569 VanDerWaalsContact O-CD 3.26Å; K567-P569 WeakPolarHBondContact O-CD 3.43Å
570	W	93.4	Very high	86.7	Confident	105 Å²	105	75 Å²	75	40%	0.398	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	149.3	171.1	60.8	83.4	0	0	0	112.3	F531 F533 I556	F531-W570 HydrophobicContact CB-CB 3.75Å; F531-W570 CarbonylContact O-C 3.59Å; F531-W570 WeakPolarHBondContact O-CA 3.38Å; F533-W570 HydrophobicContact CD2-CB 3.91Å; F533-W570 AromaticContact CD2-CD1 3.86Å; F533-W570 AromaticContact CD2-CG 4Å; F533-W570 HydrophobicContact CD2-CG 4Å; F533-W570 HydrophobicContact CE2-CB 3.53Å; F533-W570 AromaticContact CE2-CD1 3.75Å; F533-W570 HydrophobicContact CE2-CD2 4.23Å; F533-W570 AromaticContact CE2-CG 3.54Å; F533-W570 HydrophobicContact CE2-CG 3.54Å; F533-W570 HydrophobicContact CZ-CB 4.25Å; I556-W570 HydrophobicContact CD1-CE3 4.43Å; I556-W570 HydrophobicContact CG2-CE3 4.28Å; I556-W570 HydrophobicContact CG2-CZ3 4.07Å
571	I	93.1	Very high	86.5	Confident	13 Å²	13	72.1 Å²	72.1	7%	0.067	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	122.5	177	-63.6	160.4	0	0	0	108.4	T530 F531 L532 F533 V573 I586 K590	T530-I571 HydrophobicContact CG2-CD1 4.12Å; F531-I571 PolarHBondContact O-N 3.38Å; L532-I571 CarbonylContact C-O 3.59Å; L532-I571 WeakPolarHBondContact CA-O 3.36Å; L532-I571 HydrophobicContact CD1-CB 3.96Å; L532-I571 HydrophobicContact CD1-CG2 3.87Å; F533-I571 PolarHBondContact N-O 3.01Å; I571-V573 HydrophobicContact CG2-CG2 4.03Å; I571-I586 HydrophobicContact CG2-CG2 4.28Å; I571-K590 HydrophobicContact CD1-CB 4.37Å; I571-K590 HydrophobicContact CD1-CD 3.66Å; I571-K590 HydrophobicContact CG1-CD 3.82Å; I571-K590 HydrophobicContact CG2-CD 4.19Å
572	S	91.6	Very high	86.3	Confident	65 Å²	65	66.1 Å²	66.1	46%	0.455	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	127.1	172.8	-57.5	0	0	0	0	110.6	F533	F533-S572 WeakPolarHBondContact O-CA 3.46Å
573	V	89.6	Confident	86.3	Confident	10 Å²	10	58.2 Å²	58.2	6%	0.061	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	133.4	176.4	177.6	0	0	0	0	109.5	L532 F533 Y535 I571 L583 I586	L532-V573 HydrophobicContact CD1-CB 4.47Å; L532-V573 HydrophobicContact CD1-CG2 3.51Å; L532-V573 HydrophobicContact CG-CG2 4.49Å; F533-V573 PolarHBondContact O-N 2.65Å; Y535-V573 PolarHBondContact N-O 3.33Å; I571-V573 HydrophobicContact CG2-CG2 4.03Å; V573-L583 HydrophobicContact CG1-CD2 4.06Å; V573-I586 HydrophobicContact CB-CD1 4.32Å; V573-I586 HydrophobicContact CG1-CD1 3.51Å; V573-I586 HydrophobicContact CG2-CD1 3.77Å; V573-I586 HydrophobicContact CG2-CG2 4.03Å
574	K	87.5	Confident	86.5	Confident	133 Å²	133	56.2 Å²	56.2	58%	0.578	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	121.4	170.8	178.3	-172.9	176.1	-171.8	0	108.5	A540	A540-K574 HydrophobicContact CB-CB 4.26Å; A540-K574 HydrophobicContact CB-CD 3.84Å; A540-K574 HydrophobicContact CB-CG 3.77Å
575	T	82.1	Confident	87	Confident	24 Å²	24	54.3 Å²	54.3	15%	0.147	27%	0.274	C	S	.	.			trans	-151.2	147.4	175	-174.5	0	0	0	0	111.3	I534 Y535 V577 P578	I534-T575 HydrophobicContact CG2-CG2 3.77Å; Y535-T575 PolarHBondContact O-N 2.86Å; T575-V577 PolarHBondContact OG1-N 3Å; T575-V577 PolarHBondContact OG1-O 3.3Å; T575-P578 HydrophobicContact CG2-CB 4.03Å
576	E	73.1	Confident	87.4	Confident	142 Å²	142	49.1 Å²	49.1	66%	0.664	25%	0.246	S	C	*	.	S	Bend	trans	-81.9	-29.1	171.3	-77.2	-178.5	-163.2	0	0	112.5	P537	P537-E576 HydrophobicContact CG-CB 4.4Å; P537-E576 HydrophobicContact CG-CG 3.32Å
577	V	74.1	Confident	87.7	Confident	14 Å²	14	47.9 Å²	47.9	9%	0.085	24%	0.238	C	C	.	.	S	Bend	trans	-136.9	111.6	178.6	-176.3	0	0	0	0	108	T575 S579 F731	T575-V577 PolarHBondContact OG1-N 3Å; T575-V577 PolarHBondContact OG1-O 3.3Å; V577-S579 VanDerWaalsContact C-N 3.29Å; V577-S579 PolarHBondContact O-N 3.41Å; V577-F731 HydrophobicContact CG1-CD1 4.38Å; V577-F731 HydrophobicContact CG1-CE1 3.58Å; V577-F731 HydrophobicContact CG1-CZ 3.89Å
578	P	77.1	Confident	87.8	Confident	48 Å²	48	40.2 Å²	40.2	31%	0.312	21%	0.205	S	C	.	.			trans	-78.6	75.7	-179.3	31.5	-34	0	0	0	111.1	I534 T575 L583	I534-P578 HydrophobicContact CD1-CB 4.16Å; I534-P578 HydrophobicContact CG2-CB 4.13Å; T575-P578 HydrophobicContact CG2-CB 4.03Å; P578-L583 HydrophobicContact CB-CD1 4.24Å
579	S	83.4	Confident	87.9	Confident	5 Å²	5	48.1 Å²	48.1	4%	0.035	24%	0.239	C	C	.	.			trans	-67.5	132.6	168.8	154.3	0	0	0	0	110.2	V577 V581 K582 L583 M693	V577-S579 VanDerWaalsContact C-N 3.29Å; V577-S579 PolarHBondContact O-N 3.41Å; S579-V581 PolarHBondContact O-N 3.03Å; S579-V581 PolarHBondContact OG-N 3.4Å; S579-K582 PolarHBondContact O-N 3.47Å; S579-K582 VanDerWaalsContact O-N 3.11Å; S579-L583 WeakPolarHBondContact O-CG 3.19Å; S579-L583 PolarHBondContact O-N 3.44Å; S579-M693 PolarHBondContact OG-O 2.83Å
580	Q	86.4	Confident	87.9	Confident	39 Å²	39	51.1 Å²	51.1	18%	0.182	25%	0.245	C	C	.	.	H	α-helix	trans	-53.9	-41	179.5	-164.4	-167.2	34.8	0	0	111.6	L583 M584 F665 D666 V698	Q580-L583 PolarHBondContact O-N 3.49Å; Q580-M584 WeakPolarHBondContact O-CB 3.3Å; Q580-M584 PolarHBondContact O-N 2.89Å; Q580-F665 PolarHBondContact NE2-O 3Å; Q580-D666 PolarHBondContact NE2-O 3.31Å; Q580-V698 HydrophobicContact CB-CG2 4.5Å; Q580-V698 HydrophobicContact CG-CG2 3.86Å
581	V	88.3	Confident	87.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.6	-45.2	178.6	179	0	0	0	0	111.6	S579 L583 M584 D585 Y675 M696 V698 I701	S579-V581 PolarHBondContact O-N 3.03Å; S579-V581 PolarHBondContact OG-N 3.4Å; V581-L583 VanDerWaalsContact C-N 3.31Å; V581-L583 PolarHBondContact O-N 2.97Å; V581-M584 PolarHBondContact O-N 3.32Å; V581-D585 PolarHBondContact O-N 3.32Å; V581-Y675 PolarHBondContact O-OH 2.88Å; V581-M696 VanDerWaalsContact CG2-O 3.3Å; V581-M696 WeakPolarHBondContact CG2-O 3.33Å; V581-V698 HydrophobicContact CG2-CG2 4.5Å; V581-I701 HydrophobicContact CB-CD1 4.2Å; V581-I701 HydrophobicContact CG1-CD1 3.6Å; V581-I701 HydrophobicContact CG2-CD1 3.56Å; V581-I701 HydrophobicContact CG2-CG1 4.42Å
582	K	87.1	Confident	88	Confident	63 Å²	63	50.7 Å²	50.7	27%	0.274	25%	0.254	S	S	.	.	H	α-helix	trans	-61.9	-40.1	178.1	-70	-174.8	-176.8	176.4	0	111.6	S579 I586 E694	S579-K582 PolarHBondContact O-N 3.47Å; S579-K582 VanDerWaalsContact O-N 3.11Å; K582-I586 PolarHBondContact O-N 3.33Å; K582-E694 IonicContact NZ-OE1 3.76Å; K582-E694 PolarHBondContact NZ-OE1 3.46Å
583	L	89.9	Confident	88.1	Confident	18 Å²	18	52.1 Å²	52.1	9%	0.094	26%	0.26	C	S	.	.	H	α-helix	trans	-65.9	-44.4	175.9	-62.1	-178.9	0	0	0	110.8	L532 I534 V573 P578 S579 Q580 V581 D585 I586 I587	L532-L583 HydrophobicContact CD2-CB 3.91Å; L532-L583 HydrophobicContact CD2-CD1 3.99Å; L532-L583 HydrophobicContact CD2-CD2 4.08Å; L532-L583 HydrophobicContact CD2-CG 4.18Å; I534-L583 HydrophobicContact CD1-CD1 3.66Å; I534-L583 HydrophobicContact CD1-CD2 4.39Å; I534-L583 HydrophobicContact CG1-CD2 4.44Å; V573-L583 HydrophobicContact CG1-CD2 4.06Å; P578-L583 HydrophobicContact CB-CD1 4.24Å; S579-L583 WeakPolarHBondContact O-CG 3.19Å; S579-L583 PolarHBondContact O-N 3.44Å; Q580-L583 PolarHBondContact O-N 3.49Å; V581-L583 VanDerWaalsContact C-N 3.31Å; V581-L583 PolarHBondContact O-N 2.97Å; L583-D585 VanDerWaalsContact C-N 3.34Å; L583-D585 PolarHBondContact O-N 3.26Å; L583-I586 PolarHBondContact O-N 3.12Å; L583-I586 VanDerWaalsContact O-N 3.14Å; L583-I587 WeakPolarHBondContact O-CD1 3.29Å; L583-I587 WeakPolarHBondContact O-CG1 2.99Å; L583-I587 PolarHBondContact O-N 3.02Å
584	M	92.3	Very high	88.2	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-64.3	-37	179.6	-164.6	60.7	-133	0	0	112.3	Q580 V581 I586 I587 S588 F597 L599 F670 Y675 V698	Q580-M584 WeakPolarHBondContact O-CB 3.3Å; Q580-M584 PolarHBondContact O-N 2.89Å; V581-M584 PolarHBondContact O-N 3.32Å; M584-I586 PolarHBondContact O-N 3.25Å; M584-I587 HydrophobicContact CE-CB 4.06Å; M584-I587 HydrophobicContact CE-CG2 3.85Å; M584-I587 PolarHBondContact O-N 3.14Å; M584-I587 HydrophobicContact SD-CB 4.39Å; M584-I587 HydrophobicContact SD-CD1 4.34Å; M584-I587 HydrophobicContact SD-CG2 4.48Å; M584-S588 WeakPolarHBondContact O-CB 3.37Å; M584-S588 PolarHBondContact O-N 2.93Å; M584-F597 HydrophobicContact CE-CD2 3.47Å; M584-F597 VanDerWaalsContact CE-CD2 3.47Å; M584-F597 HydrophobicContact CE-CE1 4.49Å; M584-F597 HydrophobicContact CE-CE2 3.26Å; M584-F597 HydrophobicContact CE-CG 4.15Å; M584-F597 HydrophobicContact CE-CZ 3.82Å; M584-L599 HydrophobicContact SD-CD2 4.03Å; M584-F670 HydrophobicContact CE-CE2 4.03Å; M584-F670 HydrophobicContact CE-CZ 4.15Å; M584-F670 HydrophobicContact CG-CZ 4.19Å; M584-F670 HydrophobicContact SD-CE2 4.22Å; M584-F670 HydrophobicContact SD-CZ 3.74Å; M584-Y675 HydrophobicContact CB-CE1 4.32Å; M584-Y675 HydrophobicContact CB-CE2 4.19Å; M584-Y675 HydrophobicContact CG-CD1 4.12Å; M584-Y675 HydrophobicContact CG-CD2 4.05Å; M584-Y675 HydrophobicContact CG-CE1 3.74Å; M584-Y675 HydrophobicContact CG-CE2 3.64Å; M584-Y675 HydrophobicContact CG-CG 4.28Å; M584-Y675 VanDerWaalsContact CG-CZ 3.49Å; M584-V698 HydrophobicContact CB-CG2 4.29Å; M584-V698 HydrophobicContact CG-CG2 4.49Å
585	D	90	Very high	88.7	Confident	29 Å²	29	51.7 Å²	51.7	16%	0.155	26%	0.264	C	S	.	.	H	α-helix	trans	-59.9	-33	174.4	-82.6	-1.8	0	0	0	112.6	V581 L583 K589 Y675 R679	V581-D585 PolarHBondContact O-N 3.32Å; L583-D585 VanDerWaalsContact C-N 3.34Å; L583-D585 PolarHBondContact O-N 3.26Å; D585-K589 WeakPolarHBondContact O-CD 3.33Å; D585-K589 VanDerWaalsContact O-CG 3.3Å; D585-K589 WeakPolarHBondContact O-CG 3.22Å; D585-Y675 PolarHBondContact OD1-OH 3.3Å; D585-R679 IonicContact OD1-NE 3.52Å; D585-R679 PolarHBondContact OD1-NE 2.68Å; D585-R679 VanDerWaalsContact OD1-NE 3.12Å; D585-R679 IonicContact OD2-CZ 3.85Å; D585-R679 IonicContact OD2-NE 2.77Å; D585-R679 PolarHBondContact OD2-NE 2.97Å; D585-R679 IonicContact OD2-NH2 3.81Å; D585-R679 PolarHBondContact OD2-NH2 3.48Å
586	I	91.4	Very high	89.4	Confident	62 Å²	62	50.6 Å²	50.6	32%	0.318	26%	0.258	S	S	.	.	H	α-helix	trans	-76.4	-44.8	176.3	-62.7	168.2	0	0	0	110.6	I571 V573 K582 L583 M584	I571-I586 HydrophobicContact CG2-CG2 4.28Å; V573-I586 HydrophobicContact CB-CD1 4.32Å; V573-I586 HydrophobicContact CG1-CD1 3.51Å; V573-I586 HydrophobicContact CG2-CD1 3.77Å; V573-I586 HydrophobicContact CG2-CG2 4.03Å; K582-I586 PolarHBondContact O-N 3.33Å; L583-I586 PolarHBondContact O-N 3.12Å; L583-I586 VanDerWaalsContact O-N 3.14Å; M584-I586 PolarHBondContact O-N 3.25Å
587	I	93.6	Very high	90.5	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-63.4	-48.7	-179.9	-66.3	156.4	0	0	0	110.4	I498 L532 L583 M584 K589 K590 H591 F597	I498-I587 HydrophobicContact CD1-CG2 3.82Å; I498-I587 HydrophobicContact CG1-CG2 4.14Å; I498-I587 HydrophobicContact CG2-CD1 3.5Å; I498-I587 VanDerWaalsContact CG2-CD1 3.5Å; I498-I587 HydrophobicContact CG2-CG1 4.35Å; L532-I587 HydrophobicContact CD1-CG1 4.33Å; L532-I587 HydrophobicContact CD2-CD1 3.89Å; L532-I587 HydrophobicContact CD2-CG1 4.43Å; L583-I587 WeakPolarHBondContact O-CD1 3.29Å; L583-I587 WeakPolarHBondContact O-CG1 2.99Å; L583-I587 PolarHBondContact O-N 3.02Å; M584-I587 HydrophobicContact CE-CB 4.06Å; M584-I587 HydrophobicContact CE-CG2 3.85Å; M584-I587 PolarHBondContact O-N 3.14Å; M584-I587 HydrophobicContact SD-CB 4.39Å; M584-I587 HydrophobicContact SD-CD1 4.34Å; M584-I587 HydrophobicContact SD-CG2 4.48Å; I587-K589 VanDerWaalsContact C-N 3.27Å; I587-K589 PolarHBondContact O-N 3.28Å; I587-K590 PolarHBondContact O-N 3.48Å; I587-H591 PolarHBondContact O-N 3.06Å; I587-H591 PolarHBondContact O-ND1 2.99Å; I587-F597 HydrophobicContact CG2-CD1 4.46Å; I587-F597 HydrophobicContact CG2-CE1 3.78Å; I587-F597 HydrophobicContact CG2-CZ 3.88Å
588	S	94.3	Very high	91.6	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.021	22%	0.222	C	C	.	.	H	α-helix	trans	-53.5	-42.8	-178.8	-176.6	0	0	0	0	112.2	M584 K590 H591 N672 M676	M584-S588 WeakPolarHBondContact O-CB 3.37Å; M584-S588 PolarHBondContact O-N 2.93Å; S588-K590 VanDerWaalsContact C-N 3.29Å; S588-K590 PolarHBondContact O-N 2.89Å; S588-H591 PolarHBondContact O-N 2.91Å; S588-N672 PolarHBondContact O-ND2 3.17Å; S588-N672 VanDerWaalsContact O-ND2 3.13Å; S588-N672 PolarHBondContact OG-OD1 2.6Å; S588-M676 WeakPolarHBondContact OG-CG 3.43Å; S588-M676 PolarHBondContact OG-SD 3.01Å
589	K	93.1	Very high	92.5	Very high	167 Å²	167	41.6 Å²	41.6	73%	0.726	21%	0.211	S	C	*	.	H	α-helix	trans	-69.5	-21.7	178.5	-72.3	173.3	-174.1	173.2	0	114.1	D585 I587	D585-K589 WeakPolarHBondContact O-CD 3.33Å; D585-K589 VanDerWaalsContact O-CG 3.3Å; D585-K589 WeakPolarHBondContact O-CG 3.22Å; I587-K589 VanDerWaalsContact C-N 3.27Å; I587-K589 PolarHBondContact O-N 3.28Å
590	K	93.5	Very high	93	Very high	127 Å²	127	41.7 Å²	41.7	55%	0.552	21%	0.212	S	C	*	.	H	α-helix	trans	-95.2	-4.7	-177.5	-72	-170.1	176	-169.7	0	113.9	I571 I587 S588	I571-K590 HydrophobicContact CD1-CB 4.37Å; I571-K590 HydrophobicContact CD1-CD 3.66Å; I571-K590 HydrophobicContact CG1-CD 3.82Å; I571-K590 HydrophobicContact CG2-CD 4.19Å; I587-K590 PolarHBondContact O-N 3.48Å; S588-K590 VanDerWaalsContact C-N 3.29Å; S588-K590 PolarHBondContact O-N 2.89Å
591	H	94.3	Very high	93.3	Very high	34 Å²	34	40.9 Å²	40.9	16%	0.157	21%	0.21	C	C	.	.	S	Bend	trans	-122.6	153	-177	-67.7	83.1	0	0	0	110.8	I587 S588 T595 F597 N672	I587-H591 PolarHBondContact O-N 3.06Å; I587-H591 PolarHBondContact O-ND1 2.99Å; S588-H591 PolarHBondContact O-N 2.91Å; H591-T595 HydrophobicContact CB-CG2 4.48Å; H591-F597 HydrophobicContact CB-CE1 3.98Å; H591-F597 HydrophobicContact CB-CZ 3.64Å; H591-F597 AromaticContact CD2-CE1 3.97Å; H591-F597 AromaticContact CG-CE1 3.7Å; H591-F597 AromaticContact CG-CZ 3.82Å; H591-F597 AromaticContact ND1-CE1 3.95Å; H591-N672 PolarHBondContact O-ND2 3.48Å; H591-N672 VanDerWaalsContact O-ND2 3.09Å
592	P	95.3	Very high	93.4	Very high	76 Å²	76	41.3 Å²	41.3	49%	0.494	21%	0.213	S	C	.	.			trans	-70.3	161.4	176.8	31.4	-35.4	0	0	0	111.4	D594 T595 N672	P592-D594 VanDerWaalsContact C-N 3.28Å; P592-D594 VanDerWaalsContact CB-OD1 3.29Å; P592-D594 WeakPolarHBondContact CB-OD1 3.42Å; P592-D594 WeakPolarHBondContact CG-OD1 3.46Å; P592-D594 PolarHBondContact O-N 3.42Å; P592-T595 WeakPolarHBondContact CD-OG1 3.44Å; P592-T595 VanDerWaalsContact CG-OG1 3.27Å; P592-T595 WeakPolarHBondContact CG-OG1 3.38Å; P592-T595 WeakPolarHBondContact O-CB 3.35Å; P592-T595 PolarHBondContact O-N 3.07Å; P592-T595 PolarHBondContact O-OG1 3.46Å; P592-N672 WeakPolarHBondContact O-CB 3.39Å; P592-N672 PolarHBondContact O-ND2 2.9Å
593	V	93.1	Very high	93.6	Very high	94 Å²	94	40.3 Å²	40.3	57%	0.57	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-25	-172.4	-65.3	0	0	0	0	113.7	T595 A673	V593-T595 VanDerWaalsContact C-N 3.28Å; V593-T595 PolarHBondContact O-N 2.93Å; V593-A673 HydrophobicContact CB-CB 4.28Å; V593-A673 WeakPolarHBondContact O-CB 3.46Å; V593-A673 PolarHBondContact O-N 3.33Å
594	D	93.1	Very high	93.7	Very high	117 Å²	117	39.7 Å²	39.7	63%	0.626	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	2.6	179.5	63.5	-33.8	0	0	0	113.5	P592 L596 Y671	P592-D594 VanDerWaalsContact C-N 3.28Å; P592-D594 VanDerWaalsContact CB-OD1 3.29Å; P592-D594 WeakPolarHBondContact CB-OD1 3.42Å; P592-D594 WeakPolarHBondContact CG-OD1 3.46Å; P592-D594 PolarHBondContact O-N 3.42Å; D594-L596 PolarHBondContact O-N 3.14Å; D594-Y671 WeakPolarHBondContact O-CE1 3.29Å
595	T	96.3	Very high	93.6	Very high	17 Å²	17	40.6 Å²	40.6	10%	0.104	21%	0.208	C	C	.	.			trans	-69.1	126.3	179.1	-50.2	0	0	0	0	110.9	Q496 H591 P592 V593 F597 Y671 N672	Q496-T595 HydrophobicContact CB-CG2 3.5Å; Q496-T595 HydrophobicContact CG-CG2 4.03Å; H591-T595 HydrophobicContact CB-CG2 4.48Å; P592-T595 WeakPolarHBondContact CD-OG1 3.44Å; P592-T595 VanDerWaalsContact CG-OG1 3.27Å; P592-T595 WeakPolarHBondContact CG-OG1 3.38Å; P592-T595 WeakPolarHBondContact O-CB 3.35Å; P592-T595 PolarHBondContact O-N 3.07Å; P592-T595 PolarHBondContact O-OG1 3.46Å; V593-T595 VanDerWaalsContact C-N 3.28Å; V593-T595 PolarHBondContact O-N 2.93Å; T595-F597 HydrophobicContact CG2-CD1 3.89Å; T595-F597 HydrophobicContact CG2-CE1 3.64Å; T595-F597 HydrophobicContact CG2-CZ 4.13Å; T595-Y671 CarbonylContact O-C 3.6Å; T595-Y671 WeakPolarHBondContact O-CA 3.39Å; T595-N672 PolarHBondContact O-N 3.21Å
