A0A087XRB6_POEFO Loading...

Hexosyltransferase

AlphaFold DB , UniProt , Accession A0A087XRB6, 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	M	51.7	Low	54.9	Low	234 Å²	234	141.9 Å²	141.9	100%	1.153	69%	0.689	S	S	*	*				0	32.5	0	-126.4	171	-170.6	0	0	114
2	R	52.7	Low	55.3	Low	230 Å²	230	136.7 Å²	136.7	87%	0.868	68%	0.678	S	S	*	*			trans	-131.7	-3.5	176.7	-77.6	-171.6	175.5	178.2	-1.5	115.8
3	F	51.9	Low	55.9	Low	178 Å²	178	133.5 Å²	133.5	78%	0.781	66%	0.664	S	S	*	*	S	Bend	trans	-92.6	-25.3	-179.2	-112.2	-91.5	0	0	0	114.4
4	S	52	Low	56.9	Low	85 Å²	85	125.9 Å²	125.9	59%	0.594	64%	0.637	S	S	*	*	H	α-helix	trans	-72.4	-31.8	-179	48.6	0	0	0	0	113.8
5	V	56.1	Low	58.2	Low	94 Å²	94	123.3 Å²	123.3	57%	0.57	63%	0.632	S	S	*	*	H	α-helix	trans	-72.9	-32.8	-178.7	-178.2	0	0	0	0	112	I7 S8	V5-I7 VanDerWaalsContact C-N 3.32Å; V5-I7 PolarHBondContact O-N 3.18Å; V5-S8 PolarHBondContact O-OG 3.44Å
6	F	54.5	Low	59.4	Low	156 Å²	156	120.6 Å²	120.6	68%	0.684	62%	0.623	S	S	*	*	H	α-helix	trans	-69	-31.7	177.9	-121.3	-90.2	0	0	0	112.5	L10	F6-L10 HydrophobicContact CD1-CD1 4.5Å; F6-L10 PolarHBondContact O-N 2.95Å
7	I	57.7	Low	60.6	Low	105 Å²	105	118.9 Å²	118.9	54%	0.538	62%	0.619	S	S	.	*	H	α-helix	trans	-77.2	-28.5	-178.4	-64.3	172.9	0	0	0	111.9	V5	V5-I7 VanDerWaalsContact C-N 3.32Å; V5-I7 PolarHBondContact O-N 3.18Å
8	S	57.5	Low	61.9	Low	75 Å²	75	118.3 Å²	118.3	52%	0.524	62%	0.616	S	S	.	*	H	α-helix	trans	-72.6	-34.2	175.6	58.8	0	0	0	0	113	V5	V5-S8 PolarHBondContact O-OG 3.44Å
9	V	57.5	Low	62.9	Low	74 Å²	74	114.4 Å²	114.4	45%	0.448	61%	0.606	S	S	.	*	H	α-helix	trans	-72.8	-36.7	178.2	179.7	0	0	0	0	111.7	R11 S12 L13	V9-R11 VanDerWaalsContact C-N 3.26Å; V9-R11 PolarHBondContact O-N 3.21Å; V9-S12 PolarHBondContact O-N 3.46Å; V9-S12 PolarHBondContact O-OG 3.44Å; V9-L13 HydrophobicContact CG1-CD1 3.73Å; V9-L13 PolarHBondContact O-N 3.1Å
10	L	54.9	Low	64.1	Low	119 Å²	119	114 Å²	114	62%	0.623	60%	0.604	S	S	*	*	H	α-helix	trans	-63.9	-29.4	176.1	-111.4	84.9	0	0	0	113.3	F6 G14	F6-L10 HydrophobicContact CD1-CD1 4.5Å; F6-L10 PolarHBondContact O-N 2.95Å; L10-G14 PolarHBondContact O-N 3.24Å
11	R	57.1	Low	64.9	Low	211 Å²	211	111.6 Å²	111.6	80%	0.796	60%	0.596	S	S	*	*	H	α-helix	trans	-71.2	-27.2	-178.1	-90.8	-173.3	168.8	-177.6	-3.3	114.3	V9	V9-R11 VanDerWaalsContact C-N 3.26Å; V9-R11 PolarHBondContact O-N 3.21Å
12	S	59.8	Low	66.5	Low	79 Å²	79	105.2 Å²	105.2	55%	0.552	57%	0.566	S	S	*	*	H	α-helix	trans	-89.9	-34.6	177	53.7	0	0	0	0	113	V9	V9-S12 PolarHBondContact O-N 3.46Å; V9-S12 PolarHBondContact O-OG 3.44Å
13	L	63.2	Low	67.9	Low	95 Å²	95	96.1 Å²	96.1	50%	0.497	54%	0.544	S	S	.	.	H	α-helix	trans	-82.9	-29.2	-179.8	-86.2	137.6	0	0	0	114.1	V9 V16 V17	V9-L13 HydrophobicContact CG1-CD1 3.73Å; V9-L13 PolarHBondContact O-N 3.1Å; L13-V16 PolarHBondContact O-N 3.23Å; L13-V16 VanDerWaalsContact O-N 3.15Å; L13-V17 WeakPolarHBondContact O-CG2 3.48Å; L13-V17 PolarHBondContact O-N 3.19Å
14	G	69.6	Low	69.3	Low	28 Å²	28	94.3 Å²	94.3	29%	0.289	54%	0.536	S	S	.	.	H	α-helix	trans	-51.8	-52.6	-179.7	0	0	0	0	0	114.3	L10 V16 V17 I18	L10-G14 PolarHBondContact O-N 3.24Å; G14-V16 VanDerWaalsContact C-N 3.3Å; G14-V16 PolarHBondContact O-N 2.86Å; G14-V17 PolarHBondContact O-N 2.77Å; G14-I18 WeakPolarHBondContact O-CB 3.27Å; G14-I18 VanDerWaalsContact O-CG1 3.27Å; G14-I18 WeakPolarHBondContact O-CG1 3.48Å; G14-I18 PolarHBondContact O-N 3.5Å
15	P	77.4	Confident	70.5	Confident	87 Å²	87	93.9 Å²	93.9	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-62.4	-34	178.5	-23.5	34.5	0	0	0	113.6	G19	P15-G19 PolarHBondContact O-N 2.98Å
16	V	77.6	Confident	71.4	Confident	80 Å²	80	94.4 Å²	94.4	49%	0.485	53%	0.529	S	S	.	.	H	α-helix	trans	-71.6	-45.6	-179.5	-179.5	0	0	0	0	110.9	L13 G14 G19 I20	L13-V16 PolarHBondContact O-N 3.23Å; L13-V16 VanDerWaalsContact O-N 3.15Å; G14-V16 VanDerWaalsContact C-N 3.3Å; G14-V16 PolarHBondContact O-N 2.86Å; V16-G19 PolarHBondContact O-N 2.8Å; V16-I20 HydrophobicContact CG1-CD1 3.86Å; V16-I20 VanDerWaalsContact O-CG1 3.32Å; V16-I20 WeakPolarHBondContact O-CG1 3.46Å; V16-I20 PolarHBondContact O-N 3.24Å
17	V	79.9	Confident	72.2	Confident	91 Å²	91	90 Å²	90	55%	0.552	52%	0.517	S	S	*	.	H	α-helix	trans	-64.4	-42.1	176.8	175.7	0	0	0	0	110.8	L13 G14 I20 S21	L13-V17 WeakPolarHBondContact O-CG2 3.48Å; L13-V17 PolarHBondContact O-N 3.19Å; G14-V17 PolarHBondContact O-N 2.77Å; V17-I20 PolarHBondContact O-N 3.46Å; V17-S21 WeakPolarHBondContact O-CB 3.39Å; V17-S21 PolarHBondContact O-N 3.43Å; V17-S21 PolarHBondContact O-OG 2.89Å
18	I	83.1	Confident	72.9	Confident	109 Å²	109	90.7 Å²	90.7	56%	0.559	52%	0.522	S	S	*	.	H	α-helix	trans	-61.2	-48.8	174.1	-67.8	167.1	0	0	0	110.1	G14 I20 S21 L22	G14-I18 WeakPolarHBondContact O-CB 3.27Å; G14-I18 VanDerWaalsContact O-CG1 3.27Å; G14-I18 WeakPolarHBondContact O-CG1 3.48Å; G14-I18 PolarHBondContact O-N 3.5Å; I18-I20 PolarHBondContact O-N 3.23Å; I18-S21 PolarHBondContact O-N 3.27Å; I18-S21 PolarHBondContact O-OG 3.45Å; I18-L22 WeakPolarHBondContact O-CB 3.42Å; I18-L22 PolarHBondContact O-N 2.87Å
19	G	81.6	Confident	73.4	Confident	43 Å²	43	92.6 Å²	92.6	44%	0.443	53%	0.525	S	S	.	.	H	α-helix	trans	-59.1	-43.5	178.7	0	0	0	0	0	113.9	P15 V16 L22 G23	P15-G19 PolarHBondContact O-N 2.98Å; V16-G19 PolarHBondContact O-N 2.8Å; G19-L22 PolarHBondContact O-N 3.26Å; G19-G23 PolarHBondContact O-N 3.01Å
20	I	85.8	Confident	73.5	Confident	107 Å²	107	92.4 Å²	92.4	55%	0.549	53%	0.527	S	S	.	.	H	α-helix	trans	-65.1	-44.1	176.1	-68	167.6	0	0	0	110.7	V16 V17 I18 G23 F24	V16-I20 HydrophobicContact CG1-CD1 3.86Å; V16-I20 VanDerWaalsContact O-CG1 3.32Å; V16-I20 WeakPolarHBondContact O-CG1 3.46Å; V16-I20 PolarHBondContact O-N 3.24Å; V17-I20 PolarHBondContact O-N 3.46Å; I18-I20 PolarHBondContact O-N 3.23Å; I20-G23 PolarHBondContact O-N 2.98Å; I20-F24 PolarHBondContact O-N 3.37Å
21	S	81.8	Confident	73.4	Confident	64 Å²	64	90.9 Å²	90.9	45%	0.448	52%	0.523	S	S	.	.	H	α-helix	trans	-64	-42.1	177.6	69.1	0	0	0	0	112.4	V17 I18 F24 T25	V17-S21 WeakPolarHBondContact O-CB 3.39Å; V17-S21 PolarHBondContact O-N 3.43Å; V17-S21 PolarHBondContact O-OG 2.89Å; I18-S21 PolarHBondContact O-N 3.27Å; I18-S21 PolarHBondContact O-OG 3.45Å; S21-F24 PolarHBondContact O-N 3.38Å; S21-T25 WeakPolarHBondContact O-CG2 3.39Å; S21-T25 PolarHBondContact O-N 2.73Å; S21-T25 PolarHBondContact O-OG1 3.14Å
22	L	84.2	Confident	73	Confident	99 Å²	99	85 Å²	85	52%	0.518	51%	0.514	S	S	.	.	H	α-helix	trans	-65.1	-43.7	177.7	-151.1	94.6	0	0	0	110.9	I18 G19 T25 L26	I18-L22 WeakPolarHBondContact O-CB 3.42Å; I18-L22 PolarHBondContact O-N 2.87Å; G19-L22 PolarHBondContact O-N 3.26Å; L22-T25 WeakPolarHBondContact CA-OG1 3.44Å; L22-T25 PolarHBondContact O-N 3.06Å; L22-T25 PolarHBondContact O-OG1 3.32Å; L22-L26 HydrophobicContact CD2-CD1 4.06Å; L22-L26 HydrophobicContact CG-CD1 4.32Å; L22-L26 WeakPolarHBondContact O-CB 3.45Å; L22-L26 PolarHBondContact O-N 2.91Å
23	G	82.5	Confident	72.2	Confident	39 Å²	39	92.5 Å²	92.5	40%	0.402	53%	0.53	S	S	.	.	H	α-helix	trans	-59.9	-43.5	175.4	0	0	0	0	0	112.9	G19 I20 L26 S27	G19-G23 PolarHBondContact O-N 3.01Å; I20-G23 PolarHBondContact O-N 2.98Å; G23-L26 PolarHBondContact O-N 3.36Å; G23-S27 VanDerWaalsContact O-CB 3.3Å; G23-S27 WeakPolarHBondContact O-CB 3.41Å; G23-S27 PolarHBondContact O-N 3.43Å
24	F	80.9	Confident	71.2	Confident	140 Å²	140	93.5 Å²	93.5	61%	0.614	54%	0.54	S	S	*	.	H	α-helix	trans	-63.5	-42.1	174.1	-112.1	-84.1	0	0	0	112.3	I20 S21 S27 L28	I20-F24 PolarHBondContact O-N 3.37Å; S21-F24 PolarHBondContact O-N 3.38Å; F24-S27 PolarHBondContact O-N 3.39Å; F24-L28 WeakPolarHBondContact O-CB 3.46Å; F24-L28 WeakPolarHBondContact O-CG 3.48Å; F24-L28 PolarHBondContact O-N 3.06Å
25	T	77.4	Confident	69.5	Low	76 Å²	76	100.5 Å²	100.5	47%	0.466	57%	0.565	S	S	.	*	H	α-helix	trans	-67.4	-38.3	177.5	54.4	0	0	0	0	113.2	S21 L22 L29	S21-T25 WeakPolarHBondContact O-CG2 3.39Å; S21-T25 PolarHBondContact O-N 2.73Å; S21-T25 PolarHBondContact O-OG1 3.14Å; L22-T25 WeakPolarHBondContact CA-OG1 3.44Å; L22-T25 PolarHBondContact O-N 3.06Å; L22-T25 PolarHBondContact O-OG1 3.32Å; T25-L29 WeakPolarHBondContact O-CG 3.47Å; T25-L29 PolarHBondContact O-N 3.34Å
26	L	76.4	Confident	67.3	Low	105 Å²	105	105.8 Å²	105.8	55%	0.55	58%	0.583	S	S	.	*	H	α-helix	trans	-68.7	-38.9	175.1	-82.8	160.3	0	0	0	111.8	L22 G23 L29 S30	L22-L26 HydrophobicContact CD2-CD1 4.06Å; L22-L26 HydrophobicContact CG-CD1 4.32Å; L22-L26 WeakPolarHBondContact O-CB 3.45Å; L22-L26 PolarHBondContact O-N 2.91Å; G23-L26 PolarHBondContact O-N 3.36Å; L26-L29 PolarHBondContact O-N 3Å; L26-S30 WeakPolarHBondContact O-CB 3.41Å; L26-S30 PolarHBondContact O-N 3.37Å; L26-S30 PolarHBondContact O-OG 3.21Å
27	S	70.1	Confident	65.1	Low	64 Å²	64	106.5 Å²	106.5	45%	0.448	60%	0.597	S	S	.	*	H	α-helix	trans	-62.2	-48.4	174.6	-179	0	0	0	0	111.4	G23 F24 L29 S30 V31	G23-S27 VanDerWaalsContact O-CB 3.3Å; G23-S27 WeakPolarHBondContact O-CB 3.41Å; G23-S27 PolarHBondContact O-N 3.43Å; F24-S27 PolarHBondContact O-N 3.39Å; S27-L29 VanDerWaalsContact C-N 3.32Å; S27-L29 PolarHBondContact O-N 3.46Å; S27-S30 WeakPolarHBondContact CA-OG 3.48Å; S27-S30 PolarHBondContact O-N 3.42Å; S27-S30 VanDerWaalsContact O-N 3.14Å; S27-S30 PolarHBondContact O-OG 2.71Å; S27-V31 WeakPolarHBondContact O-CG2 3.42Å; S27-V31 PolarHBondContact O-N 3.27Å
28	L	72.2	Confident	62.8	Low	120 Å²	120	107.9 Å²	107.9	63%	0.628	61%	0.609	S	S	*	*	H	α-helix	trans	-61.5	-36.7	176.7	-75.9	165.1	0	0	0	113.1	F24	F24-L28 WeakPolarHBondContact O-CB 3.46Å; F24-L28 WeakPolarHBondContact O-CG 3.48Å; F24-L28 PolarHBondContact O-N 3.06Å
29	L	68.5	Low	60.4	Low	115 Å²	115	108.6 Å²	108.6	60%	0.602	62%	0.621	S	S	*	*	H	α-helix	trans	-67.9	-42	173.1	-76.8	164.9	0	0	0	111.9	T25 L26 S27 V31 S32	T25-L29 WeakPolarHBondContact O-CG 3.47Å; T25-L29 PolarHBondContact O-N 3.34Å; L26-L29 PolarHBondContact O-N 3Å; S27-L29 VanDerWaalsContact C-N 3.32Å; S27-L29 PolarHBondContact O-N 3.46Å; L29-V31 VanDerWaalsContact C-N 3.34Å; L29-V31 PolarHBondContact O-N 3.39Å; L29-S32 PolarHBondContact O-N 3.46Å; L29-S32 PolarHBondContact O-OG 3.32Å
30	S	58.9	Low	58	Low	70 Å²	70	114.9 Å²	114.9	49%	0.49	64%	0.643	S	S	.	*	H	α-helix	trans	-65.1	-33.4	179.6	64.5	0	0	0	0	113.9	L26 S27 S32 W33	L26-S30 WeakPolarHBondContact O-CB 3.41Å; L26-S30 PolarHBondContact O-N 3.37Å; L26-S30 PolarHBondContact O-OG 3.21Å; S27-S30 WeakPolarHBondContact CA-OG 3.48Å; S27-S30 PolarHBondContact O-N 3.42Å; S27-S30 VanDerWaalsContact O-N 3.14Å; S27-S30 PolarHBondContact O-OG 2.71Å; S30-S32 VanDerWaalsContact C-N 3.25Å; S30-S32 PolarHBondContact O-N 3.2Å; S30-W33 PolarHBondContact O-N 3.4Å
31	V	53.2	Low	55.5	Low	87 Å²	87	119 Å²	119	53%	0.527	66%	0.661	S	S	.	*	H	α-helix	trans	-66.6	-27.6	177	171.3	0	0	0	0	111.8	S27 L29 W33	S27-V31 WeakPolarHBondContact O-CG2 3.42Å; S27-V31 PolarHBondContact O-N 3.27Å; L29-V31 VanDerWaalsContact C-N 3.34Å; L29-V31 PolarHBondContact O-N 3.39Å; V31-W33 PolarHBondContact O-N 3.03Å
32	S	48.2	Very low	52.9	Low	86 Å²	86	119.3 Å²	119.3	60%	0.601	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-1.8	179.6	71.2	0	0	0	0	115.5	L29 S30	L29-S32 PolarHBondContact O-N 3.46Å; L29-S32 PolarHBondContact O-OG 3.32Å; S30-S32 VanDerWaalsContact C-N 3.25Å; S30-S32 PolarHBondContact O-N 3.2Å
33	W	44.2	Very low	50.2	Low	238 Å²	238	123.1 Å²	123.1	90%	0.902	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.6	7.4	-176.8	-97.8	23.7	0	0	0	114.4	S30 V31	S30-W33 PolarHBondContact O-N 3.4Å; V31-W33 PolarHBondContact O-N 3.03Å
34	T	42.7	Very low	47.7	Very low	115 Å²	115	129 Å²	129	71%	0.706	70%	0.703	S	S	*	*	S	Bend	trans	-134	41.8	-178.7	61.3	0	0	0	0	113.8
35	E	33.9	Very low	45.2	Very low	175 Å²	175	125.8 Å²	125.8	82%	0.818	71%	0.709	S	S	*	*			trans	-130.3	69.9	167.5	-71.7	-166.8	157.6	0	0	111.3	A37	E35-A37 PolarHBondContact O-N 2.98Å
36	E	30.9	Very low	42.8	Very low	199 Å²	199	130.9 Å²	130.9	93%	0.93	73%	0.728	S	S	*	*			trans	-78.1	99.9	154	-81.8	-171.1	144.1	0	0	108.3
37	A	31.8	Very low	40.5	Very low	94 Å²	94	133 Å²	133	78%	0.777	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-77.6	123.7	-177.6	0	0	0	0	0	112.1	E35	E35-A37 PolarHBondContact O-N 2.98Å
38	C	30	Very low	38.5	Very low	120 Å²	120	136.4 Å²	136.4	81%	0.811	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-69.4	126.8	166.5	-60.2	0	0	0	0	110.4
39	P	33.8	Very low	36.3	Very low	125 Å²	125	135.1 Å²	135.1	81%	0.812	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-79.8	123.8	176.2	30.5	-32.2	0	0	0	111.4
40	L	31.6	Very low	34.3	Very low	175 Å²	175	135.9 Å²	135.9	92%	0.916	78%	0.779	S	S	*	*			trans	-107.6	106.7	162.6	-84	167	0	0	0	108.6
41	E	31.6	Very low	32.8	Very low	194 Å²	194	135.7 Å²	135.7	91%	0.907	79%	0.788	S	S	*	*			trans	-110.1	146	161.5	-76	-170.9	149.2	0	0	109.5
42	G	29.1	Very low	31.6	Very low	70 Å²	70	140.1 Å²	140.1	72%	0.722	80%	0.803	S	S	*	*			cis	174.5	-163.2	-1	0	0	0	0	0	111.6
43	K	27.1	Very low	30.7	Very low	179 Å²	179	143.2 Å²	143.2	78%	0.778	81%	0.812	S	S	*	*			trans	-155.3	135.1	167	-123.2	-169.3	172.9	-134.7	0	111.6
44	E	29.1	Very low	29.9	Very low	162 Å²	162	135.7 Å²	135.7	76%	0.757	81%	0.809	S	S	*	*			trans	64.1	121.1	153.4	-69	163.5	-154.6	0	0	119.7
45	G	27.8	Very low	29.3	Very low	72 Å²	72	137.9 Å²	137.9	74%	0.742	82%	0.815	S	S	*	*			trans	131.8	95.3	140.3	0	0	0	0	0	119
46	E	28.3	Very low	29.1	Very low	184 Å²	184	136.8 Å²	136.8	86%	0.86	81%	0.814	S	S	*	*			trans	57.5	109.1	138.8	-61.2	-177.5	159.5	0	0	122.4
47	D	27.3	Very low	29	Very low	150 Å²	150	136.9 Å²	136.9	80%	0.802	81%	0.811	S	S	*	*				68	147	123.3	-68.7	-6.4	0	0	0	125.6
48	V	28.2	Very low	28.7	Very low	135 Å²	135	136.1 Å²	136.1	82%	0.818	81%	0.813	S	S	*	*			trans	96.1	78.5	158.1	-159.8	0	0	0	0	119.6
49	A	26	Very low	28.6	Very low	92 Å²	92	135.4 Å²	135.4	76%	0.76	82%	0.816	S	S	*	*				54.4	143.3	118.1	0	0	0	0	0	124.5
50	S	27.6	Very low	28.4	Very low	132 Å²	132	141.5 Å²	141.5	92%	0.923	82%	0.822	S	S	*	*			trans	79.3	132.2	163.8	-151.6	0	0	0	0	116.8
51	G	26.4	Very low	28.2	Very low	65 Å²	65	142.8 Å²	142.8	67%	0.67	82%	0.821	S	S	*	*			cis	171.9	162.4	-4.1	0	0	0	0	0	112.9
52	Q	29.1	Very low	28.1	Very low	181 Å²	181	139.4 Å²	139.4	85%	0.846	82%	0.816	S	S	*	*			trans	75.7	112.2	170.1	-63.4	-166	-82.4	0	0	122.1
53	D	28.2	Very low	28	Very low	150 Å²	150	141.2 Å²	141.2	80%	0.802	82%	0.817	S	S	*	*				57.2	117.7	126.2	-54.9	-30.9	0	0	0	122.2
54	G	28.4	Very low	28	Very low	80 Å²	80	137.3 Å²	137.3	83%	0.825	81%	0.813	S	S	*	*			trans	-179.9	55.3	174.1	0	0	0	0	0	115.7
55	L	28.4	Very low	28.1	Very low	162 Å²	162	137.2 Å²	137.2	85%	0.848	82%	0.816	S	S	*	*			trans	-31.4	128.3	175.3	-168.6	83.5	0	0	0	116.4
56	L	30	Very low	28.1	Very low	151 Å²	151	136.9 Å²	136.9	79%	0.791	80%	0.802	S	S	*	*				-179.2	146.3	122.7	-95.4	163.2	0	0	0	115.3
57	K	28.9	Very low	28.1	Very low	201 Å²	201	134.7 Å²	134.7	87%	0.874	80%	0.801	S	S	*	*			trans	-55.4	154.2	177.9	-54.7	159.4	179.9	178.8	0	112.3
58	G	26.4	Very low	28.3	Very low	78 Å²	78	130.7 Å²	130.7	80%	0.804	80%	0.796	S	S	*	*			cis	144.4	134	1.8	0	0	0	0	0	111
59	A	27.4	Very low	28.4	Very low	106 Å²	106	131.3 Å²	131.3	88%	0.876	79%	0.794	S	S	*	*			trans	-157.8	125	170.3	0	0	0	0	0	111.2
60	R	29.3	Very low	28.6	Very low	252 Å²	252	134.2 Å²	134.2	95%	0.951	80%	0.797	S	S	*	*			trans	-133.5	141.6	165.4	-107.7	-172.1	-179.5	-179	1.2	110.2
61	K	28	Very low	28.8	Very low	202 Å²	202	134.3 Å²	134.3	88%	0.878	79%	0.792	S	S	*	*			trans	-67.6	159	172.4	-82.3	179.1	171.6	-179.1	0	111.6
62	P	28.8	Very low	29.6	Very low	124 Å²	124	140.4 Å²	140.4	81%	0.805	80%	0.803	S	S	*	*			trans	-88.2	157.3	-179.7	36.5	-35.8	0	0	0	112.8
63	S	26.7	Very low	29.7	Very low	107 Å²	107	136.3 Å²	136.3	75%	0.748	79%	0.794	S	S	*	*			trans	-163.2	117	146.7	56.1	0	0	0	0	111.1
64	S	28.6	Very low	30.6	Very low	98 Å²	98	139 Å²	139	69%	0.685	80%	0.802	S	S	*	*			trans	53.1	128.8	140.2	68.6	0	0	0	0	121.5
65	I	29.4	Very low	31.1	Very low	160 Å²	160	143 Å²	143	82%	0.821	80%	0.799	S	S	*	*				178.4	148.7	101	-89.3	160.5	0	0	0	110.2
66	S	28.9	Very low	31.8	Very low	64 Å²	64	143.1 Å²	143.1	45%	0.448	80%	0.801	S	S	.	*			trans	-76.2	149.5	-178.7	57.4	0	0	0	0	115.1
67	T	29.2	Very low	32.2	Very low	138 Å²	138	145.9 Å²	145.9	85%	0.847	81%	0.807	S	S	*	*			trans	40.3	142.3	140.6	59.6	0	0	0	0	120.3
68	G	30.4	Very low	32.7	Very low	67 Å²	67	144.7 Å²	144.7	69%	0.691	80%	0.804	S	S	*	*			cis	149.5	155.6	12	0	0	0	0	0	108
69	N	29.6	Very low	33	Very low	147 Å²	147	146.9 Å²	146.9	79%	0.786	81%	0.805	S	S	*	*			cis	-147.5	167.6	1.1	-60.9	-31.3	0	0	0	108.6
70	D	30.3	Very low	33.9	Very low	153 Å²	153	153.1 Å²	153.1	82%	0.818	81%	0.806	S	S	*	*				175.3	130.9	122.7	-97.4	-15.1	0	0	0	113.5
71	V	32.6	Very low	34.9	Very low	135 Å²	135	148.7 Å²	148.7	82%	0.818	80%	0.799	S	S	*	*			trans	58.1	130	157.5	-169.7	0	0	0	0	119.7
72	E	43.2	Very low	36	Very low	192 Å²	192	145.2 Å²	145.2	90%	0.897	79%	0.794	S	S	*	*			trans	-63.3	133	-177.2	-59.1	171.3	137	0	0	114.7
73	S	31.7	Very low	37	Very low	96 Å²	96	144.4 Å²	144.4	67%	0.671	79%	0.789	S	S	*	*			trans	-159.1	139.5	141.9	40.3	0	0	0	0	109.8	E75	S73-E75 PolarHBondContact O-N 3.15Å
74	E	46.8	Very low	38.2	Very low	207 Å²	207	148.8 Å²	148.8	97%	0.967	79%	0.791	S	S	*	*			trans	-75.6	95.5	172.7	-68.4	-175.9	140.4	0	0	109.5
75	E	38.4	Very low	39.4	Very low	163 Å²	163	152.9 Å²	152.9	76%	0.762	80%	0.796	S	S	*	*			trans	-130.5	133.3	170.2	-67.6	-165.2	164.2	0	0	111.6	S73 F77	S73-E75 PolarHBondContact O-N 3.15Å; E75-F77 PolarHBondContact O-N 2.87Å
76	D	43	Very low	40.3	Very low	165 Å²	165	153.4 Å²	153.4	88%	0.882	80%	0.795	S	S	*	*			trans	-60.3	128	-177	-77.4	-55.6	0	0	0	112.2	E78	D76-E78 PolarHBondContact O-N 3.35Å
77	F	38.8	Very low	41.4	Very low	208 Å²	208	156.4 Å²	156.4	91%	0.912	81%	0.811	S	S	*	*			trans	-71.6	90.8	177.4	-102.2	-93.7	0	0	0	112.1	E75	E75-F77 PolarHBondContact O-N 2.87Å
78	E	38.4	Very low	42.4	Very low	176 Å²	176	158.1 Å²	158.1	82%	0.822	81%	0.809	S	S	*	*			trans	-72.4	124.2	162.9	-73.3	-161.9	159.5	0	0	111	D76 R80	D76-E78 PolarHBondContact O-N 3.35Å; E78-R80 PolarHBondContact O-N 3.45Å; E78-R80 VanDerWaalsContact O-N 3.1Å
79	P	34.6	Very low	43.3	Very low	125 Å²	125	161.2 Å²	161.2	81%	0.812	82%	0.817	S	S	*	*			trans	-74.3	105.4	-177.1	28.6	-34.2	0	0	0	112.1	I81	P79-I81 PolarHBondContact O-N 2.9Å
80	R	44.8	Very low	44.4	Very low	237 Å²	237	159.2 Å²	159.2	89%	0.894	81%	0.814	S	S	*	*			trans	-82.1	112.3	176.1	-150.5	178.9	-165	-174	6.9	111.3	E78 V82	E78-R80 PolarHBondContact O-N 3.45Å; E78-R80 VanDerWaalsContact O-N 3.1Å; R80-V82 PolarHBondContact O-N 3.03Å
81	I	51.8	Low	45.4	Very low	159 Å²	159	156 Å²	156	82%	0.815	81%	0.809	S	S	*	*			trans	-68.3	114.6	178.3	-58.5	171.2	0	0	0	109.9	P79 P83	P79-I81 PolarHBondContact O-N 2.9Å; I81-P83 WeakPolarHBondContact O-CD 3.32Å
82	V	49.5	Very low	46	Very low	129 Å²	129	155.7 Å²	155.7	78%	0.782	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-88.4	117	172	-175.1	0	0	0	0	109.1	R80 Y84	R80-V82 PolarHBondContact O-N 3.03Å; V82-Y84 PolarHBondContact O-N 2.91Å
83	P	50.3	Low	46.5	Very low	107 Å²	107	155.5 Å²	155.5	70%	0.695	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-70.1	130.6	178.6	27.5	-33.3	0	0	0	111.1	I81 K85	I81-P83 WeakPolarHBondContact O-CD 3.32Å; P83-K85 PolarHBondContact O-N 3.3Å
84	Y	52.1	Low	47.1	Very low	198 Å²	198	160.4 Å²	160.4	78%	0.776	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-61.9	116.6	180	-179.6	-96	0	0	0	111.5	V82 Q86	V82-Y84 PolarHBondContact O-N 2.91Å; Y84-Q86 HydrophobicContact CD1-CG 4.34Å; Y84-Q86 HydrophobicContact CE1-CB 4.48Å; Y84-Q86 HydrophobicContact CE1-CG 3.83Å
85	K	54.5	Low	47.1	Very low	185 Å²	185	157.2 Å²	157.2	80%	0.804	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-89.3	122.9	165.5	-78.1	-177	175.4	177.1	0	109.1	P83 V87	P83-K85 PolarHBondContact O-N 3.3Å; K85-V87 PolarHBondContact O-N 2.96Å
86	Q	46.8	Very low	47.7	Very low	171 Å²	171	158.8 Å²	158.8	80%	0.799	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-58.7	119.8	170.7	-78.4	178.2	-23.2	0	0	110.1	Y84	Y84-Q86 HydrophobicContact CD1-CG 4.34Å; Y84-Q86 HydrophobicContact CE1-CB 4.48Å; Y84-Q86 HydrophobicContact CE1-CG 3.83Å
87	V	51.8	Low	48.1	Very low	127 Å²	127	161.1 Å²	161.1	77%	0.77	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-74.2	128.7	170.6	-179.5	0	0	0	0	107.9	K85	K85-V87 PolarHBondContact O-N 2.96Å
88	Q	51.8	Low	48.6	Very low	174 Å²	174	152.6 Å²	152.6	81%	0.813	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-61.6	138.9	176	-68.7	-178.1	-6.7	0	0	110.1	S90	Q88-S90 PolarHBondContact O-N 3.41Å
89	P	48.7	Very low	49.2	Very low	131 Å²	131	152.6 Å²	152.6	85%	0.851	78%	0.776	S	S	*	*			trans	-66.5	108.2	-176.3	26.5	-33.7	0	0	0	110.4
90	S	53.3	Low	50.1	Low	106 Å²	106	153.3 Å²	153.3	74%	0.741	76%	0.763	S	S	*	*			trans	-69.9	151.1	163.9	56.9	0	0	0	0	109.7	Q88	Q88-S90 PolarHBondContact O-N 3.41Å
91	A	50.3	Low	50.7	Low	85 Å²	85	148 Å²	148	70%	0.702	75%	0.751	S	S	*	*			trans	-54.1	139.2	-175.6	0	0	0	0	0	111.3	K93	A91-K93 PolarHBondContact O-N 2.9Å
92	P	45.5	Very low	50.7	Low	128 Å²	128	143 Å²	143	83%	0.831	73%	0.73	S	S	*	*			trans	-62.4	107.7	-172.8	24.8	-34.1	0	0	0	110.4	K94	P92-K94 PolarHBondContact O-N 3.3Å
93	K	53.2	Low	51.1	Low	189 Å²	189	141 Å²	141	82%	0.822	72%	0.719	S	S	*	*			trans	-56.2	133.2	161.4	-68.1	-174.6	179.3	-179.3	0	106.8	A91 V95	A91-K93 PolarHBondContact O-N 2.9Å; K93-V95 PolarHBondContact O-N 3.31Å
94	K	45.4	Very low	51.6	Low	199 Å²	199	141.5 Å²	141.5	87%	0.865	71%	0.712	S	S	*	*			trans	-52	116.2	175.9	-75.4	-178.3	174.7	-179.3	0	108.4	P92 F96	P92-K94 PolarHBondContact O-N 3.3Å; K94-F96 PolarHBondContact O-N 2.9Å
95	V	47.2	Very low	52.3	Low	140 Å²	140	137.9 Å²	137.9	85%	0.848	71%	0.705	S	S	*	*			trans	-68.8	99.2	175.6	-178.6	0	0	0	0	107	K93 R97	K93-V95 PolarHBondContact O-N 3.31Å; V95-R97 VanDerWaalsContact C-N 3.32Å; V95-R97 PolarHBondContact O-N 2.85Å
96	F	50.9	Low	52.7	Low	196 Å²	196	131.8 Å²	131.8	86%	0.86	69%	0.694	S	S	*	*			trans	-71.3	95.7	166.4	-118.2	-88.5	0	0	0	106.5	K94 A98	K94-F96 PolarHBondContact O-N 2.9Å; F96-A98 PolarHBondContact O-N 3.1Å; F96-A98 VanDerWaalsContact O-N 3.15Å
97	R	50.2	Low	53.7	Low	214 Å²	214	129.7 Å²	129.7	81%	0.808	69%	0.686	S	S	*	*			trans	-65.6	112	168.6	-169.9	180	-166.8	172.2	3.9	106.9	V95 E104	V95-R97 VanDerWaalsContact C-N 3.32Å; V95-R97 PolarHBondContact O-N 2.85Å; R97-E104 WeakPolarHBondContact CG-OE1 3.3Å
98	A	49.1	Very low	54.6	Low	28 Å²	28	128.5 Å²	128.5	23%	0.231	67%	0.668	C	S	.	*			trans	-70.5	151.2	-179.3	0	0	0	0	0	109.7	F96 Y100 T103 E104	F96-A98 PolarHBondContact O-N 3.1Å; F96-A98 VanDerWaalsContact O-N 3.15Å; A98-Y100 PolarHBondContact O-N 3.43Å; A98-T103 HydrophobicContact CB-CG2 3.71Å; A98-E104 HydrophobicContact CB-CG 3.88Å
99	K	51.6	Low	56	Low	176 Å²	176	124.7 Å²	124.7	77%	0.765	65%	0.65	S	S	*	*	S	Bend	trans	-71.3	-18.3	-178.1	-164.9	-179.3	176	-164.5	0	112.4
100	Y	53.3	Low	57.7	Low	141 Å²	141	124.5 Å²	124.5	55%	0.553	63%	0.632	S	S	*	*	S	Bend	trans	-132.7	145	-173.9	-54.1	-64.8	0	0	0	111.6	A98 S102 T103 E104	A98-Y100 PolarHBondContact O-N 3.43Å; Y100-S102 VanDerWaalsContact C-N 3.3Å; Y100-S102 PolarHBondContact O-N 3.18Å; Y100-T103 PolarHBondContact O-N 3.18Å; Y100-E104 PolarHBondContact O-N 2.95Å
101	I	58.6	Low	59.6	Low	126 Å²	126	120.2 Å²	120.2	65%	0.646	60%	0.601	S	S	*	*	H	α-helix	trans	-63.8	-34.8	-178.5	-64.9	169.8	0	0	0	111.5	T103 E104 L105	I101-T103 VanDerWaalsContact C-N 3.3Å; I101-T103 PolarHBondContact O-N 2.92Å; I101-E104 PolarHBondContact O-N 3.43Å; I101-E104 VanDerWaalsContact O-N 3.16Å; I101-L105 HydrophobicContact CG2-CD1 3.69Å; I101-L105 HydrophobicContact CG2-CG 4.07Å; I101-L105 WeakPolarHBondContact O-CB 3.46Å; I101-L105 WeakPolarHBondContact O-CG 3.33Å; I101-L105 PolarHBondContact O-N 2.88Å
102	S	50.3	Low	61.7	Low	52 Å²	52	116.4 Å²	116.4	36%	0.364	57%	0.569	S	S	.	*	H	α-helix	trans	-53.8	-46.4	175.6	46.2	0	0	0	0	111.9	Y100 L105 G106 M107	Y100-S102 VanDerWaalsContact C-N 3.3Å; Y100-S102 PolarHBondContact O-N 3.18Å; S102-L105 CarbonylContact O-C 3.56Å; S102-L105 PolarHBondContact O-N 3.03Å; S102-G106 PolarHBondContact O-N 2.68Å; S102-M107 PolarHBondContact O-N 3.28Å
103	T	58.1	Low	64.1	Low	89 Å²	89	110.3 Å²	110.3	55%	0.546	53%	0.529	S	S	.	.	H	α-helix	trans	-68.5	-35	178.7	-40.2	0	0	0	0	112.8	A98 Y100 I101 G106	A98-T103 HydrophobicContact CB-CG2 3.71Å; Y100-T103 PolarHBondContact O-N 3.18Å; I101-T103 VanDerWaalsContact C-N 3.3Å; I101-T103 PolarHBondContact O-N 2.92Å; T103-G106 PolarHBondContact O-N 2.85Å
104	E	60.5	Low	66.1	Low	117 Å²	117	101.4 Å²	101.4	55%	0.547	49%	0.491	S	S	.	.	H	α-helix	trans	-71	-31.4	174.4	-63.7	-161.5	154.6	0	0	112.4	R97 A98 Y100 I101 G106	R97-E104 WeakPolarHBondContact CG-OE1 3.3Å; A98-E104 HydrophobicContact CB-CG 3.88Å; Y100-E104 PolarHBondContact O-N 2.95Å; I101-E104 PolarHBondContact O-N 3.43Å; I101-E104 VanDerWaalsContact O-N 3.16Å; E104-G106 VanDerWaalsContact C-N 3.34Å
105	L	67.3	Low	68.5	Low	122 Å²	122	92 Å²	92	64%	0.639	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-6	175.2	-67.2	178.2	0	0	0	113.8	I101 S102 M107	I101-L105 HydrophobicContact CG2-CD1 3.69Å; I101-L105 HydrophobicContact CG2-CG 4.07Å; I101-L105 WeakPolarHBondContact O-CB 3.46Å; I101-L105 WeakPolarHBondContact O-CG 3.33Å; I101-L105 PolarHBondContact O-N 2.88Å; S102-L105 CarbonylContact O-C 3.56Å; S102-L105 PolarHBondContact O-N 3.03Å; L105-M107 HydrophobicContact CB-CG 3.89Å; L105-M107 HydrophobicContact CB-SD 4.29Å; L105-M107 HydrophobicContact CD1-SD 3.95Å; L105-M107 PolarHBondContact O-N 2.63Å
106	G	63.1	Low	70.7	Confident	56 Å²	56	86.4 Å²	86.4	58%	0.577	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	23.6	-173.9	0	0	0	0	0	113.8	S102 T103 E104 R108	S102-G106 PolarHBondContact O-N 2.68Å; T103-G106 PolarHBondContact O-N 2.85Å; E104-G106 VanDerWaalsContact C-N 3.34Å; G106-R108 PolarHBondContact O-N 2.99Å
107	M	66.8	Low	72.7	Confident	127 Å²	127	77.5 Å²	77.5	63%	0.626	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-67.4	119.1	174.5	-66.3	177.4	67.5	0	0	109.2	S102 L105	S102-M107 PolarHBondContact O-N 3.28Å; L105-M107 HydrophobicContact CB-CG 3.89Å; L105-M107 HydrophobicContact CB-SD 4.29Å; L105-M107 HydrophobicContact CD1-SD 3.95Å; L105-M107 PolarHBondContact O-N 2.63Å
108	R	72.1	Confident	74.6	Confident	103 Å²	103	69.4 Å²	69.4	39%	0.389	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-85.4	155.8	173.7	-71	-177.4	-163.7	131.2	14.2	111.2	G106 N182 E183 D185	G106-R108 PolarHBondContact O-N 2.99Å; R108-N182 PolarHBondContact NE-O 3.44Å; R108-E183 VanDerWaalsContact CA-O 3.31Å; R108-E183 WeakPolarHBondContact CA-O 3.4Å; R108-E183 WeakPolarHBondContact CB-O 3.44Å; R108-E183 WeakPolarHBondContact CG-O 3.19Å; R108-D185 WeakPolarHBondContact CD-OD1 3.18Å; R108-D185 IonicContact CZ-OD1 3.24Å; R108-D185 IonicContact NE-OD1 3.79Å; R108-D185 IonicContact NH1-OD1 3.5Å; R108-D185 PolarHBondContact NH1-OD1 2.98Å
109	E	80.7	Confident	76.5	Confident	94 Å²	94	73 Å²	73	44%	0.439	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	148.4	167	-73.1	174.8	-158	0	0	109.3	E183 Y184 D185	E109-E183 PolarHBondContact N-O 3.13Å; E109-Y184 HydrophobicContact CB-CD1 3.63Å; E109-Y184 HydrophobicContact CB-CE1 3.35Å; E109-Y184 HydrophobicContact CG-CE1 4.28Å; E109-Y184 VanDerWaalsContact O-CA 3.3Å; E109-Y184 WeakPolarHBondContact O-CA 3.35Å; E109-Y184 WeakPolarHBondContact OE2-CE1 3.45Å; E109-Y184 PolarHBondContact OE2-OH 3.37Å; E109-D185 PolarHBondContact O-N 3.31Å
110	R	84.6	Confident	78.3	Confident	127 Å²	127	71 Å²	71	48%	0.479	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-37.4	-169.3	-70.3	-168	-178.5	-137.9	18.7	113.2	W186 V205 E206	R110-W186 VanDerWaalsContact O-CB 3.26Å; R110-W186 WeakPolarHBondContact O-CB 3.41Å; R110-W186 PolarHBondContact O-N 3.25Å; R110-V205 HydrophobicContact CB-CG1 4.25Å; R110-E206 PolarHBondContact NH1-O 3.13Å
111	L	92.3	Very high	80.1	Confident	16 Å²	16	65.7 Å²	65.7	8%	0.084	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	133.4	-165	180	60.8	0	0	0	112.8	V113 L137 Y184 W186 I201 V205 L239	L111-V113 HydrophobicContact CG-CG2 4.44Å; L111-L137 HydrophobicContact CD2-CD2 4.28Å; L111-Y184 WeakPolarHBondContact O-CD1 3.31Å; L111-W186 WeakPolarHBondContact CA-O 3.24Å; L111-W186 HydrophobicContact CD1-CB 4.18Å; L111-I201 HydrophobicContact CD2-CG2 3.63Å; L111-V205 HydrophobicContact CB-CG1 4.24Å; L111-V205 HydrophobicContact CD1-CG2 4.17Å; L111-V205 HydrophobicContact CD2-CG2 4.4Å; L111-L239 HydrophobicContact CD1-CD2 4.17Å
112	I	94.3	Very high	81.6	Confident	4 Å²	4	59.9 Å²	59.9	2%	0.021	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	138.3	163.2	171.2	166.2	0	0	0	110.4	I139 V141 Y180 Y184 W186 F187 Y188	I112-I139 HydrophobicContact CB-CG2 3.72Å; I112-I139 HydrophobicContact CD1-CD1 4.36Å; I112-I139 HydrophobicContact CD1-CG2 4.23Å; I112-I139 HydrophobicContact CG1-CG2 3.79Å; I112-V141 HydrophobicContact CD1-CG2 4.24Å; I112-Y180 HydrophobicContact CD1-CD1 3.9Å; I112-Y180 HydrophobicContact CD1-CD2 3.31Å; I112-Y180 HydrophobicContact CD1-CE1 4.18Å; I112-Y180 HydrophobicContact CD1-CE2 3.63Å; I112-Y180 HydrophobicContact CD1-CG 3.45Å; I112-Y180 VanDerWaalsContact CD1-CG 3.45Å; I112-Y184 HydrophobicContact CB-CD1 3.86Å; I112-Y184 HydrophobicContact CB-CD2 4.33Å; I112-Y184 HydrophobicContact CB-CE1 4.22Å; I112-Y184 HydrophobicContact CB-CG 3.93Å; I112-Y184 HydrophobicContact CG2-CD1 4.14Å; I112-Y184 HydrophobicContact CG2-CD2 4.3Å; I112-Y184 HydrophobicContact CG2-CG 3.8Å; I112-W186 WeakPolarHBondContact CG2-O 3.48Å; I112-W186 PolarHBondContact N-O 2.93Å; I112-F187 HydrophobicContact CG2-CB 4.44Å; I112-F187 HydrophobicContact CG2-CD1 3.18Å; I112-F187 HydrophobicContact CG2-CE1 3.42Å; I112-F187 VanDerWaalsContact CG2-CE1 3.42Å; I112-F187 HydrophobicContact CG2-CG 3.99Å; I112-F187 HydrophobicContact CG2-CZ 4.36Å; I112-Y188 PolarHBondContact O-N 3.23Å
113	V	96	Very high	83.5	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.006	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	123.4	175.1	-179.5	0	0	0	0	111.9	L111 V115 I133 L137 I139 V140 V141 Y188 V190	L111-V113 HydrophobicContact CG-CG2 4.44Å; V113-V115 HydrophobicContact CG1-CG2 4Å; V113-I133 HydrophobicContact CG1-CD1 3.95Å; V113-L137 HydrophobicContact CG2-CD1 3.6Å; V113-I139 PolarHBondContact N-O 3.13Å; V113-V140 HydrophobicContact CB-CG1 4.5Å; V113-V140 HydrophobicContact CB-CG2 4.49Å; V113-V140 HydrophobicContact CG1-CG1 4.43Å; V113-V141 PolarHBondContact O-N 3.09Å; V113-Y188 CarbonylContact C-O 3.53Å; V113-Y188 WeakPolarHBondContact CA-O 3.33Å; V113-Y188 HydrophobicContact CB-CD1 4.35Å; V113-Y188 HydrophobicContact CG1-CD1 3.76Å; V113-Y188 HydrophobicContact CG1-CE1 4.33Å; V113-Y188 HydrophobicContact CG2-CD1 3.87Å; V113-V190 HydrophobicContact CG1-CG1 4.43Å
114	G	96	Very high	85.2	Confident	2 Å²	2	60.4 Å²	60.4	2%	0.021	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	109	170.9	0	0	0	0	0	112.2	V141 Y188 F189 V190	G114-V141 CarbonylContact C-O 3.57Å; G114-V141 WeakPolarHBondContact CA-O 3.03Å; G114-Y188 PolarHBondContact N-O 3.48Å; G114-F189 WeakPolarHBondContact O-CA 3.01Å; G114-V190 PolarHBondContact O-N 3.27Å; G114-V190 VanDerWaalsContact O-N 3.11Å
115	V	95.8	Very high	86.8	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	114.5	177.4	-173.4	0	0	0	0	110.1	V113 V129 I133 V140 V141 F142 F143 V190 D192	V113-V115 HydrophobicContact CG1-CG2 4Å; V115-V129 HydrophobicContact CG1-CG1 4.23Å; V115-V129 HydrophobicContact CG2-CG1 4Å; V115-I133 HydrophobicContact CG2-CD1 4.18Å; V115-V140 HydrophobicContact CG2-CG1 4.02Å; V115-V141 PolarHBondContact N-O 3.45Å; V115-F142 HydrophobicContact CB-CD1 3.66Å; V115-F142 HydrophobicContact CB-CE1 3.73Å; V115-F142 HydrophobicContact CB-CG 4.31Å; V115-F142 HydrophobicContact CB-CZ 4.41Å; V115-F142 HydrophobicContact CG1-CD1 3.83Å; V115-F142 HydrophobicContact CG1-CE1 3.75Å; V115-F142 HydrophobicContact CG2-CD1 4.27Å; V115-F142 HydrophobicContact CG2-CE1 3.89Å; V115-F142 HydrophobicContact CG2-CZ 4.13Å; V115-F142 CarbonylContact O-C 3.59Å; V115-F142 WeakPolarHBondContact O-CA 3.28Å; V115-F143 PolarHBondContact O-N 3.08Å; V115-V190 CarbonylContact C-O 3.5Å; V115-V190 WeakPolarHBondContact CA-O 3.3Å; V115-V190 HydrophobicContact CG2-CG1 4.09Å; V115-D192 HydrophobicContact CG1-CB 4.08Å
116	L	94.3	Very high	88	Confident	24 Å²	24	49.7 Å²	49.7	13%	0.126	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	122.5	174.3	-64.9	167.6	0	0	0	109.6	F143 M169 T172 V190 D192	L116-F143 HydrophobicContact CD2-CB 4.23Å; L116-M169 HydrophobicContact CD1-SD 3.59Å; L116-M169 VanDerWaalsContact CD1-SD 3.59Å; L116-M169 HydrophobicContact CD2-SD 3.94Å; L116-M169 HydrophobicContact CG-SD 4.39Å; L116-T172 HydrophobicContact CD2-CG2 4.11Å; L116-V190 PolarHBondContact N-O 2.84Å; L116-D192 PolarHBondContact O-N 3.38Å; L116-D192 VanDerWaalsContact O-N 3.1Å
117	T	92.5	Very high	89.5	Confident	9 Å²	9	48.4 Å²	48.4	6%	0.055	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	157.4	-172.3	-174.6	0	0	0	0	112.3	I122 F142 F143 D192	T117-I122 HydrophobicContact CG2-CB 4.28Å; T117-I122 HydrophobicContact CG2-CD1 3.82Å; T117-I122 HydrophobicContact CG2-CG1 4.34Å; T117-I122 WeakPolarHBondContact OG1-CA 3.31Å; T117-I122 PolarHBondContact OG1-N 2.86Å; T117-F142 HydrophobicContact CG2-CB 4.27Å; T117-F143 PolarHBondContact N-O 3.27Å; T117-D192 WeakPolarHBondContact CA-OD2 3.19Å; T117-D192 WeakPolarHBondContact CB-OD2 3.47Å; T117-D192 PolarHBondContact OG1-OD2 2.92Å
118	S	90.4	Very high	90.8	Very high	44 Å²	44	42.4 Å²	42.4	31%	0.308	21%	0.21	S	C	.	.			trans	-107.4	162.4	178.7	85.8	0	0	0	0	112.3	N120 T121 I122	S118-N120 PolarHBondContact O-N 2.68Å; S118-N120 VanDerWaalsContact O-N 3.1Å; S118-N120 PolarHBondContact OG-N 2.88Å; S118-T121 WeakPolarHBondContact CB-OG1 3.47Å; S118-T121 PolarHBondContact N-OG1 3.36Å; S118-T121 VanDerWaalsContact N-OG1 3.13Å; S118-T121 PolarHBondContact O-N 3.49Å; S118-T121 PolarHBondContact O-OG1 2.82Å; S118-T121 PolarHBondContact OG-N 3.39Å; S118-T121 PolarHBondContact OG-OG1 2.75Å; S118-I122 WeakPolarHBondContact O-CB 3.23Å; S118-I122 VanDerWaalsContact O-CG2 3.32Å; S118-I122 WeakPolarHBondContact O-CG2 3.41Å; S118-I122 PolarHBondContact O-N 3.19Å
119	K	88.1	Confident	91.9	Very high	103 Å²	103	37.7 Å²	37.7	45%	0.448	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51	-31.8	170.9	-174.4	-176.5	179.1	-179.8	0	114.2
120	N	88.6	Confident	92.6	Very high	133 Å²	133	34.2 Å²	34.2	71%	0.711	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-29.5	-175	-62.2	-18.4	0	0	0	112.1	S118	S118-N120 PolarHBondContact O-N 2.68Å; S118-N120 VanDerWaalsContact O-N 3.1Å; S118-N120 PolarHBondContact OG-N 2.88Å
121	T	91.3	Very high	93	Very high	30 Å²	30	35.2 Å²	35.2	18%	0.184	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-22	-171.7	50.6	0	0	0	0	113.6	S118 N123 T124 L125 G126 D192	S118-T121 WeakPolarHBondContact CB-OG1 3.47Å; S118-T121 PolarHBondContact N-OG1 3.36Å; S118-T121 VanDerWaalsContact N-OG1 3.13Å; S118-T121 PolarHBondContact O-N 3.49Å; S118-T121 PolarHBondContact O-OG1 2.82Å; S118-T121 PolarHBondContact OG-N 3.39Å; S118-T121 PolarHBondContact OG-OG1 2.75Å; T121-N123 VanDerWaalsContact C-N 3.26Å; T121-N123 PolarHBondContact O-N 2.8Å; T121-T124 CarbonylContact O-C 3.58Å; T121-T124 PolarHBondContact O-N 2.9Å; T121-T124 PolarHBondContact O-OG1 3.41Å; T121-L125 HydrophobicContact CG2-CD1 4.1Å; T121-L125 PolarHBondContact O-N 2.86Å; T121-G126 PolarHBondContact O-N 3.42Å; T121-D192 WeakPolarHBondContact CB-OD2 3.44Å; T121-D192 PolarHBondContact OG1-OD2 2.9Å
122	I	90.9	Very high	93.1	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.021	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-35.9	178.8	-175.3	50	0	0	0	113.9	T117 S118 T124 V127 F142 N148 M155 V157	T117-I122 HydrophobicContact CG2-CB 4.28Å; T117-I122 HydrophobicContact CG2-CD1 3.82Å; T117-I122 HydrophobicContact CG2-CG1 4.34Å; T117-I122 WeakPolarHBondContact OG1-CA 3.31Å; T117-I122 PolarHBondContact OG1-N 2.86Å; S118-I122 WeakPolarHBondContact O-CB 3.23Å; S118-I122 VanDerWaalsContact O-CG2 3.32Å; S118-I122 WeakPolarHBondContact O-CG2 3.41Å; S118-I122 PolarHBondContact O-N 3.19Å; I122-T124 VanDerWaalsContact C-N 3.33Å; I122-V127 PolarHBondContact O-N 2.98Å; I122-F142 HydrophobicContact CD1-CB 4.3Å; I122-F142 HydrophobicContact CD1-CD1 4.22Å; I122-F142 HydrophobicContact CD1-CG 4.44Å; I122-N148 WeakPolarHBondContact CG2-ND2 3.42Å; I122-M155 HydrophobicContact CD1-CE 3.57Å; I122-V157 HydrophobicContact CD1-CG2 4.3Å
123	N	90.5	Very high	93	Very high	84 Å²	84	34.5 Å²	34.5	45%	0.449	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-3.7	179.7	-66.7	-44.7	0	0	0	113.8	T121	T121-N123 VanDerWaalsContact C-N 3.26Å; T121-N123 PolarHBondContact O-N 2.8Å
124	T	92.9	Very high	92.7	Very high	69 Å²	69	36.3 Å²	36.3	42%	0.423	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125	-80.6	-176.6	52.2	0	0	0	0	110.6	T121 I122 V127 A128	T121-T124 CarbonylContact O-C 3.58Å; T121-T124 PolarHBondContact O-N 2.9Å; T121-T124 PolarHBondContact O-OG1 3.41Å; I122-T124 VanDerWaalsContact C-N 3.33Å; T124-V127 PolarHBondContact O-N 3.37Å; T124-A128 PolarHBondContact O-N 3.27Å; T124-A128 VanDerWaalsContact O-N 3.16Å
125	L	93.8	Very high	92.4	Very high	14 Å²	14	43.5 Å²	43.5	7%	0.073	22%	0.223	C	C	.	.	H	α-helix	trans	-65.6	-42.8	177.7	-71.2	174.5	0	0	0	111.8	T121 V127 A128 V129 D192 D193 P320 M323	T121-L125 HydrophobicContact CG2-CD1 4.1Å; T121-L125 PolarHBondContact O-N 2.86Å; L125-V127 VanDerWaalsContact C-N 3.3Å; L125-V127 PolarHBondContact O-N 3.37Å; L125-A128 WeakPolarHBondContact O-CA 3.14Å; L125-A128 WeakPolarHBondContact O-CB 3.37Å; L125-A128 PolarHBondContact O-N 3.05Å; L125-V129 WeakPolarHBondContact O-CG2 3.32Å; L125-V129 PolarHBondContact O-N 3.4Å; L125-D192 HydrophobicContact CB-CB 4.34Å; L125-D192 WeakPolarHBondContact CB-O 3.35Å; L125-D193 HydrophobicContact CD1-CB 4.4Å; L125-P320 HydrophobicContact CD2-CG 4.22Å; L125-M323 HydrophobicContact CD2-CE 4.33Å
126	G	93.3	Very high	92	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59	-38.6	177.1	0	0	0	0	0	113.3	T121 N130 F142 M155	T121-G126 PolarHBondContact O-N 3.42Å; G126-N130 WeakPolarHBondContact O-CB 3.48Å; G126-N130 PolarHBondContact O-N 2.82Å; G126-F142 WeakPolarHBondContact O-CE1 3.07Å; G126-M155 WeakPolarHBondContact O-CE 3.43Å
127	V	93.8	Very high	91.8	Very high	29 Å²	29	46.1 Å²	46.1	18%	0.176	24%	0.235	C	C	.	.	H	α-helix	trans	-67.5	-37.9	173.3	177.3	0	0	0	0	111.6	I122 T124 L125 R131 P152 M155	I122-V127 PolarHBondContact O-N 2.98Å; T124-V127 PolarHBondContact O-N 3.37Å; L125-V127 VanDerWaalsContact C-N 3.3Å; L125-V127 PolarHBondContact O-N 3.37Å; V127-R131 WeakPolarHBondContact O-CG 3.4Å; V127-R131 PolarHBondContact O-N 2.6Å; V127-P152 HydrophobicContact CG2-CB 3.96Å; V127-P152 HydrophobicContact CG2-CG 3.69Å; V127-M155 HydrophobicContact CG2-SD 3.98Å
128	A	95.2	Very high	91.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-66.7	-48.9	177.8	0	0	0	0	0	111.4	T124 L125 N130 R131 T132 P320 M323 Y324	T124-A128 PolarHBondContact O-N 3.27Å; T124-A128 VanDerWaalsContact O-N 3.16Å; L125-A128 WeakPolarHBondContact O-CA 3.14Å; L125-A128 WeakPolarHBondContact O-CB 3.37Å; L125-A128 PolarHBondContact O-N 3.05Å; A128-N130 VanDerWaalsContact C-N 3.34Å; A128-N130 PolarHBondContact O-N 3.36Å; A128-R131 PolarHBondContact O-N 3.27Å; A128-T132 WeakPolarHBondContact O-CG2 3.48Å; A128-T132 PolarHBondContact O-N 2.81Å; A128-T132 VanDerWaalsContact O-N 3.1Å; A128-T132 PolarHBondContact O-OG1 2.93Å; A128-P320 HydrophobicContact CB-CB 4.08Å; A128-M323 HydrophobicContact CB-CB 4.07Å; A128-M323 HydrophobicContact CB-CG 3.93Å; A128-Y324 HydrophobicContact CB-CE1 4.25Å; A128-Y324 HydrophobicContact CB-CE2 4.19Å
129	V	95.3	Very high	91.3	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.024	26%	0.26	C	S	.	.	H	α-helix	trans	-54.8	-50	172.5	174.8	0	0	0	0	110.2	V115 L125 R131 T132 I133 F142 M323	V115-V129 HydrophobicContact CG1-CG1 4.23Å; V115-V129 HydrophobicContact CG2-CG1 4Å; L125-V129 WeakPolarHBondContact O-CG2 3.32Å; L125-V129 PolarHBondContact O-N 3.4Å; V129-R131 VanDerWaalsContact C-N 3.3Å; V129-R131 PolarHBondContact O-N 3.2Å; V129-T132 PolarHBondContact O-N 3.44Å; V129-T132 PolarHBondContact O-OG1 3.33Å; V129-I133 HydrophobicContact CG1-CD1 3.73Å; V129-I133 HydrophobicContact CG1-CG1 4.06Å; V129-I133 WeakPolarHBondContact O-CG1 3.43Å; V129-I133 PolarHBondContact O-N 3.42Å; V129-F142 HydrophobicContact CB-CE1 4.31Å; V129-F142 HydrophobicContact CG1-CE1 4.19Å; V129-F142 HydrophobicContact CG1-CZ 4.27Å; V129-M323 HydrophobicContact CG2-CE 3.7Å; V129-M323 HydrophobicContact CG2-SD 4.45Å
130	N	94.6	Very high	91.6	Very high	21 Å²	21	47.4 Å²	47.4	11%	0.112	24%	0.243	C	C	.	.	H	α-helix	trans	-55.2	-45.7	179	-168.3	65.5	0	0	0	112.1	G126 A128 T132 S134 F142 M155	G126-N130 WeakPolarHBondContact O-CB 3.48Å; G126-N130 PolarHBondContact O-N 2.82Å; A128-N130 VanDerWaalsContact C-N 3.34Å; A128-N130 PolarHBondContact O-N 3.36Å; N130-T132 VanDerWaalsContact C-N 3.27Å; N130-T132 PolarHBondContact O-N 2.9Å; N130-S134 WeakPolarHBondContact O-CB 3.42Å; N130-S134 PolarHBondContact O-N 3.29Å; N130-S134 PolarHBondContact O-OG 2.81Å; N130-F142 HydrophobicContact CB-CE1 4.49Å; N130-F142 HydrophobicContact CB-CE2 3.92Å; N130-F142 HydrophobicContact CB-CZ 3.58Å; N130-F142 VanDerWaalsContact OD1-CE2 3.3Å; N130-F142 WeakPolarHBondContact OD1-CE2 3.42Å; N130-M155 HydrophobicContact CB-CE 3.95Å; N130-M155 HydrophobicContact CB-CG 4.03Å; N130-M155 HydrophobicContact CB-SD 4.03Å; N130-M155 WeakPolarHBondContact ND2-CG 3.28Å
131	R	93.2	Very high	91.9	Very high	149 Å²	149	41 Å²	41	56%	0.562	21%	0.209	S	C	*	.	H	α-helix	trans	-69.9	-20.6	-179.1	-77.2	173.4	170.7	-173.3	-2.4	114.3	V127 A128 V129 H135 Y324	V127-R131 WeakPolarHBondContact O-CG 3.4Å; V127-R131 PolarHBondContact O-N 2.6Å; A128-R131 PolarHBondContact O-N 3.27Å; V129-R131 VanDerWaalsContact C-N 3.3Å; V129-R131 PolarHBondContact O-N 3.2Å; R131-H135 PolarHBondContact O-CD2 3.31Å; R131-Y324 HydrophobicContact CB-CE1 4.1Å; R131-Y324 VanDerWaalsContact CD-OH 3.31Å; R131-Y324 WeakPolarHBondContact CD-OH 3.46Å
132	T	93.6	Very high	92.1	Very high	4 Å²	4	39.6 Å²	39.6	3%	0.025	20%	0.2	C	C	.	.	H	α-helix	trans	-93.2	-35.5	178.5	55.9	0	0	0	0	112.8	A128 V129 N130 Y324 H327	A128-T132 WeakPolarHBondContact O-CG2 3.48Å; A128-T132 PolarHBondContact O-N 2.81Å; A128-T132 VanDerWaalsContact O-N 3.1Å; A128-T132 PolarHBondContact O-OG1 2.93Å; V129-T132 PolarHBondContact O-N 3.44Å; V129-T132 PolarHBondContact O-OG1 3.33Å; N130-T132 VanDerWaalsContact C-N 3.27Å; N130-T132 PolarHBondContact O-N 2.9Å; T132-Y324 HydrophobicContact CG2-CD1 4.17Å; T132-Y324 HydrophobicContact CG2-CE1 4.43Å; T132-H327 HydrophobicContact CG2-CB 3.66Å
133	I	93.4	Very high	92.2	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-103.9	-27	-175.6	72.9	173	0	0	0	115.3	V113 V115 V129 H135 H136 L137 V140 A198	V113-I133 HydrophobicContact CG1-CD1 3.95Å; V115-I133 HydrophobicContact CG2-CD1 4.18Å; V129-I133 HydrophobicContact CG1-CD1 3.73Å; V129-I133 HydrophobicContact CG1-CG1 4.06Å; V129-I133 WeakPolarHBondContact O-CG1 3.43Å; V129-I133 PolarHBondContact O-N 3.42Å; I133-H135 PolarHBondContact O-N 3.35Å; I133-H136 PolarHBondContact O-N 3.34Å; I133-H136 VanDerWaalsContact O-N 3.15Å; I133-L137 HydrophobicContact CB-CD1 4.19Å; I133-L137 PolarHBondContact O-N 3.31Å; I133-V140 HydrophobicContact CD1-CG1 3.71Å; I133-V140 HydrophobicContact CD1-CG2 4.18Å; I133-V140 HydrophobicContact CG1-CG1 4.09Å; I133-V140 HydrophobicContact CG1-CG2 4.09Å; I133-A198 HydrophobicContact CB-CB 4.33Å; I133-A198 HydrophobicContact CG2-CB 4.33Å
134	S	89.7	Confident	92.3	Very high	39 Å²	39	35.5 Å²	35.5	27%	0.273	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-10.9	-172.4	69.4	0	0	0	0	115.2	N130	N130-S134 WeakPolarHBondContact O-CB 3.42Å; N130-S134 PolarHBondContact O-N 3.29Å; N130-S134 PolarHBondContact O-OG 2.81Å
135	H	88.5	Confident	92	Very high	152 Å²	152	32.5 Å²	32.5	70%	0.704	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-13.2	174.1	-62.3	-55.3	0	0	0	113.4	R131 I133	R131-H135 PolarHBondContact O-CD2 3.31Å; I133-H135 PolarHBondContact O-N 3.35Å
136	H	88.3	Confident	91.4	Very high	63 Å²	63	32.5 Å²	32.5	29%	0.292	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-11.9	-174.9	-66.4	-104.2	0	0	0	113.1	I133 A198 D199 R202	I133-H136 PolarHBondContact O-N 3.34Å; I133-H136 VanDerWaalsContact O-N 3.15Å; H136-A198 HydrophobicContact CB-CB 3.5Å; H136-A198 VanDerWaalsContact CB-CB 3.5Å; H136-D199 IonicContact CE1-OD2 3.91Å; H136-D199 PolarHBondContact CE1-OD2 3.28Å; H136-D199 IonicContact CG-OD1 3.18Å; H136-D199 IonicContact ND1-OD1 3.02Å; H136-D199 PolarHBondContact ND1-OD1 3.42Å; H136-D199 IonicContact ND1-OD2 3.28Å; H136-D199 PolarHBondContact ND1-OD2 2.7Å; H136-R202 PolarHBondContact O-NH1 3.31Å