596	L	96.9	Very high	93.6	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	111.5	166	174	58.5	0	0	0	108.9	V495 Q496 D594 R615 A618 Y671	V495-L596 HydrophobicContact CG2-CD2 3.96Å; Q496-L596 PolarHBondContact N-O 2.99Å; D594-L596 PolarHBondContact O-N 3.14Å; L596-R615 HydrophobicContact CD2-CG 4.16Å; L596-A618 HydrophobicContact CD1-CB 3.53Å; L596-Y671 HydrophobicContact CB-CD1 4.31Å; L596-Y671 HydrophobicContact CB-CE1 3.98Å; L596-Y671 HydrophobicContact CD1-CD2 4.3Å; L596-Y671 HydrophobicContact CD1-CE2 4.22Å
597	F	97.4	Very high	93.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	144.1	176.5	-66.8	-58.6	0	0	0	111.5	Q496 I498 M584 I587 H591 T595 C669 F670 N672	Q496-F597 HydrophobicContact CB-CD1 4.06Å; Q496-F597 HydrophobicContact CB-CE1 4.48Å; Q496-F597 HydrophobicContact CG-CD1 4.14Å; Q496-F597 HydrophobicContact CG-CE1 4.23Å; Q496-F597 WeakPolarHBondContact O-CA 3.12Å; I498-F597 HydrophobicContact CD1-CD1 4.04Å; I498-F597 HydrophobicContact CD1-CE1 4.16Å; I498-F597 HydrophobicContact CG1-CD1 3.85Å; I498-F597 HydrophobicContact CG1-CE1 4.38Å; M584-F597 HydrophobicContact CE-CD2 3.47Å; M584-F597 VanDerWaalsContact CE-CD2 3.47Å; M584-F597 HydrophobicContact CE-CE1 4.49Å; M584-F597 HydrophobicContact CE-CE2 3.26Å; M584-F597 HydrophobicContact CE-CG 4.15Å; M584-F597 HydrophobicContact CE-CZ 3.82Å; I587-F597 HydrophobicContact CG2-CD1 4.46Å; I587-F597 HydrophobicContact CG2-CE1 3.78Å; I587-F597 HydrophobicContact CG2-CZ 3.88Å; H591-F597 HydrophobicContact CB-CE1 3.98Å; H591-F597 HydrophobicContact CB-CZ 3.64Å; H591-F597 AromaticContact CD2-CE1 3.97Å; H591-F597 AromaticContact CG-CE1 3.7Å; H591-F597 AromaticContact CG-CZ 3.82Å; H591-F597 AromaticContact ND1-CE1 3.95Å; T595-F597 HydrophobicContact CG2-CD1 3.89Å; T595-F597 HydrophobicContact CG2-CE1 3.64Å; T595-F597 HydrophobicContact CG2-CZ 4.13Å; F597-C669 VanDerWaalsContact O-CA 3.27Å; F597-C669 WeakPolarHBondContact O-CA 3.4Å; F597-F670 HydrophobicContact CB-CE2 4.43Å; F597-F670 HydrophobicContact CD2-CD2 4.32Å; F597-F670 AromaticContact CD2-CE2 3.86Å; F597-F670 HydrophobicContact CD2-CE2 3.86Å; F597-F670 HydrophobicContact CD2-CZ 4.5Å; F597-F670 PolarHBondContact N-O 3.38Å; F597-F670 PolarHBondContact O-N 3.37Å; F597-N672 HydrophobicContact CD2-CB 4.13Å; F597-N672 HydrophobicContact CE2-CB 3.43Å; F597-N672 VanDerWaalsContact CE2-CB 3.43Å; F597-N672 VanDerWaalsContact CE2-CG 3.48Å; F597-N672 HydrophobicContact CZ-CB 4.11Å
598	F	97.3	Very high	93.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	115.6	158.3	170.5	-131.8	0	0	0	108.6	V495 Q496 V497 I498 T604 V606 F610 E667 A668 L718	V495-F598 HydrophobicContact CG1-CB 3.67Å; Q496-F598 PolarHBondContact O-N 3.26Å; V497-F598 WeakPolarHBondContact CA-O 3.27Å; V497-F598 HydrophobicContact CB-CD1 4.43Å; V497-F598 HydrophobicContact CG1-CD1 3.91Å; V497-F598 HydrophobicContact CG1-CE1 4.35Å; V497-F598 HydrophobicContact CG2-CD1 4.02Å; I498-F598 PolarHBondContact N-O 2.87Å; F598-T604 HydrophobicContact CZ-CG2 4.35Å; F598-V606 HydrophobicContact CE1-CG2 4.11Å; F598-F610 AromaticContact CD1-CE1 3.92Å; F598-F610 HydrophobicContact CD1-CE1 3.92Å; F598-F610 AromaticContact CD2-CE1 3.64Å; F598-F610 HydrophobicContact CD2-CE1 3.64Å; F598-F610 AromaticContact CD2-CZ 3.87Å; F598-F610 HydrophobicContact CD2-CZ 3.87Å; F598-F610 HydrophobicContact CE1-CD1 4.16Å; F598-F610 AromaticContact CE1-CE1 3.56Å; F598-F610 HydrophobicContact CE1-CE1 3.56Å; F598-F610 HydrophobicContact CE1-CZ 4.5Å; F598-F610 HydrophobicContact CE2-CD1 4.45Å; F598-F610 AromaticContact CE2-CE1 3.25Å; F598-F610 HydrophobicContact CE2-CE1 3.25Å; F598-F610 AromaticContact CE2-CZ 3.39Å; F598-F610 HydrophobicContact CE2-CZ 3.39Å; F598-F610 AromaticContact CG-CE1 3.98Å; F598-F610 HydrophobicContact CG-CE1 3.98Å; F598-F610 HydrophobicContact CZ-CD1 4.08Å; F598-F610 AromaticContact CZ-CE1 3.22Å; F598-F610 HydrophobicContact CZ-CE1 3.22Å; F598-F610 AromaticContact CZ-CZ 3.77Å; F598-F610 HydrophobicContact CZ-CZ 3.77Å; F598-E667 HydrophobicContact CE2-CB 4.34Å; F598-A668 WeakPolarHBondContact CA-O 3.48Å; F598-L718 HydrophobicContact CZ-CD1 4.1Å
599	L	95.8	Very high	92.8	Very high	15 Å²	15	44.5 Å²	44.5	8%	0.079	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	121.2	172.3	-57.3	-176.5	0	0	0	108.9	I498 M584 D666 E667 A668 F670	I498-L599 HydrophobicContact CB-CD2 3.9Å; I498-L599 HydrophobicContact CG1-CD2 4.2Å; I498-L599 HydrophobicContact CG2-CD2 4.17Å; M584-L599 HydrophobicContact SD-CD2 4.03Å; L599-D666 WeakPolarHBondContact CB-O 3.45Å; L599-E667 WeakPolarHBondContact O-CA 3.36Å; L599-A668 HydrophobicContact CD1-CB 4.32Å; L599-A668 PolarHBondContact N-O 3.4Å; L599-F670 HydrophobicContact CD1-CE1 3.9Å; L599-F670 HydrophobicContact CD1-CZ 4.2Å; L599-F670 HydrophobicContact CG-CE1 4.13Å; L599-F670 HydrophobicContact CG-CZ 4.45Å
600	S	93.8	Very high	92.8	Very high	7 Å²	7	36.5 Å²	36.5	5%	0.049	20%	0.199	C	C	.	.			trans	-123.7	166.8	-177.7	-171.1	0	0	0	0	111.1	I498 P500 T604	I498-S600 PolarHBondContact O-N 3.14Å; P500-S600 WeakPolarHBondContact CD-O 3.44Å; S600-T604 WeakPolarHBondContact OG-CB 3.46Å
601	S	91.6	Very high	92.7	Very high	21 Å²	21	30.5 Å²	30.5	15%	0.147	17%	0.173	C	C	.	.			trans	-113.1	167.4	166.8	83.1	0	0	0	0	111.3	L499 W603 T604 Q720	L499-S601 WeakPolarHBondContact CD1-O 3.34Å; S601-W603 PolarHBondContact O-N 2.98Å; S601-W603 PolarHBondContact OG-N 3.29Å; S601-T604 PolarHBondContact N-OG1 3.14Å; S601-T604 WeakPolarHBondContact O-CB 3.42Å; S601-T604 PolarHBondContact O-N 3.07Å; S601-T604 PolarHBondContact OG-N 3.2Å; S601-T604 PolarHBondContact OG-OG1 3.01Å; S601-Q720 PolarHBondContact OG-NE2 2.66Å
602	V	92	Very high	92.6	Very high	10 Å²	10	30.8 Å²	30.8	6%	0.061	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-18.6	175.4	-174.8	0	0	0	0	111.9	L499 V501 D505 V509 F512	L499-V602 HydrophobicContact CD1-CG2 4.05Å; L499-V602 HydrophobicContact CD2-CG2 4.43Å; L499-V602 HydrophobicContact CG-CG2 4.3Å; V501-V602 HydrophobicContact CG2-CG2 4.1Å; D505-V602 HydrophobicContact CB-CG2 4Å; V509-V602 HydrophobicContact CG2-CG1 4.2Å; V509-V602 HydrophobicContact CG2-CG2 4.45Å; F512-V602 HydrophobicContact CB-CG1 4.15Å
603	W	91.3	Very high	92.3	Very high	42 Å²	42	33.9 Å²	33.9	16%	0.159	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-10	-177.4	-46	99	0	0	0	113.2	Y508 S601 Q720 K721 V723	Y508-W603 HydrophobicContact CD1-CE3 4.35Å; Y508-W603 AromaticContact CD1-CH2 3.39Å; Y508-W603 HydrophobicContact CD1-CH2 3.39Å; Y508-W603 HydrophobicContact CD1-CZ2 4.45Å; Y508-W603 AromaticContact CD1-CZ3 3.29Å; Y508-W603 HydrophobicContact CD1-CZ3 3.29Å; Y508-W603 AromaticContact CD2-CH2 3.28Å; Y508-W603 HydrophobicContact CD2-CH2 3.28Å; Y508-W603 AromaticContact CD2-CZ2 3.71Å; Y508-W603 HydrophobicContact CD2-CZ2 3.71Å; Y508-W603 HydrophobicContact CD2-CZ3 4.06Å; Y508-W603 AromaticContact CE1-CH2 3.45Å; Y508-W603 HydrophobicContact CE1-CH2 3.45Å; Y508-W603 VanDerWaalsContact CE1-CH2 3.45Å; Y508-W603 AromaticContact CE1-CZ3 3.54Å; Y508-W603 HydrophobicContact CE1-CZ3 3.54Å; Y508-W603 AromaticContact CE2-CH2 3.36Å; Y508-W603 HydrophobicContact CE2-CH2 3.36Å; Y508-W603 AromaticContact CE2-CZ2 3.99Å; Y508-W603 HydrophobicContact CE2-CZ2 3.99Å; Y508-W603 HydrophobicContact CE2-CZ3 4.28Å; Y508-W603 HydrophobicContact CG-CE3 4.47Å; Y508-W603 AromaticContact CG-CH2 3.29Å; Y508-W603 HydrophobicContact CG-CH2 3.29Å; Y508-W603 AromaticContact CG-CZ2 3.96Å; Y508-W603 HydrophobicContact CG-CZ2 3.96Å; Y508-W603 AromaticContact CG-CZ3 3.56Å; Y508-W603 HydrophobicContact CG-CZ3 3.56Å; Y508-W603 AromaticContact CZ-CH2 3.43Å; Y508-W603 VanDerWaalsContact CZ-CH2 3.43Å; S601-W603 PolarHBondContact O-N 2.98Å; S601-W603 PolarHBondContact OG-N 3.29Å; W603-Q720 HydrophobicContact CB-CG 3.57Å; W603-Q720 WeakPolarHBondContact O-CA 3.27Å; W603-K721 PolarHBondContact O-N 2.78Å; W603-V723 HydrophobicContact CD2-CB 3.85Å; W603-V723 HydrophobicContact CD2-CG1 4.48Å; W603-V723 HydrophobicContact CD2-CG2 3.95Å; W603-V723 VanDerWaalsContact CE2-CG2 3.48Å; W603-V723 HydrophobicContact CE3-CB 4.3Å; W603-V723 HydrophobicContact CG-CB 3.98Å; W603-V723 HydrophobicContact CG-CG1 4.09Å; W603-V723 HydrophobicContact CG-CG2 4.27Å; W603-V723 HydrophobicContact CH2-CG2 4.29Å; W603-V723 HydrophobicContact CZ2-CB 4.41Å; W603-V723 HydrophobicContact CZ2-CG2 3.7Å
604	T	91.8	Very high	92.3	Very high	4 Å²	4	29.4 Å²	29.4	3%	0.025	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	128	-174.6	-51.8	0	0	0	0	109.9	F598 S600 S601 V606 L718	F598-T604 HydrophobicContact CZ-CG2 4.35Å; S600-T604 WeakPolarHBondContact OG-CB 3.46Å; S601-T604 PolarHBondContact N-OG1 3.14Å; S601-T604 WeakPolarHBondContact O-CB 3.42Å; S601-T604 PolarHBondContact O-N 3.07Å; S601-T604 PolarHBondContact OG-N 3.2Å; S601-T604 PolarHBondContact OG-OG1 3.01Å; T604-V606 PolarHBondContact O-N 2.76Å; T604-L718 HydrophobicContact CG2-CD1 3.37Å; T604-L718 HydrophobicContact CG2-CG 4.29Å
605	E	90.5	Very high	92.3	Very high	22 Å²	22	24 Å²	24	10%	0.103	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	109.9	174.1	-65.9	-175	177.9	0	0	109.6	R656 I719 K721	E605-R656 IonicContact OE1-NH1 3.76Å; E605-R656 PolarHBondContact OE1-NH1 2.76Å; E605-R656 IonicContact OE1-NH2 2.92Å; E605-R656 IonicContact OE2-CZ 3.85Å; E605-R656 IonicContact OE2-NH1 2.8Å; E605-R656 PolarHBondContact OE2-NH1 3.17Å; E605-R656 IonicContact OE2-NH2 3.88Å; E605-R656 PolarHBondContact OE2-NH2 3.4Å; E605-I719 PolarHBondContact N-O 3.08Å; E605-K721 WeakPolarHBondContact OE1-CE 3.03Å
606	V	88.9	Confident	91.9	Very high	4 Å²	4	26.4 Å²	26.4	2%	0.024	13%	0.132	C	C	.	.			trans	-86.2	121.5	176.6	-172	0	0	0	0	109.3	F512 N519 T520 F598 T604 L611	F512-V606 HydrophobicContact CE2-CG2 4.02Å; F512-V606 HydrophobicContact CZ-CG2 4.16Å; N519-V606 VanDerWaalsContact CB-O 3.31Å; N519-V606 WeakPolarHBondContact CB-O 3.43Å; N519-V606 PolarHBondContact ND2-O 3.19Å; T520-V606 HydrophobicContact CG2-CG1 4.27Å; F598-V606 HydrophobicContact CE1-CG2 4.11Å; T604-V606 PolarHBondContact O-N 2.76Å; V606-L611 HydrophobicContact CG1-CD1 3.85Å; V606-L611 HydrophobicContact CG1-CD2 3.97Å; V606-L611 HydrophobicContact CG1-CG 3.93Å
607	N	87.9	Confident	91.7	Very high	34 Å²	34	27.9 Å²	27.9	18%	0.182	14%	0.14	C	C	.	.			trans	-131.4	163.4	177.4	64	21.9	0	0	0	111.8	D609 F610 L611 A717	N607-D609 VanDerWaalsContact C-N 3.31Å; N607-D609 PolarHBondContact O-N 2.98Å; N607-F610 PolarHBondContact O-N 3.14Å; N607-F610 WeakPolarHBondContact OD1-CA 3.45Å; N607-F610 WeakPolarHBondContact OD1-CB 3.3Å; N607-F610 PolarHBondContact OD1-N 3.09Å; N607-L611 WeakPolarHBondContact O-CD1 3.3Å; N607-L611 VanDerWaalsContact O-CG 3.23Å; N607-L611 WeakPolarHBondContact O-CG 3.3Å; N607-L611 PolarHBondContact O-N 2.86Å; N607-A717 PolarHBondContact ND2-O 3.21Å
608	A	87.6	Confident	91.5	Very high	29 Å²	29	27.9 Å²	27.9	24%	0.24	14%	0.14	C	C	.	.	H	α-helix	trans	-60.8	-39.1	-178.8	0	0	0	0	0	112.5	D525 L611 N612	D525-A608 VanDerWaalsContact OD2-CB 3.31Å; D525-A608 WeakPolarHBondContact OD2-CB 3.31Å; A608-L611 PolarHBondContact O-N 2.94Å; A608-N612 WeakPolarHBondContact O-CB 3.28Å; A608-N612 VanDerWaalsContact O-CG 3.3Å; A608-N612 PolarHBondContact O-N 2.9Å; A608-N612 PolarHBondContact O-ND2 2.95Å
609	D	88.1	Confident	91.3	Very high	112 Å²	112	28.2 Å²	28.2	60%	0.599	14%	0.142	S	C	*	.	H	α-helix	trans	-60.8	-49.6	-179.6	-70.4	-24	0	0	0	111.6	N607 N612 R613 A717	N607-D609 VanDerWaalsContact C-N 3.31Å; N607-D609 PolarHBondContact O-N 2.98Å; D609-N612 PolarHBondContact O-N 3.23Å; D609-R613 WeakPolarHBondContact O-CG 3.38Å; D609-R613 PolarHBondContact O-N 3.1Å; D609-A717 HydrophobicContact CB-CB 3.98Å
610	F	91.5	Very high	91.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.6	-44	176	174.1	-101.2	0	0	0	111.9	F598 N607 N612 R613 C614 F625 P627 E715 A717 L718	F598-F610 AromaticContact CD1-CE1 3.92Å; F598-F610 HydrophobicContact CD1-CE1 3.92Å; F598-F610 AromaticContact CD2-CE1 3.64Å; F598-F610 HydrophobicContact CD2-CE1 3.64Å; F598-F610 AromaticContact CD2-CZ 3.87Å; F598-F610 HydrophobicContact CD2-CZ 3.87Å; F598-F610 HydrophobicContact CE1-CD1 4.16Å; F598-F610 AromaticContact CE1-CE1 3.56Å; F598-F610 HydrophobicContact CE1-CE1 3.56Å; F598-F610 HydrophobicContact CE1-CZ 4.5Å; F598-F610 HydrophobicContact CE2-CD1 4.45Å; F598-F610 AromaticContact CE2-CE1 3.25Å; F598-F610 HydrophobicContact CE2-CE1 3.25Å; F598-F610 AromaticContact CE2-CZ 3.39Å; F598-F610 HydrophobicContact CE2-CZ 3.39Å; F598-F610 AromaticContact CG-CE1 3.98Å; F598-F610 HydrophobicContact CG-CE1 3.98Å; F598-F610 HydrophobicContact CZ-CD1 4.08Å; F598-F610 AromaticContact CZ-CE1 3.22Å; F598-F610 HydrophobicContact CZ-CE1 3.22Å; F598-F610 AromaticContact CZ-CZ 3.77Å; F598-F610 HydrophobicContact CZ-CZ 3.77Å; N607-F610 PolarHBondContact O-N 3.14Å; N607-F610 WeakPolarHBondContact OD1-CA 3.45Å; N607-F610 WeakPolarHBondContact OD1-CB 3.3Å; N607-F610 PolarHBondContact OD1-N 3.09Å; F610-N612 VanDerWaalsContact C-N 3.26Å; F610-N612 PolarHBondContact O-N 3.33Å; F610-R613 CarbonylContact O-C 3.59Å; F610-R613 WeakPolarHBondContact O-CA 3.3Å; F610-R613 WeakPolarHBondContact O-CB 3.46Å; F610-R613 PolarHBondContact O-N 2.93Å; F610-C614 HydrophobicContact CE1-CB 4.43Å; F610-C614 PolarHBondContact O-N 3.44Å; F610-F625 HydrophobicContact CE2-CE1 4.31Å; F610-P627 HydrophobicContact CE2-CB 3.83Å; F610-P627 HydrophobicContact CE2-CG 3.8Å; F610-P627 HydrophobicContact CZ-CB 4.42Å; F610-P627 HydrophobicContact CZ-CG 3.88Å; F610-E715 HydrophobicContact CD2-CG 3.51Å; F610-E715 HydrophobicContact CE2-CG 3.88Å; F610-A717 HydrophobicContact CB-CB 4.17Å; F610-L718 HydrophobicContact CD1-CD1 3.98Å; F610-L718 HydrophobicContact CD2-CB 3.69Å; F610-L718 HydrophobicContact CD2-CD1 3.89Å; F610-L718 HydrophobicContact CD2-CD2 4.37Å; F610-L718 HydrophobicContact CD2-CG 4.2Å; F610-L718 HydrophobicContact CE1-CD1 3.98Å; F610-L718 HydrophobicContact CE2-CB 3.96Å; F610-L718 HydrophobicContact CE2-CD1 3.86Å; F610-L718 HydrophobicContact CE2-CD2 3.77Å; F610-L718 HydrophobicContact CE2-CG 4.09Å; F610-L718 HydrophobicContact CG-CB 4.32Å; F610-L718 HydrophobicContact CG-CD1 3.94Å; F610-L718 HydrophobicContact CZ-CD1 3.91Å; F610-L718 HydrophobicContact CZ-CD2 4.1Å
611	L	92.4	Very high	91.1	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.4	-38.7	178.7	-71.1	165.6	0	0	0	111.4	V495 V497 T520 V527 V606 N607 A608 C614 R615	V495-L611 HydrophobicContact CB-CD2 4.19Å; V495-L611 HydrophobicContact CG1-CD2 3.93Å; V495-L611 HydrophobicContact CG2-CD2 4.42Å; V497-L611 HydrophobicContact CG2-CD2 4.41Å; T520-L611 HydrophobicContact CG2-CD1 3.96Å; V527-L611 HydrophobicContact CG2-CD1 3.57Å; V527-L611 HydrophobicContact CG2-CD2 4.25Å; V527-L611 HydrophobicContact CG2-CG 4.45Å; V606-L611 HydrophobicContact CG1-CD1 3.85Å; V606-L611 HydrophobicContact CG1-CD2 3.97Å; V606-L611 HydrophobicContact CG1-CG 3.93Å; N607-L611 WeakPolarHBondContact O-CD1 3.3Å; N607-L611 VanDerWaalsContact O-CG 3.23Å; N607-L611 WeakPolarHBondContact O-CG 3.3Å; N607-L611 PolarHBondContact O-N 2.86Å; A608-L611 PolarHBondContact O-N 2.94Å; L611-C614 WeakPolarHBondContact O-CB 3.06Å; L611-C614 PolarHBondContact O-N 3.29Å; L611-R615 VanDerWaalsContact O-CG 3.28Å; L611-R615 WeakPolarHBondContact O-CG 3.28Å; L611-R615 PolarHBondContact O-N 3.32Å
612	N	91	Very high	91.1	Very high	41 Å²	41	39.6 Å²	39.6	22%	0.219	20%	0.196	C	C	.	.	H	α-helix	trans	-65.2	-40.5	173.1	-72	-26.1	0	0	0	112	A608 D609 F610 C614 R615 M616	A608-N612 WeakPolarHBondContact O-CB 3.28Å; A608-N612 VanDerWaalsContact O-CG 3.3Å; A608-N612 PolarHBondContact O-N 2.9Å; A608-N612 PolarHBondContact O-ND2 2.95Å; D609-N612 PolarHBondContact O-N 3.23Å; F610-N612 VanDerWaalsContact C-N 3.26Å; F610-N612 PolarHBondContact O-N 3.33Å; N612-C614 VanDerWaalsContact C-N 3.33Å; N612-C614 PolarHBondContact O-N 3.34Å; N612-R615 PolarHBondContact O-N 2.95Å; N612-R615 PolarHBondContact OD1-NH1 3.05Å; N612-M616 VanDerWaalsContact O-CG 3.25Å; N612-M616 WeakPolarHBondContact O-CG 3.37Å; N612-M616 PolarHBondContact O-N 3.33Å
613	R	90.7	Very high	91.2	Very high	141 Å²	141	39.5 Å²	39.5	53%	0.532	19%	0.194	S	C	.	.	H	α-helix	trans	-61.3	-41.3	173	-66.7	-68.8	-173.9	-158.3	-0.1	112.3	D609 F610 R615 M616 N617 E715	D609-R613 WeakPolarHBondContact O-CG 3.38Å; D609-R613 PolarHBondContact O-N 3.1Å; F610-R613 CarbonylContact O-C 3.59Å; F610-R613 WeakPolarHBondContact O-CA 3.3Å; F610-R613 WeakPolarHBondContact O-CB 3.46Å; F610-R613 PolarHBondContact O-N 2.93Å; R613-R615 PolarHBondContact O-N 3.44Å; R613-M616 PolarHBondContact O-N 3.24Å; R613-N617 VanDerWaalsContact O-CB 3.27Å; R613-N617 WeakPolarHBondContact O-CB 3.09Å; R613-N617 PolarHBondContact O-N 3.22Å; R613-N617 PolarHBondContact O-ND2 3.48Å; R613-E715 WeakPolarHBondContact CG-OE2 3.47Å
614	C	93.3	Very high	91.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-57.6	-47.7	173.7	-174.8	0	0	0	0	111.5	F610 L611 N612 M616 A618 C669	F610-C614 HydrophobicContact CE1-CB 4.43Å; F610-C614 PolarHBondContact O-N 3.44Å; L611-C614 WeakPolarHBondContact O-CB 3.06Å; L611-C614 PolarHBondContact O-N 3.29Å; N612-C614 VanDerWaalsContact C-N 3.33Å; N612-C614 PolarHBondContact O-N 3.34Å; C614-M616 PolarHBondContact O-N 3.01Å; C614-A618 VanDerWaalsContact O-CB 3.29Å; C614-A618 WeakPolarHBondContact O-CB 3.45Å; C614-A618 PolarHBondContact O-N 3.19Å; C614-C669 HydrophobicContact CB-CB 4.07Å; C614-C669 WeakPolarHBondContact CB-SG 3.33Å; C614-C669 WeakPolarHBondContact SG-CB 3.38Å; C614-C669 CovalentContact SG-SG 2.03Å; C614-C669 PolarHBondContact SG-SG 3.16Å
615	R	92.4	Very high	91.7	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.015	19%	0.186	C	C	.	.	H	α-helix	trans	-63.2	-39.2	177.8	-65.7	172.7	-178	113.5	3.7	113.4	E491 T493 V495 N526 L596 L611 N612 R613	E491-R615 WeakPolarHBondContact O-CD 3.24Å; E491-R615 PolarHBondContact O-NE 3.28Å; T493-R615 WeakPolarHBondContact O-CD 3.16Å; T493-R615 PolarHBondContact O-NE 2.86Å; T493-R615 WeakPolarHBondContact OG1-CG 3.25Å; V495-R615 HydrophobicContact CG2-CG 3.62Å; N526-R615 PolarHBondContact O-NH2 3.28Å; L596-R615 HydrophobicContact CD2-CG 4.16Å; L611-R615 VanDerWaalsContact O-CG 3.28Å; L611-R615 WeakPolarHBondContact O-CG 3.28Å; L611-R615 PolarHBondContact O-N 3.32Å; N612-R615 PolarHBondContact O-N 2.95Å; N612-R615 PolarHBondContact OD1-NH1 3.05Å; R613-R615 PolarHBondContact O-N 3.44Å
616	M	88.3	Confident	92	Very high	67 Å²	67	36.4 Å²	36.4	33%	0.33	18%	0.181	S	C	.	.	H	α-helix	trans	-80.9	-28.9	-175.8	-65.2	-60.3	-76.1	0	0	112.9	V489 E491 N612 R613 C614	V489-M616 HydrophobicContact CB-SD 4.08Å; V489-M616 HydrophobicContact CG2-CE 3.98Å; V489-M616 HydrophobicContact CG2-SD 4.07Å; E491-M616 HydrophobicContact CG-SD 4.26Å; N612-M616 VanDerWaalsContact O-CG 3.25Å; N612-M616 WeakPolarHBondContact O-CG 3.37Å; N612-M616 PolarHBondContact O-N 3.33Å; R613-M616 PolarHBondContact O-N 3.24Å; C614-M616 PolarHBondContact O-N 3.01Å
617	N	91.6	Very high	92.3	Very high	33 Å²	33	36.4 Å²	36.4	18%	0.176	18%	0.182	C	C	.	.	H	α-helix	trans	-99.2	-17.7	-175.6	-66.9	-32.2	0	0	0	113.9	R613 Q623 F625 F711	R613-N617 VanDerWaalsContact O-CB 3.27Å; R613-N617 WeakPolarHBondContact O-CB 3.09Å; R613-N617 PolarHBondContact O-N 3.22Å; R613-N617 PolarHBondContact O-ND2 3.48Å; N617-Q623 WeakPolarHBondContact O-CG 3.36Å; N617-Q623 PolarHBondContact O-NE2 3.2Å; N617-F625 HydrophobicContact CB-CB 3.81Å; N617-F625 HydrophobicContact CB-CD1 3.85Å; N617-F625 HydrophobicContact CB-CD2 3.79Å; N617-F625 HydrophobicContact CB-CE1 4.34Å; N617-F625 HydrophobicContact CB-CE2 4.29Å; N617-F625 HydrophobicContact CB-CG 3.54Å; N617-F711 HydrophobicContact CB-CD1 4.2Å; N617-F711 HydrophobicContact CB-CE1 4.44Å
618	A	94.1	Very high	92.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.175	C	C	.	.			trans	-92.7	113.9	169.9	0	0	0	0	0	109.5	L596 C614 C669 Y671	L596-A618 HydrophobicContact CD1-CB 3.53Å; C614-A618 VanDerWaalsContact O-CB 3.29Å; C614-A618 WeakPolarHBondContact O-CB 3.45Å; C614-A618 PolarHBondContact O-N 3.19Å; A618-C669 HydrophobicContact CB-CB 4.17Å; A618-Y671 WeakPolarHBondContact O-CE2 3.28Å
619	I	92.8	Very high	92.9	Very high	7 Å²	7	33.9 Å²	33.9	4%	0.036	16%	0.164	C	C	.	.	B	Isolated β-bridge	trans	-123.9	115.6	-174.9	-51.4	-179.8	0	0	0	108.6	M486 P487 V489 N621 W622 Q623	M486-I619 HydrophobicContact CB-CD1 4.41Å; P487-I619 HydrophobicContact CB-CG2 3.8Å; P487-I619 HydrophobicContact CG-CG2 3.9Å; V489-I619 HydrophobicContact CG1-CG1 3.9Å; I619-N621 PolarHBondContact O-N 3.45Å; I619-W622 HydrophobicContact CB-CB 4.06Å; I619-W622 HydrophobicContact CG2-CB 3.78Å; I619-W622 HydrophobicContact CG2-CG 4.36Å; I619-W622 PolarHBondContact O-N 3.14Å; I619-Q623 HydrophobicContact CB-CB 4.22Å; I619-Q623 HydrophobicContact CG1-CB 4.4Å; I619-Q623 PolarHBondContact N-O 3Å; I619-Q623 PolarHBondContact O-N 3.45Å; I619-Q623 VanDerWaalsContact O-O 3.11Å
620	S	92.8	Very high	93.1	Very high	49 Å²	49	30.2 Å²	30.2	34%	0.343	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	133.6	-177.1	-174.7	0	0	0	0	112.1	W622 D674	S620-W622 PolarHBondContact O-N 3.17Å; S620-W622 VanDerWaalsContact O-N 3.12Å; S620-D674 WeakPolarHBondContact CA-OD2 3.36Å
621	N	92.8	Very high	93.2	Very high	116 Å²	116	30.3 Å²	30.3	62%	0.62	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	12.7	-177.2	-58.8	-60.5	0	0	0	115.4	I619 D674 L708	I619-N621 PolarHBondContact O-N 3.45Å; N621-D674 VanDerWaalsContact CA-OD1 3.28Å; N621-D674 WeakPolarHBondContact CA-OD1 3.14Å; N621-D674 PolarHBondContact N-OD1 3.02Å; N621-D674 PolarHBondContact N-OD2 2.91Å; N621-D674 PolarHBondContact OD1-OD1 3.2Å; N621-L708 WeakPolarHBondContact O-CD2 3.34Å
622	W	92.1	Very high	93.1	Very high	117 Å²	117	32.4 Å²	32.4	44%	0.443	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-131.2	-52.9	-179.1	-177.3	-93.5	0	0	0	113.3	P487 I619 S620 H709	P487-W622 HydrophobicContact CG-CB 4.26Å; P487-W622 HydrophobicContact CG-CD2 4.14Å; P487-W622 HydrophobicContact CG-CE3 4.48Å; P487-W622 HydrophobicContact CG-CG 4.01Å; I619-W622 HydrophobicContact CB-CB 4.06Å; I619-W622 HydrophobicContact CG2-CB 3.78Å; I619-W622 HydrophobicContact CG2-CG 4.36Å; I619-W622 PolarHBondContact O-N 3.14Å; S620-W622 PolarHBondContact O-N 3.17Å; S620-W622 VanDerWaalsContact O-N 3.12Å; W622-H709 PolarHBondContact O-N 3.39Å
623	Q	94.1	Very high	93.2	Very high	8 Å²	8	31.3 Å²	31.3	4%	0.037	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	137.7	-170.6	-179.7	173.8	-70.3	0	0	112.7	N617 I619 H709 F711	N617-Q623 WeakPolarHBondContact O-CG 3.36Å; N617-Q623 PolarHBondContact O-NE2 3.2Å; I619-Q623 HydrophobicContact CB-CB 4.22Å; I619-Q623 HydrophobicContact CG1-CB 4.4Å; I619-Q623 PolarHBondContact N-O 3Å; I619-Q623 PolarHBondContact O-N 3.45Å; I619-Q623 VanDerWaalsContact O-O 3.11Å; Q623-H709 VanDerWaalsContact CA-O 3.25Å; Q623-H709 WeakPolarHBondContact CA-O 3.26Å; Q623-H709 HydrophobicContact CB-CB 4.27Å; Q623-H709 HydrophobicContact CG-CB 4.33Å; Q623-H709 WeakPolarHBondContact CG-O 3.2Å; Q623-H709 PolarHBondContact OE1-ND1 3.38Å; Q623-F711 HydrophobicContact CG-CB 3.86Å
624	V	96.7	Very high	93.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	145.8	169.1	-63.1	0	0	0	0	109.8	F626 F670 F702 L708 H709 V710 F711	V624-F626 HydrophobicContact CB-CE2 4.26Å; V624-F626 HydrophobicContact CG2-CD2 4.24Å; V624-F626 HydrophobicContact CG2-CE2 3.78Å; V624-F670 HydrophobicContact CB-CB 4.18Å; V624-F670 HydrophobicContact CG1-CB 3.8Å; V624-F702 HydrophobicContact CG1-CD1 3.83Å; V624-F702 HydrophobicContact CG1-CE1 3.68Å; V624-F702 HydrophobicContact CG1-CE2 4.4Å; V624-F702 HydrophobicContact CG1-CG 4.3Å; V624-F702 HydrophobicContact CG1-CZ 3.97Å; V624-F702 HydrophobicContact CG2-CB 4.14Å; V624-F702 HydrophobicContact CG2-CD1 4.23Å; V624-F702 HydrophobicContact CG2-CD2 4.4Å; V624-F702 HydrophobicContact CG2-CG 4.01Å; V624-L708 HydrophobicContact CG1-CD1 4.03Å; V624-H709 PolarHBondContact N-O 2.79Å; V624-V710 HydrophobicContact CG2-CB 4.17Å; V624-V710 HydrophobicContact CG2-CG1 4.13Å; V624-V710 HydrophobicContact CG2-CG2 3.89Å; V624-F711 PolarHBondContact O-N 2.99Å
625	F	96.3	Very high	92.8	Very high	1 Å²	1	29 Å²	29	0%	0.004	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	122.2	-173.8	177.5	-129.5	0	0	0	111.7	F610 N617 P627 C669 F711 A713	F610-F625 HydrophobicContact CE2-CE1 4.31Å; N617-F625 HydrophobicContact CB-CB 3.81Å; N617-F625 HydrophobicContact CB-CD1 3.85Å; N617-F625 HydrophobicContact CB-CD2 3.79Å; N617-F625 HydrophobicContact CB-CE1 4.34Å; N617-F625 HydrophobicContact CB-CE2 4.29Å; N617-F625 HydrophobicContact CB-CG 3.54Å; F625-P627 HydrophobicContact CE1-CB 3.88Å; F625-P627 HydrophobicContact CE1-CG 4.25Å; F625-P627 HydrophobicContact CE2-CB 4.42Å; F625-P627 HydrophobicContact CZ-CB 3.76Å; F625-P627 WeakPolarHBondContact O-CD 3.28Å; F625-C669 HydrophobicContact CB-CB 4.06Å; F625-C669 HydrophobicContact CD1-CB 3.96Å; F625-C669 HydrophobicContact CG-CB 4.49Å; F625-C669 PolarHBondContact N-O 2.85Å; F625-C669 PolarHBondContact O-N 3.36Å; F625-F711 CarbonylContact C-O 3.59Å; F625-F711 WeakPolarHBondContact CA-O 3.15Å; F625-F711 AromaticContact CD2-CD1 3.48Å; F625-F711 HydrophobicContact CD2-CD1 3.48Å; F625-F711 VanDerWaalsContact CD2-CD1 3.48Å; F625-F711 AromaticContact CD2-CE1 3.94Å; F625-F711 HydrophobicContact CD2-CE1 3.94Å; F625-F711 HydrophobicContact CD2-CG 4.35Å; F625-F711 AromaticContact CE2-CD1 3.87Å; F625-F711 HydrophobicContact CE2-CD1 3.87Å; F625-F711 AromaticContact CE2-CE1 3.84Å; F625-F711 HydrophobicContact CE2-CE1 3.84Å; F625-A713 HydrophobicContact CE2-CB 4.47Å
626	F	96.9	Very high	92.4	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.009	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	92.7	176.2	-75.5	-92	0	0	0	109.2	V624 A668 V698 Y699 F702 V710 F711 R712 A713	V624-F626 HydrophobicContact CB-CE2 4.26Å; V624-F626 HydrophobicContact CG2-CD2 4.24Å; V624-F626 HydrophobicContact CG2-CE2 3.78Å; F626-A668 HydrophobicContact CD1-CB 3.69Å; F626-A668 HydrophobicContact CE1-CB 3.46Å; F626-A668 VanDerWaalsContact CE1-CB 3.46Å; F626-A668 HydrophobicContact CG-CB 4.47Å; F626-A668 HydrophobicContact CZ-CB 4.06Å; F626-V698 HydrophobicContact CZ-CG1 4.39Å; F626-Y699 HydrophobicContact CB-CD2 4.49Å; F626-Y699 AromaticContact CD1-CD2 3.96Å; F626-Y699 HydrophobicContact CD1-CD2 3.96Å; F626-Y699 AromaticContact CD2-CD2 3.95Å; F626-Y699 HydrophobicContact CD2-CD2 3.95Å; F626-Y699 HydrophobicContact CE1-CD2 4.13Å; F626-Y699 HydrophobicContact CE1-CG 4.42Å; F626-Y699 HydrophobicContact CE2-CD2 4.13Å; F626-Y699 AromaticContact CG-CD2 3.86Å; F626-Y699 HydrophobicContact CG-CD2 3.86Å; F626-Y699 HydrophobicContact CZ-CD2 4.22Å; F626-F702 HydrophobicContact CE2-CD2 4.02Å; F626-F702 AromaticContact CZ-CD2 3.83Å; F626-F702 HydrophobicContact CZ-CD2 3.83Å; F626-F702 HydrophobicContact CZ-CE2 4.4Å; F626-V710 HydrophobicContact CD2-CG1 3.81Å; F626-V710 HydrophobicContact CE2-CG1 4.05Å; F626-F711 PolarHBondContact N-O 3.22Å; F626-R712 HydrophobicContact CB-CB 4.23Å; F626-R712 HydrophobicContact CB-CG 4.07Å; F626-R712 VanDerWaalsContact O-CA 3.27Å; F626-R712 WeakPolarHBondContact O-CA 3.05Å; F626-R712 WeakPolarHBondContact O-CG 3.22Å; F626-A713 PolarHBondContact O-N 3.4Å
627	P	95.3	Very high	92.1	Very high	4 Å²	4	29.7 Å²	29.7	3%	0.026	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	145.2	179.1	30.1	-35.9	0	0	0	111.4	F610 F625 E667 A713 E715 L718	F610-P627 HydrophobicContact CE2-CB 3.83Å; F610-P627 HydrophobicContact CE2-CG 3.8Å; F610-P627 HydrophobicContact CZ-CB 4.42Å; F610-P627 HydrophobicContact CZ-CG 3.88Å; F625-P627 HydrophobicContact CE1-CB 3.88Å; F625-P627 HydrophobicContact CE1-CG 4.25Å; F625-P627 HydrophobicContact CE2-CB 4.42Å; F625-P627 HydrophobicContact CZ-CB 3.76Å; F625-P627 WeakPolarHBondContact O-CD 3.28Å; P627-E667 HydrophobicContact CG-CB 4.14Å; P627-A713 CarbonylContact C-O 3.55Å; P627-A713 WeakPolarHBondContact CA-O 3.39Å; P627-E715 HydrophobicContact CB-CB 3.89Å; P627-E715 HydrophobicContact CB-CG 4.43Å; P627-L718 HydrophobicContact CB-CD2 3.66Å; P627-L718 HydrophobicContact CG-CD2 3.61Å
628	V	94.4	Very high	91.6	Very high	8 Å²	8	29.7 Å²	29.7	5%	0.048	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	109.8	168.6	175.7	0	0	0	0	107.2	F660 D661 R662 R712 A713 V714 E715	V628-F660 HydrophobicContact CG1-CB 4.06Å; V628-D661 WeakPolarHBondContact CG1-O 3.45Å; V628-R662 HydrophobicContact CG1-CG 4.45Å; V628-R712 HydrophobicContact CG2-CG 4.05Å; V628-A713 PolarHBondContact N-O 2.93Å; V628-V714 HydrophobicContact CB-CG2 4.43Å; V628-V714 HydrophobicContact CG1-CG2 4.49Å; V628-E715 PolarHBondContact O-N 2.9Å
629	H	93.6	Very high	90.6	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	160.4	-176.9	68	-81	0	0	0	112.3	Q631 F660 D661 E667 L718 Q720	H629-Q631 PolarHBondContact NE2-OE1 3.42Å; H629-F660 WeakPolarHBondContact O-CA 3.46Å; H629-D661 PolarHBondContact O-N 2.87Å; H629-E667 IonicContact ND1-OE2 2.72Å; H629-L718 CarbonylContact C-O 3.57Å; H629-L718 WeakPolarHBondContact CA-O 3.39Å; H629-L718 HydrophobicContact CB-CB 4.23Å; H629-L718 HydrophobicContact CB-CD2 3.66Å; H629-L718 HydrophobicContact CB-CG 3.67Å; H629-L718 WeakPolarHBondContact CB-O 3.47Å; H629-Q720 WeakPolarHBondContact CD2-CB 3.38Å; H629-Q720 PolarHBondContact CD2-OE1 3.4Å; H629-Q720 PolarHBondContact CE1-OE1 2.95Å; H629-Q720 VanDerWaalsContact CE1-OE1 3.28Å; H629-Q720 PolarHBondContact NE2-OE1 3.08Å
630	F	93	Very high	89.1	Confident	35 Å²	35	42.9 Å²	42.9	15%	0.154	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	117.2	166.5	-172.1	-96.5	0	0	0	110.1	R656 G658 F660 L718 I719 Q720	F630-R656 HydrophobicContact CE1-CB 4.02Å; F630-R656 WeakPolarHBondContact CE1-O 3.19Å; F630-R656 WeakPolarHBondContact CZ-O 3.11Å; F630-G658 VanDerWaalsContact CZ-C 3.44Å; F630-F660 HydrophobicContact CB-CD1 4Å; F630-F660 HydrophobicContact CB-CE1 3.73Å; F630-F660 HydrophobicContact CB-CZ 4.47Å; F630-F660 HydrophobicContact CD2-CD1 4.08Å; F630-F660 HydrophobicContact CD2-CD2 4.34Å; F630-F660 AromaticContact CD2-CE1 3.86Å; F630-F660 HydrophobicContact CD2-CE1 3.86Å; F630-F660 HydrophobicContact CD2-CE2 4.12Å; F630-F660 HydrophobicContact CD2-CG 4.33Å; F630-F660 AromaticContact CD2-CZ 3.89Å; F630-F660 HydrophobicContact CD2-CZ 3.89Å; F630-F660 HydrophobicContact CG-CE1 4.29Å; F630-L718 PolarHBondContact N-O 2.99Å; F630-I719 HydrophobicContact CD1-CG2 4.4Å; F630-I719 WeakPolarHBondContact O-CA 3.33Å; F630-Q720 PolarHBondContact O-N 3.43Å
631	Q	92	Very high	87.3	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.009	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	119.4	179.7	-178.3	60.6	67.5	0	0	110.3	H629 G658 H659 D661 Q720 K721 Y722	H629-Q631 PolarHBondContact NE2-OE1 3.42Å; Q631-G658 CarbonylContact O-C 3.53Å; Q631-G658 WeakPolarHBondContact O-CA 3.37Å; Q631-H659 PolarHBondContact N-O 2.83Å; Q631-H659 PolarHBondContact O-N 3.27Å; Q631-D661 HydrophobicContact CB-CB 4.13Å; Q631-Q720 PolarHBondContact NE2-O 3.38Å; Q631-K721 VanDerWaalsContact NE2-C 3.26Å; Q631-K721 PolarHBondContact NE2-O 2.96Å; Q631-Y722 VanDerWaalsContact NE2-CA 3.32Å