137	L	89.3	Confident	90.7	Very high	16 Å²	16	42.1 Å²	42.1	8%	0.084	20%	0.198	C	C	.	.	S	Bend	trans	-131.3	139.3	-173.3	-57.9	175.8	0	0	0	110.6	L111 V113 I133 I139 V140 A198 R202	L111-L137 HydrophobicContact CD2-CD2 4.28Å; V113-L137 HydrophobicContact CG2-CD1 3.6Å; I133-L137 HydrophobicContact CB-CD1 4.19Å; I133-L137 PolarHBondContact O-N 3.31Å; L137-I139 PolarHBondContact O-N 3.42Å; L137-V140 HydrophobicContact CB-CG2 4.22Å; L137-A198 HydrophobicContact CD1-CB 4Å; L137-A198 HydrophobicContact CD2-CB 4.25Å; L137-A198 HydrophobicContact CG-CB 3.92Å; L137-R202 HydrophobicContact CD2-CB 4.37Å
138	D	82.8	Confident	89.5	Confident	136 Å²	136	42.8 Å²	42.8	73%	0.727	20%	0.201	S	C	*	.	S	Bend	trans	-64.7	-39.2	-171.8	-55.1	-63.8	0	0	0	113.4
139	I	89.8	Confident	88	Confident	34 Å²	34	54.9 Å²	54.9	17%	0.174	25%	0.247	C	C	.	.			trans	-139.6	129.4	-179.7	-167.4	166.1	0	0	0	113	I112 V113 L137 V141 Y180 Y184	I112-I139 HydrophobicContact CB-CG2 3.72Å; I112-I139 HydrophobicContact CD1-CD1 4.36Å; I112-I139 HydrophobicContact CD1-CG2 4.23Å; I112-I139 HydrophobicContact CG1-CG2 3.79Å; V113-I139 PolarHBondContact N-O 3.13Å; L137-I139 PolarHBondContact O-N 3.42Å; I139-V141 HydrophobicContact CD1-CG2 4.39Å; I139-V141 HydrophobicContact CG1-CG2 4.12Å; I139-Y180 HydrophobicContact CD1-CD1 4.44Å; I139-Y180 HydrophobicContact CD1-CE1 3.63Å; I139-Y184 HydrophobicContact CG2-CD1 4.4Å; I139-Y184 HydrophobicContact CG2-CE1 3.5Å; I139-Y184 HydrophobicContact CG2-CE2 4.42Å; I139-Y184 WeakPolarHBondContact CG2-OH 3.46Å
140	V	94.4	Very high	86.9	Confident	13 Å²	13	63.1 Å²	63.1	8%	0.079	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	118.9	177.6	-174.1	0	0	0	0	108.7	V113 V115 I133 L137 F142	V113-V140 HydrophobicContact CB-CG1 4.5Å; V113-V140 HydrophobicContact CB-CG2 4.49Å; V113-V140 HydrophobicContact CG1-CG1 4.43Å; V115-V140 HydrophobicContact CG2-CG1 4.02Å; I133-V140 HydrophobicContact CD1-CG1 3.71Å; I133-V140 HydrophobicContact CD1-CG2 4.18Å; I133-V140 HydrophobicContact CG1-CG1 4.09Å; I133-V140 HydrophobicContact CG1-CG2 4.09Å; L137-V140 HydrophobicContact CB-CG2 4.22Å; V140-F142 HydrophobicContact CB-CE2 4.43Å; V140-F142 HydrophobicContact CG1-CD2 4.34Å; V140-F142 HydrophobicContact CG1-CE2 3.56Å; V140-F142 HydrophobicContact CG1-CZ 3.89Å
141	V	95.2	Very high	86.1	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	128	-177.3	-177	0	0	0	0	110.1	I112 V113 G114 V115 I139 F143 F156 V158 Y180	I112-V141 HydrophobicContact CD1-CG2 4.24Å; V113-V141 PolarHBondContact O-N 3.09Å; G114-V141 CarbonylContact C-O 3.57Å; G114-V141 WeakPolarHBondContact CA-O 3.03Å; V115-V141 PolarHBondContact N-O 3.45Å; I139-V141 HydrophobicContact CD1-CG2 4.39Å; I139-V141 HydrophobicContact CG1-CG2 4.12Å; V141-F143 HydrophobicContact CB-CE2 3.78Å; V141-F143 HydrophobicContact CB-CZ 3.92Å; V141-F143 HydrophobicContact CG1-CD1 4.33Å; V141-F143 HydrophobicContact CG1-CD2 4.17Å; V141-F143 HydrophobicContact CG1-CE1 3.75Å; V141-F143 HydrophobicContact CG1-CE2 3.58Å; V141-F143 HydrophobicContact CG1-CZ 3.35Å; V141-F156 HydrophobicContact CG1-CD1 4.05Å; V141-F156 HydrophobicContact CG2-CD1 4.02Å; V141-V158 HydrophobicContact CG1-CB 4.47Å; V141-V158 HydrophobicContact CG1-CG2 3.69Å; V141-Y180 HydrophobicContact CG2-CE2 4.1Å
142	F	95	Very high	85.6	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	124.7	179.5	-69.1	-96.4	0	0	0	110.7	V115 T117 I122 G126 V129 N130 V140 M155 F156 V157 V158	V115-F142 HydrophobicContact CB-CD1 3.66Å; V115-F142 HydrophobicContact CB-CE1 3.73Å; V115-F142 HydrophobicContact CB-CG 4.31Å; V115-F142 HydrophobicContact CB-CZ 4.41Å; V115-F142 HydrophobicContact CG1-CD1 3.83Å; V115-F142 HydrophobicContact CG1-CE1 3.75Å; V115-F142 HydrophobicContact CG2-CD1 4.27Å; V115-F142 HydrophobicContact CG2-CE1 3.89Å; V115-F142 HydrophobicContact CG2-CZ 4.13Å; V115-F142 CarbonylContact O-C 3.59Å; V115-F142 WeakPolarHBondContact O-CA 3.28Å; T117-F142 HydrophobicContact CG2-CB 4.27Å; I122-F142 HydrophobicContact CD1-CB 4.3Å; I122-F142 HydrophobicContact CD1-CD1 4.22Å; I122-F142 HydrophobicContact CD1-CG 4.44Å; G126-F142 WeakPolarHBondContact O-CE1 3.07Å; V129-F142 HydrophobicContact CB-CE1 4.31Å; V129-F142 HydrophobicContact CG1-CE1 4.19Å; V129-F142 HydrophobicContact CG1-CZ 4.27Å; N130-F142 HydrophobicContact CB-CE1 4.49Å; N130-F142 HydrophobicContact CB-CE2 3.92Å; N130-F142 HydrophobicContact CB-CZ 3.58Å; N130-F142 VanDerWaalsContact OD1-CE2 3.3Å; N130-F142 WeakPolarHBondContact OD1-CE2 3.42Å; V140-F142 HydrophobicContact CB-CE2 4.43Å; V140-F142 HydrophobicContact CG1-CD2 4.34Å; V140-F142 HydrophobicContact CG1-CE2 3.56Å; V140-F142 HydrophobicContact CG1-CZ 3.89Å; F142-M155 HydrophobicContact CB-CE 4.49Å; F142-M155 HydrophobicContact CD1-CE 3.64Å; F142-M155 HydrophobicContact CD2-CE 3.65Å; F142-M155 HydrophobicContact CE1-CE 3.69Å; F142-M155 HydrophobicContact CE2-CE 3.7Å; F142-M155 HydrophobicContact CG-CE 3.64Å; F142-M155 HydrophobicContact CZ-CE 3.74Å; F142-F156 PolarHBondContact N-O 3.48Å; F142-V157 HydrophobicContact CB-CB 4.46Å; F142-V157 HydrophobicContact CB-CG1 4.36Å; F142-V157 HydrophobicContact CB-CG2 4.05Å; F142-V157 CarbonylContact O-C 3.59Å; F142-V157 WeakPolarHBondContact O-CA 3.25Å; F142-V158 PolarHBondContact O-N 2.96Å
143	F	94.1	Very high	84.8	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	113.1	-172.4	-67.7	-77.6	0	0	0	112	V115 L116 T117 V141 V158 H160 N168 T172 Y175 V176	V115-F143 PolarHBondContact O-N 3.08Å; L116-F143 HydrophobicContact CD2-CB 4.23Å; T117-F143 PolarHBondContact N-O 3.27Å; V141-F143 HydrophobicContact CB-CE2 3.78Å; V141-F143 HydrophobicContact CB-CZ 3.92Å; V141-F143 HydrophobicContact CG1-CD1 4.33Å; V141-F143 HydrophobicContact CG1-CD2 4.17Å; V141-F143 HydrophobicContact CG1-CE1 3.75Å; V141-F143 HydrophobicContact CG1-CE2 3.58Å; V141-F143 HydrophobicContact CG1-CZ 3.35Å; F143-V158 HydrophobicContact CD1-CB 3.83Å; F143-V158 HydrophobicContact CD1-CG1 4.14Å; F143-V158 HydrophobicContact CD1-CG2 4.46Å; F143-V158 HydrophobicContact CE1-CB 3.98Å; F143-V158 HydrophobicContact CE1-CG1 4.2Å; F143-V158 HydrophobicContact CE1-CG2 4.15Å; F143-H160 AromaticContact CD1-NE2 3.41Å; F143-H160 WeakPolarHBondContact CD1-NE2 3.39Å; F143-N168 PolarHBondContact O-ND2 2.87Å; F143-T172 HydrophobicContact CB-CG2 4.11Å; F143-T172 WeakPolarHBondContact CB-OG1 3.44Å; F143-T172 HydrophobicContact CD1-CG2 3.84Å; F143-T172 HydrophobicContact CD2-CG2 3.52Å; F143-T172 HydrophobicContact CE1-CG2 4.08Å; F143-T172 HydrophobicContact CE2-CG2 3.76Å; F143-T172 HydrophobicContact CG-CG2 3.55Å; F143-T172 HydrophobicContact CZ-CG2 4.03Å; F143-Y175 AromaticContact CE1-CD1 3.6Å; F143-Y175 HydrophobicContact CE1-CD1 3.6Å; F143-Y175 HydrophobicContact CE1-CE1 4.21Å; F143-Y175 HydrophobicContact CE1-CG 4.24Å; F143-Y175 HydrophobicContact CZ-CD1 4.05Å; F143-V176 HydrophobicContact CE2-CG2 4.33Å; F143-V176 HydrophobicContact CZ-CG2 3.78Å
144	T	92.4	Very high	84.2	Confident	1 Å²	1	72.2 Å²	72.2	1%	0.006	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	141.3	-176.9	-177.2	0	0	0	0	113.4	V157 V158 S159 H160 N168	T144-V157 HydrophobicContact CG2-CG1 3.75Å; T144-V158 PolarHBondContact N-O 3.46Å; T144-S159 WeakPolarHBondContact CG2-OG 3.45Å; T144-S159 CarbonylContact O-C 3.53Å; T144-S159 VanDerWaalsContact O-CA 3.31Å; T144-S159 WeakPolarHBondContact O-CA 3.32Å; T144-H160 PolarHBondContact O-N 3.36Å; T144-N168 PolarHBondContact O-OD1 3.37Å
145	G	86	Confident	84.1	Confident	7 Å²	7	71.2 Å²	71.2	7%	0.072	35%	0.349	C	S	.	.	S	Bend	trans	-68.3	-43.8	175.7	0	0	0	0	0	112.6	G161 D162 N168	G145-G161 CarbonylContact O-C 3.53Å; G145-G161 VanDerWaalsContact O-C 3.27Å; G145-G161 WeakPolarHBondContact O-CA 3.18Å; G145-G161 PolarHBondContact O-N 3.05Å; G145-D162 CarbonylContact C-O 3.53Å; G145-D162 WeakPolarHBondContact CA-O 3.47Å; G145-D162 PolarHBondContact O-N 2.93Å; G145-N168 WeakPolarHBondContact CA-OD1 3.47Å; G145-N168 PolarHBondContact N-OD1 2.81Å
146	S	82.3	Confident	84.2	Confident	13 Å²	13	69.5 Å²	69.5	9%	0.091	34%	0.34	C	S	.	.	S	Bend	trans	-87.6	132.1	-174	-45.8	0	0	0	0	112.3	N148 E163	S146-N148 PolarHBondContact O-N 3.41Å; S146-E163 WeakPolarHBondContact CB-OE1 3.47Å; S146-E163 VanDerWaalsContact OG-CD 3.31Å; S146-E163 WeakPolarHBondContact OG-CG 3.46Å; S146-E163 PolarHBondContact OG-OE1 3.45Å
147	R	78	Confident	84.3	Confident	202 Å²	202	68 Å²	68	76%	0.762	34%	0.335	S	S	*	.			trans	-70	96.5	171.3	-68.9	-177.5	178.8	-176.3	0.9	111.4
148	N	69.4	Low	84.5	Confident	44 Å²	44	68 Å²	68	24%	0.235	34%	0.335	C	S	.	.			trans	-83.3	131.6	176.2	-101.6	-16.8	0	0	0	111.9	I122 S146 K150	I122-N148 WeakPolarHBondContact CG2-ND2 3.42Å; S146-N148 PolarHBondContact O-N 3.41Å; N148-K150 VanDerWaalsContact C-N 3.32Å
149	R	63.6	Low	84.8	Confident	253 Å²	253	63.3 Å²	63.3	96%	0.955	31%	0.313	S	S	*	.	S	Bend	trans	-80.1	-10.5	177.4	-68.1	-173.3	-179.3	-177.4	0.4	114.3
150	K	71.8	Confident	84.8	Confident	178 Å²	178	63.3 Å²	63.3	77%	0.774	31%	0.313	S	S	*	.			trans	-127.5	101	176.1	-66.5	-174.2	178.5	-174.1	0	107	N148	N148-K150 VanDerWaalsContact C-N 3.32Å
151	V	78.1	Confident	84.1	Confident	63 Å²	63	64.8 Å²	64.8	38%	0.382	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-94	137.6	170.8	175.1	0	0	0	0	107.2	V157	V151-V157 HydrophobicContact CG1-CB 3.86Å; V151-V157 HydrophobicContact CG1-CG2 3.43Å; V151-V157 VanDerWaalsContact CG1-CG2 3.43Å; V151-V157 HydrophobicContact CG2-CB 4.44Å
152	P	81.3	Confident	83.4	Confident	28 Å²	28	66.4 Å²	66.4	18%	0.182	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-58.9	141.6	175.3	-23	33.7	0	0	0	111.9	V127 G154 M155	V127-P152 HydrophobicContact CG2-CB 3.96Å; V127-P152 HydrophobicContact CG2-CG 3.69Å; P152-G154 PolarHBondContact O-N 3.17Å; P152-M155 HydrophobicContact CB-CG 4.25Å; P152-M155 HydrophobicContact CB-SD 3.64Å; P152-M155 HydrophobicContact CG-SD 3.75Å; P152-M155 PolarHBondContact O-N 2.81Å
153	H	77.9	Confident	82.7	Confident	195 Å²	195	72.6 Å²	72.6	90%	0.903	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	135.2	179.8	-62.7	-68.2	0	0	0	111.1
154	G	80.5	Confident	82.4	Confident	80 Å²	80	79.8 Å²	79.8	83%	0.825	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	4.6	179.4	0	0	0	0	0	115.8	P152	P152-G154 PolarHBondContact O-N 3.17Å
155	M	88.1	Confident	82.1	Confident	18 Å²	18	85.2 Å²	85.2	9%	0.089	42%	0.424	C	S	.	.			trans	-102.5	133.1	175.7	-68.6	-177.3	64.9	0	0	112	I122 G126 V127 N130 F142 P152 V157	I122-M155 HydrophobicContact CD1-CE 3.57Å; G126-M155 WeakPolarHBondContact O-CE 3.43Å; V127-M155 HydrophobicContact CG2-SD 3.98Å; N130-M155 HydrophobicContact CB-CE 3.95Å; N130-M155 HydrophobicContact CB-CG 4.03Å; N130-M155 HydrophobicContact CB-SD 4.03Å; N130-M155 WeakPolarHBondContact ND2-CG 3.28Å; F142-M155 HydrophobicContact CB-CE 4.49Å; F142-M155 HydrophobicContact CD1-CE 3.64Å; F142-M155 HydrophobicContact CD2-CE 3.65Å; F142-M155 HydrophobicContact CE1-CE 3.69Å; F142-M155 HydrophobicContact CE2-CE 3.7Å; F142-M155 HydrophobicContact CG-CE 3.64Å; F142-M155 HydrophobicContact CZ-CE 3.74Å; P152-M155 HydrophobicContact CB-CG 4.25Å; P152-M155 HydrophobicContact CB-SD 3.64Å; P152-M155 HydrophobicContact CG-SD 3.75Å; P152-M155 PolarHBondContact O-N 2.81Å; M155-V157 HydrophobicContact CB-CG2 3.81Å; M155-V157 HydrophobicContact CE-CG2 4.49Å; M155-V157 PolarHBondContact O-N 3.39Å
156	F	89.9	Confident	82.3	Confident	115 Å²	115	85.9 Å²	85.9	50%	0.504	43%	0.425	S	S	.	.			trans	-87.5	100.1	171.9	-159.4	-97.1	0	0	0	110	V141 F142 V158	V141-F156 HydrophobicContact CG1-CD1 4.05Å; V141-F156 HydrophobicContact CG2-CD1 4.02Å; F142-F156 PolarHBondContact N-O 3.48Å; F156-V158 HydrophobicContact CE1-CG2 4.24Å
157	V	91.4	Very high	82.7	Confident	31 Å²	31	88.4 Å²	88.4	19%	0.188	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	120.5	-172.7	-172.3	0	0	0	0	111.5	I122 F142 T144 V151 M155	I122-V157 HydrophobicContact CD1-CG2 4.3Å; F142-V157 HydrophobicContact CB-CB 4.46Å; F142-V157 HydrophobicContact CB-CG1 4.36Å; F142-V157 HydrophobicContact CB-CG2 4.05Å; F142-V157 CarbonylContact O-C 3.59Å; F142-V157 WeakPolarHBondContact O-CA 3.25Å; T144-V157 HydrophobicContact CG2-CG1 3.75Å; V151-V157 HydrophobicContact CG1-CB 3.86Å; V151-V157 HydrophobicContact CG1-CG2 3.43Å; V151-V157 VanDerWaalsContact CG1-CG2 3.43Å; V151-V157 HydrophobicContact CG2-CB 4.44Å; M155-V157 HydrophobicContact CB-CG2 3.81Å; M155-V157 HydrophobicContact CE-CG2 4.49Å; M155-V157 PolarHBondContact O-N 3.39Å
158	V	91.6	Very high	83.3	Confident	16 Å²	16	79.3 Å²	79.3	10%	0.097	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	125.6	175.7	179.9	0	0	0	0	109.1	V141 F142 F143 T144 F156 Y175	V141-V158 HydrophobicContact CG1-CB 4.47Å; V141-V158 HydrophobicContact CG1-CG2 3.69Å; F142-V158 PolarHBondContact O-N 2.96Å; F143-V158 HydrophobicContact CD1-CB 3.83Å; F143-V158 HydrophobicContact CD1-CG1 4.14Å; F143-V158 HydrophobicContact CD1-CG2 4.46Å; F143-V158 HydrophobicContact CE1-CB 3.98Å; F143-V158 HydrophobicContact CE1-CG1 4.2Å; F143-V158 HydrophobicContact CE1-CG2 4.15Å; T144-V158 PolarHBondContact N-O 3.46Å; F156-V158 HydrophobicContact CE1-CG2 4.24Å; V158-Y175 HydrophobicContact CG1-CD1 4.43Å; V158-Y175 HydrophobicContact CG1-CD2 4.12Å; V158-Y175 HydrophobicContact CG1-CE1 4.36Å; V158-Y175 HydrophobicContact CG1-CE2 4.07Å; V158-Y175 HydrophobicContact CG1-CG 4.3Å; V158-Y175 HydrophobicContact CG2-CD1 4.42Å; V158-Y175 HydrophobicContact CG2-CE1 3.75Å; V158-Y175 HydrophobicContact CG2-CE2 4.48Å
159	S	90.6	Very high	84.3	Confident	38 Å²	38	77.3 Å²	77.3	27%	0.266	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	107.3	-178.5	-63.1	0	0	0	0	112	T144	T144-S159 WeakPolarHBondContact CG2-OG 3.45Å; T144-S159 CarbonylContact O-C 3.53Å; T144-S159 VanDerWaalsContact O-CA 3.31Å; T144-S159 WeakPolarHBondContact O-CA 3.32Å
160	H	88.5	Confident	85.7	Confident	35 Å²	35	65.3 Å²	65.3	16%	0.162	34%	0.344	C	S	.	.			trans	-77.5	-24.5	-173.9	-66.5	-54.9	0	0	0	114.4	F143 T144 N168 Q171 T172	F143-H160 AromaticContact CD1-NE2 3.41Å; F143-H160 WeakPolarHBondContact CD1-NE2 3.39Å; T144-H160 PolarHBondContact O-N 3.36Å; H160-N168 PolarHBondContact CD2-OD1 3.04Å; H160-Q171 HydrophobicContact CB-CB 3.8Å; H160-Q171 HydrophobicContact CB-CG 4.18Å; H160-Q171 PolarHBondContact CE1-O 3.03Å; H160-T172 PolarHBondContact NE2-N 3.41Å
161	G	80.8	Confident	86.8	Confident	44 Å²	44	58.9 Å²	58.9	45%	0.454	32%	0.316	S	S	.	.	S	Bend	trans	91.5	14.4	173.4	0	0	0	0	0	116.2	G145	G145-G161 CarbonylContact O-C 3.53Å; G145-G161 VanDerWaalsContact O-C 3.27Å; G145-G161 WeakPolarHBondContact O-CA 3.18Å; G145-G161 PolarHBondContact O-N 3.05Å
162	D	79.8	Confident	87.5	Confident	34 Å²	34	55.9 Å²	55.9	18%	0.182	30%	0.298	C	S	.	.			trans	-134.3	128	174.9	-166.5	-39.4	0	0	0	109.3	G145 R164 W167	G145-D162 CarbonylContact C-O 3.53Å; G145-D162 WeakPolarHBondContact CA-O 3.47Å; G145-D162 PolarHBondContact O-N 2.93Å; D162-R164 VanDerWaalsContact C-N 3.3Å; D162-R164 PolarHBondContact O-N 3.28Å; D162-R164 VanDerWaalsContact OD1-CB 3.28Å; D162-R164 WeakPolarHBondContact OD1-CB 3.42Å; D162-R164 VanDerWaalsContact OD1-CG 3.28Å; D162-R164 WeakPolarHBondContact OD1-CG 3.49Å; D162-R164 IonicContact OD1-CZ 3.38Å; D162-R164 PolarHBondContact OD1-N 3.29Å; D162-R164 IonicContact OD1-NE 3.16Å; D162-R164 PolarHBondContact OD1-NE 3.4Å; D162-R164 IonicContact OD2-CZ 3.66Å; D162-R164 VanDerWaalsContact OD2-CZ 3.28Å; D162-R164 IonicContact OD2-NE 3.71Å; D162-R164 PolarHBondContact OD2-NE 3.3Å; D162-R164 VanDerWaalsContact OD2-NE 3.09Å; D162-R164 IonicContact OD2-NH2 3.65Å; D162-R164 PolarHBondContact OD2-NH2 2.86Å; D162-W167 HydrophobicContact CB-CB 4.27Å; D162-W167 HydrophobicContact CB-CG 3.91Å
163	E	80.1	Confident	88.2	Confident	130 Å²	130	54.5 Å²	54.5	61%	0.607	29%	0.289	S	S	*	.			trans	-81.9	-6	-175.5	-51.9	-163.3	142.5	0	0	113.2	S146 L165	S146-E163 WeakPolarHBondContact CB-OE1 3.47Å; S146-E163 VanDerWaalsContact OG-CD 3.31Å; S146-E163 WeakPolarHBondContact OG-CG 3.46Å; S146-E163 PolarHBondContact OG-OE1 3.45Å; E163-L165 PolarHBondContact O-N 2.96Å
164	R	87.8	Confident	89	Confident	151 Å²	151	49.8 Å²	49.8	57%	0.57	26%	0.263	S	S	*	.			trans	-71.8	119.7	177.3	-64.5	177	-69.6	170.6	0.7	110.4	D162 I166 W167 N168	D162-R164 VanDerWaalsContact C-N 3.3Å; D162-R164 PolarHBondContact O-N 3.28Å; D162-R164 VanDerWaalsContact OD1-CB 3.28Å; D162-R164 WeakPolarHBondContact OD1-CB 3.42Å; D162-R164 VanDerWaalsContact OD1-CG 3.28Å; D162-R164 WeakPolarHBondContact OD1-CG 3.49Å; D162-R164 IonicContact OD1-CZ 3.38Å; D162-R164 PolarHBondContact OD1-N 3.29Å; D162-R164 IonicContact OD1-NE 3.16Å; D162-R164 PolarHBondContact OD1-NE 3.4Å; D162-R164 IonicContact OD2-CZ 3.66Å; D162-R164 VanDerWaalsContact OD2-CZ 3.28Å; D162-R164 IonicContact OD2-NE 3.71Å; D162-R164 PolarHBondContact OD2-NE 3.3Å; D162-R164 VanDerWaalsContact OD2-NE 3.09Å; D162-R164 IonicContact OD2-NH2 3.65Å; D162-R164 PolarHBondContact OD2-NH2 2.86Å; R164-I166 VanDerWaalsContact C-N 3.32Å; R164-I166 PolarHBondContact O-N 2.76Å; R164-W167 HydrophobicContact CB-CB 4.05Å; R164-W167 WeakPolarHBondContact O-CA 3.5Å; R164-W167 WeakPolarHBondContact O-CB 3.36Å; R164-W167 PolarHBondContact O-N 3.41Å; R164-N168 PolarHBondContact O-N 3Å
165	L	87.4	Confident	89.7	Confident	114 Å²	114	48.4 Å²	48.4	60%	0.597	23%	0.233	S	C	*	.	H	α-helix	trans	-52.9	-44.6	-174.6	-60	178.7	0	0	0	113.6	E163 W167 N168 M169 P264	E163-L165 PolarHBondContact O-N 2.96Å; L165-W167 VanDerWaalsContact C-N 3.34Å; L165-W167 PolarHBondContact O-N 2.99Å; L165-N168 WeakPolarHBondContact O-CB 3.48Å; L165-N168 PolarHBondContact O-N 3.47Å; L165-M169 WeakPolarHBondContact O-CB 3.33Å; L165-M169 PolarHBondContact O-N 3.02Å; L165-P264 HydrophobicContact CB-CB 4.47Å; L165-P264 HydrophobicContact CB-CG 4.25Å
166	I	90.3	Very high	90	Very high	21 Å²	21	47.6 Å²	47.6	11%	0.108	23%	0.23	C	C	.	.	H	α-helix	trans	-66.1	-36.3	178.5	-60	174.8	0	0	0	111.3	R164 M169 F170 I259 S261 P264 W267	R164-I166 VanDerWaalsContact C-N 3.32Å; R164-I166 PolarHBondContact O-N 2.76Å; I166-M169 PolarHBondContact O-N 2.03Å; I166-F170 WeakPolarHBondContact O-CB 3.42Å; I166-F170 PolarHBondContact O-N 3.31Å; I166-I259 HydrophobicContact CD1-CG2 3.59Å; I166-I259 HydrophobicContact CG2-CD1 4Å; I166-I259 HydrophobicContact CG2-CG1 4.31Å; I166-I259 HydrophobicContact CG2-CG2 4.28Å; I166-S261 WeakPolarHBondContact CD1-O 3.43Å; I166-P264 HydrophobicContact CG1-CB 4.43Å; I166-W267 HydrophobicContact CG2-CB 4.17Å; I166-W267 HydrophobicContact CG2-CD2 3.64Å; I166-W267 HydrophobicContact CG2-CE3 4.15Å; I166-W267 HydrophobicContact CG2-CG 3.59Å
167	W	89.2	Confident	90.2	Very high	67 Å²	67	42.4 Å²	42.4	25%	0.254	21%	0.207	S	C	.	.	H	α-helix	trans	-71.6	-40.1	175.7	-167	-83.7	0	0	0	111.9	D162 R164 L165 M169 F170 Q171 R256	D162-W167 HydrophobicContact CB-CB 4.27Å; D162-W167 HydrophobicContact CB-CG 3.91Å; R164-W167 HydrophobicContact CB-CB 4.05Å; R164-W167 WeakPolarHBondContact O-CA 3.5Å; R164-W167 WeakPolarHBondContact O-CB 3.36Å; R164-W167 PolarHBondContact O-N 3.41Å; L165-W167 VanDerWaalsContact C-N 3.34Å; L165-W167 PolarHBondContact O-N 2.99Å; W167-M169 VanDerWaalsContact C-N 3.25Å; W167-M169 PolarHBondContact O-N 3.49Å; W167-F170 PolarHBondContact O-N 3.16Å; W167-Q171 HydrophobicContact CG-CG 4.45Å; W167-Q171 WeakPolarHBondContact O-CB 3.34Å; W167-Q171 VanDerWaalsContact O-CG 3.26Å; W167-Q171 WeakPolarHBondContact O-CG 3.38Å; W167-Q171 PolarHBondContact O-N 3.35Å; W167-R256 HydrophobicContact CE3-CG 4.24Å; W167-R256 HydrophobicContact CZ3-CG 3.85Å
168	N	90.3	Very high	90.3	Very high	10 Å²	10	45.5 Å²	45.5	5%	0.053	22%	0.223	C	C	.	.	H	α-helix	trans	-57	-43.9	172.2	-168.5	52.4	0	0	0	110.4	F143 T144 G145 H160 R164 L165 Q171 T172	F143-N168 PolarHBondContact O-ND2 2.87Å; T144-N168 PolarHBondContact O-OD1 3.37Å; G145-N168 WeakPolarHBondContact CA-OD1 3.47Å; G145-N168 PolarHBondContact N-OD1 2.81Å; H160-N168 PolarHBondContact CD2-OD1 3.04Å; R164-N168 PolarHBondContact O-N 3Å; L165-N168 WeakPolarHBondContact O-CB 3.48Å; L165-N168 PolarHBondContact O-N 3.47Å; N168-Q171 PolarHBondContact O-N 2.87Å; N168-T172 WeakPolarHBondContact O-CB 3.41Å; N168-T172 PolarHBondContact O-N 3.31Å; N168-T172 PolarHBondContact O-OG1 3.07Å
169	M	92.1	Very high	90.4	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-64.3	-48.7	177.2	-170.8	59.3	-163.8	0	0	113	L116 L165 I166 W167 Q171 T172 I173 Y238 P264 W267 L268	L116-M169 HydrophobicContact CD1-SD 3.59Å; L116-M169 VanDerWaalsContact CD1-SD 3.59Å; L116-M169 HydrophobicContact CD2-SD 3.94Å; L116-M169 HydrophobicContact CG-SD 4.39Å; L165-M169 WeakPolarHBondContact O-CB 3.33Å; L165-M169 PolarHBondContact O-N 3.02Å; I166-M169 PolarHBondContact O-N 2.03Å; W167-M169 VanDerWaalsContact C-N 3.25Å; W167-M169 PolarHBondContact O-N 3.49Å; M169-Q171 VanDerWaalsContact C-N 3.34Å; M169-Q171 PolarHBondContact O-N 3.19Å; M169-T172 WeakPolarHBondContact O-CB 3.41Å; M169-T172 PolarHBondContact O-N 2.93Å; M169-T172 VanDerWaalsContact O-N 3.16Å; M169-I173 HydrophobicContact CE-CD1 3.7Å; M169-I173 HydrophobicContact CE-CG1 3.72Å; M169-I173 PolarHBondContact O-N 2.94Å; M169-Y238 WeakPolarHBondContact CE-OH 3.46Å; M169-P264 HydrophobicContact CB-CB 3.83Å; M169-P264 HydrophobicContact CG-CB 4.1Å; M169-W267 HydrophobicContact CB-CE3 4.44Å; M169-W267 HydrophobicContact CB-CZ3 4.31Å; M169-W267 HydrophobicContact CG-CE3 4.11Å; M169-W267 HydrophobicContact CG-CZ3 3.94Å; M169-L268 HydrophobicContact CE-CB 4.38Å; M169-L268 HydrophobicContact CE-CD2 3.45Å; M169-L268 VanDerWaalsContact CE-CD2 3.45Å; M169-L268 HydrophobicContact CE-CG 4.4Å
170	F	93.3	Very high	90.4	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.009	23%	0.231	C	C	.	.	H	α-helix	trans	-55.7	-46.8	174.5	167	-96.7	0	0	0	112.2	I166 W167 T172 R174 L252 R256 W267	I166-F170 WeakPolarHBondContact O-CB 3.42Å; I166-F170 PolarHBondContact O-N 3.31Å; W167-F170 PolarHBondContact O-N 3.16Å; F170-T172 VanDerWaalsContact C-N 3.33Å; F170-T172 PolarHBondContact O-N 3.42Å; F170-R174 WeakPolarHBondContact O-CB 3.48Å; F170-R174 PolarHBondContact O-N 2.9Å; F170-L252 HydrophobicContact CE2-CB 4.02Å; F170-L252 WeakPolarHBondContact CE2-O 3.47Å; F170-R256 HydrophobicContact CD1-CG 4.19Å; F170-R256 HydrophobicContact CD2-CB 3.9Å; F170-R256 HydrophobicContact CD2-CG 4Å; F170-R256 HydrophobicContact CE1-CG 4.34Å; F170-R256 HydrophobicContact CE2-CB 3.87Å; F170-R256 HydrophobicContact CE2-CG 4.13Å; F170-R256 HydrophobicContact CG-CB 4.44Å; F170-R256 HydrophobicContact CG-CG 4.04Å; F170-R256 HydrophobicContact CZ-CB 4.41Å; F170-R256 HydrophobicContact CZ-CG 4.32Å; F170-W267 HydrophobicContact CB-CH2 3.63Å; F170-W267 HydrophobicContact CB-CZ2 4.14Å; F170-W267 HydrophobicContact CB-CZ3 4.22Å; F170-W267 AromaticContact CD2-CH2 3.98Å; F170-W267 HydrophobicContact CD2-CH2 3.98Å; F170-W267 HydrophobicContact CD2-CZ2 4.17Å; F170-W267 HydrophobicContact CG-CH2 4.31Å
171	Q	93.3	Very high	90.6	Very high	42 Å²	42	47.1 Å²	47.1	20%	0.196	22%	0.224	C	C	.	.	H	α-helix	trans	-69.5	-31	178.9	-65.1	-67.9	-17.3	0	0	112.4	H160 W167 N168 M169 Y175	H160-Q171 HydrophobicContact CB-CB 3.8Å; H160-Q171 HydrophobicContact CB-CG 4.18Å; H160-Q171 PolarHBondContact CE1-O 3.03Å; W167-Q171 HydrophobicContact CG-CG 4.45Å; W167-Q171 WeakPolarHBondContact O-CB 3.34Å; W167-Q171 VanDerWaalsContact O-CG 3.26Å; W167-Q171 WeakPolarHBondContact O-CG 3.38Å; W167-Q171 PolarHBondContact O-N 3.35Å; N168-Q171 PolarHBondContact O-N 2.87Å; M169-Q171 VanDerWaalsContact C-N 3.34Å; M169-Q171 PolarHBondContact O-N 3.19Å; Q171-Y175 WeakPolarHBondContact O-CB 3.26Å; Q171-Y175 PolarHBondContact O-N 3.44Å
172	T	94.3	Very high	90.9	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.2	-53.6	174.3	-63	0	0	0	0	110.6	L116 F143 H160 N168 M169 F170 R174 Y175 V176 F189	L116-T172 HydrophobicContact CD2-CG2 4.11Å; F143-T172 HydrophobicContact CB-CG2 4.11Å; F143-T172 WeakPolarHBondContact CB-OG1 3.44Å; F143-T172 HydrophobicContact CD1-CG2 3.84Å; F143-T172 HydrophobicContact CD2-CG2 3.52Å; F143-T172 HydrophobicContact CE1-CG2 4.08Å; F143-T172 HydrophobicContact CE2-CG2 3.76Å; F143-T172 HydrophobicContact CG-CG2 3.55Å; F143-T172 HydrophobicContact CZ-CG2 4.03Å; H160-T172 PolarHBondContact NE2-N 3.41Å; N168-T172 WeakPolarHBondContact O-CB 3.41Å; N168-T172 PolarHBondContact O-N 3.31Å; N168-T172 PolarHBondContact O-OG1 3.07Å; M169-T172 WeakPolarHBondContact O-CB 3.41Å; M169-T172 PolarHBondContact O-N 2.93Å; M169-T172 VanDerWaalsContact O-N 3.16Å; F170-T172 VanDerWaalsContact C-N 3.33Å; F170-T172 PolarHBondContact O-N 3.42Å; T172-R174 VanDerWaalsContact C-N 3.33Å; T172-R174 PolarHBondContact O-N 3.3Å; T172-Y175 PolarHBondContact O-N 2.98Å; T172-V176 WeakPolarHBondContact O-CG2 3.31Å; T172-V176 PolarHBondContact O-N 2.95Å; T172-F189 HydrophobicContact CG2-CD1 4.15Å; T172-F189 HydrophobicContact CG2-CE1 3.64Å
173	I	95.4	Very high	91.3	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-42.7	178.5	-62.8	-59.4	0	0	0	111.2	M169 V176 L177 F189 L240 L245 L252 L268	M169-I173 HydrophobicContact CE-CD1 3.7Å; M169-I173 HydrophobicContact CE-CG1 3.72Å; M169-I173 PolarHBondContact O-N 2.94Å; I173-V176 PolarHBondContact O-N 3.35Å; I173-L177 HydrophobicContact CG2-CD1 4.05Å; I173-L177 WeakPolarHBondContact O-CB 3.07Å; I173-L177 WeakPolarHBondContact O-CG 3.32Å; I173-L177 PolarHBondContact O-N 3.41Å; I173-F189 HydrophobicContact CD1-CD2 4.25Å; I173-F189 HydrophobicContact CD1-CE1 4.18Å; I173-F189 HydrophobicContact CD1-CE2 3.64Å; I173-F189 HydrophobicContact CD1-CZ 3.6Å; I173-L240 HydrophobicContact CD1-CD1 4.35Å; I173-L245 HydrophobicContact CG2-CD2 4.07Å; I173-L252 HydrophobicContact CG2-CD1 3.84Å; I173-L252 HydrophobicContact CG2-CD2 4.12Å; I173-L268 HydrophobicContact CD1-CD2 4.27Å; I173-L268 HydrophobicContact CG1-CD1 4.36Å
174	R	94.4	Very high	91.8	Very high	96 Å²	96	48.3 Å²	48.3	36%	0.362	22%	0.22	S	C	.	.	H	α-helix	trans	-59.9	-46.5	174.5	-178	-176.5	-172.8	135.7	9.2	112.4	F170 T172 V176 L177 D178 E253	F170-R174 WeakPolarHBondContact O-CB 3.48Å; F170-R174 PolarHBondContact O-N 2.9Å; T172-R174 VanDerWaalsContact C-N 3.33Å; T172-R174 PolarHBondContact O-N 3.3Å; R174-V176 VanDerWaalsContact C-N 3.33Å; R174-V176 PolarHBondContact O-N 2.71Å; R174-L177 WeakPolarHBondContact O-CB 3.26Å; R174-L177 PolarHBondContact O-N 3.14Å; R174-D178 IonicContact NE-OD2 3.02Å; R174-D178 WeakPolarHBondContact O-CB 3.37Å; R174-D178 PolarHBondContact O-N 2.94Å; R174-E253 IonicContact CZ-OE1 2.7Å; R174-E253 IonicContact NH1-OE1 2.68Å; R174-E253 PolarHBondContact NH1-OE1 3.03Å
175	Y	95	Very high	92	Very high	50 Å²	50	42.2 Å²	42.2	20%	0.196	20%	0.199	C	C	.	.	H	α-helix	trans	-62.3	-42.6	-179.6	-177.9	-89.9	0	0	0	111.5	F143 V158 Q171 T172 D178 H179 Y180	F143-Y175 AromaticContact CE1-CD1 3.6Å; F143-Y175 HydrophobicContact CE1-CD1 3.6Å; F143-Y175 HydrophobicContact CE1-CE1 4.21Å; F143-Y175 HydrophobicContact CE1-CG 4.24Å; F143-Y175 HydrophobicContact CZ-CD1 4.05Å; V158-Y175 HydrophobicContact CG1-CD1 4.43Å; V158-Y175 HydrophobicContact CG1-CD2 4.12Å; V158-Y175 HydrophobicContact CG1-CE1 4.36Å; V158-Y175 HydrophobicContact CG1-CE2 4.07Å; V158-Y175 HydrophobicContact CG1-CG 4.3Å; V158-Y175 HydrophobicContact CG2-CD1 4.42Å; V158-Y175 HydrophobicContact CG2-CE1 3.75Å; V158-Y175 HydrophobicContact CG2-CE2 4.48Å; Q171-Y175 WeakPolarHBondContact O-CB 3.26Å; Q171-Y175 PolarHBondContact O-N 3.44Å; T172-Y175 PolarHBondContact O-N 2.98Å; Y175-D178 PolarHBondContact O-N 3.26Å; Y175-H179 AromaticContact CD2-CE1 3.42Å; Y175-H179 VanDerWaalsContact CD2-CE1 3.42Å; Y175-H179 WeakPolarHBondContact CD2-CE1 3.48Å; Y175-H179 AromaticContact CD2-ND1 3.52Å; Y175-H179 HydrophobicContact CE1-CB 4.48Å; Y175-H179 AromaticContact CE2-CE1 3.29Å; Y175-H179 WeakPolarHBondContact CE2-CE1 3.18Å; Y175-H179 AromaticContact CE2-ND1 3.55Å; Y175-H179 AromaticContact CE2-NE2 3.62Å; Y175-H179 AromaticContact CG-ND1 3.8Å; Y175-H179 AromaticContact CZ-CE1 3.97Å; Y175-H179 AromaticContact CZ-CG 3.95Å; Y175-H179 AromaticContact CZ-ND1 3.87Å; Y175-H179 WeakPolarHBondContact O-CB 3.46Å; Y175-H179 PolarHBondContact O-N 3.47Å; Y175-H179 PolarHBondContact O-ND1 2.99Å; Y175-Y180 HydrophobicContact CD1-CE2 4.38Å; Y175-Y180 AromaticContact CE1-CE2 3.84Å; Y175-Y180 HydrophobicContact CE1-CE2 3.84Å
176	V	95.2	Very high	92.3	Very high	2 Å²	2	37 Å²	37	1%	0.012	17%	0.171	C	C	.	.	H	α-helix	trans	-63.1	-40.8	174.9	168.6	0	0	0	0	111.7	F143 T172 I173 R174 Y180 V181 F187 F189 L245	F143-V176 HydrophobicContact CE2-CG2 4.33Å; F143-V176 HydrophobicContact CZ-CG2 3.78Å; T172-V176 WeakPolarHBondContact O-CG2 3.31Å; T172-V176 PolarHBondContact O-N 2.95Å; I173-V176 PolarHBondContact O-N 3.35Å; R174-V176 VanDerWaalsContact C-N 3.33Å; R174-V176 PolarHBondContact O-N 2.71Å; V176-Y180 HydrophobicContact CG2-CD2 4.43Å; V176-Y180 WeakPolarHBondContact O-CA 3.31Å; V176-Y180 PolarHBondContact O-N 3.03Å; V176-V181 PolarHBondContact O-N 3.11Å; V176-V181 VanDerWaalsContact O-N 3.07Å; V176-F187 HydrophobicContact CG1-CD1 3.21Å; V176-F187 HydrophobicContact CG1-CE1 3.47Å; V176-F187 VanDerWaalsContact CG1-CE1 3.47Å; V176-F187 HydrophobicContact CG1-CG 4.2Å; V176-F189 HydrophobicContact CB-CZ 4.35Å; V176-F189 HydrophobicContact CG1-CZ 4.23Å; V176-F189 HydrophobicContact CG2-CE1 4.13Å; V176-F189 HydrophobicContact CG2-CZ 3.96Å; V176-L245 HydrophobicContact CG1-CD1 4.42Å
177	L	94.4	Very high	92.5	Very high	6 Å²	6	36 Å²	36	3%	0.031	17%	0.166	C	C	.	.	H	α-helix	trans	-62.9	-41.1	173.1	-81.1	168	0	0	0	113.4	I173 R174 V181 L245 Q249 L252	I173-L177 HydrophobicContact CG2-CD1 4.05Å; I173-L177 WeakPolarHBondContact O-CB 3.07Å; I173-L177 WeakPolarHBondContact O-CG 3.32Å; I173-L177 PolarHBondContact O-N 3.41Å; R174-L177 WeakPolarHBondContact O-CB 3.26Å; R174-L177 PolarHBondContact O-N 3.14Å; L177-V181 HydrophobicContact CD2-CB 4.19Å; L177-V181 HydrophobicContact CD2-CG2 3.86Å; L177-V181 WeakPolarHBondContact O-CG1 3.15Å; L177-L245 HydrophobicContact CD2-CB 3.96Å; L177-Q249 HydrophobicContact CD1-CB 3.9Å; L177-Q249 HydrophobicContact CD1-CG 4.04Å; L177-Q249 HydrophobicContact CD2-CB 4.12Å; L177-Q249 HydrophobicContact CD2-CG 4.38Å; L177-L252 HydrophobicContact CD1-CD1 3.28Å
178	D	93.6	Very high	92.9	Very high	95 Å²	95	32.9 Å²	32.9	51%	0.508	15%	0.154	S	C	.	.	H	α-helix	trans	-76.5	-29.2	-177.1	-70.4	-21.5	0	0	0	112.6	R174 Y175	R174-D178 IonicContact NE-OD2 3.02Å; R174-D178 WeakPolarHBondContact O-CB 3.37Å; R174-D178 PolarHBondContact O-N 2.94Å; Y175-D178 PolarHBondContact O-N 3.26Å
179	H	92.1	Very high	93.2	Very high	97 Å²	97	32.5 Å²	32.5	45%	0.449	15%	0.152	S	C	.	.	H	α-helix	trans	-111.6	-38.3	-172	-60.1	75.7	0	0	0	114.7	Y175	Y175-H179 AromaticContact CD2-CE1 3.42Å; Y175-H179 VanDerWaalsContact CD2-CE1 3.42Å; Y175-H179 WeakPolarHBondContact CD2-CE1 3.48Å; Y175-H179 AromaticContact CD2-ND1 3.52Å; Y175-H179 HydrophobicContact CE1-CB 4.48Å; Y175-H179 AromaticContact CE2-CE1 3.29Å; Y175-H179 WeakPolarHBondContact CE2-CE1 3.18Å; Y175-H179 AromaticContact CE2-ND1 3.55Å; Y175-H179 AromaticContact CE2-NE2 3.62Å; Y175-H179 AromaticContact CG-ND1 3.8Å; Y175-H179 AromaticContact CZ-CE1 3.97Å; Y175-H179 AromaticContact CZ-CG 3.95Å; Y175-H179 AromaticContact CZ-ND1 3.87Å; Y175-H179 WeakPolarHBondContact O-CB 3.46Å; Y175-H179 PolarHBondContact O-N 3.47Å; Y175-H179 PolarHBondContact O-ND1 2.99Å
180	Y	92	Very high	93.3	Very high	22 Å²	22	32.6 Å²	32.6	9%	0.086	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.9	-17.4	-165.5	-63.5	-60.4	0	0	0	114.9	I112 I139 V141 Y175 V176 N182 E183 Y184	I112-Y180 HydrophobicContact CD1-CD1 3.9Å; I112-Y180 HydrophobicContact CD1-CD2 3.31Å; I112-Y180 HydrophobicContact CD1-CE1 4.18Å; I112-Y180 HydrophobicContact CD1-CE2 3.63Å; I112-Y180 HydrophobicContact CD1-CG 3.45Å; I112-Y180 VanDerWaalsContact CD1-CG 3.45Å; I139-Y180 HydrophobicContact CD1-CD1 4.44Å; I139-Y180 HydrophobicContact CD1-CE1 3.63Å; V141-Y180 HydrophobicContact CG2-CE2 4.1Å; Y175-Y180 HydrophobicContact CD1-CE2 4.38Å; Y175-Y180 AromaticContact CE1-CE2 3.84Å; Y175-Y180 HydrophobicContact CE1-CE2 3.84Å; V176-Y180 HydrophobicContact CG2-CD2 4.43Å; V176-Y180 WeakPolarHBondContact O-CA 3.31Å; V176-Y180 PolarHBondContact O-N 3.03Å; Y180-N182 PolarHBondContact O-N 3.38Å; Y180-E183 PolarHBondContact O-N 3Å; Y180-Y184 HydrophobicContact CD1-CD2 4.09Å; Y180-Y184 AromaticContact CD1-CE2 3.77Å; Y180-Y184 HydrophobicContact CD1-CE2 3.77Å; Y180-Y184 HydrophobicContact CE1-CE2 4.46Å; Y180-Y184 HydrophobicContact CG-CD2 4.41Å; Y180-Y184 HydrophobicContact CG-CE2 4.49Å; Y180-Y184 PolarHBondContact O-N 2.92Å; Y180-Y184 VanDerWaalsContact O-N 3.09Å
181	V	90.9	Very high	93.4	Very high	4 Å²	4	35 Å²	35	2%	0.024	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-18.6	-175.6	81.3	0	0	0	0	115	V176 L177 R242 L246	V176-V181 PolarHBondContact O-N 3.11Å; V176-V181 VanDerWaalsContact O-N 3.07Å; L177-V181 HydrophobicContact CD2-CB 4.19Å; L177-V181 HydrophobicContact CD2-CG2 3.86Å; L177-V181 WeakPolarHBondContact O-CG1 3.15Å; V181-R242 HydrophobicContact CG2-CG 4.03Å; V181-R242 WeakPolarHBondContact O-CD 3.31Å; V181-R242 PolarHBondContact O-NE 2.88Å; V181-R242 PolarHBondContact O-NH2 3.38Å; V181-L246 HydrophobicContact CG1-CD2 4.03Å; V181-L246 HydrophobicContact CG2-CD1 4.45Å; V181-L246 HydrophobicContact CG2-CD2 3.67Å; V181-L246 HydrophobicContact CG2-CG 3.77Å
182	N	88.3	Confident	93.4	Very high	110 Å²	110	33.6 Å²	33.6	59%	0.588	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-17.7	179.2	-66.8	-49.5	0	0	0	113.5	R108 Y180 R242	R108-N182 PolarHBondContact NE-O 3.44Å; Y180-N182 PolarHBondContact O-N 3.38Å; N182-R242 PolarHBondContact OD1-NH2 3.49Å
183	E	87.8	Confident	93.4	Very high	112 Å²	112	35.6 Å²	35.6	52%	0.523	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-26.9	-174.2	-62.8	-178.7	169.2	0	0	112.3	R108 E109 Y180	R108-E183 VanDerWaalsContact CA-O 3.31Å; R108-E183 WeakPolarHBondContact CA-O 3.4Å; R108-E183 WeakPolarHBondContact CB-O 3.44Å; R108-E183 WeakPolarHBondContact CG-O 3.19Å; E109-E183 PolarHBondContact N-O 3.13Å; Y180-E183 PolarHBondContact O-N 3Å
184	Y	91	Very high	93.4	Very high	12 Å²	12	35.7 Å²	35.7	5%	0.047	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	146.2	-176.2	-63.4	-92	0	0	0	113.2	E109 L111 I112 I139 Y180 F187 R242	E109-Y184 HydrophobicContact CB-CD1 3.63Å; E109-Y184 HydrophobicContact CB-CE1 3.35Å; E109-Y184 HydrophobicContact CG-CE1 4.28Å; E109-Y184 VanDerWaalsContact O-CA 3.3Å; E109-Y184 WeakPolarHBondContact O-CA 3.35Å; E109-Y184 WeakPolarHBondContact OE2-CE1 3.45Å; E109-Y184 PolarHBondContact OE2-OH 3.37Å; L111-Y184 WeakPolarHBondContact O-CD1 3.31Å; I112-Y184 HydrophobicContact CB-CD1 3.86Å; I112-Y184 HydrophobicContact CB-CD2 4.33Å; I112-Y184 HydrophobicContact CB-CE1 4.22Å; I112-Y184 HydrophobicContact CB-CG 3.93Å; I112-Y184 HydrophobicContact CG2-CD1 4.14Å; I112-Y184 HydrophobicContact CG2-CD2 4.3Å; I112-Y184 HydrophobicContact CG2-CG 3.8Å; I139-Y184 HydrophobicContact CG2-CD1 4.4Å; I139-Y184 HydrophobicContact CG2-CE1 3.5Å; I139-Y184 HydrophobicContact CG2-CE2 4.42Å; I139-Y184 WeakPolarHBondContact CG2-OH 3.46Å; Y180-Y184 HydrophobicContact CD1-CD2 4.09Å; Y180-Y184 AromaticContact CD1-CE2 3.77Å; Y180-Y184 HydrophobicContact CD1-CE2 3.77Å; Y180-Y184 HydrophobicContact CE1-CE2 4.46Å; Y180-Y184 HydrophobicContact CG-CD2 4.41Å; Y180-Y184 HydrophobicContact CG-CE2 4.49Å; Y180-Y184 PolarHBondContact O-N 2.92Å; Y180-Y184 VanDerWaalsContact O-N 3.09Å; Y184-F187 WeakPolarHBondContact O-CE2 3.46Å; Y184-F187 VanDerWaalsContact O-CZ 3.31Å; Y184-F187 WeakPolarHBondContact O-CZ 3.49Å; Y184-R242 WeakPolarHBondContact O-CD 3.31Å
185	D	90.9	Very high	93.5	Very high	22 Å²	22	31.2 Å²	31.2	12%	0.118	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-29.8	177.4	-73.7	-41.1	0	0	0	114.1	R108 E109 V210 R242	R108-D185 WeakPolarHBondContact CD-OD1 3.18Å; R108-D185 IonicContact CZ-OD1 3.24Å; R108-D185 IonicContact NE-OD1 3.79Å; R108-D185 IonicContact NH1-OD1 3.5Å; R108-D185 PolarHBondContact NH1-OD1 2.98Å; E109-D185 PolarHBondContact O-N 3.31Å; D185-V210 HydrophobicContact CB-CG1 3.86Å; D185-V210 HydrophobicContact CB-CG2 4.22Å; D185-R242 VanDerWaalsContact O-CB 3.26Å; D185-R242 WeakPolarHBondContact O-CB 3.26Å; D185-R242 PolarHBondContact O-N 3Å
186	W	93.7	Very high	93.5	Very high	4 Å²	4	29.2 Å²	29.2	2%	0.015	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	143	179	-62.7	93.2	0	0	0	113.4	R110 L111 I112 V205 L208 S209 L214	R110-W186 VanDerWaalsContact O-CB 3.26Å; R110-W186 WeakPolarHBondContact O-CB 3.41Å; R110-W186 PolarHBondContact O-N 3.25Å; L111-W186 WeakPolarHBondContact CA-O 3.24Å; L111-W186 HydrophobicContact CD1-CB 4.18Å; I112-W186 WeakPolarHBondContact CG2-O 3.48Å; I112-W186 PolarHBondContact N-O 2.93Å; W186-V205 HydrophobicContact CB-CG1 3.84Å; W186-V205 HydrophobicContact CG-CG1 3.65Å; W186-L208 HydrophobicContact CH2-CB 4.09Å; W186-L208 HydrophobicContact CH2-CD1 4.25Å; W186-L208 HydrophobicContact CZ2-CB 3.55Å; W186-L208 HydrophobicContact CZ2-CD1 4.36Å; W186-L208 HydrophobicContact CZ3-CD1 4.38Å; W186-S209 WeakPolarHBondContact CZ2-O 3.05Å; W186-L214 HydrophobicContact CH2-CB 3.93Å; W186-L214 HydrophobicContact CH2-CD2 3.65Å; W186-L214 HydrophobicContact CH2-CG 4.33Å; W186-L214 HydrophobicContact CZ3-CB 3.95Å; W186-L214 HydrophobicContact CZ3-CD2 3.81Å; W186-L214 HydrophobicContact CZ3-CG 4.23Å
187	F	95.5	Very high	93.5	Very high	1 Å²	1	29.3 Å²	29.3	0%	0.004	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	107.3	-174.2	-57.3	-93.5	0	0	0	109	I112 V176 Y184 F189 L240 R242 L245	I112-F187 HydrophobicContact CG2-CB 4.44Å; I112-F187 HydrophobicContact CG2-CD1 3.18Å; I112-F187 HydrophobicContact CG2-CE1 3.42Å; I112-F187 VanDerWaalsContact CG2-CE1 3.42Å; I112-F187 HydrophobicContact CG2-CG 3.99Å; I112-F187 HydrophobicContact CG2-CZ 4.36Å; V176-F187 HydrophobicContact CG1-CD1 3.21Å; V176-F187 HydrophobicContact CG1-CE1 3.47Å; V176-F187 VanDerWaalsContact CG1-CE1 3.47Å; V176-F187 HydrophobicContact CG1-CG 4.2Å; Y184-F187 WeakPolarHBondContact O-CE2 3.46Å; Y184-F187 VanDerWaalsContact O-CZ 3.31Å; Y184-F187 WeakPolarHBondContact O-CZ 3.49Å; F187-F189 HydrophobicContact CB-CE2 3.79Å; F187-F189 HydrophobicContact CB-CZ 4.38Å; F187-L240 HydrophobicContact CB-CB 4.41Å; F187-L240 PolarHBondContact N-O 3Å; F187-L240 PolarHBondContact O-N 3.4Å; F187-R242 HydrophobicContact CE2-CB 3.95Å; F187-R242 HydrophobicContact CE2-CG 4.37Å; F187-L245 HydrophobicContact CB-CD1 3.93Å; F187-L245 HydrophobicContact CD1-CD1 4.03Å; F187-L245 HydrophobicContact CD2-CD1 3.44Å; F187-L245 VanDerWaalsContact CD2-CD1 3.44Å; F187-L245 HydrophobicContact CE2-CD1 4.02Å; F187-L245 HydrophobicContact CG-CD1 3.48Å; F187-L245 VanDerWaalsContact CG-CD1 3.48Å
188	Y	96.6	Very high	93.5	Very high	1 Å²	1	29.1 Å²	29.1	0%	0.004	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	123.4	176.8	177.1	-119	0	0	0	110	I112 V113 G114 V190 T196 I201 Y238 L239 Y289 T313	I112-Y188 PolarHBondContact O-N 3.23Å; V113-Y188 CarbonylContact C-O 3.53Å; V113-Y188 WeakPolarHBondContact CA-O 3.33Å; V113-Y188 HydrophobicContact CB-CD1 4.35Å; V113-Y188 HydrophobicContact CG1-CD1 3.76Å; V113-Y188 HydrophobicContact CG1-CE1 4.33Å; V113-Y188 HydrophobicContact CG2-CD1 3.87Å; G114-Y188 PolarHBondContact N-O 3.48Å; Y188-V190 HydrophobicContact CD1-CG1 4.47Å; Y188-V190 HydrophobicContact CE1-CB 3.73Å; Y188-V190 HydrophobicContact CE1-CG1 3.78Å; Y188-V190 HydrophobicContact CE1-CG2 4.36Å; Y188-V190 WeakPolarHBondContact OH-CG2 3.46Å; Y188-T196 HydrophobicContact CE1-CG2 3.93Å; Y188-T196 PolarHBondContact OH-OG1 2.9Å; Y188-I201 HydrophobicContact CD1-CD1 3.76Å; Y188-I201 HydrophobicContact CD2-CD1 4Å; Y188-I201 HydrophobicContact CE1-CD1 3.34Å; Y188-I201 HydrophobicContact CE2-CD1 3.6Å; Y188-I201 HydrophobicContact CG-CD1 4.08Å; Y188-Y238 WeakPolarHBondContact CA-O 3.42Å; Y188-Y238 WeakPolarHBondContact CD2-O 3.21Å; Y188-L239 HydrophobicContact CD2-CD2 4.11Å; Y188-L239 HydrophobicContact CD2-CG 4.2Å; Y188-L239 HydrophobicContact CG-CD2 4.34Å; Y188-Y289 WeakPolarHBondContact CE2-OH 3.49Å; Y188-T313 WeakPolarHBondContact OH-CG2 3.42Å
189	F	96.6	Very high	93.4	Very high	3 Å²	3	26.9 Å²	26.9	1%	0.013	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	135.4	175.6	-67.1	-79.1	0	0	0	110.5	G114 T172 I173 V176 F187 G237 Y238 L240	G114-F189 WeakPolarHBondContact O-CA 3.01Å; T172-F189 HydrophobicContact CG2-CD1 4.15Å; T172-F189 HydrophobicContact CG2-CE1 3.64Å; I173-F189 HydrophobicContact CD1-CD2 4.25Å; I173-F189 HydrophobicContact CD1-CE1 4.18Å; I173-F189 HydrophobicContact CD1-CE2 3.64Å; I173-F189 HydrophobicContact CD1-CZ 3.6Å; V176-F189 HydrophobicContact CB-CZ 4.35Å; V176-F189 HydrophobicContact CG1-CZ 4.23Å; V176-F189 HydrophobicContact CG2-CE1 4.13Å; V176-F189 HydrophobicContact CG2-CZ 3.96Å; F187-F189 HydrophobicContact CB-CE2 3.79Å; F187-F189 HydrophobicContact CB-CZ 4.38Å; F189-G237 CarbonylContact O-C 3.57Å; F189-G237 WeakPolarHBondContact O-CA 3.1Å; F189-Y238 HydrophobicContact CB-CD2 4.25Å; F189-Y238 HydrophobicContact CB-CE2 3.65Å; F189-Y238 AromaticContact CD2-CE2 4Å; F189-Y238 HydrophobicContact CD2-CE2 4Å; F189-Y238 HydrophobicContact CG-CE2 4.2Å; F189-Y238 PolarHBondContact N-O 2.86Å; F189-Y238 PolarHBondContact O-N 3.09Å; F189-L240 HydrophobicContact CD2-CD1 3.91Å; F189-L240 HydrophobicContact CE2-CD1 3.9Å
190	V	95.8	Very high	93.5	Very high	3 Å²	3	23.8 Å²	23.8	2%	0.018	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	154.2	-177.2	69.4	0	0	0	0	110.9	V113 G114 V115 L116 Y188 A194	V113-V190 HydrophobicContact CG1-CG1 4.43Å; G114-V190 PolarHBondContact O-N 3.27Å; G114-V190 VanDerWaalsContact O-N 3.11Å; V115-V190 CarbonylContact C-O 3.5Å; V115-V190 WeakPolarHBondContact CA-O 3.3Å; V115-V190 HydrophobicContact CG2-CG1 4.09Å; L116-V190 PolarHBondContact N-O 2.84Å; Y188-V190 HydrophobicContact CD1-CG1 4.47Å; Y188-V190 HydrophobicContact CE1-CB 3.73Å; Y188-V190 HydrophobicContact CE1-CG1 3.78Å; Y188-V190 HydrophobicContact CE1-CG2 4.36Å; Y188-V190 WeakPolarHBondContact OH-CG2 3.46Å; V190-A194 HydrophobicContact CG2-CB 3.67Å
191	Q	94.5	Very high	93.5	Very high	52 Å²	52	22.8 Å²	22.8	24%	0.243	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	157.2	173	-61.5	-172.2	-96.3	0	0	111.5	D193 A194 G235	Q191-D193 WeakPolarHBondContact CB-OD1 3.24Å; Q191-D193 PolarHBondContact O-N 3.01Å; Q191-A194 PolarHBondContact O-N 3.29Å; Q191-G235 VanDerWaalsContact OE1-N 3.15Å
192	D	94.1	Very high	93.6	Very high	14 Å²	14	26.6 Å²	26.6	8%	0.075	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-7.9	-179.4	62.1	-6.1	0	0	0	114.9	V115 L116 T117 T121 L125 A194	V115-D192 HydrophobicContact CG1-CB 4.08Å; L116-D192 PolarHBondContact O-N 3.38Å; L116-D192 VanDerWaalsContact O-N 3.1Å; T117-D192 WeakPolarHBondContact CA-OD2 3.19Å; T117-D192 WeakPolarHBondContact CB-OD2 3.47Å; T117-D192 PolarHBondContact OG1-OD2 2.92Å; T121-D192 WeakPolarHBondContact CB-OD2 3.44Å; T121-D192 PolarHBondContact OG1-OD2 2.9Å; L125-D192 HydrophobicContact CB-CB 4.34Å; L125-D192 WeakPolarHBondContact CB-O 3.35Å; D192-A194 VanDerWaalsContact C-N 3.33Å
193	D	94.6	Very high	93.8	Very high	42 Å²	42	25.9 Å²	25.9	23%	0.225	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	16.9	171	68.2	-24.7	0	0	0	113.6	L125 Q191 H315 V317	L125-D193 HydrophobicContact CD1-CB 4.4Å; Q191-D193 WeakPolarHBondContact CB-OD1 3.24Å; Q191-D193 PolarHBondContact O-N 3.01Å; D193-H315 PolarHBondContact O-CD2 3.27Å; D193-H315 VanDerWaalsContact O-CD2 3.29Å; D193-H315 IonicContact OD1-CD2 2.77Å; D193-H315 IonicContact OD1-NE2 3.7Å; D193-H315 PolarHBondContact OD1-NE2 3.4Å; D193-H315 IonicContact OD2-CD2 3.18Å; D193-H315 IonicContact OD2-CE1 2.71Å; D193-H315 IonicContact OD2-NE2 3.38Å; D193-H315 PolarHBondContact OD2-NE2 2.88Å; D193-V317 WeakPolarHBondContact O-CB 3.48Å; D193-V317 PolarHBondContact O-N 2.71Å
194	A	95.1	Very high	94	Very high	2 Å²	2	21.3 Å²	21.3	2%	0.017	10%	0.1	C	C	.	.			trans	-119.1	132.6	177.1	0	0	0	0	0	112	V190 Q191 D192 G235 H315	V190-A194 HydrophobicContact CG2-CB 3.67Å; Q191-A194 PolarHBondContact O-N 3.29Å; D192-A194 VanDerWaalsContact C-N 3.33Å; A194-G235 WeakPolarHBondContact CB-O 3.37Å; A194-H315 HydrophobicContact CB-CB 4.36Å
195	Y	95.8	Very high	94	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.008	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	135.6	163.7	177.6	-100.1	0	0	0	109.2	E197 T313 V314 M323 L326 H327 F330	Y195-E197 HydrophobicContact CE1-CB 4.23Å; Y195-T313 CarbonylContact O-C 3.58Å; Y195-T313 VanDerWaalsContact O-CA 3.25Å; Y195-T313 WeakPolarHBondContact O-CA 3.07Å; Y195-V314 HydrophobicContact CD1-CG2 4.42Å; Y195-V314 PolarHBondContact N-O 3.1Å; Y195-V314 PolarHBondContact O-N 2.91Å; Y195-M323 VanDerWaalsContact CA-SD 3.58Å; Y195-M323 HydrophobicContact CD2-CG 4.49Å; Y195-M323 HydrophobicContact CD2-SD 3.8Å; Y195-M323 HydrophobicContact CG-SD 4.27Å; Y195-L326 HydrophobicContact CD1-CB 4.2Å; Y195-L326 HydrophobicContact CD2-CB 4.09Å; Y195-L326 HydrophobicContact CG-CB 3.9Å; Y195-L326 HydrophobicContact CG-CD1 4.34Å; Y195-H327 HydrophobicContact CE2-CB 3.63Å; Y195-H327 AromaticContact CE2-ND1 3.88Å; Y195-H327 PolarHBondContact OH-ND1 3.36Å; Y195-F330 AromaticContact CD1-CD2 3.97Å; Y195-F330 HydrophobicContact CD1-CD2 3.97Å; Y195-F330 HydrophobicContact CD1-CE2 4.12Å; Y195-F330 HydrophobicContact CE1-CB 4.13Å; Y195-F330 AromaticContact CE1-CD2 3.44Å; Y195-F330 HydrophobicContact CE1-CD2 3.44Å; Y195-F330 VanDerWaalsContact CE1-CD2 3.44Å; Y195-F330 HydrophobicContact CE1-CE2 4.01Å; Y195-F330 AromaticContact CE1-CG 3.84Å; Y195-F330 HydrophobicContact CE1-CG 3.84Å