632	E	91.6	Very high	85.4	Confident	45 Å²	45	48.9 Å²	48.9	21%	0.21	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	143.5	172	-66.4	177.9	175.7	0	0	110.8	R656 I719 Q720	E632-R656 WeakPolarHBondContact OE1-CD 3.13Å; E632-R656 IonicContact OE1-CZ 3.91Å; E632-R656 IonicContact OE1-NE 3.82Å; E632-R656 IonicContact OE1-NH1 3.21Å; E632-R656 PolarHBondContact OE1-NH1 2.89Å; E632-I719 HydrophobicContact CG-CG2 4.45Å; E632-Q720 PolarHBondContact N-O 3.02Å
633	F	91.8	Very high	83.1	Confident	17 Å²	17	52.2 Å²	52.2	8%	0.075	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-75.7	167.2	175.3	-61.5	-53.9	0	0	0	112.4	P635 I638 D657 G658 H659 Y722 E745 S746	F633-P635 WeakPolarHBondContact O-CD 3.5Å; F633-P635 VanDerWaalsContact O-N 3.14Å; F633-I638 HydrophobicContact CB-CD1 3.53Å; F633-I638 HydrophobicContact CB-CG1 4.01Å; F633-I638 HydrophobicContact CD2-CD1 4.42Å; F633-I638 HydrophobicContact CG-CD1 4.5Å; F633-D657 HydrophobicContact CD2-CB 4.13Å; F633-D657 PolarHBondContact N-O 3.47Å; F633-D657 VanDerWaalsContact N-O 3.11Å; F633-G658 WeakPolarHBondContact CE2-O 3.49Å; F633-G658 VanDerWaalsContact CZ-C 3.5Å; F633-G658 WeakPolarHBondContact CZ-O 3.3Å; F633-H659 HydrophobicContact CE1-CB 4.1Å; F633-H659 AromaticContact CE1-CG 3.98Å; F633-H659 AromaticContact CE1-ND1 3.5Å; F633-H659 HydrophobicContact CZ-CB 4.11Å; F633-Y722 WeakPolarHBondContact O-CB 3.4Å; F633-E745 WeakPolarHBondContact CD1-O 3.44Å; F633-E745 VanDerWaalsContact CE1-O 3.25Å; F633-E745 WeakPolarHBondContact CE1-O 3.44Å; F633-S746 CarbonylContact C-O 3.57Å; F633-S746 WeakPolarHBondContact CA-O 3.04Å
634	N	90.2	Very high	80.6	Confident	27 Å²	27	57.8 Å²	57.8	14%	0.144	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-56.4	116.4	177.4	-171.2	-17.8	0	0	0	111.9	A636 V637 I638 Y722 S746 L747	N634-A636 PolarHBondContact O-N 2.95Å; N634-A636 VanDerWaalsContact O-N 3.16Å; N634-A636 VanDerWaalsContact OD1-CB 3.3Å; N634-A636 WeakPolarHBondContact OD1-CB 3.36Å; N634-A636 PolarHBondContact OD1-N 3.26Å; N634-V637 HydrophobicContact CB-CB 4.33Å; N634-V637 HydrophobicContact CB-CG2 4Å; N634-V637 PolarHBondContact O-N 3.05Å; N634-I638 PolarHBondContact O-N 3.09Å; N634-I638 VanDerWaalsContact O-N 3.13Å; N634-Y722 VanDerWaalsContact CA-CD2 3.49Å; N634-Y722 HydrophobicContact CB-CD1 4.22Å; N634-Y722 HydrophobicContact CB-CD2 3.91Å; N634-Y722 HydrophobicContact CB-CE1 3.87Å; N634-Y722 HydrophobicContact CB-CE2 3.55Å; N634-Y722 HydrophobicContact CB-CG 4.23Å; N634-Y722 VanDerWaalsContact CG-CZ 3.5Å; N634-Y722 VanDerWaalsContact N-CD2 3.34Å; N634-Y722 PolarHBondContact ND2-OH 2.94Å; N634-S746 PolarHBondContact N-O 3.03Å; N634-L747 WeakPolarHBondContact CB-O 3.4Å
635	P	85.8	Confident	77.8	Confident	65 Å²	65	61.8 Å²	61.8	42%	0.422	32%	0.322	S	S	.	.	H	α-helix	trans	-62.8	-26.9	-179.4	25.4	-34.3	0	0	0	112.2	F633 V637 Y639	F633-P635 WeakPolarHBondContact O-CD 3.5Å; F633-P635 VanDerWaalsContact O-N 3.14Å; P635-V637 PolarHBondContact O-N 2.79Å; P635-Y639 HydrophobicContact CB-CD2 3.8Å; P635-Y639 HydrophobicContact CB-CE2 4.18Å; P635-Y639 WeakPolarHBondContact O-CB 3.08Å; P635-Y639 PolarHBondContact O-N 2.96Å
636	A	84.1	Confident	75	Confident	60 Å²	60	67.3 Å²	67.3	50%	0.496	37%	0.367	S	S	.	.	H	α-helix	trans	-74.8	-8.1	176.4	0	0	0	0	0	113.9	N634 R640	N634-A636 PolarHBondContact O-N 2.95Å; N634-A636 VanDerWaalsContact O-N 3.16Å; N634-A636 VanDerWaalsContact OD1-CB 3.3Å; N634-A636 WeakPolarHBondContact OD1-CB 3.36Å; N634-A636 PolarHBondContact OD1-N 3.26Å; A636-R640 WeakPolarHBondContact O-CD 3.11Å; A636-R640 VanDerWaalsContact O-CG 3.25Å; A636-R640 WeakPolarHBondContact O-CG 3.47Å; A636-R640 PolarHBondContact O-NE 3.1Å; A636-R640 VanDerWaalsContact O-NE 3.08Å
637	V	82.5	Confident	72	Confident	27 Å²	27	71.7 Å²	71.7	16%	0.164	40%	0.398	C	S	.	.	H	α-helix	trans	-101.9	-39.3	172	179.1	0	0	0	0	110	N634 P635 L747 H752 L753	N634-V637 HydrophobicContact CB-CB 4.33Å; N634-V637 HydrophobicContact CB-CG2 4Å; N634-V637 PolarHBondContact O-N 3.05Å; P635-V637 PolarHBondContact O-N 2.79Å; V637-L747 WeakPolarHBondContact CB-O 3.49Å; V637-L747 WeakPolarHBondContact CG2-O 3.16Å; V637-H752 HydrophobicContact CG1-CB 4.3Å; V637-L753 HydrophobicContact CG1-CD2 4.31Å
638	I	80.7	Confident	69	Low	32 Å²	32	75.3 Å²	75.3	16%	0.164	42%	0.424	C	S	.	.	H	α-helix	trans	-73.5	-50.2	-179.5	-56.4	165.5	0	0	0	112.1	F633 N634 R640 D657	F633-I638 HydrophobicContact CB-CD1 3.53Å; F633-I638 HydrophobicContact CB-CG1 4.01Å; F633-I638 HydrophobicContact CD2-CD1 4.42Å; F633-I638 HydrophobicContact CG-CD1 4.5Å; N634-I638 PolarHBondContact O-N 3.09Å; N634-I638 VanDerWaalsContact O-N 3.13Å; I638-R640 PolarHBondContact O-N 2.9Å; I638-D657 HydrophobicContact CD1-CB 4.01Å
639	Y	72.4	Confident	66.1	Low	129 Å²	129	81.5 Å²	81.5	51%	0.506	46%	0.462	S	S	.	.	S	Bend	trans	-98.8	28.4	-167.5	-56.9	-68.3	0	0	0	113.6	P635 D641 Q642	P635-Y639 HydrophobicContact CB-CD2 3.8Å; P635-Y639 HydrophobicContact CB-CE2 4.18Å; P635-Y639 WeakPolarHBondContact O-CB 3.08Å; P635-Y639 PolarHBondContact O-N 2.96Å; Y639-D641 PolarHBondContact O-N 3.33Å; Y639-Q642 PolarHBondContact O-N 3.48Å
640	R	62.4	Low	63.2	Low	156 Å²	156	91.2 Å²	91.2	59%	0.589	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-27.6	-172.8	-108.5	168	-176.9	-157.3	-3.2	114.8	A636 I638	A636-R640 WeakPolarHBondContact O-CD 3.11Å; A636-R640 VanDerWaalsContact O-CG 3.25Å; A636-R640 WeakPolarHBondContact O-CG 3.47Å; A636-R640 PolarHBondContact O-NE 3.1Å; A636-R640 VanDerWaalsContact O-NE 3.08Å; I638-R640 PolarHBondContact O-N 2.9Å
641	D	54.6	Low	60.4	Low	145 Å²	145	92.3 Å²	92.3	78%	0.775	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121	-1.2	-176.5	-71.9	-35.3	0	0	0	115.6	Y639	Y639-D641 PolarHBondContact O-N 3.33Å
642	Q	52.9	Low	57.6	Low	146 Å²	146	97.6 Å²	97.6	68%	0.682	56%	0.557	S	S	*	*			trans	-120.8	103.2	-177.4	-69.2	-177.4	11.2	0	0	110.5	Y639	Y639-Q642 PolarHBondContact O-N 3.48Å
643	Q	43.3	Very low	55.1	Low	187 Å²	187	104.1 Å²	104.1	87%	0.874	59%	0.588	S	S	*	*			trans	-58.7	126.8	151.9	-86	-176.1	-20.3	0	0	107.2	S645	Q643-S645 PolarHBondContact O-N 2.78Å
644	P	42.7	Very low	52.7	Low	124 Å²	124	107.7 Å²	107.7	81%	0.805	61%	0.614	S	S	*	*			trans	-64.4	103.8	178	25	-32	0	0	0	108.5	A646	P644-A646 PolarHBondContact O-N 3.19Å
645	S	36.8	Very low	50.9	Low	85 Å²	85	113.9 Å²	113.9	59%	0.594	65%	0.647	S	S	*	*			trans	-67	119.1	172.1	57	0	0	0	0	108.4	Q643 S647	Q643-S645 PolarHBondContact O-N 2.78Å; S645-S647 PolarHBondContact O-N 2.84Å
646	A	38.6	Very low	49.9	Very low	116 Å²	116	115.9 Å²	115.9	96%	0.959	65%	0.646	S	S	*	*	S	Bend	trans	-66.8	26	179.9	0	0	0	0	0	114.9	P644	P644-A646 PolarHBondContact O-N 3.19Å
647	S	34.1	Very low	49.7	Very low	95 Å²	95	116.2 Å²	116.2	66%	0.664	64%	0.639	S	S	*	*			trans	-135.3	32.4	-167.3	67.4	0	0	0	0	115.2	S645	S645-S647 PolarHBondContact O-N 2.84Å
648	S	32.2	Very low	50	Low	80 Å²	80	115.9 Å²	115.9	56%	0.559	64%	0.641	S	S	*	*			trans	-111.2	80.8	164.8	59.3	0	0	0	0	111.1	F650 A651	S648-F650 PolarHBondContact O-N 2.69Å; S648-A651 PolarHBondContact O-N 2.78Å
649	T	33.5	Very low	50.4	Low	138 Å²	138	115.8 Å²	115.8	85%	0.847	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	19.7	173.5	24	0	0	0	0	114.4
650	F	32.7	Very low	51.3	Low	204 Å²	204	113 Å²	113	90%	0.895	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.2	9.8	174.4	-80	-79.2	0	0	0	113.9	S648 S652	S648-F650 PolarHBondContact O-N 2.69Å; F650-S652 PolarHBondContact O-N 2.97Å
651	A	33.2	Very low	52.7	Low	58 Å²	58	105.6 Å²	105.6	48%	0.479	60%	0.602	S	S	.	*			trans	-94	75	170.7	0	0	0	0	0	110.5	S648 E653	S648-A651 PolarHBondContact O-N 2.78Å; A651-E653 PolarHBondContact O-N 2.87Å
652	S	32.7	Very low	54.4	Low	113 Å²	113	107.2 Å²	107.2	79%	0.79	60%	0.598	S	S	*	*	S	Bend	trans	-62.9	115.2	151.2	53.1	0	0	0	0	106.7	F650	F650-S652 PolarHBondContact O-N 2.97Å
653	E	39.8	Very low	56.2	Low	183 Å²	183	102.5 Å²	102.5	86%	0.855	58%	0.576	S	S	*	*	S	Bend	trans	59.3	78.5	178.4	-61	175.5	168.6	0	0	114.1	A651 L655	A651-E653 PolarHBondContact O-N 2.87Å; E653-L655 PolarHBondContact O-N 3.44Å
654	S	42.4	Very low	58.3	Low	91 Å²	91	94 Å²	94	64%	0.636	54%	0.537	S	S	*	.			trans	-54.2	109.7	153.4	53.1	0	0	0	0	107.2	R656	S654-R656 PolarHBondContact O-N 3.15Å
655	L	52.1	Low	60.5	Low	158 Å²	158	89.3 Å²	89.3	83%	0.827	50%	0.504	S	S	*	.			trans	-42	107.3	173.9	-77.9	152.7	0	0	0	108.1	E653 D657	E653-L655 PolarHBondContact O-N 3.44Å; L655-D657 PolarHBondContact O-N 2.9Å
656	R	64.9	Low	63	Low	107 Å²	107	89 Å²	89	40%	0.404	50%	0.495	S	S	.	.			trans	-64.3	111.8	176.4	-67.9	-174.7	-176.4	-155.3	19.2	105.9	E605 F630 E632 S654 G658	E605-R656 IonicContact OE1-NH1 3.76Å; E605-R656 PolarHBondContact OE1-NH1 2.76Å; E605-R656 IonicContact OE1-NH2 2.92Å; E605-R656 IonicContact OE2-CZ 3.85Å; E605-R656 IonicContact OE2-NH1 2.8Å; E605-R656 PolarHBondContact OE2-NH1 3.17Å; E605-R656 IonicContact OE2-NH2 3.88Å; E605-R656 PolarHBondContact OE2-NH2 3.4Å; F630-R656 HydrophobicContact CE1-CB 4.02Å; F630-R656 WeakPolarHBondContact CE1-O 3.19Å; F630-R656 WeakPolarHBondContact CZ-O 3.11Å; E632-R656 WeakPolarHBondContact OE1-CD 3.13Å; E632-R656 IonicContact OE1-CZ 3.91Å; E632-R656 IonicContact OE1-NE 3.82Å; E632-R656 IonicContact OE1-NH1 3.21Å; E632-R656 PolarHBondContact OE1-NH1 2.89Å; S654-R656 PolarHBondContact O-N 3.15Å; R656-G658 PolarHBondContact O-N 3.14Å
657	D	79.8	Confident	65.6	Low	67 Å²	67	83.6 Å²	83.6	36%	0.358	45%	0.45	S	S	.	.			trans	-73.6	120.5	178	-88.7	-24.8	0	0	0	109.7	F633 I638 L655 H752	F633-D657 HydrophobicContact CD2-CB 4.13Å; F633-D657 PolarHBondContact N-O 3.47Å; F633-D657 VanDerWaalsContact N-O 3.11Å; I638-D657 HydrophobicContact CD1-CB 4.01Å; L655-D657 PolarHBondContact O-N 2.9Å; D657-H752 IonicContact OD2-CE1 3.49Å; D657-H752 PolarHBondContact OD2-CE1 3.38Å; D657-H752 IonicContact OD2-NE2 3.95Å
658	G	87.6	Confident	68.5	Low	19 Å²	19	79 Å²	79	20%	0.196	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.6	-165.1	-174.6	0	0	0	0	0	112.6	F630 Q631 F633 R656	F630-G658 VanDerWaalsContact CZ-C 3.44Å; Q631-G658 CarbonylContact O-C 3.53Å; Q631-G658 WeakPolarHBondContact O-CA 3.37Å; F633-G658 WeakPolarHBondContact CE2-O 3.49Å; F633-G658 VanDerWaalsContact CZ-C 3.5Å; F633-G658 WeakPolarHBondContact CZ-O 3.3Å; R656-G658 PolarHBondContact O-N 3.14Å
659	H	89.1	Confident	71.6	Confident	30 Å²	30	75.2 Å²	75.2	14%	0.139	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	161.6	178.7	71.1	-58.3	0	0	0	110.7	Q631 F633 E745	Q631-H659 PolarHBondContact N-O 2.83Å; Q631-H659 PolarHBondContact O-N 3.27Å; F633-H659 HydrophobicContact CE1-CB 4.1Å; F633-H659 AromaticContact CE1-CG 3.98Å; F633-H659 AromaticContact CE1-ND1 3.5Å; F633-H659 HydrophobicContact CZ-CB 4.11Å; H659-E745 IonicContact CD2-OE2 3Å; H659-E745 IonicContact NE2-OE2 3.5Å
660	F	91.8	Very high	74.7	Confident	71 Å²	71	68.7 Å²	68.7	31%	0.311	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	114.4	170.1	-69.1	-71.2	0	0	0	109.8	V628 H629 F630 R662 V714	V628-F660 HydrophobicContact CG1-CB 4.06Å; H629-F660 WeakPolarHBondContact O-CA 3.46Å; F630-F660 HydrophobicContact CB-CD1 4Å; F630-F660 HydrophobicContact CB-CE1 3.73Å; F630-F660 HydrophobicContact CB-CZ 4.47Å; F630-F660 HydrophobicContact CD2-CD1 4.08Å; F630-F660 HydrophobicContact CD2-CD2 4.34Å; F630-F660 AromaticContact CD2-CE1 3.86Å; F630-F660 HydrophobicContact CD2-CE1 3.86Å; F630-F660 HydrophobicContact CD2-CE2 4.12Å; F630-F660 HydrophobicContact CD2-CG 4.33Å; F630-F660 AromaticContact CD2-CZ 3.89Å; F630-F660 HydrophobicContact CD2-CZ 3.89Å; F630-F660 HydrophobicContact CG-CE1 4.29Å; F660-R662 PolarHBondContact O-N 2.84Å; F660-V714 HydrophobicContact CB-CG1 4.47Å; F660-V714 HydrophobicContact CB-CG2 4.42Å; F660-V714 HydrophobicContact CD1-CB 4.5Å; F660-V714 HydrophobicContact CD1-CG1 3.35Å; F660-V714 HydrophobicContact CD2-CG1 3.79Å; F660-V714 HydrophobicContact CE1-CG1 3.26Å; F660-V714 HydrophobicContact CE2-CG1 3.72Å; F660-V714 HydrophobicContact CG-CG1 3.6Å; F660-V714 HydrophobicContact CG-CG2 4.36Å; F660-V714 HydrophobicContact CZ-CG1 3.45Å; F660-V714 VanDerWaalsContact CZ-CG1 3.45Å
661	D	90.9	Very high	77.7	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.315	C	S	.	.			trans	-83.6	100.1	-173	-171.8	-18.1	0	0	0	111.5	V628 H629 Q631 H663 V664 S742	V628-D661 WeakPolarHBondContact CG1-O 3.45Å; H629-D661 PolarHBondContact O-N 2.87Å; Q631-D661 HydrophobicContact CB-CB 4.13Å; D661-H663 VanDerWaalsContact C-N 3.26Å; D661-H663 PolarHBondContact O-N 3.48Å; D661-H663 WeakPolarHBondContact OD1-CB 3.38Å; D661-H663 IonicContact OD1-CD2 3.76Å; D661-H663 PolarHBondContact OD1-N 3.08Å; D661-V664 HydrophobicContact CB-CG2 4.41Å; D661-V664 VanDerWaalsContact OD2-CG2 3.22Å; D661-V664 WeakPolarHBondContact OD2-CG2 3.32Å; D661-S742 VanDerWaalsContact OD2-CB 3.27Å; D661-S742 WeakPolarHBondContact OD2-CB 3.49Å; D661-S742 PolarHBondContact OD2-OG 3.49Å
662	R	91	Very high	80.7	Confident	179 Å²	179	57.8 Å²	57.8	68%	0.675	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-7.8	-177.6	-60.8	177.6	-177.1	170.4	0.1	113.5	V628 F660 R712	V628-R662 HydrophobicContact CG1-CG 4.45Å; F660-R662 PolarHBondContact O-N 2.84Å; R662-R712 PolarHBondContact O-NH1 2.93Å; R662-R712 PolarHBondContact O-NH2 2.83Å
663	H	90.4	Very high	83.8	Confident	48 Å²	48	53.8 Å²	53.8	22%	0.222	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-10.5	-176.3	-57.9	-64.8	0	0	0	112.4	D661 F665 R738 E745	D661-H663 VanDerWaalsContact C-N 3.26Å; D661-H663 PolarHBondContact O-N 3.48Å; D661-H663 WeakPolarHBondContact OD1-CB 3.38Å; D661-H663 IonicContact OD1-CD2 3.76Å; D661-H663 PolarHBondContact OD1-N 3.08Å; H663-F665 VanDerWaalsContact O-CD2 3.27Å; H663-F665 WeakPolarHBondContact O-CD2 3.27Å; H663-F665 WeakPolarHBondContact O-CE2 3.08Å; H663-R738 HydrophobicContact CB-CB 4.31Å; H663-E745 IonicContact CD2-OE1 3.88Å; H663-E745 IonicContact CD2-OE2 2.84Å; H663-E745 PolarHBondContact CD2-OE2 3.21Å; H663-E745 IonicContact NE2-OE1 3.65Å; H663-E745 PolarHBondContact NE2-OE1 3.44Å; H663-E745 IonicContact NE2-OE2 2.78Å; H663-E745 PolarHBondContact NE2-OE2 3.42Å
664	V	87.6	Confident	86.4	Confident	9 Å²	9	45.1 Å²	45.1	6%	0.055	23%	0.226	C	C	.	.			trans	-96.2	141.8	-178.1	177	0	0	0	0	112.4	D661 D666 E667 R712 R725	D661-V664 HydrophobicContact CB-CG2 4.41Å; D661-V664 VanDerWaalsContact OD2-CG2 3.22Å; D661-V664 WeakPolarHBondContact OD2-CG2 3.32Å; V664-D666 HydrophobicContact CG1-CB 4.11Å; V664-E667 VanDerWaalsContact CG1-OE2 3.3Å; V664-E667 WeakPolarHBondContact CG1-OE2 3.02Å; V664-R712 PolarHBondContact O-NH2 2.93Å; V664-R725 VanDerWaalsContact CG2-NH1 3.26Å
665	F	89.9	Confident	89	Confident	25 Å²	25	40.8 Å²	40.8	11%	0.11	20%	0.196	C	C	.	.			trans	-137.6	18.3	-176.9	-62.7	-101.6	0	0	0	111.8	Q580 H663 Y699 R712	Q580-F665 PolarHBondContact NE2-O 3Å; H663-F665 VanDerWaalsContact O-CD2 3.27Å; H663-F665 WeakPolarHBondContact O-CD2 3.27Å; H663-F665 WeakPolarHBondContact O-CE2 3.08Å; F665-Y699 AromaticContact CD1-CD1 3.76Å; F665-Y699 HydrophobicContact CD1-CD1 3.76Å; F665-Y699 AromaticContact CD1-CD2 3.89Å; F665-Y699 HydrophobicContact CD1-CD2 3.89Å; F665-Y699 HydrophobicContact CD1-CE1 4.28Å; F665-Y699 HydrophobicContact CD1-CE2 4.39Å; F665-Y699 AromaticContact CD1-CG 3.54Å; F665-Y699 HydrophobicContact CD1-CG 3.54Å; F665-Y699 AromaticContact CE1-CD1 3.67Å; F665-Y699 HydrophobicContact CE1-CD1 3.67Å; F665-Y699 HydrophobicContact CE1-CD2 4.12Å; F665-Y699 AromaticContact CE1-CE1 3.75Å; F665-Y699 HydrophobicContact CE1-CE1 3.75Å; F665-Y699 HydrophobicContact CE1-CE2 4.17Å; F665-Y699 AromaticContact CE1-CG 3.87Å; F665-Y699 HydrophobicContact CE1-CG 3.87Å; F665-Y699 AromaticContact CE1-CZ 4Å; F665-R712 VanDerWaalsContact CE1-NH1 3.26Å; F665-R712 VanDerWaalsContact CZ-NH2 3.32Å