196	T	95.7	Very high	94	Very high	7 Å²	7	24.1 Å²	24.1	4%	0.043	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.4	176.2	-71.4	0	0	0	0	108.2	Y188 I201	Y188-T196 HydrophobicContact CE1-CG2 3.93Å; Y188-T196 PolarHBondContact OH-OG1 2.9Å; T196-I201 HydrophobicContact CG2-CD1 3.33Å; T196-I201 HydrophobicContact CG2-CG1 4.03Å
197	E	95.4	Very high	93.8	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.019	14%	0.139	C	C	.	.			trans	-80.5	119.6	166.6	-149.6	-48.3	107.8	0	0	108.3	Y195 D199 R200 I201 L312 F330	Y195-E197 HydrophobicContact CE1-CB 4.23Å; E197-D199 WeakPolarHBondContact OE2-CA 3.4Å; E197-D199 PolarHBondContact OE2-N 3.03Å; E197-R200 HydrophobicContact CB-CB 4.32Å; E197-R200 HydrophobicContact CB-CG 4.37Å; E197-R200 HydrophobicContact CG-CG 4.2Å; E197-R200 WeakPolarHBondContact OE2-CG 3.45Å; E197-R200 PolarHBondContact OE2-N 3.05Å; E197-I201 PolarHBondContact O-N 2.81Å; E197-L312 PolarHBondContact N-O 3.06Å; E197-F330 HydrophobicContact CG-CB 4.25Å; E197-F330 HydrophobicContact CG-CD1 4.45Å
198	A	93.8	Very high	93.5	Very high	2 Å²	2	30.1 Å²	30.1	2%	0.017	14%	0.141	C	C	.	.	H	α-helix	trans	-80.5	-41.8	-166.8	0	0	0	0	0	113.3	I133 H136 L137 R200 I201 R202	I133-A198 HydrophobicContact CB-CB 4.33Å; I133-A198 HydrophobicContact CG2-CB 4.33Å; H136-A198 HydrophobicContact CB-CB 3.5Å; H136-A198 VanDerWaalsContact CB-CB 3.5Å; L137-A198 HydrophobicContact CD1-CB 4Å; L137-A198 HydrophobicContact CD2-CB 4.25Å; L137-A198 HydrophobicContact CG-CB 3.92Å; A198-R200 VanDerWaalsContact C-N 3.31Å; A198-R200 PolarHBondContact O-N 2.59Å; A198-I201 PolarHBondContact O-N 3.22Å; A198-R202 PolarHBondContact O-N 2.72Å; A198-R202 VanDerWaalsContact O-N 3.09Å
199	D	91.9	Very high	92.9	Very high	48 Å²	48	31.9 Å²	31.9	26%	0.257	15%	0.153	S	C	.	.	H	α-helix	trans	-67.1	-35.9	-179	-69	-44.5	0	0	0	110.7	H136 E197 R202 E203	H136-D199 IonicContact CE1-OD2 3.91Å; H136-D199 PolarHBondContact CE1-OD2 3.28Å; H136-D199 IonicContact CG-OD1 3.18Å; H136-D199 IonicContact ND1-OD1 3.02Å; H136-D199 PolarHBondContact ND1-OD1 3.42Å; H136-D199 IonicContact ND1-OD2 3.28Å; H136-D199 PolarHBondContact ND1-OD2 2.7Å; E197-D199 WeakPolarHBondContact OE2-CA 3.4Å; E197-D199 PolarHBondContact OE2-N 3.03Å; D199-R202 PolarHBondContact O-N 2.79Å; D199-R202 IonicContact OD1-CZ 2.72Å; D199-R202 IonicContact OD1-NH1 3.66Å; D199-R202 PolarHBondContact OD1-NH1 3.41Å; D199-R202 IonicContact OD1-NH2 3.03Å; D199-R202 PolarHBondContact OD1-NH2 3.44Å; D199-E203 WeakPolarHBondContact O-CB 3.46Å; D199-E203 PolarHBondContact O-N 2.98Å
200	R	92.9	Very high	92	Very high	32 Å²	32	34 Å²	34	12%	0.121	17%	0.167	C	C	.	.	H	α-helix	trans	-67.9	-36.4	174.5	-68.6	180	179.1	-172.5	-4.5	113.6	E197 A198 E203 L204 K309 R310 A311 L312 E334	E197-R200 HydrophobicContact CB-CB 4.32Å; E197-R200 HydrophobicContact CB-CG 4.37Å; E197-R200 HydrophobicContact CG-CG 4.2Å; E197-R200 WeakPolarHBondContact OE2-CG 3.45Å; E197-R200 PolarHBondContact OE2-N 3.05Å; A198-R200 VanDerWaalsContact C-N 3.31Å; A198-R200 PolarHBondContact O-N 2.59Å; R200-E203 PolarHBondContact O-N 2.84Å; R200-L204 WeakPolarHBondContact O-CB 3.37Å; R200-L204 PolarHBondContact O-N 2.88Å; R200-K309 VanDerWaalsContact CZ-O 3.27Å; R200-K309 PolarHBondContact NH1-O 2.59Å; R200-K309 PolarHBondContact NH2-O 2.85Å; R200-R310 PolarHBondContact NH1-O 3.42Å; R200-A311 PolarHBondContact NH1-O 2.97Å; R200-L312 VanDerWaalsContact C-CD1 3.44Å; R200-L312 HydrophobicContact CB-CD1 3.51Å; R200-E334 IonicContact CZ-OE1 3.09Å; R200-E334 IonicContact NE-OE1 2.66Å; R200-E334 PolarHBondContact NE-OE1 3.37Å; R200-E334 IonicContact NH2-OE1 3.97Å; R200-E334 PolarHBondContact NH2-OE1 3.05Å
201	I	93.5	Very high	90.7	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-67.1	-41.1	172.7	-69	-165.3	0	0	0	110.2	L111 Y188 T196 E197 A198 L204 V205 L312 T313	L111-I201 HydrophobicContact CD2-CG2 3.63Å; Y188-I201 HydrophobicContact CD1-CD1 3.76Å; Y188-I201 HydrophobicContact CD2-CD1 4Å; Y188-I201 HydrophobicContact CE1-CD1 3.34Å; Y188-I201 HydrophobicContact CE2-CD1 3.6Å; Y188-I201 HydrophobicContact CG-CD1 4.08Å; T196-I201 HydrophobicContact CG2-CD1 3.33Å; T196-I201 HydrophobicContact CG2-CG1 4.03Å; E197-I201 PolarHBondContact O-N 2.81Å; A198-I201 PolarHBondContact O-N 3.22Å; I201-L204 PolarHBondContact O-N 3.45Å; I201-V205 HydrophobicContact CG2-CG2 4.25Å; I201-V205 WeakPolarHBondContact O-CB 3.5Å; I201-V205 VanDerWaalsContact O-CG2 3.31Å; I201-V205 WeakPolarHBondContact O-CG2 3.43Å; I201-V205 PolarHBondContact O-N 3Å; I201-L312 HydrophobicContact CB-CD1 4.31Å; I201-L312 HydrophobicContact CD1-CD2 4.35Å; I201-L312 HydrophobicContact CD1-CG 4.18Å; I201-L312 HydrophobicContact CG1-CD1 3.47Å; I201-L312 VanDerWaalsContact CG1-CD1 3.47Å; I201-L312 HydrophobicContact CG1-CD2 3.88Å; I201-L312 HydrophobicContact CG1-CG 3.52Å; I201-T313 HydrophobicContact CD1-CG2 4.5Å
202	R	92.9	Very high	90.2	Very high	84 Å²	84	43.6 Å²	43.6	32%	0.317	21%	0.21	S	C	.	.	H	α-helix	trans	-60.4	-47	175.1	-167.9	177.8	66	-119.2	-13.5	111	H136 L137 A198 D199 L204 V205 E206	H136-R202 PolarHBondContact O-NH1 3.31Å; L137-R202 HydrophobicContact CD2-CB 4.37Å; A198-R202 PolarHBondContact O-N 2.72Å; A198-R202 VanDerWaalsContact O-N 3.09Å; D199-R202 PolarHBondContact O-N 2.79Å; D199-R202 IonicContact OD1-CZ 2.72Å; D199-R202 IonicContact OD1-NH1 3.66Å; D199-R202 PolarHBondContact OD1-NH1 3.41Å; D199-R202 IonicContact OD1-NH2 3.03Å; D199-R202 PolarHBondContact OD1-NH2 3.44Å; R202-L204 PolarHBondContact O-N 3.2Å; R202-V205 PolarHBondContact O-N 3.48Å; R202-E206 WeakPolarHBondContact O-CB 3.42Å; R202-E206 WeakPolarHBondContact O-CG 3.48Å; R202-E206 PolarHBondContact O-N 3.12Å
203	E	91.4	Very high	90	Very high	95 Å²	95	46.3 Å²	46.3	44%	0.444	22%	0.223	S	C	.	.	H	α-helix	trans	-58.2	-45.2	175.8	-173.2	-179.4	-176.8	0	0	112.2	D199 R200 E206 H207 K337	D199-E203 WeakPolarHBondContact O-CB 3.46Å; D199-E203 PolarHBondContact O-N 2.98Å; R200-E203 PolarHBondContact O-N 2.84Å; E203-E206 PolarHBondContact O-N 2.85Å; E203-H207 PolarHBondContact O-N 3.26Å; E203-H207 PolarHBondContact O-ND1 3.28Å; E203-K337 IonicContact OE2-NZ 2.97Å
204	L	92.4	Very high	90	Very high	17 Å²	17	44.5 Å²	44.5	9%	0.089	21%	0.213	C	C	.	.	H	α-helix	trans	-60	-48.9	176.2	177.7	63.7	0	0	0	111.5	R200 I201 R202 E206 H207 L208 M216 L239 L287 Y289 L312	R200-L204 WeakPolarHBondContact O-CB 3.37Å; R200-L204 PolarHBondContact O-N 2.88Å; I201-L204 PolarHBondContact O-N 3.45Å; R202-L204 PolarHBondContact O-N 3.2Å; L204-E206 VanDerWaalsContact C-N 3.31Å; L204-E206 PolarHBondContact O-N 2.68Å; L204-H207 PolarHBondContact O-N 3.47Å; L204-L208 HydrophobicContact CG-CD1 4.31Å; L204-L208 WeakPolarHBondContact O-CG 3.41Å; L204-L208 PolarHBondContact O-N 3.18Å; L204-M216 HydrophobicContact CD1-CE 4.23Å; L204-M216 HydrophobicContact CD2-CE 4.49Å; L204-L239 HydrophobicContact CD2-CD1 3.83Å; L204-L239 HydrophobicContact CG-CD1 4.4Å; L204-L287 HydrophobicContact CD1-CB 3.8Å; L204-L287 HydrophobicContact CD1-CD1 4.19Å; L204-L287 HydrophobicContact CD1-CG 4.44Å; L204-Y289 HydrophobicContact CD2-CD2 4.19Å; L204-L312 HydrophobicContact CD2-CD2 3.77Å
205	V	91.7	Very high	90	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-69.5	-27.9	-178.6	171.4	0	0	0	0	112.4	R110 L111 W186 I201 R202 H207 L208 L239	R110-V205 HydrophobicContact CB-CG1 4.25Å; L111-V205 HydrophobicContact CB-CG1 4.24Å; L111-V205 HydrophobicContact CD1-CG2 4.17Å; L111-V205 HydrophobicContact CD2-CG2 4.4Å; W186-V205 HydrophobicContact CB-CG1 3.84Å; W186-V205 HydrophobicContact CG-CG1 3.65Å; I201-V205 HydrophobicContact CG2-CG2 4.25Å; I201-V205 WeakPolarHBondContact O-CB 3.5Å; I201-V205 VanDerWaalsContact O-CG2 3.31Å; I201-V205 WeakPolarHBondContact O-CG2 3.43Å; I201-V205 PolarHBondContact O-N 3Å; R202-V205 PolarHBondContact O-N 3.48Å; V205-H207 VanDerWaalsContact C-N 3.27Å; V205-H207 PolarHBondContact O-N 3.46Å; V205-L208 PolarHBondContact O-N 3.44Å; V205-L239 HydrophobicContact CG2-CD1 3.95Å; V205-L239 HydrophobicContact CG2-CD2 3.73Å
206	E	89.8	Confident	90	Very high	92 Å²	92	44.3 Å²	44.3	43%	0.43	21%	0.212	S	C	.	.	H	α-helix	trans	-66.7	-27.6	175.4	-83.3	178	-172.2	0	0	113.6	R110 R202 E203 L204	R110-E206 PolarHBondContact NH1-O 3.13Å; R202-E206 WeakPolarHBondContact O-CB 3.42Å; R202-E206 WeakPolarHBondContact O-CG 3.48Å; R202-E206 PolarHBondContact O-N 3.12Å; E203-E206 PolarHBondContact O-N 2.85Å; L204-E206 VanDerWaalsContact C-N 3.31Å; L204-E206 PolarHBondContact O-N 2.68Å
207	H	89.7	Confident	89.9	Confident	123 Å²	123	44 Å²	44	57%	0.569	21%	0.21	S	C	*	.	H	α-helix	trans	-95.1	-11.6	-180	-67.7	88.6	0	0	0	114.3	E203 L204 V205 L287	E203-H207 PolarHBondContact O-N 3.26Å; E203-H207 PolarHBondContact O-ND1 3.28Å; L204-H207 PolarHBondContact O-N 3.47Å; V205-H207 VanDerWaalsContact C-N 3.27Å; V205-H207 PolarHBondContact O-N 3.46Å; H207-L287 HydrophobicContact CB-CD1 3.76Å; H207-L287 HydrophobicContact CB-CD2 4.36Å
208	L	89.3	Confident	89.9	Confident	7 Å²	7	44.3 Å²	44.3	4%	0.037	21%	0.212	C	C	.	.	S	Bend	trans	-79.5	142.8	-179.8	-75.5	170.5	0	0	0	113.3	W186 L204 V205 L214 M216 L239 Y284 L287	W186-L208 HydrophobicContact CH2-CB 4.09Å; W186-L208 HydrophobicContact CH2-CD1 4.25Å; W186-L208 HydrophobicContact CZ2-CB 3.55Å; W186-L208 HydrophobicContact CZ2-CD1 4.36Å; W186-L208 HydrophobicContact CZ3-CD1 4.38Å; L204-L208 HydrophobicContact CG-CD1 4.31Å; L204-L208 WeakPolarHBondContact O-CG 3.41Å; L204-L208 PolarHBondContact O-N 3.18Å; V205-L208 PolarHBondContact O-N 3.44Å; L208-L214 HydrophobicContact CD1-CD2 4.19Å; L208-L214 HydrophobicContact CD2-CD2 3.81Å; L208-M216 HydrophobicContact CD1-SD 4.38Å; L208-M216 HydrophobicContact CD2-SD 4.47Å; L208-L239 HydrophobicContact CD1-CD1 4.15Å; L208-Y284 HydrophobicContact CD2-CD1 3.88Å; L208-L287 HydrophobicContact CD2-CD1 3.89Å; L208-L287 HydrophobicContact CG-CD1 4.1Å
209	S	84.1	Confident	90	Very high	38 Å²	38	46 Å²	46	27%	0.266	22%	0.223	S	C	.	.			trans	-81.3	121.1	179.9	55.8	0	0	0	0	112.9	W186 D211 E285	W186-S209 WeakPolarHBondContact CZ2-O 3.05Å; S209-D211 PolarHBondContact O-N 3.18Å; S209-E285 WeakPolarHBondContact CB-OE2 3.39Å; S209-E285 PolarHBondContact OG-OE2 2.83Å
210	V	77.5	Confident	90	Very high	49 Å²	49	46.8 Å²	46.8	30%	0.297	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-29.3	-170.2	175.3	0	0	0	0	114.2	D185 R212	D185-V210 HydrophobicContact CB-CG1 3.86Å; D185-V210 HydrophobicContact CB-CG2 4.22Å; V210-R212 VanDerWaalsContact C-N 3.28Å; V210-R212 PolarHBondContact O-N 3.11Å
211	D	69.6	Low	89.8	Confident	135 Å²	135	51.8 Å²	51.8	72%	0.722	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	2.1	-170.7	-69.4	-33	0	0	0	114.7	S209	S209-D211 PolarHBondContact O-N 3.18Å
212	R	82.2	Confident	89.4	Confident	120 Å²	120	52.5 Å²	52.5	45%	0.453	25%	0.253	S	S	.	.	S	Bend	trans	-104.2	148.6	-173.8	-65.9	-83.7	-173.4	67.4	5.7	111.7	V210 L214 S241 S243 Y284 E285	V210-R212 VanDerWaalsContact C-N 3.28Å; V210-R212 PolarHBondContact O-N 3.11Å; R212-L214 PolarHBondContact O-N 3.34Å; R212-S241 WeakPolarHBondContact O-CB 3.31Å; R212-S241 PolarHBondContact O-OG 3.08Å; R212-S243 PolarHBondContact O-OG 3.19Å; R212-Y284 WeakPolarHBondContact CB-OH 3.29Å; R212-Y284 VanDerWaalsContact CD-OH 3.31Å; R212-Y284 WeakPolarHBondContact CD-OH 3.38Å; R212-Y284 VanDerWaalsContact CG-OH 3.24Å; R212-Y284 WeakPolarHBondContact CG-OH 3.35Å; R212-Y284 PolarHBondContact NH1-OH 3.4Å; R212-E285 IonicContact CZ-OE1 2.77Å; R212-E285 IonicContact NH1-OE1 2.67Å; R212-E285 PolarHBondContact NH1-OE1 2.85Å; R212-E285 IonicContact NH2-OE1 3.56Å
213	E	91.3	Very high	88.6	Confident	72 Å²	72	54.1 Å²	54.1	34%	0.336	27%	0.267	S	S	.	.			trans	-79	106.5	167.1	-71.4	176.2	-161.8	0	0	108.9	L244 R247	E213-L244 HydrophobicContact CB-CD1 4.44Å; E213-R247 WeakPolarHBondContact OE1-CD 3.36Å; E213-R247 IonicContact OE1-CZ 2.84Å; E213-R247 IonicContact OE1-NE 2.77Å; E213-R247 IonicContact OE1-NH1 2.8Å; E213-R247 PolarHBondContact OE1-NH1 2.87Å; E213-R247 IonicContact OE2-CZ 3.64Å; E213-R247 IonicContact OE2-NE 3.31Å; E213-R247 IonicContact OE2-NH1 3.53Å; E213-R247 PolarHBondContact OE2-NH1 3.49Å
214	L	93.4	Very high	87.5	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.021	28%	0.278	C	S	.	.			trans	-126.5	135.9	179.9	-176	61.8	0	0	0	111.8	W186 L208 R212 M216 S241 L244 V281 Y284	W186-L214 HydrophobicContact CH2-CB 3.93Å; W186-L214 HydrophobicContact CH2-CD2 3.65Å; W186-L214 HydrophobicContact CH2-CG 4.33Å; W186-L214 HydrophobicContact CZ3-CB 3.95Å; W186-L214 HydrophobicContact CZ3-CD2 3.81Å; W186-L214 HydrophobicContact CZ3-CG 4.23Å; L208-L214 HydrophobicContact CD1-CD2 4.19Å; L208-L214 HydrophobicContact CD2-CD2 3.81Å; R212-L214 PolarHBondContact O-N 3.34Å; L214-M216 HydrophobicContact CD1-CB 4.19Å; L214-M216 HydrophobicContact CD2-CB 4.17Å; L214-M216 HydrophobicContact CD2-SD 4.23Å; L214-M216 HydrophobicContact CG-CB 4.03Å; L214-S241 PolarHBondContact N-OG 3.43Å; L214-S241 PolarHBondContact O-N 3.15Å; L214-S241 VanDerWaalsContact O-N 3.07Å; L214-S241 PolarHBondContact O-OG 3.05Å; L214-L244 WeakPolarHBondContact O-CD2 3.48Å; L214-V281 HydrophobicContact CD1-CG2 3.61Å; L214-Y284 HydrophobicContact CD1-CD1 4.22Å; L214-Y284 HydrophobicContact CD1-CD2 3.58Å; L214-Y284 HydrophobicContact CD1-CE2 4.01Å; L214-Y284 HydrophobicContact CD1-CG 3.68Å; L214-Y284 HydrophobicContact CD2-CD1 3.82Å; L214-Y284 HydrophobicContact CD2-CE1 4.31Å; L214-Y284 HydrophobicContact CD2-CG 3.98Å; L214-Y284 HydrophobicContact CG-CG 4.49Å
215	Y	95.6	Very high	85.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	105.2	167.8	-179	-154.6	0	0	0	107.9	C232 Y238 L239 L240 I272 C280 V281	Y215-C232 HydrophobicContact CD2-CB 4.37Å; Y215-C232 VanDerWaalsContact CD2-SG 3.53Å; Y215-C232 HydrophobicContact CE1-CB 4.4Å; Y215-C232 HydrophobicContact CE2-CB 3.58Å; Y215-C232 WeakPolarHBondContact CE2-SG 3.4Å; Y215-C232 VanDerWaalsContact CZ-SG 3.58Å; Y215-C232 PolarHBondContact OH-N 3.01Å; Y215-Y238 HydrophobicContact CD2-CD2 4.45Å; Y215-Y238 AromaticContact CE2-CD2 3.76Å; Y215-Y238 HydrophobicContact CE2-CD2 3.76Å; Y215-Y238 HydrophobicContact CE2-CE2 4.37Å; Y215-Y238 AromaticContact CE2-CG 3.95Å; Y215-Y238 HydrophobicContact CE2-CG 3.95Å; Y215-L239 WeakPolarHBondContact CA-O 3.41Å; Y215-L240 HydrophobicContact CD2-CD2 3.32Å; Y215-L240 HydrophobicContact CD2-CG 4.34Å; Y215-L240 HydrophobicContact CE2-CD2 3.83Å; Y215-L240 HydrophobicContact CG-CD2 3.97Å; Y215-I272 HydrophobicContact CD1-CD1 4.08Å; Y215-I272 HydrophobicContact CD1-CG2 4.05Å; Y215-I272 HydrophobicContact CD2-CD1 4.34Å; Y215-I272 HydrophobicContact CE1-CD1 3.96Å; Y215-I272 HydrophobicContact CE2-CD1 4.2Å; Y215-I272 HydrophobicContact CG-CD1 4.28Å; Y215-C280 HydrophobicContact CD1-CB 4.01Å; Y215-C280 HydrophobicContact CE1-CB 3.96Å; Y215-C280 WeakPolarHBondContact O-CA 3.2Å; Y215-V281 PolarHBondContact O-N 3.34Å
216	M	95	Very high	84.6	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.1	-168.8	-174.9	176.6	-176	0	0	111.4	L204 L208 L214 Y238 L239 V281 L287 Y289	L204-M216 HydrophobicContact CD1-CE 4.23Å; L204-M216 HydrophobicContact CD2-CE 4.49Å; L208-M216 HydrophobicContact CD1-SD 4.38Å; L208-M216 HydrophobicContact CD2-SD 4.47Å; L214-M216 HydrophobicContact CD1-CB 4.19Å; L214-M216 HydrophobicContact CD2-CB 4.17Å; L214-M216 HydrophobicContact CD2-SD 4.23Å; L214-M216 HydrophobicContact CG-CB 4.03Å; M216-Y238 CarbonylContact O-C 3.56Å; M216-Y238 VanDerWaalsContact O-CA 3.24Å; M216-Y238 WeakPolarHBondContact O-CA 3.41Å; M216-Y238 VanDerWaalsContact O-CB 3.3Å; M216-Y238 WeakPolarHBondContact O-CB 3.39Å; M216-L239 HydrophobicContact CB-CB 4.4Å; M216-L239 PolarHBondContact N-O 3.33Å; M216-L239 PolarHBondContact O-N 2.92Å; M216-V281 VanDerWaalsContact CA-O 3.31Å; M216-V281 WeakPolarHBondContact CA-O 3.35Å; M216-V281 HydrophobicContact CB-CG2 4.39Å; M216-V281 HydrophobicContact CG-CG2 4.49Å; M216-L287 WeakPolarHBondContact CE-O 3.25Å; M216-Y289 HydrophobicContact CG-CD2 4.14Å
217	G	95.5	Very high	83.7	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.8	-151.6	-176.1	0	0	0	0	0	112.2	P219 V281 S282	G217-P219 VanDerWaalsContact O-CD 3.32Å; G217-P219 WeakPolarHBondContact O-CD 3.22Å; G217-V281 PolarHBondContact N-O 2.77Å; G217-S282 WeakPolarHBondContact O-CA 3.42Å
218	S	95.1	Very high	83.1	Confident	10 Å²	10	64.9 Å²	64.9	7%	0.07	35%	0.354	C	S	.	.			trans	-91.7	108.4	172.5	179.5	0	0	0	0	111.2	C232 Y233 H291	S218-C232 CarbonylContact O-C 3.57Å; S218-C232 WeakPolarHBondContact O-CA 3.42Å; S218-Y233 PolarHBondContact O-N 2.79Å; S218-H291 PolarHBondContact OG-NE2 3.09Å
219	P	94.4	Very high	82.9	Confident	38 Å²	38	65.6 Å²	65.6	25%	0.247	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	122.7	-172.7	31	-35.2	0	0	0	113.5	G217 K230 Y231 C280	G217-P219 VanDerWaalsContact O-CD 3.32Å; G217-P219 WeakPolarHBondContact O-CD 3.22Å; P219-K230 HydrophobicContact CB-CB 4.11Å; P219-K230 HydrophobicContact CB-CD 4.09Å; P219-Y231 CarbonylContact C-O 3.51Å; P219-Y231 WeakPolarHBondContact CA-O 3.33Å; P219-C280 HydrophobicContact CB-CB 4.15Å
220	E	91.8	Very high	83.3	Confident	65 Å²	65	67.7 Å²	67.7	30%	0.304	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	159.3	174.4	-74.3	-168.6	170.5	0	0	112.6	K230 Y231 Y233	E220-K230 CarbonylContact O-C 3.56Å; E220-K230 WeakPolarHBondContact O-CA 3.49Å; E220-K230 WeakPolarHBondContact O-CB 3.45Å; E220-Y231 HydrophobicContact CB-CD1 4.4Å; E220-Y231 HydrophobicContact CB-CE1 3.84Å; E220-Y231 HydrophobicContact CB-CE2 4.05Å; E220-Y231 PolarHBondContact N-O 3.24Å; E220-Y231 PolarHBondContact O-N 2.94Å; E220-Y231 PolarHBondContact OE2-OH 3.2Å; E220-Y233 VanDerWaalsContact OE1-CD2 3.25Å; E220-Y233 WeakPolarHBondContact OE1-CD2 3.49Å; E220-Y233 WeakPolarHBondContact OE2-CD2 3.48Å
221	E	90.1	Very high	84.1	Confident	137 Å²	137	65.6 Å²	65.6	64%	0.64	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	143.1	179.6	-67	176.9	-175.6	0	0	111.5	K230	E221-K230 HydrophobicContact CG-CD 4.43Å; E221-K230 HydrophobicContact CG-CG 4.37Å; E221-K230 IonicContact OE1-NZ 2.82Å; E221-K230 PolarHBondContact OE1-NZ 3.47Å
222	F	85.5	Confident	85.3	Confident	16 Å²	16	59.1 Å²	59.1	7%	0.07	32%	0.32	C	S	.	.			trans	-65.2	135	-176.9	-71.9	-80.8	0	0	0	113.3	G224 M227 Y231 E266 R270 I273	F222-G224 PolarHBondContact O-N 2.7Å; F222-G224 VanDerWaalsContact O-N 3.14Å; F222-M227 HydrophobicContact CD1-SD 4.38Å; F222-M227 HydrophobicContact CD2-CB 4.34Å; F222-M227 HydrophobicContact CD2-CG 4.35Å; F222-M227 HydrophobicContact CD2-SD 4.07Å; F222-M227 HydrophobicContact CE1-SD 4.24Å; F222-M227 HydrophobicContact CE2-SD 3.91Å; F222-M227 HydrophobicContact CG-CB 4.49Å; F222-M227 HydrophobicContact CG-SD 4.3Å; F222-M227 HydrophobicContact CZ-SD 4Å; F222-Y231 AromaticContact CD1-CD1 3.89Å; F222-Y231 HydrophobicContact CD1-CD1 3.89Å; F222-Y231 HydrophobicContact CD1-CE1 4.44Å; F222-Y231 AromaticContact CE1-CD1 3.81Å; F222-Y231 HydrophobicContact CE1-CD1 3.81Å; F222-Y231 HydrophobicContact CE1-CG 4.29Å; F222-Y231 HydrophobicContact CE2-CD1 4.48Å; F222-Y231 HydrophobicContact CG-CD1 4.26Å; F222-Y231 HydrophobicContact CZ-CD1 4.13Å; F222-Y231 HydrophobicContact CZ-CG 4.46Å; F222-E266 HydrophobicContact CD1-CG 3.74Å; F222-E266 HydrophobicContact CE1-CG 4.01Å; F222-R270 HydrophobicContact CD1-CG 4.35Å; F222-R270 HydrophobicContact CE1-CB 4.14Å; F222-R270 HydrophobicContact CE1-CG 3.82Å; F222-R270 HydrophobicContact CZ-CG 4.31Å; F222-I273 HydrophobicContact CE2-CD1 3.62Å; F222-I273 HydrophobicContact CZ-CD1 3.81Å
223	I	74.9	Confident	85.9	Confident	117 Å²	117	55.4 Å²	55.4	60%	0.6	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	110.8	177.5	-55.4	175.2	0	0	0	108.8
224	G	69.1	Low	85.9	Confident	67 Å²	67	52.1 Å²	52.1	69%	0.691	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	121.4	-6.9	176.3	0	0	0	0	0	115.6	F222 E226	F222-G224 PolarHBondContact O-N 2.7Å; F222-G224 VanDerWaalsContact O-N 3.14Å; G224-E226 PolarHBondContact O-N 3.11Å
225	G	59.1	Low	85.8	Confident	71 Å²	71	52 Å²	52	73%	0.732	29%	0.291	S	S	*	.	S	Bend	trans	69.1	-1.1	162.8	0	0	0	0	0	118.2
226	E	63.9	Low	85.7	Confident	187 Å²	187	52.7 Å²	52.7	87%	0.874	30%	0.295	S	S	*	.			trans	-84.2	-6.3	179	-67.8	-175.4	159.9	0	0	114.2	G224	G224-E226 PolarHBondContact O-N 3.11Å
227	M	71.3	Confident	85.8	Confident	35 Å²	35	52.7 Å²	52.7	17%	0.172	30%	0.295	C	S	.	.	S	Bend	trans	-120.7	126.8	-174.9	-167	178.8	-154.3	0	0	112	F222 G229 R270 I273 D274	F222-M227 HydrophobicContact CD1-SD 4.38Å; F222-M227 HydrophobicContact CD2-CB 4.34Å; F222-M227 HydrophobicContact CD2-CG 4.35Å; F222-M227 HydrophobicContact CD2-SD 4.07Å; F222-M227 HydrophobicContact CE1-SD 4.24Å; F222-M227 HydrophobicContact CE2-SD 3.91Å; F222-M227 HydrophobicContact CG-CB 4.49Å; F222-M227 HydrophobicContact CG-SD 4.3Å; F222-M227 HydrophobicContact CZ-SD 4Å; M227-G229 PolarHBondContact O-N 3.17Å; M227-R270 HydrophobicContact CE-CG 3.72Å; M227-R270 HydrophobicContact SD-CG 3.31Å; M227-R270 WeakPolarHBondContact SD-CG 3.28Å; M227-I273 HydrophobicContact CE-CB 4.27Å; M227-I273 HydrophobicContact CE-CG2 3.95Å; M227-D274 VanDerWaalsContact CE-CG 3.46Å; M227-D274 WeakPolarHBondContact CE-OD1 3.28Å
228	E	77.3	Confident	85.8	Confident	194 Å²	194	52.9 Å²	52.9	91%	0.907	30%	0.295	S	S	*	.			trans	-81.8	109.8	173.4	-65	-173.2	168.8	0	0	110.4
229	G	84.4	Confident	85.8	Confident	23 Å²	23	52.4 Å²	52.4	24%	0.237	29%	0.292	C	S	.	.	S	Bend	trans	157.4	-179.7	173.5	0	0	0	0	0	114.1	M227 N279	M227-G229 PolarHBondContact O-N 3.17Å; G229-N279 WeakPolarHBondContact CA-OD1 3.36Å
230	K	92.4	Very high	85.9	Confident	82 Å²	82	50.6 Å²	50.6	36%	0.357	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	133.3	176.9	-62.8	-167.2	178.1	-159.6	0	112.2	P219 E220 E221 N279 C280	P219-K230 HydrophobicContact CB-CB 4.11Å; P219-K230 HydrophobicContact CB-CD 4.09Å; E220-K230 CarbonylContact O-C 3.56Å; E220-K230 WeakPolarHBondContact O-CA 3.49Å; E220-K230 WeakPolarHBondContact O-CB 3.45Å; E221-K230 HydrophobicContact CG-CD 4.43Å; E221-K230 HydrophobicContact CG-CG 4.37Å; E221-K230 IonicContact OE1-NZ 2.82Å; E221-K230 PolarHBondContact OE1-NZ 3.47Å; K230-N279 PolarHBondContact N-OD1 2.9Å; K230-C280 VanDerWaalsContact O-CB 3.24Å; K230-C280 WeakPolarHBondContact O-CB 3.48Å; K230-C280 PolarHBondContact O-N 3.14Å
231	Y	93.8	Very high	86	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.016	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	158.5	174	70.9	-87.8	0	0	0	111.1	P219 E220 F222 E266	P219-Y231 CarbonylContact C-O 3.51Å; P219-Y231 WeakPolarHBondContact CA-O 3.33Å; E220-Y231 HydrophobicContact CB-CD1 4.4Å; E220-Y231 HydrophobicContact CB-CE1 3.84Å; E220-Y231 HydrophobicContact CB-CE2 4.05Å; E220-Y231 PolarHBondContact N-O 3.24Å; E220-Y231 PolarHBondContact O-N 2.94Å; E220-Y231 PolarHBondContact OE2-OH 3.2Å; F222-Y231 AromaticContact CD1-CD1 3.89Å; F222-Y231 HydrophobicContact CD1-CD1 3.89Å; F222-Y231 HydrophobicContact CD1-CE1 4.44Å; F222-Y231 AromaticContact CE1-CD1 3.81Å; F222-Y231 HydrophobicContact CE1-CD1 3.81Å; F222-Y231 HydrophobicContact CE1-CG 4.29Å; F222-Y231 HydrophobicContact CE2-CD1 4.48Å; F222-Y231 HydrophobicContact CG-CD1 4.26Å; F222-Y231 HydrophobicContact CZ-CD1 4.13Å; F222-Y231 HydrophobicContact CZ-CG 4.46Å; Y231-E266 HydrophobicContact CD1-CG 4.2Å; Y231-E266 HydrophobicContact CD2-CB 4.5Å; Y231-E266 HydrophobicContact CE1-CB 4.41Å; Y231-E266 HydrophobicContact CE1-CG 4Å; Y231-E266 HydrophobicContact CE2-CB 4.35Å
232	C	95.4	Very high	86.2	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.1	173.1	-59.7	0	0	0	0	110.7	Y215 S218 G234 Y238 C280	Y215-C232 HydrophobicContact CD2-CB 4.37Å; Y215-C232 VanDerWaalsContact CD2-SG 3.53Å; Y215-C232 HydrophobicContact CE1-CB 4.4Å; Y215-C232 HydrophobicContact CE2-CB 3.58Å; Y215-C232 WeakPolarHBondContact CE2-SG 3.4Å; Y215-C232 VanDerWaalsContact CZ-SG 3.58Å; Y215-C232 PolarHBondContact OH-N 3.01Å; S218-C232 CarbonylContact O-C 3.57Å; S218-C232 WeakPolarHBondContact O-CA 3.42Å; C232-G234 PolarHBondContact O-N 2.93Å; C232-Y238 HydrophobicContact CB-CD1 4Å; C232-Y238 HydrophobicContact CB-CG 3.96Å; C232-C280 WeakPolarHBondContact CA-SG 3.43Å; C232-C280 HydrophobicContact CB-CB 4.02Å; C232-C280 WeakPolarHBondContact CB-SG 3.19Å; C232-C280 PolarHBondContact N-SG 3.03Å; C232-C280 WeakPolarHBondContact SG-CB 3.18Å; C232-C280 CovalentContact SG-SG 2.03Å; C232-C280 PolarHBondContact SG-SG 3.24Å
233	Y	94.4	Very high	86.5	Confident	41 Å²	41	44 Å²	44	16%	0.161	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-63.4	124.6	176.4	-175.4	-102.3	0	0	0	111.9	S218 E220 G235 F236 H315	S218-Y233 PolarHBondContact O-N 2.79Å; E220-Y233 VanDerWaalsContact OE1-CD2 3.25Å; E220-Y233 WeakPolarHBondContact OE1-CD2 3.49Å; E220-Y233 WeakPolarHBondContact OE2-CD2 3.48Å; Y233-G235 VanDerWaalsContact C-N 3.31Å; Y233-G235 VanDerWaalsContact CD1-N 3.29Å; Y233-G235 PolarHBondContact O-N 2.87Å; Y233-F236 AromaticContact CD1-CD2 3.5Å; Y233-F236 HydrophobicContact CD1-CD2 3.5Å; Y233-F236 AromaticContact CD1-CE2 3.89Å; Y233-F236 HydrophobicContact CD1-CE2 3.89Å; Y233-F236 HydrophobicContact CD1-CG 4.27Å; Y233-F236 HydrophobicContact CE1-CD2 4.18Å; Y233-F236 HydrophobicContact CE1-CE2 4.2Å; Y233-F236 HydrophobicContact CG-CD2 4.31Å; Y233-F236 PolarHBondContact O-N 2.83Å; Y233-H315 AromaticContact CE1-CE1 3.86Å; Y233-H315 AromaticContact CE1-ND1 3.84Å
234	G	90.9	Very high	87.4	Confident	4 Å²	4	38.4 Å²	38.4	4%	0.041	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-67.5	-26.2	-173.2	0	0	0	0	0	115.1	C232 F236 G237 D265	C232-G234 PolarHBondContact O-N 2.93Å; G234-F236 VanDerWaalsContact C-N 3.33Å; G234-F236 PolarHBondContact O-N 3.33Å; G234-G237 PolarHBondContact O-N 3.28Å; G234-G237 VanDerWaalsContact O-N 3.11Å; G234-D265 PolarHBondContact N-OD2 2.92Å
235	G	91.6	Very high	88.6	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-69.6	-27	-179.1	0	0	0	0	0	113.6	Q191 A194 Y233 G237 H315	Q191-G235 VanDerWaalsContact OE1-N 3.15Å; A194-G235 WeakPolarHBondContact CB-O 3.37Å; Y233-G235 VanDerWaalsContact C-N 3.31Å; Y233-G235 VanDerWaalsContact CD1-N 3.29Å; Y233-G235 PolarHBondContact O-N 2.87Å; G235-G237 VanDerWaalsContact C-N 3.32Å; G235-H315 VanDerWaalsContact O-CB 3.22Å; G235-H315 WeakPolarHBondContact O-CB 3.44Å; G235-H315 PolarHBondContact O-CD2 3.16Å; G235-H315 VanDerWaalsContact O-CG 3.27Å
236	F	94.5	Very high	90.3	Very high	16 Å²	16	34.5 Å²	34.5	7%	0.07	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-90.5	2.3	173	-64.9	-61.7	0	0	0	113.1	Y233 G234 Y289 H291 Y292 E293 T313 H315	Y233-F236 AromaticContact CD1-CD2 3.5Å; Y233-F236 HydrophobicContact CD1-CD2 3.5Å; Y233-F236 AromaticContact CD1-CE2 3.89Å; Y233-F236 HydrophobicContact CD1-CE2 3.89Å; Y233-F236 HydrophobicContact CD1-CG 4.27Å; Y233-F236 HydrophobicContact CE1-CD2 4.18Å; Y233-F236 HydrophobicContact CE1-CE2 4.2Å; Y233-F236 HydrophobicContact CG-CD2 4.31Å; Y233-F236 PolarHBondContact O-N 2.83Å; G234-F236 VanDerWaalsContact C-N 3.33Å; G234-F236 PolarHBondContact O-N 3.33Å; F236-Y289 PolarHBondContact O-OH 3.46Å; F236-H291 HydrophobicContact CB-CB 4.05Å; F236-H291 HydrophobicContact CD1-CB 3.77Å; F236-H291 AromaticContact CD2-CD2 3.96Å; F236-H291 HydrophobicContact CE1-CB 4.42Å; F236-H291 HydrophobicContact CG-CB 3.9Å; F236-Y292 WeakPolarHBondContact CE1-O 3.49Å; F236-E293 HydrophobicContact CZ-CB 4.01Å; F236-E293 HydrophobicContact CZ-CG 4.32Å; F236-T313 WeakPolarHBondContact O-CB 3.41Å; F236-T313 VanDerWaalsContact O-CG2 3.32Å; F236-T313 WeakPolarHBondContact O-CG2 3.28Å; F236-T313 PolarHBondContact O-OG1 3.38Å; F236-H315 HydrophobicContact CD1-CB 3.74Å; F236-H315 HydrophobicContact CE1-CB 3.68Å; F236-H315 HydrophobicContact CZ-CB 4.47Å
237	G	95.6	Very high	91.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.147	C	C	.	.			trans	66.6	166.8	-169.9	0	0	0	0	0	113.9	F189 G234 G235 Y289	F189-G237 CarbonylContact O-C 3.57Å; F189-G237 WeakPolarHBondContact O-CA 3.1Å; G234-G237 PolarHBondContact O-N 3.28Å; G234-G237 VanDerWaalsContact O-N 3.11Å; G235-G237 VanDerWaalsContact C-N 3.32Å; G237-Y289 VanDerWaalsContact C-OH 3.26Å; G237-Y289 PolarHBondContact O-OH 3.15Å; G237-Y289 VanDerWaalsContact O-OH 3.11Å
238	Y	96.4	Very high	92.7	Very high	3 Å²	3	29.3 Å²	29.3	1%	0.012	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	152.8	175	51	-97	0	0	0	112.4	M169 Y188 F189 Y215 M216 C232 L240 L268	M169-Y238 WeakPolarHBondContact CE-OH 3.46Å; Y188-Y238 WeakPolarHBondContact CA-O 3.42Å; Y188-Y238 WeakPolarHBondContact CD2-O 3.21Å; F189-Y238 HydrophobicContact CB-CD2 4.25Å; F189-Y238 HydrophobicContact CB-CE2 3.65Å; F189-Y238 AromaticContact CD2-CE2 4Å; F189-Y238 HydrophobicContact CD2-CE2 4Å; F189-Y238 HydrophobicContact CG-CE2 4.2Å; F189-Y238 PolarHBondContact N-O 2.86Å; F189-Y238 PolarHBondContact O-N 3.09Å; Y215-Y238 HydrophobicContact CD2-CD2 4.45Å; Y215-Y238 AromaticContact CE2-CD2 3.76Å; Y215-Y238 HydrophobicContact CE2-CD2 3.76Å; Y215-Y238 HydrophobicContact CE2-CE2 4.37Å; Y215-Y238 AromaticContact CE2-CG 3.95Å; Y215-Y238 HydrophobicContact CE2-CG 3.95Å; M216-Y238 CarbonylContact O-C 3.56Å; M216-Y238 VanDerWaalsContact O-CA 3.24Å; M216-Y238 WeakPolarHBondContact O-CA 3.41Å; M216-Y238 VanDerWaalsContact O-CB 3.3Å; M216-Y238 WeakPolarHBondContact O-CB 3.39Å; C232-Y238 HydrophobicContact CB-CD1 4Å; C232-Y238 HydrophobicContact CB-CG 3.96Å; Y238-L240 HydrophobicContact CD2-CD1 4.39Å; Y238-L240 HydrophobicContact CD2-CG 4.17Å; Y238-L240 HydrophobicContact CE2-CD1 4.07Å; Y238-L240 HydrophobicContact CE2-CG 4.36Å; Y238-L268 HydrophobicContact CE2-CD2 3.94Å
239	L	95.8	Very high	93.5	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	134.8	175.8	-73	165.2	0	0	0	110.9	L111 Y188 L204 V205 L208 Y215 M216	L111-L239 HydrophobicContact CD1-CD2 4.17Å; Y188-L239 HydrophobicContact CD2-CD2 4.11Å; Y188-L239 HydrophobicContact CD2-CG 4.2Å; Y188-L239 HydrophobicContact CG-CD2 4.34Å; L204-L239 HydrophobicContact CD2-CD1 3.83Å; L204-L239 HydrophobicContact CG-CD1 4.4Å; V205-L239 HydrophobicContact CG2-CD1 3.95Å; V205-L239 HydrophobicContact CG2-CD2 3.73Å; L208-L239 HydrophobicContact CD1-CD1 4.15Å; Y215-L239 WeakPolarHBondContact CA-O 3.41Å; M216-L239 HydrophobicContact CB-CB 4.4Å; M216-L239 PolarHBondContact N-O 3.33Å; M216-L239 PolarHBondContact O-N 2.92Å
240	L	95.6	Very high	94	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	131.3	169.1	-64.9	169.6	0	0	0	109.4	I173 F187 F189 Y215 Y238 L244 L245 L268 I272	I173-L240 HydrophobicContact CD1-CD1 4.35Å; F187-L240 HydrophobicContact CB-CB 4.41Å; F187-L240 PolarHBondContact N-O 3Å; F187-L240 PolarHBondContact O-N 3.4Å; F189-L240 HydrophobicContact CD2-CD1 3.91Å; F189-L240 HydrophobicContact CE2-CD1 3.9Å; Y215-L240 HydrophobicContact CD2-CD2 3.32Å; Y215-L240 HydrophobicContact CD2-CG 4.34Å; Y215-L240 HydrophobicContact CE2-CD2 3.83Å; Y215-L240 HydrophobicContact CG-CD2 3.97Å; Y238-L240 HydrophobicContact CD2-CD1 4.39Å; Y238-L240 HydrophobicContact CD2-CG 4.17Å; Y238-L240 HydrophobicContact CE2-CD1 4.07Å; Y238-L240 HydrophobicContact CE2-CG 4.36Å; L240-L244 HydrophobicContact CD2-CD2 3.71Å; L240-L245 HydrophobicContact CB-CD1 4.45Å; L240-L245 HydrophobicContact CB-CD2 4.45Å; L240-L245 HydrophobicContact CB-CG 4.2Å; L240-L245 HydrophobicContact CD1-CD2 3.88Å; L240-L268 HydrophobicContact CD1-CD2 4.08Å; L240-I272 HydrophobicContact CD2-CD1 3.68Å
241	S	94.9	Very high	94	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.007	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	147.7	169.8	52.4	0	0	0	0	112	R212 L214 S243 L244 L245	R212-S241 WeakPolarHBondContact O-CB 3.31Å; R212-S241 PolarHBondContact O-OG 3.08Å; L214-S241 PolarHBondContact N-OG 3.43Å; L214-S241 PolarHBondContact O-N 3.15Å; L214-S241 VanDerWaalsContact O-N 3.07Å; L214-S241 PolarHBondContact O-OG 3.05Å; S241-S243 VanDerWaalsContact C-N 3.29Å; S241-S243 WeakPolarHBondContact CB-OG 3.48Å; S241-S243 PolarHBondContact O-N 2.95Å; S241-S243 PolarHBondContact OG-OG 2.87Å; S241-L244 PolarHBondContact O-N 3.27Å; S241-L244 WeakPolarHBondContact OG-CB 3.07Å; S241-L245 PolarHBondContact O-N 3.14Å; S241-L245 VanDerWaalsContact O-N 3.14Å
242	R	93.1	Very high	93.9	Very high	45 Å²	45	26.7 Å²	26.7	17%	0.17	13%	0.129	C	C	.	.	H	α-helix	trans	-54.3	-42.7	173.1	-176	-175.1	178.1	-81.4	-13.6	113.3	V181 N182 Y184 D185 F187 L245 L246	V181-R242 HydrophobicContact CG2-CG 4.03Å; V181-R242 WeakPolarHBondContact O-CD 3.31Å; V181-R242 PolarHBondContact O-NE 2.88Å; V181-R242 PolarHBondContact O-NH2 3.38Å; N182-R242 PolarHBondContact OD1-NH2 3.49Å; Y184-R242 WeakPolarHBondContact O-CD 3.31Å; D185-R242 VanDerWaalsContact O-CB 3.26Å; D185-R242 WeakPolarHBondContact O-CB 3.26Å; D185-R242 PolarHBondContact O-N 3Å; F187-R242 HydrophobicContact CE2-CB 3.95Å; F187-R242 HydrophobicContact CE2-CG 4.37Å; R242-L245 PolarHBondContact O-N 2.97Å; R242-L246 HydrophobicContact CG-CD1 4.17Å; R242-L246 WeakPolarHBondContact O-CG 3.48Å; R242-L246 PolarHBondContact O-N 3.07Å
243	S	92.5	Very high	93.6	Very high	32 Å²	32	30.1 Å²	30.1	22%	0.224	15%	0.145	C	C	.	.	H	α-helix	trans	-56.1	-49.3	177.6	49.8	0	0	0	0	111.5	R212 S241 L246 R247	R212-S243 PolarHBondContact O-OG 3.19Å; S241-S243 VanDerWaalsContact C-N 3.29Å; S241-S243 WeakPolarHBondContact CB-OG 3.48Å; S241-S243 PolarHBondContact O-N 2.95Å; S241-S243 PolarHBondContact OG-OG 2.87Å; S243-L246 PolarHBondContact O-N 2.9Å; S243-R247 PolarHBondContact O-N 3.35Å
244	L	94.1	Very high	93.4	Very high	1 Å²	1	32 Å²	32	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-63.4	-45.4	178.8	-176.3	66.7	0	0	0	112	E213 L214 L240 S241 L246 R247 L248 I272 T276 T278	E213-L244 HydrophobicContact CB-CD1 4.44Å; L214-L244 WeakPolarHBondContact O-CD2 3.48Å; L240-L244 HydrophobicContact CD2-CD2 3.71Å; S241-L244 PolarHBondContact O-N 3.27Å; S241-L244 WeakPolarHBondContact OG-CB 3.07Å; L244-L246 PolarHBondContact O-N 3.17Å; L244-R247 PolarHBondContact O-N 3.5Å; L244-L248 WeakPolarHBondContact O-CB 3.3Å; L244-L248 PolarHBondContact O-N 3.46Å; L244-I272 HydrophobicContact CD1-CG2 4.21Å; L244-I272 HydrophobicContact CD2-CG2 4.22Å; L244-T276 HydrophobicContact CD1-CG2 3.84Å; L244-T276 WeakPolarHBondContact CD1-OG1 3.48Å; L244-T278 HydrophobicContact CD1-CG2 4.25Å; L244-T278 HydrophobicContact CD2-CG2 4.33Å
245	L	94.2	Very high	93.3	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-61.2	-42.9	177.2	-77.3	-178.5	0	0	0	112.4	I173 V176 L177 F187 L240 S241 R242 R247 L248 Q249	I173-L245 HydrophobicContact CG2-CD2 4.07Å; V176-L245 HydrophobicContact CG1-CD1 4.42Å; L177-L245 HydrophobicContact CD2-CB 3.96Å; F187-L245 HydrophobicContact CB-CD1 3.93Å; F187-L245 HydrophobicContact CD1-CD1 4.03Å; F187-L245 HydrophobicContact CD2-CD1 3.44Å; F187-L245 VanDerWaalsContact CD2-CD1 3.44Å; F187-L245 HydrophobicContact CE2-CD1 4.02Å; F187-L245 HydrophobicContact CG-CD1 3.48Å; F187-L245 VanDerWaalsContact CG-CD1 3.48Å; L240-L245 HydrophobicContact CB-CD1 4.45Å; L240-L245 HydrophobicContact CB-CD2 4.45Å; L240-L245 HydrophobicContact CB-CG 4.2Å; L240-L245 HydrophobicContact CD1-CD2 3.88Å; S241-L245 PolarHBondContact O-N 3.14Å; S241-L245 VanDerWaalsContact O-N 3.14Å; R242-L245 PolarHBondContact O-N 2.97Å; L245-R247 VanDerWaalsContact C-N 3.34Å; L245-R247 PolarHBondContact O-N 2.94Å; L245-L248 PolarHBondContact O-N 3.22Å; L245-Q249 PolarHBondContact O-N 2.03Å
246	L	93.6	Very high	93	Very high	53 Å²	53	34.8 Å²	34.8	28%	0.277	17%	0.168	S	C	.	.	H	α-helix	trans	-64.8	-36.8	176.5	-72.8	172	0	0	0	112.6	V181 R242 S243 L244 L248 Q249	V181-L246 HydrophobicContact CG1-CD2 4.03Å; V181-L246 HydrophobicContact CG2-CD1 4.45Å; V181-L246 HydrophobicContact CG2-CD2 3.67Å; V181-L246 HydrophobicContact CG2-CG 3.77Å; R242-L246 HydrophobicContact CG-CD1 4.17Å; R242-L246 WeakPolarHBondContact O-CG 3.48Å; R242-L246 PolarHBondContact O-N 3.07Å; S243-L246 PolarHBondContact O-N 2.9Å; L244-L246 PolarHBondContact O-N 3.17Å; L246-L248 VanDerWaalsContact C-N 3.32Å; L246-Q249 WeakPolarHBondContact O-CB 3.3Å
247	R	93.4	Very high	92.5	Very high	112 Å²	112	39.6 Å²	39.6	42%	0.423	20%	0.195	S	C	.	.	H	α-helix	trans	-68.7	-32.5	174.6	-171.2	170.3	174.7	176.1	-5.9	112.3	E213 S243 L244 L245 P250 F251 T276	E213-R247 WeakPolarHBondContact OE1-CD 3.36Å; E213-R247 IonicContact OE1-CZ 2.84Å; E213-R247 IonicContact OE1-NE 2.77Å; E213-R247 IonicContact OE1-NH1 2.8Å; E213-R247 PolarHBondContact OE1-NH1 2.87Å; E213-R247 IonicContact OE2-CZ 3.64Å; E213-R247 IonicContact OE2-NE 3.31Å; E213-R247 IonicContact OE2-NH1 3.53Å; E213-R247 PolarHBondContact OE2-NH1 3.49Å; S243-R247 PolarHBondContact O-N 3.35Å; L244-R247 PolarHBondContact O-N 3.5Å; L245-R247 VanDerWaalsContact C-N 3.34Å; L245-R247 PolarHBondContact O-N 2.94Å; R247-P250 WeakPolarHBondContact O-CD 3.44Å; R247-F251 WeakPolarHBondContact O-CD2 3.36Å; R247-T276 HydrophobicContact CB-CG2 4.42Å; R247-T276 HydrophobicContact CG-CG2 4.1Å
248	L	93.7	Very high	91.8	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-75.2	-33.4	176.5	-162.8	68.3	0	0	0	113.1	L244 L245 L246 F251 L252 L268 C271 I272 T276	L244-L248 WeakPolarHBondContact O-CB 3.3Å; L244-L248 PolarHBondContact O-N 3.46Å; L245-L248 PolarHBondContact O-N 3.22Å; L246-L248 VanDerWaalsContact C-N 3.32Å; L248-F251 PolarHBondContact O-N 3.13Å; L248-L252 HydrophobicContact CD2-CD2 3.8Å; L248-L252 HydrophobicContact CG-CD2 3.89Å; L248-L252 HydrophobicContact CG-CG 4.24Å; L248-L252 PolarHBondContact O-N 2.93Å; L248-L268 HydrophobicContact CD2-CD1 3.93Å; L248-C271 WeakPolarHBondContact CD1-O 3.45Å; L248-I272 HydrophobicContact CD1-CG1 4.25Å; L248-I272 HydrophobicContact CD2-CG1 3.91Å; L248-T276 HydrophobicContact CD1-CG2 4.15Å
249	Q	93.9	Very high	91	Very high	80 Å²	80	48.1 Å²	48.1	37%	0.374	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-42.9	-50.3	-175	-176.6	172.6	25.1	0	0	115.6	L177 L245 L246 F251	L177-Q249 HydrophobicContact CD1-CB 3.9Å; L177-Q249 HydrophobicContact CD1-CG 4.04Å; L177-Q249 HydrophobicContact CD2-CB 4.12Å; L177-Q249 HydrophobicContact CD2-CG 4.38Å; L245-Q249 PolarHBondContact O-N 2.03Å; L246-Q249 WeakPolarHBondContact O-CB 3.3Å; Q249-F251 PolarHBondContact O-N 2.93Å
250	P	94.1	Very high	90.1	Very high	87 Å²	87	53.6 Å²	53.6	57%	0.565	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-67.9	-18	-179.6	26.4	-35.4	0	0	0	114.4	R247	R247-P250 WeakPolarHBondContact O-CD 3.44Å
251	F	92.9	Very high	89.3	Confident	72 Å²	72	53.9 Å²	53.9	32%	0.316	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-103.5	-11.6	-173.7	-56.5	-66.3	0	0	0	114.4	R247 L248 Q249 E253 N254 C255 Y275	R247-F251 WeakPolarHBondContact O-CD2 3.36Å; L248-F251 PolarHBondContact O-N 3.13Å; Q249-F251 PolarHBondContact O-N 2.93Å; F251-E253 VanDerWaalsContact C-N 3.27Å; F251-E253 PolarHBondContact O-N 3.09Å; F251-N254 WeakPolarHBondContact O-CA 3.24Å; F251-N254 VanDerWaalsContact O-CB 3.32Å; F251-N254 WeakPolarHBondContact O-CB 3.36Å; F251-N254 PolarHBondContact O-N 3.19Å; F251-C255 PolarHBondContact O-N 3.41Å; F251-C255 VanDerWaalsContact O-N 3.09Å; F251-Y275 HydrophobicContact CB-CD1 3.52Å; F251-Y275 HydrophobicContact CB-CD2 3.96Å; F251-Y275 HydrophobicContact CB-CE1 3.88Å; F251-Y275 HydrophobicContact CB-CE2 4.32Å; F251-Y275 HydrophobicContact CB-CG 3.55Å; F251-Y275 AromaticContact CD1-CD1 3.27Å; F251-Y275 HydrophobicContact CD1-CD1 3.27Å; F251-Y275 AromaticContact CD1-CE1 3.49Å; F251-Y275 HydrophobicContact CD1-CE1 3.49Å; F251-Y275 VanDerWaalsContact CD1-CE1 3.49Å; F251-Y275 HydrophobicContact CD1-CG 4.16Å; F251-Y275 AromaticContact CD2-CD1 3.79Å; F251-Y275 HydrophobicContact CD2-CD1 3.79Å; F251-Y275 AromaticContact CD2-CG 3.99Å; F251-Y275 HydrophobicContact CD2-CG 3.99Å; F251-Y275 AromaticContact CE1-CD1 3.85Å; F251-Y275 HydrophobicContact CE1-CD1 3.85Å; F251-Y275 HydrophobicContact CE1-CE1 4.2Å; F251-Y275 HydrophobicContact CE2-CD1 4.3Å; F251-Y275 AromaticContact CG-CD1 3.23Å; F251-Y275 HydrophobicContact CG-CD1 3.23Å; F251-Y275 AromaticContact CG-CE1 3.81Å; F251-Y275 HydrophobicContact CG-CE1 3.81Å; F251-Y275 AromaticContact CG-CG 3.64Å; F251-Y275 HydrophobicContact CG-CG 3.64Å; F251-Y275 HydrophobicContact CZ-CD1 4.33Å
252	L	90.8	Very high	88.6	Confident	9 Å²	9	58.8 Å²	58.8	5%	0.047	31%	0.305	C	S	.	.	H	α-helix	trans	-55.2	-38	-178	-75.1	173.7	0	0	0	114	F170 I173 L177 L248 N254 C255 R256	F170-L252 HydrophobicContact CE2-CB 4.02Å; F170-L252 WeakPolarHBondContact CE2-O 3.47Å; I173-L252 HydrophobicContact CG2-CD1 3.84Å; I173-L252 HydrophobicContact CG2-CD2 4.12Å; L177-L252 HydrophobicContact CD1-CD1 3.28Å; L248-L252 HydrophobicContact CD2-CD2 3.8Å; L248-L252 HydrophobicContact CG-CD2 3.89Å; L248-L252 HydrophobicContact CG-CG 4.24Å; L248-L252 PolarHBondContact O-N 2.93Å; L252-N254 VanDerWaalsContact C-N 3.26Å; L252-N254 PolarHBondContact O-N 3.05Å; L252-C255 PolarHBondContact O-N 3.38Å; L252-R256 PolarHBondContact O-N 2.89Å
253	E	89.9	Confident	88.4	Confident	73 Å²	73	59.9 Å²	59.9	34%	0.341	31%	0.309	S	S	.	.	H	α-helix	trans	-65.9	-28.2	176.7	-71.7	-78.7	151.8	0	0	112.2	R174 F251 R256 N257	R174-E253 IonicContact CZ-OE1 2.7Å; R174-E253 IonicContact NH1-OE1 2.68Å; R174-E253 PolarHBondContact NH1-OE1 3.03Å; F251-E253 VanDerWaalsContact C-N 3.27Å; F251-E253 PolarHBondContact O-N 3.09Å; E253-R256 VanDerWaalsContact CD-NH1 3.27Å; E253-R256 IonicContact OE1-NH1 3.88Å; E253-R256 PolarHBondContact OE1-NH1 3.46Å; E253-R256 IonicContact OE2-CZ 3.21Å; E253-R256 IonicContact OE2-NH1 3.99Å; E253-R256 PolarHBondContact OE2-NH1 3.08Å; E253-R256 IonicContact OE2-NH2 2.63Å; E253-R256 PolarHBondContact OE2-NH2 3.34Å; E253-N257 VanDerWaalsContact O-CG 3.27Å; E253-N257 PolarHBondContact O-ND2 3.13Å; E253-N257 VanDerWaalsContact O-ND2 3.08Å; E253-N257 PolarHBondContact O-OD1 3.19Å
254	N	90.4	Very high	88.3	Confident	81 Å²	81	59.4 Å²	59.4	43%	0.433	31%	0.305	S	S	.	.	H	α-helix	trans	-74.5	-49.3	173.1	-65.2	12.5	0	0	0	110.5	F251 L252 R256 N257 D258 Y275	F251-N254 WeakPolarHBondContact O-CA 3.24Å; F251-N254 VanDerWaalsContact O-CB 3.32Å; F251-N254 WeakPolarHBondContact O-CB 3.36Å; F251-N254 PolarHBondContact O-N 3.19Å; L252-N254 VanDerWaalsContact C-N 3.26Å; L252-N254 PolarHBondContact O-N 3.05Å; N254-R256 PolarHBondContact O-N 3.18Å; N254-R256 VanDerWaalsContact O-N 3.13Å; N254-N257 PolarHBondContact O-N 2.9Å; N254-D258 PolarHBondContact O-N 2.77Å; N254-Y275 WeakPolarHBondContact CB-OH 3.47Å
255	C	88.6	Confident	88.2	Confident	7 Å²	7	59.5 Å²	59.5	5%	0.047	31%	0.306	C	S	.	.	H	α-helix	trans	-56.3	-29.6	177	-59.5	0	0	0	0	113.2	F251 L252 N257 W267 C271 Y275	F251-C255 PolarHBondContact O-N 3.41Å; F251-C255 VanDerWaalsContact O-N 3.09Å; L252-C255 PolarHBondContact O-N 3.38Å; C255-N257 VanDerWaalsContact C-N 3.32Å; C255-W267 HydrophobicContact CB-CZ2 4.04Å; C255-W267 PolarHBondContact O-NE1 2.84Å; C255-C271 HydrophobicContact CB-CB 3.62Å; C255-C271 WeakPolarHBondContact CB-SG 3.41Å; C255-C271 VanDerWaalsContact SG-CA 3.59Å; C255-C271 WeakPolarHBondContact SG-CB 2.96Å; C255-C271 CovalentContact SG-SG 2.03Å; C255-C271 PolarHBondContact SG-SG 3.01Å; C255-Y275 WeakPolarHBondContact SG-CE2 3.48Å
256	R	85.9	Confident	88.1	Confident	54 Å²	54	59.7 Å²	59.7	20%	0.204	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-25.3	175.7	-165.5	-163.3	71.2	-147.6	-23.8	113.5	W167 F170 L252 E253 N254 I259	W167-R256 HydrophobicContact CE3-CG 4.24Å; W167-R256 HydrophobicContact CZ3-CG 3.85Å; F170-R256 HydrophobicContact CD1-CG 4.19Å; F170-R256 HydrophobicContact CD2-CB 3.9Å; F170-R256 HydrophobicContact CD2-CG 4Å; F170-R256 HydrophobicContact CE1-CG 4.34Å; F170-R256 HydrophobicContact CE2-CB 3.87Å; F170-R256 HydrophobicContact CE2-CG 4.13Å; F170-R256 HydrophobicContact CG-CB 4.44Å; F170-R256 HydrophobicContact CG-CG 4.04Å; F170-R256 HydrophobicContact CZ-CB 4.41Å; F170-R256 HydrophobicContact CZ-CG 4.32Å; L252-R256 PolarHBondContact O-N 2.89Å; E253-R256 VanDerWaalsContact CD-NH1 3.27Å; E253-R256 IonicContact OE1-NH1 3.88Å; E253-R256 PolarHBondContact OE1-NH1 3.46Å; E253-R256 IonicContact OE2-CZ 3.21Å; E253-R256 IonicContact OE2-NH1 3.99Å; E253-R256 PolarHBondContact OE2-NH1 3.08Å; E253-R256 IonicContact OE2-NH2 2.63Å; E253-R256 PolarHBondContact OE2-NH2 3.34Å; N254-R256 PolarHBondContact O-N 3.18Å; N254-R256 VanDerWaalsContact O-N 3.13Å; R256-I259 WeakPolarHBondContact O-CD1 3.48Å; R256-I259 WeakPolarHBondContact O-CG1 3.34Å
257	N	84.3	Confident	88	Confident	118 Å²	118	57.4 Å²	57.4	63%	0.631	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-19.3	-179.3	-57.8	-25.3	0	0	0	111.8	E253 N254 C255	E253-N257 VanDerWaalsContact O-CG 3.27Å; E253-N257 PolarHBondContact O-ND2 3.13Å; E253-N257 VanDerWaalsContact O-ND2 3.08Å; E253-N257 PolarHBondContact O-OD1 3.19Å; N254-N257 PolarHBondContact O-N 2.9Å; C255-N257 VanDerWaalsContact C-N 3.32Å