666	D	87.7	Confident	91	Very high	78 Å²	78	36.9 Å²	36.9	42%	0.417	17%	0.174	S	C	.	.			trans	-76.6	-38.9	-174.9	-62.6	-38.9	0	0	0	110.9	Q580 L599 V664 R725	Q580-D666 PolarHBondContact NE2-O 3.31Å; L599-D666 WeakPolarHBondContact CB-O 3.45Å; V664-D666 HydrophobicContact CG1-CB 4.11Å; D666-R725 IonicContact OD2-CZ 2.92Å; D666-R725 IonicContact OD2-NH1 3.42Å; D666-R725 PolarHBondContact OD2-NH1 3.39Å
667	E	93.8	Very high	92.4	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.009	17%	0.174	C	C	.	.			trans	-81.7	125.2	178.5	-61.5	81.9	-179.9	0	0	112	F598 L599 P627 H629 V664 L718	F598-E667 HydrophobicContact CE2-CB 4.34Å; L599-E667 WeakPolarHBondContact O-CA 3.36Å; P627-E667 HydrophobicContact CG-CB 4.14Å; H629-E667 IonicContact ND1-OE2 2.72Å; V664-E667 VanDerWaalsContact CG1-OE2 3.3Å; V664-E667 WeakPolarHBondContact CG1-OE2 3.02Å; E667-L718 HydrophobicContact CB-CD2 4.22Å; E667-L718 HydrophobicContact CG-CD2 4.28Å
668	A	96.1	Very high	93	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	146.6	-178	0	0	0	0	0	112.1	F598 L599 F626 F670	F598-A668 WeakPolarHBondContact CA-O 3.48Å; L599-A668 HydrophobicContact CD1-CB 4.32Å; L599-A668 PolarHBondContact N-O 3.4Å; F626-A668 HydrophobicContact CD1-CB 3.69Å; F626-A668 HydrophobicContact CE1-CB 3.46Å; F626-A668 VanDerWaalsContact CE1-CB 3.46Å; F626-A668 HydrophobicContact CG-CB 4.47Å; F626-A668 HydrophobicContact CZ-CB 4.06Å; A668-F670 HydrophobicContact CB-CD1 3.88Å; A668-F670 HydrophobicContact CB-CE1 3.86Å
669	C	96.9	Very high	93.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	114.5	176.8	-75.4	0	0	0	0	110.6	F597 C614 A618 F625	F597-C669 VanDerWaalsContact O-CA 3.27Å; F597-C669 WeakPolarHBondContact O-CA 3.4Å; C614-C669 HydrophobicContact CB-CB 4.07Å; C614-C669 WeakPolarHBondContact CB-SG 3.33Å; C614-C669 WeakPolarHBondContact SG-CB 3.38Å; C614-C669 CovalentContact SG-SG 2.03Å; C614-C669 PolarHBondContact SG-SG 3.16Å; A618-C669 HydrophobicContact CB-CB 4.17Å; F625-C669 HydrophobicContact CB-CB 4.06Å; F625-C669 HydrophobicContact CD1-CB 3.96Å; F625-C669 HydrophobicContact CG-CB 4.49Å; F625-C669 PolarHBondContact N-O 2.85Å; F625-C669 PolarHBondContact O-N 3.36Å
670	F	97.1	Very high	93.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	157.4	-177.8	57.7	-91.8	0	0	0	112.5	M584 F597 L599 V624 A668 Y675 V698 F702	M584-F670 HydrophobicContact CE-CE2 4.03Å; M584-F670 HydrophobicContact CE-CZ 4.15Å; M584-F670 HydrophobicContact CG-CZ 4.19Å; M584-F670 HydrophobicContact SD-CE2 4.22Å; M584-F670 HydrophobicContact SD-CZ 3.74Å; F597-F670 HydrophobicContact CB-CE2 4.43Å; F597-F670 HydrophobicContact CD2-CD2 4.32Å; F597-F670 AromaticContact CD2-CE2 3.86Å; F597-F670 HydrophobicContact CD2-CE2 3.86Å; F597-F670 HydrophobicContact CD2-CZ 4.5Å; F597-F670 PolarHBondContact N-O 3.38Å; F597-F670 PolarHBondContact O-N 3.37Å; L599-F670 HydrophobicContact CD1-CE1 3.9Å; L599-F670 HydrophobicContact CD1-CZ 4.2Å; L599-F670 HydrophobicContact CG-CE1 4.13Å; L599-F670 HydrophobicContact CG-CZ 4.45Å; V624-F670 HydrophobicContact CB-CB 4.18Å; V624-F670 HydrophobicContact CG1-CB 3.8Å; A668-F670 HydrophobicContact CB-CD1 3.88Å; A668-F670 HydrophobicContact CB-CE1 3.86Å; F670-Y675 HydrophobicContact CE2-CD2 4.16Å; F670-Y675 HydrophobicContact CE2-CG 4.08Å; F670-V698 HydrophobicContact CE1-CG1 3.96Å; F670-V698 HydrophobicContact CZ-CG1 4.1Å; F670-F702 HydrophobicContact CB-CE2 4.29Å; F670-F702 HydrophobicContact CB-CZ 4.04Å; F670-F702 HydrophobicContact CD1-CE2 4.11Å; F670-F702 HydrophobicContact CD2-CE2 4.17Å; F670-F702 AromaticContact CD2-CZ 3.87Å; F670-F702 HydrophobicContact CD2-CZ 3.87Å; F670-F702 HydrophobicContact CE1-CE2 4.49Å; F670-F702 HydrophobicContact CE2-CZ 4.47Å; F670-F702 AromaticContact CG-CE2 3.93Å; F670-F702 HydrophobicContact CG-CE2 3.93Å; F670-F702 AromaticContact CG-CZ 3.9Å; F670-F702 HydrophobicContact CG-CZ 3.9Å
671	Y	96.9	Very high	93.1	Very high	31 Å²	31	38 Å²	38	12%	0.122	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	143.2	174.2	-78.9	-87.5	0	0	0	111.9	D594 T595 L596 A618 A673 D674 Y675	D594-Y671 WeakPolarHBondContact O-CE1 3.29Å; T595-Y671 CarbonylContact O-C 3.6Å; T595-Y671 WeakPolarHBondContact O-CA 3.39Å; L596-Y671 HydrophobicContact CB-CD1 4.31Å; L596-Y671 HydrophobicContact CB-CE1 3.98Å; L596-Y671 HydrophobicContact CD1-CD2 4.3Å; L596-Y671 HydrophobicContact CD1-CE2 4.22Å; A618-Y671 WeakPolarHBondContact O-CE2 3.28Å; Y671-A673 VanDerWaalsContact C-N 3.28Å; Y671-A673 PolarHBondContact O-N 2.92Å; Y671-D674 WeakPolarHBondContact O-CB 3.11Å; Y671-D674 PolarHBondContact O-N 3.5Å; Y671-D674 VanDerWaalsContact O-N 3.08Å; Y671-Y675 PolarHBondContact O-N 3.4Å
672	N	96.8	Very high	92.8	Very high	2 Å²	2	38 Å²	38	1%	0.011	19%	0.188	C	C	.	.	H	α-helix	trans	-59.1	-38.7	178.1	-167.9	19.6	0	0	0	112.5	S588 H591 P592 T595 F597 D674 Y675 M676	S588-N672 PolarHBondContact O-ND2 3.17Å; S588-N672 VanDerWaalsContact O-ND2 3.13Å; S588-N672 PolarHBondContact OG-OD1 2.6Å; H591-N672 PolarHBondContact O-ND2 3.48Å; H591-N672 VanDerWaalsContact O-ND2 3.09Å; P592-N672 WeakPolarHBondContact O-CB 3.39Å; P592-N672 PolarHBondContact O-ND2 2.9Å; T595-N672 PolarHBondContact O-N 3.21Å; F597-N672 HydrophobicContact CD2-CB 4.13Å; F597-N672 HydrophobicContact CE2-CB 3.43Å; F597-N672 VanDerWaalsContact CE2-CB 3.43Å; F597-N672 VanDerWaalsContact CE2-CG 3.48Å; F597-N672 HydrophobicContact CZ-CB 4.11Å; N672-D674 VanDerWaalsContact C-N 3.27Å; N672-D674 PolarHBondContact O-N 3.31Å; N672-Y675 PolarHBondContact O-N 3.05Å; N672-M676 WeakPolarHBondContact O-CB 3.49Å; N672-M676 VanDerWaalsContact O-CG 3.29Å; N672-M676 WeakPolarHBondContact O-CG 3.06Å; N672-M676 PolarHBondContact O-N 3.2Å
673	A	95.9	Very high	92.4	Very high	29 Å²	29	31.5 Å²	31.5	24%	0.24	17%	0.173	C	C	.	.	H	α-helix	trans	-55.6	-40.8	174.7	0	0	0	0	0	112.7	V593 Y671 S677	V593-A673 HydrophobicContact CB-CB 4.28Å; V593-A673 WeakPolarHBondContact O-CB 3.46Å; V593-A673 PolarHBondContact O-N 3.33Å; Y671-A673 VanDerWaalsContact C-N 3.28Å; Y671-A673 PolarHBondContact O-N 2.92Å; A673-S677 VanDerWaalsContact O-CB 3.3Å; A673-S677 WeakPolarHBondContact O-CB 3.42Å; A673-S677 PolarHBondContact O-N 3.36Å
674	D	96.4	Very high	91.6	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.011	19%	0.187	C	C	.	.	H	α-helix	trans	-70.1	-43.4	-178.9	-67.3	-29.3	0	0	0	111.1	S620 N621 Y671 N672 S677 A678 F702 L708	S620-D674 WeakPolarHBondContact CA-OD2 3.36Å; N621-D674 VanDerWaalsContact CA-OD1 3.28Å; N621-D674 WeakPolarHBondContact CA-OD1 3.14Å; N621-D674 PolarHBondContact N-OD1 3.02Å; N621-D674 PolarHBondContact N-OD2 2.91Å; N621-D674 PolarHBondContact OD1-OD1 3.2Å; Y671-D674 WeakPolarHBondContact O-CB 3.11Å; Y671-D674 PolarHBondContact O-N 3.5Å; Y671-D674 VanDerWaalsContact O-N 3.08Å; N672-D674 VanDerWaalsContact C-N 3.27Å; N672-D674 PolarHBondContact O-N 3.31Å; D674-S677 PolarHBondContact O-N 2.95Å; D674-A678 PolarHBondContact O-N 3.01Å; D674-F702 HydrophobicContact CB-CE1 4.1Å; D674-L708 HydrophobicContact CB-CD1 3.62Å
675	Y	95.8	Very high	90.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.9	-48.6	174.4	179.7	-99.6	0	0	0	111.4	V581 M584 D585 F670 Y671 N672 S677 A678 R679 V698 I701 F702	V581-Y675 PolarHBondContact O-OH 2.88Å; M584-Y675 HydrophobicContact CB-CE1 4.32Å; M584-Y675 HydrophobicContact CB-CE2 4.19Å; M584-Y675 HydrophobicContact CG-CD1 4.12Å; M584-Y675 HydrophobicContact CG-CD2 4.05Å; M584-Y675 HydrophobicContact CG-CE1 3.74Å; M584-Y675 HydrophobicContact CG-CE2 3.64Å; M584-Y675 HydrophobicContact CG-CG 4.28Å; M584-Y675 VanDerWaalsContact CG-CZ 3.49Å; D585-Y675 PolarHBondContact OD1-OH 3.3Å; F670-Y675 HydrophobicContact CE2-CD2 4.16Å; F670-Y675 HydrophobicContact CE2-CG 4.08Å; Y671-Y675 PolarHBondContact O-N 3.4Å; N672-Y675 PolarHBondContact O-N 3.05Å; Y675-S677 VanDerWaalsContact C-N 3.31Å; Y675-S677 PolarHBondContact O-N 3.37Å; Y675-A678 PolarHBondContact O-N 3.12Å; Y675-R679 WeakPolarHBondContact O-CB 3.28Å; Y675-R679 PolarHBondContact O-N 3.36Å; Y675-V698 HydrophobicContact CD2-CG1 4.33Å; Y675-V698 HydrophobicContact CE2-CG1 4.34Å; Y675-V698 HydrophobicContact CE2-CG2 4.44Å; Y675-I701 HydrophobicContact CE2-CD1 4.25Å; Y675-F702 HydrophobicContact CD2-CE2 4.34Å; Y675-F702 HydrophobicContact CD2-CZ 4.23Å
676	M	94.4	Very high	90	Very high	75 Å²	75	35.3 Å²	35.3	37%	0.369	20%	0.204	S	C	.	.	H	α-helix	trans	-62	-37.8	179.4	-71.5	-70.8	-80	0	0	112.5	S588 N672 R679 T680	S588-M676 WeakPolarHBondContact OG-CG 3.43Å; S588-M676 PolarHBondContact OG-SD 3.01Å; N672-M676 WeakPolarHBondContact O-CB 3.49Å; N672-M676 VanDerWaalsContact O-CG 3.29Å; N672-M676 WeakPolarHBondContact O-CG 3.06Å; N672-M676 PolarHBondContact O-N 3.2Å; M676-R679 PolarHBondContact O-N 3.01Å; M676-T680 WeakPolarHBondContact O-CB 3.28Å; M676-T680 PolarHBondContact O-N 2.03Å; M676-T680 PolarHBondContact O-OG1 2.91Å
677	S	94.1	Very high	88.9	Confident	57 Å²	57	39.1 Å²	39.1	40%	0.399	22%	0.223	S	C	.	.	H	α-helix	trans	-63.2	-50.1	174.3	174.3	0	0	0	0	111.9	A673 D674 Y675 R679 T680 K681	A673-S677 VanDerWaalsContact O-CB 3.3Å; A673-S677 WeakPolarHBondContact O-CB 3.42Å; A673-S677 PolarHBondContact O-N 3.36Å; D674-S677 PolarHBondContact O-N 2.95Å; Y675-S677 VanDerWaalsContact C-N 3.31Å; Y675-S677 PolarHBondContact O-N 3.37Å; S677-R679 VanDerWaalsContact C-N 3.32Å; S677-R679 PolarHBondContact O-N 3.03Å; S677-T680 PolarHBondContact O-N 2.91Å; S677-K681 PolarHBondContact O-N 2.92Å
678	A	93.4	Very high	87.4	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.008	26%	0.262	C	S	.	.	H	α-helix	trans	-61.8	-41.6	176.6	0	0	0	0	0	111.5	D674 Y675 T680 K681 M682 I701 F702	D674-A678 PolarHBondContact O-N 3.01Å; Y675-A678 PolarHBondContact O-N 3.12Å; A678-T680 VanDerWaalsContact C-N 3.34Å; A678-T680 PolarHBondContact O-N 2.99Å; A678-K681 PolarHBondContact O-N 3.46Å; A678-M682 PolarHBondContact O-N 3.1Å; A678-I701 HydrophobicContact CB-CG2 3.87Å; A678-F702 HydrophobicContact CB-CD1 4.37Å; A678-F702 HydrophobicContact CB-CE1 4.41Å
679	R	90.7	Very high	86	Confident	40 Å²	40	51 Å²	51	15%	0.151	28%	0.281	C	S	.	.	H	α-helix	trans	-64.2	-35.6	178.9	-170.7	66.8	-177.1	85.9	-7.3	113.2	D585 Y675 M676 S677 M682 A683 M693	D585-R679 IonicContact OD1-NE 3.52Å; D585-R679 PolarHBondContact OD1-NE 2.68Å; D585-R679 VanDerWaalsContact OD1-NE 3.12Å; D585-R679 IonicContact OD2-CZ 3.85Å; D585-R679 IonicContact OD2-NE 2.77Å; D585-R679 PolarHBondContact OD2-NE 2.97Å; D585-R679 IonicContact OD2-NH2 3.81Å; D585-R679 PolarHBondContact OD2-NH2 3.48Å; Y675-R679 WeakPolarHBondContact O-CB 3.28Å; Y675-R679 PolarHBondContact O-N 3.36Å; M676-R679 PolarHBondContact O-N 3.01Å; S677-R679 VanDerWaalsContact C-N 3.32Å; S677-R679 PolarHBondContact O-N 3.03Å; R679-M682 PolarHBondContact O-N 3.2Å; R679-A683 PolarHBondContact O-N 2.83Å; R679-M693 PolarHBondContact NH2-SD 2.55Å
680	T	89.7	Confident	84.4	Confident	105 Å²	105	58.9 Å²	58.9	64%	0.644	32%	0.318	S	S	*	.	H	α-helix	trans	-66.4	-39.7	176.3	-57.5	0	0	0	0	111.3	M676 S677 A678 A683	M676-T680 WeakPolarHBondContact O-CB 3.28Å; M676-T680 PolarHBondContact O-N 2.03Å; M676-T680 PolarHBondContact O-OG1 2.91Å; S677-T680 PolarHBondContact O-N 2.91Å; A678-T680 VanDerWaalsContact C-N 3.34Å; A678-T680 PolarHBondContact O-N 2.99Å; T680-A683 WeakPolarHBondContact O-CB 3.43Å; T680-A683 PolarHBondContact O-N 3.26Å
681	K	88.7	Confident	82.9	Confident	114 Å²	114	66.1 Å²	66.1	50%	0.496	35%	0.352	S	S	.	.	H	α-helix	trans	-66.9	-40.9	174.8	-69.5	171.3	176.5	177.2	0	111.7	S677 A678 A683 A684 Y705	S677-K681 PolarHBondContact O-N 2.92Å; A678-K681 PolarHBondContact O-N 3.46Å; K681-A683 VanDerWaalsContact C-N 3.26Å; K681-A683 PolarHBondContact O-N 2.77Å; K681-A684 PolarHBondContact O-N 2.76Å; K681-Y705 WeakPolarHBondContact CD-O 3.26Å
682	M	86.4	Confident	81.6	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-63.2	-29.4	175.8	-172.4	-169.5	-178	0	0	112.9	A678 R679 A684 D685 I686 L692 M696 I701 Y705	A678-M682 PolarHBondContact O-N 3.1Å; R679-M682 PolarHBondContact O-N 3.2Å; M682-A684 PolarHBondContact O-N 3.29Å; M682-A684 VanDerWaalsContact O-N 3.13Å; M682-D685 PolarHBondContact O-N 3.01Å; M682-I686 HydrophobicContact CE-CD1 3.8Å; M682-I686 HydrophobicContact CE-CG1 4.02Å; M682-I686 HydrophobicContact CG-CD1 3.83Å; M682-I686 HydrophobicContact CG-CG1 4.05Å; M682-I686 PolarHBondContact O-N 2.99Å; M682-I686 HydrophobicContact SD-CD1 3.88Å; M682-L692 HydrophobicContact CE-CD2 4.28Å; M682-M696 HydrophobicContact CE-SD 3.77Å; M682-I701 HydrophobicContact CE-CG1 4.5Å; M682-I701 HydrophobicContact SD-CD1 4.02Å; M682-I701 HydrophobicContact SD-CG1 3.95Å; M682-Y705 HydrophobicContact CB-CD1 4.15Å; M682-Y705 HydrophobicContact CB-CD2 3.91Å; M682-Y705 HydrophobicContact CB-CE1 4.42Å; M682-Y705 HydrophobicContact CB-CE2 4.2Å; M682-Y705 HydrophobicContact CB-CG 3.89Å; M682-Y705 HydrophobicContact CG-CD2 3.84Å; M682-Y705 HydrophobicContact CG-CE1 4.44Å; M682-Y705 HydrophobicContact CG-CE2 3.69Å; M682-Y705 HydrophobicContact CG-CG 4.3Å; M682-Y705 HydrophobicContact SD-CD2 4.42Å; M682-Y705 HydrophobicContact SD-CE2 4.39Å
683	A	81.4	Confident	80.2	Confident	44 Å²	44	68.1 Å²	68.1	36%	0.364	36%	0.364	S	S	.	.	H	α-helix	trans	-60.6	-24.3	-177.7	0	0	0	0	0	113.7	R679 T680 K681	R679-A683 PolarHBondContact O-N 2.83Å; T680-A683 WeakPolarHBondContact O-CB 3.43Å; T680-A683 PolarHBondContact O-N 3.26Å; K681-A683 VanDerWaalsContact C-N 3.26Å; K681-A683 PolarHBondContact O-N 2.77Å
684	A	74.1	Confident	78.9	Confident	63 Å²	63	70.5 Å²	70.5	52%	0.521	37%	0.37	S	S	.	.	H	α-helix	trans	-66	-38.7	173.6	0	0	0	0	0	112.3	K681 M682	K681-A684 PolarHBondContact O-N 2.76Å; M682-A684 PolarHBondContact O-N 3.29Å; M682-A684 VanDerWaalsContact O-N 3.13Å
685	D	73.3	Confident	77.9	Confident	77 Å²	77	72.5 Å²	72.5	41%	0.412	38%	0.384	S	S	.	.	H	α-helix	trans	-82.4	-31	-176.6	-69.6	12.8	0	0	0	112.6	M682 L687 E688 Y705	M682-D685 PolarHBondContact O-N 3.01Å; D685-L687 VanDerWaalsContact C-N 3.26Å; D685-L687 PolarHBondContact O-N 2.87Å; D685-E688 PolarHBondContact O-N 2.82Å; D685-Y705 HydrophobicContact CB-CE1 4.48Å; D685-Y705 WeakPolarHBondContact OD2-CE1 3.29Å; D685-Y705 PolarHBondContact OD2-OH 2.89Å
686	I	71.1	Confident	77.3	Confident	21 Å²	21	72.9 Å²	72.9	11%	0.108	39%	0.386	C	S	.	.	H	α-helix	trans	-66.7	-28.4	-178.8	-67.5	170.8	0	0	0	112.2	M682 E688 N689 M693	M682-I686 HydrophobicContact CE-CD1 3.8Å; M682-I686 HydrophobicContact CE-CG1 4.02Å; M682-I686 HydrophobicContact CG-CD1 3.83Å; M682-I686 HydrophobicContact CG-CG1 4.05Å; M682-I686 PolarHBondContact O-N 2.99Å; M682-I686 HydrophobicContact SD-CD1 3.88Å; I686-E688 PolarHBondContact O-N 3.16Å; I686-N689 CarbonylContact O-C 3.39Å; I686-N689 PolarHBondContact O-N 2.97Å; I686-M693 HydrophobicContact CD1-CG 3.91Å; I686-M693 HydrophobicContact CD1-SD 4.07Å; I686-M693 HydrophobicContact CG1-CG 4.38Å; I686-M693 HydrophobicContact CG2-CE 4.34Å; I686-M693 HydrophobicContact CG2-SD 4.44Å
687	L	64.6	Low	77	Confident	158 Å²	158	69.9 Å²	69.9	83%	0.827	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-20.6	177	-72.9	168	0	0	0	112.6	D685	D685-L687 VanDerWaalsContact C-N 3.26Å; D685-L687 PolarHBondContact O-N 2.87Å
688	E	61.9	Low	77	Confident	178 Å²	178	67.1 Å²	67.1	83%	0.832	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-17.7	178.4	-60	-173.5	168	0	0	113.2	D685 I686	D685-E688 PolarHBondContact O-N 2.82Å; I686-E688 PolarHBondContact O-N 3.16Å
689	N	65.4	Low	77	Confident	74 Å²	74	69.9 Å²	69.9	40%	0.396	36%	0.363	S	S	.	.			trans	-157.3	99.7	-173.9	-155.3	-8.6	0	0	0	113.9	I686 E691 L692	I686-N689 CarbonylContact O-C 3.39Å; I686-N689 PolarHBondContact O-N 2.97Å; N689-E691 VanDerWaalsContact C-N 3.29Å; N689-E691 PolarHBondContact O-N 3.45Å; N689-L692 HydrophobicContact CB-CB 4.47Å; N689-L692 HydrophobicContact CB-CD1 4.21Å; N689-L692 WeakPolarHBondContact O-CB 3.47Å; N689-L692 PolarHBondContact O-N 3.45Å
690	E	63.8	Low	77	Confident	165 Å²	165	69.2 Å²	69.2	77%	0.771	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-25.3	179.4	-71.8	-170.5	157.1	0	0	113.5	L692	E690-L692 PolarHBondContact O-N 3.14Å
691	E	66.2	Low	77.1	Confident	152 Å²	152	64.2 Å²	64.2	71%	0.71	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-14.1	178.3	-65.6	-177.5	172.4	0	0	113	N689 M693 E694 S695	N689-E691 VanDerWaalsContact C-N 3.29Å; N689-E691 PolarHBondContact O-N 3.45Å; E691-M693 VanDerWaalsContact C-N 3.26Å; E691-M693 PolarHBondContact O-N 2.84Å; E691-E694 PolarHBondContact O-N 2.52Å; E691-S695 PolarHBondContact O-OG 3.34Å
692	L	70.5	Confident	77.4	Confident	36 Å²	36	58.8 Å²	58.8	19%	0.188	31%	0.308	C	S	.	.	H	α-helix	trans	-64.8	-29.4	-179.1	-140.3	98.5	0	0	0	112.6	M682 N689 E690 E694 S695 M696	M682-L692 HydrophobicContact CE-CD2 4.28Å; N689-L692 HydrophobicContact CB-CB 4.47Å; N689-L692 HydrophobicContact CB-CD1 4.21Å; N689-L692 WeakPolarHBondContact O-CB 3.47Å; N689-L692 PolarHBondContact O-N 3.45Å; E690-L692 PolarHBondContact O-N 3.14Å; L692-E694 VanDerWaalsContact C-N 3.31Å; L692-E694 PolarHBondContact O-N 3.33Å; L692-S695 WeakPolarHBondContact CA-OG 3.48Å; L692-S695 PolarHBondContact O-OG 2.96Å; L692-S695 VanDerWaalsContact O-OG 3.1Å; L692-M696 HydrophobicContact CD2-CE 3.68Å; L692-M696 HydrophobicContact CD2-SD 3.99Å; L692-M696 HydrophobicContact CG-CE 4.1Å; L692-M696 HydrophobicContact CG-SD 4.45Å
693	M	66.4	Low	77.7	Confident	40 Å²	40	62.2 Å²	62.2	20%	0.197	33%	0.329	C	S	.	.	H	α-helix	trans	-75.1	-19.1	-179.9	-70.3	-168.4	-69.6	0	0	113.8	S579 R679 I686 E691	S579-M693 PolarHBondContact OG-O 2.83Å; R679-M693 PolarHBondContact NH2-SD 2.55Å; I686-M693 HydrophobicContact CD1-CG 3.91Å; I686-M693 HydrophobicContact CD1-SD 4.07Å; I686-M693 HydrophobicContact CG1-CG 4.38Å; I686-M693 HydrophobicContact CG2-CE 4.34Å; I686-M693 HydrophobicContact CG2-SD 4.44Å; E691-M693 VanDerWaalsContact C-N 3.26Å; E691-M693 PolarHBondContact O-N 2.84Å
694	E	69.4	Low	78.1	Confident	78 Å²	78	67.4 Å²	67.4	36%	0.364	34%	0.339	S	S	.	.	H	α-helix	trans	-93.5	-13.1	180	-58.8	-168.5	165.5	0	0	112.2	K582 E691 L692	K582-E694 IonicContact NZ-OE1 3.76Å; K582-E694 PolarHBondContact NZ-OE1 3.46Å; E691-E694 PolarHBondContact O-N 2.52Å; L692-E694 VanDerWaalsContact C-N 3.31Å; L692-E694 PolarHBondContact O-N 3.33Å
695	S	74.7	Confident	78.9	Confident	44 Å²	44	66.1 Å²	66.1	31%	0.308	32%	0.321	S	S	.	.	H	α-helix	trans	-102.4	-11.1	-177.4	52.4	0	0	0	0	114.8	E691 L692 S732 I735	E691-S695 PolarHBondContact O-OG 3.34Å; L692-S695 WeakPolarHBondContact CA-OG 3.48Å; L692-S695 PolarHBondContact O-OG 2.96Å; L692-S695 VanDerWaalsContact O-OG 3.1Å; S695-S732 PolarHBondContact O-OG 3.23Å; S695-I735 WeakPolarHBondContact O-CD1 3.47Å
696	M	83.5	Confident	79.6	Confident	8 Å²	8	63.4 Å²	63.4	4%	0.039	31%	0.308	C	S	.	.			trans	-109.4	146.1	-178.4	-69.2	-175.4	168.3	0	0	112.8	V581 M682 L692 D700 R704 Y705	V581-M696 VanDerWaalsContact CG2-O 3.3Å; V581-M696 WeakPolarHBondContact CG2-O 3.33Å; M682-M696 HydrophobicContact CE-SD 3.77Å; L692-M696 HydrophobicContact CD2-CE 3.68Å; L692-M696 HydrophobicContact CD2-SD 3.99Å; L692-M696 HydrophobicContact CG-CE 4.1Å; L692-M696 HydrophobicContact CG-SD 4.45Å; M696-D700 HydrophobicContact CB-CB 4.03Å; M696-D700 HydrophobicContact CG-CB 4.13Å; M696-R704 VanDerWaalsContact CE-NH1 3.3Å; M696-Y705 HydrophobicContact CE-CE2 4.24Å; M696-Y705 HydrophobicContact SD-CE2 4.17Å
697	D	88.6	Confident	80.5	Confident	12 Å²	12	66 Å²	66	6%	0.064	34%	0.341	C	S	.	.			trans	-96.5	172.8	165.9	57.2	34.7	0	0	0	111.2	Y699 D700 I701 R738	D697-Y699 PolarHBondContact O-N 3.11Å; D697-Y699 WeakPolarHBondContact OD1-CA 3.4Å; D697-Y699 VanDerWaalsContact OD1-CB 3.3Å; D697-Y699 WeakPolarHBondContact OD1-CB 3.41Å; D697-Y699 PolarHBondContact OD1-N 3.09Å; D697-D700 PolarHBondContact O-N 2.86Å; D697-D700 WeakPolarHBondContact OD1-CB 3.36Å; D697-D700 PolarHBondContact OD1-N 3.31Å; D697-I701 PolarHBondContact O-N 3.23Å; D697-R738 IonicContact OD2-CZ 2.72Å; D697-R738 IonicContact OD2-NH1 3.18Å; D697-R738 PolarHBondContact OD2-NH1 2.9Å; D697-R738 IonicContact OD2-NH2 3.38Å; D697-R738 PolarHBondContact OD2-NH2 3.11Å
698	V	92.3	Very high	81.9	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.1	-29.6	178.4	173.5	0	0	0	0	111	Q580 V581 M584 F626 F670 Y675 I701 F702	Q580-V698 HydrophobicContact CB-CG2 4.5Å; Q580-V698 HydrophobicContact CG-CG2 3.86Å; V581-V698 HydrophobicContact CG2-CG2 4.5Å; M584-V698 HydrophobicContact CB-CG2 4.29Å; M584-V698 HydrophobicContact CG-CG2 4.49Å; F626-V698 HydrophobicContact CZ-CG1 4.39Å; F670-V698 HydrophobicContact CE1-CG1 3.96Å; F670-V698 HydrophobicContact CZ-CG1 4.1Å; Y675-V698 HydrophobicContact CD2-CG1 4.33Å; Y675-V698 HydrophobicContact CE2-CG1 4.34Å; Y675-V698 HydrophobicContact CE2-CG2 4.44Å; V698-I701 PolarHBondContact O-N 3.34Å; V698-F702 HydrophobicContact CG1-CD2 3.92Å; V698-F702 HydrophobicContact CG1-CE2 3.62Å; V698-F702 VanDerWaalsContact O-CD2 3.24Å; V698-F702 WeakPolarHBondContact O-CD2 3.07Å; V698-F702 PolarHBondContact O-N 3.01Å
699	Y	93.4	Very high	83.4	Confident	58 Å²	58	56.5 Å²	56.5	23%	0.227	29%	0.293	C	S	.	.	H	α-helix	trans	-63.8	-47.8	175.9	172.5	-91.8	0	0	0	111.8	F626 F665 D697 I701 F702 V703 V710	F626-Y699 HydrophobicContact CB-CD2 4.49Å; F626-Y699 AromaticContact CD1-CD2 3.96Å; F626-Y699 HydrophobicContact CD1-CD2 3.96Å; F626-Y699 AromaticContact CD2-CD2 3.95Å; F626-Y699 HydrophobicContact CD2-CD2 3.95Å; F626-Y699 HydrophobicContact CE1-CD2 4.13Å; F626-Y699 HydrophobicContact CE1-CG 4.42Å; F626-Y699 HydrophobicContact CE2-CD2 4.13Å; F626-Y699 AromaticContact CG-CD2 3.86Å; F626-Y699 HydrophobicContact CG-CD2 3.86Å; F626-Y699 HydrophobicContact CZ-CD2 4.22Å; F665-Y699 AromaticContact CD1-CD1 3.76Å; F665-Y699 HydrophobicContact CD1-CD1 3.76Å; F665-Y699 AromaticContact CD1-CD2 3.89Å; F665-Y699 HydrophobicContact CD1-CD2 3.89Å; F665-Y699 HydrophobicContact CD1-CE1 4.28Å; F665-Y699 HydrophobicContact CD1-CE2 4.39Å; F665-Y699 AromaticContact CD1-CG 3.54Å; F665-Y699 HydrophobicContact CD1-CG 3.54Å; F665-Y699 AromaticContact CE1-CD1 3.67Å; F665-Y699 HydrophobicContact CE1-CD1 3.67Å; F665-Y699 HydrophobicContact CE1-CD2 4.12Å; F665-Y699 AromaticContact CE1-CE1 3.75Å; F665-Y699 HydrophobicContact CE1-CE1 3.75Å; F665-Y699 HydrophobicContact CE1-CE2 4.17Å; F665-Y699 AromaticContact CE1-CG 3.87Å; F665-Y699 HydrophobicContact CE1-CG 3.87Å; F665-Y699 AromaticContact CE1-CZ 4Å; D697-Y699 PolarHBondContact O-N 3.11Å; D697-Y699 WeakPolarHBondContact OD1-CA 3.4Å; D697-Y699 VanDerWaalsContact OD1-CB 3.3Å; D697-Y699 WeakPolarHBondContact OD1-CB 3.41Å; D697-Y699 PolarHBondContact OD1-N 3.09Å; Y699-I701 PolarHBondContact O-N 2.71Å; Y699-F702 PolarHBondContact O-N 2.96Å; Y699-F702 VanDerWaalsContact O-N 3.14Å; Y699-V703 HydrophobicContact CD1-CG2 4.17Å; Y699-V703 HydrophobicContact CD2-CG2 4.46Å; Y699-V703 HydrophobicContact CE1-CG2 3.72Å; Y699-V703 HydrophobicContact CE2-CG2 4.06Å; Y699-V703 WeakPolarHBondContact O-CG2 3.34Å; Y699-V703 PolarHBondContact O-N 3.3Å; Y699-V710 HydrophobicContact CD2-CG1 3.98Å; Y699-V710 HydrophobicContact CE2-CG1 3.62Å
700	D	90.9	Very high	84.8	Confident	26 Å²	26	54.7 Å²	54.7	14%	0.139	28%	0.284	C	S	.	.	H	α-helix	trans	-55.7	-39.8	174.7	-84.2	-55.4	0	0	0	111.8	M696 D697 F702 V703 R704	M696-D700 HydrophobicContact CB-CB 4.03Å; M696-D700 HydrophobicContact CG-CB 4.13Å; D697-D700 PolarHBondContact O-N 2.86Å; D697-D700 WeakPolarHBondContact OD1-CB 3.36Å; D697-D700 PolarHBondContact OD1-N 3.31Å; D700-F702 PolarHBondContact O-N 3.14Å; D700-V703 PolarHBondContact O-N 3.32Å; D700-R704 WeakPolarHBondContact O-CB 3.45Å; D700-R704 WeakPolarHBondContact O-CG 3.19Å; D700-R704 PolarHBondContact O-N 3.48Å; D700-R704 IonicContact OD1-CZ 4Å; D700-R704 IonicContact OD1-NE 3.75Å; D700-R704 IonicContact OD1-NH2 3.52Å; D700-R704 PolarHBondContact OD1-NH2 3.26Å; D700-R704 VanDerWaalsContact OD1-NH2 3.16Å
701	I	91.9	Very high	86.2	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.4	-47.9	177.9	-65.9	176.4	0	0	0	110.5	V581 Y675 A678 M682 D697 V698 Y699 Y705	V581-I701 HydrophobicContact CB-CD1 4.2Å; V581-I701 HydrophobicContact CG1-CD1 3.6Å; V581-I701 HydrophobicContact CG2-CD1 3.56Å; V581-I701 HydrophobicContact CG2-CG1 4.42Å; Y675-I701 HydrophobicContact CE2-CD1 4.25Å; A678-I701 HydrophobicContact CB-CG2 3.87Å; M682-I701 HydrophobicContact CE-CG1 4.5Å; M682-I701 HydrophobicContact SD-CD1 4.02Å; M682-I701 HydrophobicContact SD-CG1 3.95Å; D697-I701 PolarHBondContact O-N 3.23Å; V698-I701 PolarHBondContact O-N 3.34Å; Y699-I701 PolarHBondContact O-N 2.71Å; I701-Y705 WeakPolarHBondContact O-CA 3.4Å; I701-Y705 VanDerWaalsContact O-CB 3.29Å; I701-Y705 WeakPolarHBondContact O-CB 3.33Å; I701-Y705 PolarHBondContact O-N 3.49Å
702	F	95.4	Very high	87.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-67.8	-41.2	179.5	-75.2	-69.4	0	0	0	112	V624 F626 F670 D674 Y675 A678 V698 Y699 D700 R704 S706 L708 V710	V624-F702 HydrophobicContact CG1-CD1 3.83Å; V624-F702 HydrophobicContact CG1-CE1 3.68Å; V624-F702 HydrophobicContact CG1-CE2 4.4Å; V624-F702 HydrophobicContact CG1-CG 4.3Å; V624-F702 HydrophobicContact CG1-CZ 3.97Å; V624-F702 HydrophobicContact CG2-CB 4.14Å; V624-F702 HydrophobicContact CG2-CD1 4.23Å; V624-F702 HydrophobicContact CG2-CD2 4.4Å; V624-F702 HydrophobicContact CG2-CG 4.01Å; F626-F702 HydrophobicContact CE2-CD2 4.02Å; F626-F702 AromaticContact CZ-CD2 3.83Å; F626-F702 HydrophobicContact CZ-CD2 3.83Å; F626-F702 HydrophobicContact CZ-CE2 4.4Å; F670-F702 HydrophobicContact CB-CE2 4.29Å; F670-F702 HydrophobicContact CB-CZ 4.04Å; F670-F702 HydrophobicContact CD1-CE2 4.11Å; F670-F702 HydrophobicContact CD2-CE2 4.17Å; F670-F702 AromaticContact CD2-CZ 3.87Å; F670-F702 HydrophobicContact CD2-CZ 3.87Å; F670-F702 HydrophobicContact CE1-CE2 4.49Å; F670-F702 HydrophobicContact CE2-CZ 4.47Å; F670-F702 AromaticContact CG-CE2 3.93Å; F670-F702 HydrophobicContact CG-CE2 3.93Å; F670-F702 AromaticContact CG-CZ 3.9Å; F670-F702 HydrophobicContact CG-CZ 3.9Å; D674-F702 HydrophobicContact CB-CE1 4.1Å; Y675-F702 HydrophobicContact CD2-CE2 4.34Å; Y675-F702 HydrophobicContact CD2-CZ 4.23Å; A678-F702 HydrophobicContact CB-CD1 4.37Å; A678-F702 HydrophobicContact CB-CE1 4.41Å; V698-F702 HydrophobicContact CG1-CD2 3.92Å; V698-F702 HydrophobicContact CG1-CE2 3.62Å; V698-F702 VanDerWaalsContact O-CD2 3.24Å; V698-F702 WeakPolarHBondContact O-CD2 3.07Å; V698-F702 PolarHBondContact O-N 3.01Å; Y699-F702 PolarHBondContact O-N 2.96Å; Y699-F702 VanDerWaalsContact O-N 3.14Å; D700-F702 PolarHBondContact O-N 3.14Å; F702-R704 PolarHBondContact O-N 3.03Å; F702-S706 WeakPolarHBondContact O-CA 3.29Å; F702-S706 WeakPolarHBondContact O-CB 3.46Å; F702-S706 PolarHBondContact O-N 3.5Å; F702-S706 PolarHBondContact O-OG 3.29Å; F702-L708 HydrophobicContact CD1-CD1 4.28Å; F702-L708 HydrophobicContact CE1-CD1 4.28Å; F702-V710 HydrophobicContact CB-CG2 3.95Å
703	V	92.8	Very high	88.5	Confident	73 Å²	73	45.9 Å²	45.9	44%	0.442	24%	0.242	S	C	.	.	H	α-helix	trans	-65.3	-40.2	-179.5	173.8	0	0	0	0	112.2	Y699 D700 V710	Y699-V703 HydrophobicContact CD1-CG2 4.17Å; Y699-V703 HydrophobicContact CD2-CG2 4.46Å; Y699-V703 HydrophobicContact CE1-CG2 3.72Å; Y699-V703 HydrophobicContact CE2-CG2 4.06Å; Y699-V703 WeakPolarHBondContact O-CG2 3.34Å; Y699-V703 PolarHBondContact O-N 3.3Å; D700-V703 PolarHBondContact O-N 3.32Å; V703-V710 HydrophobicContact CG2-CB 4.43Å; V703-V710 HydrophobicContact CG2-CG1 4.22Å; V703-V710 HydrophobicContact CG2-CG2 4.13Å
704	R	90.3	Very high	89.7	Confident	153 Å²	153	47.4 Å²	47.4	58%	0.577	25%	0.253	S	S	*	.	H	α-helix	trans	-89.8	-36.1	-174.7	-61.6	-179.8	-163.6	-156.2	8.1	113.3	M696 D700 F702	M696-R704 VanDerWaalsContact CE-NH1 3.3Å; D700-R704 WeakPolarHBondContact O-CB 3.45Å; D700-R704 WeakPolarHBondContact O-CG 3.19Å; D700-R704 PolarHBondContact O-N 3.48Å; D700-R704 IonicContact OD1-CZ 4Å; D700-R704 IonicContact OD1-NE 3.75Å; D700-R704 IonicContact OD1-NH2 3.52Å; D700-R704 PolarHBondContact OD1-NH2 3.26Å; D700-R704 VanDerWaalsContact OD1-NH2 3.16Å; F702-R704 PolarHBondContact O-N 3.03Å
705	Y	91.3	Very high	90.7	Very high	35 Å²	35	44.4 Å²	44.4	14%	0.137	24%	0.24	C	C	.	.	H	α-helix	trans	-116.5	-7.9	-168.4	-58.8	-71	0	0	0	114.4	K681 M682 D685 M696 I701	K681-Y705 WeakPolarHBondContact CD-O 3.26Å; M682-Y705 HydrophobicContact CB-CD1 4.15Å; M682-Y705 HydrophobicContact CB-CD2 3.91Å; M682-Y705 HydrophobicContact CB-CE1 4.42Å; M682-Y705 HydrophobicContact CB-CE2 4.2Å; M682-Y705 HydrophobicContact CB-CG 3.89Å; M682-Y705 HydrophobicContact CG-CD2 3.84Å; M682-Y705 HydrophobicContact CG-CE1 4.44Å; M682-Y705 HydrophobicContact CG-CE2 3.69Å; M682-Y705 HydrophobicContact CG-CG 4.3Å; M682-Y705 HydrophobicContact SD-CD2 4.42Å; M682-Y705 HydrophobicContact SD-CE2 4.39Å; D685-Y705 HydrophobicContact CB-CE1 4.48Å; D685-Y705 WeakPolarHBondContact OD2-CE1 3.29Å; D685-Y705 PolarHBondContact OD2-OH 2.89Å; M696-Y705 HydrophobicContact CE-CE2 4.24Å; M696-Y705 HydrophobicContact SD-CE2 4.17Å; I701-Y705 WeakPolarHBondContact O-CA 3.4Å; I701-Y705 VanDerWaalsContact O-CB 3.29Å; I701-Y705 WeakPolarHBondContact O-CB 3.33Å; I701-Y705 PolarHBondContact O-N 3.49Å
706	S	88.1	Confident	91.3	Very high	20 Å²	20	46.6 Å²	46.6	14%	0.14	25%	0.253	C	S	.	.			trans	-100.2	143.1	172.6	93.1	0	0	0	0	111.2	F702 L708	F702-S706 WeakPolarHBondContact O-CA 3.29Å; F702-S706 WeakPolarHBondContact O-CB 3.46Å; F702-S706 PolarHBondContact O-N 3.5Å; F702-S706 PolarHBondContact O-OG 3.29Å; S706-L708 PolarHBondContact O-N 3.12Å; S706-L708 WeakPolarHBondContact OG-CB 3.15Å; S706-L708 PolarHBondContact OG-N 3Å
707	G	90	Very high	91.5	Very high	77 Å²	77	47 Å²	47	79%	0.794	26%	0.258	S	S	*	.			trans	-88.7	19.9	167.4	0	0	0	0	0	111.9
708	L	93.6	Very high	91.6	Very high	35 Å²	35	46.5 Å²	46.5	18%	0.183	26%	0.255	C	S	.	.	S	Bend	trans	-92.6	157.2	-172	-56.7	176.1	0	0	0	110.4	N621 V624 D674 F702 S706 V710	N621-L708 WeakPolarHBondContact O-CD2 3.34Å; V624-L708 HydrophobicContact CG1-CD1 4.03Å; D674-L708 HydrophobicContact CB-CD1 3.62Å; F702-L708 HydrophobicContact CD1-CD1 4.28Å; F702-L708 HydrophobicContact CE1-CD1 4.28Å; S706-L708 PolarHBondContact O-N 3.12Å; S706-L708 WeakPolarHBondContact OG-CB 3.15Å; S706-L708 PolarHBondContact OG-N 3Å; L708-V710 PolarHBondContact O-N 3.41Å
709	H	92.9	Very high	91.5	Very high	101 Å²	101	47.7 Å²	47.7	47%	0.468	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	115.3	169.5	-176.6	-116.2	0	0	0	109.6	W622 Q623 V624 F711	W622-H709 PolarHBondContact O-N 3.39Å; Q623-H709 VanDerWaalsContact CA-O 3.25Å; Q623-H709 WeakPolarHBondContact CA-O 3.26Å; Q623-H709 HydrophobicContact CB-CB 4.27Å; Q623-H709 HydrophobicContact CG-CB 4.33Å; Q623-H709 WeakPolarHBondContact CG-O 3.2Å; Q623-H709 PolarHBondContact OE1-ND1 3.38Å; V624-H709 PolarHBondContact N-O 2.79Å; H709-F711 PolarHBondContact O-N 3.18Å
710	V	95.1	Very high	91.4	Very high	35 Å²	35	45 Å²	45	21%	0.212	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	98.8	176.1	-175.9	0	0	0	0	108.4	V624 F626 Y699 F702 V703 L708	V624-V710 HydrophobicContact CG2-CB 4.17Å; V624-V710 HydrophobicContact CG2-CG1 4.13Å; V624-V710 HydrophobicContact CG2-CG2 3.89Å; F626-V710 HydrophobicContact CD2-CG1 3.81Å; F626-V710 HydrophobicContact CE2-CG1 4.05Å; Y699-V710 HydrophobicContact CD2-CG1 3.98Å; Y699-V710 HydrophobicContact CE2-CG1 3.62Å; F702-V710 HydrophobicContact CB-CG2 3.95Å; V703-V710 HydrophobicContact CG2-CB 4.43Å; V703-V710 HydrophobicContact CG2-CG1 4.22Å; V703-V710 HydrophobicContact CG2-CG2 4.13Å; L708-V710 PolarHBondContact O-N 3.41Å