258	D	80.8	Confident	88	Confident	101 Å²	101	52.1 Å²	52.1	54%	0.54	27%	0.274	S	S	.	.			trans	-111.6	62.1	-178.7	-159.9	8.1	0	0	0	111.9	N254 L260	N254-D258 PolarHBondContact O-N 2.77Å; D258-L260 PolarHBondContact O-N 2.71Å
259	I	79.9	Confident	88	Confident	80 Å²	80	52 Å²	52	41%	0.41	27%	0.274	S	S	.	.			trans	-84.8	92.6	-179	-59.5	172.6	0	0	0	109.4	I166 R256	I166-I259 HydrophobicContact CD1-CG2 3.59Å; I166-I259 HydrophobicContact CG2-CD1 4Å; I166-I259 HydrophobicContact CG2-CG1 4.31Å; I166-I259 HydrophobicContact CG2-CG2 4.28Å; R256-I259 WeakPolarHBondContact O-CD1 3.48Å; R256-I259 WeakPolarHBondContact O-CG1 3.34Å
260	L	76.1	Confident	87.8	Confident	115 Å²	115	50.4 Å²	50.4	60%	0.602	26%	0.264	S	S	*	.			trans	-92.2	-25.8	177.1	-63.5	171.6	0	0	0	113.8	D258	D258-L260 PolarHBondContact O-N 2.71Å
261	S	78.1	Confident	87.7	Confident	8 Å²	8	46.5 Å²	46.5	6%	0.056	24%	0.239	C	C	.	.			trans	-98	152.6	-173.3	-64.9	0	0	0	0	112.5	I166 E266 R270	I166-S261 WeakPolarHBondContact CD1-O 3.43Å; S261-E266 VanDerWaalsContact CB-OE1 3.28Å; S261-E266 WeakPolarHBondContact CB-OE1 3.46Å; S261-E266 PolarHBondContact OG-OE1 2.93Å; S261-R270 PolarHBondContact OG-NH1 3.16Å
262	S	80.8	Confident	87.7	Confident	104 Å²	104	43 Å²	43	73%	0.727	22%	0.224	S	C	*	.	S	Bend	trans	-90.5	-20.3	179.6	67.7	0	0	0	0	113.7
263	R	87.9	Confident	87.8	Confident	68 Å²	68	43.4 Å²	43.4	26%	0.257	23%	0.226	S	C	.	.	S	Bend	trans	-102	147	-179.5	-51.6	175.4	52.4	112.8	5.3	112	D265 E266 W267	R263-D265 WeakPolarHBondContact CB-OD1 3.42Å; R263-D265 IonicContact CZ-OD1 3Å; R263-D265 IonicContact CZ-OD2 2.67Å; R263-D265 IonicContact NE-OD1 2.72Å; R263-D265 PolarHBondContact NE-OD1 2.89Å; R263-D265 IonicContact NE-OD2 2.78Å; R263-D265 PolarHBondContact NE-OD2 2.82Å; R263-D265 IonicContact NH2-OD1 2.71Å; R263-D265 IonicContact NH2-OD2 3.31Å; R263-D265 PolarHBondContact NH2-OD2 3.49Å; R263-E266 HydrophobicContact CB-CB 3.99Å; R263-W267 WeakPolarHBondContact O-CB 3.07Å; R263-W267 PolarHBondContact O-N 2.88Å; R263-W267 VanDerWaalsContact O-N 3.1Å
264	P	90.8	Very high	87.8	Confident	21 Å²	21	44.7 Å²	44.7	14%	0.136	24%	0.235	C	C	.	.	H	α-helix	trans	-73.2	-30.3	-179.3	29.9	-35.4	0	0	0	114.2	L165 I166 M169 L268	L165-P264 HydrophobicContact CB-CB 4.47Å; L165-P264 HydrophobicContact CB-CG 4.25Å; I166-P264 HydrophobicContact CG1-CB 4.43Å; M169-P264 HydrophobicContact CB-CB 3.83Å; M169-P264 HydrophobicContact CG-CB 4.1Å; P264-L268 PolarHBondContact O-N 2.81Å; P264-L268 VanDerWaalsContact O-N 3.17Å
265	D	92.6	Very high	87.9	Confident	4 Å²	4	44.5 Å²	44.5	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-72.6	-46.5	176.3	51.8	-8	0	0	0	111.6	G234 R263 W267 L268 G269	G234-D265 PolarHBondContact N-OD2 2.92Å; R263-D265 WeakPolarHBondContact CB-OD1 3.42Å; R263-D265 IonicContact CZ-OD1 3Å; R263-D265 IonicContact CZ-OD2 2.67Å; R263-D265 IonicContact NE-OD1 2.72Å; R263-D265 PolarHBondContact NE-OD1 2.89Å; R263-D265 IonicContact NE-OD2 2.78Å; R263-D265 PolarHBondContact NE-OD2 2.82Å; R263-D265 IonicContact NH2-OD1 2.71Å; R263-D265 IonicContact NH2-OD2 3.31Å; R263-D265 PolarHBondContact NH2-OD2 3.49Å; D265-W267 VanDerWaalsContact C-N 3.35Å; D265-W267 PolarHBondContact O-N 2.71Å; D265-L268 PolarHBondContact O-N 3.22Å; D265-G269 PolarHBondContact O-N 3.11Å
266	E	91.5	Very high	88	Confident	5 Å²	5	44.3 Å²	44.3	2%	0.023	23%	0.227	C	C	.	.	H	α-helix	trans	-58.6	-44.2	172.9	-165.4	-159	148	0	0	111.5	F222 Y231 S261 R263 L268 G269 R270	F222-E266 HydrophobicContact CD1-CG 3.74Å; F222-E266 HydrophobicContact CE1-CG 4.01Å; Y231-E266 HydrophobicContact CD1-CG 4.2Å; Y231-E266 HydrophobicContact CD2-CB 4.5Å; Y231-E266 HydrophobicContact CE1-CB 4.41Å; Y231-E266 HydrophobicContact CE1-CG 4Å; Y231-E266 HydrophobicContact CE2-CB 4.35Å; S261-E266 VanDerWaalsContact CB-OE1 3.28Å; S261-E266 WeakPolarHBondContact CB-OE1 3.46Å; S261-E266 PolarHBondContact OG-OE1 2.93Å; R263-E266 HydrophobicContact CB-CB 3.99Å; E266-L268 PolarHBondContact O-N 3.18Å; E266-G269 PolarHBondContact O-N 3.07Å; E266-R270 PolarHBondContact O-N 2.8Å; E266-R270 IonicContact OE1-NH1 3.57Å
267	W	92.1	Very high	88.2	Confident	6 Å²	6	46.3 Å²	46.3	2%	0.023	25%	0.249	C	C	.	.	H	α-helix	trans	-59	-46	175.2	167.5	79.6	0	0	0	112.7	I166 M169 F170 C255 R263 D265 R270 C271	I166-W267 HydrophobicContact CG2-CB 4.17Å; I166-W267 HydrophobicContact CG2-CD2 3.64Å; I166-W267 HydrophobicContact CG2-CE3 4.15Å; I166-W267 HydrophobicContact CG2-CG 3.59Å; M169-W267 HydrophobicContact CB-CE3 4.44Å; M169-W267 HydrophobicContact CB-CZ3 4.31Å; M169-W267 HydrophobicContact CG-CE3 4.11Å; M169-W267 HydrophobicContact CG-CZ3 3.94Å; F170-W267 HydrophobicContact CB-CH2 3.63Å; F170-W267 HydrophobicContact CB-CZ2 4.14Å; F170-W267 HydrophobicContact CB-CZ3 4.22Å; F170-W267 AromaticContact CD2-CH2 3.98Å; F170-W267 HydrophobicContact CD2-CH2 3.98Å; F170-W267 HydrophobicContact CD2-CZ2 4.17Å; F170-W267 HydrophobicContact CG-CH2 4.31Å; C255-W267 HydrophobicContact CB-CZ2 4.04Å; C255-W267 PolarHBondContact O-NE1 2.84Å; R263-W267 WeakPolarHBondContact O-CB 3.07Å; R263-W267 PolarHBondContact O-N 2.88Å; R263-W267 VanDerWaalsContact O-N 3.1Å; D265-W267 VanDerWaalsContact C-N 3.35Å; D265-W267 PolarHBondContact O-N 2.71Å; W267-R270 PolarHBondContact O-N 3.24Å; W267-C271 PolarHBondContact O-N 2.9Å; W267-C271 VanDerWaalsContact O-N 3.13Å
268	L	93.4	Very high	88.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.8	-44.3	177.8	177.4	65.1	0	0	0	110.8	M169 I173 Y238 L240 L248 P264 D265 E266 R270 C271 I272	M169-L268 HydrophobicContact CE-CB 4.38Å; M169-L268 HydrophobicContact CE-CD2 3.45Å; M169-L268 VanDerWaalsContact CE-CD2 3.45Å; M169-L268 HydrophobicContact CE-CG 4.4Å; I173-L268 HydrophobicContact CD1-CD2 4.27Å; I173-L268 HydrophobicContact CG1-CD1 4.36Å; Y238-L268 HydrophobicContact CE2-CD2 3.94Å; L240-L268 HydrophobicContact CD1-CD2 4.08Å; L248-L268 HydrophobicContact CD2-CD1 3.93Å; P264-L268 PolarHBondContact O-N 2.81Å; P264-L268 VanDerWaalsContact O-N 3.17Å; D265-L268 PolarHBondContact O-N 3.22Å; E266-L268 PolarHBondContact O-N 3.18Å; L268-R270 VanDerWaalsContact C-N 3.3Å; L268-R270 PolarHBondContact O-N 3Å; L268-C271 WeakPolarHBondContact O-CB 3.44Å; L268-C271 PolarHBondContact O-N 3.39Å; L268-I272 HydrophobicContact CD1-CD1 4.06Å; L268-I272 HydrophobicContact CD1-CG1 4.14Å; L268-I272 HydrophobicContact CD2-CD1 4.14Å; L268-I272 HydrophobicContact CG-CD1 3.75Å; L268-I272 HydrophobicContact CG-CG1 4.26Å; L268-I272 WeakPolarHBondContact O-CG1 3.32Å; L268-I272 PolarHBondContact O-N 2.92Å
269	G	92.6	Very high	89.3	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.7	-41.1	178.5	0	0	0	0	0	112.7	D265 E266 I272 I273	D265-G269 PolarHBondContact O-N 3.11Å; E266-G269 PolarHBondContact O-N 3.07Å; G269-I272 PolarHBondContact O-N 2.76Å; G269-I273 WeakPolarHBondContact O-CG1 3.44Å; G269-I273 PolarHBondContact O-N 2.95Å
270	R	90.6	Very high	90	Very high	46 Å²	46	36.6 Å²	36.6	17%	0.174	20%	0.199	C	C	.	.	H	α-helix	trans	-56.4	-55.7	171.8	-121.3	171.9	177	150.8	-1.4	111.3	F222 M227 S261 E266 W267 L268 I272 I273 D274	F222-R270 HydrophobicContact CD1-CG 4.35Å; F222-R270 HydrophobicContact CE1-CB 4.14Å; F222-R270 HydrophobicContact CE1-CG 3.82Å; F222-R270 HydrophobicContact CZ-CG 4.31Å; M227-R270 HydrophobicContact CE-CG 3.72Å; M227-R270 HydrophobicContact SD-CG 3.31Å; M227-R270 WeakPolarHBondContact SD-CG 3.28Å; S261-R270 PolarHBondContact OG-NH1 3.16Å; E266-R270 PolarHBondContact O-N 2.8Å; E266-R270 IonicContact OE1-NH1 3.57Å; W267-R270 PolarHBondContact O-N 3.24Å; L268-R270 VanDerWaalsContact C-N 3.3Å; L268-R270 PolarHBondContact O-N 3Å; R270-I272 VanDerWaalsContact C-N 3.28Å; R270-I272 PolarHBondContact O-N 3.41Å; R270-I273 PolarHBondContact O-N 3.03Å; R270-I273 VanDerWaalsContact O-N 3.11Å; R270-D274 WeakPolarHBondContact O-CB 3.38Å; R270-D274 PolarHBondContact O-N 3.21Å
271	C	91.8	Very high	90.9	Very high	4 Å²	4	33.4 Å²	33.4	3%	0.027	19%	0.185	C	C	.	.	H	α-helix	trans	-56.1	-40	178.4	-176.4	0	0	0	0	112.9	L248 C255 W267 L268 Y275	L248-C271 WeakPolarHBondContact CD1-O 3.45Å; C255-C271 HydrophobicContact CB-CB 3.62Å; C255-C271 WeakPolarHBondContact CB-SG 3.41Å; C255-C271 VanDerWaalsContact SG-CA 3.59Å; C255-C271 WeakPolarHBondContact SG-CB 2.96Å; C255-C271 CovalentContact SG-SG 2.03Å; C255-C271 PolarHBondContact SG-SG 3.01Å; W267-C271 PolarHBondContact O-N 2.9Å; W267-C271 VanDerWaalsContact O-N 3.13Å; L268-C271 WeakPolarHBondContact O-CB 3.44Å; L268-C271 PolarHBondContact O-N 3.39Å; C271-Y275 WeakPolarHBondContact O-CD2 3.03Å; C271-Y275 PolarHBondContact O-N 3.41Å
272	I	93.9	Very high	91.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.5	-50.6	175.8	-71.2	171	0	0	0	110.4	Y215 L240 L244 L248 L268 G269 R270 T276 T278	Y215-I272 HydrophobicContact CD1-CD1 4.08Å; Y215-I272 HydrophobicContact CD1-CG2 4.05Å; Y215-I272 HydrophobicContact CD2-CD1 4.34Å; Y215-I272 HydrophobicContact CE1-CD1 3.96Å; Y215-I272 HydrophobicContact CE2-CD1 4.2Å; Y215-I272 HydrophobicContact CG-CD1 4.28Å; L240-I272 HydrophobicContact CD2-CD1 3.68Å; L244-I272 HydrophobicContact CD1-CG2 4.21Å; L244-I272 HydrophobicContact CD2-CG2 4.22Å; L248-I272 HydrophobicContact CD1-CG1 4.25Å; L248-I272 HydrophobicContact CD2-CG1 3.91Å; L268-I272 HydrophobicContact CD1-CD1 4.06Å; L268-I272 HydrophobicContact CD1-CG1 4.14Å; L268-I272 HydrophobicContact CD2-CD1 4.14Å; L268-I272 HydrophobicContact CG-CD1 3.75Å; L268-I272 HydrophobicContact CG-CG1 4.26Å; L268-I272 WeakPolarHBondContact O-CG1 3.32Å; L268-I272 PolarHBondContact O-N 2.92Å; G269-I272 PolarHBondContact O-N 2.76Å; R270-I272 VanDerWaalsContact C-N 3.28Å; R270-I272 PolarHBondContact O-N 3.41Å; I272-T276 WeakPolarHBondContact O-CA 3.18Å; I272-T276 WeakPolarHBondContact O-CB 3.38Å; I272-T276 PolarHBondContact O-N 3.39Å; I272-T276 PolarHBondContact O-OG1 2.71Å; I272-T278 WeakPolarHBondContact CG2-O 3.44Å
273	I	92.2	Very high	92.3	Very high	17 Å²	17	35.8 Å²	35.8	9%	0.087	19%	0.189	C	C	.	.	H	α-helix	trans	-65.9	-45.9	-176.2	-72.4	164.5	0	0	0	111.5	F222 M227 G269 R270 Y275 S277 T278 N279	F222-I273 HydrophobicContact CE2-CD1 3.62Å; F222-I273 HydrophobicContact CZ-CD1 3.81Å; M227-I273 HydrophobicContact CE-CB 4.27Å; M227-I273 HydrophobicContact CE-CG2 3.95Å; G269-I273 WeakPolarHBondContact O-CG1 3.44Å; G269-I273 PolarHBondContact O-N 2.95Å; R270-I273 PolarHBondContact O-N 3.03Å; R270-I273 VanDerWaalsContact O-N 3.11Å; I273-Y275 VanDerWaalsContact C-N 3.33Å; I273-Y275 PolarHBondContact O-N 2.84Å; I273-S277 VanDerWaalsContact O-CA 3.25Å; I273-S277 WeakPolarHBondContact O-CA 3.38Å; I273-S277 PolarHBondContact O-N 2.9Å; I273-T278 WeakPolarHBondContact CG1-O 3.33Å; I273-N279 WeakPolarHBondContact CD1-OD1 3.5Å
274	D	90.3	Very high	92.5	Very high	99 Å²	99	34.7 Å²	34.7	53%	0.529	19%	0.185	S	C	.	.	H	α-helix	trans	-60.1	-38.6	-177.6	-74.9	-42.7	0	0	0	113.3	M227 R270	M227-D274 VanDerWaalsContact CE-CG 3.46Å; M227-D274 WeakPolarHBondContact CE-OD1 3.28Å; R270-D274 WeakPolarHBondContact O-CB 3.38Å; R270-D274 PolarHBondContact O-N 3.21Å
275	Y	91.4	Very high	92.3	Very high	77 Å²	77	38.8 Å²	38.8	30%	0.302	20%	0.202	S	C	.	.	H	α-helix	trans	-106.7	-17.1	-171.9	-68.3	-80.2	0	0	0	114.9	F251 N254 C255 C271 I273	F251-Y275 HydrophobicContact CB-CD1 3.52Å; F251-Y275 HydrophobicContact CB-CD2 3.96Å; F251-Y275 HydrophobicContact CB-CE1 3.88Å; F251-Y275 HydrophobicContact CB-CE2 4.32Å; F251-Y275 HydrophobicContact CB-CG 3.55Å; F251-Y275 AromaticContact CD1-CD1 3.27Å; F251-Y275 HydrophobicContact CD1-CD1 3.27Å; F251-Y275 AromaticContact CD1-CE1 3.49Å; F251-Y275 HydrophobicContact CD1-CE1 3.49Å; F251-Y275 VanDerWaalsContact CD1-CE1 3.49Å; F251-Y275 HydrophobicContact CD1-CG 4.16Å; F251-Y275 AromaticContact CD2-CD1 3.79Å; F251-Y275 HydrophobicContact CD2-CD1 3.79Å; F251-Y275 AromaticContact CD2-CG 3.99Å; F251-Y275 HydrophobicContact CD2-CG 3.99Å; F251-Y275 AromaticContact CE1-CD1 3.85Å; F251-Y275 HydrophobicContact CE1-CD1 3.85Å; F251-Y275 HydrophobicContact CE1-CE1 4.2Å; F251-Y275 HydrophobicContact CE2-CD1 4.3Å; F251-Y275 AromaticContact CG-CD1 3.23Å; F251-Y275 HydrophobicContact CG-CD1 3.23Å; F251-Y275 AromaticContact CG-CE1 3.81Å; F251-Y275 HydrophobicContact CG-CE1 3.81Å; F251-Y275 AromaticContact CG-CG 3.64Å; F251-Y275 HydrophobicContact CG-CG 3.64Å; F251-Y275 HydrophobicContact CZ-CD1 4.33Å; N254-Y275 WeakPolarHBondContact CB-OH 3.47Å; C255-Y275 WeakPolarHBondContact SG-CE2 3.48Å; C271-Y275 WeakPolarHBondContact O-CD2 3.03Å; C271-Y275 PolarHBondContact O-N 3.41Å; I273-Y275 VanDerWaalsContact C-N 3.33Å; I273-Y275 PolarHBondContact O-N 2.84Å
276	T	91.3	Very high	92.1	Very high	4 Å²	4	41.5 Å²	41.5	3%	0.025	23%	0.231	C	C	.	.	H	α-helix	trans	-122.6	-15.2	-178.9	79	0	0	0	0	113.8	L244 R247 L248 I272 T278	L244-T276 HydrophobicContact CD1-CG2 3.84Å; L244-T276 WeakPolarHBondContact CD1-OG1 3.48Å; R247-T276 HydrophobicContact CB-CG2 4.42Å; R247-T276 HydrophobicContact CG-CG2 4.1Å; L248-T276 HydrophobicContact CD1-CG2 4.15Å; I272-T276 WeakPolarHBondContact O-CA 3.18Å; I272-T276 WeakPolarHBondContact O-CB 3.38Å; I272-T276 PolarHBondContact O-N 3.39Å; I272-T276 PolarHBondContact O-OG1 2.71Å; T276-T278 PolarHBondContact O-N 3.36Å; T276-T278 WeakPolarHBondContact OG1-CB 3.36Å; T276-T278 PolarHBondContact OG1-N 2.84Å; T276-T278 PolarHBondContact OG1-OG1 3.47Å
277	S	91	Very high	92	Very high	95 Å²	95	43.5 Å²	43.5	66%	0.664	24%	0.241	S	C	*	.			trans	59	17.4	-173.2	-48.3	0	0	0	0	114.8	I273	I273-S277 VanDerWaalsContact O-CA 3.25Å; I273-S277 WeakPolarHBondContact O-CA 3.38Å; I273-S277 PolarHBondContact O-N 2.9Å
278	T	92.6	Very high	92.1	Very high	21 Å²	21	48.3 Å²	48.3	13%	0.129	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-88.6	124.4	176.5	-59.2	0	0	0	0	110.5	L244 I272 I273 T276	L244-T278 HydrophobicContact CD1-CG2 4.25Å; L244-T278 HydrophobicContact CD2-CG2 4.33Å; I272-T278 WeakPolarHBondContact CG2-O 3.44Å; I273-T278 WeakPolarHBondContact CG1-O 3.33Å; T276-T278 PolarHBondContact O-N 3.36Å; T276-T278 WeakPolarHBondContact OG1-CB 3.36Å; T276-T278 PolarHBondContact OG1-N 2.84Å; T276-T278 PolarHBondContact OG1-OG1 3.47Å
279	N	93.9	Very high	92.1	Very high	67 Å²	67	48.4 Å²	48.4	36%	0.358	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-93.3	155.4	175.2	-78.6	-79.2	0	0	0	111.6	G229 K230 I273 V281	G229-N279 WeakPolarHBondContact CA-OD1 3.36Å; K230-N279 PolarHBondContact N-OD1 2.9Å; I273-N279 WeakPolarHBondContact CD1-OD1 3.5Å; N279-V281 PolarHBondContact O-N 3.48Å
280	C	95.3	Very high	92.2	Very high	7 Å²	7	51.7 Å²	51.7	5%	0.047	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-64.8	130.7	168.2	-177.5	0	0	0	0	110.8	Y215 P219 K230 C232	Y215-C280 HydrophobicContact CD1-CB 4.01Å; Y215-C280 HydrophobicContact CE1-CB 3.96Å; Y215-C280 WeakPolarHBondContact O-CA 3.2Å; P219-C280 HydrophobicContact CB-CB 4.15Å; K230-C280 VanDerWaalsContact O-CB 3.24Å; K230-C280 WeakPolarHBondContact O-CB 3.48Å; K230-C280 PolarHBondContact O-N 3.14Å; C232-C280 WeakPolarHBondContact CA-SG 3.43Å; C232-C280 HydrophobicContact CB-CB 4.02Å; C232-C280 WeakPolarHBondContact CB-SG 3.19Å; C232-C280 PolarHBondContact N-SG 3.03Å; C232-C280 WeakPolarHBondContact SG-CB 3.18Å; C232-C280 CovalentContact SG-SG 2.03Å; C232-C280 PolarHBondContact SG-SG 3.24Å
281	V	95	Very high	92.3	Very high	49 Å²	49	52.6 Å²	52.6	30%	0.297	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-118.9	144.5	174.2	-62	0	0	0	0	111.9	L214 Y215 M216 G217 N279	L214-V281 HydrophobicContact CD1-CG2 3.61Å; Y215-V281 PolarHBondContact O-N 3.34Å; M216-V281 VanDerWaalsContact CA-O 3.31Å; M216-V281 WeakPolarHBondContact CA-O 3.35Å; M216-V281 HydrophobicContact CB-CG2 4.39Å; M216-V281 HydrophobicContact CG-CG2 4.49Å; G217-V281 PolarHBondContact N-O 2.77Å; N279-V281 PolarHBondContact O-N 3.48Å
282	S	93.8	Very high	92.5	Very high	46 Å²	46	53.9 Å²	53.9	32%	0.322	29%	0.29	S	S	.	.	S	Bend	trans	-91.9	-10.3	170.6	56.7	0	0	0	0	113.3	G217 E288 Y289	G217-S282 WeakPolarHBondContact O-CA 3.42Å; S282-E288 CarbonylContact O-C 3.54Å; S282-Y289 PolarHBondContact O-N 2.75Å
283	E	93.9	Very high	92.4	Very high	115 Å²	115	61 Å²	61	54%	0.537	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	138.2	-179.8	-167.5	-170.2	158.7	0	0	109.7	L287	E283-L287 CarbonylContact C-O 3.04Å; E283-L287 VanDerWaalsContact CA-O 3.28Å; E283-L287 WeakPolarHBondContact CA-O 3.34Å; E283-L287 WeakPolarHBondContact CG-O 3.46Å
284	Y	91.6	Very high	92.3	Very high	46 Å²	46	60.5 Å²	60.5	18%	0.18	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	131.1	174.9	-166	-104.6	0	0	0	111.2	L208 R212 L214 G286 L287	L208-Y284 HydrophobicContact CD2-CD1 3.88Å; R212-Y284 WeakPolarHBondContact CB-OH 3.29Å; R212-Y284 VanDerWaalsContact CD-OH 3.31Å; R212-Y284 WeakPolarHBondContact CD-OH 3.38Å; R212-Y284 VanDerWaalsContact CG-OH 3.24Å; R212-Y284 WeakPolarHBondContact CG-OH 3.35Å; R212-Y284 PolarHBondContact NH1-OH 3.4Å; L214-Y284 HydrophobicContact CD1-CD1 4.22Å; L214-Y284 HydrophobicContact CD1-CD2 3.58Å; L214-Y284 HydrophobicContact CD1-CE2 4.01Å; L214-Y284 HydrophobicContact CD1-CG 3.68Å; L214-Y284 HydrophobicContact CD2-CD1 3.82Å; L214-Y284 HydrophobicContact CD2-CE1 4.31Å; L214-Y284 HydrophobicContact CD2-CG 3.98Å; L214-Y284 HydrophobicContact CG-CG 4.49Å; Y284-G286 PolarHBondContact O-N 2.64Å; Y284-L287 PolarHBondContact N-O 2.78Å; Y284-L287 WeakPolarHBondContact O-CB 3.38Å; Y284-L287 PolarHBondContact O-N 3.03Å
285	E	87.4	Confident	92	Very high	107 Å²	107	57.6 Å²	57.6	50%	0.5	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	27.9	179.3	-65.8	-176	143.8	0	0	114.7	S209 R212	S209-E285 WeakPolarHBondContact CB-OE2 3.39Å; S209-E285 PolarHBondContact OG-OE2 2.83Å; R212-E285 IonicContact CZ-OE1 2.77Å; R212-E285 IonicContact NH1-OE1 2.67Å; R212-E285 PolarHBondContact NH1-OE1 2.85Å; R212-E285 IonicContact NH2-OE1 3.56Å
286	G	87.4	Confident	91.2	Very high	60 Å²	60	63 Å²	63	62%	0.619	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.3	4.9	-177.7	0	0	0	0	0	115	Y284	Y284-G286 PolarHBondContact O-N 2.64Å
287	L	91.1	Very high	90.2	Very high	47 Å²	47	70.8 Å²	70.8	25%	0.246	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	128.7	172.8	-57.8	168.9	0	0	0	109.5	L204 H207 L208 M216 E283 Y284	L204-L287 HydrophobicContact CD1-CB 3.8Å; L204-L287 HydrophobicContact CD1-CD1 4.19Å; L204-L287 HydrophobicContact CD1-CG 4.44Å; H207-L287 HydrophobicContact CB-CD1 3.76Å; H207-L287 HydrophobicContact CB-CD2 4.36Å; L208-L287 HydrophobicContact CD2-CD1 3.89Å; L208-L287 HydrophobicContact CG-CD1 4.1Å; M216-L287 WeakPolarHBondContact CE-O 3.25Å; E283-L287 CarbonylContact C-O 3.04Å; E283-L287 VanDerWaalsContact CA-O 3.28Å; E283-L287 WeakPolarHBondContact CA-O 3.34Å; E283-L287 WeakPolarHBondContact CG-O 3.46Å; Y284-L287 PolarHBondContact N-O 2.78Å; Y284-L287 WeakPolarHBondContact O-CB 3.38Å; Y284-L287 PolarHBondContact O-N 3.03Å
288	E	93.1	Very high	89.4	Confident	107 Å²	107	67.7 Å²	67.7	50%	0.5	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	134.6	-175.3	-159.6	-174.7	-161.5	0	0	111.4	S282 H290	S282-E288 CarbonylContact O-C 3.54Å; E288-H290 PolarHBondContact O-N 2.83Å; E288-H290 IonicContact OE2-CE1 2.68Å; E288-H290 PolarHBondContact OE2-CE1 2.74Å; E288-H290 IonicContact OE2-ND1 2.68Å; E288-H290 PolarHBondContact OE2-ND1 2.83Å
289	Y	94.1	Very high	88.7	Confident	3 Å²	3	68.9 Å²	68.9	1%	0.012	37%	0.365	C	S	.	.			trans	-80.3	80.9	177.2	-164.1	-88.8	0	0	0	110.6	Y188 L204 M216 F236 G237 S282 H291 L312	Y188-Y289 WeakPolarHBondContact CE2-OH 3.49Å; L204-Y289 HydrophobicContact CD2-CD2 4.19Å; M216-Y289 HydrophobicContact CG-CD2 4.14Å; F236-Y289 PolarHBondContact O-OH 3.46Å; G237-Y289 VanDerWaalsContact C-OH 3.26Å; G237-Y289 PolarHBondContact O-OH 3.15Å; G237-Y289 VanDerWaalsContact O-OH 3.11Å; S282-Y289 PolarHBondContact O-N 2.75Å; Y289-H291 HydrophobicContact CD1-CB 4.44Å; Y289-H291 HydrophobicContact CE1-CB 4.4Å; Y289-H291 PolarHBondContact O-N 3.31Å; Y289-H291 PolarHBondContact O-ND1 2.92Å; Y289-H291 VanDerWaalsContact O-ND1 3.17Å; Y289-L312 HydrophobicContact CD2-CD2 3.77Å; Y289-L312 HydrophobicContact CE1-CD2 4.49Å; Y289-L312 HydrophobicContact CE2-CD2 3.42Å; Y289-L312 VanDerWaalsContact CE2-CD2 3.42Å; Y289-L312 HydrophobicContact CG-CD2 4.45Å
290	H	94.3	Very high	88	Confident	68 Å²	68	66 Å²	66	32%	0.315	35%	0.35	S	S	.	.			trans	-67	115.3	179.6	-59.4	-38.9	0	0	0	111.6	E288 R310 L312	E288-H290 PolarHBondContact O-N 2.83Å; E288-H290 IonicContact OE2-CE1 2.68Å; E288-H290 PolarHBondContact OE2-CE1 2.74Å; E288-H290 IonicContact OE2-ND1 2.68Å; E288-H290 PolarHBondContact OE2-ND1 2.83Å; H290-R310 WeakPolarHBondContact CB-O 3.2Å; H290-R310 PolarHBondContact CD2-O 2.85Å; H290-R310 VanDerWaalsContact CD2-O 3.28Å; H290-L312 WeakPolarHBondContact O-CA 3.43Å; H290-L312 WeakPolarHBondContact O-CB 2.97Å; H290-L312 PolarHBondContact O-N 2.72Å
291	H	93.9	Very high	87.1	Confident	66 Å²	66	69.8 Å²	69.8	31%	0.306	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	159.3	174.6	60.6	-81.6	0	0	0	110.4	S218 F236 Y289	S218-H291 PolarHBondContact OG-NE2 3.09Å; F236-H291 HydrophobicContact CB-CB 4.05Å; F236-H291 HydrophobicContact CD1-CB 3.77Å; F236-H291 AromaticContact CD2-CD2 3.96Å; F236-H291 HydrophobicContact CE1-CB 4.42Å; F236-H291 HydrophobicContact CG-CB 3.9Å; Y289-H291 HydrophobicContact CD1-CB 4.44Å; Y289-H291 HydrophobicContact CE1-CB 4.4Å; Y289-H291 PolarHBondContact O-N 3.31Å; Y289-H291 PolarHBondContact O-ND1 2.92Å; Y289-H291 VanDerWaalsContact O-ND1 3.17Å
292	Y	94.4	Very high	86.4	Confident	31 Å²	31	74.8 Å²	74.8	12%	0.122	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	123	178.9	-168.8	-99.4	0	0	0	113.3	F236 L294 E303 N305 K307 F308 T313 V314 H315	F236-Y292 WeakPolarHBondContact CE1-O 3.49Å; Y292-L294 HydrophobicContact CE1-CD1 4.43Å; Y292-E303 HydrophobicContact CE1-CG 4.34Å; Y292-E303 PolarHBondContact OH-OE2 2.81Å; Y292-N305 HydrophobicContact CE2-CB 4.33Å; Y292-N305 WeakPolarHBondContact CE2-ND2 3.47Å; Y292-N305 PolarHBondContact OH-ND2 2.59Å; Y292-K307 HydrophobicContact CD2-CB 4.19Å; Y292-K307 HydrophobicContact CE2-CB 4.44Å; Y292-F308 HydrophobicContact CD1-CB 4.07Å; Y292-F308 AromaticContact CD1-CD2 3.41Å; Y292-F308 HydrophobicContact CD1-CD2 3.41Å; Y292-F308 VanDerWaalsContact CD1-CD2 3.41Å; Y292-F308 HydrophobicContact CD1-CE2 4.22Å; Y292-F308 HydrophobicContact CD1-CG 4.12Å; Y292-F308 HydrophobicContact CD2-CB 3.88Å; Y292-F308 HydrophobicContact CE1-CB 4Å; Y292-F308 AromaticContact CE1-CD2 3.76Å; Y292-F308 HydrophobicContact CE1-CD2 3.76Å; Y292-F308 HydrophobicContact CE1-CG 4.12Å; Y292-F308 HydrophobicContact CE2-CB 3.84Å; Y292-F308 HydrophobicContact CG-CB 3.99Å; Y292-F308 AromaticContact CG-CD2 3.86Å; Y292-F308 HydrophobicContact CG-CD2 3.86Å; Y292-F308 HydrophobicContact CG-CG 4.42Å; Y292-T313 PolarHBondContact N-O 3.5Å; Y292-V314 HydrophobicContact CD1-CG1 4.5Å; Y292-V314 WeakPolarHBondContact O-CA 3.25Å; Y292-H315 PolarHBondContact O-N 3.47Å
293	E	92.7	Very high	85.7	Confident	150 Å²	150	74.9 Å²	74.9	70%	0.701	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	120.3	173.5	-164.1	-173.4	168.4	0	0	110.9	F236 H315	F236-E293 HydrophobicContact CZ-CB 4.01Å; F236-E293 HydrophobicContact CZ-CG 4.32Å; E293-H315 CarbonylContact C-O 3.56Å; E293-H315 VanDerWaalsContact CA-O 3.25Å; E293-H315 WeakPolarHBondContact CA-O 3.32Å
294	L	89.3	Confident	85	Confident	5 Å²	5	76.8 Å²	76.8	3%	0.026	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-88.8	124.7	-176.6	-164.4	65.6	0	0	0	111.6	Y292 S298 V314 H315 Q322 L326	Y292-L294 HydrophobicContact CE1-CD1 4.43Å; L294-S298 WeakPolarHBondContact CD1-OG 3.36Å; L294-S298 WeakPolarHBondContact CG-OG 3.2Å; L294-V314 HydrophobicContact CB-CG1 3.85Å; L294-V314 HydrophobicContact CD1-CG1 4.08Å; L294-V314 HydrophobicContact CD2-CG1 4.08Å; L294-V314 HydrophobicContact CG-CG1 4.23Å; L294-H315 PolarHBondContact N-O 2.92Å; L294-Q322 HydrophobicContact CD2-CG 4.35Å; L294-L326 HydrophobicContact CD2-CD1 4.16Å
295	G	84.9	Confident	84.8	Confident	39 Å²	39	77.6 Å²	77.6	40%	0.402	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-65.7	138.6	176.6	0	0	0	0	0	112.1	N297 S298	G295-N297 PolarHBondContact O-N 2.99Å; G295-S298 PolarHBondContact N-OG 2.76Å; G295-S298 PolarHBondContact O-N 3.23Å; G295-S298 PolarHBondContact O-OG 2.96Å
296	K	74.1	Confident	84.9	Confident	189 Å²	189	77.3 Å²	77.3	82%	0.822	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-15	-174	-66.5	-177.7	178.1	178.2	0	116.6
297	N	70.4	Confident	84.9	Confident	169 Å²	169	81.9 Å²	81.9	90%	0.904	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.9	19.8	175.8	-70.9	-38.2	0	0	0	112.7	G295	G295-N297 PolarHBondContact O-N 2.99Å
298	S	74.8	Confident	84.9	Confident	29 Å²	29	79.7 Å²	79.7	20%	0.203	39%	0.389	C	S	.	.			trans	-77.9	133.9	178.3	52.8	0	0	0	0	111.5	L294 G295 P300	L294-S298 WeakPolarHBondContact CD1-OG 3.36Å; L294-S298 WeakPolarHBondContact CG-OG 3.2Å; G295-S298 PolarHBondContact N-OG 2.76Å; G295-S298 PolarHBondContact O-N 3.23Å; G295-S298 PolarHBondContact O-OG 2.96Å; S298-P300 WeakPolarHBondContact O-CD 3.25Å
299	D	78.1	Confident	84.8	Confident	47 Å²	47	77.5 Å²	77.5	25%	0.251	38%	0.378	S	S	.	.			trans	-89.6	114.3	173	178.2	-0.5	0	0	0	108.8	N301 K302 E303	D299-N301 PolarHBondContact O-N 3.11Å; D299-N301 PolarHBondContact OD1-N 3.11Å; D299-N301 PolarHBondContact OD1-ND2 3.44Å; D299-K302 HydrophobicContact CB-CB 4.36Å; D299-K302 HydrophobicContact CB-CD 4.24Å; D299-K302 HydrophobicContact CB-CG 4.28Å; D299-K302 PolarHBondContact O-N 3.41Å; D299-K302 WeakPolarHBondContact OD2-CE 3.39Å; D299-K302 IonicContact OD2-NZ 3.24Å; D299-K302 PolarHBondContact OD2-NZ 2.65Å; D299-E303 PolarHBondContact O-N 3.31Å
300	P	78.2	Confident	84.6	Confident	5 Å²	5	84.6 Å²	84.6	3%	0.032	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-51.2	-35.6	-177.4	-30.2	36.8	0	0	0	113.8	S298 K302 E303 F308 L326 Y329	S298-P300 WeakPolarHBondContact O-CD 3.25Å; P300-K302 PolarHBondContact O-N 3.29Å; P300-E303 PolarHBondContact O-N 2.93Å; P300-F308 HydrophobicContact CB-CZ 4.2Å; P300-L326 HydrophobicContact CB-CD2 3.87Å; P300-L326 HydrophobicContact CB-CG 4.42Å; P300-L326 HydrophobicContact CG-CD2 3.76Å; P300-L326 HydrophobicContact CG-CG 3.97Å; P300-Y329 WeakPolarHBondContact O-CE2 3.25Å
301	N	77.3	Confident	84.6	Confident	87 Å²	87	81.4 Å²	81.4	47%	0.465	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-71.6	-14.7	-177.3	-53	-69.3	0	0	0	113.6	D299	D299-N301 PolarHBondContact O-N 3.11Å; D299-N301 PolarHBondContact OD1-N 3.11Å; D299-N301 PolarHBondContact OD1-ND2 3.44Å
302	K	79.3	Confident	84.6	Confident	155 Å²	155	78.8 Å²	78.8	67%	0.674	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-105	-9.1	179.8	-64.5	-176.7	-177.7	114.9	0	112.8	D299 P300 Q304	D299-K302 HydrophobicContact CB-CB 4.36Å; D299-K302 HydrophobicContact CB-CD 4.24Å; D299-K302 HydrophobicContact CB-CG 4.28Å; D299-K302 PolarHBondContact O-N 3.41Å; D299-K302 WeakPolarHBondContact OD2-CE 3.39Å; D299-K302 IonicContact OD2-NZ 3.24Å; D299-K302 PolarHBondContact OD2-NZ 2.65Å; P300-K302 PolarHBondContact O-N 3.29Å; K302-Q304 PolarHBondContact O-N 2.81Å
303	E	80.2	Confident	84.6	Confident	47 Å²	47	77.3 Å²	77.3	22%	0.22	37%	0.372	C	S	.	.			trans	-75.5	113.3	179.8	-168.9	57.1	-96.7	0	0	109.5	Y292 D299 P300 N305 F308 Y329	Y292-E303 HydrophobicContact CE1-CG 4.34Å; Y292-E303 PolarHBondContact OH-OE2 2.81Å; D299-E303 PolarHBondContact O-N 3.31Å; P300-E303 PolarHBondContact O-N 2.93Å; E303-N305 HydrophobicContact CG-CB 4.29Å; E303-N305 WeakPolarHBondContact OE1-CB 3.18Å; E303-N305 PolarHBondContact OE1-N 2.85Å; E303-F308 HydrophobicContact CB-CD1 3.6Å; E303-F308 HydrophobicContact CB-CE1 3.74Å; E303-F308 HydrophobicContact CB-CG 4.33Å; E303-F308 HydrophobicContact CG-CB 3.87Å; E303-F308 HydrophobicContact CG-CD1 3.43Å; E303-F308 VanDerWaalsContact CG-CD1 3.43Å; E303-F308 HydrophobicContact CG-CD2 4.47Å; E303-F308 HydrophobicContact CG-CE1 4.02Å; E303-F308 HydrophobicContact CG-CG 3.68Å; E303-Y329 PolarHBondContact O-OH 2.84Å
304	Q	79.2	Confident	84.7	Confident	155 Å²	155	70.1 Å²	70.1	72%	0.724	34%	0.339	S	S	*	.			trans	-102.3	-0.3	-179.1	-66	-162.8	2	0	0	113.1	K302 E306 K309	K302-Q304 PolarHBondContact O-N 2.81Å; Q304-E306 PolarHBondContact O-N 3.41Å; Q304-K309 WeakPolarHBondContact O-CE 3.25Å; Q304-K309 PolarHBondContact O-NZ 2.98Å
305	N	87.6	Confident	85	Confident	64 Å²	64	70.4 Å²	70.4	34%	0.342	34%	0.34	S	S	.	.			trans	-59.2	125.4	-177.5	-167.6	-19.5	0	0	0	112	Y292 E303 K307 F308 K309	Y292-N305 HydrophobicContact CE2-CB 4.33Å; Y292-N305 WeakPolarHBondContact CE2-ND2 3.47Å; Y292-N305 PolarHBondContact OH-ND2 2.59Å; E303-N305 HydrophobicContact CG-CB 4.29Å; E303-N305 WeakPolarHBondContact OE1-CB 3.18Å; E303-N305 PolarHBondContact OE1-N 2.85Å; N305-K307 PolarHBondContact O-N 3.48Å; N305-K307 PolarHBondContact OD1-N 3.21Å; N305-K307 VanDerWaalsContact OD1-N 3.08Å; N305-F308 HydrophobicContact CB-CB 4.18Å; N305-F308 WeakPolarHBondContact O-CB 3.48Å; N305-F308 PolarHBondContact O-N 2.72Å; N305-K309 PolarHBondContact O-N 2.9Å; N305-K309 VanDerWaalsContact O-N 3.14Å
306	E	87.9	Confident	85.4	Confident	100 Å²	100	70.3 Å²	70.3	47%	0.467	33%	0.332	S	S	.	.	H	α-helix	trans	-61.2	-28.9	178.5	-69.4	-60.9	126.3	0	0	112.7	Q304 K309 R310	Q304-E306 PolarHBondContact O-N 3.41Å; E306-K309 IonicContact OE1-NZ 3.55Å; E306-K309 PolarHBondContact OE1-NZ 2.98Å; E306-R310 WeakPolarHBondContact O-CG 3.37Å; E306-R310 PolarHBondContact O-N 3.3Å
307	K	89	Confident	86.3	Confident	157 Å²	157	61.4 Å²	61.4	68%	0.683	29%	0.294	S	S	*	.	H	α-helix	trans	-65.8	-39	173.1	-68.3	-166.3	173	-163.8	0	112.3	Y292 N305 R310 A311	Y292-K307 HydrophobicContact CD2-CB 4.19Å; Y292-K307 HydrophobicContact CE2-CB 4.44Å; N305-K307 PolarHBondContact O-N 3.48Å; N305-K307 PolarHBondContact OD1-N 3.21Å; N305-K307 VanDerWaalsContact OD1-N 3.08Å; K307-R310 PolarHBondContact O-N 2.88Å; K307-A311 PolarHBondContact O-N 3.1Å; K307-A311 VanDerWaalsContact O-N 3.11Å
308	F	91.1	Very high	87.3	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-65.9	-47.2	176.4	176.4	-119.6	0	0	0	110.9	Y292 P300 E303 N305 R310 A311 V314 L326 Y329 F330	Y292-F308 HydrophobicContact CD1-CB 4.07Å; Y292-F308 AromaticContact CD1-CD2 3.41Å; Y292-F308 HydrophobicContact CD1-CD2 3.41Å; Y292-F308 VanDerWaalsContact CD1-CD2 3.41Å; Y292-F308 HydrophobicContact CD1-CE2 4.22Å; Y292-F308 HydrophobicContact CD1-CG 4.12Å; Y292-F308 HydrophobicContact CD2-CB 3.88Å; Y292-F308 HydrophobicContact CE1-CB 4Å; Y292-F308 AromaticContact CE1-CD2 3.76Å; Y292-F308 HydrophobicContact CE1-CD2 3.76Å; Y292-F308 HydrophobicContact CE1-CG 4.12Å; Y292-F308 HydrophobicContact CE2-CB 3.84Å; Y292-F308 HydrophobicContact CG-CB 3.99Å; Y292-F308 AromaticContact CG-CD2 3.86Å; Y292-F308 HydrophobicContact CG-CD2 3.86Å; Y292-F308 HydrophobicContact CG-CG 4.42Å; P300-F308 HydrophobicContact CB-CZ 4.2Å; E303-F308 HydrophobicContact CB-CD1 3.6Å; E303-F308 HydrophobicContact CB-CE1 3.74Å; E303-F308 HydrophobicContact CB-CG 4.33Å; E303-F308 HydrophobicContact CG-CB 3.87Å; E303-F308 HydrophobicContact CG-CD1 3.43Å; E303-F308 VanDerWaalsContact CG-CD1 3.43Å; E303-F308 HydrophobicContact CG-CD2 4.47Å; E303-F308 HydrophobicContact CG-CE1 4.02Å; E303-F308 HydrophobicContact CG-CG 3.68Å; N305-F308 HydrophobicContact CB-CB 4.18Å; N305-F308 WeakPolarHBondContact O-CB 3.48Å; N305-F308 PolarHBondContact O-N 2.72Å; F308-R310 PolarHBondContact O-N 3.46Å; F308-A311 VanDerWaalsContact O-CB 3.25Å; F308-A311 WeakPolarHBondContact O-CB 3.41Å; F308-A311 PolarHBondContact O-N 3.02Å; F308-V314 HydrophobicContact CD2-CG2 4.2Å; F308-V314 HydrophobicContact CE2-CG1 4.15Å; F308-V314 HydrophobicContact CE2-CG2 3.9Å; F308-L326 HydrophobicContact CE2-CD2 3.87Å; F308-L326 HydrophobicContact CZ-CD2 3.72Å; F308-Y329 AromaticContact CD1-CE1 3.92Å; F308-Y329 HydrophobicContact CD1-CE1 3.92Å; F308-Y329 AromaticContact CE1-CD1 3.83Å; F308-Y329 HydrophobicContact CE1-CD1 3.83Å; F308-Y329 AromaticContact CE1-CE1 3.29Å; F308-Y329 HydrophobicContact CE1-CE1 3.29Å; F308-Y329 AromaticContact CE1-CZ 3.86Å; F308-Y329 HydrophobicContact CZ-CD1 4.2Å; F308-Y329 HydrophobicContact CZ-CE1 4.09Å; F308-F330 HydrophobicContact CD2-CE2 4.5Å; F308-F330 HydrophobicContact CD2-CZ 4.08Å; F308-F330 AromaticContact CE2-CE2 3.76Å; F308-F330 HydrophobicContact CE2-CE2 3.76Å; F308-F330 AromaticContact CE2-CZ 3.79Å; F308-F330 HydrophobicContact CE2-CZ 3.79Å; F308-F330 AromaticContact CZ-CE2 3.81Å; F308-F330 HydrophobicContact CZ-CE2 3.81Å; F308-F330 HydrophobicContact CZ-CZ 4.07Å; F308-F330 WeakPolarHBondContact O-CE1 3.14Å; F308-F330 WeakPolarHBondContact O-CZ 3.11Å
309	K	89.9	Confident	88.1	Confident	62 Å²	62	59.2 Å²	59.2	27%	0.27	29%	0.286	S	S	.	.	H	α-helix	trans	-58.5	-32.3	178	-63.6	178	-166.6	164.6	0	113.1	R200 Q304 N305 E306 I333	R200-K309 VanDerWaalsContact CZ-O 3.27Å; R200-K309 PolarHBondContact NH1-O 2.59Å; R200-K309 PolarHBondContact NH2-O 2.85Å; Q304-K309 WeakPolarHBondContact O-CE 3.25Å; Q304-K309 PolarHBondContact O-NZ 2.98Å; N305-K309 PolarHBondContact O-N 2.9Å; N305-K309 VanDerWaalsContact O-N 3.14Å; E306-K309 IonicContact OE1-NZ 3.55Å; E306-K309 PolarHBondContact OE1-NZ 2.98Å; K309-I333 HydrophobicContact CB-CD1 4.4Å; K309-I333 HydrophobicContact CG-CD1 4.14Å
310	R	90.7	Very high	88.9	Confident	152 Å²	152	58.9 Å²	58.9	57%	0.574	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-1.6	178.2	-64.2	-177.4	-169.3	-164.2	1.2	114.5	R200 H290 E306 K307 F308 L312	R200-R310 PolarHBondContact NH1-O 3.42Å; H290-R310 WeakPolarHBondContact CB-O 3.2Å; H290-R310 PolarHBondContact CD2-O 2.85Å; H290-R310 VanDerWaalsContact CD2-O 3.28Å; E306-R310 WeakPolarHBondContact O-CG 3.37Å; E306-R310 PolarHBondContact O-N 3.3Å; K307-R310 PolarHBondContact O-N 2.88Å; F308-R310 PolarHBondContact O-N 3.46Å; R310-L312 PolarHBondContact O-N 3.03Å
311	A	93.3	Very high	89.6	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.31	C	S	.	.			trans	-63.2	134.1	-177.1	0	0	0	0	0	112.2	R200 K307 F308 V314 F330	R200-A311 PolarHBondContact NH1-O 2.97Å; K307-A311 PolarHBondContact O-N 3.1Å; K307-A311 VanDerWaalsContact O-N 3.11Å; F308-A311 VanDerWaalsContact O-CB 3.25Å; F308-A311 WeakPolarHBondContact O-CB 3.41Å; F308-A311 PolarHBondContact O-N 3.02Å; A311-V314 HydrophobicContact CB-CG2 4.08Å; A311-F330 HydrophobicContact CB-CZ 4.37Å
312	L	93.5	Very high	90.3	Very high	11 Å²	11	60.9 Å²	60.9	6%	0.058	29%	0.293	C	S	.	.	S	Bend	trans	-74.2	-42.7	166.2	-165.5	68.4	0	0	0	109.9	E197 R200 I201 L204 Y289 H290 R310	E197-L312 PolarHBondContact N-O 3.06Å; R200-L312 VanDerWaalsContact C-CD1 3.44Å; R200-L312 HydrophobicContact CB-CD1 3.51Å; I201-L312 HydrophobicContact CB-CD1 4.31Å; I201-L312 HydrophobicContact CD1-CD2 4.35Å; I201-L312 HydrophobicContact CD1-CG 4.18Å; I201-L312 HydrophobicContact CG1-CD1 3.47Å; I201-L312 VanDerWaalsContact CG1-CD1 3.47Å; I201-L312 HydrophobicContact CG1-CD2 3.88Å; I201-L312 HydrophobicContact CG1-CG 3.52Å; L204-L312 HydrophobicContact CD2-CD2 3.77Å; Y289-L312 HydrophobicContact CD2-CD2 3.77Å; Y289-L312 HydrophobicContact CE1-CD2 4.49Å; Y289-L312 HydrophobicContact CE2-CD2 3.42Å; Y289-L312 VanDerWaalsContact CE2-CD2 3.42Å; Y289-L312 HydrophobicContact CG-CD2 4.45Å; H290-L312 WeakPolarHBondContact O-CA 3.43Å; H290-L312 WeakPolarHBondContact O-CB 2.97Å; H290-L312 PolarHBondContact O-N 2.72Å; R310-L312 PolarHBondContact O-N 3.03Å
313	T	95.3	Very high	91	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	147	-175.3	64	0	0	0	0	111.9	Y188 Y195 I201 F236 Y292	Y188-T313 WeakPolarHBondContact OH-CG2 3.42Å; Y195-T313 CarbonylContact O-C 3.58Å; Y195-T313 VanDerWaalsContact O-CA 3.25Å; Y195-T313 WeakPolarHBondContact O-CA 3.07Å; I201-T313 HydrophobicContact CD1-CG2 4.5Å; F236-T313 WeakPolarHBondContact O-CB 3.41Å; F236-T313 VanDerWaalsContact O-CG2 3.32Å; F236-T313 WeakPolarHBondContact O-CG2 3.28Å; F236-T313 PolarHBondContact O-OG1 3.38Å; Y292-T313 PolarHBondContact N-O 3.5Å
314	V	95.1	Very high	91.6	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	123.6	-178.2	-177.8	0	0	0	0	109.1	Y195 Y292 L294 F308 A311 L326 F330	Y195-V314 HydrophobicContact CD1-CG2 4.42Å; Y195-V314 PolarHBondContact N-O 3.1Å; Y195-V314 PolarHBondContact O-N 2.91Å; Y292-V314 HydrophobicContact CD1-CG1 4.5Å; Y292-V314 WeakPolarHBondContact O-CA 3.25Å; L294-V314 HydrophobicContact CB-CG1 3.85Å; L294-V314 HydrophobicContact CD1-CG1 4.08Å; L294-V314 HydrophobicContact CD2-CG1 4.08Å; L294-V314 HydrophobicContact CG-CG1 4.23Å; F308-V314 HydrophobicContact CD2-CG2 4.2Å; F308-V314 HydrophobicContact CE2-CG1 4.15Å; F308-V314 HydrophobicContact CE2-CG2 3.9Å; A311-V314 HydrophobicContact CB-CG2 4.08Å; V314-L326 HydrophobicContact CG1-CD1 4.38Å; V314-L326 HydrophobicContact CG1-CD2 4.25Å; V314-F330 HydrophobicContact CG2-CE2 3.9Å; V314-F330 HydrophobicContact CG2-CZ 3.85Å
315	H	94.6	Very high	92.3	Very high	10 Å²	10	53.1 Å²	53.1	5%	0.046	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	147.3	-176.1	177.4	-85.7	0	0	0	110	D193 A194 Y233 G235 F236 Y292 E293 L294	D193-H315 PolarHBondContact O-CD2 3.27Å; D193-H315 VanDerWaalsContact O-CD2 3.29Å; D193-H315 IonicContact OD1-CD2 2.77Å; D193-H315 IonicContact OD1-NE2 3.7Å; D193-H315 PolarHBondContact OD1-NE2 3.4Å; D193-H315 IonicContact OD2-CD2 3.18Å; D193-H315 IonicContact OD2-CE1 2.71Å; D193-H315 IonicContact OD2-NE2 3.38Å; D193-H315 PolarHBondContact OD2-NE2 2.88Å; A194-H315 HydrophobicContact CB-CB 4.36Å; Y233-H315 AromaticContact CE1-CE1 3.86Å; Y233-H315 AromaticContact CE1-ND1 3.84Å; G235-H315 VanDerWaalsContact O-CB 3.22Å; G235-H315 WeakPolarHBondContact O-CB 3.44Å; G235-H315 PolarHBondContact O-CD2 3.16Å; G235-H315 VanDerWaalsContact O-CG 3.27Å; F236-H315 HydrophobicContact CD1-CB 3.74Å; F236-H315 HydrophobicContact CE1-CB 3.68Å; F236-H315 HydrophobicContact CZ-CB 4.47Å; Y292-H315 PolarHBondContact O-N 3.47Å; E293-H315 CarbonylContact C-O 3.56Å; E293-H315 VanDerWaalsContact CA-O 3.25Å; E293-H315 WeakPolarHBondContact CA-O 3.32Å; L294-H315 PolarHBondContact N-O 2.92Å
316	P	94.4	Very high	92.6	Very high	37 Å²	37	50.1 Å²	50.1	24%	0.24	24%	0.235	C	C	.	.			cis	-85.8	143.3	-5.5	32.7	-33.8	0	0	0	113
317	V	93.3	Very high	92.9	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.012	22%	0.221	C	C	.	.			trans	-99.9	115.1	169.4	-175.3	0	0	0	0	108.5	D193 D319 Q322 M323 L326	D193-V317 WeakPolarHBondContact O-CB 3.48Å; D193-V317 PolarHBondContact O-N 2.71Å; V317-D319 WeakPolarHBondContact CG1-O 3.37Å; V317-Q322 HydrophobicContact CG1-CB 4.06Å; V317-Q322 HydrophobicContact CG1-CG 4.14Å; V317-M323 HydrophobicContact CB-CE 3.97Å; V317-M323 HydrophobicContact CG1-CB 4.01Å; V317-M323 HydrophobicContact CG1-CE 3.86Å; V317-M323 HydrophobicContact CG1-SD 4.2Å; V317-M323 HydrophobicContact CG2-CE 4.22Å; V317-M323 HydrophobicContact CG2-SD 4.28Å; V317-L326 HydrophobicContact CG1-CD1 4.46Å; V317-L326 HydrophobicContact CG2-CD1 3.7Å
318	S	90.4	Very high	93.1	Very high	88 Å²	88	48 Å²	48	62%	0.615	22%	0.22	S	C	*	.			trans	-83.6	-24.7	-171.4	-63	0	0	0	0	113.7
319	D	92.1	Very high	93.2	Very high	64 Å²	64	49.5 Å²	49.5	34%	0.342	23%	0.226	S	C	.	.	S	Bend	trans	-149.3	156.8	-173.8	72.5	82.8	0	0	0	113.4	V317 E321 Q322 M323	V317-D319 WeakPolarHBondContact CG1-O 3.37Å; D319-E321 VanDerWaalsContact C-N 3.28Å; D319-E321 PolarHBondContact O-N 2.77Å; D319-E321 VanDerWaalsContact OD1-CA 3.29Å; D319-E321 WeakPolarHBondContact OD1-CA 3.16Å; D319-E321 VanDerWaalsContact OD1-CB 3.22Å; D319-E321 WeakPolarHBondContact OD1-CB 3.47Å; D319-E321 PolarHBondContact OD1-N 2.67Å; D319-Q322 PolarHBondContact O-N 2.84Å; D319-Q322 PolarHBondContact OD1-N 2.85Å; D319-Q322 WeakPolarHBondContact OD2-CB 3.37Å; D319-M323 PolarHBondContact O-N 2.83Å
320	P	94	Very high	93.3	Very high	40 Å²	40	46.6 Å²	46.6	26%	0.26	21%	0.214	S	C	.	.	H	α-helix	trans	-62.3	-27.4	179.4	-26.4	36.6	0	0	0	115	L125 A128 M323 Y324	L125-P320 HydrophobicContact CD2-CG 4.22Å; A128-P320 HydrophobicContact CB-CB 4.08Å; P320-M323 WeakPolarHBondContact O-CB 3.42Å; P320-M323 PolarHBondContact O-N 3.01Å; P320-Y324 HydrophobicContact CB-CE2 4.4Å; P320-Y324 WeakPolarHBondContact O-CD2 3.39Å; P320-Y324 WeakPolarHBondContact O-CE2 3.49Å; P320-Y324 PolarHBondContact O-N 3.46Å
321	E	93.2	Very high	93.4	Very high	113 Å²	113	41.5 Å²	41.5	53%	0.528	20%	0.201	S	C	.	.	H	α-helix	trans	-73.3	-40.6	-180	-159.2	-168.6	152.3	0	0	110.5	D319 M323 Y324 R325	D319-E321 VanDerWaalsContact C-N 3.28Å; D319-E321 PolarHBondContact O-N 2.77Å; D319-E321 VanDerWaalsContact OD1-CA 3.29Å; D319-E321 WeakPolarHBondContact OD1-CA 3.16Å; D319-E321 VanDerWaalsContact OD1-CB 3.22Å; D319-E321 WeakPolarHBondContact OD1-CB 3.47Å; D319-E321 PolarHBondContact OD1-N 2.67Å; E321-M323 VanDerWaalsContact C-N 3.29Å; E321-M323 PolarHBondContact O-N 2.94Å; E321-Y324 PolarHBondContact O-N 2.84Å; E321-R325 WeakPolarHBondContact O-CB 3.43Å; E321-R325 VanDerWaalsContact O-CG 3.23Å; E321-R325 WeakPolarHBondContact O-CG 3.3Å; E321-R325 PolarHBondContact O-N 2.85Å; E321-R325 IonicContact OE1-CZ 2.83Å; E321-R325 IonicContact OE1-NE 2.85Å; E321-R325 PolarHBondContact OE1-NE 2.83Å; E321-R325 IonicContact OE1-NH2 3.07Å; E321-R325 PolarHBondContact OE1-NH2 3.25Å; E321-R325 IonicContact OE2-NH2 3.97Å
322	Q	91.4	Very high	93.4	Very high	21 Å²	21	46.9 Å²	46.9	10%	0.098	23%	0.226	C	C	.	.	H	α-helix	trans	-58	-40.6	170.3	-171.8	177.4	48.4	0	0	111.4	L294 V317 D319 R325 L326	L294-Q322 HydrophobicContact CD2-CG 4.35Å; V317-Q322 HydrophobicContact CG1-CB 4.06Å; V317-Q322 HydrophobicContact CG1-CG 4.14Å; D319-Q322 PolarHBondContact O-N 2.84Å; D319-Q322 PolarHBondContact OD1-N 2.85Å; D319-Q322 WeakPolarHBondContact OD2-CB 3.37Å; Q322-R325 PolarHBondContact O-N 2.93Å; Q322-L326 HydrophobicContact CG-CD1 4.22Å; Q322-L326 WeakPolarHBondContact O-CB 3.5Å; Q322-L326 WeakPolarHBondContact O-CG 3.35Å; Q322-L326 PolarHBondContact O-N 3.47Å
323	M	93.9	Very high	93.2	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-58.3	-49.3	174.2	-166.3	73	76.3	0	0	112.1	L125 A128 V129 Y195 V317 D319 P320 E321 L326 H327	L125-M323 HydrophobicContact CD2-CE 4.33Å; A128-M323 HydrophobicContact CB-CB 4.07Å; A128-M323 HydrophobicContact CB-CG 3.93Å; V129-M323 HydrophobicContact CG2-CE 3.7Å; V129-M323 HydrophobicContact CG2-SD 4.45Å; Y195-M323 VanDerWaalsContact CA-SD 3.58Å; Y195-M323 HydrophobicContact CD2-CG 4.49Å; Y195-M323 HydrophobicContact CD2-SD 3.8Å; Y195-M323 HydrophobicContact CG-SD 4.27Å; V317-M323 HydrophobicContact CB-CE 3.97Å; V317-M323 HydrophobicContact CG1-CB 4.01Å; V317-M323 HydrophobicContact CG1-CE 3.86Å; V317-M323 HydrophobicContact CG1-SD 4.2Å; V317-M323 HydrophobicContact CG2-CE 4.22Å; V317-M323 HydrophobicContact CG2-SD 4.28Å; D319-M323 PolarHBondContact O-N 2.83Å; P320-M323 WeakPolarHBondContact O-CB 3.42Å; P320-M323 PolarHBondContact O-N 3.01Å; E321-M323 VanDerWaalsContact C-N 3.29Å; E321-M323 PolarHBondContact O-N 2.94Å; M323-L326 PolarHBondContact O-N 2.81Å; M323-H327 PolarHBondContact O-N 3.08Å
324	Y	94.6	Very high	93.1	Very high	78 Å²	78	49.4 Å²	49.4	31%	0.306	24%	0.239	S	C	.	.	H	α-helix	trans	-69.8	-32.7	178.1	-62	-59.6	0	0	0	113.3	A128 R131 T132 P320 E321 H327 R328	A128-Y324 HydrophobicContact CB-CE1 4.25Å; A128-Y324 HydrophobicContact CB-CE2 4.19Å; R131-Y324 HydrophobicContact CB-CE1 4.1Å; R131-Y324 VanDerWaalsContact CD-OH 3.31Å; R131-Y324 WeakPolarHBondContact CD-OH 3.46Å; T132-Y324 HydrophobicContact CG2-CD1 4.17Å; T132-Y324 HydrophobicContact CG2-CE1 4.43Å; P320-Y324 HydrophobicContact CB-CE2 4.4Å; P320-Y324 WeakPolarHBondContact O-CD2 3.39Å; P320-Y324 WeakPolarHBondContact O-CE2 3.49Å; P320-Y324 PolarHBondContact O-N 3.46Å; E321-Y324 PolarHBondContact O-N 2.84Å; Y324-H327 PolarHBondContact O-N 2.91Å; Y324-R328 WeakPolarHBondContact O-CB 3.41Å; Y324-R328 PolarHBondContact O-N 2.92Å
325	R	93.1	Very high	93	Very high	116 Å²	116	53.7 Å²	53.7	44%	0.438	26%	0.261	S	S	.	.	H	α-helix	trans	-66.2	-42.1	174.4	-72.8	169.2	178.8	-157.5	6.7	111.4	E321 Q322 Y329	E321-R325 WeakPolarHBondContact O-CB 3.43Å; E321-R325 VanDerWaalsContact O-CG 3.23Å; E321-R325 WeakPolarHBondContact O-CG 3.3Å; E321-R325 PolarHBondContact O-N 2.85Å; E321-R325 IonicContact OE1-CZ 2.83Å; E321-R325 IonicContact OE1-NE 2.85Å; E321-R325 PolarHBondContact OE1-NE 2.83Å; E321-R325 IonicContact OE1-NH2 3.07Å; E321-R325 PolarHBondContact OE1-NH2 3.25Å; E321-R325 IonicContact OE2-NH2 3.97Å; Q322-R325 PolarHBondContact O-N 2.93Å; R325-Y329 WeakPolarHBondContact O-CB 3.12Å; R325-Y329 PolarHBondContact O-N 3.29Å; R325-Y329 VanDerWaalsContact O-N 3.14Å
326	L	93.1	Very high	92.9	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-59.8	-51.7	171.2	-75.7	163.2	0	0	0	110.2	Y195 L294 P300 F308 V314 V317 Q322 M323 R328 Y329 F330	Y195-L326 HydrophobicContact CD1-CB 4.2Å; Y195-L326 HydrophobicContact CD2-CB 4.09Å; Y195-L326 HydrophobicContact CG-CB 3.9Å; Y195-L326 HydrophobicContact CG-CD1 4.34Å; L294-L326 HydrophobicContact CD2-CD1 4.16Å; P300-L326 HydrophobicContact CB-CD2 3.87Å; P300-L326 HydrophobicContact CB-CG 4.42Å; P300-L326 HydrophobicContact CG-CD2 3.76Å; P300-L326 HydrophobicContact CG-CG 3.97Å; F308-L326 HydrophobicContact CE2-CD2 3.87Å; F308-L326 HydrophobicContact CZ-CD2 3.72Å; V314-L326 HydrophobicContact CG1-CD1 4.38Å; V314-L326 HydrophobicContact CG1-CD2 4.25Å; V317-L326 HydrophobicContact CG1-CD1 4.46Å; V317-L326 HydrophobicContact CG2-CD1 3.7Å; Q322-L326 HydrophobicContact CG-CD1 4.22Å; Q322-L326 WeakPolarHBondContact O-CB 3.5Å; Q322-L326 WeakPolarHBondContact O-CG 3.35Å; Q322-L326 PolarHBondContact O-N 3.47Å; M323-L326 PolarHBondContact O-N 2.81Å; L326-R328 PolarHBondContact O-N 2.91Å; L326-Y329 PolarHBondContact O-N 2.91Å; L326-Y329 VanDerWaalsContact O-N 3.07Å; L326-F330 HydrophobicContact CD2-CE2 4.12Å; L326-F330 WeakPolarHBondContact O-CD2 3.44Å; L326-F330 PolarHBondContact O-N 2.89Å
327	H	94.4	Very high	92.7	Very high	38 Å²	38	61.4 Å²	61.4	18%	0.176	29%	0.293	C	S	.	.	H	α-helix	trans	-54.4	-51.7	179.6	-173.2	56.2	0	0	0	112.4	T132 Y195 M323 Y324 Y329 F330 S331	T132-H327 HydrophobicContact CG2-CB 3.66Å; Y195-H327 HydrophobicContact CE2-CB 3.63Å; Y195-H327 AromaticContact CE2-ND1 3.88Å; Y195-H327 PolarHBondContact OH-ND1 3.36Å; M323-H327 PolarHBondContact O-N 3.08Å; Y324-H327 PolarHBondContact O-N 2.91Å; H327-Y329 VanDerWaalsContact C-N 3.3Å; H327-Y329 PolarHBondContact O-N 2.9Å; H327-F330 PolarHBondContact O-N 3.08Å; H327-S331 WeakPolarHBondContact O-CB 3.16Å; H327-S331 PolarHBondContact O-N 3.47Å; H327-S331 PolarHBondContact O-OG 3.17Å
328	R	93.7	Very high	92.7	Very high	174 Å²	174	64.4 Å²	64.4	66%	0.657	31%	0.311	S	S	*	.	H	α-helix	trans	-53.7	-46.4	175.4	175.6	-177.2	163.7	171	-1.4	112.3	Y324 L326 S331 E332	Y324-R328 WeakPolarHBondContact O-CB 3.41Å; Y324-R328 PolarHBondContact O-N 2.92Å; L326-R328 PolarHBondContact O-N 2.91Å; R328-S331 PolarHBondContact O-N 3.02Å; R328-E332 WeakPolarHBondContact O-CB 3.49Å; R328-E332 PolarHBondContact O-N 2.81Å
329	Y	92.5	Very high	92.8	Very high	32 Å²	32	67.4 Å²	67.4	13%	0.125	31%	0.31	C	S	.	.	H	α-helix	trans	-65.5	-44.8	-177.6	176.4	-89.8	0	0	0	112.1	P300 E303 F308 R325 L326 H327 E332 I333	P300-Y329 WeakPolarHBondContact O-CE2 3.25Å; E303-Y329 PolarHBondContact O-OH 2.84Å; F308-Y329 AromaticContact CD1-CE1 3.92Å; F308-Y329 HydrophobicContact CD1-CE1 3.92Å; F308-Y329 AromaticContact CE1-CD1 3.83Å; F308-Y329 HydrophobicContact CE1-CD1 3.83Å; F308-Y329 AromaticContact CE1-CE1 3.29Å; F308-Y329 HydrophobicContact CE1-CE1 3.29Å; F308-Y329 AromaticContact CE1-CZ 3.86Å; F308-Y329 HydrophobicContact CZ-CD1 4.2Å; F308-Y329 HydrophobicContact CZ-CE1 4.09Å; R325-Y329 WeakPolarHBondContact O-CB 3.12Å; R325-Y329 PolarHBondContact O-N 3.29Å; R325-Y329 VanDerWaalsContact O-N 3.14Å; L326-Y329 PolarHBondContact O-N 2.91Å; L326-Y329 VanDerWaalsContact O-N 3.07Å; H327-Y329 VanDerWaalsContact C-N 3.3Å; H327-Y329 PolarHBondContact O-N 2.9Å; Y329-E332 PolarHBondContact O-N 2.97Å; Y329-I333 HydrophobicContact CD1-CD1 3.9Å; Y329-I333 HydrophobicContact CE1-CD1 3.27Å; Y329-I333 HydrophobicContact CE1-CG1 4.34Å; Y329-I333 PolarHBondContact O-N 2.84Å; Y329-I333 VanDerWaalsContact O-N 3.1Å
330	F	92.8	Very high	92.9	Very high	1 Å²	1	69 Å²	69	0%	0.004	32%	0.319	C	S	.	.	H	α-helix	trans	-67	-39.9	175.7	-81.4	-82.1	0	0	0	112	Y195 E197 F308 A311 V314 L326 H327 E332 I333 E334	Y195-F330 AromaticContact CD1-CD2 3.97Å; Y195-F330 HydrophobicContact CD1-CD2 3.97Å; Y195-F330 HydrophobicContact CD1-CE2 4.12Å; Y195-F330 HydrophobicContact CE1-CB 4.13Å; Y195-F330 AromaticContact CE1-CD2 3.44Å; Y195-F330 HydrophobicContact CE1-CD2 3.44Å; Y195-F330 VanDerWaalsContact CE1-CD2 3.44Å; Y195-F330 HydrophobicContact CE1-CE2 4.01Å; Y195-F330 AromaticContact CE1-CG 3.84Å; Y195-F330 HydrophobicContact CE1-CG 3.84Å; E197-F330 HydrophobicContact CG-CB 4.25Å; E197-F330 HydrophobicContact CG-CD1 4.45Å; F308-F330 HydrophobicContact CD2-CE2 4.5Å; F308-F330 HydrophobicContact CD2-CZ 4.08Å; F308-F330 AromaticContact CE2-CE2 3.76Å; F308-F330 HydrophobicContact CE2-CE2 3.76Å; F308-F330 AromaticContact CE2-CZ 3.79Å; F308-F330 HydrophobicContact CE2-CZ 3.79Å; F308-F330 AromaticContact CZ-CE2 3.81Å; F308-F330 HydrophobicContact CZ-CE2 3.81Å; F308-F330 HydrophobicContact CZ-CZ 4.07Å; F308-F330 WeakPolarHBondContact O-CE1 3.14Å; F308-F330 WeakPolarHBondContact O-CZ 3.11Å; A311-F330 HydrophobicContact CB-CZ 4.37Å; V314-F330 HydrophobicContact CG2-CE2 3.9Å; V314-F330 HydrophobicContact CG2-CZ 3.85Å; L326-F330 HydrophobicContact CD2-CE2 4.12Å; L326-F330 WeakPolarHBondContact O-CD2 3.44Å; L326-F330 PolarHBondContact O-N 2.89Å; H327-F330 PolarHBondContact O-N 3.08Å; F330-E332 VanDerWaalsContact C-N 3.31Å; F330-E332 PolarHBondContact O-N 2.9Å; F330-I333 PolarHBondContact O-N 2.87Å; F330-E334 PolarHBondContact O-N 3.4Å
331	S	92.8	Very high	93	Very high	45 Å²	45	72 Å²	72	32%	0.315	33%	0.33	S	S	.	.	H	α-helix	trans	-61.1	-37.9	172.9	-57.3	0	0	0	0	112.5	H327 R328 L335	H327-S331 WeakPolarHBondContact O-CB 3.16Å; H327-S331 PolarHBondContact O-N 3.47Å; H327-S331 PolarHBondContact O-OG 3.17Å; R328-S331 PolarHBondContact O-N 3.02Å; S331-L335 WeakPolarHBondContact O-CB 3.25Å; S331-L335 PolarHBondContact O-N 3.36Å
332	E	92.3	Very high	92.9	Very high	113 Å²	113	70.1 Å²	70.1	53%	0.528	32%	0.322	S	S	.	.	H	α-helix	trans	-66.1	-38.2	175.8	-169.9	168.9	169.9	0	0	111.6	R328 Y329 F330 Q336	R328-E332 WeakPolarHBondContact O-CB 3.49Å; R328-E332 PolarHBondContact O-N 2.81Å; Y329-E332 PolarHBondContact O-N 2.97Å; F330-E332 VanDerWaalsContact C-N 3.31Å; F330-E332 PolarHBondContact O-N 2.9Å; E332-Q336 WeakPolarHBondContact O-CB 3.31Å; E332-Q336 PolarHBondContact O-N 2.82Å
333	I	91	Very high	92.9	Very high	38 Å²	38	71.7 Å²	71.7	20%	0.195	34%	0.338	C	S	.	.	H	α-helix	trans	-65.6	-50.4	173.2	-71.2	175.7	0	0	0	111.8	K309 Y329 F330 L335 Q336 K337	K309-I333 HydrophobicContact CB-CD1 4.4Å; K309-I333 HydrophobicContact CG-CD1 4.14Å; Y329-I333 HydrophobicContact CD1-CD1 3.9Å; Y329-I333 HydrophobicContact CE1-CD1 3.27Å; Y329-I333 HydrophobicContact CE1-CG1 4.34Å; Y329-I333 PolarHBondContact O-N 2.84Å; Y329-I333 VanDerWaalsContact O-N 3.1Å; F330-I333 PolarHBondContact O-N 2.87Å; I333-L335 VanDerWaalsContact C-N 3.33Å; I333-L335 PolarHBondContact O-N 2.81Å; I333-Q336 PolarHBondContact O-N 2.77Å; I333-K337 WeakPolarHBondContact O-CB 3.45Å; I333-K337 PolarHBondContact O-N 2.84Å
334	E	91.3	Very high	92.9	Very high	27 Å²	27	77.5 Å²	77.5	13%	0.126	36%	0.364	C	S	.	.	H	α-helix	trans	-66.1	-36.4	-179.5	-71.7	-54.6	135.4	0	0	111.7	R200 F330 K337 T338	R200-E334 IonicContact CZ-OE1 3.09Å; R200-E334 IonicContact NE-OE1 2.66Å; R200-E334 PolarHBondContact NE-OE1 3.37Å; R200-E334 IonicContact NH2-OE1 3.97Å; R200-E334 PolarHBondContact NH2-OE1 3.05Å; F330-E334 PolarHBondContact O-N 3.4Å; E334-K337 PolarHBondContact O-N 3.03Å; E334-K337 WeakPolarHBondContact OE2-CD 3.41Å; E334-K337 IonicContact OE2-NZ 3.63Å; E334-K337 PolarHBondContact OE2-NZ 3.21Å; E334-K337 VanDerWaalsContact OE2-NZ 3.13Å; E334-T338 VanDerWaalsContact O-CB 3.29Å; E334-T338 WeakPolarHBondContact O-CB 3.32Å; E334-T338 PolarHBondContact O-N 3.1Å; E334-T338 PolarHBondContact O-OG1 2.95Å
335	L	93.3	Very high	92.9	Very high	90 Å²	90	77.6 Å²	77.6	47%	0.471	37%	0.369	S	S	.	.	H	α-helix	trans	-60.7	-45.5	171.7	-178.4	63.7	0	0	0	111.3	S331 I333 T338 Y339	S331-L335 WeakPolarHBondContact O-CB 3.25Å; S331-L335 PolarHBondContact O-N 3.36Å; I333-L335 VanDerWaalsContact C-N 3.33Å; I333-L335 PolarHBondContact O-N 2.81Å; L335-T338 PolarHBondContact O-N 2.87Å; L335-Y339 HydrophobicContact CD1-CD2 4.03Å; L335-Y339 HydrophobicContact CD1-CE2 3.45Å; L335-Y339 VanDerWaalsContact CD1-CE2 3.45Å; L335-Y339 HydrophobicContact CD2-CE2 4.13Å; L335-Y339 HydrophobicContact CG-CD2 3.92Å; L335-Y339 HydrophobicContact CG-CE2 3.55Å; L335-Y339 WeakPolarHBondContact O-CD2 3.09Å; L335-Y339 PolarHBondContact O-N 3.42Å
336	Q	93.1	Very high	92.7	Very high	124 Å²	124	76.2 Å²	76.2	58%	0.579	37%	0.368	S	S	*	.	H	α-helix	trans	-67	-40.5	177.4	-168.5	179.8	15.9	0	0	112.4	E332 I333 Y339 N340	E332-Q336 WeakPolarHBondContact O-CB 3.31Å; E332-Q336 PolarHBondContact O-N 2.82Å; I333-Q336 PolarHBondContact O-N 2.77Å; Q336-Y339 PolarHBondContact O-N 3.33Å; Q336-N340 WeakPolarHBondContact O-CB 3.45Å; Q336-N340 VanDerWaalsContact O-CG 3.23Å; Q336-N340 PolarHBondContact O-N 3.01Å; Q336-N340 PolarHBondContact O-ND2 3.3Å; Q336-N340 VanDerWaalsContact O-ND2 3.12Å
337	K	91.1	Very high	92.6	Very high	84 Å²	84	78.4 Å²	78.4	37%	0.365	39%	0.386	S	S	.	.	H	α-helix	trans	-58.3	-48.8	173.3	-178.3	-160.2	173.5	-166	0	110.2	E203 I333 E334 Y339 N340 E341	E203-K337 IonicContact OE2-NZ 2.97Å; I333-K337 WeakPolarHBondContact O-CB 3.45Å; I333-K337 PolarHBondContact O-N 2.84Å; E334-K337 PolarHBondContact O-N 3.03Å; E334-K337 WeakPolarHBondContact OE2-CD 3.41Å; E334-K337 IonicContact OE2-NZ 3.63Å; E334-K337 PolarHBondContact OE2-NZ 3.21Å; E334-K337 VanDerWaalsContact OE2-NZ 3.13Å; K337-Y339 PolarHBondContact O-N 3.15Å; K337-N340 WeakPolarHBondContact O-CB 3.34Å; K337-N340 PolarHBondContact O-N 3.24Å; K337-E341 WeakPolarHBondContact O-CB 3.12Å; K337-E341 PolarHBondContact O-N 3.42Å
338	T	92.9	Very high	92.4	Very high	66 Å²	66	80.5 Å²	80.5	41%	0.405	40%	0.396	S	S	.	.	H	α-helix	trans	-59.2	-46.5	177.5	-57	0	0	0	0	111.6	E334 L335 N340 E341 I342	E334-T338 VanDerWaalsContact O-CB 3.29Å; E334-T338 WeakPolarHBondContact O-CB 3.32Å; E334-T338 PolarHBondContact O-N 3.1Å; E334-T338 PolarHBondContact O-OG1 2.95Å; L335-T338 PolarHBondContact O-N 2.87Å; T338-N340 PolarHBondContact O-N 3.33Å; T338-E341 PolarHBondContact O-N 2.94Å; T338-I342 HydrophobicContact CG2-CD1 3.91Å; T338-I342 HydrophobicContact CG2-CG1 4.48Å; T338-I342 WeakPolarHBondContact O-CB 3.41Å; T338-I342 VanDerWaalsContact O-CG1 3.28Å; T338-I342 WeakPolarHBondContact O-CG1 3.47Å; T338-I342 PolarHBondContact O-N 2.86Å
339	Y	93	Very high	92.1	Very high	150 Å²	150	76.1 Å²	76.1	59%	0.588	38%	0.384	S	S	*	.	H	α-helix	trans	-62.4	-40.4	175.7	-78.7	-54.4	0	0	0	113.2	L335 Q336 K337 E341 A343	L335-Y339 HydrophobicContact CD1-CD2 4.03Å; L335-Y339 HydrophobicContact CD1-CE2 3.45Å; L335-Y339 VanDerWaalsContact CD1-CE2 3.45Å; L335-Y339 HydrophobicContact CD2-CE2 4.13Å; L335-Y339 HydrophobicContact CG-CD2 3.92Å; L335-Y339 HydrophobicContact CG-CE2 3.55Å; L335-Y339 WeakPolarHBondContact O-CD2 3.09Å; L335-Y339 PolarHBondContact O-N 3.42Å; Q336-Y339 PolarHBondContact O-N 3.33Å; K337-Y339 PolarHBondContact O-N 3.15Å; Y339-E341 VanDerWaalsContact C-N 3.34Å; Y339-A343 WeakPolarHBondContact O-CB 3.42Å; Y339-A343 PolarHBondContact O-N 3.29Å
340	N	94.5	Very high	91.8	Very high	99 Å²	99	81.2 Å²	81.2	53%	0.529	41%	0.407	S	S	.	.	H	α-helix	trans	-65.2	-39.3	175.9	-71.2	-33	0	0	0	111.7	Q336 K337 T338 A343 K344	Q336-N340 WeakPolarHBondContact O-CB 3.45Å; Q336-N340 VanDerWaalsContact O-CG 3.23Å; Q336-N340 PolarHBondContact O-N 3.01Å; Q336-N340 PolarHBondContact O-ND2 3.3Å; Q336-N340 VanDerWaalsContact O-ND2 3.12Å; K337-N340 WeakPolarHBondContact O-CB 3.34Å; K337-N340 PolarHBondContact O-N 3.24Å; T338-N340 PolarHBondContact O-N 3.33Å; N340-A343 PolarHBondContact O-N 3.3Å; N340-K344 WeakPolarHBondContact O-CB 3.35Å; N340-K344 PolarHBondContact O-N 3.07Å
341	E	94.4	Very high	91.6	Very high	103 Å²	103	86.6 Å²	86.6	48%	0.481	44%	0.436	S	S	.	.	H	α-helix	trans	-68.1	-44.3	176.7	-177.3	161.8	-163.9	0	0	111.9	K337 T338 Y339 A343 K344 L345	K337-E341 WeakPolarHBondContact O-CB 3.12Å; K337-E341 PolarHBondContact O-N 3.42Å; T338-E341 PolarHBondContact O-N 2.94Å; Y339-E341 VanDerWaalsContact C-N 3.34Å; E341-A343 VanDerWaalsContact C-N 3.33Å; E341-A343 PolarHBondContact O-N 2.92Å; E341-K344 WeakPolarHBondContact O-CB 3.4Å; E341-K344 PolarHBondContact O-N 3.38Å; E341-K344 VanDerWaalsContact O-N 3.17Å; E341-L345 HydrophobicContact CG-CD1 3.94Å; E341-L345 HydrophobicContact CG-CG 4.33Å; E341-L345 WeakPolarHBondContact O-CB 3.22Å; E341-L345 WeakPolarHBondContact O-CG 3.42Å; E341-L345 PolarHBondContact O-N 3.2Å
342	I	92.1	Very high	91.4	Very high	73 Å²	73	89.1 Å²	89.1	37%	0.374	45%	0.45	S	S	.	.	H	α-helix	trans	-55.4	-48.6	171.3	-70.3	165.6	0	0	0	110.3	T338 K344 L345 Q346	T338-I342 HydrophobicContact CG2-CD1 3.91Å; T338-I342 HydrophobicContact CG2-CG1 4.48Å; T338-I342 WeakPolarHBondContact O-CB 3.41Å; T338-I342 VanDerWaalsContact O-CG1 3.28Å; T338-I342 WeakPolarHBondContact O-CG1 3.47Å; T338-I342 PolarHBondContact O-N 2.86Å; I342-K344 VanDerWaalsContact C-N 3.32Å; I342-K344 PolarHBondContact O-N 3.15Å; I342-L345 PolarHBondContact O-N 2.88Å; I342-Q346 HydrophobicContact CG2-CG 4.33Å; I342-Q346 WeakPolarHBondContact O-CB 3.42Å; I342-Q346 VanDerWaalsContact O-CG 3.22Å; I342-Q346 WeakPolarHBondContact O-CG 3.4Å; I342-Q346 PolarHBondContact O-N 2.83Å
343	A	90.8	Very high	91.1	Very high	53 Å²	53	84 Å²	84	44%	0.438	43%	0.426	S	S	.	.	H	α-helix	trans	-62.6	-38.3	178.8	0	0	0	0	0	112.5	Y339 N340 E341 A347	Y339-A343 WeakPolarHBondContact O-CB 3.42Å; Y339-A343 PolarHBondContact O-N 3.29Å; N340-A343 PolarHBondContact O-N 3.3Å; E341-A343 VanDerWaalsContact C-N 3.33Å; E341-A343 PolarHBondContact O-N 2.92Å; A343-A347 WeakPolarHBondContact O-CB 3.4Å; A343-A347 PolarHBondContact O-N 3.33Å; A343-A347 VanDerWaalsContact O-N 3.09Å
344	K	95.1	Very high	90.8	Very high	123 Å²	123	86.7 Å²	86.7	54%	0.535	44%	0.444	S	S	.	.	H	α-helix	trans	-65	-50.4	175	-175.5	-178.1	178.7	-93.4	0	111.4	N340 E341 I342 Q346 A347 E348	N340-K344 WeakPolarHBondContact O-CB 3.35Å; N340-K344 PolarHBondContact O-N 3.07Å; E341-K344 WeakPolarHBondContact O-CB 3.4Å; E341-K344 PolarHBondContact O-N 3.38Å; E341-K344 VanDerWaalsContact O-N 3.17Å; I342-K344 VanDerWaalsContact C-N 3.32Å; I342-K344 PolarHBondContact O-N 3.15Å; K344-Q346 PolarHBondContact O-N 3.43Å; K344-A347 WeakPolarHBondContact O-CB 3.33Å; K344-A347 PolarHBondContact O-N 3.19Å; K344-A347 VanDerWaalsContact O-N 3.13Å; K344-E348 WeakPolarHBondContact CE-OE1 3.41Å; K344-E348 WeakPolarHBondContact CG-OE1 3.09Å; K344-E348 IonicContact NZ-OE1 3.25Å; K344-E348 PolarHBondContact NZ-OE1 3.33Å; K344-E348 WeakPolarHBondContact O-CG 3.38Å; K344-E348 PolarHBondContact O-N 2.96Å
345	L	93	Very high	90.5	Very high	80 Å²	80	92.8 Å²	92.8	42%	0.419	48%	0.477	S	S	.	.	H	α-helix	trans	-61.3	-41.8	178.2	-71.4	170.5	0	0	0	111.6	E341 I342 A347 E348 I349	E341-L345 HydrophobicContact CG-CD1 3.94Å; E341-L345 HydrophobicContact CG-CG 4.33Å; E341-L345 WeakPolarHBondContact O-CB 3.22Å; E341-L345 WeakPolarHBondContact O-CG 3.42Å; E341-L345 PolarHBondContact O-N 3.2Å; I342-L345 PolarHBondContact O-N 2.88Å; L345-A347 VanDerWaalsContact C-N 3.32Å; L345-A347 PolarHBondContact O-N 2.99Å; L345-E348 PolarHBondContact O-N 2.86Å; L345-I349 WeakPolarHBondContact O-CB 3.45Å; L345-I349 WeakPolarHBondContact O-CD1 3.1Å; L345-I349 VanDerWaalsContact O-CG1 3.23Å; L345-I349 WeakPolarHBondContact O-CG1 3.29Å; L345-I349 PolarHBondContact O-N 3.33Å
346	Q	90.5	Very high	90	Very high	87 Å²	87	90.1 Å²	90.1	41%	0.407	47%	0.468	S	S	.	.	H	α-helix	trans	-61.4	-39	174.1	-73.9	177.9	-9.3	0	0	112.4	I342 K344 K350 V367	I342-Q346 HydrophobicContact CG2-CG 4.33Å; I342-Q346 WeakPolarHBondContact O-CB 3.42Å; I342-Q346 VanDerWaalsContact O-CG 3.22Å; I342-Q346 WeakPolarHBondContact O-CG 3.4Å; I342-Q346 PolarHBondContact O-N 2.83Å; K344-Q346 PolarHBondContact O-N 3.43Å; Q346-K350 VanDerWaalsContact O-CB 3.31Å; Q346-K350 WeakPolarHBondContact O-CB 3.42Å; Q346-K350 PolarHBondContact O-N 2.8Å; Q346-K350 VanDerWaalsContact O-N 3.13Å; Q346-V367 HydrophobicContact CB-CG1 4.49Å; Q346-V367 HydrophobicContact CG-CB 4.09Å; Q346-V367 HydrophobicContact CG-CG1 4.03Å
347	A	89.4	Confident	89.4	Confident	47 Å²	47	94.5 Å²	94.5	39%	0.388	49%	0.485	S	S	.	.	H	α-helix	trans	-69.2	-41.4	174.6	0	0	0	0	0	112.1	A343 K344 L345 K350 N351	A343-A347 WeakPolarHBondContact O-CB 3.4Å; A343-A347 PolarHBondContact O-N 3.33Å; A343-A347 VanDerWaalsContact O-N 3.09Å; K344-A347 WeakPolarHBondContact O-CB 3.33Å; K344-A347 PolarHBondContact O-N 3.19Å; K344-A347 VanDerWaalsContact O-N 3.13Å; L345-A347 VanDerWaalsContact C-N 3.32Å; L345-A347 PolarHBondContact O-N 2.99Å; A347-K350 PolarHBondContact O-N 3.31Å; A347-N351 WeakPolarHBondContact O-CB 3.2Å; A347-N351 PolarHBondContact O-N 2.83Å; A347-N351 PolarHBondContact O-ND2 2.82Å
348	E	90.9	Very high	88.6	Confident	81 Å²	81	96.7 Å²	96.7	38%	0.379	50%	0.497	S	S	.	.	H	α-helix	trans	-62.5	-49.5	175.9	-73.8	174.8	-172.8	0	0	111.6	K344 L345 K350 N351 V352	K344-E348 WeakPolarHBondContact CE-OE1 3.41Å; K344-E348 WeakPolarHBondContact CG-OE1 3.09Å; K344-E348 IonicContact NZ-OE1 3.25Å; K344-E348 PolarHBondContact NZ-OE1 3.33Å; K344-E348 WeakPolarHBondContact O-CG 3.38Å; K344-E348 PolarHBondContact O-N 2.96Å; L345-E348 PolarHBondContact O-N 2.86Å; E348-K350 VanDerWaalsContact C-N 3.28Å; E348-K350 PolarHBondContact O-N 3.2Å; E348-N351 PolarHBondContact O-N 2.87Å; E348-N351 VanDerWaalsContact O-N 3.08Å; E348-V352 WeakPolarHBondContact O-CG2 3.44Å; E348-V352 PolarHBondContact O-N 2.82Å
349	I	88.5	Confident	87.9	Confident	82 Å²	82	94.5 Å²	94.5	42%	0.421	49%	0.487	S	S	.	.	H	α-helix	trans	-55.4	-44.1	175.1	-70.1	163.6	0	0	0	110.9	L345 V352 S353 V367	L345-I349 WeakPolarHBondContact O-CB 3.45Å; L345-I349 WeakPolarHBondContact O-CD1 3.1Å; L345-I349 VanDerWaalsContact O-CG1 3.23Å; L345-I349 WeakPolarHBondContact O-CG1 3.29Å; L345-I349 PolarHBondContact O-N 3.33Å; I349-V352 PolarHBondContact O-N 2.7Å; I349-S353 WeakPolarHBondContact O-CB 3.26Å; I349-S353 PolarHBondContact O-N 3.41Å; I349-V367 HydrophobicContact CB-CG1 4.15Å; I349-V367 HydrophobicContact CD1-CG1 3.65Å; I349-V367 HydrophobicContact CG2-CG1 3.85Å; I349-V367 HydrophobicContact CG2-CG2 4.46Å
350	K	85.4	Confident	86.7	Confident	140 Å²	140	93 Å²	93	61%	0.609	49%	0.49	S	S	*	.	H	α-helix	trans	-67.7	-34	178.3	-174.4	-179.9	178.3	-175.4	0	113.2	Q346 A347 E348 S353	Q346-K350 VanDerWaalsContact O-CB 3.31Å; Q346-K350 WeakPolarHBondContact O-CB 3.42Å; Q346-K350 PolarHBondContact O-N 2.8Å; Q346-K350 VanDerWaalsContact O-N 3.13Å; A347-K350 PolarHBondContact O-N 3.31Å; E348-K350 VanDerWaalsContact C-N 3.28Å; E348-K350 PolarHBondContact O-N 3.2Å; K350-S353 PolarHBondContact O-OG 3.35Å
351	N	88.9	Confident	85.3	Confident	114 Å²	114	98.7 Å²	98.7	61%	0.61	50%	0.504	S	S	*	.	H	α-helix	trans	-72.9	-39.7	176.2	-69.2	-22	0	0	0	111.2	A347 E348	A347-N351 WeakPolarHBondContact O-CB 3.2Å; A347-N351 PolarHBondContact O-N 2.83Å; A347-N351 PolarHBondContact O-ND2 2.82Å; E348-N351 PolarHBondContact O-N 2.87Å; E348-N351 VanDerWaalsContact O-N 3.08Å
352	V	87.9	Confident	83.9	Confident	98 Å²	98	96.1 Å²	96.1	59%	0.594	50%	0.497	S	S	*	.	H	α-helix	trans	-70.4	-34.5	178.6	173.3	0	0	0	0	112	E348 I349 V354 L355 A356	E348-V352 WeakPolarHBondContact O-CG2 3.44Å; E348-V352 PolarHBondContact O-N 2.82Å; I349-V352 PolarHBondContact O-N 2.7Å; V352-V354 PolarHBondContact O-N 3.46Å; V352-L355 WeakPolarHBondContact O-CB 3.22Å; V352-L355 PolarHBondContact O-N 2.94Å; V352-A356 PolarHBondContact O-N 3.43Å
353	S	86.1	Confident	82.9	Confident	5 Å²	5	93.7 Å²	93.7	4%	0.035	49%	0.487	C	S	.	.	H	α-helix	trans	-61.3	-27.1	-179.2	66.9	0	0	0	0	114.2	I349 K350 L355 A356 G359 S362 A363	I349-S353 WeakPolarHBondContact O-CB 3.26Å; I349-S353 PolarHBondContact O-N 3.41Å; K350-S353 PolarHBondContact O-OG 3.35Å; S353-L355 PolarHBondContact O-N 2.88Å; S353-A356 WeakPolarHBondContact O-CB 3.49Å; S353-A356 PolarHBondContact O-N 3.41Å; S353-A356 VanDerWaalsContact O-N 3.1Å; S353-G359 CarbonylContact O-C 3.57Å; S353-G359 WeakPolarHBondContact O-CA 3.01Å; S353-S362 VanDerWaalsContact CB-OG 3.28Å; S353-S362 WeakPolarHBondContact CB-OG 3.47Å; S353-A363 VanDerWaalsContact CB-CB 3.42Å; S353-A363 VanDerWaalsContact OG-CB 3.3Å; S353-A363 WeakPolarHBondContact OG-CB 3.22Å
354	V	84.1	Confident	82.3	Confident	95 Å²	95	95.2 Å²	95.2	58%	0.576	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-26.9	173.2	-175	0	0	0	0	111.9	V352	V352-V354 PolarHBondContact O-N 3.46Å
355	L	85.9	Confident	81.5	Confident	154 Å²	154	96.3 Å²	96.3	81%	0.806	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-4.7	179.9	-56.5	176.1	0	0	0	113.5	V352 S353	V352-L355 WeakPolarHBondContact O-CB 3.22Å; V352-L355 PolarHBondContact O-N 2.94Å; S353-L355 PolarHBondContact O-N 2.88Å
356	A	82.1	Confident	81.2	Confident	35 Å²	35	94.1 Å²	94.1	29%	0.289	48%	0.477	S	S	.	.	S	Bend	trans	-71.2	157.2	179.2	0	0	0	0	0	111.7	V352 S353 E358 G359 S362	V352-A356 PolarHBondContact O-N 3.43Å; S353-A356 WeakPolarHBondContact O-CB 3.49Å; S353-A356 PolarHBondContact O-N 3.41Å; S353-A356 VanDerWaalsContact O-N 3.1Å; A356-E358 PolarHBondContact O-N 3.4Å; A356-G359 WeakPolarHBondContact O-CA 3.39Å; A356-G359 PolarHBondContact O-N 2.95Å; A356-S362 WeakPolarHBondContact CB-OG 3.36Å
357	F	80.7	Confident	81	Confident	216 Å²	216	91.7 Å²	91.7	95%	0.947	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-36.2	178.4	178.2	-102.5	0	0	0	113.1	G359	F357-G359 VanDerWaalsContact C-N 3.28Å
358	E	75.2	Confident	80.6	Confident	130 Å²	130	93.5 Å²	93.5	61%	0.607	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	0.8	175.8	-55.1	-176.6	156.2	0	0	113	A356 R361	A356-E358 PolarHBondContact O-N 3.4Å; E358-R361 HydrophobicContact CB-CB 4.2Å; E358-R361 WeakPolarHBondContact O-CB 3.36Å; E358-R361 PolarHBondContact O-N 2.9Å
359	G	77.3	Confident	80.3	Confident	19 Å²	19	90.9 Å²	90.9	20%	0.196	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	52.9	-139.8	-171.7	0	0	0	0	0	112.1	S353 A356 F357 R361 S362	S353-G359 CarbonylContact O-C 3.57Å; S353-G359 WeakPolarHBondContact O-CA 3.01Å; A356-G359 WeakPolarHBondContact O-CA 3.39Å; A356-G359 PolarHBondContact O-N 2.95Å; F357-G359 VanDerWaalsContact C-N 3.28Å; G359-R361 PolarHBondContact O-N 3.34Å; G359-S362 PolarHBondContact O-N 3.48Å; G359-S362 PolarHBondContact O-OG 2.94Å
360	N	67.2	Low	80.2	Confident	120 Å²	120	91.7 Å²	91.7	64%	0.642	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-56.5	-10.3	-179.9	-67.6	-11.8	0	0	0	115.4
361	R	65.1	Low	80.1	Confident	218 Å²	218	87.8 Å²	87.8	82%	0.823	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-75.1	-23.4	171.8	-70.7	-179.5	165.4	179.5	-6.8	113.1	E358 G359 A363	E358-R361 HydrophobicContact CB-CB 4.2Å; E358-R361 WeakPolarHBondContact O-CB 3.36Å; E358-R361 PolarHBondContact O-N 2.9Å; G359-R361 PolarHBondContact O-N 3.34Å; R361-A363 VanDerWaalsContact C-N 3.29Å; R361-A363 PolarHBondContact O-N 3.22Å
362	S	65.1	Low	79.9	Confident	48 Å²	48	85 Å²	85	34%	0.336	46%	0.463	S	S	.	.	S	Bend	trans	-71	-25.4	178.4	86.4	0	0	0	0	112.7	S353 A356 G359 Q364	S353-S362 VanDerWaalsContact CB-OG 3.28Å; S353-S362 WeakPolarHBondContact CB-OG 3.47Å; A356-S362 WeakPolarHBondContact CB-OG 3.36Å; G359-S362 PolarHBondContact O-N 3.48Å; G359-S362 PolarHBondContact O-OG 2.94Å; S362-Q364 PolarHBondContact O-N 2.98Å
363	A	71.1	Confident	80	Confident	22 Å²	22	83.8 Å²	83.8	18%	0.182	45%	0.45	C	S	.	.	S	Bend	trans	-85.9	95.1	169.9	0	0	0	0	0	109.9	S353 R361	S353-A363 VanDerWaalsContact CB-CB 3.42Å; S353-A363 VanDerWaalsContact OG-CB 3.3Å; S353-A363 WeakPolarHBondContact OG-CB 3.22Å; R361-A363 VanDerWaalsContact C-N 3.29Å; R361-A363 PolarHBondContact O-N 3.22Å
364	Q	78.1	Confident	80	Confident	85 Å²	85	91.6 Å²	91.6	40%	0.397	49%	0.486	S	S	.	.			trans	-59.4	141.9	170.4	-64.6	166.8	5.4	0	0	110.1	S362 P366 V367 V369 P371	S362-Q364 PolarHBondContact O-N 2.98Å; Q364-P366 CarbonylContact O-C 3.56Å; Q364-P366 VanDerWaalsContact O-C 3.27Å; Q364-V367 WeakPolarHBondContact O-CA 3.39Å; Q364-V367 WeakPolarHBondContact O-CG2 3.27Å; Q364-V367 PolarHBondContact O-N 2.66Å; Q364-V369 PolarHBondContact OE1-O 3.45Å; Q364-P371 HydrophobicContact CG-CB 4.23Å
365	W	79.6	Confident	80.3	Confident	147 Å²	147	89.1 Å²	89.1	56%	0.557	48%	0.475	S	S	*	.	S	Bend	trans	-114.7	126.2	177.2	175.8	84.8	0	0	0	110.1	R449 H476 V478	W365-R449 PolarHBondContact O-NH2 3.16Å; W365-H476 HydrophobicContact CH2-CB 3.44Å; W365-H476 VanDerWaalsContact CH2-CB 3.44Å; W365-H476 WeakPolarHBondContact CH2-O 3.32Å; W365-H476 HydrophobicContact CZ2-CB 4.2Å; W365-H476 HydrophobicContact CZ3-CB 3.87Å; W365-V478 HydrophobicContact CH2-CG2 4.14Å; W365-V478 HydrophobicContact CZ3-CG2 3.89Å
366	P	85.6	Confident	80.5	Confident	34 Å²	34	91.3 Å²	91.3	22%	0.221	48%	0.478	C	S	.	.	S	Bend	cis	-66	155.1	-9.3	-19.9	33.9	0	0	0	113.6	Q364 V369 V478	Q364-P366 CarbonylContact O-C 3.56Å; Q364-P366 VanDerWaalsContact O-C 3.27Å; P366-V369 HydrophobicContact CB-CG2 4.03Å; P366-V369 HydrophobicContact CG-CG2 4.34Å; P366-V369 PolarHBondContact O-N 3.24Å; P366-V478 HydrophobicContact CG-CB 4.2Å; P366-V478 HydrophobicContact CG-CG2 4.24Å
367	V	86.1	Confident	81.1	Confident	36 Å²	36	91.6 Å²	91.6	22%	0.218	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	130.7	177.1	176.4	0	0	0	0	109.5	Q346 I349 Q364	Q346-V367 HydrophobicContact CB-CG1 4.49Å; Q346-V367 HydrophobicContact CG-CB 4.09Å; Q346-V367 HydrophobicContact CG-CG1 4.03Å; I349-V367 HydrophobicContact CB-CG1 4.15Å; I349-V367 HydrophobicContact CD1-CG1 3.65Å; I349-V367 HydrophobicContact CG2-CG1 3.85Å; I349-V367 HydrophobicContact CG2-CG2 4.46Å; Q364-V367 WeakPolarHBondContact O-CA 3.39Å; Q364-V367 WeakPolarHBondContact O-CG2 3.27Å; Q364-V367 PolarHBondContact O-N 2.66Å
368	G	81.6	Confident	81.6	Confident	85 Å²	85	91 Å²	91	88%	0.876	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.6	2.1	-174.8	0	0	0	0	0	114.4
369	V	85.7	Confident	82.2	Confident	25 Å²	25	93.1 Å²	93.1	15%	0.152	48%	0.477	C	S	.	.	S	Bend	trans	-109.8	142.3	172.5	-178.5	0	0	0	0	109.1	Q364 P366 R449 V478 P480	Q364-V369 PolarHBondContact OE1-O 3.45Å; P366-V369 HydrophobicContact CB-CG2 4.03Å; P366-V369 HydrophobicContact CG-CG2 4.34Å; P366-V369 PolarHBondContact O-N 3.24Å; V369-R449 HydrophobicContact CG1-CB 4.01Å; V369-V478 HydrophobicContact CG1-CG1 4.46Å; V369-P480 HydrophobicContact CG1-CB 4.41Å; V369-P480 HydrophobicContact CG2-CB 4.32Å
370	N	84.9	Confident	82.7	Confident	99 Å²	99	95.7 Å²	95.7	53%	0.529	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-51.2	150.1	176.2	-72.6	-24.5	0	0	0	113	T448 R449	N370-T448 WeakPolarHBondContact CB-O 3.27Å; N370-T448 PolarHBondContact ND2-O 2.94Å; N370-R449 HydrophobicContact CB-CB 4.33Å; N370-R449 PolarHBondContact O-NE 3.37Å; N370-R449 PolarHBondContact O-NH2 3.07Å
371	P	84.1	Confident	83.8	Confident	58 Å²	58	94.6 Å²	94.6	38%	0.377	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-64.6	153.4	176.5	27.7	-32.7	0	0	0	111.1	Q364 T448	Q364-P371 HydrophobicContact CG-CB 4.23Å; P371-T448 PolarHBondContact O-OG1 3.36Å; P371-T448 VanDerWaalsContact O-OG1 3.05Å
372	P	85.3	Confident	85.1	Confident	55 Å²	55	86.7 Å²	86.7	36%	0.357	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-60.8	144.1	172.9	28.7	-35.3	0	0	0	111.4	E374 D446	P372-E374 PolarHBondContact O-N 2.81Å; P372-D446 WeakPolarHBondContact CA-OD2 3.38Å
373	F	88.8	Confident	86.2	Confident	74 Å²	74	90.9 Å²	90.9	33%	0.325	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-62.2	121.1	177.4	174.6	-96.8	0	0	0	111.7	A375 E380 L382 D446 T448	F373-A375 HydrophobicContact CE1-CB 4.01Å; F373-E380 HydrophobicContact CE1-CB 3.99Å; F373-E380 WeakPolarHBondContact CE1-O 3.5Å; F373-E380 HydrophobicContact CZ-CB 4.15Å; F373-E380 HydrophobicContact CZ-CG 4.49Å; F373-L382 HydrophobicContact CB-CD1 4.19Å; F373-L382 HydrophobicContact CD1-CD1 4Å; F373-L382 HydrophobicContact CD1-CG 4.16Å; F373-L382 HydrophobicContact CG-CD1 4.43Å; F373-D446 WeakPolarHBondContact CB-OD1 3.37Å; F373-D446 PolarHBondContact N-OD2 2.64Å; F373-T448 HydrophobicContact CB-CG2 4.27Å; F373-T448 HydrophobicContact CD2-CG2 4.31Å
374	E	87.2	Confident	87.2	Confident	168 Å²	168	94.3 Å²	94.3	79%	0.785	48%	0.476	S	S	*	.			trans	-93.2	102.3	176.6	-63.7	-165.7	160.1	0	0	110.8	P372 K376	P372-E374 PolarHBondContact O-N 2.81Å; E374-K376 PolarHBondContact O-N 2.83Å
375	A	89.7	Confident	87.9	Confident	44 Å²	44	92.6 Å²	92.6	36%	0.364	47%	0.468	S	S	.	.			trans	-63.7	121.5	176.3	0	0	0	0	0	111.5	F373 E380 V381	F373-A375 HydrophobicContact CE1-CB 4.01Å; A375-E380 HydrophobicContact CB-CB 3.72Å; A375-V381 HydrophobicContact CB-CG2 4.06Å
376	K	91.1	Very high	88.6	Confident	199 Å²	199	88.9 Å²	88.9	87%	0.865	45%	0.454	S	S	*	.	S	Bend	trans	-81.1	-26.4	177	-61.2	-179.2	-178.8	177.1	0	112.2	E374 E380	E374-K376 PolarHBondContact O-N 2.83Å; K376-E380 WeakPolarHBondContact CB-OE2 3.31Å; K376-E380 PolarHBondContact N-OE2 2.82Å
377	S	93.6	Very high	89	Confident	42 Å²	42	87.3 Å²	87.3	29%	0.294	44%	0.444	S	S	.	.	S	Bend	trans	-128.2	161.7	178.7	79	0	0	0	0	112.7	F379 E380	S377-F379 PolarHBondContact O-N 3.29Å; S377-F379 PolarHBondContact OG-N 2.93Å; S377-E380 WeakPolarHBondContact CB-OE1 3.17Å; S377-E380 PolarHBondContact N-OE1 2.79Å; S377-E380 PolarHBondContact O-N 2.97Å; S377-E380 VanDerWaalsContact O-N 3.1Å; S377-E380 PolarHBondContact OG-OE1 2.88Å
378	R	91	Very high	89.4	Confident	204 Å²	204	87.1 Å²	87.1	77%	0.77	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-15.5	173.7	62.1	172	-80.3	178.4	-5.7	114.6
379	F	87.6	Confident	89.8	Confident	174 Å²	174	86.2 Å²	86.2	76%	0.763	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-16.1	-179.4	-57.9	-73.1	0	0	0	112.4	S377	S377-F379 PolarHBondContact O-N 3.29Å; S377-F379 PolarHBondContact OG-N 2.93Å
380	E	88.7	Confident	90.1	Very high	72 Å²	72	92.1 Å²	92.1	34%	0.336	44%	0.442	S	S	.	.	S	Bend	trans	-92.2	-2.9	176.7	-69.5	152.6	-120.5	0	0	112.7	F373 A375 K376 S377 L382	F373-E380 HydrophobicContact CE1-CB 3.99Å; F373-E380 WeakPolarHBondContact CE1-O 3.5Å; F373-E380 HydrophobicContact CZ-CB 4.15Å; F373-E380 HydrophobicContact CZ-CG 4.49Å; A375-E380 HydrophobicContact CB-CB 3.72Å; K376-E380 WeakPolarHBondContact CB-OE2 3.31Å; K376-E380 PolarHBondContact N-OE2 2.82Å; S377-E380 WeakPolarHBondContact CB-OE1 3.17Å; S377-E380 PolarHBondContact N-OE1 2.79Å; S377-E380 PolarHBondContact O-N 2.97Å; S377-E380 VanDerWaalsContact O-N 3.1Å; S377-E380 PolarHBondContact OG-OE1 2.88Å; E380-L382 PolarHBondContact O-N 2.89Å; E380-L382 VanDerWaalsContact O-N 3.07Å
381	V	90.7	Very high	90.5	Very high	98 Å²	98	89.2 Å²	89.2	59%	0.594	43%	0.425	S	S	*	.			trans	-69.2	108.6	-176.9	179.4	0	0	0	0	110.5	A375 K383	A375-V381 HydrophobicContact CB-CG2 4.06Å; V381-K383 PolarHBondContact O-N 3.02Å
382	L	91.2	Very high	90.8	Very high	51 Å²	51	87 Å²	87	27%	0.267	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-62.6	126	175.5	-57.8	176.6	0	0	0	110.9	F373 E380 D446	F373-L382 HydrophobicContact CB-CD1 4.19Å; F373-L382 HydrophobicContact CD1-CD1 4Å; F373-L382 HydrophobicContact CD1-CG 4.16Å; F373-L382 HydrophobicContact CG-CD1 4.43Å; E380-L382 PolarHBondContact O-N 2.89Å; E380-L382 VanDerWaalsContact O-N 3.07Å; L382-D446 HydrophobicContact CD1-CB 4.01Å
383	K	89.4	Confident	91	Very high	137 Å²	137	89 Å²	89	60%	0.596	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-73.6	136	-179.3	-173.9	-168.3	173.3	-163.4	0	110.6	V381 S394	V381-K383 PolarHBondContact O-N 3.02Å; K383-S394 PolarHBondContact NZ-OG 2.9Å
384	W	92	Very high	90.8	Very high	94 Å²	94	86.6 Å²	86.6	36%	0.356	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-84.5	133.7	163.4	-75.1	94.1	0	0	0	110.6	R443 R444 E452	W384-R443 VanDerWaalsContact CE3-C 3.43Å; W384-R444 HydrophobicContact CD2-CB 4.08Å; W384-R444 HydrophobicContact CD2-CG 3.97Å; W384-R444 VanDerWaalsContact CE2-CD 3.44Å; W384-R444 HydrophobicContact CE3-CB 3.97Å; W384-R444 HydrophobicContact CE3-CG 3.88Å; W384-R444 HydrophobicContact CH2-CG 3.8Å; W384-R444 HydrophobicContact CZ2-CG 3.89Å; W384-R444 HydrophobicContact CZ3-CB 4.31Å; W384-R444 HydrophobicContact CZ3-CG 3.8Å; W384-E452 HydrophobicContact CH2-CB 4Å; W384-E452 WeakPolarHBondContact CH2-OE2 3.29Å; W384-E452 HydrophobicContact CZ3-CB 4.44Å
385	E	92.2	Very high	90.5	Very high	49 Å²	49	79.4 Å²	79.4	23%	0.229	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	128.7	171.8	-51.1	-162.8	125.5	0	0	109.9	I392 S394 Y442 R443	E385-I392 HydrophobicContact CB-CD1 4.39Å; E385-S394 WeakPolarHBondContact OE1-CB 3.44Å; E385-S394 PolarHBondContact OE1-OG 3.47Å; E385-Y442 CarbonylContact O-C 3.48Å; E385-Y442 VanDerWaalsContact O-CA 3.3Å; E385-Y442 WeakPolarHBondContact O-CA 3.29Å; E385-R443 HydrophobicContact CB-CG 3.96Å; E385-R443 PolarHBondContact N-O 2.85Å; E385-R443 PolarHBondContact O-N 3.37Å; E385-R443 IonicContact OE2-CZ 2.92Å; E385-R443 IonicContact OE2-NE 3.21Å; E385-R443 PolarHBondContact OE2-NE 2.81Å; E385-R443 IonicContact OE2-NH2 2.65Å; E385-R443 PolarHBondContact OE2-NH2 2.69Å
386	Y	94.4	Very high	89.7	Confident	68 Å²	68	84.1 Å²	84.1	27%	0.267	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	136.5	173.6	176.6	-104.1	0	0	0	110.6	T388 Y393 N440 G441 Y442	Y386-T388 HydrophobicContact CE1-CG2 4.13Å; Y386-Y393 AromaticContact CD1-CD2 3.56Å; Y386-Y393 HydrophobicContact CD1-CD2 3.56Å; Y386-Y393 HydrophobicContact CD1-CE2 4.14Å; Y386-Y393 AromaticContact CD1-CG 3.86Å; Y386-Y393 HydrophobicContact CD1-CG 3.86Å; Y386-Y393 AromaticContact CE1-CD2 3.93Å; Y386-Y393 HydrophobicContact CE1-CD2 3.93Å; Y386-Y393 HydrophobicContact CE1-CE2 4.02Å; Y386-Y393 HydrophobicContact CE1-CG 4.48Å; Y386-Y393 PolarHBondContact O-N 3.24Å; Y386-N440 HydrophobicContact CE2-CB 3.9Å; Y386-G441 WeakPolarHBondContact CA-O 3.44Å; Y386-G441 VanDerWaalsContact CD2-O 3.22Å; Y386-G441 WeakPolarHBondContact CD2-O 3.32Å; Y386-Y442 AromaticContact CD2-CD1 3.94Å; Y386-Y442 HydrophobicContact CD2-CD1 3.94Å; Y386-Y442 AromaticContact CD2-CE1 3.52Å; Y386-Y442 HydrophobicContact CD2-CE1 3.52Å; Y386-Y442 AromaticContact CD2-CZ 3.85Å; Y386-Y442 HydrophobicContact CE2-CE1 4.35Å; Y386-Y442 HydrophobicContact CG-CE1 4.3Å
387	F	94.5	Very high	88.6	Confident	1 Å²	1	79.8 Å²	79.8	0%	0.004	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	155.4	178.6	67.3	-90.4	0	0	0	112.3	E391 I392 V412 L438 G441 R443 Y453 L455	F387-E391 CarbonylContact C-O 3.57Å; F387-E391 VanDerWaalsContact CA-O 3.31Å; F387-E391 WeakPolarHBondContact CA-O 3.45Å; F387-I392 HydrophobicContact CB-CB 4.43Å; F387-I392 HydrophobicContact CB-CG1 4.26Å; F387-V412 HydrophobicContact CD2-CB 4.49Å; F387-V412 HydrophobicContact CD2-CG1 3.98Å; F387-V412 HydrophobicContact CD2-CG2 3.63Å; F387-V412 HydrophobicContact CE2-CB 4.31Å; F387-V412 HydrophobicContact CE2-CG1 3.8Å; F387-V412 HydrophobicContact CE2-CG2 3.66Å; F387-V412 HydrophobicContact CG-CG2 4.3Å; F387-V412 HydrophobicContact CZ-CG2 4.33Å; F387-L438 HydrophobicContact CD2-CD2 4.06Å; F387-L438 HydrophobicContact CE2-CD2 3.79Å; F387-G441 VanDerWaalsContact CE1-C 3.45Å; F387-G441 PolarHBondContact N-O 3.02Å; F387-G441 WeakPolarHBondContact O-CA 3.43Å; F387-G441 PolarHBondContact O-N 2.97Å; F387-R443 HydrophobicContact CD1-CB 4.29Å; F387-R443 HydrophobicContact CD1-CG 4.05Å; F387-R443 HydrophobicContact CE1-CB 3.83Å; F387-R443 HydrophobicContact CE1-CG 4.08Å; F387-Y453 HydrophobicContact CE1-CD1 4.38Å; F387-Y453 HydrophobicContact CZ-CD1 4.3Å; F387-L455 HydrophobicContact CE2-CD2 4.14Å; F387-L455 HydrophobicContact CZ-CD2 3.64Å
388	T	93.3	Very high	87.6	Confident	33 Å²	33	80 Å²	80	20%	0.202	39%	0.385	C	S	.	.			trans	-112.3	-169.6	169.3	65.7	0	0	0	0	109.1	Y386 E390 E391 Y393 L404	Y386-T388 HydrophobicContact CE1-CG2 4.13Å; T388-E390 PolarHBondContact O-N 3.21Å; T388-E390 PolarHBondContact OG1-N 3.19Å; T388-E391 PolarHBondContact N-O 3.1Å; T388-E391 PolarHBondContact OG1-N 3.05Å; T388-E391 PolarHBondContact OG1-O 3.35Å; T388-Y393 HydrophobicContact CG2-CE2 4.21Å; T388-L404 WeakPolarHBondContact O-CD1 3.2Å
389	E	90.8	Very high	86.9	Confident	65 Å²	65	71.7 Å²	71.7	30%	0.304	36%	0.359	S	S	.	.	S	Bend	trans	-73.3	-12.6	175.2	-52.6	-164.1	-166	0	0	113.4	I416 K435 L438	E389-I416 HydrophobicContact CG-CD1 4.45Å; E389-K435 WeakPolarHBondContact OE1-CE 3.38Å; E389-K435 IonicContact OE1-NZ 2.68Å; E389-K435 PolarHBondContact OE1-NZ 2.94Å; E389-K435 WeakPolarHBondContact OE2-CE 3.49Å; E389-K435 IonicContact OE2-NZ 3.87Å; E389-K435 PolarHBondContact OE2-NZ 2.88Å; E389-L438 HydrophobicContact CG-CB 3.72Å; E389-L438 HydrophobicContact CG-CD2 4.27Å; E389-L438 WeakPolarHBondContact OE1-CB 3.02Å; E389-L438 PolarHBondContact OE1-N 3.47Å
390	E	91.6	Very high	86.8	Confident	149 Å²	149	68.5 Å²	68.5	70%	0.696	36%	0.356	S	S	*	.	S	Bend	trans	-125.8	-23.3	-173	-63.6	-178.7	173.5	0	0	113.6	T388 E403 L404	T388-E390 PolarHBondContact O-N 3.21Å; T388-E390 PolarHBondContact OG1-N 3.19Å; E390-E403 WeakPolarHBondContact O-CA 3.4Å; E390-L404 PolarHBondContact O-N 3.09Å
391	E	92.8	Very high	86.8	Confident	39 Å²	39	70.1 Å²	70.1	18%	0.182	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	151	-168.9	-53.8	-179.6	134.7	0	0	112.8	F387 T388 Y393 K401 C402	F387-E391 CarbonylContact C-O 3.57Å; F387-E391 VanDerWaalsContact CA-O 3.31Å; F387-E391 WeakPolarHBondContact CA-O 3.45Å; T388-E391 PolarHBondContact N-O 3.1Å; T388-E391 PolarHBondContact OG1-N 3.05Å; T388-E391 PolarHBondContact OG1-O 3.35Å; E391-Y393 HydrophobicContact CB-CE2 3.88Å; E391-Y393 PolarHBondContact OE2-OH 2.92Å; E391-K401 WeakPolarHBondContact OE1-CD 3.32Å; E391-K401 WeakPolarHBondContact OE1-CE 3.44Å; E391-K401 IonicContact OE1-NZ 3.13Å; E391-K401 PolarHBondContact OE1-NZ 3.08Å; E391-K401 IonicContact OE2-NZ 2.64Å; E391-C402 CarbonylContact C-O 3.6Å; E391-C402 VanDerWaalsContact CA-O 3.31Å; E391-C402 WeakPolarHBondContact CA-O 3.33Å
392	I	91.7	Very high	86.6	Confident	12 Å²	12	67.4 Å²	67.4	6%	0.062	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	142.7	168	-167.5	168.8	0	0	0	110.8	E385 F387 K401 C402 L404	E385-I392 HydrophobicContact CB-CD1 4.39Å; F387-I392 HydrophobicContact CB-CB 4.43Å; F387-I392 HydrophobicContact CB-CG1 4.26Å; I392-K401 WeakPolarHBondContact O-CA 3.44Å; I392-C402 WeakPolarHBondContact CG2-SG 3.18Å; I392-C402 PolarHBondContact N-O 3.38Å; I392-C402 PolarHBondContact O-N 3.2Å; I392-L404 HydrophobicContact CB-CD2 4.03Å; I392-L404 HydrophobicContact CG2-CD2 4.38Å
393	Y	89.3	Confident	86.6	Confident	95 Å²	95	70.7 Å²	70.7	37%	0.373	36%	0.361	S	S	.	.	S	Bend	trans	-106.2	35.3	-172.5	-70.5	-104.5	0	0	0	111.9	Y386 T388 E391 P400 K401	Y386-Y393 AromaticContact CD1-CD2 3.56Å; Y386-Y393 HydrophobicContact CD1-CD2 3.56Å; Y386-Y393 HydrophobicContact CD1-CE2 4.14Å; Y386-Y393 AromaticContact CD1-CG 3.86Å; Y386-Y393 HydrophobicContact CD1-CG 3.86Å; Y386-Y393 AromaticContact CE1-CD2 3.93Å; Y386-Y393 HydrophobicContact CE1-CD2 3.93Å; Y386-Y393 HydrophobicContact CE1-CE2 4.02Å; Y386-Y393 HydrophobicContact CE1-CG 4.48Å; Y386-Y393 PolarHBondContact O-N 3.24Å; T388-Y393 HydrophobicContact CG2-CE2 4.21Å; E391-Y393 HydrophobicContact CB-CE2 3.88Å; E391-Y393 PolarHBondContact OE2-OH 2.92Å; Y393-P400 WeakPolarHBondContact CD1-O 3.27Å; Y393-K401 HydrophobicContact CD1-CB 4.06Å; Y393-K401 HydrophobicContact CE1-CB 3.93Å
394	S	83.6	Confident	86.5	Confident	24 Å²	24	64.7 Å²	64.7	17%	0.168	34%	0.335	C	S	.	.			trans	-151	70.9	-175.9	-169.5	0	0	0	0	109.4	K383 E385	K383-S394 PolarHBondContact NZ-OG 2.9Å; E385-S394 WeakPolarHBondContact OE1-CB 3.44Å; E385-S394 PolarHBondContact OE1-OG 3.47Å
395	C	81.4	Confident	86.2	Confident	18 Å²	18	68.4 Å²	68.4	12%	0.122	35%	0.349	C	S	.	.			trans	-92.5	142.6	-169.3	-51.5	0	0	0	0	112.6	D397 G398 A399 C402	C395-D397 VanDerWaalsContact C-N 3.27Å; C395-D397 WeakPolarHBondContact CB-OD1 3.49Å; C395-D397 PolarHBondContact O-N 2.94Å; C395-G398 PolarHBondContact O-N 2.65Å; C395-A399 HydrophobicContact CB-CB 4.03Å; C395-A399 WeakPolarHBondContact CB-O 3.28Å; C395-C402 VanDerWaalsContact CA-SG 3.6Å; C395-C402 HydrophobicContact CB-CB 3.98Å; C395-C402 WeakPolarHBondContact CB-SG 3.49Å; C395-C402 WeakPolarHBondContact SG-CB 3.45Å; C395-C402 PolarHBondContact SG-N 3.47Å; C395-C402 CovalentContact SG-SG 2.04Å; C395-C402 PolarHBondContact SG-SG 2.71Å
396	I	72.6	Confident	86	Confident	142 Å²	142	68.8 Å²	68.8	73%	0.728	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-30.6	-174.9	-59.8	171.8	0	0	0	111.9	G398	I396-G398 VanDerWaalsContact C-N 3.27Å; I396-G398 PolarHBondContact O-N 2.94Å
397	D	67.8	Low	85.6	Confident	109 Å²	109	71.9 Å²	71.9	58%	0.583	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-5.6	174.6	61	-5.3	0	0	0	113.7	C395 A399	C395-D397 VanDerWaalsContact C-N 3.27Å; C395-D397 WeakPolarHBondContact CB-OD1 3.49Å; C395-D397 PolarHBondContact O-N 2.94Å; D397-A399 VanDerWaalsContact C-N 3.29Å; D397-A399 WeakPolarHBondContact OD1-CB 3.19Å; D397-A399 PolarHBondContact OD1-N 2.86Å
398	G	72.6	Confident	85.4	Confident	46 Å²	46	74.4 Å²	74.4	47%	0.474	40%	0.4	S	S	.	.			trans	71.4	21.9	-172.5	0	0	0	0	0	113.9	C395 I396 R750	C395-G398 PolarHBondContact O-N 2.65Å; I396-G398 VanDerWaalsContact C-N 3.27Å; I396-G398 PolarHBondContact O-N 2.94Å; G398-R750 PolarHBondContact O-NH1 2.95Å
399	A	77.9	Confident	85.3	Confident	29 Å²	29	78.7 Å²	78.7	24%	0.24	42%	0.416	C	S	.	.			trans	-67.8	150.2	162.6	0	0	0	0	0	110.6	C395 D397 K401	C395-A399 HydrophobicContact CB-CB 4.03Å; C395-A399 WeakPolarHBondContact CB-O 3.28Å; D397-A399 VanDerWaalsContact C-N 3.29Å; D397-A399 WeakPolarHBondContact OD1-CB 3.19Å; D397-A399 PolarHBondContact OD1-N 2.86Å; A399-K401 VanDerWaalsContact C-N 3.3Å; A399-K401 PolarHBondContact O-N 2.71Å
400	P	84.4	Confident	85.5	Confident	108 Å²	108	81.3 Å²	81.3	70%	0.701	43%	0.431	S	S	*	.	S	Bend	trans	-72.3	-23.8	179.3	29.6	-35.3	0	0	0	113.2	Y393	Y393-P400 WeakPolarHBondContact CD1-O 3.27Å
401	K	88.1	Confident	85.5	Confident	106 Å²	106	75.1 Å²	75.1	46%	0.461	40%	0.403	S	S	.	.			trans	-153.2	151.3	175.4	69.5	174.9	-162.6	155.8	0	110.6	E391 I392 Y393 A399	E391-K401 WeakPolarHBondContact OE1-CD 3.32Å; E391-K401 WeakPolarHBondContact OE1-CE 3.44Å; E391-K401 IonicContact OE1-NZ 3.13Å; E391-K401 PolarHBondContact OE1-NZ 3.08Å; E391-K401 IonicContact OE2-NZ 2.64Å; I392-K401 WeakPolarHBondContact O-CA 3.44Å; Y393-K401 HydrophobicContact CD1-CB 4.06Å; Y393-K401 HydrophobicContact CE1-CB 3.93Å; A399-K401 VanDerWaalsContact C-N 3.3Å; A399-K401 PolarHBondContact O-N 2.71Å
402	C	88.1	Confident	85.6	Confident	41 Å²	41	73.5 Å²	73.5	28%	0.277	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	152.9	177.4	41.9	0	0	0	0	109.3	E391 I392 C395	E391-C402 CarbonylContact C-O 3.6Å; E391-C402 VanDerWaalsContact CA-O 3.31Å; E391-C402 WeakPolarHBondContact CA-O 3.33Å; I392-C402 WeakPolarHBondContact CG2-SG 3.18Å; I392-C402 PolarHBondContact N-O 3.38Å; I392-C402 PolarHBondContact O-N 3.2Å; C395-C402 VanDerWaalsContact CA-SG 3.6Å; C395-C402 HydrophobicContact CB-CB 3.98Å; C395-C402 WeakPolarHBondContact CB-SG 3.49Å; C395-C402 WeakPolarHBondContact SG-CB 3.45Å; C395-C402 PolarHBondContact SG-N 3.47Å; C395-C402 CovalentContact SG-SG 2.04Å; C395-C402 PolarHBondContact SG-SG 2.71Å
403	E	89.7	Confident	85.7	Confident	120 Å²	120	75.1 Å²	75.1	56%	0.561	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	141.7	-178.5	-65.5	172.3	-179.1	0	0	112	E390 R405	E390-E403 WeakPolarHBondContact O-CA 3.4Å; E403-R405 HydrophobicContact CB-CG 4.21Å; E403-R405 PolarHBondContact O-N 3.27Å; E403-R405 IonicContact OE2-CZ 2.68Å; E403-R405 IonicContact OE2-NE 3.77Å; E403-R405 PolarHBondContact OE2-NE 2.94Å; E403-R405 IonicContact OE2-NH2 2.74Å; E403-R405 PolarHBondContact OE2-NH2 3.01Å
404	L	87.6	Confident	85.9	Confident	10 Å²	10	75 Å²	75	5%	0.052	41%	0.414	C	S	.	.			trans	-69.8	113.8	169.1	-72.3	171.1	0	0	0	109.8	T388 E390 I392 D408 K409 V412	T388-L404 WeakPolarHBondContact O-CD1 3.2Å; E390-L404 PolarHBondContact O-N 3.09Å; I392-L404 HydrophobicContact CB-CD2 4.03Å; I392-L404 HydrophobicContact CG2-CD2 4.38Å; L404-D408 HydrophobicContact CD2-CB 3.75Å; L404-K409 HydrophobicContact CB-CB 4.15Å; L404-V412 HydrophobicContact CD1-CB 4.37Å; L404-V412 HydrophobicContact CD1-CG1 4.31Å; L404-V412 HydrophobicContact CD1-CG2 4.05Å; L404-V412 HydrophobicContact CD2-CG2 4.36Å
405	R	85.6	Confident	86.5	Confident	172 Å²	172	74.4 Å²	74.4	65%	0.649	41%	0.409	S	S	*	.			trans	-129.4	153.9	-178.5	-64.2	-179.5	178.4	-169.5	0.8	110.4	E403 I407 D408	E403-R405 HydrophobicContact CB-CG 4.21Å; E403-R405 PolarHBondContact O-N 3.27Å; E403-R405 IonicContact OE2-CZ 2.68Å; E403-R405 IonicContact OE2-NE 3.77Å; E403-R405 PolarHBondContact OE2-NE 2.94Å; E403-R405 IonicContact OE2-NH2 2.74Å; E403-R405 PolarHBondContact OE2-NH2 3.01Å; R405-I407 PolarHBondContact O-N 3.07Å; R405-D408 PolarHBondContact O-N 2.96Å
406	G	87.5	Confident	87.1	Confident	57 Å²	57	73.7 Å²	73.7	59%	0.588	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	-126.9	175.9	0	0	0	0	0	113.5	D408 K409 L410	G406-D408 PolarHBondContact O-N 3.44Å; G406-K409 PolarHBondContact O-N 3.14Å; G406-L410 PolarHBondContact O-N 3.43Å
407	I	87.3	Confident	88.1	Confident	134 Å²	134	71.9 Å²	71.9	69%	0.687	40%	0.395	S	S	*	.	H	α-helix	trans	-61.6	-38.4	-173.1	-157.3	74.9	0	0	0	112.9	R405 K409 L410 D411	R405-I407 PolarHBondContact O-N 3.07Å; I407-K409 VanDerWaalsContact C-N 3.32Å; I407-K409 PolarHBondContact O-N 2.96Å; I407-L410 PolarHBondContact O-N 3.22Å; I407-D411 WeakPolarHBondContact O-CB 3.16Å; I407-D411 PolarHBondContact O-N 2.89Å