711	F	93.9	Very high	91.3	Very high	66 Å²	66	47.7 Å²	47.7	29%	0.289	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	111.8	-178.7	-179.3	-131.3	0	0	0	110.6	N617 Q623 V624 F625 F626 H709 A713	N617-F711 HydrophobicContact CB-CD1 4.2Å; N617-F711 HydrophobicContact CB-CE1 4.44Å; Q623-F711 HydrophobicContact CG-CB 3.86Å; V624-F711 PolarHBondContact O-N 2.99Å; F625-F711 CarbonylContact C-O 3.59Å; F625-F711 WeakPolarHBondContact CA-O 3.15Å; F625-F711 AromaticContact CD2-CD1 3.48Å; F625-F711 HydrophobicContact CD2-CD1 3.48Å; F625-F711 VanDerWaalsContact CD2-CD1 3.48Å; F625-F711 AromaticContact CD2-CE1 3.94Å; F625-F711 HydrophobicContact CD2-CE1 3.94Å; F625-F711 HydrophobicContact CD2-CG 4.35Å; F625-F711 AromaticContact CE2-CD1 3.87Å; F625-F711 HydrophobicContact CE2-CD1 3.87Å; F625-F711 AromaticContact CE2-CE1 3.84Å; F625-F711 HydrophobicContact CE2-CE1 3.84Å; F626-F711 PolarHBondContact N-O 3.22Å; H709-F711 PolarHBondContact O-N 3.18Å; F711-A713 HydrophobicContact CE1-CB 4.02Å; F711-A713 HydrophobicContact CE2-CB 3.78Å; F711-A713 HydrophobicContact CZ-CB 3.46Å; F711-A713 VanDerWaalsContact CZ-CB 3.46Å
712	R	93.4	Very high	91.2	Very high	76 Å²	76	49.8 Å²	49.8	29%	0.287	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	120.1	175.9	-169.3	177.2	-169.1	-147.1	1.4	110.3	F626 V628 R662 V664 F665	F626-R712 HydrophobicContact CB-CB 4.23Å; F626-R712 HydrophobicContact CB-CG 4.07Å; F626-R712 VanDerWaalsContact O-CA 3.27Å; F626-R712 WeakPolarHBondContact O-CA 3.05Å; F626-R712 WeakPolarHBondContact O-CG 3.22Å; V628-R712 HydrophobicContact CG2-CG 4.05Å; R662-R712 PolarHBondContact O-NH1 2.93Å; R662-R712 PolarHBondContact O-NH2 2.83Å; V664-R712 PolarHBondContact O-NH2 2.93Å; F665-R712 VanDerWaalsContact CE1-NH1 3.26Å; F665-R712 VanDerWaalsContact CZ-NH2 3.32Å
713	A	89.9	Confident	90.9	Very high	26 Å²	26	50.5 Å²	50.5	22%	0.215	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	154.2	-175	0	0	0	0	0	112.7	F625 F626 P627 V628 F711 E715	F625-A713 HydrophobicContact CE2-CB 4.47Å; F626-A713 PolarHBondContact O-N 3.4Å; P627-A713 CarbonylContact C-O 3.55Å; P627-A713 WeakPolarHBondContact CA-O 3.39Å; V628-A713 PolarHBondContact N-O 2.93Å; F711-A713 HydrophobicContact CE1-CB 4.02Å; F711-A713 HydrophobicContact CE2-CB 3.78Å; F711-A713 HydrophobicContact CZ-CB 3.46Å; F711-A713 VanDerWaalsContact CZ-CB 3.46Å; A713-E715 PolarHBondContact O-N 3.21Å
714	V	91.6	Very high	90.7	Very high	72 Å²	72	56.7 Å²	56.7	44%	0.436	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	128.6	172.3	173.6	0	0	0	0	110	V628 F660	V628-V714 HydrophobicContact CB-CG2 4.43Å; V628-V714 HydrophobicContact CG1-CG2 4.49Å; F660-V714 HydrophobicContact CB-CG1 4.47Å; F660-V714 HydrophobicContact CB-CG2 4.42Å; F660-V714 HydrophobicContact CD1-CB 4.5Å; F660-V714 HydrophobicContact CD1-CG1 3.35Å; F660-V714 HydrophobicContact CD2-CG1 3.79Å; F660-V714 HydrophobicContact CE1-CG1 3.26Å; F660-V714 HydrophobicContact CE2-CG1 3.72Å; F660-V714 HydrophobicContact CG-CG1 3.6Å; F660-V714 HydrophobicContact CG-CG2 4.36Å; F660-V714 HydrophobicContact CZ-CG1 3.45Å; F660-V714 VanDerWaalsContact CZ-CG1 3.45Å
715	E	91.3	Very high	90.5	Very high	16 Å²	16	51.5 Å²	51.5	8%	0.075	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	98.4	-179	-177.2	44.8	-103.8	0	0	110.7	F610 R613 P627 V628 A713 A717 L718	F610-E715 HydrophobicContact CD2-CG 3.51Å; F610-E715 HydrophobicContact CE2-CG 3.88Å; R613-E715 WeakPolarHBondContact CG-OE2 3.47Å; P627-E715 HydrophobicContact CB-CB 3.89Å; P627-E715 HydrophobicContact CB-CG 4.43Å; V628-E715 PolarHBondContact O-N 2.9Å; A713-E715 PolarHBondContact O-N 3.21Å; E715-A717 PolarHBondContact O-N 2.83Å; E715-A717 WeakPolarHBondContact OE1-CB 3.4Å; E715-A717 PolarHBondContact OE1-N 3.41Å; E715-L718 HydrophobicContact CB-CB 4.11Å; E715-L718 HydrophobicContact CG-CB 3.82Å; E715-L718 PolarHBondContact O-N 3.06Å; E715-L718 VanDerWaalsContact O-N 3.12Å
716	P	86.9	Confident	90.3	Very high	89 Å²	89	53.7 Å²	53.7	58%	0.578	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.6	-27.3	-177.2	-23.6	34.4	0	0	0	114.3	L718	P716-L718 VanDerWaalsContact C-N 3.3Å
717	A	87.4	Confident	90.3	Very high	18 Å²	18	54.1 Å²	54.1	15%	0.149	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-15.3	179.4	0	0	0	0	0	113	N607 D609 F610 E715	N607-A717 PolarHBondContact ND2-O 3.21Å; D609-A717 HydrophobicContact CB-CB 3.98Å; F610-A717 HydrophobicContact CB-CB 4.17Å; E715-A717 PolarHBondContact O-N 2.83Å; E715-A717 WeakPolarHBondContact OE1-CB 3.4Å; E715-A717 PolarHBondContact OE1-N 3.41Å
718	L	91.1	Very high	90	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	102.7	179	-172.6	66.4	0	0	0	109.6	F598 T604 F610 P627 H629 F630 E667 E715 P716	F598-L718 HydrophobicContact CZ-CD1 4.1Å; T604-L718 HydrophobicContact CG2-CD1 3.37Å; T604-L718 HydrophobicContact CG2-CG 4.29Å; F610-L718 HydrophobicContact CD1-CD1 3.98Å; F610-L718 HydrophobicContact CD2-CB 3.69Å; F610-L718 HydrophobicContact CD2-CD1 3.89Å; F610-L718 HydrophobicContact CD2-CD2 4.37Å; F610-L718 HydrophobicContact CD2-CG 4.2Å; F610-L718 HydrophobicContact CE1-CD1 3.98Å; F610-L718 HydrophobicContact CE2-CB 3.96Å; F610-L718 HydrophobicContact CE2-CD1 3.86Å; F610-L718 HydrophobicContact CE2-CD2 3.77Å; F610-L718 HydrophobicContact CE2-CG 4.09Å; F610-L718 HydrophobicContact CG-CB 4.32Å; F610-L718 HydrophobicContact CG-CD1 3.94Å; F610-L718 HydrophobicContact CZ-CD1 3.91Å; F610-L718 HydrophobicContact CZ-CD2 4.1Å; P627-L718 HydrophobicContact CB-CD2 3.66Å; P627-L718 HydrophobicContact CG-CD2 3.61Å; H629-L718 CarbonylContact C-O 3.57Å; H629-L718 WeakPolarHBondContact CA-O 3.39Å; H629-L718 HydrophobicContact CB-CB 4.23Å; H629-L718 HydrophobicContact CB-CD2 3.66Å; H629-L718 HydrophobicContact CB-CG 3.67Å; H629-L718 WeakPolarHBondContact CB-O 3.47Å; F630-L718 PolarHBondContact N-O 2.99Å; E667-L718 HydrophobicContact CB-CD2 4.22Å; E667-L718 HydrophobicContact CG-CD2 4.28Å; E715-L718 HydrophobicContact CB-CB 4.11Å; E715-L718 HydrophobicContact CG-CB 3.82Å; E715-L718 PolarHBondContact O-N 3.06Å; E715-L718 VanDerWaalsContact O-N 3.12Å; P716-L718 VanDerWaalsContact C-N 3.3Å
719	I	91.1	Very high	89.5	Confident	26 Å²	26	55.8 Å²	55.8	13%	0.133	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	136.2	-177.1	-54.4	170.4	0	0	0	109.7	E605 F630 E632	E605-I719 PolarHBondContact N-O 3.08Å; F630-I719 HydrophobicContact CD1-CG2 4.4Å; F630-I719 WeakPolarHBondContact O-CA 3.33Å; E632-I719 HydrophobicContact CG-CG2 4.45Å
720	Q	90.9	Very high	88.9	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.009	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	128.5	172.7	-160.8	177.5	19.9	0	0	110	S601 W603 H629 F630 Q631 E632	S601-Q720 PolarHBondContact OG-NE2 2.66Å; W603-Q720 HydrophobicContact CB-CG 3.57Å; W603-Q720 WeakPolarHBondContact O-CA 3.27Å; H629-Q720 WeakPolarHBondContact CD2-CB 3.38Å; H629-Q720 PolarHBondContact CD2-OE1 3.4Å; H629-Q720 PolarHBondContact CE1-OE1 2.95Å; H629-Q720 VanDerWaalsContact CE1-OE1 3.28Å; H629-Q720 PolarHBondContact NE2-OE1 3.08Å; F630-Q720 PolarHBondContact O-N 3.43Å; Q631-Q720 PolarHBondContact NE2-O 3.38Å; E632-Q720 PolarHBondContact N-O 3.02Å
721	K	89.1	Confident	88.2	Confident	81 Å²	81	59.5 Å²	59.5	35%	0.352	30%	0.301	S	S	.	.			trans	-65.2	154.5	172.6	-68.3	-176.8	179.4	174.7	0	110.6	W603 E605 Q631 V723	W603-K721 PolarHBondContact O-N 2.78Å; E605-K721 WeakPolarHBondContact OE1-CE 3.03Å; Q631-K721 VanDerWaalsContact NE2-C 3.26Å; Q631-K721 PolarHBondContact NE2-O 2.96Å; K721-V723 PolarHBondContact O-N 3.17Å
722	Y	89.8	Confident	87.7	Confident	45 Å²	45	57.8 Å²	57.8	18%	0.176	30%	0.298	C	S	.	.			trans	-54.9	124.1	177	174.2	-102.6	0	0	0	111.6	Q631 F633 N634 S746	Q631-Y722 VanDerWaalsContact NE2-CA 3.32Å; F633-Y722 WeakPolarHBondContact O-CB 3.4Å; N634-Y722 VanDerWaalsContact CA-CD2 3.49Å; N634-Y722 HydrophobicContact CB-CD1 4.22Å; N634-Y722 HydrophobicContact CB-CD2 3.91Å; N634-Y722 HydrophobicContact CB-CE1 3.87Å; N634-Y722 HydrophobicContact CB-CE2 3.55Å; N634-Y722 HydrophobicContact CB-CG 4.23Å; N634-Y722 VanDerWaalsContact CG-CZ 3.5Å; N634-Y722 VanDerWaalsContact N-CD2 3.34Å; N634-Y722 PolarHBondContact ND2-OH 2.94Å; Y722-S746 WeakPolarHBondContact CE2-O 3.18Å
723	V	88	Confident	87.2	Confident	15 Å²	15	61.1 Å²	61.1	9%	0.091	32%	0.316	C	S	.	.			trans	-136.9	135.4	173.5	59.5	0	0	0	0	109.6	W603 K721 R725	W603-V723 HydrophobicContact CD2-CB 3.85Å; W603-V723 HydrophobicContact CD2-CG1 4.48Å; W603-V723 HydrophobicContact CD2-CG2 3.95Å; W603-V723 VanDerWaalsContact CE2-CG2 3.48Å; W603-V723 HydrophobicContact CE3-CB 4.3Å; W603-V723 HydrophobicContact CG-CB 3.98Å; W603-V723 HydrophobicContact CG-CG1 4.09Å; W603-V723 HydrophobicContact CG-CG2 4.27Å; W603-V723 HydrophobicContact CH2-CG2 4.29Å; W603-V723 HydrophobicContact CZ2-CB 4.41Å; W603-V723 HydrophobicContact CZ2-CG2 3.7Å; K721-V723 PolarHBondContact O-N 3.17Å; V723-R725 HydrophobicContact CG1-CG 4.11Å; V723-R725 HydrophobicContact CG2-CG 4.47Å
724	R	88.5	Confident	86.9	Confident	203 Å²	203	65.6 Å²	65.6	77%	0.766	34%	0.336	S	S	*	.			trans	-93.3	106.7	168.4	-174.3	178.4	-179	179.5	1.4	109
725	R	86.8	Confident	86.6	Confident	44 Å²	44	63.8 Å²	63.8	17%	0.166	32%	0.324	C	S	.	.			trans	-79.8	140.1	-175.3	-56.9	175.6	-175.7	-154.8	-0.7	110.9	V664 D666 V723 C727 N743	V664-R725 VanDerWaalsContact CG2-NH1 3.26Å; D666-R725 IonicContact OD2-CZ 2.92Å; D666-R725 IonicContact OD2-NH1 3.42Å; D666-R725 PolarHBondContact OD2-NH1 3.39Å; V723-R725 HydrophobicContact CG1-CG 4.11Å; V723-R725 HydrophobicContact CG2-CG 4.47Å; R725-C727 PolarHBondContact O-N 2.91Å; R725-N743 PolarHBondContact N-OD1 3.29Å; R725-N743 PolarHBondContact O-ND2 2.92Å
726	A	86.1	Confident	86.4	Confident	81 Å²	81	67.1 Å²	67.1	67%	0.669	34%	0.337	S	S	*	.			trans	-79	100.1	172.9	0	0	0	0	0	110.3	N728	A726-N728 PolarHBondContact O-N 2.75Å
727	C	88.6	Confident	86.5	Confident	29 Å²	29	67.4 Å²	67.4	20%	0.196	33%	0.33	C	S	.	.			trans	-73	112.1	179.2	-54.7	0	0	0	0	110.7	R725 P729 Y736 C739 V740 N743	R725-C727 PolarHBondContact O-N 2.91Å; C727-P729 WeakPolarHBondContact O-CD 3.29Å; C727-Y736 HydrophobicContact CB-CD2 3.95Å; C727-Y736 HydrophobicContact CB-CE2 3.8Å; C727-C739 WeakPolarHBondContact CA-SG 3.48Å; C727-C739 HydrophobicContact CB-CB 3.84Å; C727-C739 WeakPolarHBondContact CB-SG 3.03Å; C727-C739 WeakPolarHBondContact SG-CB 3.4Å; C727-C739 CovalentContact SG-SG 2.05Å; C727-C739 PolarHBondContact SG-SG 2.95Å; C727-V740 HydrophobicContact CB-CG2 4.17Å; C727-V740 PolarHBondContact SG-N 3.29Å; C727-N743 PolarHBondContact SG-ND2 2.97Å
728	N	83.8	Confident	86.6	Confident	45 Å²	45	68.9 Å²	68.9	24%	0.241	33%	0.332	C	S	.	.			trans	-82.6	118.7	-176.9	-175.4	-8.2	0	0	0	110.8	A726 R730 F731	A726-N728 PolarHBondContact O-N 2.75Å; N728-R730 PolarHBondContact O-N 3.23Å; N728-R730 WeakPolarHBondContact OD1-CB 3.31Å; N728-R730 WeakPolarHBondContact OD1-CG 3.49Å; N728-R730 PolarHBondContact OD1-N 3.24Å; N728-F731 HydrophobicContact CB-CD2 3.67Å; N728-F731 HydrophobicContact CB-CE2 3.68Å; N728-F731 PolarHBondContact O-N 3.37Å
729	P	83.2	Confident	86.6	Confident	102 Å²	102	70.1 Å²	70.1	66%	0.662	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-4.8	-179.2	31.7	-37.3	0	0	0	113.8	C727 F731 Y736	C727-P729 WeakPolarHBondContact O-CD 3.29Å; P729-F731 VanDerWaalsContact C-N 3.34Å; P729-Y736 HydrophobicContact CB-CD2 4.47Å; P729-Y736 HydrophobicContact CB-CE2 4.28Å
730	R	80.3	Confident	86.7	Confident	166 Å²	166	71 Å²	71	63%	0.626	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-15.9	174.1	-64.1	-173.4	177.3	-173.2	-0.8	113.5	N728	N728-R730 PolarHBondContact O-N 3.23Å; N728-R730 WeakPolarHBondContact OD1-CB 3.31Å; N728-R730 WeakPolarHBondContact OD1-CG 3.49Å; N728-R730 PolarHBondContact OD1-N 3.24Å
731	F	80.9	Confident	86.7	Confident	48 Å²	48	74.5 Å²	74.5	21%	0.211	37%	0.365	C	S	.	.	S	Bend	trans	-76.3	170.6	174	-66	-50.8	0	0	0	111.3	V577 N728 P729 I735	V577-F731 HydrophobicContact CG1-CD1 4.38Å; V577-F731 HydrophobicContact CG1-CE1 3.58Å; V577-F731 HydrophobicContact CG1-CZ 3.89Å; N728-F731 HydrophobicContact CB-CD2 3.67Å; N728-F731 HydrophobicContact CB-CE2 3.68Å; N728-F731 PolarHBondContact O-N 3.37Å; P729-F731 VanDerWaalsContact C-N 3.34Å; F731-I735 HydrophobicContact CB-CB 4.05Å; F731-I735 HydrophobicContact CB-CG2 3.84Å; F731-I735 HydrophobicContact CD2-CG2 4.14Å; F731-I735 HydrophobicContact CG-CG2 4.14Å
732	S	82.8	Confident	86.8	Confident	30 Å²	30	70.8 Å²	70.8	21%	0.21	35%	0.349	C	S	.	.			trans	-56.5	150.5	174.6	60.7	0	0	0	0	111.6	S695 D734 I735 Y736	S695-S732 PolarHBondContact O-OG 3.23Å; S732-D734 PolarHBondContact O-N 3.26Å; S732-I735 PolarHBondContact O-N 3.43Å; S732-I735 WeakPolarHBondContact OG-CD1 3.22Å; S732-I735 VanDerWaalsContact OG-CG1 3.28Å; S732-I735 WeakPolarHBondContact OG-CG1 3.13Å; S732-Y736 PolarHBondContact O-N 2.85Å
733	E	83.9	Confident	86.9	Confident	146 Å²	146	69.8 Å²	69.8	68%	0.682	35%	0.347	S	S	*	.	H	α-helix	trans	-51.7	-42	179	-178.1	169.7	-167.3	0	0	111.1	Y736 H737	E733-Y736 PolarHBondContact O-N 3.35Å; E733-H737 VanDerWaalsContact CG-CD2 3.49Å; E733-H737 WeakPolarHBondContact CG-CD2 3.32Å; E733-H737 WeakPolarHBondContact O-CB 3.17Å; E733-H737 PolarHBondContact O-CD2 2.9Å; E733-H737 PolarHBondContact O-N 3.28Å; E733-H737 IonicContact OE1-NE2 3.89Å
734	D	83.4	Confident	87	Confident	119 Å²	119	73.7 Å²	73.7	64%	0.636	37%	0.367	S	S	*	.	H	α-helix	trans	-62.5	-46	177	-64.9	-29.4	0	0	0	113.4	S732 Y736 R738	S732-D734 PolarHBondContact O-N 3.26Å; D734-Y736 VanDerWaalsContact C-N 3.35Å; D734-R738 WeakPolarHBondContact O-CB 3.4Å; D734-R738 VanDerWaalsContact O-CG 3.27Å; D734-R738 WeakPolarHBondContact O-CG 3.45Å; D734-R738 PolarHBondContact O-N 2.81Å; D734-R738 PolarHBondContact O-NE 3.31Å
735	I	84.7	Confident	87	Confident	35 Å²	35	68 Å²	68	18%	0.179	35%	0.349	C	S	.	.	H	α-helix	trans	-64.5	-43.4	177.5	-69.8	169.8	0	0	0	110.2	S695 F731 S732 R738 C739	S695-I735 WeakPolarHBondContact O-CD1 3.47Å; F731-I735 HydrophobicContact CB-CB 4.05Å; F731-I735 HydrophobicContact CB-CG2 3.84Å; F731-I735 HydrophobicContact CD2-CG2 4.14Å; F731-I735 HydrophobicContact CG-CG2 4.14Å; S732-I735 PolarHBondContact O-N 3.43Å; S732-I735 WeakPolarHBondContact OG-CD1 3.22Å; S732-I735 VanDerWaalsContact OG-CG1 3.28Å; S732-I735 WeakPolarHBondContact OG-CG1 3.13Å; I735-R738 PolarHBondContact O-N 3.48Å; I735-C739 PolarHBondContact O-N 3Å
736	Y	87.6	Confident	87.2	Confident	86 Å²	86	66 Å²	66	34%	0.337	34%	0.341	S	S	.	.	H	α-helix	trans	-61.7	-48.9	179.1	178.7	-98.7	0	0	0	111.5	C727 P729 S732 E733 D734 R738 C739 V740	C727-Y736 HydrophobicContact CB-CD2 3.95Å; C727-Y736 HydrophobicContact CB-CE2 3.8Å; P729-Y736 HydrophobicContact CB-CD2 4.47Å; P729-Y736 HydrophobicContact CB-CE2 4.28Å; S732-Y736 PolarHBondContact O-N 2.85Å; E733-Y736 PolarHBondContact O-N 3.35Å; D734-Y736 VanDerWaalsContact C-N 3.35Å; Y736-R738 PolarHBondContact O-N 2.94Å; Y736-C739 WeakPolarHBondContact O-CB 3.38Å; Y736-C739 PolarHBondContact O-N 3.31Å; Y736-V740 HydrophobicContact CD1-CG2 4.32Å; Y736-V740 HydrophobicContact CE1-CG2 3.89Å; Y736-V740 HydrophobicContact CE2-CG2 4.31Å; Y736-V740 WeakPolarHBondContact O-CG2 3.32Å; Y736-V740 PolarHBondContact O-N 3.07Å
737	H	88.8	Confident	87.4	Confident	94 Å²	94	64.8 Å²	64.8	44%	0.435	32%	0.324	S	S	.	.	H	α-helix	trans	-63	-41.9	178.3	-83.5	-68.7	0	0	0	112.5	E733 C739 V740 L741	E733-H737 VanDerWaalsContact CG-CD2 3.49Å; E733-H737 WeakPolarHBondContact CG-CD2 3.32Å; E733-H737 WeakPolarHBondContact O-CB 3.17Å; E733-H737 PolarHBondContact O-CD2 2.9Å; E733-H737 PolarHBondContact O-N 3.28Å; E733-H737 IonicContact OE1-NE2 3.89Å; H737-C739 VanDerWaalsContact C-N 3.33Å; H737-C739 PolarHBondContact O-N 3.31Å; H737-V740 PolarHBondContact O-N 3.41Å; H737-L741 WeakPolarHBondContact O-CB 3.23Å; H737-L741 WeakPolarHBondContact O-CG 3.44Å; H737-L741 PolarHBondContact O-N 3.49Å