408	D	89.6	Confident	89.5	Confident	54 Å²	54	69.6 Å²	69.6	29%	0.289	39%	0.386	S	S	.	.	H	α-helix	trans	-65.2	-36.3	-178.2	-69.9	-66.7	0	0	0	112	L404 R405 G406 V412 R443	L404-D408 HydrophobicContact CD2-CB 3.75Å; R405-D408 PolarHBondContact O-N 2.96Å; G406-D408 PolarHBondContact O-N 3.44Å; D408-V412 WeakPolarHBondContact O-CB 3.47Å; D408-V412 VanDerWaalsContact O-CG2 3.29Å; D408-V412 WeakPolarHBondContact O-CG2 3.47Å; D408-V412 PolarHBondContact O-N 3.27Å; D408-R443 IonicContact OD1-CZ 3.79Å; D408-R443 IonicContact OD1-NH1 3.14Å; D408-R443 PolarHBondContact OD1-NH1 2.67Å; D408-R443 IonicContact OD1-NH2 3.4Å; D408-R443 PolarHBondContact OD1-NH2 2.99Å
409	K	92.4	Very high	90.5	Very high	123 Å²	123	67.4 Å²	67.4	54%	0.535	36%	0.363	S	S	.	.	H	α-helix	trans	-69.3	-37.1	176.8	-171.7	172.6	-175.4	167.8	0	111.9	L404 G406 I407 A413	L404-K409 HydrophobicContact CB-CB 4.15Å; G406-K409 PolarHBondContact O-N 3.14Å; I407-K409 VanDerWaalsContact C-N 3.32Å; I407-K409 PolarHBondContact O-N 2.96Å; K409-A413 WeakPolarHBondContact O-CB 3.46Å; K409-A413 PolarHBondContact O-N 2.91Å; K409-A413 VanDerWaalsContact O-N 3.16Å
410	L	93.8	Very high	91.2	Very high	120 Å²	120	67.1 Å²	67.1	63%	0.628	36%	0.357	S	S	*	.	H	α-helix	trans	-69.5	-44.2	176.5	-65.7	174.2	0	0	0	111.2	G406 I407 A413 E414	G406-L410 PolarHBondContact O-N 3.43Å; I407-L410 PolarHBondContact O-N 3.22Å; L410-A413 PolarHBondContact O-N 3.44Å; L410-E414 WeakPolarHBondContact O-CB 3.3Å; L410-E414 PolarHBondContact O-N 2.61Å
411	D	92.8	Very high	91.7	Very high	19 Å²	19	67.4 Å²	67.4	10%	0.102	35%	0.349	C	S	.	.	H	α-helix	trans	-59.9	-47.3	175.7	-176.2	66.5	0	0	0	111.6	I407 A413 E414 V415 Y453 R479	I407-D411 WeakPolarHBondContact O-CB 3.16Å; I407-D411 PolarHBondContact O-N 2.89Å; D411-A413 VanDerWaalsContact C-N 3.32Å; D411-A413 PolarHBondContact O-N 2.82Å; D411-E414 PolarHBondContact O-N 3.34Å; D411-V415 WeakPolarHBondContact O-CB 3.49Å; D411-V415 WeakPolarHBondContact O-CG2 3.4Å; D411-V415 PolarHBondContact O-N 3.05Å; D411-Y453 PolarHBondContact OD1-OH 3.2Å; D411-Y453 WeakPolarHBondContact OD2-CE1 3.23Å; D411-Y453 PolarHBondContact OD2-OH 3Å; D411-R479 IonicContact OD1-NH1 2.67Å; D411-R479 PolarHBondContact OD1-NH1 2.84Å
412	V	93.1	Very high	91.9	Very high	5 Å²	5	66.8 Å²	66.8	3%	0.03	35%	0.348	C	S	.	.	H	α-helix	trans	-60.6	-40.2	176.7	167.8	0	0	0	0	111.9	F387 L404 D408 I416	F387-V412 HydrophobicContact CD2-CB 4.49Å; F387-V412 HydrophobicContact CD2-CG1 3.98Å; F387-V412 HydrophobicContact CD2-CG2 3.63Å; F387-V412 HydrophobicContact CE2-CB 4.31Å; F387-V412 HydrophobicContact CE2-CG1 3.8Å; F387-V412 HydrophobicContact CE2-CG2 3.66Å; F387-V412 HydrophobicContact CG-CG2 4.3Å; F387-V412 HydrophobicContact CZ-CG2 4.33Å; L404-V412 HydrophobicContact CD1-CB 4.37Å; L404-V412 HydrophobicContact CD1-CG1 4.31Å; L404-V412 HydrophobicContact CD1-CG2 4.05Å; L404-V412 HydrophobicContact CD2-CG2 4.36Å; D408-V412 WeakPolarHBondContact O-CB 3.47Å; D408-V412 VanDerWaalsContact O-CG2 3.29Å; D408-V412 WeakPolarHBondContact O-CG2 3.47Å; D408-V412 PolarHBondContact O-N 3.27Å; V412-I416 HydrophobicContact CG1-CD1 3.85Å; V412-I416 WeakPolarHBondContact O-CB 3.36Å; V412-I416 VanDerWaalsContact O-CD1 3.31Å; V412-I416 WeakPolarHBondContact O-CD1 3.21Å; V412-I416 WeakPolarHBondContact O-CG1 3.43Å; V412-I416 PolarHBondContact O-N 2.98Å
413	A	93.7	Very high	92.1	Very high	46 Å²	46	65.6 Å²	65.6	38%	0.38	34%	0.339	S	S	.	.	H	α-helix	trans	-66.6	-50.2	175.7	0	0	0	0	0	112.2	K409 L410 D411 V415 I416 D417	K409-A413 WeakPolarHBondContact O-CB 3.46Å; K409-A413 PolarHBondContact O-N 2.91Å; K409-A413 VanDerWaalsContact O-N 3.16Å; L410-A413 PolarHBondContact O-N 3.44Å; D411-A413 VanDerWaalsContact C-N 3.32Å; D411-A413 PolarHBondContact O-N 2.82Å; A413-V415 VanDerWaalsContact C-N 3.32Å; A413-V415 PolarHBondContact O-N 3.26Å; A413-I416 PolarHBondContact O-N 3.42Å; A413-D417 PolarHBondContact O-N 3Å
414	E	95	Very high	92.2	Very high	92 Å²	92	60.9 Å²	60.9	43%	0.43	32%	0.317	S	S	.	.	H	α-helix	trans	-55.1	-45.6	178.7	-177	-175.7	-170.1	0	0	111.5	L410 D411 D417 T418 R479	L410-E414 WeakPolarHBondContact O-CB 3.3Å; L410-E414 PolarHBondContact O-N 2.61Å; D411-E414 PolarHBondContact O-N 3.34Å; E414-D417 PolarHBondContact O-N 3.26Å; E414-T418 VanDerWaalsContact O-CB 3.27Å; E414-T418 WeakPolarHBondContact O-CB 3.35Å; E414-T418 PolarHBondContact O-N 2.76Å; E414-T418 PolarHBondContact O-OG1 2.94Å; E414-R479 IonicContact OE1-CZ 2.76Å; E414-R479 IonicContact OE1-NH1 3.84Å; E414-R479 IonicContact OE1-NH2 3.8Å; E414-R479 PolarHBondContact OE1-NH2 3.22Å; E414-R479 VanDerWaalsContact OE1-NH2 3.08Å; E414-R479 IonicContact OE2-CZ 2.7Å; E414-R479 VanDerWaalsContact OE2-CZ 3.31Å; E414-R479 IonicContact OE2-NH1 3.44Å; E414-R479 PolarHBondContact OE2-NH1 3.07Å; E414-R479 IonicContact OE2-NH2 2.72Å; E414-R479 PolarHBondContact OE2-NH2 3.1Å
415	V	95.1	Very high	92.4	Very high	11 Å²	11	66.3 Å²	66.3	7%	0.067	34%	0.341	C	S	.	.	H	α-helix	trans	-69.9	-36.2	-178.5	176.3	0	0	0	0	111.7	D411 A413 A419 Y453 L455 L477	D411-V415 WeakPolarHBondContact O-CB 3.49Å; D411-V415 WeakPolarHBondContact O-CG2 3.4Å; D411-V415 PolarHBondContact O-N 3.05Å; A413-V415 VanDerWaalsContact C-N 3.32Å; A413-V415 PolarHBondContact O-N 3.26Å; V415-A419 WeakPolarHBondContact O-CB 3.08Å; V415-A419 PolarHBondContact O-N 3.18Å; V415-Y453 HydrophobicContact CB-CD1 4.49Å; V415-Y453 HydrophobicContact CG1-CD1 3.84Å; V415-Y453 HydrophobicContact CG1-CD2 4.05Å; V415-Y453 HydrophobicContact CG1-CE1 4.35Å; V415-Y453 HydrophobicContact CG1-CG 3.68Å; V415-Y453 HydrophobicContact CG2-CD1 4.23Å; V415-Y453 HydrophobicContact CG2-CD2 4.24Å; V415-Y453 HydrophobicContact CG2-CE1 3.91Å; V415-Y453 HydrophobicContact CG2-CE2 3.95Å; V415-Y453 HydrophobicContact CG2-CG 4.39Å; V415-L455 HydrophobicContact CG1-CD1 4.11Å; V415-L477 HydrophobicContact CG1-CD1 3.61Å; V415-L477 WeakPolarHBondContact O-CD1 3.36Å
416	I	94	Very high	92.6	Very high	4 Å²	4	65.5 Å²	65.5	2%	0.021	34%	0.342	C	S	.	.	H	α-helix	trans	-67.3	-47.1	174.3	-69.5	165.9	0	0	0	110.9	E389 V412 A413 A419 I420 K435 L438 L455 L457	E389-I416 HydrophobicContact CG-CD1 4.45Å; V412-I416 HydrophobicContact CG1-CD1 3.85Å; V412-I416 WeakPolarHBondContact O-CB 3.36Å; V412-I416 VanDerWaalsContact O-CD1 3.31Å; V412-I416 WeakPolarHBondContact O-CD1 3.21Å; V412-I416 WeakPolarHBondContact O-CG1 3.43Å; V412-I416 PolarHBondContact O-N 2.98Å; A413-I416 PolarHBondContact O-N 3.42Å; I416-A419 WeakPolarHBondContact O-CB 3.39Å; I416-A419 PolarHBondContact O-N 2.56Å; I416-I420 HydrophobicContact CG2-CD1 3.74Å; I416-I420 VanDerWaalsContact O-CD1 3.29Å; I416-I420 WeakPolarHBondContact O-CD1 2.95Å; I416-I420 VanDerWaalsContact O-CG1 3.32Å; I416-I420 WeakPolarHBondContact O-CG1 3.42Å; I416-I420 PolarHBondContact O-N 3.04Å; I416-I420 VanDerWaalsContact O-N 3.1Å; I416-K435 HydrophobicContact CG2-CD 3.79Å; I416-L438 HydrophobicContact CD1-CB 4.38Å; I416-L438 HydrophobicContact CD1-CD2 4.12Å; I416-L455 HydrophobicContact CG1-CD1 4.11Å; I416-L457 HydrophobicContact CG2-CD2 4.41Å
417	D	95	Very high	92.6	Very high	103 Å²	103	66.3 Å²	66.3	55%	0.551	33%	0.328	S	S	*	.	H	α-helix	trans	-64.6	-43.1	-179.4	-73.5	-17.5	0	0	0	111.2	A413 E414 A419 I420 E421	A413-D417 PolarHBondContact O-N 3Å; E414-D417 PolarHBondContact O-N 3.26Å; D417-A419 VanDerWaalsContact C-N 3.31Å; D417-A419 PolarHBondContact O-N 2.55Å; D417-I420 PolarHBondContact O-N 2.81Å; D417-I420 VanDerWaalsContact O-N 3.09Å; D417-E421 PolarHBondContact O-N 2.85Å
418	T	95.3	Very high	92.4	Very high	62 Å²	62	64.5 Å²	64.5	38%	0.38	32%	0.318	S	S	.	.	H	α-helix	trans	-58.1	-41.6	172.6	-57.1	0	0	0	0	111.9	E414 I420 E421 E422	E414-T418 VanDerWaalsContact O-CB 3.27Å; E414-T418 WeakPolarHBondContact O-CB 3.35Å; E414-T418 PolarHBondContact O-N 2.76Å; E414-T418 PolarHBondContact O-OG1 2.94Å; T418-I420 VanDerWaalsContact C-N 3.3Å; T418-I420 PolarHBondContact O-N 3.29Å; T418-E421 PolarHBondContact O-N 3.1Å; T418-E422 PolarHBondContact O-N 3.4Å
419	A	94.6	Very high	92	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-60.3	-40.5	175.7	0	0	0	0	0	112	V415 I416 D417 L423 L455 L457 V475 L477	V415-A419 WeakPolarHBondContact O-CB 3.08Å; V415-A419 PolarHBondContact O-N 3.18Å; I416-A419 WeakPolarHBondContact O-CB 3.39Å; I416-A419 PolarHBondContact O-N 2.56Å; D417-A419 VanDerWaalsContact C-N 3.31Å; D417-A419 PolarHBondContact O-N 2.55Å; A419-L423 VanDerWaalsContact O-CB 3.25Å; A419-L423 WeakPolarHBondContact O-CB 3.37Å; A419-L423 WeakPolarHBondContact O-CD1 3.28Å; A419-L423 WeakPolarHBondContact O-CG 3.28Å; A419-L423 PolarHBondContact O-N 3.4Å; A419-L423 VanDerWaalsContact O-N 3.08Å; A419-L455 HydrophobicContact CB-CD1 4.08Å; A419-L457 HydrophobicContact CB-CD1 3.82Å; A419-V475 HydrophobicContact CB-CG1 4.29Å; A419-L477 HydrophobicContact CB-CD1 3.92Å
420	I	93.4	Very high	91.7	Very high	23 Å²	23	64.5 Å²	64.5	12%	0.118	33%	0.332	C	S	.	.	H	α-helix	trans	-72.7	-38.6	-179.6	-63.1	152.3	0	0	0	110.8	I416 D417 T418 N424 K435	I416-I420 HydrophobicContact CG2-CD1 3.74Å; I416-I420 VanDerWaalsContact O-CD1 3.29Å; I416-I420 WeakPolarHBondContact O-CD1 2.95Å; I416-I420 VanDerWaalsContact O-CG1 3.32Å; I416-I420 WeakPolarHBondContact O-CG1 3.42Å; I416-I420 PolarHBondContact O-N 3.04Å; I416-I420 VanDerWaalsContact O-N 3.1Å; D417-I420 PolarHBondContact O-N 2.81Å; D417-I420 VanDerWaalsContact O-N 3.09Å; T418-I420 VanDerWaalsContact C-N 3.3Å; T418-I420 PolarHBondContact O-N 3.29Å; I420-N424 WeakPolarHBondContact CG2-ND2 3.49Å; I420-N424 WeakPolarHBondContact O-CB 3.31Å; I420-N424 PolarHBondContact O-N 3.39Å; I420-N424 PolarHBondContact O-ND2 2.97Å; I420-K435 HydrophobicContact CD1-CB 3.67Å; I420-K435 HydrophobicContact CD1-CD 4.13Å; I420-K435 HydrophobicContact CD1-CG 4.15Å; I420-K435 HydrophobicContact CG1-CB 4.49Å
421	E	94.3	Very high	91.4	Very high	113 Å²	113	61.2 Å²	61.2	53%	0.528	31%	0.314	S	S	.	.	H	α-helix	trans	-62.1	-53.8	175.9	-166.3	-165.3	134.5	0	0	110.9	D417 T418 L423 N424 K425	D417-E421 PolarHBondContact O-N 2.85Å; T418-E421 PolarHBondContact O-N 3.1Å; E421-L423 VanDerWaalsContact C-N 3.31Å; E421-L423 PolarHBondContact O-N 2.83Å; E421-N424 CarbonylContact O-C 3.55Å; E421-N424 WeakPolarHBondContact O-CA 3.05Å; E421-N424 PolarHBondContact O-N 3.46Å; E421-K425 PolarHBondContact O-N 3.29Å; E421-K425 IonicContact OE1-NZ 3.13Å; E421-K425 PolarHBondContact OE1-NZ 3.09Å
422	E	91.8	Very high	91.2	Very high	94 Å²	94	63.7 Å²	63.7	44%	0.439	33%	0.325	S	S	.	.	H	α-helix	trans	-64.2	-34.5	-179.1	-77.3	-59.3	133.9	0	0	112.7	T418 K425 K426	T418-E422 PolarHBondContact O-N 3.4Å; E422-K425 WeakPolarHBondContact OE1-CD 3.03Å; E422-K425 WeakPolarHBondContact OE1-CE 3.46Å; E422-K425 IonicContact OE1-NZ 3.95Å; E422-K425 PolarHBondContact OE1-NZ 3.02Å; E422-K426 WeakPolarHBondContact O-CB 3.46Å; E422-K426 PolarHBondContact O-N 3.05Å; E422-K426 VanDerWaalsContact O-N 3.11Å
423	L	92.3	Very high	91	Very high	15 Å²	15	63.7 Å²	63.7	8%	0.079	33%	0.325	C	S	.	.	H	α-helix	trans	-63.7	-44.5	169.6	-77.5	173.8	0	0	0	111.9	A419 E421 K426 Y427 L433 L459 V475	A419-L423 VanDerWaalsContact O-CB 3.25Å; A419-L423 WeakPolarHBondContact O-CB 3.37Å; A419-L423 WeakPolarHBondContact O-CD1 3.28Å; A419-L423 WeakPolarHBondContact O-CG 3.28Å; A419-L423 PolarHBondContact O-N 3.4Å; A419-L423 VanDerWaalsContact O-N 3.08Å; E421-L423 VanDerWaalsContact C-N 3.31Å; E421-L423 PolarHBondContact O-N 2.83Å; L423-K426 PolarHBondContact O-N 2.96Å; L423-Y427 HydrophobicContact CD2-CE2 3.92Å; L423-Y427 WeakPolarHBondContact O-CD2 3.45Å; L423-Y427 PolarHBondContact O-N 2.6Å; L423-L433 HydrophobicContact CB-CD1 3.76Å; L423-L459 HydrophobicContact CD1-CD1 3.65Å; L423-V475 HydrophobicContact CD1-CG2 3.77Å; L423-V475 HydrophobicContact CD2-CG2 4.4Å; L423-V475 HydrophobicContact CG-CG2 4.28Å
424	N	92.5	Very high	90.7	Very high	21 Å²	21	66.3 Å²	66.3	11%	0.112	33%	0.328	C	S	.	.	H	α-helix	trans	-64.6	-45.2	176.2	-83.4	-72.9	0	0	0	111.6	I420 E421 K426 Y427 M428 H432 L433	I420-N424 WeakPolarHBondContact CG2-ND2 3.49Å; I420-N424 WeakPolarHBondContact O-CB 3.31Å; I420-N424 PolarHBondContact O-N 3.39Å; I420-N424 PolarHBondContact O-ND2 2.97Å; E421-N424 CarbonylContact O-C 3.55Å; E421-N424 WeakPolarHBondContact O-CA 3.05Å; E421-N424 PolarHBondContact O-N 3.46Å; N424-K426 PolarHBondContact O-N 3.38Å; N424-K426 VanDerWaalsContact O-N 3.17Å; N424-Y427 PolarHBondContact O-N 3.03Å; N424-M428 HydrophobicContact CB-CG 4.45Å; N424-M428 WeakPolarHBondContact O-CB 3.39Å; N424-M428 WeakPolarHBondContact O-CG 3.31Å; N424-M428 PolarHBondContact O-N 3.42Å; N424-H432 PolarHBondContact OD1-ND1 2.96Å; N424-L433 PolarHBondContact ND2-O 3.24Å; N424-L433 PolarHBondContact OD1-N 3.34Å; N424-L433 PolarHBondContact OD1-O 2.66Å
425	K	91.4	Very high	90.3	Very high	124 Å²	124	65.5 Å²	65.5	54%	0.539	32%	0.323	S	S	.	.	H	α-helix	trans	-48.4	-41.1	172.1	-114.7	165.2	-177.3	152.4	0	112.3	E421 E422	E421-K425 PolarHBondContact O-N 3.29Å; E421-K425 IonicContact OE1-NZ 3.13Å; E421-K425 PolarHBondContact OE1-NZ 3.09Å; E422-K425 WeakPolarHBondContact OE1-CD 3.03Å; E422-K425 WeakPolarHBondContact OE1-CE 3.46Å; E422-K425 IonicContact OE1-NZ 3.95Å; E422-K425 PolarHBondContact OE1-NZ 3.02Å
426	K	89.5	Confident	90	Very high	155 Å²	155	69.1 Å²	69.1	67%	0.674	34%	0.339	S	S	*	.	H	α-helix	trans	-77.6	-31.9	-176.8	-176.6	168.9	-176.7	165.3	0	115.3	E422 L423 N424	E422-K426 WeakPolarHBondContact O-CB 3.46Å; E422-K426 PolarHBondContact O-N 3.05Å; E422-K426 VanDerWaalsContact O-N 3.11Å; L423-K426 PolarHBondContact O-N 2.96Å; N424-K426 PolarHBondContact O-N 3.38Å; N424-K426 VanDerWaalsContact O-N 3.17Å
427	Y	88.3	Confident	89.9	Confident	75 Å²	75	74.1 Å²	74.1	29%	0.294	36%	0.362	S	S	.	.	H	α-helix	trans	-111	-11.2	-175.9	-60.2	-73.6	0	0	0	114.5	L423 N424 T430 L431 L433	L423-Y427 HydrophobicContact CD2-CE2 3.92Å; L423-Y427 WeakPolarHBondContact O-CD2 3.45Å; L423-Y427 PolarHBondContact O-N 2.6Å; N424-Y427 PolarHBondContact O-N 3.03Å; Y427-T430 WeakPolarHBondContact O-CA 3.17Å; Y427-T430 PolarHBondContact O-N 3.38Å; Y427-T430 PolarHBondContact O-OG1 3.18Å; Y427-L431 CarbonylContact C-O 3.59Å; Y427-L431 PolarHBondContact O-N 3.04Å; Y427-L431 VanDerWaalsContact O-N 3.08Å; Y427-L433 HydrophobicContact CD2-CD1 3.55Å; Y427-L433 HydrophobicContact CE2-CD1 4.12Å; Y427-L433 HydrophobicContact CG-CD1 4.44Å
428	M	82.3	Confident	89.9	Confident	96 Å²	96	69.5 Å²	69.5	47%	0.473	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	145.2	167.9	-82.1	-76.1	176.3	0	0	110.9	N424 T430 H432	N424-M428 HydrophobicContact CB-CG 4.45Å; N424-M428 WeakPolarHBondContact O-CB 3.39Å; N424-M428 WeakPolarHBondContact O-CG 3.31Å; N424-M428 PolarHBondContact O-N 3.42Å; M428-T430 VanDerWaalsContact C-N 3.34Å; M428-H432 HydrophobicContact CE-CB 3.73Å; M428-H432 WeakPolarHBondContact CE-ND1 3.46Å
429	P	81.5	Confident	89.8	Confident	99 Å²	99	69.7 Å²	69.7	64%	0.643	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	cis	-87.1	9.1	-3	36.7	-36.6	0	0	0	113.5	Q464	P429-Q464 PolarHBondContact O-NE2 3.36Å
430	T	86.1	Confident	89.8	Confident	78 Å²	78	71.7 Å²	71.7	48%	0.479	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-40.8	-170.5	67.5	0	0	0	0	113.5	Y427 M428 N463	Y427-T430 WeakPolarHBondContact O-CA 3.17Å; Y427-T430 PolarHBondContact O-N 3.38Å; Y427-T430 PolarHBondContact O-OG1 3.18Å; M428-T430 VanDerWaalsContact C-N 3.34Å; T430-N463 PolarHBondContact O-OD1 3.22Å
431	L	86.6	Confident	89.9	Confident	50 Å²	50	70.6 Å²	70.6	26%	0.262	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	134.3	-179.5	-58.3	175	0	0	0	109.1	Y427 V461 N463	Y427-L431 CarbonylContact C-O 3.59Å; Y427-L431 PolarHBondContact O-N 3.04Å; Y427-L431 VanDerWaalsContact O-N 3.08Å; L431-V461 HydrophobicContact CB-CG1 4.11Å; L431-V461 HydrophobicContact CD1-CG1 3.94Å; L431-V461 HydrophobicContact CD2-CG1 3.73Å; L431-V461 HydrophobicContact CG-CG1 4.14Å; L431-N463 HydrophobicContact CD2-CB 4.1Å
432	H	88.7	Confident	90	Very high	71 Å²	71	68.9 Å²	68.9	33%	0.329	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	129.3	168.1	178.5	40.9	0	0	0	109.1	N424 M428 K434 V462	N424-H432 PolarHBondContact OD1-ND1 2.96Å; M428-H432 HydrophobicContact CE-CB 3.73Å; M428-H432 WeakPolarHBondContact CE-ND1 3.46Å; H432-K434 VanDerWaalsContact NE2-CE 3.27Å; H432-K434 WeakPolarHBondContact NE2-CE 3.31Å; H432-V462 PolarHBondContact N-O 3.43Å; H432-V462 PolarHBondContact O-N 3.18Å
433	L	88.9	Confident	90.2	Very high	5 Å²	5	65.4 Å²	65.4	3%	0.026	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	122.8	-177	-64.5	170.5	0	0	0	109.5	L423 N424 Y427 V461	L423-L433 HydrophobicContact CB-CD1 3.76Å; N424-L433 PolarHBondContact ND2-O 3.24Å; N424-L433 PolarHBondContact OD1-N 3.34Å; N424-L433 PolarHBondContact OD1-O 2.66Å; Y427-L433 HydrophobicContact CD2-CD1 3.55Å; Y427-L433 HydrophobicContact CE2-CD1 4.12Å; Y427-L433 HydrophobicContact CG-CD1 4.44Å; L433-V461 HydrophobicContact CD2-CB 4.21Å; L433-V461 HydrophobicContact CD2-CG1 4.36Å; L433-V461 HydrophobicContact CD2-CG2 3.6Å
434	K	88.1	Confident	90.2	Very high	102 Å²	102	67 Å²	67	44%	0.443	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	143.8	172.7	-62.8	-174.3	177.9	-174.2	0	110.3	H432 L459 E460	H432-K434 VanDerWaalsContact NE2-CE 3.27Å; H432-K434 WeakPolarHBondContact NE2-CE 3.31Å; K434-L459 CarbonylContact O-C 3.56Å; K434-L459 VanDerWaalsContact O-CA 3.27Å; K434-L459 WeakPolarHBondContact O-CA 3.29Å; K434-E460 HydrophobicContact CB-CB 4.38Å; K434-E460 PolarHBondContact N-O 3.27Å; K434-E460 PolarHBondContact O-N 3.07Å
435	K	87.3	Confident	90.2	Very high	74 Å²	74	71.4 Å²	71.4	32%	0.322	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	137.6	170.8	-171.6	-175.2	171.4	-173.8	0	110.3	E389 I416 I420	E389-K435 WeakPolarHBondContact OE1-CE 3.38Å; E389-K435 IonicContact OE1-NZ 2.68Å; E389-K435 PolarHBondContact OE1-NZ 2.94Å; E389-K435 WeakPolarHBondContact OE2-CE 3.49Å; E389-K435 IonicContact OE2-NZ 3.87Å; E389-K435 PolarHBondContact OE2-NZ 2.88Å; I416-K435 HydrophobicContact CG2-CD 3.79Å; I420-K435 HydrophobicContact CD1-CB 3.67Å; I420-K435 HydrophobicContact CD1-CD 4.13Å; I420-K435 HydrophobicContact CD1-CG 4.15Å; I420-K435 HydrophobicContact CG1-CB 4.49Å
436	Q	88.4	Confident	90.2	Very high	87 Å²	87	65.5 Å²	65.5	41%	0.407	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	-55	158.2	-64.4	-172	-45.2	0	0	109.9	Q458 E460 S470	Q436-Q458 HydrophobicContact CB-CB 4.4Å; Q436-Q458 HydrophobicContact CB-CG 4.26Å; Q436-Q458 PolarHBondContact N-O 3.02Å; Q436-E460 HydrophobicContact CG-CB 3.95Å; Q436-S470 VanDerWaalsContact OE1-CB 3.31Å; Q436-S470 PolarHBondContact OE1-OG 3.46Å
437	Q	92.4	Very high	90.1	Very high	110 Å²	110	61.9 Å²	61.9	51%	0.514	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	148.7	-176.8	-166.8	-178.8	-14.8	0	0	111.6	Q458	Q437-Q458 PolarHBondContact N-O 2.89Å; Q437-Q458 PolarHBondContact O-N 2.71Å
438	L	93.4	Very high	90	Very high	6 Å²	6	60.8 Å²	60.8	3%	0.031	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	120.7	159.7	179.4	68.7	0	0	0	110.1	F387 E389 I416 N440 L455 L457	F387-L438 HydrophobicContact CD2-CD2 4.06Å; F387-L438 HydrophobicContact CE2-CD2 3.79Å; E389-L438 HydrophobicContact CG-CB 3.72Å; E389-L438 HydrophobicContact CG-CD2 4.27Å; E389-L438 WeakPolarHBondContact OE1-CB 3.02Å; E389-L438 PolarHBondContact OE1-N 3.47Å; I416-L438 HydrophobicContact CD1-CB 4.38Å; I416-L438 HydrophobicContact CD1-CD2 4.12Å; L438-N440 WeakPolarHBondContact CD1-O 3.01Å; L438-L455 HydrophobicContact CD1-CB 4.03Å; L438-L455 HydrophobicContact CD1-CD2 3.99Å; L438-L455 HydrophobicContact CD1-CG 4.46Å; L438-L457 HydrophobicContact CB-CD2 4.38Å; L438-L457 HydrophobicContact CD1-CD2 3.73Å
439	I	94.1	Very high	90.3	Very high	66 Å²	66	56.7 Å²	56.7	34%	0.338	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	-51.3	176.5	-52.9	175.7	0	0	0	110	D456 Q458 T472	I439-D456 HydrophobicContact CB-CB 4.19Å; I439-D456 WeakPolarHBondContact CB-O 3Å; I439-D456 PolarHBondContact N-O 2.97Å; I439-Q458 HydrophobicContact CD1-CB 4.1Å; I439-Q458 HydrophobicContact CG1-CB 4.13Å; I439-T472 HydrophobicContact CD1-CG2 3.66Å
440	N	94.9	Very high	90.8	Very high	41 Å²	41	52 Å²	52	22%	0.219	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	128.4	177.5	-56.1	-57	0	0	0	109.9	Y386 L438 Y442 L455 D456	Y386-N440 HydrophobicContact CE2-CB 3.9Å; L438-N440 WeakPolarHBondContact CD1-O 3.01Å; N440-Y442 HydrophobicContact CB-CD2 4.36Å; N440-Y442 HydrophobicContact CB-CE2 3.63Å; N440-L455 WeakPolarHBondContact O-CA 3.43Å; N440-D456 HydrophobicContact CB-CB 4.03Å; N440-D456 PolarHBondContact N-O 3.41Å; N440-D456 PolarHBondContact ND2-OD2 2.77Å; N440-D456 PolarHBondContact O-N 2.72Å
441	G	96.2	Very high	91.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	132.7	163.9	0	0	0	0	0	110.9	Y386 F387	Y386-G441 WeakPolarHBondContact CA-O 3.44Å; Y386-G441 VanDerWaalsContact CD2-O 3.22Å; Y386-G441 WeakPolarHBondContact CD2-O 3.32Å; F387-G441 VanDerWaalsContact CE1-C 3.45Å; F387-G441 PolarHBondContact N-O 3.02Å; F387-G441 WeakPolarHBondContact O-CA 3.43Å; F387-G441 PolarHBondContact O-N 2.97Å
442	Y	96.2	Very high	91.5	Very high	77 Å²	77	48.7 Å²	48.7	30%	0.302	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	131.3	168.2	-56.6	-86.2	0	0	0	109.4	E385 Y386 N440 Y453 T454	E385-Y442 CarbonylContact O-C 3.48Å; E385-Y442 VanDerWaalsContact O-CA 3.3Å; E385-Y442 WeakPolarHBondContact O-CA 3.29Å; Y386-Y442 AromaticContact CD2-CD1 3.94Å; Y386-Y442 HydrophobicContact CD2-CD1 3.94Å; Y386-Y442 AromaticContact CD2-CE1 3.52Å; Y386-Y442 HydrophobicContact CD2-CE1 3.52Å; Y386-Y442 AromaticContact CD2-CZ 3.85Å; Y386-Y442 HydrophobicContact CE2-CE1 4.35Å; Y386-Y442 HydrophobicContact CG-CE1 4.3Å; N440-Y442 HydrophobicContact CB-CD2 4.36Å; N440-Y442 HydrophobicContact CB-CE2 3.63Å; Y442-Y453 CarbonylContact O-C 3.55Å; Y442-Y453 VanDerWaalsContact O-CA 3.31Å; Y442-Y453 WeakPolarHBondContact O-CA 3.46Å; Y442-T454 HydrophobicContact CD2-CG2 4.49Å; Y442-T454 PolarHBondContact N-O 2.85Å; Y442-T454 PolarHBondContact O-N 2.85Å
443	R	94.5	Very high	91.8	Very high	22 Å²	22	45.5 Å²	45.5	8%	0.083	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	152.1	172.8	67.4	-176.4	-164.3	177.6	3.7	112.1	W384 E385 F387 D408 M451 E452 Y453	W384-R443 VanDerWaalsContact CE3-C 3.43Å; E385-R443 HydrophobicContact CB-CG 3.96Å; E385-R443 PolarHBondContact N-O 2.85Å; E385-R443 PolarHBondContact O-N 3.37Å; E385-R443 IonicContact OE2-CZ 2.92Å; E385-R443 IonicContact OE2-NE 3.21Å; E385-R443 PolarHBondContact OE2-NE 2.81Å; E385-R443 IonicContact OE2-NH2 2.65Å; E385-R443 PolarHBondContact OE2-NH2 2.69Å; F387-R443 HydrophobicContact CD1-CB 4.29Å; F387-R443 HydrophobicContact CD1-CG 4.05Å; F387-R443 HydrophobicContact CE1-CB 3.83Å; F387-R443 HydrophobicContact CE1-CG 4.08Å; D408-R443 IonicContact OD1-CZ 3.79Å; D408-R443 IonicContact OD1-NH1 3.14Å; D408-R443 PolarHBondContact OD1-NH1 2.67Å; D408-R443 IonicContact OD1-NH2 3.4Å; D408-R443 PolarHBondContact OD1-NH2 2.99Å; R443-M451 HydrophobicContact CB-CE 4.04Å; R443-M451 HydrophobicContact CG-CE 4.23Å; R443-E452 CarbonylContact C-O 3.57Å; R443-E452 VanDerWaalsContact CA-O 3.25Å; R443-E452 WeakPolarHBondContact CA-O 3.47Å; R443-Y453 HydrophobicContact CB-CD1 3.74Å; R443-Y453 HydrophobicContact CB-CE1 3.86Å
444	R	92.8	Very high	92.2	Very high	48 Å²	48	46 Å²	46	18%	0.181	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	147	164.9	64.1	174.6	174	167.5	7.4	110.6	W384 E452	W384-R444 HydrophobicContact CD2-CB 4.08Å; W384-R444 HydrophobicContact CD2-CG 3.97Å; W384-R444 VanDerWaalsContact CE2-CD 3.44Å; W384-R444 HydrophobicContact CE3-CB 3.97Å; W384-R444 HydrophobicContact CE3-CG 3.88Å; W384-R444 HydrophobicContact CH2-CG 3.8Å; W384-R444 HydrophobicContact CZ2-CG 3.89Å; W384-R444 HydrophobicContact CZ3-CB 4.31Å; W384-R444 HydrophobicContact CZ3-CG 3.8Å; R444-E452 HydrophobicContact CG-CB 3.96Å; R444-E452 HydrophobicContact CG-CG 4.45Å; R444-E452 IonicContact CZ-OE1 2.86Å; R444-E452 IonicContact CZ-OE2 3.2Å; R444-E452 PolarHBondContact N-O 3.01Å; R444-E452 IonicContact NE-OE1 3.84Å; R444-E452 IonicContact NE-OE2 2.71Å; R444-E452 PolarHBondContact NE-OE2 3.46Å; R444-E452 IonicContact NH2-OE1 3.72Å; R444-E452 PolarHBondContact NH2-OE1 3.36Å; R444-E452 IonicContact NH2-OE2 3.83Å; R444-E452 PolarHBondContact NH2-OE2 3.16Å; R444-E452 PolarHBondContact O-N 3.25Å
445	F	92.7	Very high	92.6	Very high	114 Å²	114	41.2 Å²	41.2	50%	0.5	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	126.2	166.9	-175.6	-109.5	0	0	0	109.4	P447 M451 L481	F445-P447 HydrophobicContact CE1-CB 4.33Å; F445-M451 HydrophobicContact CB-SD 3.6Å; F445-M451 HydrophobicContact CD2-CG 4.05Å; F445-M451 HydrophobicContact CD2-SD 3.69Å; F445-M451 HydrophobicContact CG-SD 4.14Å; F445-L481 HydrophobicContact CE2-CD2 4.02Å; F445-L481 HydrophobicContact CZ-CD2 4.24Å
446	D	91.6	Very high	93	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	118.6	172.6	177.9	-19.6	0	0	0	108.7	P372 F373 L382 T448 R449 G450	P372-D446 WeakPolarHBondContact CA-OD2 3.38Å; F373-D446 WeakPolarHBondContact CB-OD1 3.37Å; F373-D446 PolarHBondContact N-OD2 2.64Å; L382-D446 HydrophobicContact CD1-CB 4.01Å; D446-T448 PolarHBondContact O-N 3.02Å; D446-T448 VanDerWaalsContact O-N 3.16Å; D446-T448 PolarHBondContact OD1-N 2.04Å; D446-T448 PolarHBondContact OD1-OG1 3.02Å; D446-R449 HydrophobicContact CB-CG 3.82Å; D446-R449 PolarHBondContact O-N 3.34Å; D446-R449 WeakPolarHBondContact OD2-CD 3.49Å; D446-G450 PolarHBondContact N-O 3.5Å; D446-G450 WeakPolarHBondContact O-CA 3.45Å; D446-G450 PolarHBondContact O-N 2.78Å
447	P	87.9	Confident	93.3	Very high	78 Å²	78	34.5 Å²	34.5	51%	0.506	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-16	-173.1	29.5	-36.9	0	0	0	114	F445 L481	F445-P447 HydrophobicContact CE1-CB 4.33Å; P447-L481 WeakPolarHBondContact O-CD1 3.41Å
448	T	86.6	Confident	93.5	Very high	53 Å²	53	32.1 Å²	32.1	33%	0.325	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-25.7	178.4	68.2	0	0	0	0	112.7	N370 P371 F373 D446	N370-T448 WeakPolarHBondContact CB-O 3.27Å; N370-T448 PolarHBondContact ND2-O 2.94Å; P371-T448 PolarHBondContact O-OG1 3.36Å; P371-T448 VanDerWaalsContact O-OG1 3.05Å; F373-T448 HydrophobicContact CB-CG2 4.27Å; F373-T448 HydrophobicContact CD2-CG2 4.31Å; D446-T448 PolarHBondContact O-N 3.02Å; D446-T448 VanDerWaalsContact O-N 3.16Å; D446-T448 PolarHBondContact OD1-N 2.04Å; D446-T448 PolarHBondContact OD1-OG1 3.02Å
449	R	88.5	Confident	93.5	Very high	10 Å²	10	31.9 Å²	31.9	4%	0.038	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.1	-26.9	-169.1	77.5	-170.7	-39.4	-146.7	-1.9	115.6	W365 V369 N370 D446 E452 P480 L481	W365-R449 PolarHBondContact O-NH2 3.16Å; V369-R449 HydrophobicContact CG1-CB 4.01Å; N370-R449 HydrophobicContact CB-CB 4.33Å; N370-R449 PolarHBondContact O-NE 3.37Å; N370-R449 PolarHBondContact O-NH2 3.07Å; D446-R449 HydrophobicContact CB-CG 3.82Å; D446-R449 PolarHBondContact O-N 3.34Å; D446-R449 WeakPolarHBondContact OD2-CD 3.49Å; R449-E452 WeakPolarHBondContact CD-OE1 3.35Å; R449-E452 IonicContact CZ-OE1 2.82Å; R449-E452 IonicContact NE-OE1 3.08Å; R449-E452 IonicContact NH1-OE1 3.96Å; R449-E452 PolarHBondContact NH1-OE1 3.27Å; R449-P480 CarbonylContact O-C 3.27Å; R449-P480 WeakPolarHBondContact O-CA 3.07Å; R449-L481 PolarHBondContact O-N 2.87Å
450	G	91.9	Very high	93.5	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.01	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	117.4	-153.7	-177.4	0	0	0	0	0	113.9	D446	D446-G450 PolarHBondContact N-O 3.5Å; D446-G450 WeakPolarHBondContact O-CA 3.45Å; D446-G450 PolarHBondContact O-N 2.78Å
451	M	92.9	Very high	93.3	Very high	40 Å²	40	30.3 Å²	30.3	20%	0.197	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	126.4	-178.4	-73	-68.7	-69.3	0	0	111.1	R443 F445 Y453 V478 R479	R443-M451 HydrophobicContact CB-CE 4.04Å; R443-M451 HydrophobicContact CG-CE 4.23Å; F445-M451 HydrophobicContact CB-SD 3.6Å; F445-M451 HydrophobicContact CD2-CG 4.05Å; F445-M451 HydrophobicContact CD2-SD 3.69Å; F445-M451 HydrophobicContact CG-SD 4.14Å; M451-Y453 HydrophobicContact CB-CD2 4.5Å; M451-Y453 HydrophobicContact CB-CE2 3.53Å; M451-Y453 HydrophobicContact CE-CE1 4.22Å; M451-V478 CarbonylContact O-C 3.5Å; M451-V478 WeakPolarHBondContact O-CA 3.44Å; M451-R479 HydrophobicContact CB-CB 4.23Å; M451-R479 PolarHBondContact N-O 3.19Å; M451-R479 PolarHBondContact O-N 3.2Å
452	E	93.9	Very high	93	Very high	17 Å²	17	31.9 Å²	31.9	8%	0.079	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	142.6	169.6	-62.3	-169.8	178.3	0	0	111.5	W384 R443 R444 R449 V478	W384-E452 HydrophobicContact CH2-CB 4Å; W384-E452 WeakPolarHBondContact CH2-OE2 3.29Å; W384-E452 HydrophobicContact CZ3-CB 4.44Å; R443-E452 CarbonylContact C-O 3.57Å; R443-E452 VanDerWaalsContact CA-O 3.25Å; R443-E452 WeakPolarHBondContact CA-O 3.47Å; R444-E452 HydrophobicContact CG-CB 3.96Å; R444-E452 HydrophobicContact CG-CG 4.45Å; R444-E452 IonicContact CZ-OE1 2.86Å; R444-E452 IonicContact CZ-OE2 3.2Å; R444-E452 PolarHBondContact N-O 3.01Å; R444-E452 IonicContact NE-OE1 3.84Å; R444-E452 IonicContact NE-OE2 2.71Å; R444-E452 PolarHBondContact NE-OE2 3.46Å; R444-E452 IonicContact NH2-OE1 3.72Å; R444-E452 PolarHBondContact NH2-OE1 3.36Å; R444-E452 IonicContact NH2-OE2 3.83Å; R444-E452 PolarHBondContact NH2-OE2 3.16Å; R444-E452 PolarHBondContact O-N 3.25Å; R449-E452 WeakPolarHBondContact CD-OE1 3.35Å; R449-E452 IonicContact CZ-OE1 2.82Å; R449-E452 IonicContact NE-OE1 3.08Å; R449-E452 IonicContact NH1-OE1 3.96Å; R449-E452 PolarHBondContact NH1-OE1 3.27Å; E452-V478 HydrophobicContact CG-CG2 4.26Å
453	Y	95.6	Very high	92.6	Very high	5 Å²	5	31.9 Å²	31.9	2%	0.02	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	140.6	175.8	-53.7	-99.8	0	0	0	111.2	F387 D411 V415 Y442 R443 M451 H476 L477 R479	F387-Y453 HydrophobicContact CE1-CD1 4.38Å; F387-Y453 HydrophobicContact CZ-CD1 4.3Å; D411-Y453 PolarHBondContact OD1-OH 3.2Å; D411-Y453 WeakPolarHBondContact OD2-CE1 3.23Å; D411-Y453 PolarHBondContact OD2-OH 3Å; V415-Y453 HydrophobicContact CB-CD1 4.49Å; V415-Y453 HydrophobicContact CG1-CD1 3.84Å; V415-Y453 HydrophobicContact CG1-CD2 4.05Å; V415-Y453 HydrophobicContact CG1-CE1 4.35Å; V415-Y453 HydrophobicContact CG1-CG 3.68Å; V415-Y453 HydrophobicContact CG2-CD1 4.23Å; V415-Y453 HydrophobicContact CG2-CD2 4.24Å; V415-Y453 HydrophobicContact CG2-CE1 3.91Å; V415-Y453 HydrophobicContact CG2-CE2 3.95Å; V415-Y453 HydrophobicContact CG2-CG 4.39Å; Y442-Y453 CarbonylContact O-C 3.55Å; Y442-Y453 VanDerWaalsContact O-CA 3.31Å; Y442-Y453 WeakPolarHBondContact O-CA 3.46Å; R443-Y453 HydrophobicContact CB-CD1 3.74Å; R443-Y453 HydrophobicContact CB-CE1 3.86Å; M451-Y453 HydrophobicContact CB-CD2 4.5Å; M451-Y453 HydrophobicContact CB-CE2 3.53Å; M451-Y453 HydrophobicContact CE-CE1 4.22Å; Y453-H476 WeakPolarHBondContact O-CA 3.4Å; Y453-L477 PolarHBondContact N-O 3.4Å; Y453-L477 PolarHBondContact O-N 2.9Å; Y453-R479 HydrophobicContact CE2-CB 4.21Å
454	T	96.3	Very high	92	Very high	16 Å²	16	37.6 Å²	37.6	10%	0.098	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	115.2	166.5	-63.6	0	0	0	0	108.3	Y442 R474 V475 H476	Y442-T454 HydrophobicContact CD2-CG2 4.49Å; Y442-T454 PolarHBondContact N-O 2.85Å; Y442-T454 PolarHBondContact O-N 2.85Å; T454-R474 HydrophobicContact CG2-CG 3.95Å; T454-V475 WeakPolarHBondContact CA-O 3.49Å; T454-H476 PolarHBondContact OG1-CE1 3.13Å; T454-H476 PolarHBondContact OG1-ND1 3.47Å
455	L	96.5	Very high	91.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	128.2	-178.9	-54.8	-174.9	0	0	0	110.5	F387 V415 I416 A419 L438 N440 L457 R474 V475	F387-L455 HydrophobicContact CE2-CD2 4.14Å; F387-L455 HydrophobicContact CZ-CD2 3.64Å; V415-L455 HydrophobicContact CG1-CD1 4.11Å; I416-L455 HydrophobicContact CG1-CD1 4.11Å; A419-L455 HydrophobicContact CB-CD1 4.08Å; L438-L455 HydrophobicContact CD1-CB 4.03Å; L438-L455 HydrophobicContact CD1-CD2 3.99Å; L438-L455 HydrophobicContact CD1-CG 4.46Å; N440-L455 WeakPolarHBondContact O-CA 3.43Å; L455-L457 HydrophobicContact CB-CD2 4.36Å; L455-L457 HydrophobicContact CB-CG 4.08Å; L455-L457 HydrophobicContact CD1-CD1 4.45Å; L455-L457 HydrophobicContact CD1-CD2 4.39Å; L455-R474 CarbonylContact O-C 3.58Å; L455-R474 VanDerWaalsContact O-CA 3.28Å; L455-R474 WeakPolarHBondContact O-CA 3.39Å; L455-V475 PolarHBondContact N-O 2.7Å; L455-V475 PolarHBondContact O-N 2.93Å
456	D	96.3	Very high	90.9	Very high	21 Å²	21	41 Å²	41	11%	0.112	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	100.4	163.4	-70.4	-34.1	0	0	0	108.9	I439 N440 R474	I439-D456 HydrophobicContact CB-CB 4.19Å; I439-D456 WeakPolarHBondContact CB-O 3Å; I439-D456 PolarHBondContact N-O 2.97Å; N440-D456 HydrophobicContact CB-CB 4.03Å; N440-D456 PolarHBondContact N-O 3.41Å; N440-D456 PolarHBondContact ND2-OD2 2.77Å; N440-D456 PolarHBondContact O-N 2.72Å; D456-R474 WeakPolarHBondContact OD1-CB 3.49Å; D456-R474 IonicContact OD1-CZ 2.81Å; D456-R474 IonicContact OD1-NE 3.85Å; D456-R474 PolarHBondContact OD1-NE 3.21Å; D456-R474 IonicContact OD1-NH2 3.28Å; D456-R474 PolarHBondContact OD1-NH2 2.96Å; D456-R474 IonicContact OD2-CZ 3.05Å; D456-R474 IonicContact OD2-NE 3.74Å; D456-R474 IonicContact OD2-NH2 3.19Å; D456-R474 PolarHBondContact OD2-NH2 3.17Å
457	L	95.1	Very high	90.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	135	-177.1	-64.3	173	0	0	0	111.5	I416 A419 L438 L455 L459 T472 K473 V475	I416-L457 HydrophobicContact CG2-CD2 4.41Å; A419-L457 HydrophobicContact CB-CD1 3.82Å; L438-L457 HydrophobicContact CB-CD2 4.38Å; L438-L457 HydrophobicContact CD1-CD2 3.73Å; L455-L457 HydrophobicContact CB-CD2 4.36Å; L455-L457 HydrophobicContact CB-CG 4.08Å; L455-L457 HydrophobicContact CD1-CD1 4.45Å; L455-L457 HydrophobicContact CD1-CD2 4.39Å; L457-L459 HydrophobicContact CB-CD1 4.49Å; L457-L459 HydrophobicContact CB-CD2 3.97Å; L457-L459 HydrophobicContact CB-CG 4.05Å; L457-L459 HydrophobicContact CD1-CD2 4.45Å; L457-T472 CarbonylContact O-C 3.5Å; L457-T472 WeakPolarHBondContact O-CA 3.47Å; L457-K473 PolarHBondContact N-O 2.92Å; L457-K473 PolarHBondContact O-N 2.95Å; L457-V475 HydrophobicContact CD1-CG2 4.15Å
458	Q	95.4	Very high	90.6	Very high	59 Å²	59	47.4 Å²	47.4	28%	0.276	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	122.9	162.1	-166.7	171.1	1	0	0	109.2	Q436 Q437 I439 S470 I471	Q436-Q458 HydrophobicContact CB-CB 4.4Å; Q436-Q458 HydrophobicContact CB-CG 4.26Å; Q436-Q458 PolarHBondContact N-O 3.02Å; Q437-Q458 PolarHBondContact N-O 2.89Å; Q437-Q458 PolarHBondContact O-N 2.71Å; I439-Q458 HydrophobicContact CD1-CB 4.1Å; I439-Q458 HydrophobicContact CG1-CB 4.13Å; Q458-S470 WeakPolarHBondContact CG-OG 2.95Å; Q458-S470 PolarHBondContact NE2-OG 3.34Å; Q458-I471 WeakPolarHBondContact CA-O 3.43Å
459	L	93.6	Very high	90.9	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	135.6	-170.4	-58.9	173.5	0	0	0	110.8	L423 K434 L457 S470 I471 K473	L423-L459 HydrophobicContact CD1-CD1 3.65Å; K434-L459 CarbonylContact O-C 3.56Å; K434-L459 VanDerWaalsContact O-CA 3.27Å; K434-L459 WeakPolarHBondContact O-CA 3.29Å; L457-L459 HydrophobicContact CB-CD1 4.49Å; L457-L459 HydrophobicContact CB-CD2 3.97Å; L457-L459 HydrophobicContact CB-CG 4.05Å; L457-L459 HydrophobicContact CD1-CD2 4.45Å; L459-S470 CarbonylContact O-C 3.57Å; L459-S470 WeakPolarHBondContact O-CA 3.43Å; L459-I471 HydrophobicContact CB-CG1 4.19Å; L459-I471 PolarHBondContact N-O 3.33Å; L459-I471 PolarHBondContact O-N 3.3Å; L459-K473 HydrophobicContact CD1-CB 3.99Å
460	E	93.3	Very high	91.1	Very high	55 Å²	55	55.8 Å²	55.8	26%	0.257	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	115.2	165.8	-172.3	175.3	-155.2	0	0	109.5	K434 Q436 V462 S468	K434-E460 HydrophobicContact CB-CB 4.38Å; K434-E460 PolarHBondContact N-O 3.27Å; K434-E460 PolarHBondContact O-N 3.07Å; Q436-E460 HydrophobicContact CG-CB 3.95Å; E460-V462 HydrophobicContact CG-CG2 4.28Å; E460-S468 WeakPolarHBondContact OE1-CB 3.46Å; E460-S468 PolarHBondContact OE1-OG 3Å
461	V	90.7	Very high	91.1	Very high	19 Å²	19	58.8 Å²	58.8	12%	0.115	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	109.8	174.3	-177.2	0	0	0	0	108.6	L431 L433 S468 R469 I471	L431-V461 HydrophobicContact CB-CG1 4.11Å; L431-V461 HydrophobicContact CD1-CG1 3.94Å; L431-V461 HydrophobicContact CD2-CG1 3.73Å; L431-V461 HydrophobicContact CG-CG1 4.14Å; L433-V461 HydrophobicContact CD2-CB 4.21Å; L433-V461 HydrophobicContact CD2-CG1 4.36Å; L433-V461 HydrophobicContact CD2-CG2 3.6Å; V461-S468 CarbonylContact O-C 3.27Å; V461-S468 WeakPolarHBondContact O-CA 3.22Å; V461-R469 WeakPolarHBondContact CB-O 3.31Å; V461-R469 PolarHBondContact N-O 3.39Å; V461-R469 PolarHBondContact O-N 3.46Å; V461-I471 HydrophobicContact CG2-CB 4.23Å; V461-I471 HydrophobicContact CG2-CD1 3.41Å; V461-I471 VanDerWaalsContact CG2-CD1 3.41Å; V461-I471 HydrophobicContact CG2-CG1 3.54Å; V461-I471 HydrophobicContact CG2-CG2 3.74Å
462	V	90.4	Very high	91.2	Very high	34 Å²	34	61.9 Å²	61.9	21%	0.206	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118.7	170.8	-173.2	0	0	0	0	108.8	H432 E460	H432-V462 PolarHBondContact N-O 3.43Å; H432-V462 PolarHBondContact O-N 3.18Å; E460-V462 HydrophobicContact CG-CG2 4.28Å
463	N	87.5	Confident	91.2	Very high	76 Å²	76	65.2 Å²	65.2	41%	0.406	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	161.3	175	-163.2	-18.1	0	0	0	110.4	T430 L431 K465 G466 H467	T430-N463 PolarHBondContact O-OD1 3.22Å; L431-N463 HydrophobicContact CD2-CB 4.1Å; N463-K465 PolarHBondContact O-N 2.8Å; N463-G466 PolarHBondContact O-N 3.42Å; N463-H467 PolarHBondContact N-O 2.83Å
464	Q	82.6	Confident	91.2	Very high	142 Å²	142	71.3 Å²	71.3	66%	0.664	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-23.4	179.2	-65	-178.2	-11.2	0	0	114.4	P429 G466	P429-Q464 PolarHBondContact O-NE2 3.36Å; Q464-G466 VanDerWaalsContact C-N 3.31Å
465	K	81.9	Confident	91.1	Very high	178 Å²	178	71.6 Å²	71.6	77%	0.774	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	8.7	176.3	-60.8	-175.5	179.5	-178.7	0	114.2	N463 H467	N463-K465 PolarHBondContact O-N 2.8Å; K465-H467 PolarHBondContact O-N 3.3Å
466	G	80.5	Confident	91	Very high	56 Å²	56	76 Å²	76	58%	0.577	38%	0.381	S	S	*	.	S	Bend	trans	75.4	-1	-179.6	0	0	0	0	0	115.5	N463 Q464 S468	N463-G466 PolarHBondContact O-N 3.42Å; Q464-G466 VanDerWaalsContact C-N 3.31Å; G466-S468 PolarHBondContact O-N 3.16Å
467	H	85.7	Confident	90.8	Very high	144 Å²	144	76.7 Å²	76.7	67%	0.667	39%	0.385	S	S	*	.			trans	-70.7	127.3	173.6	-68.7	-166.7	0	0	0	109.8	N463 K465	N463-H467 PolarHBondContact N-O 2.83Å; K465-H467 PolarHBondContact O-N 3.3Å
468	S	88.3	Confident	90.7	Very high	68 Å²	68	77.9 Å²	77.9	48%	0.476	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	148.4	174.2	81.1	0	0	0	0	113.4	E460 V461 G466	E460-S468 WeakPolarHBondContact OE1-CB 3.46Å; E460-S468 PolarHBondContact OE1-OG 3Å; V461-S468 CarbonylContact O-C 3.27Å; V461-S468 WeakPolarHBondContact O-CA 3.22Å; G466-S468 PolarHBondContact O-N 3.16Å
469	R	91.8	Very high	90.6	Very high	190 Å²	190	80.3 Å²	80.3	72%	0.717	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.3	132.2	175.1	-179.2	176	178.7	174.7	2.3	110.6	V461	V461-R469 WeakPolarHBondContact CB-O 3.31Å; V461-R469 PolarHBondContact N-O 3.39Å; V461-R469 PolarHBondContact O-N 3.46Å
470	S	92.3	Very high	90.4	Very high	50 Å²	50	83.8 Å²	83.8	35%	0.35	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	132.8	170.6	-168.2	0	0	0	0	111.2	Q436 Q458 L459	Q436-S470 VanDerWaalsContact OE1-CB 3.31Å; Q436-S470 PolarHBondContact OE1-OG 3.46Å; Q458-S470 WeakPolarHBondContact CG-OG 2.95Å; Q458-S470 PolarHBondContact NE2-OG 3.34Å; L459-S470 CarbonylContact O-C 3.57Å; L459-S470 WeakPolarHBondContact O-CA 3.43Å
471	I	93.4	Very high	90.1	Very high	64 Å²	64	85.5 Å²	85.5	33%	0.328	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	156.8	171.1	71.7	171.4	0	0	0	110.2	Q458 L459 V461	Q458-I471 WeakPolarHBondContact CA-O 3.43Å; L459-I471 HydrophobicContact CB-CG1 4.19Å; L459-I471 PolarHBondContact N-O 3.33Å; L459-I471 PolarHBondContact O-N 3.3Å; V461-I471 HydrophobicContact CG2-CB 4.23Å; V461-I471 HydrophobicContact CG2-CD1 3.41Å; V461-I471 VanDerWaalsContact CG2-CD1 3.41Å; V461-I471 HydrophobicContact CG2-CG1 3.54Å; V461-I471 HydrophobicContact CG2-CG2 3.74Å
472	T	94.1	Very high	89.6	Confident	104 Å²	104	89.5 Å²	89.5	64%	0.638	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	131.5	170.7	55.6	0	0	0	0	110	I439 L457	I439-T472 HydrophobicContact CD1-CG2 3.66Å; L457-T472 CarbonylContact O-C 3.5Å; L457-T472 WeakPolarHBondContact O-CA 3.47Å
473	K	93.3	Very high	89	Confident	88 Å²	88	95.4 Å²	95.4	38%	0.383	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	124.8	-179.9	-170.3	67.9	-175.5	-179	0	111.6	L457 L459	L457-K473 PolarHBondContact N-O 2.92Å; L457-K473 PolarHBondContact O-N 2.95Å; L459-K473 HydrophobicContact CD1-CB 3.99Å
474	R	95.6	Very high	88.3	Confident	133 Å²	133	99.6 Å²	99.6	50%	0.502	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	131.8	166	-173.7	163.8	-69.8	-174.2	-5	110.6	T454 L455 D456	T454-R474 HydrophobicContact CG2-CG 3.95Å; L455-R474 CarbonylContact O-C 3.58Å; L455-R474 VanDerWaalsContact O-CA 3.28Å; L455-R474 WeakPolarHBondContact O-CA 3.39Å; D456-R474 WeakPolarHBondContact OD1-CB 3.49Å; D456-R474 IonicContact OD1-CZ 2.81Å; D456-R474 IonicContact OD1-NE 3.85Å; D456-R474 PolarHBondContact OD1-NE 3.21Å; D456-R474 IonicContact OD1-NH2 3.28Å; D456-R474 PolarHBondContact OD1-NH2 2.96Å; D456-R474 IonicContact OD2-CZ 3.05Å; D456-R474 IonicContact OD2-NE 3.74Å; D456-R474 IonicContact OD2-NH2 3.19Å; D456-R474 PolarHBondContact OD2-NH2 3.17Å
475	V	94.3	Very high	87.7	Confident	22 Å²	22	100.6 Å²	100.6	13%	0.133	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	138.7	173	-170.5	0	0	0	0	108	A419 L423 T454 L455 L457 L477	A419-V475 HydrophobicContact CB-CG1 4.29Å; L423-V475 HydrophobicContact CD1-CG2 3.77Å; L423-V475 HydrophobicContact CD2-CG2 4.4Å; L423-V475 HydrophobicContact CG-CG2 4.28Å; T454-V475 WeakPolarHBondContact CA-O 3.49Å; L455-V475 PolarHBondContact N-O 2.7Å; L455-V475 PolarHBondContact O-N 2.93Å; L457-V475 HydrophobicContact CD1-CG2 4.15Å; V475-L477 HydrophobicContact CG1-CD2 4.22Å; V475-L477 HydrophobicContact CG1-CG 4.11Å
476	H	93.9	Very high	87.3	Confident	91 Å²	91	99.6 Å²	99.6	42%	0.421	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	137.6	169.5	-60	-77.4	0	0	0	107.9	W365 Y453 T454	W365-H476 HydrophobicContact CH2-CB 3.44Å; W365-H476 VanDerWaalsContact CH2-CB 3.44Å; W365-H476 WeakPolarHBondContact CH2-O 3.32Å; W365-H476 HydrophobicContact CZ2-CB 4.2Å; W365-H476 HydrophobicContact CZ3-CB 3.87Å; Y453-H476 WeakPolarHBondContact O-CA 3.4Å; T454-H476 PolarHBondContact OG1-CE1 3.13Å; T454-H476 PolarHBondContact OG1-ND1 3.47Å
477	L	93.8	Very high	86.6	Confident	36 Å²	36	103 Å²	103	19%	0.188	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	152.8	178.6	-64.4	170.1	0	0	0	109.6	V415 A419 Y453 V475	V415-L477 HydrophobicContact CG1-CD1 3.61Å; V415-L477 WeakPolarHBondContact O-CD1 3.36Å; A419-L477 HydrophobicContact CB-CD1 3.92Å; Y453-L477 PolarHBondContact N-O 3.4Å; Y453-L477 PolarHBondContact O-N 2.9Å; V475-L477 HydrophobicContact CG1-CD2 4.22Å; V475-L477 HydrophobicContact CG1-CG 4.11Å
478	V	92.9	Very high	85.7	Confident	25 Å²	25	101.5 Å²	101.5	15%	0.152	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	124.7	172.4	-175.9	0	0	0	0	107.4	W365 P366 V369 M451 E452 P480	W365-V478 HydrophobicContact CH2-CG2 4.14Å; W365-V478 HydrophobicContact CZ3-CG2 3.89Å; P366-V478 HydrophobicContact CG-CB 4.2Å; P366-V478 HydrophobicContact CG-CG2 4.24Å; V369-V478 HydrophobicContact CG1-CG1 4.46Å; M451-V478 CarbonylContact O-C 3.5Å; M451-V478 WeakPolarHBondContact O-CA 3.44Å; E452-V478 HydrophobicContact CG-CG2 4.26Å; V478-P480 WeakPolarHBondContact O-CD 3.41Å
479	R	92.3	Very high	84.6	Confident	110 Å²	110	103.5 Å²	103.5	42%	0.415	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	98.5	169.3	-177.6	-176.5	-162.7	134.6	20.6	106.3	D411 E414 M451 Y453	D411-R479 IonicContact OD1-NH1 2.67Å; D411-R479 PolarHBondContact OD1-NH1 2.84Å; E414-R479 IonicContact OE1-CZ 2.76Å; E414-R479 IonicContact OE1-NH1 3.84Å; E414-R479 IonicContact OE1-NH2 3.8Å; E414-R479 PolarHBondContact OE1-NH2 3.22Å; E414-R479 VanDerWaalsContact OE1-NH2 3.08Å; E414-R479 IonicContact OE2-CZ 2.7Å; E414-R479 VanDerWaalsContact OE2-CZ 3.31Å; E414-R479 IonicContact OE2-NH1 3.44Å; E414-R479 PolarHBondContact OE2-NH1 3.07Å; E414-R479 IonicContact OE2-NH2 2.72Å; E414-R479 PolarHBondContact OE2-NH2 3.1Å; M451-R479 HydrophobicContact CB-CB 4.23Å; M451-R479 PolarHBondContact N-O 3.19Å; M451-R479 PolarHBondContact O-N 3.2Å; Y453-R479 HydrophobicContact CE2-CB 4.21Å
480	P	90.6	Very high	83.8	Confident	75 Å²	75	97.1 Å²	97.1	49%	0.487	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	153.4	-172.7	27.6	-34.6	0	0	0	111.6	V369 R449 V478	V369-P480 HydrophobicContact CG1-CB 4.41Å; V369-P480 HydrophobicContact CG2-CB 4.32Å; R449-P480 CarbonylContact O-C 3.27Å; R449-P480 WeakPolarHBondContact O-CA 3.07Å; V478-P480 WeakPolarHBondContact O-CD 3.41Å