738	R	90.1	Very high	87.3	Confident	50 Å²	50	63.7 Å²	63.7	19%	0.189	32%	0.317	C	S	.	.	H	α-helix	trans	-56.6	-46	174	-77.5	-173.4	-73.5	168.7	-1.7	111.8	H663 D697 D734 I735 Y736 V740 L741 S742	H663-R738 HydrophobicContact CB-CB 4.31Å; D697-R738 IonicContact OD2-CZ 2.72Å; D697-R738 IonicContact OD2-NH1 3.18Å; D697-R738 PolarHBondContact OD2-NH1 2.9Å; D697-R738 IonicContact OD2-NH2 3.38Å; D697-R738 PolarHBondContact OD2-NH2 3.11Å; D734-R738 WeakPolarHBondContact O-CB 3.4Å; D734-R738 VanDerWaalsContact O-CG 3.27Å; D734-R738 WeakPolarHBondContact O-CG 3.45Å; D734-R738 PolarHBondContact O-N 2.81Å; D734-R738 PolarHBondContact O-NE 3.31Å; I735-R738 PolarHBondContact O-N 3.48Å; Y736-R738 PolarHBondContact O-N 2.94Å; R738-V740 PolarHBondContact O-N 2.91Å; R738-L741 PolarHBondContact O-N 3.28Å; R738-S742 WeakPolarHBondContact O-CB 3.39Å; R738-S742 PolarHBondContact O-N 2.98Å
739	C	90.9	Very high	87.3	Confident	26 Å²	26	63.1 Å²	63.1	18%	0.176	32%	0.316	C	S	.	.	H	α-helix	trans	-62	-43.4	177.1	175.9	0	0	0	0	112.6	C727 I735 Y736 H737 N743	C727-C739 WeakPolarHBondContact CA-SG 3.48Å; C727-C739 HydrophobicContact CB-CB 3.84Å; C727-C739 WeakPolarHBondContact CB-SG 3.03Å; C727-C739 WeakPolarHBondContact SG-CB 3.4Å; C727-C739 CovalentContact SG-SG 2.05Å; C727-C739 PolarHBondContact SG-SG 2.95Å; I735-C739 PolarHBondContact O-N 3Å; Y736-C739 WeakPolarHBondContact O-CB 3.38Å; Y736-C739 PolarHBondContact O-N 3.31Å; H737-C739 VanDerWaalsContact C-N 3.33Å; H737-C739 PolarHBondContact O-N 3.31Å; C739-N743 PolarHBondContact O-N 3.48Å; C739-N743 VanDerWaalsContact O-N 3.07Å; C739-N743 PolarHBondContact O-ND2 3.45Å
740	V	92.1	Very high	87.3	Confident	43 Å²	43	69.3 Å²	69.3	26%	0.261	33%	0.327	S	S	.	.	H	α-helix	trans	-64.5	-43.6	178.5	173.3	0	0	0	0	110.7	C727 Y736 H737 R738 N743 L744	C727-V740 HydrophobicContact CB-CG2 4.17Å; C727-V740 PolarHBondContact SG-N 3.29Å; Y736-V740 HydrophobicContact CD1-CG2 4.32Å; Y736-V740 HydrophobicContact CE1-CG2 3.89Å; Y736-V740 HydrophobicContact CE2-CG2 4.31Å; Y736-V740 WeakPolarHBondContact O-CG2 3.32Å; Y736-V740 PolarHBondContact O-N 3.07Å; H737-V740 PolarHBondContact O-N 3.41Å; R738-V740 PolarHBondContact O-N 2.91Å; V740-N743 PolarHBondContact O-N 3.1Å; V740-L744 HydrophobicContact CG1-CD1 4.01Å; V740-L744 HydrophobicContact CG1-CG 4.49Å; V740-L744 VanDerWaalsContact O-CG 3.29Å; V740-L744 WeakPolarHBondContact O-CG 3.43Å; V740-L744 PolarHBondContact O-N 2.91Å
741	L	90.9	Very high	87.2	Confident	76 Å²	76	64.9 Å²	64.9	40%	0.398	32%	0.321	S	S	.	.	H	α-helix	trans	-63.3	-46.7	177.9	-71.9	172.7	0	0	0	112.2	H737 R738 N743 L744 E745	H737-L741 WeakPolarHBondContact O-CB 3.23Å; H737-L741 WeakPolarHBondContact O-CG 3.44Å; H737-L741 PolarHBondContact O-N 3.49Å; R738-L741 PolarHBondContact O-N 3.28Å; L741-N743 VanDerWaalsContact C-N 3.32Å; L741-N743 PolarHBondContact O-N 3.42Å; L741-L744 PolarHBondContact O-N 3.24Å; L741-E745 PolarHBondContact O-N 2.64Å
742	S	91.4	Very high	87.3	Confident	3 Å²	3	64.3 Å²	64.3	2%	0.021	32%	0.319	C	S	.	.	H	α-helix	trans	-53.6	-47.2	173.6	164.5	0	0	0	0	111.9	D661 R738 L744 E745 S746	D661-S742 VanDerWaalsContact OD2-CB 3.27Å; D661-S742 WeakPolarHBondContact OD2-CB 3.49Å; D661-S742 PolarHBondContact OD2-OG 3.49Å; R738-S742 WeakPolarHBondContact O-CB 3.39Å; R738-S742 PolarHBondContact O-N 2.98Å; S742-L744 VanDerWaalsContact C-N 3.3Å; S742-L744 PolarHBondContact O-N 2.96Å; S742-E745 PolarHBondContact O-N 2.95Å; S742-S746 WeakPolarHBondContact O-CB 3.49Å; S742-S746 PolarHBondContact O-N 3.38Å; S742-S746 PolarHBondContact O-OG 3.41Å
743	N	92.3	Very high	87.4	Confident	24 Å²	24	65.8 Å²	65.8	13%	0.128	32%	0.324	C	S	.	.	H	α-helix	trans	-63.7	-30.9	176.6	-83.8	-32.1	0	0	0	113.8	R725 C727 C739 V740 L741 S746	R725-N743 PolarHBondContact N-OD1 3.29Å; R725-N743 PolarHBondContact O-ND2 2.92Å; C727-N743 PolarHBondContact SG-ND2 2.97Å; C739-N743 PolarHBondContact O-N 3.48Å; C739-N743 VanDerWaalsContact O-N 3.07Å; C739-N743 PolarHBondContact O-ND2 3.45Å; V740-N743 PolarHBondContact O-N 3.1Å; L741-N743 VanDerWaalsContact C-N 3.32Å; L741-N743 PolarHBondContact O-N 3.42Å; N743-S746 PolarHBondContact O-OG 2.93Å; N743-S746 VanDerWaalsContact O-OG 3.1Å
744	L	89.9	Confident	87.5	Confident	97 Å²	97	60.6 Å²	60.6	51%	0.508	31%	0.307	S	S	.	.	H	α-helix	trans	-78.2	-42.4	178.7	-71.6	170.8	0	0	0	111.4	V740 L741 S742 S746 L747	V740-L744 HydrophobicContact CG1-CD1 4.01Å; V740-L744 HydrophobicContact CG1-CG 4.49Å; V740-L744 VanDerWaalsContact O-CG 3.29Å; V740-L744 WeakPolarHBondContact O-CG 3.43Å; V740-L744 PolarHBondContact O-N 2.91Å; L741-L744 PolarHBondContact O-N 3.24Å; S742-L744 VanDerWaalsContact C-N 3.3Å; S742-L744 PolarHBondContact O-N 2.96Å; L744-S746 VanDerWaalsContact C-N 3.28Å; L744-S746 PolarHBondContact O-N 3.47Å; L744-L747 HydrophobicContact CD2-CD1 4.3Å; L744-L747 WeakPolarHBondContact O-CB 3.32Å; L744-L747 PolarHBondContact O-N 3.22Å
745	E	89.4	Confident	87.4	Confident	83 Å²	83	59.6 Å²	59.6	39%	0.388	30%	0.299	S	S	.	.	H	α-helix	trans	-66.4	-31.9	177.3	-70	-177.5	-174.4	0	0	111.6	F633 H659 H663 L741 S742 L747	F633-E745 WeakPolarHBondContact CD1-O 3.44Å; F633-E745 VanDerWaalsContact CE1-O 3.25Å; F633-E745 WeakPolarHBondContact CE1-O 3.44Å; H659-E745 IonicContact CD2-OE2 3Å; H659-E745 IonicContact NE2-OE2 3.5Å; H663-E745 IonicContact CD2-OE1 3.88Å; H663-E745 IonicContact CD2-OE2 2.84Å; H663-E745 PolarHBondContact CD2-OE2 3.21Å; H663-E745 IonicContact NE2-OE1 3.65Å; H663-E745 PolarHBondContact NE2-OE1 3.44Å; H663-E745 IonicContact NE2-OE2 2.78Å; H663-E745 PolarHBondContact NE2-OE2 3.42Å; L741-E745 PolarHBondContact O-N 2.64Å; S742-E745 PolarHBondContact O-N 2.95Å; E745-L747 VanDerWaalsContact C-N 3.26Å; E745-L747 PolarHBondContact O-N 3.43Å
746	S	89.6	Confident	87.3	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.014	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-6	177.4	70.6	0	0	0	0	115	F633 N634 Y722 S742 N743 L744 G748	F633-S746 CarbonylContact C-O 3.57Å; F633-S746 WeakPolarHBondContact CA-O 3.04Å; N634-S746 PolarHBondContact N-O 3.03Å; Y722-S746 WeakPolarHBondContact CE2-O 3.18Å; S742-S746 WeakPolarHBondContact O-CB 3.49Å; S742-S746 PolarHBondContact O-N 3.38Å; S742-S746 PolarHBondContact O-OG 3.41Å; N743-S746 PolarHBondContact O-OG 2.93Å; N743-S746 VanDerWaalsContact O-OG 3.1Å; L744-S746 VanDerWaalsContact C-N 3.28Å; L744-S746 PolarHBondContact O-N 3.47Å; S746-G748 PolarHBondContact O-N 3.45Å
747	L	90.2	Very high	87.2	Confident	57 Å²	57	59.7 Å²	59.7	30%	0.298	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-35.5	178.7	-69.7	175.3	0	0	0	113.1	N634 V637 L744 E745 L753	N634-L747 WeakPolarHBondContact CB-O 3.4Å; V637-L747 WeakPolarHBondContact CB-O 3.49Å; V637-L747 WeakPolarHBondContact CG2-O 3.16Å; L744-L747 HydrophobicContact CD2-CD1 4.3Å; L744-L747 WeakPolarHBondContact O-CB 3.32Å; L744-L747 PolarHBondContact O-N 3.22Å; E745-L747 VanDerWaalsContact C-N 3.26Å; E745-L747 PolarHBondContact O-N 3.43Å; L747-L753 HydrophobicContact CB-CD2 4.09Å
748	G	86.8	Confident	86.9	Confident	6 Å²	6	62 Å²	62	6%	0.062	32%	0.317	C	S	.	.			trans	160.7	161.1	-176.1	0	0	0	0	0	112.3	S746 L753	S746-G748 PolarHBondContact O-N 3.45Å; G748-L753 WeakPolarHBondContact O-CD1 2.97Å
749	S	85	Confident	86.3	Confident	32 Å²	32	64 Å²	64	22%	0.224	33%	0.329	C	S	.	.			trans	-63.9	161.4	172.5	78.8	0	0	0	0	111.4	S751 H752 L753	S749-S751 PolarHBondContact O-N 3.36Å; S749-S751 VanDerWaalsContact O-N 3.14Å; S749-S751 PolarHBondContact OG-OG 3.47Å; S749-H752 PolarHBondContact O-N 3.34Å; S749-H752 PolarHBondContact OG-N 3.15Å; S749-H752 PolarHBondContact OG-ND1 2.92Å; S749-L753 PolarHBondContact O-N 2.02Å
750	R	82.4	Confident	85.7	Confident	233 Å²	233	68 Å²	68	88%	0.879	35%	0.345	S	S	*	.	H	α-helix	trans	-54.5	-34.6	177.2	-69.9	-177.4	176	-178.8	-1.1	113	A754	R750-A754 VanDerWaalsContact O-CB 3.23Å; R750-A754 WeakPolarHBondContact O-CB 3.36Å; R750-A754 PolarHBondContact O-N 3.36Å
751	S	78.8	Confident	85	Confident	72 Å²	72	70.7 Å²	70.7	50%	0.503	36%	0.358	S	S	.	.	H	α-helix	trans	-70	-44.9	176.7	52.4	0	0	0	0	111.7	S749 A754 M755	S749-S751 PolarHBondContact O-N 3.36Å; S749-S751 VanDerWaalsContact O-N 3.14Å; S749-S751 PolarHBondContact OG-OG 3.47Å; S751-A754 PolarHBondContact O-N 3.15Å; S751-M755 WeakPolarHBondContact O-CG 3.39Å; S751-M755 PolarHBondContact O-N 3.41Å
752	H	82.3	Confident	84.1	Confident	36 Å²	36	73.5 Å²	73.5	17%	0.167	37%	0.369	C	S	.	.	H	α-helix	trans	-60.8	-46.1	177.6	-68.3	122	0	0	0	111.9	V637 D657 S749 M755 A756	V637-H752 HydrophobicContact CG1-CB 4.3Å; D657-H752 IonicContact OD2-CE1 3.49Å; D657-H752 PolarHBondContact OD2-CE1 3.38Å; D657-H752 IonicContact OD2-NE2 3.95Å; S749-H752 PolarHBondContact O-N 3.34Å; S749-H752 PolarHBondContact OG-N 3.15Å; S749-H752 PolarHBondContact OG-ND1 2.92Å; H752-M755 PolarHBondContact O-N 3.04Å; H752-A756 PolarHBondContact O-N 3.44Å
753	L	85.9	Confident	83.2	Confident	61 Å²	61	76.2 Å²	76.2	32%	0.319	39%	0.392	S	S	.	.	H	α-helix	trans	-67.2	-38.2	178.8	-63.4	174.3	0	0	0	112.4	V637 L747 G748 S749 A756 L757	V637-L753 HydrophobicContact CG1-CD2 4.31Å; L747-L753 HydrophobicContact CB-CD2 4.09Å; G748-L753 WeakPolarHBondContact O-CD1 2.97Å; S749-L753 PolarHBondContact O-N 2.02Å; L753-A756 PolarHBondContact O-N 2.93Å; L753-L757 WeakPolarHBondContact O-CG 3.16Å; L753-L757 PolarHBondContact O-N 2.58Å
754	A	84.4	Confident	82.3	Confident	38 Å²	38	80.8 Å²	80.8	31%	0.314	42%	0.416	S	S	.	.	H	α-helix	trans	-62.9	-43.8	175.4	0	0	0	0	0	111.6	R750 S751 L757 F758	R750-A754 VanDerWaalsContact O-CB 3.23Å; R750-A754 WeakPolarHBondContact O-CB 3.36Å; R750-A754 PolarHBondContact O-N 3.36Å; S751-A754 PolarHBondContact O-N 3.15Å; A754-L757 PolarHBondContact O-N 3Å; A754-F758 HydrophobicContact CB-CE2 4.38Å; A754-F758 WeakPolarHBondContact O-CD2 3.45Å; A754-F758 PolarHBondContact O-N 2.84Å
755	M	82.4	Confident	81	Confident	97 Å²	97	81.2 Å²	81.2	48%	0.478	43%	0.427	S	S	.	.	H	α-helix	trans	-60.5	-46.9	175.7	-70.7	-175.1	-62.9	0	0	111.4	S751 H752 L757 F758 E759	S751-M755 WeakPolarHBondContact O-CG 3.39Å; S751-M755 PolarHBondContact O-N 3.41Å; H752-M755 PolarHBondContact O-N 3.04Å; M755-L757 VanDerWaalsContact C-N 3.27Å; M755-L757 PolarHBondContact O-N 3.24Å; M755-F758 PolarHBondContact O-N 3.35Å; M755-E759 WeakPolarHBondContact O-CG 3.29Å; M755-E759 PolarHBondContact O-N 3.08Å
756	A	82.4	Confident	79	Confident	21 Å²	21	85.2 Å²	85.2	17%	0.174	46%	0.457	C	S	.	.	H	α-helix	trans	-59.4	-36.4	177.4	0	0	0	0	0	113.1	H752 L753 Q760	H752-A756 PolarHBondContact O-N 3.44Å; L753-A756 PolarHBondContact O-N 2.93Å; A756-Q760 WeakPolarHBondContact O-CB 3.49Å; A756-Q760 PolarHBondContact O-N 3.12Å
757	L	84.9	Confident	78.5	Confident	102 Å²	102	89.4 Å²	89.4	53%	0.534	48%	0.48	S	S	.	.	H	α-helix	trans	-69.6	-45.9	174.7	-75.9	168.6	0	0	0	112.1	L753 A754 M755 E759 Q760 D761	L753-L757 WeakPolarHBondContact O-CG 3.16Å; L753-L757 PolarHBondContact O-N 2.58Å; A754-L757 PolarHBondContact O-N 3Å; M755-L757 VanDerWaalsContact C-N 3.27Å; M755-L757 PolarHBondContact O-N 3.24Å; L757-E759 VanDerWaalsContact C-N 3.28Å; L757-E759 PolarHBondContact O-N 2.78Å; L757-Q760 PolarHBondContact O-N 2.92Å; L757-D761 PolarHBondContact O-N 2.68Å
758	F	83.4	Confident	77.8	Confident	142 Å²	142	91.1 Å²	91.1	62%	0.623	49%	0.489	S	S	*	.	H	α-helix	trans	-60	-39	178.7	-79.6	-60.7	0	0	0	112.4	A754 M755 D761 Q762	A754-F758 HydrophobicContact CB-CE2 4.38Å; A754-F758 WeakPolarHBondContact O-CD2 3.45Å; A754-F758 PolarHBondContact O-N 2.84Å; M755-F758 PolarHBondContact O-N 3.35Å; F758-D761 PolarHBondContact O-N 3.14Å; F758-Q762 WeakPolarHBondContact O-CG 3.44Å; F758-Q762 PolarHBondContact O-N 3.48Å
759	E	77.4	Confident	77.4	Confident	93 Å²	93	95.8 Å²	95.8	44%	0.435	51%	0.513	S	S	.	.	H	α-helix	trans	-69.4	-39.8	176.6	-72.3	168.8	-175	0	0	112.3	M755 L757 D761 Q762 A763	M755-E759 WeakPolarHBondContact O-CG 3.29Å; M755-E759 PolarHBondContact O-N 3.08Å; L757-E759 VanDerWaalsContact C-N 3.28Å; L757-E759 PolarHBondContact O-N 2.78Å; E759-D761 VanDerWaalsContact C-N 3.32Å; E759-D761 PolarHBondContact O-N 3.09Å; E759-Q762 PolarHBondContact O-N 3.3Å; E759-A763 WeakPolarHBondContact O-CB 3.35Å; E759-A763 PolarHBondContact O-N 3.5Å
760	Q	78.8	Confident	76.9	Confident	111 Å²	111	99.6 Å²	99.6	52%	0.519	53%	0.53	S	S	.	.	H	α-helix	trans	-62.6	-40.7	175	-175.1	175.9	0.2	0	0	111.4	A756 L757 Q762 A763 N764	A756-Q760 WeakPolarHBondContact O-CB 3.49Å; A756-Q760 PolarHBondContact O-N 3.12Å; L757-Q760 PolarHBondContact O-N 2.92Å; Q760-Q762 VanDerWaalsContact C-N 3.34Å; Q760-A763 PolarHBondContact O-N 3.16Å; Q760-N764 WeakPolarHBondContact O-CB 3.05Å; Q760-N764 VanDerWaalsContact O-CG 3.23Å; Q760-N764 PolarHBondContact O-N 2.98Å; Q760-N764 PolarHBondContact O-ND2 2.97Å
761	D	76.9	Confident	76.6	Confident	98 Å²	98	91.3 Å²	91.3	52%	0.524	51%	0.508	S	S	.	.	H	α-helix	trans	-65.6	-36.9	175.2	-77.9	-15	0	0	0	112	L757 F758 E759 S765	L757-D761 PolarHBondContact O-N 2.68Å; F758-D761 PolarHBondContact O-N 3.14Å; E759-D761 VanDerWaalsContact C-N 3.32Å; E759-D761 PolarHBondContact O-N 3.09Å; D761-S765 VanDerWaalsContact O-CB 3.29Å; D761-S765 WeakPolarHBondContact O-CB 3.08Å; D761-S765 PolarHBondContact O-N 3.22Å; D761-S765 VanDerWaalsContact O-N 3.13Å; D761-S765 PolarHBondContact O-OG 3.48Å
762	Q	71.9	Confident	76.4	Confident	136 Å²	136	92.5 Å²	92.5	64%	0.636	51%	0.508	S	S	*	.	H	α-helix	trans	-65.3	-46	173.4	-76.5	-178.7	6	0	0	111.9	F758 E759 Q760 N764 S765 T766	F758-Q762 WeakPolarHBondContact O-CG 3.44Å; F758-Q762 PolarHBondContact O-N 3.48Å; E759-Q762 PolarHBondContact O-N 3.3Å; Q760-Q762 VanDerWaalsContact C-N 3.34Å; Q762-N764 VanDerWaalsContact C-N 3.33Å; Q762-N764 PolarHBondContact O-N 3.01Å; Q762-S765 PolarHBondContact O-N 3.27Å; Q762-S765 VanDerWaalsContact O-N 3.14Å; Q762-T766 PolarHBondContact O-N 3.33Å; Q762-T766 PolarHBondContact O-OG1 3.2Å
763	A	71.9	Confident	76	Confident	60 Å²	60	96.6 Å²	96.6	50%	0.496	53%	0.533	S	S	.	.	H	α-helix	trans	-66.6	-31.8	179.3	0	0	0	0	0	113.2	E759 Q760 S765 T766	E759-A763 WeakPolarHBondContact O-CB 3.35Å; E759-A763 PolarHBondContact O-N 3.5Å; Q760-A763 PolarHBondContact O-N 3.16Å; A763-S765 VanDerWaalsContact C-N 3.32Å; A763-T766 PolarHBondContact O-OG1 3.43Å; A763-T766 VanDerWaalsContact O-OG1 3.05Å
764	N	72.9	Confident	75.2	Confident	120 Å²	120	99.3 Å²	99.3	64%	0.642	55%	0.549	S	S	*	.	H	α-helix	trans	-78.2	-17.9	174.4	-71.7	-24.9	0	0	0	113.1	Q760 Q762	Q760-N764 WeakPolarHBondContact O-CB 3.05Å; Q760-N764 VanDerWaalsContact O-CG 3.23Å; Q760-N764 PolarHBondContact O-N 2.98Å; Q760-N764 PolarHBondContact O-ND2 2.97Å; Q762-N764 VanDerWaalsContact C-N 3.33Å; Q762-N764 PolarHBondContact O-N 3.01Å
765	S	62.9	Low	74.5	Confident	106 Å²	106	104.4 Å²	104.4	74%	0.741	57%	0.569	S	S	*	*	H	α-helix	trans	-92.2	-8.4	179.1	-59.6	0	0	0	0	113.4	D761 Q762 A763	D761-S765 VanDerWaalsContact O-CB 3.29Å; D761-S765 WeakPolarHBondContact O-CB 3.08Å; D761-S765 PolarHBondContact O-N 3.22Å; D761-S765 VanDerWaalsContact O-N 3.13Å; D761-S765 PolarHBondContact O-OG 3.48Å; Q762-S765 PolarHBondContact O-N 3.27Å; Q762-S765 VanDerWaalsContact O-N 3.14Å; A763-S765 VanDerWaalsContact C-N 3.32Å
766	T	47.8	Very low	73.7	Confident	167 Å²	167	105.1 Å²	105.1	100%	1.025	58%	0.577	S	S	*	*			trans	-103.3	0	171.7	52.6	0	0	0	0	110.9	Q762 A763	Q762-T766 PolarHBondContact O-N 3.33Å; Q762-T766 PolarHBondContact O-OG1 3.2Å; A763-T766 PolarHBondContact O-OG1 3.43Å; A763-T766 VanDerWaalsContact O-OG1 3.05Å

Retrieved 766 of 766 residues in 137.2 ms (Link to these results)

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