481	L	87	Confident	82.9	Confident	91 Å²	91	104.7 Å²	104.7	48%	0.476	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-61.6	135.7	166.1	-67	174.1	0	0	0	109.6	F445 P447 R449	F445-L481 HydrophobicContact CE2-CD2 4.02Å; F445-L481 HydrophobicContact CZ-CD2 4.24Å; P447-L481 WeakPolarHBondContact O-CD1 3.41Å; R449-L481 PolarHBondContact O-N 2.87Å
482	S	80.3	Confident	82.1	Confident	103 Å²	103	103 Å²	103	72%	0.72	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-68	168.8	169	61.8	0	0	0	0	110.7
483	L	76.3	Confident	81.3	Confident	157 Å²	157	100 Å²	100	82%	0.822	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-58.8	149.3	164.2	-64.5	174.6	0	0	0	109.8	E485	L483-E485 PolarHBondContact O-N 3.1Å; L483-E485 VanDerWaalsContact O-N 3.15Å
484	I	73.4	Confident	80.6	Confident	164 Å²	164	101.5 Å²	101.5	84%	0.841	52%	0.515	S	S	*	.			trans	-74.2	105.5	179.1	-59.9	171.6	0	0	0	108.1
485	E	71.1	Confident	80.1	Confident	164 Å²	164	98.9 Å²	98.9	77%	0.766	52%	0.522	S	S	*	.			trans	-85.6	121.5	173.2	-67.6	-176	-176.1	0	0	110.3	L483 I487	L483-E485 PolarHBondContact O-N 3.1Å; L483-E485 VanDerWaalsContact O-N 3.15Å; E485-I487 PolarHBondContact O-N 3Å
486	I	72.9	Confident	79.9	Confident	157 Å²	157	99.3 Å²	99.3	81%	0.805	53%	0.525	S	S	*	.			trans	-82.9	96.5	172.7	-57.6	176.6	0	0	0	107.6	P488	I486-P488 VanDerWaalsContact O-CD 3.28Å; I486-P488 WeakPolarHBondContact O-CD 3.44Å
487	I	66.1	Low	79.8	Confident	126 Å²	126	100.3 Å²	100.3	65%	0.646	53%	0.525	S	S	*	.			trans	-70.5	116.1	173.3	-57.7	176.3	0	0	0	108.3	E485 M489	E485-I487 PolarHBondContact O-N 3Å; I487-M489 PolarHBondContact O-N 3Å; I487-M489 VanDerWaalsContact O-N 3.07Å
488	P	66.3	Low	79.9	Confident	113 Å²	113	98.6 Å²	98.6	73%	0.734	52%	0.516	S	S	*	.			trans	-72.5	105.3	179.4	29.4	-33.2	0	0	0	109.8	I486	I486-P488 VanDerWaalsContact O-CD 3.28Å; I486-P488 WeakPolarHBondContact O-CD 3.44Å
489	M	64.3	Low	80.1	Confident	111 Å²	111	98.7 Å²	98.7	55%	0.547	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-68.4	142.3	173.2	-66.9	179	69.1	0	0	110.4	I487 I622	I487-M489 PolarHBondContact O-N 3Å; I487-M489 VanDerWaalsContact O-N 3.07Å; M489-I622 HydrophobicContact CE-CD1 3.75Å
490	P	75.9	Confident	80.2	Confident	55 Å²	55	93.4 Å²	93.4	36%	0.357	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-55.7	153	171.2	-24.4	34.5	0	0	0	111.7	V492 I622 W625	P490-V492 WeakPolarHBondContact O-CG2 3.32Å; P490-V492 PolarHBondContact O-N 2.59Å; P490-I622 HydrophobicContact CB-CG2 3.79Å; P490-I622 HydrophobicContact CG-CG2 3.94Å; P490-W625 HydrophobicContact CG-CB 4.41Å; P490-W625 HydrophobicContact CG-CD2 4.38Å; P490-W625 HydrophobicContact CG-CG 4.08Å
491	Y	73.2	Confident	80.5	Confident	210 Å²	210	89.9 Å²	89.9	82%	0.824	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-64.2	122.5	-178.1	179.5	-105.9	0	0	0	111.8	T493	Y491-T493 HydrophobicContact CD1-CG2 4.02Å; Y491-T493 HydrophobicContact CE1-CG2 3.22Å; Y491-T493 HydrophobicContact CE2-CG2 4.48Å; Y491-T493 WeakPolarHBondContact OH-CG2 3.35Å
492	V	76.4	Confident	80.9	Confident	27 Å²	27	85.6 Å²	85.6	16%	0.164	45%	0.449	C	S	.	.			trans	-117.9	151.8	179.6	-156.2	0	0	0	0	110.2	P490 R618 M619 I622	P490-V492 WeakPolarHBondContact O-CG2 3.32Å; P490-V492 PolarHBondContact O-N 2.59Å; V492-R618 WeakPolarHBondContact CG1-O 3.37Å; V492-M619 HydrophobicContact CB-CE 4.14Å; V492-M619 HydrophobicContact CB-SD 4.03Å; V492-M619 HydrophobicContact CG1-SD 4.07Å; V492-I622 HydrophobicContact CG2-CD1 3.76Å; V492-I622 HydrophobicContact CG2-CG1 3.86Å
493	T	76.6	Confident	81.4	Confident	42 Å²	42	81.7 Å²	81.7	26%	0.258	42%	0.421	S	S	.	.			trans	-136.7	138.7	179.4	67.7	0	0	0	0	113.6	Y491 A495 T496	Y491-T493 HydrophobicContact CD1-CG2 4.02Å; Y491-T493 HydrophobicContact CE1-CG2 3.22Å; Y491-T493 HydrophobicContact CE2-CG2 4.48Å; Y491-T493 WeakPolarHBondContact OH-CG2 3.35Å; T493-A495 PolarHBondContact O-N 3.36Å; T493-T496 PolarHBondContact O-N 3.02Å; T493-T496 PolarHBondContact O-OG1 3.42Å
494	E	80.1	Confident	82.1	Confident	120 Å²	120	74.2 Å²	74.2	56%	0.561	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-12	171.5	-60.9	174.9	172	0	0	112.8	T496 R618 M619	E494-T496 VanDerWaalsContact C-N 3.27Å; E494-T496 PolarHBondContact O-N 2.94Å; E494-R618 WeakPolarHBondContact O-CD 3.38Å; E494-R618 PolarHBondContact O-NE 3.48Å; E494-M619 HydrophobicContact CG-CG 4.37Å; E494-M619 HydrophobicContact CG-SD 4.05Å
495	A	84.6	Confident	82.8	Confident	78 Å²	78	68.6 Å²	68.6	65%	0.645	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-5.6	179.1	0	0	0	0	0	114.1	T493 N529	T493-A495 PolarHBondContact O-N 3.36Å; A495-N529 PolarHBondContact O-ND2 3.32Å
496	T	89.9	Confident	83.4	Confident	31 Å²	31	62.1 Å²	62.1	19%	0.19	33%	0.33	C	S	.	.	S	Bend	trans	-70	137.6	179.5	48.1	0	0	0	0	111.6	T493 E494 R618	T493-T496 PolarHBondContact O-N 3.02Å; T493-T496 PolarHBondContact O-OG1 3.42Å; E494-T496 VanDerWaalsContact C-N 3.27Å; E494-T496 PolarHBondContact O-N 2.94Å; T496-R618 WeakPolarHBondContact O-CD 3.26Å; T496-R618 PolarHBondContact O-NE 2.95Å; T496-R618 VanDerWaalsContact OG1-CG 3.29Å; T496-R618 WeakPolarHBondContact OG1-CG 3.48Å
497	R	92.6	Very high	83.9	Confident	111 Å²	111	60 Å²	60	42%	0.419	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-85.6	121.2	-178.9	-173.1	176.2	72.9	-164.8	-3.8	110.9	H499 N529 I531	R497-H499 PolarHBondContact NE-NE2 2.63Å; R497-H499 PolarHBondContact NH2-CE1 3.14Å; R497-H499 VanDerWaalsContact NH2-CE1 3.28Å; R497-H499 PolarHBondContact NH2-NE2 3.37Å; R497-N529 WeakPolarHBondContact CA-O 3.42Å; R497-N529 WeakPolarHBondContact CB-OD1 3.5Å; R497-N529 VanDerWaalsContact CG-OD1 3.28Å; R497-N529 WeakPolarHBondContact CG-OD1 3.25Å; R497-I531 HydrophobicContact CG-CG1 4.49Å; R497-I531 VanDerWaalsContact CZ-CD1 3.48Å
498	V	95.3	Very high	84.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	131	178	-175.9	0	0	0	0	110	I500 N529 A530 I531 L599 F601 L614 R618	V498-I500 HydrophobicContact CG1-CG1 4.12Å; V498-N529 PolarHBondContact N-O 2.65Å; V498-A530 HydrophobicContact CB-CB 4.47Å; V498-A530 CarbonylContact O-C 3.49Å; V498-A530 WeakPolarHBondContact O-CA 3.36Å; V498-I531 PolarHBondContact O-N 3.06Å; V498-L599 HydrophobicContact CG2-CD2 4.06Å; V498-F601 HydrophobicContact CG1-CB 3.61Å; V498-L614 HydrophobicContact CB-CD2 4.22Å; V498-L614 HydrophobicContact CG1-CD2 3.98Å; V498-L614 HydrophobicContact CG2-CD2 4.35Å; V498-R618 HydrophobicContact CG2-CG 3.72Å
499	H	96.1	Very high	85.8	Confident	27 Å²	27	54.2 Å²	54.2	13%	0.125	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	105.8	171	-73.1	-118.6	0	0	0	109.3	R497 H594 T598 L599 F600 F601	R497-H499 PolarHBondContact NE-NE2 2.63Å; R497-H499 PolarHBondContact NH2-CE1 3.14Å; R497-H499 VanDerWaalsContact NH2-CE1 3.28Å; R497-H499 PolarHBondContact NH2-NE2 3.37Å; H499-H594 AromaticContact CE1-CD2 3.86Å; H499-H594 AromaticContact ND1-CD2 3.76Å; H499-H594 AromaticContact ND1-NE2 3.9Å; H499-T598 HydrophobicContact CB-CG2 3.91Å; H499-T598 VanDerWaalsContact CD2-CG2 3.44Å; H499-T598 WeakPolarHBondContact CD2-CG2 3.47Å; H499-L599 PolarHBondContact N-O 3.02Å; H499-F600 HydrophobicContact CB-CD1 3.95Å; H499-F600 HydrophobicContact CB-CE1 4.37Å; H499-F600 CarbonylContact O-C 3.57Å; H499-F600 WeakPolarHBondContact O-CA 3.31Å; H499-F601 PolarHBondContact O-N 2.68Å
500	I	96.2	Very high	86.9	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	125.5	-178	-51.8	175.5	0	0	0	107.9	V498 I502 F519 A530 I531 L532 T533 F601 I609 L614	V498-I500 HydrophobicContact CG1-CG1 4.12Å; I500-I502 HydrophobicContact CG2-CD1 3.87Å; I500-I502 HydrophobicContact CG2-CG1 4.32Å; I500-F519 HydrophobicContact CD1-CE2 3.61Å; I500-F519 HydrophobicContact CD1-CZ 3.59Å; I500-A530 HydrophobicContact CD1-CB 4.04Å; I500-A530 HydrophobicContact CG1-CB 4.47Å; I500-I531 PolarHBondContact N-O 3.43Å; I500-L532 HydrophobicContact CB-CD1 4.34Å; I500-L532 HydrophobicContact CG2-CD1 4.11Å; I500-T533 PolarHBondContact O-N 3.32Å; I500-F601 CarbonylContact C-O 3.59Å; I500-F601 WeakPolarHBondContact CA-O 3.29Å; I500-F601 HydrophobicContact CG1-CD1 4.2Å; I500-F601 HydrophobicContact CG2-CD1 4.07Å; I500-I609 HydrophobicContact CD1-CD1 4.29Å; I500-I609 HydrophobicContact CD1-CG2 4.23Å; I500-I609 HydrophobicContact CG2-CD1 3.75Å; I500-L614 HydrophobicContact CD1-CD2 4Å; I500-L614 HydrophobicContact CG1-CD2 4.37Å
501	I	95.9	Very high	87.4	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	118.6	179.9	-64.1	158.3	0	0	0	108	T533 M587 I590 F600 F601 L602 A603	I501-T533 WeakPolarHBondContact CA-O 3.48Å; I501-M587 HydrophobicContact CD1-CE 3.84Å; I501-M587 HydrophobicContact CD1-SD 3.92Å; I501-I590 HydrophobicContact CD1-CD1 4.2Å; I501-I590 HydrophobicContact CD1-CG2 3.72Å; I501-I590 HydrophobicContact CG1-CD1 4.46Å; I501-I590 HydrophobicContact CG1-CG2 4.39Å; I501-I590 HydrophobicContact CG2-CD1 3.62Å; I501-F600 HydrophobicContact CD1-CB 4.22Å; I501-F600 HydrophobicContact CD1-CD1 3.42Å; I501-F600 VanDerWaalsContact CD1-CD1 3.42Å; I501-F600 HydrophobicContact CD1-CE1 3.86Å; I501-F600 HydrophobicContact CD1-CG 3.92Å; I501-F600 HydrophobicContact CG1-CD1 4.36Å; I501-F601 PolarHBondContact N-O 2.7Å; I501-L602 HydrophobicContact CB-CD2 3.81Å; I501-L602 HydrophobicContact CD1-CD2 3.62Å; I501-L602 HydrophobicContact CG1-CD2 4.3Å; I501-L602 HydrophobicContact CG2-CD2 4.15Å; I501-A603 PolarHBondContact O-N 2.91Å
502	I	94.7	Very high	88.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	104.9	175.3	-53.3	-58.3	0	0	0	109	I500 L504 F515 L532 T533 F534 L535 A603 V605 I609	I500-I502 HydrophobicContact CG2-CD1 3.87Å; I500-I502 HydrophobicContact CG2-CG1 4.32Å; I502-L504 HydrophobicContact CG2-CD2 4.19Å; I502-L504 HydrophobicContact CG2-CG 4.45Å; I502-F515 HydrophobicContact CD1-CE2 4.31Å; I502-F515 HydrophobicContact CD1-CZ 3.83Å; I502-F515 HydrophobicContact CG1-CE1 4.08Å; I502-F515 HydrophobicContact CG1-CZ 3.87Å; I502-L532 HydrophobicContact CG1-CD1 3.66Å; I502-T533 PolarHBondContact N-O 3.1Å; I502-F534 HydrophobicContact CB-CD1 3.85Å; I502-F534 HydrophobicContact CB-CE1 3.98Å; I502-F534 HydrophobicContact CG1-CE1 4.35Å; I502-F534 HydrophobicContact CG2-CD1 4.05Å; I502-F534 HydrophobicContact CG2-CE1 3.95Å; I502-L535 PolarHBondContact O-N 3.41Å; I502-A603 HydrophobicContact CD1-CB 3.8Å; I502-A603 WeakPolarHBondContact CD1-O 3.44Å; I502-V605 HydrophobicContact CG2-CG2 3.73Å; I502-I609 HydrophobicContact CD1-CD1 4.46Å
503	P	92.5	Very high	88.9	Confident	22 Å²	22	46.8 Å²	46.8	14%	0.143	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	135.2	168.4	30.5	-30.1	0	0	0	110	L535 I537 F586 A603	P503-L535 HydrophobicContact CB-CD2 4.17Å; P503-I537 HydrophobicContact CB-CD1 4.01Å; P503-F586 HydrophobicContact CB-CE1 4.25Å; P503-F586 HydrophobicContact CB-CZ 4.12Å; P503-F586 HydrophobicContact CG-CZ 4.23Å; P503-A603 VanDerWaalsContact CD-O 3.24Å; P503-A603 WeakPolarHBondContact CD-O 3.22Å
504	L	90.9	Very high	89.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	120.7	179.4	-70.7	179.9	0	0	0	110.3	I502 D508 V512 F534 L535 F536 I537 F552 V605	I502-L504 HydrophobicContact CG2-CD2 4.19Å; I502-L504 HydrophobicContact CG2-CG 4.45Å; L504-D508 HydrophobicContact CD2-CB 3.93Å; L504-V512 HydrophobicContact CD1-CG2 4.08Å; L504-V512 HydrophobicContact CD2-CG2 3.73Å; L504-F534 HydrophobicContact CD1-CB 4.31Å; L504-F534 HydrophobicContact CD1-CD1 3.43Å; L504-F534 VanDerWaalsContact CD1-CD1 3.43Å; L504-F534 HydrophobicContact CD1-CE1 4.06Å; L504-F534 HydrophobicContact CD1-CG 4.16Å; L504-F534 HydrophobicContact CG-CD1 3.96Å; L504-L535 PolarHBondContact N-O 3.16Å; L504-F536 HydrophobicContact CB-CD1 4.16Å; L504-F536 HydrophobicContact CD1-CD1 3.69Å; L504-F536 HydrophobicContact CD1-CE1 3.39Å; L504-F536 HydrophobicContact CD1-CZ 4.45Å; L504-I537 WeakPolarHBondContact O-CB 3.24Å; L504-I537 PolarHBondContact O-N 3.32Å; L504-F552 HydrophobicContact CB-CE1 3.97Å; L504-F552 HydrophobicContact CB-CZ 4.43Å; L504-F552 WeakPolarHBondContact O-CZ 3.44Å; L504-V605 HydrophobicContact CD2-CG2 3.2Å
505	T	88	Confident	90.1	Very high	46 Å²	46	43.2 Å²	43.2	28%	0.282	23%	0.227	S	C	.	.			trans	-97.9	175.3	169	73	0	0	0	0	111.1	E507 D508 F552	T505-E507 PolarHBondContact O-N 3.33Å; T505-E507 PolarHBondContact OG1-N 3.41Å; T505-D508 WeakPolarHBondContact CB-OD2 3.31Å; T505-D508 PolarHBondContact N-OD2 2.83Å; T505-D508 PolarHBondContact O-N 3.15Å; T505-D508 PolarHBondContact OG1-OD2 2.96Å; T505-F552 WeakPolarHBondContact O-CE1 3.36Å
506	A	83.9	Confident	90.5	Very high	28 Å²	28	39.5 Å²	39.5	23%	0.231	20%	0.196	C	C	.	.	S	Bend	trans	-62.6	-20.1	175.3	0	0	0	0	0	113.9	R509 I551	A506-R509 VanDerWaalsContact O-CZ 3.24Å; A506-R509 PolarHBondContact O-NE 3.4Å; A506-R509 PolarHBondContact O-NH2 2.96Å; A506-I551 HydrophobicContact CB-CD1 4.32Å
507	E	82.9	Confident	90.6	Very high	112 Å²	112	43.6 Å²	43.6	52%	0.523	21%	0.213	S	C	.	.	S	Bend	trans	-83.5	-27.2	178	-63.5	-177.9	179.9	0	0	112.3	T505 R509 S726	T505-E507 PolarHBondContact O-N 3.33Å; T505-E507 PolarHBondContact OG1-N 3.41Å; E507-R509 VanDerWaalsContact C-N 3.29Å; E507-R509 PolarHBondContact O-N 3.12Å; E507-S726 VanDerWaalsContact OE1-CB 3.27Å; E507-S726 WeakPolarHBondContact OE1-CB 3.32Å; E507-S726 PolarHBondContact OE1-OG 2.59Å; E507-S726 WeakPolarHBondContact OE2-CB 3.5Å
508	D	86	Confident	90.4	Very high	9 Å²	9	40.1 Å²	40.1	5%	0.048	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-79.1	-8.9	-170.4	-60.3	-53.6	0	0	0	114.8	L504 T505 S510 Y511 V605 R723	L504-D508 HydrophobicContact CD2-CB 3.93Å; T505-D508 WeakPolarHBondContact CB-OD2 3.31Å; T505-D508 PolarHBondContact N-OD2 2.83Å; T505-D508 PolarHBondContact O-N 3.15Å; T505-D508 PolarHBondContact OG1-OD2 2.96Å; D508-S510 VanDerWaalsContact C-N 3.27Å; D508-S510 PolarHBondContact O-N 3.28Å; D508-S510 VanDerWaalsContact O-N 3.16Å; D508-Y511 PolarHBondContact O-N 3.33Å; D508-V605 HydrophobicContact CB-CG2 4.01Å; D508-R723 IonicContact OD1-CZ 2.72Å; D508-R723 IonicContact OD1-NH1 3.65Å; D508-R723 PolarHBondContact OD1-NH1 2.93Å
509	R	85.7	Confident	90.2	Very high	108 Å²	108	40.3 Å²	40.3	41%	0.408	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-57.3	-33.7	-169.1	-71.3	179	-73.6	-176.5	-12.5	114.2	A506 E507 I551 F552	A506-R509 VanDerWaalsContact O-CZ 3.24Å; A506-R509 PolarHBondContact O-NE 3.4Å; A506-R509 PolarHBondContact O-NH2 2.96Å; E507-R509 VanDerWaalsContact C-N 3.29Å; E507-R509 PolarHBondContact O-N 3.12Å; R509-I551 WeakPolarHBondContact CD-O 3.22Å; R509-I551 PolarHBondContact NH1-O 3.46Å; R509-F552 HydrophobicContact CG-CD1 3.92Å; R509-F552 HydrophobicContact CG-CE1 3.92Å
510	S	86.4	Confident	89.9	Confident	86 Å²	86	39.1 Å²	39.1	60%	0.601	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-67.7	-32.4	178.4	45.4	0	0	0	0	113.2	D508	D508-S510 VanDerWaalsContact C-N 3.27Å; D508-S510 PolarHBondContact O-N 3.28Å; D508-S510 VanDerWaalsContact O-N 3.16Å
511	Y	88.4	Confident	89.6	Confident	84 Å²	84	41.8 Å²	41.8	33%	0.329	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-20.9	-173.7	-57.3	-80.3	0	0	0	113.1	D508 N513 H514 F515 R723	D508-Y511 PolarHBondContact O-N 3.33Å; Y511-N513 VanDerWaalsContact C-N 3.26Å; Y511-N513 PolarHBondContact O-N 3.38Å; Y511-H514 PolarHBondContact O-N 3.31Å; Y511-F515 PolarHBondContact O-N 2.81Å; Y511-R723 HydrophobicContact CE2-CG 4.23Å
512	V	90.6	Very high	89.2	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.024	23%	0.229	C	C	.	.	H	α-helix	trans	-56.5	-36.8	-175.1	-179.6	0	0	0	0	112.9	L504 L516 F534 A555 V605	L504-V512 HydrophobicContact CD1-CG2 4.08Å; L504-V512 HydrophobicContact CD2-CG2 3.73Å; V512-L516 HydrophobicContact CG1-CD1 3.97Å; V512-L516 HydrophobicContact CG1-CG 4.4Å; V512-L516 WeakPolarHBondContact O-CB 3.21Å; V512-L516 WeakPolarHBondContact O-CG 3.44Å; V512-L516 PolarHBondContact O-N 2.83Å; V512-F534 HydrophobicContact CG1-CZ 4.49Å; V512-A555 HydrophobicContact CG1-CB 4.13Å; V512-V605 HydrophobicContact CG2-CG1 4.23Å
513	N	89.8	Confident	88.8	Confident	74 Å²	74	44 Å²	44	40%	0.396	23%	0.232	S	C	.	.	H	α-helix	trans	-66.9	-46.7	-180	-173.8	66.4	0	0	0	112.1	Y511 L516 E517	Y511-N513 VanDerWaalsContact C-N 3.26Å; Y511-N513 PolarHBondContact O-N 3.38Å; N513-L516 PolarHBondContact O-N 3.01Å; N513-E517 PolarHBondContact O-N 2.91Å; N513-E517 VanDerWaalsContact O-N 3.09Å
514	H	89.6	Confident	88.5	Confident	79 Å²	79	43.6 Å²	43.6	37%	0.366	23%	0.228	S	C	.	.	H	α-helix	trans	-64.3	-43.6	177.5	-179.1	71.6	0	0	0	111.3	Y511 L516 E517 V518 Q721	Y511-H514 PolarHBondContact O-N 3.31Å; H514-L516 PolarHBondContact O-N 3.03Å; H514-E517 PolarHBondContact O-N 3.32Å; H514-V518 WeakPolarHBondContact O-CG2 3.42Å; H514-V518 PolarHBondContact O-N 2.98Å; H514-Q721 PolarHBondContact CD2-OE1 3.46Å; H514-Q721 VanDerWaalsContact CD2-OE1 3.22Å; H514-Q721 PolarHBondContact NE2-NE2 3.46Å; H514-Q721 PolarHBondContact NE2-OE1 3.05Å
515	F	92.8	Very high	88.3	Confident	7 Å²	7	49.5 Å²	49.5	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-57.9	-47.3	174.8	176.6	-99	0	0	0	112.6	I502 Y511 E517 V518 F519 L532 F534 V605 I609	I502-F515 HydrophobicContact CD1-CE2 4.31Å; I502-F515 HydrophobicContact CD1-CZ 3.83Å; I502-F515 HydrophobicContact CG1-CE1 4.08Å; I502-F515 HydrophobicContact CG1-CZ 3.87Å; Y511-F515 PolarHBondContact O-N 2.81Å; F515-E517 VanDerWaalsContact C-N 3.31Å; F515-E517 PolarHBondContact O-N 3.38Å; F515-V518 PolarHBondContact O-N 2.75Å; F515-F519 HydrophobicContact CE1-CB 4.38Å; F515-F519 HydrophobicContact CZ-CB 4.4Å; F515-F519 HydrophobicContact CZ-CD2 4.24Å; F515-F519 HydrophobicContact CZ-CG 4.36Å; F515-F519 WeakPolarHBondContact O-CB 3.45Å; F515-F519 PolarHBondContact O-N 3.5Å; F515-L532 HydrophobicContact CE1-CD1 3.88Å; F515-L532 HydrophobicContact CE1-CD2 3.98Å; F515-L532 HydrophobicContact CZ-CD1 4.05Å; F515-F534 HydrophobicContact CD1-CE1 4.31Å; F515-F534 HydrophobicContact CD1-CZ 4.02Å; F515-F534 HydrophobicContact CE1-CE1 4.24Å; F515-F534 AromaticContact CE1-CZ 3.94Å; F515-F534 HydrophobicContact CE1-CZ 3.94Å; F515-V605 HydrophobicContact CB-CG1 3.62Å; F515-V605 WeakPolarHBondContact CB-O 3.24Å; F515-V605 WeakPolarHBondContact CD2-O 3.34Å; F515-V605 HydrophobicContact CG-CG1 4.06Å; F515-I609 HydrophobicContact CE2-CD1 4.09Å; F515-I609 HydrophobicContact CZ-CD1 4.13Å
516	L	92.4	Very high	88.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.1	-33.8	178.9	-77	172.8	0	0	0	112.8	V512 N513 H514 A520 L532 F534 Q558 I559 Y562	V512-L516 HydrophobicContact CG1-CD1 3.97Å; V512-L516 HydrophobicContact CG1-CG 4.4Å; V512-L516 WeakPolarHBondContact O-CB 3.21Å; V512-L516 WeakPolarHBondContact O-CG 3.44Å; V512-L516 PolarHBondContact O-N 2.83Å; N513-L516 PolarHBondContact O-N 3.01Å; H514-L516 PolarHBondContact O-N 3.03Å; L516-A520 WeakPolarHBondContact O-CB 3.17Å; L516-A520 PolarHBondContact O-N 2.96Å; L516-L532 HydrophobicContact CD2-CD2 4.02Å; L516-F534 HydrophobicContact CD2-CE2 3.94Å; L516-F534 HydrophobicContact CD2-CZ 3.9Å; L516-F534 HydrophobicContact CG-CZ 4.28Å; L516-Q558 HydrophobicContact CD1-CB 3.95Å; L516-I559 HydrophobicContact CD1-CG1 4.28Å; L516-Y562 HydrophobicContact CB-CD2 4.04Å; L516-Y562 HydrophobicContact CB-CE2 3.68Å; L516-Y562 HydrophobicContact CD1-CD2 4.02Å; L516-Y562 HydrophobicContact CD1-CE2 4.25Å; L516-Y562 HydrophobicContact CG-CD2 4.48Å
517	E	91	Very high	88.1	Confident	117 Å²	117	54.4 Å²	54.4	55%	0.547	29%	0.286	S	S	.	.	H	α-helix	trans	-65.4	-52	175.5	-176.1	169	-175.8	0	0	111.4	N513 H514 F515 A520 S521 Y562	N513-E517 PolarHBondContact O-N 2.91Å; N513-E517 VanDerWaalsContact O-N 3.09Å; H514-E517 PolarHBondContact O-N 3.32Å; F515-E517 VanDerWaalsContact C-N 3.31Å; F515-E517 PolarHBondContact O-N 3.38Å; E517-A520 PolarHBondContact O-N 3.02Å; E517-S521 PolarHBondContact O-N 2.87Å; E517-Y562 WeakPolarHBondContact CA-OH 3.3Å
518	V	89.8	Confident	88.3	Confident	38 Å²	38	51.3 Å²	51.3	23%	0.23	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-44.8	178	176.3	0	0	0	0	111.6	H514 F515 A520 S521 N522 N608	H514-V518 WeakPolarHBondContact O-CG2 3.42Å; H514-V518 PolarHBondContact O-N 2.98Å; F515-V518 PolarHBondContact O-N 2.75Å; V518-A520 VanDerWaalsContact C-N 3.31Å; V518-A520 PolarHBondContact O-N 3.47Å; V518-S521 PolarHBondContact O-N 3.03Å; V518-S521 PolarHBondContact O-OG 3.19Å; V518-N522 VanDerWaalsContact O-CG 3.26Å; V518-N522 PolarHBondContact O-N 3.36Å; V518-N522 VanDerWaalsContact O-N 3.13Å; V518-N522 PolarHBondContact O-ND2 3.24Å; V518-N608 VanDerWaalsContact CG1-OD1 3.23Å; V518-N608 WeakPolarHBondContact CG1-OD1 3.19Å
519	F	91.1	Very high	88.5	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.018	29%	0.287	C	S	.	.	H	α-helix	trans	-66.2	-33.7	179.4	-168.6	-97.6	0	0	0	112.2	I500 F515 N522 A523 F524 L532 I609	I500-F519 HydrophobicContact CD1-CE2 3.61Å; I500-F519 HydrophobicContact CD1-CZ 3.59Å; F515-F519 HydrophobicContact CE1-CB 4.38Å; F515-F519 HydrophobicContact CZ-CB 4.4Å; F515-F519 HydrophobicContact CZ-CD2 4.24Å; F515-F519 HydrophobicContact CZ-CG 4.36Å; F515-F519 WeakPolarHBondContact O-CB 3.45Å; F515-F519 PolarHBondContact O-N 3.5Å; F519-N522 PolarHBondContact O-N 3.43Å; F519-A523 HydrophobicContact CD1-CB 4.21Å; F519-A523 HydrophobicContact CD2-CB 4.38Å; F519-A523 HydrophobicContact CE1-CB 3.74Å; F519-A523 HydrophobicContact CE2-CB 3.92Å; F519-A523 HydrophobicContact CZ-CB 3.56Å; F519-A523 WeakPolarHBondContact O-CB 3.45Å; F519-A523 PolarHBondContact O-N 3.49Å; F519-F524 HydrophobicContact CD1-CD1 4.33Å; F519-F524 AromaticContact CD1-CE1 3.73Å; F519-F524 HydrophobicContact CD1-CE1 3.73Å; F519-F524 HydrophobicContact CD1-CE2 4.21Å; F519-F524 AromaticContact CD1-CZ 3.64Å; F519-F524 HydrophobicContact CD1-CZ 3.64Å; F519-F524 HydrophobicContact CE1-CD1 4.11Å; F519-F524 AromaticContact CE1-CE1 3.44Å; F519-F524 HydrophobicContact CE1-CE1 3.44Å; F519-F524 VanDerWaalsContact CE1-CE1 3.44Å; F519-F524 AromaticContact CE1-CZ 3.79Å; F519-F524 HydrophobicContact CE1-CZ 3.79Å; F519-L532 HydrophobicContact CD1-CD2 3.83Å; F519-L532 HydrophobicContact CE1-CB 3.91Å; F519-L532 HydrophobicContact CE1-CD2 3.98Å; F519-L532 HydrophobicContact CE1-CG 4.4Å; F519-L532 HydrophobicContact CZ-CB 4.35Å; F519-I609 HydrophobicContact CD2-CB 4.08Å; F519-I609 HydrophobicContact CD2-CD1 4.38Å; F519-I609 HydrophobicContact CE2-CB 4.05Å; F519-I609 HydrophobicContact CE2-CD1 4.25Å; F519-I609 HydrophobicContact CE2-CG2 4.14Å
520	A	90.2	Very high	88.9	Confident	2 Å²	2	50.1 Å²	50.1	2%	0.017	28%	0.277	C	S	.	.	I	π-helix	trans	-64.4	-43.8	175.8	0	0	0	0	0	112.5	L516 E517 V518 N522 F524 E525 Y562 Y566	L516-A520 WeakPolarHBondContact O-CB 3.17Å; L516-A520 PolarHBondContact O-N 2.96Å; E517-A520 PolarHBondContact O-N 3.02Å; V518-A520 VanDerWaalsContact C-N 3.31Å; V518-A520 PolarHBondContact O-N 3.47Å; A520-N522 VanDerWaalsContact C-N 3.33Å; A520-N522 PolarHBondContact O-N 3.15Å; A520-F524 HydrophobicContact CB-CB 4.45Å; A520-F524 HydrophobicContact CB-CD2 3.61Å; A520-F524 HydrophobicContact CB-CE2 4.28Å; A520-F524 HydrophobicContact CB-CG 4.39Å; A520-F524 WeakPolarHBondContact O-CB 3.35Å; A520-F524 PolarHBondContact O-N 3.33Å; A520-F524 VanDerWaalsContact O-N 3.14Å; A520-E525 PolarHBondContact O-N 2.79Å; A520-Y562 HydrophobicContact CB-CD1 4.04Å; A520-Y562 HydrophobicContact CB-CE1 3.65Å; A520-Y566 HydrophobicContact CB-CE2 4.1Å
521	S	88.7	Confident	89.2	Confident	56 Å²	56	47.9 Å²	47.9	39%	0.392	26%	0.258	S	S	.	.	I	π-helix	trans	-65.5	-36.9	176	58.9	0	0	0	0	112.4	E517 V518	E517-S521 PolarHBondContact O-N 2.87Å; V518-S521 PolarHBondContact O-N 3.03Å; V518-S521 PolarHBondContact O-OG 3.19Å
522	N	87	Confident	89.5	Confident	41 Å²	41	44.1 Å²	44.1	22%	0.219	24%	0.243	C	C	.	.	I	π-helix	trans	-82	-36.2	-174.5	-65.9	-10.2	0	0	0	114	V518 F519 A520 T526 N608 I609 N610	V518-N522 VanDerWaalsContact O-CG 3.26Å; V518-N522 PolarHBondContact O-N 3.36Å; V518-N522 VanDerWaalsContact O-N 3.13Å; V518-N522 PolarHBondContact O-ND2 3.24Å; F519-N522 PolarHBondContact O-N 3.43Å; A520-N522 VanDerWaalsContact C-N 3.33Å; A520-N522 PolarHBondContact O-N 3.15Å; N522-T526 WeakPolarHBondContact O-CG2 3.5Å; N522-T526 PolarHBondContact O-OG1 2.92Å; N522-N608 PolarHBondContact ND2-OD1 3.27Å; N522-I609 WeakPolarHBondContact CB-O 3.31Å; N522-I609 PolarHBondContact ND2-O 3.06Å; N522-N610 PolarHBondContact ND2-OD1 3.02Å
523	A	86.8	Confident	89.7	Confident	7 Å²	7	44 Å²	44	6%	0.058	24%	0.243	C	C	.	.	I	π-helix	trans	-122.2	-37.4	-169.1	0	0	0	0	0	114.8	F519 T526 S527 E528	F519-A523 HydrophobicContact CD1-CB 4.21Å; F519-A523 HydrophobicContact CD2-CB 4.38Å; F519-A523 HydrophobicContact CE1-CB 3.74Å; F519-A523 HydrophobicContact CE2-CB 3.92Å; F519-A523 HydrophobicContact CZ-CB 3.56Å; F519-A523 WeakPolarHBondContact O-CB 3.45Å; F519-A523 PolarHBondContact O-N 3.49Å; A523-T526 VanDerWaalsContact CA-OG1 3.31Å; A523-T526 WeakPolarHBondContact CA-OG1 3.27Å; A523-T526 PolarHBondContact O-OG1 3.16Å; A523-S527 PolarHBondContact O-N 3.21Å; A523-E528 HydrophobicContact CB-CB 4.16Å; A523-E528 PolarHBondContact O-N 2.86Å
524	F	86.9	Confident	89.9	Confident	14 Å²	14	40.5 Å²	40.5	6%	0.061	22%	0.224	C	C	.	.	I	π-helix	trans	-78.8	-39.3	-178.1	-60.2	-23.3	0	0	0	112.2	F519 A520 S527 L532 Y562 Y566 V569 I571	F519-F524 HydrophobicContact CD1-CD1 4.33Å; F519-F524 AromaticContact CD1-CE1 3.73Å; F519-F524 HydrophobicContact CD1-CE1 3.73Å; F519-F524 HydrophobicContact CD1-CE2 4.21Å; F519-F524 AromaticContact CD1-CZ 3.64Å; F519-F524 HydrophobicContact CD1-CZ 3.64Å; F519-F524 HydrophobicContact CE1-CD1 4.11Å; F519-F524 AromaticContact CE1-CE1 3.44Å; F519-F524 HydrophobicContact CE1-CE1 3.44Å; F519-F524 VanDerWaalsContact CE1-CE1 3.44Å; F519-F524 AromaticContact CE1-CZ 3.79Å; F519-F524 HydrophobicContact CE1-CZ 3.79Å; A520-F524 HydrophobicContact CB-CB 4.45Å; A520-F524 HydrophobicContact CB-CD2 3.61Å; A520-F524 HydrophobicContact CB-CE2 4.28Å; A520-F524 HydrophobicContact CB-CG 4.39Å; A520-F524 WeakPolarHBondContact O-CB 3.35Å; A520-F524 PolarHBondContact O-N 3.33Å; A520-F524 VanDerWaalsContact O-N 3.14Å; F524-S527 PolarHBondContact O-N 3.45Å; F524-L532 HydrophobicContact CZ-CD2 4.22Å; F524-Y562 HydrophobicContact CE2-CD1 4.46Å; F524-Y566 HydrophobicContact CB-CD1 4.07Å; F524-Y566 HydrophobicContact CB-CD2 4.17Å; F524-Y566 HydrophobicContact CB-CE1 4.18Å; F524-Y566 HydrophobicContact CB-CE2 4.26Å; F524-Y566 HydrophobicContact CB-CG 4.07Å; F524-Y566 AromaticContact CD2-CD2 3.94Å; F524-Y566 HydrophobicContact CD2-CD2 3.94Å; F524-Y566 HydrophobicContact CD2-CE2 4.13Å; F524-Y566 HydrophobicContact CG-CD2 4.43Å; F524-V569 HydrophobicContact CB-CG2 4.33Å; F524-V569 HydrophobicContact CD1-CB 4.39Å; F524-V569 HydrophobicContact CD1-CG1 3.79Å; F524-V569 HydrophobicContact CD1-CG2 3.75Å; F524-V569 HydrophobicContact CE1-CB 4.47Å; F524-V569 HydrophobicContact CE1-CG1 3.42Å; F524-V569 VanDerWaalsContact CE1-CG1 3.42Å; F524-V569 HydrophobicContact CE1-CG2 4.29Å; F524-V569 HydrophobicContact CG-CG1 4.46Å; F524-V569 HydrophobicContact CG-CG2 4.1Å; F524-V569 HydrophobicContact CZ-CG1 3.86Å; F524-I571 HydrophobicContact CE2-CD1 3.95Å; F524-I571 HydrophobicContact CZ-CD1 3.67Å; F524-I571 HydrophobicContact CZ-CG1 4.15Å
525	E	85.7	Confident	90.1	Very high	124 Å²	124	36.8 Å²	36.8	58%	0.579	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-33.7	178.2	-69	-176.5	-179.9	0	0	112.6	A520 S527 Y566	A520-E525 PolarHBondContact O-N 2.79Å; E525-S527 VanDerWaalsContact C-N 3.32Å; E525-Y566 HydrophobicContact CG-CE1 3.82Å; E525-Y566 PolarHBondContact OE1-OH 3.45Å
526	T	83.9	Confident	90	Very high	83 Å²	83	36.4 Å²	36.4	51%	0.509	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-12.4	175.4	53.4	0	0	0	0	113.6	N522 A523 E528	N522-T526 WeakPolarHBondContact O-CG2 3.5Å; N522-T526 PolarHBondContact O-OG1 2.92Å; A523-T526 VanDerWaalsContact CA-OG1 3.31Å; A523-T526 WeakPolarHBondContact CA-OG1 3.27Å; A523-T526 PolarHBondContact O-OG1 3.16Å; T526-E528 VanDerWaalsContact C-N 3.3Å; T526-E528 PolarHBondContact O-N 3.05Å
527	S	84.4	Confident	89.8	Confident	94 Å²	94	37 Å²	37	66%	0.657	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.7	42.3	-173.5	-60	0	0	0	0	113.4	A523 F524 E525	A523-S527 PolarHBondContact O-N 3.21Å; F524-S527 PolarHBondContact O-N 3.45Å; E525-S527 VanDerWaalsContact C-N 3.32Å
528	E	87.7	Confident	89.6	Confident	46 Å²	46	31.7 Å²	31.7	22%	0.215	18%	0.183	C	C	.	.			trans	-61.3	144.5	-178.9	-178.1	53.1	-148.3	0	0	112.2	A523 T526 A530 L614 R618	A523-E528 HydrophobicContact CB-CB 4.16Å; A523-E528 PolarHBondContact O-N 2.86Å; T526-E528 VanDerWaalsContact C-N 3.3Å; T526-E528 PolarHBondContact O-N 3.05Å; E528-A530 PolarHBondContact O-N 3.34Å; E528-L614 HydrophobicContact CG-CD1 3.68Å; E528-R618 IonicContact OE1-CZ 3.39Å; E528-R618 IonicContact OE1-NH1 3.27Å; E528-R618 PolarHBondContact OE1-NH1 3.32Å; E528-R618 IonicContact OE1-NH2 3.93Å; E528-R618 PolarHBondContact OE1-NH2 2.76Å
529	N	90.5	Very high	89.1	Confident	68 Å²	68	33.7 Å²	33.7	36%	0.364	19%	0.192	S	C	.	.	S	Bend	trans	-79.5	66.2	-177.7	-169.8	22.8	0	0	0	112.2	A495 R497 V498 R618	A495-N529 PolarHBondContact O-ND2 3.32Å; R497-N529 WeakPolarHBondContact CA-O 3.42Å; R497-N529 WeakPolarHBondContact CB-OD1 3.5Å; R497-N529 VanDerWaalsContact CG-OD1 3.28Å; R497-N529 WeakPolarHBondContact CG-OD1 3.25Å; V498-N529 PolarHBondContact N-O 2.65Å; N529-R618 PolarHBondContact O-NH2 2.88Å
530	A	92.8	Very high	88.4	Confident	24 Å²	24	35.2 Å²	35.2	20%	0.198	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	154.8	178	0	0	0	0	0	111.5	V498 I500 E528 L614	V498-A530 HydrophobicContact CB-CB 4.47Å; V498-A530 CarbonylContact O-C 3.49Å; V498-A530 WeakPolarHBondContact O-CA 3.36Å; I500-A530 HydrophobicContact CD1-CB 4.04Å; I500-A530 HydrophobicContact CG1-CB 4.47Å; E528-A530 PolarHBondContact O-N 3.34Å; A530-L614 HydrophobicContact CB-CD1 4.15Å
531	I	93.7	Very high	87.6	Confident	40 Å²	40	42.5 Å²	42.5	21%	0.205	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	123.5	171.9	-65	179	0	0	0	108.4	R497 V498 I500 P572	R497-I531 HydrophobicContact CG-CG1 4.49Å; R497-I531 VanDerWaalsContact CZ-CD1 3.48Å; V498-I531 PolarHBondContact O-N 3.06Å; I500-I531 PolarHBondContact N-O 3.43Å; I531-P572 HydrophobicContact CG2-CG 4.22Å
532	L	94.8	Very high	86.8	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.021	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	122.9	174.5	178.8	64.4	0	0	0	110.2	I500 I502 F515 L516 F519 F524 F534 I571 P572	I500-L532 HydrophobicContact CB-CD1 4.34Å; I500-L532 HydrophobicContact CG2-CD1 4.11Å; I502-L532 HydrophobicContact CG1-CD1 3.66Å; F515-L532 HydrophobicContact CE1-CD1 3.88Å; F515-L532 HydrophobicContact CE1-CD2 3.98Å; F515-L532 HydrophobicContact CZ-CD1 4.05Å; L516-L532 HydrophobicContact CD2-CD2 4.02Å; F519-L532 HydrophobicContact CD1-CD2 3.83Å; F519-L532 HydrophobicContact CE1-CB 3.91Å; F519-L532 HydrophobicContact CE1-CD2 3.98Å; F519-L532 HydrophobicContact CE1-CG 4.4Å; F519-L532 HydrophobicContact CZ-CB 4.35Å; F524-L532 HydrophobicContact CZ-CD2 4.22Å; L532-F534 HydrophobicContact CD2-CE2 3.64Å; L532-F534 HydrophobicContact CD2-CZ 3.89Å; L532-F534 HydrophobicContact CG-CD2 4.47Å; L532-F534 HydrophobicContact CG-CE2 3.98Å; L532-F534 HydrophobicContact CG-CZ 4.35Å; L532-I571 HydrophobicContact CD2-CG2 4.27Å; L532-I571 HydrophobicContact CG-CG2 4.3Å; L532-P572 WeakPolarHBondContact O-CD 3.4Å
533	T	94.5	Very high	86	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	123.8	177.3	-53.7	0	0	0	0	110.3	I500 I501 I502 P572 I574	I500-T533 PolarHBondContact O-N 3.32Å; I501-T533 WeakPolarHBondContact CA-O 3.48Å; I502-T533 PolarHBondContact N-O 3.1Å; T533-P572 WeakPolarHBondContact CA-O 3.43Å; T533-P572 HydrophobicContact CG2-CG 4.17Å; T533-I574 HydrophobicContact CG2-CD1 4.33Å
534	F	94.4	Very high	85.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	137.8	173.7	-73.9	-77	0	0	0	111.8	I502 L504 V512 F515 L516 L532 F536 I559 I571 P572 W573 I574	I502-F534 HydrophobicContact CB-CD1 3.85Å; I502-F534 HydrophobicContact CB-CE1 3.98Å; I502-F534 HydrophobicContact CG1-CE1 4.35Å; I502-F534 HydrophobicContact CG2-CD1 4.05Å; I502-F534 HydrophobicContact CG2-CE1 3.95Å; L504-F534 HydrophobicContact CD1-CB 4.31Å; L504-F534 HydrophobicContact CD1-CD1 3.43Å; L504-F534 VanDerWaalsContact CD1-CD1 3.43Å; L504-F534 HydrophobicContact CD1-CE1 4.06Å; L504-F534 HydrophobicContact CD1-CG 4.16Å; L504-F534 HydrophobicContact CG-CD1 3.96Å; V512-F534 HydrophobicContact CG1-CZ 4.49Å; F515-F534 HydrophobicContact CD1-CE1 4.31Å; F515-F534 HydrophobicContact CD1-CZ 4.02Å; F515-F534 HydrophobicContact CE1-CE1 4.24Å; F515-F534 AromaticContact CE1-CZ 3.94Å; F515-F534 HydrophobicContact CE1-CZ 3.94Å; L516-F534 HydrophobicContact CD2-CE2 3.94Å; L516-F534 HydrophobicContact CD2-CZ 3.9Å; L516-F534 HydrophobicContact CG-CZ 4.28Å; L532-F534 HydrophobicContact CD2-CE2 3.64Å; L532-F534 HydrophobicContact CD2-CZ 3.89Å; L532-F534 HydrophobicContact CG-CD2 4.47Å; L532-F534 HydrophobicContact CG-CE2 3.98Å; L532-F534 HydrophobicContact CG-CZ 4.35Å; F534-F536 HydrophobicContact CB-CZ 4.42Å; F534-I559 HydrophobicContact CB-CD1 4.45Å; F534-I559 HydrophobicContact CD2-CD1 3.46Å; F534-I559 VanDerWaalsContact CD2-CD1 3.46Å; F534-I559 HydrophobicContact CD2-CG1 4.01Å; F534-I559 HydrophobicContact CE2-CD1 3.88Å; F534-I559 HydrophobicContact CE2-CG1 3.93Å; F534-I559 HydrophobicContact CG-CD1 4.08Å; F534-I571 HydrophobicContact CD2-CG2 3.65Å; F534-I571 HydrophobicContact CE2-CG2 3.74Å; F534-P572 PolarHBondContact N-O 2.69Å; F534-W573 HydrophobicContact CB-CB 4.15Å; F534-W573 CarbonylContact O-C 3.56Å; F534-W573 WeakPolarHBondContact O-CA 3.41Å; F534-I574 PolarHBondContact O-N 2.99Å
535	L	92.8	Very high	84.3	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	102	173.9	176.7	81.9	0	0	0	108.9	I502 P503 L504 I537 I574 V576 F586 I590	I502-L535 PolarHBondContact O-N 3.41Å; P503-L535 HydrophobicContact CB-CD2 4.17Å; L504-L535 PolarHBondContact N-O 3.16Å; L535-I537 HydrophobicContact CD2-CD1 4.15Å; L535-I537 HydrophobicContact CD2-CG1 4.03Å; L535-I537 HydrophobicContact CG-CG1 4.21Å; L535-I537 PolarHBondContact O-N 2.92Å; L535-I574 CarbonylContact C-O 3.6Å; L535-I574 WeakPolarHBondContact CA-O 3.49Å; L535-I574 HydrophobicContact CD1-CB 4.08Å; L535-I574 HydrophobicContact CD1-CG2 4Å; L535-V576 HydrophobicContact CD1-CB 4.27Å; L535-V576 HydrophobicContact CD1-CG2 3.55Å; L535-F586 HydrophobicContact CD2-CB 3.48Å; L535-F586 VanDerWaalsContact CD2-CB 3.48Å; L535-F586 HydrophobicContact CD2-CD1 3.91Å; L535-F586 HydrophobicContact CD2-CD2 3.77Å; L535-F586 HydrophobicContact CD2-CE1 4.48Å; L535-F586 HydrophobicContact CD2-CE2 4.39Å; L535-F586 HydrophobicContact CD2-CG 3.49Å; L535-F586 VanDerWaalsContact CD2-CG 3.49Å; L535-I590 HydrophobicContact CD1-CD1 4.08Å; L535-I590 HydrophobicContact CD1-CG1 4.31Å; L535-I590 HydrophobicContact CD2-CD1 4.2Å
536	F	91.7	Very high	83.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	111.5	175.9	-63	-55.7	0	0	0	110	L504 F534 Y538 F552 A555 K556 I559 W573 I574 S575 V576	L504-F536 HydrophobicContact CB-CD1 4.16Å; L504-F536 HydrophobicContact CD1-CD1 3.69Å; L504-F536 HydrophobicContact CD1-CE1 3.39Å; L504-F536 HydrophobicContact CD1-CZ 4.45Å; F534-F536 HydrophobicContact CB-CZ 4.42Å; F536-Y538 HydrophobicContact CB-CD2 4.33Å; F536-Y538 HydrophobicContact CB-CE2 3.68Å; F536-F552 HydrophobicContact CB-CD2 3.75Å; F536-F552 HydrophobicContact CB-CE2 3.88Å; F536-F552 HydrophobicContact CB-CG 4.26Å; F536-F552 HydrophobicContact CD1-CB 3.69Å; F536-F552 AromaticContact CD1-CD1 3.51Å; F536-F552 HydrophobicContact CD1-CD1 3.51Å; F536-F552 AromaticContact CD1-CD2 3.78Å; F536-F552 HydrophobicContact CD1-CD2 3.78Å; F536-F552 HydrophobicContact CD1-CE1 4.01Å; F536-F552 HydrophobicContact CD1-CE2 4.25Å; F536-F552 AromaticContact CD1-CG 3.38Å; F536-F552 HydrophobicContact CD1-CG 3.38Å; F536-F552 HydrophobicContact CD1-CZ 4.35Å; F536-F552 HydrophobicContact CE1-CB 3.76Å; F536-F552 AromaticContact CE1-CD1 3.89Å; F536-F552 HydrophobicContact CE1-CD1 3.89Å; F536-F552 AromaticContact CE1-CG 3.88Å; F536-F552 HydrophobicContact CE1-CG 3.88Å; F536-F552 HydrophobicContact CG-CB 4.17Å; F536-F552 HydrophobicContact CG-CD1 4.48Å; F536-F552 AromaticContact CG-CD2 3.96Å; F536-F552 HydrophobicContact CG-CD2 3.96Å; F536-F552 HydrophobicContact CG-CE2 4.45Å; F536-F552 AromaticContact CG-CG 3.97Å; F536-F552 HydrophobicContact CG-CG 3.97Å; F536-F552 HydrophobicContact CZ-CB 4.3Å; F536-A555 HydrophobicContact CE1-CB 3.97Å; F536-A555 HydrophobicContact CZ-CB 4.28Å; F536-K556 VanDerWaalsContact CD2-CE 3.49Å; F536-K556 HydrophobicContact CE2-CD 4.11Å; F536-K556 HydrophobicContact CE2-CG 3.61Å; F536-K556 HydrophobicContact CZ-CG 3.7Å; F536-I559 HydrophobicContact CZ-CD1 3.96Å; F536-W573 HydrophobicContact CD2-CB 3.93Å; F536-W573 AromaticContact CD2-CD1 3.86Å; F536-W573 HydrophobicContact CD2-CG 4.04Å; F536-W573 HydrophobicContact CE2-CB 3.5Å; F536-W573 VanDerWaalsContact CE2-CB 3.5Å; F536-W573 AromaticContact CE2-CD1 3.66Å; F536-W573 HydrophobicContact CE2-CD2 4.23Å; F536-W573 AromaticContact CE2-CG 3.51Å; F536-W573 HydrophobicContact CE2-CG 3.51Å; F536-W573 HydrophobicContact CZ-CB 4.36Å; F536-I574 PolarHBondContact N-O 3.22Å; F536-S575 WeakPolarHBondContact O-CA 3.45Å; F536-V576 PolarHBondContact O-N 3Å
537	I	88.1	Confident	82.7	Confident	11 Å²	11	52.4 Å²	52.4	6%	0.056	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	118.6	178	-54.7	177.7	0	0	0	107.9	P503 L504 L535 F552 T578 P581 F586	P503-I537 HydrophobicContact CB-CD1 4.01Å; L504-I537 WeakPolarHBondContact O-CB 3.24Å; L504-I537 PolarHBondContact O-N 3.32Å; L535-I537 HydrophobicContact CD2-CD1 4.15Å; L535-I537 HydrophobicContact CD2-CG1 4.03Å; L535-I537 HydrophobicContact CG-CG1 4.21Å; L535-I537 PolarHBondContact O-N 2.92Å; I537-F552 WeakPolarHBondContact O-CE2 3.39Å; I537-F552 WeakPolarHBondContact O-CZ 3.4Å; I537-T578 HydrophobicContact CG2-CG2 3.76Å; I537-P581 HydrophobicContact CD1-CB 4.4Å; I537-P581 HydrophobicContact CG2-CB 4.37Å; I537-F586 HydrophobicContact CD1-CD1 4.2Å; I537-F586 HydrophobicContact CD1-CE1 4.34Å
538	Y	85.8	Confident	81.7	Confident	7 Å²	7	55.6 Å²	55.6	3%	0.027	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	131.7	178.1	-67.6	-95.2	0	0	0	110.5	F536 E542 V546 D550 I551 F552 K556 V576 T578	F536-Y538 HydrophobicContact CB-CD2 4.33Å; F536-Y538 HydrophobicContact CB-CE2 3.68Å; Y538-E542 HydrophobicContact CD1-CB 4.46Å; Y538-V546 HydrophobicContact CD1-CG2 3.7Å; Y538-V546 HydrophobicContact CE1-CG1 4.28Å; Y538-V546 HydrophobicContact CE1-CG2 3.6Å; Y538-V546 HydrophobicContact CG-CG2 4.41Å; Y538-D550 WeakPolarHBondContact CE1-OD1 3.17Å; Y538-D550 PolarHBondContact OH-OD1 3.42Å; Y538-I551 HydrophobicContact CD1-CD1 4.26Å; Y538-I551 HydrophobicContact CD1-CG1 4Å; Y538-I551 HydrophobicContact CE1-CD1 4.45Å; Y538-I551 HydrophobicContact CE1-CG1 3.81Å; Y538-F552 HydrophobicContact CD1-CD2 4.32Å; Y538-F552 HydrophobicContact CD1-CE2 4.27Å; Y538-F552 HydrophobicContact CD2-CE2 4.4Å; Y538-F552 AromaticContact CE1-CD2 3.73Å; Y538-F552 HydrophobicContact CE1-CD2 3.73Å; Y538-F552 HydrophobicContact CE1-CE2 4.13Å; Y538-F552 HydrophobicContact CE2-CD2 4.01Å; Y538-F552 HydrophobicContact CE2-CE2 4.25Å; Y538-F552 HydrophobicContact CG-CE2 4.43Å; Y538-F552 AromaticContact CZ-CD2 3.57Å; Y538-K556 PolarHBondContact OH-NZ 3.33Å; Y538-V576 PolarHBondContact N-O 2.8Å; Y538-T578 PolarHBondContact O-N 3.19Å
539	D	80.7	Confident	81.1	Confident	80 Å²	80	59.9 Å²	59.9	43%	0.428	31%	0.309	S	S	.	.			trans	-68	160.2	170	-83	-14.9	0	0	0	111.4	E541 E542 A543	D539-E541 PolarHBondContact O-N 3.3Å; D539-E541 VanDerWaalsContact O-N 3.15Å; D539-E542 HydrophobicContact CB-CB 4.5Å; D539-E542 HydrophobicContact CB-CG 4.09Å; D539-E542 PolarHBondContact N-OE2 3.44Å; D539-E542 PolarHBondContact O-N 3.33Å; D539-A543 VanDerWaalsContact O-CB 3.23Å; D539-A543 WeakPolarHBondContact O-CB 3.49Å; D539-A543 PolarHBondContact O-N 3.23Å
540	P	75.6	Confident	80.6	Confident	36 Å²	36	58 Å²	58	23%	0.234	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-26.9	-171.7	-21.6	30.8	0	0	0	115.2	Q544 E579	P540-Q544 PolarHBondContact O-NE2 2.92Å; P540-E579 HydrophobicContact CB-CG 4.4Å; P540-E579 HydrophobicContact CG-CB 4.3Å; P540-E579 HydrophobicContact CG-CG 3.4Å; P540-E579 VanDerWaalsContact CG-CG 3.4Å
541	E	73	Confident	80.1	Confident	154 Å²	154	58.6 Å²	58.6	72%	0.72	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-48	176.4	-58.1	-167.4	161.7	0	0	110.8	D539 A543 Q544	D539-E541 PolarHBondContact O-N 3.3Å; D539-E541 VanDerWaalsContact O-N 3.15Å; E541-A543 VanDerWaalsContact C-N 3.27Å; E541-A543 PolarHBondContact O-N 3.47Å; E541-Q544 WeakPolarHBondContact O-CB 3.27Å; E541-Q544 PolarHBondContact O-N 2.77Å
542	E	72.4	Confident	79.7	Confident	50 Å²	50	56.8 Å²	56.8	23%	0.234	29%	0.289	C	S	.	.	H	α-helix	trans	-58.5	-40.3	176.3	-57.5	-175.4	135.8	0	0	111.8	Y538 D539 Q544 H545 V546 I551	Y538-E542 HydrophobicContact CD1-CB 4.46Å; D539-E542 HydrophobicContact CB-CB 4.5Å; D539-E542 HydrophobicContact CB-CG 4.09Å; D539-E542 PolarHBondContact N-OE2 3.44Å; D539-E542 PolarHBondContact O-N 3.33Å; E542-Q544 PolarHBondContact O-N 3.28Å; E542-Q544 VanDerWaalsContact O-N 3.09Å; E542-H545 PolarHBondContact O-N 3.39Å; E542-V546 WeakPolarHBondContact O-CG2 3.41Å; E542-V546 PolarHBondContact O-N 2.96Å; E542-I551 VanDerWaalsContact OE2-CD1 3.28Å; E542-I551 WeakPolarHBondContact OE2-CD1 3.04Å
543	A	70.6	Confident	79.3	Confident	29 Å²	29	60.8 Å²	60.8	24%	0.24	31%	0.31	C	S	.	.	H	α-helix	trans	-58.1	-21.5	176.9	0	0	0	0	0	113.8	D539 E541 K577	D539-A543 VanDerWaalsContact O-CB 3.23Å; D539-A543 WeakPolarHBondContact O-CB 3.49Å; D539-A543 PolarHBondContact O-N 3.23Å; E541-A543 VanDerWaalsContact C-N 3.27Å; E541-A543 PolarHBondContact O-N 3.47Å; A543-K577 HydrophobicContact CB-CB 4.29Å; A543-K577 HydrophobicContact CB-CD 3.74Å; A543-K577 HydrophobicContact CB-CG 3.74Å
544	Q	68.1	Low	79	Confident	139 Å²	139	66.2 Å²	66.2	65%	0.65	34%	0.339	S	S	*	.	H	α-helix	trans	-82.8	-23.8	176.2	-62.7	173.8	52.1	0	0	112.3	P540 E541 E542	P540-Q544 PolarHBondContact O-NE2 2.92Å; E541-Q544 WeakPolarHBondContact O-CB 3.27Å; E541-Q544 PolarHBondContact O-N 2.77Å; E542-Q544 PolarHBondContact O-N 3.28Å; E542-Q544 VanDerWaalsContact O-N 3.09Å
545	H	69.6	Low	78.6	Confident	117 Å²	117	66.6 Å²	66.6	54%	0.542	34%	0.342	S	S	.	.	H	α-helix	trans	-100.7	-4.1	-175.2	-70.3	-68.4	0	0	0	114.7	E542 N547 H548 N549	E542-H545 PolarHBondContact O-N 3.39Å; H545-N547 PolarHBondContact O-N 2.7Å; H545-H548 PolarHBondContact O-N 3.24Å; H545-N549 PolarHBondContact O-N 3.23Å
546	V	70.8	Confident	78.5	Confident	42 Å²	42	67.9 Å²	67.9	26%	0.255	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.6	-36.3	-178.1	-175.5	0	0	0	0	114.2	Y538 E542 H548 D550	Y538-V546 HydrophobicContact CD1-CG2 3.7Å; Y538-V546 HydrophobicContact CE1-CG1 4.28Å; Y538-V546 HydrophobicContact CE1-CG2 3.6Å; Y538-V546 HydrophobicContact CG-CG2 4.41Å; E542-V546 WeakPolarHBondContact O-CG2 3.41Å; E542-V546 PolarHBondContact O-N 2.96Å; V546-H548 VanDerWaalsContact C-N 3.27Å; V546-H548 PolarHBondContact O-N 3.06Å; V546-D550 HydrophobicContact CG1-CB 4.48Å
547	N	64.9	Low	78.4	Confident	156 Å²	156	71.9 Å²	71.9	83%	0.834	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-11.5	179.9	-70.5	-16.2	0	0	0	114.5	H545	H545-N547 PolarHBondContact O-N 2.7Å
548	H	62.7	Low	78.4	Confident	162 Å²	162	74.7 Å²	74.7	75%	0.75	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.8	-46.9	-178.1	-70.2	84.1	0	0	0	112.3	H545 V546	H545-H548 PolarHBondContact O-N 3.24Å; V546-H548 VanDerWaalsContact C-N 3.27Å; V546-H548 PolarHBondContact O-N 3.06Å
549	N	75.7	Confident	78.6	Confident	135 Å²	135	74.3 Å²	74.3	72%	0.722	38%	0.38	S	S	*	.			trans	-136.2	94.7	177.3	-78.9	-17.1	0	0	0	108.8	H545	H545-N549 PolarHBondContact O-N 3.23Å
550	D	80.3	Confident	79	Confident	28 Å²	28	73 Å²	73	15%	0.15	37%	0.374	C	S	.	.			trans	-84.3	114.8	177.3	-179.5	12.6	0	0	0	111	Y538 V546 F552 I553 K556	Y538-D550 WeakPolarHBondContact CE1-OD1 3.17Å; Y538-D550 PolarHBondContact OH-OD1 3.42Å; V546-D550 HydrophobicContact CG1-CB 4.48Å; D550-F552 PolarHBondContact O-N 2.9Å; D550-F552 VanDerWaalsContact O-N 3.12Å; D550-F552 PolarHBondContact OD1-N 2.93Å; D550-I553 HydrophobicContact CB-CB 4.31Å; D550-I553 WeakPolarHBondContact O-CB 3.48Å; D550-I553 WeakPolarHBondContact O-CG2 3.49Å; D550-I553 PolarHBondContact O-N 3.3Å; D550-I553 VanDerWaalsContact O-N 3.11Å; D550-K556 IonicContact OD1-NZ 3.59Å; D550-K556 IonicContact OD2-NZ 2.65Å; D550-K556 PolarHBondContact OD2-NZ 2.99Å
551	I	81.9	Confident	79.8	Confident	37 Å²	37	75.1 Å²	75.1	19%	0.19	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.4	-178.4	53.6	147.9	0	0	0	114.4	A506 R509 Y538 E542	A506-I551 HydrophobicContact CB-CD1 4.32Å; R509-I551 WeakPolarHBondContact CD-O 3.22Å; R509-I551 PolarHBondContact NH1-O 3.46Å; Y538-I551 HydrophobicContact CD1-CD1 4.26Å; Y538-I551 HydrophobicContact CD1-CG1 4Å; Y538-I551 HydrophobicContact CE1-CD1 4.45Å; Y538-I551 HydrophobicContact CE1-CG1 3.81Å; E542-I551 VanDerWaalsContact OE2-CD1 3.28Å; E542-I551 WeakPolarHBondContact OE2-CD1 3.04Å
552	F	85.9	Confident	80.6	Confident	2 Å²	2	69.1 Å²	69.1	1%	0.009	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	14.4	179.6	-63.5	-71.3	0	0	0	113.5	L504 T505 R509 F536 I537 Y538 D550 D554 A555 K556	L504-F552 HydrophobicContact CB-CE1 3.97Å; L504-F552 HydrophobicContact CB-CZ 4.43Å; L504-F552 WeakPolarHBondContact O-CZ 3.44Å; T505-F552 WeakPolarHBondContact O-CE1 3.36Å; R509-F552 HydrophobicContact CG-CD1 3.92Å; R509-F552 HydrophobicContact CG-CE1 3.92Å; F536-F552 HydrophobicContact CB-CD2 3.75Å; F536-F552 HydrophobicContact CB-CE2 3.88Å; F536-F552 HydrophobicContact CB-CG 4.26Å; F536-F552 HydrophobicContact CD1-CB 3.69Å; F536-F552 AromaticContact CD1-CD1 3.51Å; F536-F552 HydrophobicContact CD1-CD1 3.51Å; F536-F552 AromaticContact CD1-CD2 3.78Å; F536-F552 HydrophobicContact CD1-CD2 3.78Å; F536-F552 HydrophobicContact CD1-CE1 4.01Å; F536-F552 HydrophobicContact CD1-CE2 4.25Å; F536-F552 AromaticContact CD1-CG 3.38Å; F536-F552 HydrophobicContact CD1-CG 3.38Å; F536-F552 HydrophobicContact CD1-CZ 4.35Å; F536-F552 HydrophobicContact CE1-CB 3.76Å; F536-F552 AromaticContact CE1-CD1 3.89Å; F536-F552 HydrophobicContact CE1-CD1 3.89Å; F536-F552 AromaticContact CE1-CG 3.88Å; F536-F552 HydrophobicContact CE1-CG 3.88Å; F536-F552 HydrophobicContact CG-CB 4.17Å; F536-F552 HydrophobicContact CG-CD1 4.48Å; F536-F552 AromaticContact CG-CD2 3.96Å; F536-F552 HydrophobicContact CG-CD2 3.96Å; F536-F552 HydrophobicContact CG-CE2 4.45Å; F536-F552 AromaticContact CG-CG 3.97Å; F536-F552 HydrophobicContact CG-CG 3.97Å; F536-F552 HydrophobicContact CZ-CB 4.3Å; I537-F552 WeakPolarHBondContact O-CE2 3.39Å; I537-F552 WeakPolarHBondContact O-CZ 3.4Å; Y538-F552 HydrophobicContact CD1-CD2 4.32Å; Y538-F552 HydrophobicContact CD1-CE2 4.27Å; Y538-F552 HydrophobicContact CD2-CE2 4.4Å; Y538-F552 AromaticContact CE1-CD2 3.73Å; Y538-F552 HydrophobicContact CE1-CD2 3.73Å; Y538-F552 HydrophobicContact CE1-CE2 4.13Å; Y538-F552 HydrophobicContact CE2-CD2 4.01Å; Y538-F552 HydrophobicContact CE2-CE2 4.25Å; Y538-F552 HydrophobicContact CG-CE2 4.43Å; Y538-F552 AromaticContact CZ-CD2 3.57Å; D550-F552 PolarHBondContact O-N 2.9Å; D550-F552 VanDerWaalsContact O-N 3.12Å; D550-F552 PolarHBondContact OD1-N 2.93Å; F552-D554 VanDerWaalsContact C-N 3.27Å; F552-D554 PolarHBondContact O-N 2.71Å; F552-A555 PolarHBondContact O-N 3.19Å; F552-K556 WeakPolarHBondContact O-CG 3.49Å; F552-K556 PolarHBondContact O-N 2.97Å
553	I	86.3	Confident	81.4	Confident	88 Å²	88	69.3 Å²	69.3	45%	0.451	36%	0.357	S	S	.	.	H	α-helix	trans	-58.6	-38.2	-177.8	-164.7	163.5	0	0	0	112.6	D550 K556 N557	D550-I553 HydrophobicContact CB-CB 4.31Å; D550-I553 WeakPolarHBondContact O-CB 3.48Å; D550-I553 WeakPolarHBondContact O-CG2 3.49Å; D550-I553 PolarHBondContact O-N 3.3Å; D550-I553 VanDerWaalsContact O-N 3.11Å; I553-K556 PolarHBondContact O-N 2.92Å; I553-N557 WeakPolarHBondContact O-CB 3.35Å; I553-N557 PolarHBondContact O-N 2.67Å; I553-N557 PolarHBondContact O-ND2 3.38Å
554	D	87	Confident	82.4	Confident	116 Å²	116	77.7 Å²	77.7	62%	0.62	38%	0.383	S	S	*	.	H	α-helix	trans	-67.1	-44.1	178	-64.6	-36.7	0	0	0	111.8	F552 K556 N557 Q558	F552-D554 VanDerWaalsContact C-N 3.27Å; F552-D554 PolarHBondContact O-N 2.71Å; D554-K556 VanDerWaalsContact C-N 3.35Å; D554-K556 PolarHBondContact O-N 3.32Å; D554-N557 WeakPolarHBondContact O-CB 3.29Å; D554-N557 PolarHBondContact O-N 2.99Å; D554-Q558 WeakPolarHBondContact O-CG 3.3Å; D554-Q558 PolarHBondContact O-N 3.06Å
555	A	87.4	Confident	83.4	Confident	8 Å²	8	76.8 Å²	76.8	7%	0.066	38%	0.377	C	S	.	.	H	α-helix	trans	-60.3	-44.1	174.3	0	0	0	0	0	111.5	V512 F536 F552 N557 Q558 I559	V512-A555 HydrophobicContact CG1-CB 4.13Å; F536-A555 HydrophobicContact CE1-CB 3.97Å; F536-A555 HydrophobicContact CZ-CB 4.28Å; F552-A555 PolarHBondContact O-N 3.19Å; A555-N557 VanDerWaalsContact C-N 3.34Å; A555-N557 PolarHBondContact O-N 3.11Å; A555-Q558 PolarHBondContact O-N 3.24Å; A555-I559 VanDerWaalsContact O-CG1 3.29Å; A555-I559 WeakPolarHBondContact O-CG1 3.4Å; A555-I559 PolarHBondContact O-N 3.21Å
556	K	89.8	Confident	84.4	Confident	28 Å²	28	72.6 Å²	72.6	12%	0.122	36%	0.356	C	S	.	.	H	α-helix	trans	-62.7	-39.4	174.8	-70.1	171	-174	171.7	0	111.9	F536 Y538 D550 F552 I553 D554 I559 N560	F536-K556 VanDerWaalsContact CD2-CE 3.49Å; F536-K556 HydrophobicContact CE2-CD 4.11Å; F536-K556 HydrophobicContact CE2-CG 3.61Å; F536-K556 HydrophobicContact CZ-CG 3.7Å; Y538-K556 PolarHBondContact OH-NZ 3.33Å; D550-K556 IonicContact OD1-NZ 3.59Å; D550-K556 IonicContact OD2-NZ 2.65Å; D550-K556 PolarHBondContact OD2-NZ 2.99Å; F552-K556 WeakPolarHBondContact O-CG 3.49Å; F552-K556 PolarHBondContact O-N 2.97Å; I553-K556 PolarHBondContact O-N 2.92Å; D554-K556 VanDerWaalsContact C-N 3.35Å; D554-K556 PolarHBondContact O-N 3.32Å; K556-I559 PolarHBondContact O-N 2.76Å; K556-N560 PolarHBondContact O-N 3.05Å; K556-N560 PolarHBondContact O-ND2 3.49Å
557	N	89.9	Confident	85	Confident	84 Å²	84	75.8 Å²	75.8	45%	0.449	38%	0.378	S	S	.	.	H	α-helix	trans	-63.8	-43.1	175.4	-73.7	-29.9	0	0	0	111.5	I553 D554 A555 N560 V561	I553-N557 WeakPolarHBondContact O-CB 3.35Å; I553-N557 PolarHBondContact O-N 2.67Å; I553-N557 PolarHBondContact O-ND2 3.38Å; D554-N557 WeakPolarHBondContact O-CB 3.29Å; D554-N557 PolarHBondContact O-N 2.99Å; A555-N557 VanDerWaalsContact C-N 3.34Å; A555-N557 PolarHBondContact O-N 3.11Å; N557-N560 PolarHBondContact O-N 2.83Å; N557-V561 WeakPolarHBondContact O-CG2 3.49Å; N557-V561 PolarHBondContact O-N 3.49Å; N557-V561 VanDerWaalsContact O-N 3.09Å
558	Q	87.8	Confident	86	Confident	70 Å²	70	74.3 Å²	74.3	33%	0.327	38%	0.375	S	S	.	.	H	α-helix	trans	-62.7	-45.9	175.1	-64.6	-58.7	-10	0	0	112	L516 D554 A555 N560 V561 Y562	L516-Q558 HydrophobicContact CD1-CB 3.95Å; D554-Q558 WeakPolarHBondContact O-CG 3.3Å; D554-Q558 PolarHBondContact O-N 3.06Å; A555-Q558 PolarHBondContact O-N 3.24Å; Q558-N560 VanDerWaalsContact C-N 3.29Å; Q558-N560 PolarHBondContact O-N 2.87Å; Q558-V561 WeakPolarHBondContact O-CA 3.26Å; Q558-V561 WeakPolarHBondContact O-CB 3.37Å; Q558-V561 PolarHBondContact O-N 2.93Å; Q558-Y562 WeakPolarHBondContact O-CD2 3.24Å; Q558-Y562 PolarHBondContact O-N 3.09Å
559	I	89.5	Confident	87.1	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-54.9	-46.6	175.7	-67.7	163.1	0	0	0	110.8	L516 F534 F536 A555 K556 V561 Y562 E563 I571 W573	L516-I559 HydrophobicContact CD1-CG1 4.28Å; F534-I559 HydrophobicContact CB-CD1 4.45Å; F534-I559 HydrophobicContact CD2-CD1 3.46Å; F534-I559 VanDerWaalsContact CD2-CD1 3.46Å; F534-I559 HydrophobicContact CD2-CG1 4.01Å; F534-I559 HydrophobicContact CE2-CD1 3.88Å; F534-I559 HydrophobicContact CE2-CG1 3.93Å; F534-I559 HydrophobicContact CG-CD1 4.08Å; F536-I559 HydrophobicContact CZ-CD1 3.96Å; A555-I559 VanDerWaalsContact O-CG1 3.29Å; A555-I559 WeakPolarHBondContact O-CG1 3.4Å; A555-I559 PolarHBondContact O-N 3.21Å; K556-I559 PolarHBondContact O-N 2.76Å; I559-V561 VanDerWaalsContact C-N 3.26Å; I559-V561 PolarHBondContact O-N 3.23Å; I559-Y562 PolarHBondContact O-N 3.07Å; I559-Y562 VanDerWaalsContact O-N 3.15Å; I559-E563 HydrophobicContact CG2-CG 4.45Å; I559-E563 PolarHBondContact O-N 3.3Å; I559-I571 HydrophobicContact CG1-CG2 4.37Å; I559-I571 HydrophobicContact CG2-CB 3.69Å; I559-I571 HydrophobicContact CG2-CD1 4.3Å; I559-I571 HydrophobicContact CG2-CG2 3.73Å; I559-W573 HydrophobicContact CD1-CE3 4.38Å; I559-W573 HydrophobicContact CG2-CE3 3.95Å; I559-W573 HydrophobicContact CG2-CZ3 3.8Å
560	N	90.8	Very high	87.8	Confident	53 Å²	53	69.5 Å²	69.5	28%	0.283	35%	0.348	S	S	.	.	H	α-helix	trans	-62.1	-28.4	176	-78.8	-69.9	0	0	0	113.7	K556 N557 Q558 R564	K556-N560 PolarHBondContact O-N 3.05Å; K556-N560 PolarHBondContact O-ND2 3.49Å; N557-N560 PolarHBondContact O-N 2.83Å; Q558-N560 VanDerWaalsContact C-N 3.29Å; Q558-N560 PolarHBondContact O-N 2.87Å; N560-R564 WeakPolarHBondContact O-CD 3.5Å; N560-R564 WeakPolarHBondContact O-CG 3.44Å; N560-R564 PolarHBondContact O-N 3.19Å
561	V	91.9	Very high	88.3	Confident	79 Å²	79	68.2 Å²	68.2	48%	0.479	34%	0.341	S	S	.	.	H	α-helix	trans	-71.3	-44.4	173.5	172	0	0	0	0	110.3	N557 Q558 I559 R564 K565	N557-V561 WeakPolarHBondContact O-CG2 3.49Å; N557-V561 PolarHBondContact O-N 3.49Å; N557-V561 VanDerWaalsContact O-N 3.09Å; Q558-V561 WeakPolarHBondContact O-CA 3.26Å; Q558-V561 WeakPolarHBondContact O-CB 3.37Å; Q558-V561 PolarHBondContact O-N 2.93Å; I559-V561 VanDerWaalsContact C-N 3.26Å; I559-V561 PolarHBondContact O-N 3.23Å; V561-R564 PolarHBondContact O-N 3.37Å; V561-K565 PolarHBondContact O-N 3.2Å
562	Y	89.4	Confident	88.8	Confident	28 Å²	28	69.2 Å²	69.2	11%	0.11	35%	0.35	C	S	.	.	H	α-helix	trans	-68	-40	178.6	-80.7	-84.2	0	0	0	113	L516 E517 A520 F524 Q558 I559 R564 K565 Y566	L516-Y562 HydrophobicContact CB-CD2 4.04Å; L516-Y562 HydrophobicContact CB-CE2 3.68Å; L516-Y562 HydrophobicContact CD1-CD2 4.02Å; L516-Y562 HydrophobicContact CD1-CE2 4.25Å; L516-Y562 HydrophobicContact CG-CD2 4.48Å; E517-Y562 WeakPolarHBondContact CA-OH 3.3Å; A520-Y562 HydrophobicContact CB-CD1 4.04Å; A520-Y562 HydrophobicContact CB-CE1 3.65Å; F524-Y562 HydrophobicContact CE2-CD1 4.46Å; Q558-Y562 WeakPolarHBondContact O-CD2 3.24Å; Q558-Y562 PolarHBondContact O-N 3.09Å; I559-Y562 PolarHBondContact O-N 3.07Å; I559-Y562 VanDerWaalsContact O-N 3.15Å; Y562-R564 VanDerWaalsContact C-N 3.26Å; Y562-R564 PolarHBondContact O-N 2.82Å; Y562-K565 PolarHBondContact O-N 2.92Å; Y562-K565 VanDerWaalsContact O-N 3.09Å; Y562-Y566 HydrophobicContact CD1-CD2 4.27Å; Y562-Y566 AromaticContact CD1-CE2 3.95Å; Y562-Y566 HydrophobicContact CD1-CE2 3.95Å; Y562-Y566 HydrophobicContact CE1-CE2 4.41Å; Y562-Y566 PolarHBondContact O-N 2.82Å
563	E	89.8	Confident	89.1	Confident	55 Å²	55	73.6 Å²	73.6	26%	0.257	37%	0.366	S	S	.	.	H	α-helix	trans	-61.8	-32.3	172.7	-71.2	-163.5	138.3	0	0	112.8	I559 Y566 K570 I571	I559-E563 HydrophobicContact CG2-CG 4.45Å; I559-E563 PolarHBondContact O-N 3.3Å; E563-Y566 CarbonylContact O-C 3.54Å; E563-K570 WeakPolarHBondContact OE1-CA 3.42Å; E563-I571 HydrophobicContact CG-CB 4.3Å; E563-I571 HydrophobicContact CG-CD1 4.38Å; E563-I571 HydrophobicContact CG-CG1 4.2Å; E563-I571 PolarHBondContact OE1-N 2.8Å
564	R	90.7	Very high	89.3	Confident	204 Å²	204	70.3 Å²	70.3	77%	0.77	35%	0.349	S	S	*	.	H	α-helix	trans	-74.4	-32.9	172.9	-70.9	170.8	-169.5	-175.7	5.8	112.7	N560 V561 Y562	N560-R564 WeakPolarHBondContact O-CD 3.5Å; N560-R564 WeakPolarHBondContact O-CG 3.44Å; N560-R564 PolarHBondContact O-N 3.19Å; V561-R564 PolarHBondContact O-N 3.37Å; Y562-R564 VanDerWaalsContact C-N 3.26Å; Y562-R564 PolarHBondContact O-N 2.82Å
565	K	90.1	Very high	89.4	Confident	120 Å²	120	67.8 Å²	67.8	52%	0.522	34%	0.341	S	S	.	.	H	α-helix	trans	-73	-35.7	178.1	-171.7	-178.6	173.8	-153.3	0	111.8	V561 Y562	V561-K565 PolarHBondContact O-N 3.2Å; Y562-K565 PolarHBondContact O-N 2.92Å; Y562-K565 VanDerWaalsContact O-N 3.09Å
566	Y	89.1	Confident	89.4	Confident	29 Å²	29	68 Å²	68	11%	0.114	34%	0.341	C	S	.	.			trans	-124.9	82.8	-178.2	-57.4	-83.1	0	0	0	111.4	A520 F524 E525 Y562 E563 T568 V569	A520-Y566 HydrophobicContact CB-CE2 4.1Å; F524-Y566 HydrophobicContact CB-CD1 4.07Å; F524-Y566 HydrophobicContact CB-CD2 4.17Å; F524-Y566 HydrophobicContact CB-CE1 4.18Å; F524-Y566 HydrophobicContact CB-CE2 4.26Å; F524-Y566 HydrophobicContact CB-CG 4.07Å; F524-Y566 AromaticContact CD2-CD2 3.94Å; F524-Y566 HydrophobicContact CD2-CD2 3.94Å; F524-Y566 HydrophobicContact CD2-CE2 4.13Å; F524-Y566 HydrophobicContact CG-CD2 4.43Å; E525-Y566 HydrophobicContact CG-CE1 3.82Å; E525-Y566 PolarHBondContact OE1-OH 3.45Å; Y562-Y566 HydrophobicContact CD1-CD2 4.27Å; Y562-Y566 AromaticContact CD1-CE2 3.95Å; Y562-Y566 HydrophobicContact CD1-CE2 3.95Å; Y562-Y566 HydrophobicContact CE1-CE2 4.41Å; Y562-Y566 PolarHBondContact O-N 2.82Å; E563-Y566 CarbonylContact O-C 3.54Å; Y566-T568 PolarHBondContact O-N 3.28Å; Y566-V569 PolarHBondContact O-N 3.38Å
567	P	84.9	Confident	89.1	Confident	110 Å²	110	72.7 Å²	72.7	71%	0.714	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-14.1	-172.1	-24	34.7	0	0	0	116.1
568	T	84.8	Confident	88.6	Confident	125 Å²	125	69.8 Å²	69.8	77%	0.767	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-22.5	173.9	44.3	0	0	0	0	112.7	Y566	Y566-T568 PolarHBondContact O-N 3.28Å
569	V	86.7	Confident	88	Confident	31 Å²	31	73.3 Å²	73.3	19%	0.188	36%	0.364	C	S	.	.			trans	-95.5	140.1	-176.2	-179.3	0	0	0	0	109.5	F524 Y566 I571	F524-V569 HydrophobicContact CB-CG2 4.33Å; F524-V569 HydrophobicContact CD1-CB 4.39Å; F524-V569 HydrophobicContact CD1-CG1 3.79Å; F524-V569 HydrophobicContact CD1-CG2 3.75Å; F524-V569 HydrophobicContact CE1-CB 4.47Å; F524-V569 HydrophobicContact CE1-CG1 3.42Å; F524-V569 VanDerWaalsContact CE1-CG1 3.42Å; F524-V569 HydrophobicContact CE1-CG2 4.29Å; F524-V569 HydrophobicContact CG-CG1 4.46Å; F524-V569 HydrophobicContact CG-CG2 4.1Å; F524-V569 HydrophobicContact CZ-CG1 3.86Å; Y566-V569 PolarHBondContact O-N 3.38Å; V569-I571 HydrophobicContact CG1-CD1 4.43Å; V569-I571 HydrophobicContact CG1-CG1 3.87Å
570	K	89.3	Confident	87.2	Confident	164 Å²	164	74.3 Å²	74.3	71%	0.713	37%	0.369	S	S	*	.			trans	-126.1	133.1	167.4	-65.5	-174.9	178.8	-177	0	108.7	E563 P572	E563-K570 WeakPolarHBondContact OE1-CA 3.42Å; K570-P572 VanDerWaalsContact O-CD 3.23Å; K570-P572 WeakPolarHBondContact O-CD 3.44Å
571	I	91.9	Very high	86.6	Confident	1 Å²	1	74.2 Å²	74.2	1%	0.005	37%	0.371	C	S	.	.			trans	-117.4	80.3	-174.3	-54.1	176.3	0	0	0	107.3	F524 L532 F534 I559 E563 V569	F524-I571 HydrophobicContact CE2-CD1 3.95Å; F524-I571 HydrophobicContact CZ-CD1 3.67Å; F524-I571 HydrophobicContact CZ-CG1 4.15Å; L532-I571 HydrophobicContact CD2-CG2 4.27Å; L532-I571 HydrophobicContact CG-CG2 4.3Å; F534-I571 HydrophobicContact CD2-CG2 3.65Å; F534-I571 HydrophobicContact CE2-CG2 3.74Å; I559-I571 HydrophobicContact CG1-CG2 4.37Å; I559-I571 HydrophobicContact CG2-CB 3.69Å; I559-I571 HydrophobicContact CG2-CD1 4.3Å; I559-I571 HydrophobicContact CG2-CG2 3.73Å; E563-I571 HydrophobicContact CG-CB 4.3Å; E563-I571 HydrophobicContact CG-CD1 4.38Å; E563-I571 HydrophobicContact CG-CG1 4.2Å; E563-I571 PolarHBondContact OE1-N 2.8Å; V569-I571 HydrophobicContact CG1-CD1 4.43Å; V569-I571 HydrophobicContact CG1-CG1 3.87Å
572	P	92.1	Very high	86.2	Confident	58 Å²	58	70.7 Å²	70.7	38%	0.377	35%	0.35	S	S	.	.			trans	-61	148.7	177.5	26.4	-35.6	0	0	0	111.4	I531 L532 T533 F534 K570	I531-P572 HydrophobicContact CG2-CG 4.22Å; L532-P572 WeakPolarHBondContact O-CD 3.4Å; T533-P572 WeakPolarHBondContact CA-O 3.43Å; T533-P572 HydrophobicContact CG2-CG 4.17Å; F534-P572 PolarHBondContact N-O 2.69Å; K570-P572 VanDerWaalsContact O-CD 3.23Å; K570-P572 WeakPolarHBondContact O-CD 3.44Å
573	W	91.4	Very high	86	Confident	95 Å²	95	70.8 Å²	70.8	36%	0.36	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	150.1	168.6	63.2	80.3	0	0	0	112.3	F534 F536 I559	F534-W573 HydrophobicContact CB-CB 4.15Å; F534-W573 CarbonylContact O-C 3.56Å; F534-W573 WeakPolarHBondContact O-CA 3.41Å; F536-W573 HydrophobicContact CD2-CB 3.93Å; F536-W573 AromaticContact CD2-CD1 3.86Å; F536-W573 HydrophobicContact CD2-CG 4.04Å; F536-W573 HydrophobicContact CE2-CB 3.5Å; F536-W573 VanDerWaalsContact CE2-CB 3.5Å; F536-W573 AromaticContact CE2-CD1 3.66Å; F536-W573 HydrophobicContact CE2-CD2 4.23Å; F536-W573 AromaticContact CE2-CG 3.51Å; F536-W573 HydrophobicContact CE2-CG 3.51Å; F536-W573 HydrophobicContact CZ-CB 4.36Å; I559-W573 HydrophobicContact CD1-CE3 4.38Å; I559-W573 HydrophobicContact CG2-CE3 3.95Å; I559-W573 HydrophobicContact CG2-CZ3 3.8Å
574	I	90.4	Very high	86	Confident	18 Å²	18	68.2 Å²	68.2	9%	0.092	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	124	178.6	-62.5	167.8	0	0	0	108.4	T533 F534 L535 F536 V576 I590 K593	T533-I574 HydrophobicContact CG2-CD1 4.33Å; F534-I574 PolarHBondContact O-N 2.99Å; L535-I574 CarbonylContact C-O 3.6Å; L535-I574 WeakPolarHBondContact CA-O 3.49Å; L535-I574 HydrophobicContact CD1-CB 4.08Å; L535-I574 HydrophobicContact CD1-CG2 4Å; F536-I574 PolarHBondContact N-O 3.22Å; I574-V576 HydrophobicContact CG2-CG2 4.08Å; I574-I590 HydrophobicContact CD1-CG1 4.3Å; I574-K593 HydrophobicContact CD1-CD 3.94Å; I574-K593 VanDerWaalsContact CG2-NZ 3.34Å
575	S	89.8	Confident	85.8	Confident	64 Å²	64	61.4 Å²	61.4	45%	0.448	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	131.3	168.9	-58	0	0	0	0	110.5	F536	F536-S575 WeakPolarHBondContact O-CA 3.45Å
576	V	86.9	Confident	85.7	Confident	12 Å²	12	56.6 Å²	56.6	7%	0.073	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	136.9	173.8	170.7	0	0	0	0	109.6	L535 F536 Y538 I574 I589	L535-V576 HydrophobicContact CD1-CB 4.27Å; L535-V576 HydrophobicContact CD1-CG2 3.55Å; F536-V576 PolarHBondContact O-N 3Å; Y538-V576 PolarHBondContact N-O 2.8Å; I574-V576 HydrophobicContact CG2-CG2 4.08Å; V576-I589 HydrophobicContact CB-CD1 4.39Å; V576-I589 HydrophobicContact CG1-CD1 3.66Å; V576-I589 HydrophobicContact CG2-CD1 3.75Å; V576-I589 HydrophobicContact CG2-CG2 4.15Å
577	K	84.8	Confident	85.8	Confident	127 Å²	127	55.2 Å²	55.2	55%	0.552	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.3	126.7	169.2	-179.8	-173.9	-176.9	-174.6	0	108.3	A543	A543-K577 HydrophobicContact CB-CB 4.29Å; A543-K577 HydrophobicContact CB-CD 3.74Å; A543-K577 HydrophobicContact CB-CG 3.74Å
578	T	79.6	Confident	86	Confident	23 Å²	23	51.2 Å²	51.2	14%	0.141	26%	0.261	C	S	.	.			trans	-147.5	153.2	173.1	-170.8	0	0	0	0	110.7	I537 Y538 I580 P581	I537-T578 HydrophobicContact CG2-CG2 3.76Å; Y538-T578 PolarHBondContact O-N 3.19Å; T578-I580 PolarHBondContact OG1-N 2.86Å; T578-I580 PolarHBondContact OG1-O 2.89Å; T578-P581 HydrophobicContact CG2-CB 4.37Å
579	E	73.2	Confident	86.3	Confident	144 Å²	144	48.1 Å²	48.1	67%	0.673	24%	0.24	S	C	*	.	S	Bend	trans	-86.7	-22.6	172.9	-76.7	172.8	-159.4	0	0	112.5	P540	P540-E579 HydrophobicContact CB-CG 4.4Å; P540-E579 HydrophobicContact CG-CB 4.3Å; P540-E579 HydrophobicContact CG-CG 3.4Å; P540-E579 VanDerWaalsContact CG-CG 3.4Å
580	I	74.3	Confident	86.6	Confident	21 Å²	21	46.7 Å²	46.7	11%	0.108	23%	0.231	C	C	.	.	S	Bend	trans	-140.5	118.3	179.4	-62.4	173.9	0	0	0	107.7	T578 S582 E694 K730 L731	T578-I580 PolarHBondContact OG1-N 2.86Å; T578-I580 PolarHBondContact OG1-O 2.89Å; I580-S582 VanDerWaalsContact C-N 3.33Å; I580-S582 PolarHBondContact O-N 3.37Å; I580-E694 WeakPolarHBondContact CD1-OE2 3.41Å; I580-K730 HydrophobicContact CD1-CB 4.3Å; I580-K730 HydrophobicContact CD1-CD 4.24Å; I580-K730 HydrophobicContact CG1-CD 4.09Å; I580-L731 HydrophobicContact CG2-CD2 3.88Å
581	P	76.7	Confident	86.8	Confident	50 Å²	50	38.9 Å²	38.9	33%	0.325	20%	0.197	S	C	.	.			trans	-78.6	78.6	179.1	31.8	-34.9	0	0	0	111.4	I537 T578	I537-P581 HydrophobicContact CD1-CB 4.4Å; I537-P581 HydrophobicContact CG2-CB 4.37Å; T578-P581 HydrophobicContact CG2-CB 4.37Å
582	S	83.7	Confident	86.8	Confident	6 Å²	6	46.3 Å²	46.3	4%	0.042	23%	0.23	C	C	.	.			trans	-86.7	137.5	168.5	156.7	0	0	0	0	110.6	I580 I584 K585 F586 L693	I580-S582 VanDerWaalsContact C-N 3.33Å; I580-S582 PolarHBondContact O-N 3.37Å; S582-I584 PolarHBondContact O-N 2.79Å; S582-I584 PolarHBondContact OG-N 3.31Å; S582-K585 PolarHBondContact O-N 2.97Å; S582-K585 VanDerWaalsContact O-N 3.16Å; S582-F586 WeakPolarHBondContact O-CD1 3.34Å; S582-F586 PolarHBondContact O-N 2.83Å; S582-L693 WeakPolarHBondContact CB-O 3.42Å; S582-L693 PolarHBondContact OG-O 3.06Å
583	Q	86.7	Confident	86.8	Confident	30 Å²	30	49.6 Å²	49.6	14%	0.14	24%	0.238	C	C	.	.	H	α-helix	trans	-55.9	-40.7	177.5	-63.7	179.9	5.8	0	0	112.3	K585 F586 M587 D666 I698	Q583-K585 VanDerWaalsContact C-N 3.34Å; Q583-K585 PolarHBondContact O-N 3.24Å; Q583-F586 HydrophobicContact CB-CE1 4.37Å; Q583-F586 HydrophobicContact CB-CE2 4.42Å; Q583-F586 HydrophobicContact CB-CZ 4.02Å; Q583-F586 HydrophobicContact CG-CE1 4.39Å; Q583-F586 HydrophobicContact CG-CZ 4.01Å; Q583-F586 WeakPolarHBondContact O-CD2 3.38Å; Q583-F586 PolarHBondContact O-N 3.46Å; Q583-M587 WeakPolarHBondContact O-CB 3.43Å; Q583-M587 WeakPolarHBondContact O-CG 3.37Å; Q583-M587 PolarHBondContact O-N 2.04Å; Q583-D666 PolarHBondContact NE2-OD1 3.46Å; Q583-I698 HydrophobicContact CB-CD1 3.77Å; Q583-I698 HydrophobicContact CB-CG1 3.97Å
584	I	88.7	Confident	86.9	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-63.2	-43.2	-179	-50	162	0	0	0	110	S582 F586 M587 D588 Y675 M682 L693 L696 I701	S582-I584 PolarHBondContact O-N 2.79Å; S582-I584 PolarHBondContact OG-N 3.31Å; I584-F586 PolarHBondContact O-N 2.83Å; I584-M587 PolarHBondContact O-N 2.75Å; I584-D588 WeakPolarHBondContact O-CB 3.33Å; I584-D588 PolarHBondContact O-N 3.19Å; I584-Y675 PolarHBondContact O-OH 2.97Å; I584-M682 HydrophobicContact CG2-CE 4.48Å; I584-L693 HydrophobicContact CG2-CD2 3.98Å; I584-L696 HydrophobicContact CD1-CB 4.1Å; I584-L696 WeakPolarHBondContact CD1-O 3.27Å; I584-I701 HydrophobicContact CB-CD1 4.43Å; I584-I701 HydrophobicContact CD1-CD1 3.47Å; I584-I701 VanDerWaalsContact CD1-CD1 3.47Å; I584-I701 HydrophobicContact CD1-CG1 4.44Å; I584-I701 HydrophobicContact CG1-CD1 3.57Å; I584-I701 HydrophobicContact CG2-CD1 3.96Å
585	K	86.7	Confident	87.1	Confident	61 Å²	61	49.1 Å²	49.1	27%	0.265	25%	0.245	S	C	.	.	H	α-helix	trans	-62.9	-40.8	-178	-69.2	-173.9	179.8	-176.2	0	112.1	S582 Q583 E694	S582-K585 PolarHBondContact O-N 2.97Å; S582-K585 VanDerWaalsContact O-N 3.16Å; Q583-K585 VanDerWaalsContact C-N 3.34Å; Q583-K585 PolarHBondContact O-N 3.24Å; K585-E694 IonicContact NZ-OE1 2.56Å; K585-E694 PolarHBondContact NZ-OE1 2.94Å
586	F	88.1	Confident	87.2	Confident	18 Å²	18	50.5 Å²	50.5	8%	0.079	25%	0.251	C	S	.	.	H	α-helix	trans	-79.1	-33.4	176	61.5	-117	0	0	0	113.3	P503 L535 I537 S582 Q583 I584 D588 I589 I590	P503-F586 HydrophobicContact CB-CE1 4.25Å; P503-F586 HydrophobicContact CB-CZ 4.12Å; P503-F586 HydrophobicContact CG-CZ 4.23Å; L535-F586 HydrophobicContact CD2-CB 3.48Å; L535-F586 VanDerWaalsContact CD2-CB 3.48Å; L535-F586 HydrophobicContact CD2-CD1 3.91Å; L535-F586 HydrophobicContact CD2-CD2 3.77Å; L535-F586 HydrophobicContact CD2-CE1 4.48Å; L535-F586 HydrophobicContact CD2-CE2 4.39Å; L535-F586 HydrophobicContact CD2-CG 3.49Å; L535-F586 VanDerWaalsContact CD2-CG 3.49Å; I537-F586 HydrophobicContact CD1-CD1 4.2Å; I537-F586 HydrophobicContact CD1-CE1 4.34Å; S582-F586 WeakPolarHBondContact O-CD1 3.34Å; S582-F586 PolarHBondContact O-N 2.83Å; Q583-F586 HydrophobicContact CB-CE1 4.37Å; Q583-F586 HydrophobicContact CB-CE2 4.42Å; Q583-F586 HydrophobicContact CB-CZ 4.02Å; Q583-F586 HydrophobicContact CG-CE1 4.39Å; Q583-F586 HydrophobicContact CG-CZ 4.01Å; Q583-F586 WeakPolarHBondContact O-CD2 3.38Å; Q583-F586 PolarHBondContact O-N 3.46Å; I584-F586 PolarHBondContact O-N 2.83Å; F586-D588 VanDerWaalsContact C-N 3.33Å; F586-D588 PolarHBondContact O-N 2.87Å; F586-I589 WeakPolarHBondContact O-CB 3.2Å; F586-I589 PolarHBondContact O-N 3.35Å; F586-I590 HydrophobicContact CD2-CD1 4.18Å; F586-I590 WeakPolarHBondContact O-CG1 3.03Å; F586-I590 PolarHBondContact O-N 2.83Å
587	M	91.8	Very high	87.5	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.5	-35.7	173.9	-72.8	-47.9	-64.1	0	0	112.4	I501 Q583 I584 I589 I590 S591 F600 L602 F670 Y675 I698	I501-M587 HydrophobicContact CD1-CE 3.84Å; I501-M587 HydrophobicContact CD1-SD 3.92Å; Q583-M587 WeakPolarHBondContact O-CB 3.43Å; Q583-M587 WeakPolarHBondContact O-CG 3.37Å; Q583-M587 PolarHBondContact O-N 2.04Å; I584-M587 PolarHBondContact O-N 2.75Å; M587-I589 PolarHBondContact O-N 3.13Å; M587-I589 VanDerWaalsContact O-N 3.13Å; M587-I590 HydrophobicContact CE-CB 4.44Å; M587-I590 HydrophobicContact CE-CG2 4.39Å; M587-I590 PolarHBondContact O-N 3.39Å; M587-I590 HydrophobicContact SD-CB 4.35Å; M587-I590 HydrophobicContact SD-CD1 3.93Å; M587-S591 WeakPolarHBondContact O-CB 3.45Å; M587-S591 PolarHBondContact O-N 3.5Å; M587-F600 HydrophobicContact CE-CD2 3.76Å; M587-F600 HydrophobicContact CE-CE2 3.89Å; M587-F600 HydrophobicContact CE-CG 4.15Å; M587-F600 HydrophobicContact CE-CZ 4.42Å; M587-L602 HydrophobicContact CE-CD2 4.14Å; M587-L602 HydrophobicContact CG-CD1 4.24Å; M587-L602 HydrophobicContact SD-CD1 4.27Å; M587-L602 HydrophobicContact SD-CD2 3.59Å; M587-L602 VanDerWaalsContact SD-CD2 3.59Å; M587-F670 HydrophobicContact CE-CE2 4.15Å; M587-F670 HydrophobicContact CE-CZ 3.94Å; M587-Y675 HydrophobicContact CB-CE1 4.31Å; M587-Y675 HydrophobicContact CB-CE2 3.98Å; M587-I698 HydrophobicContact CB-CD1 4.41Å; M587-I698 HydrophobicContact CG-CD1 3.63Å
588	D	89.6	Confident	88	Confident	26 Å²	26	49.4 Å²	49.4	14%	0.139	25%	0.25	C	S	.	.	H	α-helix	trans	-60.4	-20.7	170.8	-83.5	1.6	0	0	0	113.8	I584 F586 K592 Y675 R679	I584-D588 WeakPolarHBondContact O-CB 3.33Å; I584-D588 PolarHBondContact O-N 3.19Å; F586-D588 VanDerWaalsContact C-N 3.33Å; F586-D588 PolarHBondContact O-N 2.87Å; D588-K592 WeakPolarHBondContact O-CD 3.38Å; D588-K592 WeakPolarHBondContact O-CE 3.06Å; D588-K592 WeakPolarHBondContact O-CG 3.23Å; D588-K592 PolarHBondContact O-NZ 3.38Å; D588-Y675 PolarHBondContact OD1-OH 3.4Å; D588-R679 IonicContact OD1-NE 3.02Å; D588-R679 PolarHBondContact OD1-NE 3.1Å; D588-R679 VanDerWaalsContact OD1-NE 3.07Å; D588-R679 IonicContact OD2-CZ 3.81Å; D588-R679 VanDerWaalsContact OD2-CZ 3.27Å; D588-R679 IonicContact OD2-NE 2.71Å; D588-R679 PolarHBondContact OD2-NE 2.8Å; D588-R679 IonicContact OD2-NH2 3.75Å; D588-R679 PolarHBondContact OD2-NH2 2.83Å
589	I	90.2	Very high	88.8	Confident	60 Å²	60	48.4 Å²	48.4	31%	0.308	24%	0.244	S	C	.	.	H	α-helix	trans	-89.9	-43.6	174.6	-62.9	169	0	0	0	110.8	V576 F586 M587	V576-I589 HydrophobicContact CB-CD1 4.39Å; V576-I589 HydrophobicContact CG1-CD1 3.66Å; V576-I589 HydrophobicContact CG2-CD1 3.75Å; V576-I589 HydrophobicContact CG2-CG2 4.15Å; F586-I589 WeakPolarHBondContact O-CB 3.2Å; F586-I589 PolarHBondContact O-N 3.35Å; M587-I589 PolarHBondContact O-N 3.13Å; M587-I589 VanDerWaalsContact O-N 3.13Å
590	I	92.4	Very high	89.9	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-71.2	-45.4	-177.5	-65.3	166.7	0	0	0	110.9	I501 L535 I574 F586 M587 K592 K593 H594 F600	I501-I590 HydrophobicContact CD1-CD1 4.2Å; I501-I590 HydrophobicContact CD1-CG2 3.72Å; I501-I590 HydrophobicContact CG1-CD1 4.46Å; I501-I590 HydrophobicContact CG1-CG2 4.39Å; I501-I590 HydrophobicContact CG2-CD1 3.62Å; L535-I590 HydrophobicContact CD1-CD1 4.08Å; L535-I590 HydrophobicContact CD1-CG1 4.31Å; L535-I590 HydrophobicContact CD2-CD1 4.2Å; I574-I590 HydrophobicContact CD1-CG1 4.3Å; F586-I590 HydrophobicContact CD2-CD1 4.18Å; F586-I590 WeakPolarHBondContact O-CG1 3.03Å; F586-I590 PolarHBondContact O-N 2.83Å; M587-I590 HydrophobicContact CE-CB 4.44Å; M587-I590 HydrophobicContact CE-CG2 4.39Å; M587-I590 PolarHBondContact O-N 3.39Å; M587-I590 HydrophobicContact SD-CB 4.35Å; M587-I590 HydrophobicContact SD-CD1 3.93Å; I590-K592 VanDerWaalsContact C-N 3.26Å; I590-K592 PolarHBondContact O-N 3.29Å; I590-K593 PolarHBondContact O-N 3.4Å; I590-H594 PolarHBondContact O-N 2.9Å; I590-H594 PolarHBondContact O-ND1 2.98Å; I590-F600 HydrophobicContact CG2-CE1 3.94Å; I590-F600 HydrophobicContact CG2-CZ 3.98Å
591	S	93.8	Very high	91	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.007	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-54.3	-39.5	179.1	175.1	0	0	0	0	112.3	M587 K593 H594 N672 M676	M587-S591 WeakPolarHBondContact O-CB 3.45Å; M587-S591 PolarHBondContact O-N 3.5Å; S591-K593 VanDerWaalsContact C-N 3.31Å; S591-K593 PolarHBondContact O-N 3.17Å; S591-H594 PolarHBondContact O-N 3.3Å; S591-N672 WeakPolarHBondContact CA-OD1 3.44Å; S591-N672 VanDerWaalsContact CB-OD1 3.32Å; S591-N672 WeakPolarHBondContact CB-OD1 3.32Å; S591-N672 PolarHBondContact O-ND2 2.92Å; S591-N672 VanDerWaalsContact O-ND2 3.08Å; S591-N672 PolarHBondContact OG-OD1 3.38Å; S591-M676 WeakPolarHBondContact OG-CE 3.23Å; S591-M676 WeakPolarHBondContact OG-CG 3.45Å; S591-M676 PolarHBondContact OG-SD 2.85Å; S591-M676 VanDerWaalsContact OG-SD 3.33Å
592	K	91.9	Very high	91.9	Very high	157 Å²	157	38.5 Å²	38.5	68%	0.683	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-71	-18.2	175.9	-68.7	174	-170.1	151.5	0	114.7	D588 I590 M676	D588-K592 WeakPolarHBondContact O-CD 3.38Å; D588-K592 WeakPolarHBondContact O-CE 3.06Å; D588-K592 WeakPolarHBondContact O-CG 3.23Å; D588-K592 PolarHBondContact O-NZ 3.38Å; I590-K592 VanDerWaalsContact C-N 3.26Å; I590-K592 PolarHBondContact O-N 3.29Å; K592-M676 HydrophobicContact CG-CE 4.27Å
593	K	91.9	Very high	92.4	Very high	127 Å²	127	38.4 Å²	38.4	55%	0.552	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-95	-7.3	-179.9	-70.3	178.9	178.6	-178.2	0	113.6	I574 I590 S591	I574-K593 HydrophobicContact CD1-CD 3.94Å; I574-K593 VanDerWaalsContact CG2-NZ 3.34Å; I590-K593 PolarHBondContact O-N 3.4Å; S591-K593 VanDerWaalsContact C-N 3.31Å; S591-K593 PolarHBondContact O-N 3.17Å
594	H	93.6	Very high	92.6	Very high	34 Å²	34	37.9 Å²	37.9	16%	0.157	19%	0.19	C	C	.	.	S	Bend	trans	-119.9	152.3	-175.8	-68.8	83.9	0	0	0	110.9	H499 I590 S591 T598 F600 N672	H499-H594 AromaticContact CE1-CD2 3.86Å; H499-H594 AromaticContact ND1-CD2 3.76Å; H499-H594 AromaticContact ND1-NE2 3.9Å; I590-H594 PolarHBondContact O-N 2.9Å; I590-H594 PolarHBondContact O-ND1 2.98Å; S591-H594 PolarHBondContact O-N 3.3Å; H594-T598 HydrophobicContact CB-CG2 4.36Å; H594-F600 HydrophobicContact CB-CE1 4.12Å; H594-F600 HydrophobicContact CB-CZ 3.73Å; H594-F600 AromaticContact CG-CE1 3.78Å; H594-F600 AromaticContact CG-CZ 3.82Å; H594-F600 AromaticContact ND1-CE1 3.95Å; H594-F600 AromaticContact ND1-CZ 3.98Å; H594-N672 PolarHBondContact O-ND2 3.4Å; H594-N672 VanDerWaalsContact O-ND2 3.1Å
595	P	94.8	Very high	92.7	Very high	69 Å²	69	38 Å²	38	45%	0.448	19%	0.191	S	C	.	.			trans	-70.9	160.5	175.3	32.9	-37	0	0	0	111.3	D597 T598 N672	P595-D597 VanDerWaalsContact C-N 3.27Å; P595-D597 VanDerWaalsContact CB-OD1 3.26Å; P595-D597 WeakPolarHBondContact CB-OD1 3.43Å; P595-D597 WeakPolarHBondContact CG-OD1 3.27Å; P595-D597 PolarHBondContact O-N 3.14Å; P595-T598 VanDerWaalsContact CD-OG1 3.27Å; P595-T598 WeakPolarHBondContact CD-OG1 3.47Å; P595-T598 WeakPolarHBondContact CG-OG1 3.38Å; P595-T598 VanDerWaalsContact O-CB 3.29Å; P595-T598 WeakPolarHBondContact O-CB 3.23Å; P595-T598 PolarHBondContact O-N 3.05Å; P595-T598 PolarHBondContact O-OG1 2.73Å; P595-N672 PolarHBondContact O-ND2 2.8Å
596	V	92.3	Very high	92.9	Very high	93 Å²	93	35.5 Å²	35.5	56%	0.564	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-22.2	-171.4	-64.8	0	0	0	0	114.2	T598 S673	V596-T598 VanDerWaalsContact C-N 3.27Å; V596-T598 PolarHBondContact O-N 3.49Å; V596-S673 WeakPolarHBondContact O-CB 3.47Å; V596-S673 PolarHBondContact O-N 3.18Å; V596-S673 PolarHBondContact O-OG 3.06Å
597	D	92.2	Very high	93.1	Very high	112 Å²	112	34.7 Å²	34.7	60%	0.599	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.7	2.6	177.4	63	-34	0	0	0	113.7	P595 L599	P595-D597 VanDerWaalsContact C-N 3.27Å; P595-D597 VanDerWaalsContact CB-OD1 3.26Å; P595-D597 WeakPolarHBondContact CB-OD1 3.43Å; P595-D597 WeakPolarHBondContact CG-OD1 3.27Å; P595-D597 PolarHBondContact O-N 3.14Å; D597-L599 PolarHBondContact O-N 3.21Å
598	T	95.6	Very high	93.1	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.018	19%	0.19	C	C	.	.			trans	-68.6	123.8	178.5	-56.5	0	0	0	0	111.3	H499 H594 P595 V596 F600 Y671 N672	H499-T598 HydrophobicContact CB-CG2 3.91Å; H499-T598 VanDerWaalsContact CD2-CG2 3.44Å; H499-T598 WeakPolarHBondContact CD2-CG2 3.47Å; H594-T598 HydrophobicContact CB-CG2 4.36Å; P595-T598 VanDerWaalsContact CD-OG1 3.27Å; P595-T598 WeakPolarHBondContact CD-OG1 3.47Å; P595-T598 WeakPolarHBondContact CG-OG1 3.38Å; P595-T598 VanDerWaalsContact O-CB 3.29Å; P595-T598 WeakPolarHBondContact O-CB 3.23Å; P595-T598 PolarHBondContact O-N 3.05Å; P595-T598 PolarHBondContact O-OG1 2.73Å; V596-T598 VanDerWaalsContact C-N 3.27Å; V596-T598 PolarHBondContact O-N 3.49Å; T598-F600 HydrophobicContact CG2-CD1 3.72Å; T598-F600 HydrophobicContact CG2-CE1 3.5Å; T598-F600 HydrophobicContact CG2-CG 4.34Å; T598-F600 HydrophobicContact CG2-CZ 3.98Å; T598-Y671 CarbonylContact O-C 3.56Å; T598-Y671 WeakPolarHBondContact O-CA 3.35Å; T598-N672 PolarHBondContact O-N 3.23Å
599	L	96.4	Very high	93.3	Very high	3 Å²	3	36 Å²	36	2%	0.016	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	115.2	164.4	175.7	58.1	0	0	0	108.9	V498 H499 D597 R618 Y671	V498-L599 HydrophobicContact CG2-CD2 4.06Å; H499-L599 PolarHBondContact N-O 3.02Å; D597-L599 PolarHBondContact O-N 3.21Å; L599-R618 HydrophobicContact CD2-CG 4.13Å; L599-Y671 HydrophobicContact CB-CD1 4.24Å; L599-Y671 HydrophobicContact CB-CE1 3.93Å; L599-Y671 HydrophobicContact CD1-CD2 4.38Å; L599-Y671 HydrophobicContact CD1-CE2 4.31Å
600	F	97.1	Very high	93.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	147.6	174.4	-67.3	-55	0	0	0	111.3	H499 I501 M587 I590 H594 T598 C669 F670 N672	H499-F600 HydrophobicContact CB-CD1 3.95Å; H499-F600 HydrophobicContact CB-CE1 4.37Å; H499-F600 CarbonylContact O-C 3.57Å; H499-F600 WeakPolarHBondContact O-CA 3.31Å; I501-F600 HydrophobicContact CD1-CB 4.22Å; I501-F600 HydrophobicContact CD1-CD1 3.42Å; I501-F600 VanDerWaalsContact CD1-CD1 3.42Å; I501-F600 HydrophobicContact CD1-CE1 3.86Å; I501-F600 HydrophobicContact CD1-CG 3.92Å; I501-F600 HydrophobicContact CG1-CD1 4.36Å; M587-F600 HydrophobicContact CE-CD2 3.76Å; M587-F600 HydrophobicContact CE-CE2 3.89Å; M587-F600 HydrophobicContact CE-CG 4.15Å; M587-F600 HydrophobicContact CE-CZ 4.42Å; I590-F600 HydrophobicContact CG2-CE1 3.94Å; I590-F600 HydrophobicContact CG2-CZ 3.98Å; H594-F600 HydrophobicContact CB-CE1 4.12Å; H594-F600 HydrophobicContact CB-CZ 3.73Å; H594-F600 AromaticContact CG-CE1 3.78Å; H594-F600 AromaticContact CG-CZ 3.82Å; H594-F600 AromaticContact ND1-CE1 3.95Å; H594-F600 AromaticContact ND1-CZ 3.98Å; T598-F600 HydrophobicContact CG2-CD1 3.72Å; T598-F600 HydrophobicContact CG2-CE1 3.5Å; T598-F600 HydrophobicContact CG2-CG 4.34Å; T598-F600 HydrophobicContact CG2-CZ 3.98Å; F600-C669 VanDerWaalsContact O-CA 3.32Å; F600-C669 WeakPolarHBondContact O-CA 3.24Å; F600-F670 HydrophobicContact CB-CE2 4.43Å; F600-F670 HydrophobicContact CD2-CD2 4.42Å; F600-F670 AromaticContact CD2-CE2 3.97Å; F600-F670 HydrophobicContact CD2-CE2 3.97Å; F600-F670 PolarHBondContact N-O 3.03Å; F600-F670 PolarHBondContact O-N 2.77Å; F600-F670 VanDerWaalsContact O-N 3.16Å; F600-N672 HydrophobicContact CD2-CB 4.18Å; F600-N672 HydrophobicContact CE2-CB 3.59Å; F600-N672 HydrophobicContact CZ-CB 4.27Å
601	F	97.1	Very high	93.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	123	160.9	174.2	-135.9	0	0	0	109	V498 H499 I500 I501 A603 I609 F613 L614 A668 C669 L718	V498-F601 HydrophobicContact CG1-CB 3.61Å; H499-F601 PolarHBondContact O-N 2.68Å; I500-F601 CarbonylContact C-O 3.59Å; I500-F601 WeakPolarHBondContact CA-O 3.29Å; I500-F601 HydrophobicContact CG1-CD1 4.2Å; I500-F601 HydrophobicContact CG2-CD1 4.07Å; I501-F601 PolarHBondContact N-O 2.7Å; F601-A603 HydrophobicContact CD1-CB 4.28Å; F601-A603 HydrophobicContact CE1-CB 3.62Å; F601-A603 HydrophobicContact CE2-CB 4.28Å; F601-A603 HydrophobicContact CZ-CB 3.61Å; F601-I609 HydrophobicContact CD1-CD1 4.45Å; F601-I609 HydrophobicContact CE1-CD1 3.87Å; F601-I609 HydrophobicContact CE1-CG1 4.11Å; F601-I609 HydrophobicContact CE1-CG2 4.3Å; F601-F613 AromaticContact CD1-CE1 3.78Å; F601-F613 HydrophobicContact CD1-CE1 3.78Å; F601-F613 AromaticContact CD2-CE1 3.91Å; F601-F613 HydrophobicContact CD2-CE1 3.91Å; F601-F613 HydrophobicContact CD2-CZ 4.01Å; F601-F613 AromaticContact CE1-CD1 3.99Å; F601-F613 HydrophobicContact CE1-CD1 3.99Å; F601-F613 AromaticContact CE1-CE1 3.31Å; F601-F613 HydrophobicContact CE1-CE1 3.31Å; F601-F613 HydrophobicContact CE1-CZ 4.1Å; F601-F613 AromaticContact CE2-CE1 3.48Å; F601-F613 HydrophobicContact CE2-CE1 3.48Å; F601-F613 VanDerWaalsContact CE2-CE1 3.48Å; F601-F613 AromaticContact CE2-CZ 3.4Å; F601-F613 HydrophobicContact CE2-CZ 3.4Å; F601-F613 HydrophobicContact CG-CE1 4.06Å; F601-F613 HydrophobicContact CZ-CD1 4.07Å; F601-F613 AromaticContact CZ-CE1 3.16Å; F601-F613 HydrophobicContact CZ-CE1 3.16Å; F601-F613 AromaticContact CZ-CZ 3.45Å; F601-F613 HydrophobicContact CZ-CZ 3.45Å; F601-F613 VanDerWaalsContact CZ-CZ 3.45Å; F601-L614 HydrophobicContact CD1-CD2 4.46Å; F601-A668 CarbonylContact C-O 3.58Å; F601-A668 WeakPolarHBondContact CA-O 3.47Å; F601-C669 WeakPolarHBondContact CD2-SG 3.45Å; F601-L718 HydrophobicContact CZ-CD1 4.09Å
602	L	95.7	Very high	93	Very high	7 Å²	7	42.5 Å²	42.5	4%	0.037	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	132.5	172	-51.2	-172.4	0	0	0	109.2	I501 M587 D666 E667 A668 F670 I698	I501-L602 HydrophobicContact CB-CD2 3.81Å; I501-L602 HydrophobicContact CD1-CD2 3.62Å; I501-L602 HydrophobicContact CG1-CD2 4.3Å; I501-L602 HydrophobicContact CG2-CD2 4.15Å; M587-L602 HydrophobicContact CE-CD2 4.14Å; M587-L602 HydrophobicContact CG-CD1 4.24Å; M587-L602 HydrophobicContact SD-CD1 4.27Å; M587-L602 HydrophobicContact SD-CD2 3.59Å; M587-L602 VanDerWaalsContact SD-CD2 3.59Å; L602-D666 WeakPolarHBondContact CB-O 3.29Å; L602-E667 WeakPolarHBondContact O-CA 3.3Å; L602-A668 HydrophobicContact CD1-CB 4.45Å; L602-A668 PolarHBondContact N-O 2.82Å; L602-A668 PolarHBondContact O-N 3.39Å; L602-F670 HydrophobicContact CD1-CE1 3.93Å; L602-F670 HydrophobicContact CD1-CZ 4.14Å; L602-F670 HydrophobicContact CG-CE1 4.12Å; L602-F670 HydrophobicContact CG-CZ 4.42Å; L602-I698 HydrophobicContact CD1-CD1 3.43Å; L602-I698 VanDerWaalsContact CD1-CD1 3.43Å
603	A	93.8	Very high	93	Very high	3 Å²	3	35 Å²	35	3%	0.025	19%	0.188	C	C	.	.			trans	-152.7	164.1	179.4	0	0	0	0	0	111.5	I501 I502 P503 F601 T607 I609	I501-A603 PolarHBondContact O-N 2.91Å; I502-A603 HydrophobicContact CD1-CB 3.8Å; I502-A603 WeakPolarHBondContact CD1-O 3.44Å; P503-A603 VanDerWaalsContact CD-O 3.24Å; P503-A603 WeakPolarHBondContact CD-O 3.22Å; F601-A603 HydrophobicContact CD1-CB 4.28Å; F601-A603 HydrophobicContact CE1-CB 3.62Å; F601-A603 HydrophobicContact CE2-CB 4.28Å; F601-A603 HydrophobicContact CZ-CB 3.61Å; A603-T607 HydrophobicContact CB-CG2 4.42Å; A603-I609 HydrophobicContact CB-CD1 4.15Å
604	H	91.2	Very high	93.1	Very high	20 Å²	20	29.1 Å²	29.1	9%	0.093	16%	0.162	C	C	.	.			trans	-96.8	169.9	174.1	-72.8	-85	0	0	0	112.5	N606 T607 D666 E667 R723	H604-N606 VanDerWaalsContact C-N 3.29Å; H604-N606 WeakPolarHBondContact CB-OD1 3.36Å; H604-N606 PolarHBondContact O-N 2.92Å; H604-T607 PolarHBondContact N-OG1 3.28Å; H604-T607 WeakPolarHBondContact O-CB 3.18Å; H604-T607 PolarHBondContact O-N 3.31Å; H604-T607 PolarHBondContact O-OG1 2.79Å; H604-D666 IonicContact CD2-OD2 3.7Å; H604-D666 IonicContact CE1-OD2 3.51Å; H604-D666 PolarHBondContact CE1-OD2 3.26Å; H604-D666 VanDerWaalsContact NE2-CB 3.29Å; H604-D666 WeakPolarHBondContact NE2-CB 3.33Å; H604-D666 IonicContact NE2-OD2 2.9Å; H604-D666 PolarHBondContact NE2-OD2 3.44Å; H604-E667 IonicContact CD2-OE1 2.75Å; H604-E667 PolarHBondContact CD2-OE1 3.05Å; H604-R723 PolarHBondContact CE1-NH2 3.4Å; H604-R723 PolarHBondContact ND1-NH2 2.85Å
605	V	91.6	Very high	93	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.024	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-28.2	177.1	-162.1	0	0	0	0	112.7	I502 L504 D508 V512 F515 T607	I502-V605 HydrophobicContact CG2-CG2 3.73Å; L504-V605 HydrophobicContact CD2-CG2 3.2Å; D508-V605 HydrophobicContact CB-CG2 4.01Å; V512-V605 HydrophobicContact CG2-CG1 4.23Å; F515-V605 HydrophobicContact CB-CG1 3.62Å; F515-V605 WeakPolarHBondContact CB-O 3.24Å; F515-V605 WeakPolarHBondContact CD2-O 3.34Å; F515-V605 HydrophobicContact CG-CG1 4.06Å; V605-T607 VanDerWaalsContact C-N 3.3Å
606	N	90.8	Very high	92.9	Very high	7 Å²	7	32.1 Å²	32.1	4%	0.037	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-0.1	177.1	59.4	-42.4	0	0	0	113.1	H604 Q720 Q721 R723	H604-N606 VanDerWaalsContact C-N 3.29Å; H604-N606 WeakPolarHBondContact CB-OD1 3.36Å; H604-N606 PolarHBondContact O-N 2.92Å; N606-Q720 HydrophobicContact CB-CG 4.34Å; N606-Q720 WeakPolarHBondContact ND2-CG 3.09Å; N606-Q720 WeakPolarHBondContact O-CA 3.17Å; N606-Q721 HydrophobicContact CB-CB 4.29Å; N606-Q721 PolarHBondContact ND2-O 2.96Å; N606-Q721 PolarHBondContact O-N 3.34Å; N606-R723 HydrophobicContact CB-CB 4.49Å
607	T	92	Very high	92.9	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.012	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	124.4	177	-41.9	0	0	0	0	110.6	A603 H604 V605 L718 Q720	A603-T607 HydrophobicContact CB-CG2 4.42Å; H604-T607 PolarHBondContact N-OG1 3.28Å; H604-T607 WeakPolarHBondContact O-CB 3.18Å; H604-T607 PolarHBondContact O-N 3.31Å; H604-T607 PolarHBondContact O-OG1 2.79Å; V605-T607 VanDerWaalsContact C-N 3.3Å; T607-L718 HydrophobicContact CG2-CD1 3.41Å; T607-L718 VanDerWaalsContact CG2-CD1 3.41Å; T607-L718 HydrophobicContact CG2-CG 4.08Å; T607-Q720 PolarHBondContact OG1-OE1 3.28Å
608	N	91.5	Very high	93	Very high	51 Å²	51	22.5 Å²	22.5	27%	0.273	11%	0.112	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	120.9	172.9	-173.6	6	0	0	0	110	V518 N522 N610 H719	V518-N608 VanDerWaalsContact CG1-OD1 3.23Å; V518-N608 WeakPolarHBondContact CG1-OD1 3.19Å; N522-N608 PolarHBondContact ND2-OD1 3.27Å; N608-N610 PolarHBondContact OD1-OD1 3.42Å; N608-H719 HydrophobicContact CB-CB 4.31Å; N608-H719 PolarHBondContact N-O 2.7Å
609	I	92.4	Very high	92.7	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.015	13%	0.128	C	C	.	.			trans	-109.8	116.6	-174	-51.9	174.7	0	0	0	109.5	I500 I502 F515 F519 N522 F601 A603 F613 L614	I500-I609 HydrophobicContact CD1-CD1 4.29Å; I500-I609 HydrophobicContact CD1-CG2 4.23Å; I500-I609 HydrophobicContact CG2-CD1 3.75Å; I502-I609 HydrophobicContact CD1-CD1 4.46Å; F515-I609 HydrophobicContact CE2-CD1 4.09Å; F515-I609 HydrophobicContact CZ-CD1 4.13Å; F519-I609 HydrophobicContact CD2-CB 4.08Å; F519-I609 HydrophobicContact CD2-CD1 4.38Å; F519-I609 HydrophobicContact CE2-CB 4.05Å; F519-I609 HydrophobicContact CE2-CD1 4.25Å; F519-I609 HydrophobicContact CE2-CG2 4.14Å; N522-I609 WeakPolarHBondContact CB-O 3.31Å; N522-I609 PolarHBondContact ND2-O 3.06Å; F601-I609 HydrophobicContact CD1-CD1 4.45Å; F601-I609 HydrophobicContact CE1-CD1 3.87Å; F601-I609 HydrophobicContact CE1-CG1 4.11Å; F601-I609 HydrophobicContact CE1-CG2 4.3Å; A603-I609 HydrophobicContact CB-CD1 4.15Å; I609-F613 HydrophobicContact CG2-CD1 4.37Å; I609-L614 HydrophobicContact CG2-CD1 4.15Å; I609-L614 HydrophobicContact CG2-CD2 3.91Å; I609-L614 HydrophobicContact CG2-CG 3.93Å
610	N	90.1	Very high	92.5	Very high	49 Å²	49	27.1 Å²	27.1	26%	0.262	14%	0.135	S	C	.	.			trans	-111.3	157.2	-179.4	-68.6	-19.2	0	0	0	111.5	N522 N608 E612 F613 L614	N522-N610 PolarHBondContact ND2-OD1 3.02Å; N608-N610 PolarHBondContact OD1-OD1 3.42Å; N610-E612 VanDerWaalsContact C-N 3.27Å; N610-E612 PolarHBondContact O-N 2.9Å; N610-F613 WeakPolarHBondContact O-CB 3.11Å; N610-F613 PolarHBondContact O-N 3.39Å; N610-F613 VanDerWaalsContact O-N 3.16Å; N610-L614 PolarHBondContact O-N 3.33Å
611	A	90.1	Very high	92.3	Very high	34 Å²	34	27.1 Å²	27.1	28%	0.281	14%	0.135	S	C	.	.	H	α-helix	trans	-60.1	-34.2	176.1	0	0	0	0	0	113.2	L614 N615	A611-L614 PolarHBondContact O-N 3.27Å; A611-N615 PolarHBondContact O-N 3.02Å
612	E	90.6	Very high	92.1	Very high	115 Å²	115	27.7 Å²	27.7	54%	0.537	14%	0.138	S	C	.	.	H	α-helix	trans	-60.2	-48.6	173.6	179.5	168.6	-165.4	0	0	111.4	N610 L614 N615 R616 A717	N610-E612 VanDerWaalsContact C-N 3.27Å; N610-E612 PolarHBondContact O-N 2.9Å; E612-L614 VanDerWaalsContact C-N 3.34Å; E612-L614 PolarHBondContact O-N 2.59Å; E612-N615 PolarHBondContact O-N 2.89Å; E612-R616 WeakPolarHBondContact O-CG 3.18Å; E612-R616 PolarHBondContact O-N 2.63Å; E612-R616 IonicContact OE1-NH2 2.8Å; E612-A717 HydrophobicContact CB-CB 4.34Å; E612-A717 HydrophobicContact CG-CB 4.09Å
613	F	92.8	Very high	91.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-59.4	-44.1	176.1	173	-92.8	0	0	0	111.7	F601 I609 N610 N615 R616 C617 F628 P630 E715 A717 L718	F601-F613 AromaticContact CD1-CE1 3.78Å; F601-F613 HydrophobicContact CD1-CE1 3.78Å; F601-F613 AromaticContact CD2-CE1 3.91Å; F601-F613 HydrophobicContact CD2-CE1 3.91Å; F601-F613 HydrophobicContact CD2-CZ 4.01Å; F601-F613 AromaticContact CE1-CD1 3.99Å; F601-F613 HydrophobicContact CE1-CD1 3.99Å; F601-F613 AromaticContact CE1-CE1 3.31Å; F601-F613 HydrophobicContact CE1-CE1 3.31Å; F601-F613 HydrophobicContact CE1-CZ 4.1Å; F601-F613 AromaticContact CE2-CE1 3.48Å; F601-F613 HydrophobicContact CE2-CE1 3.48Å; F601-F613 VanDerWaalsContact CE2-CE1 3.48Å; F601-F613 AromaticContact CE2-CZ 3.4Å; F601-F613 HydrophobicContact CE2-CZ 3.4Å; F601-F613 HydrophobicContact CG-CE1 4.06Å; F601-F613 HydrophobicContact CZ-CD1 4.07Å; F601-F613 AromaticContact CZ-CE1 3.16Å; F601-F613 HydrophobicContact CZ-CE1 3.16Å; F601-F613 AromaticContact CZ-CZ 3.45Å; F601-F613 HydrophobicContact CZ-CZ 3.45Å; F601-F613 VanDerWaalsContact CZ-CZ 3.45Å; I609-F613 HydrophobicContact CG2-CD1 4.37Å; N610-F613 WeakPolarHBondContact O-CB 3.11Å; N610-F613 PolarHBondContact O-N 3.39Å; N610-F613 VanDerWaalsContact O-N 3.16Å; F613-N615 VanDerWaalsContact C-N 3.27Å; F613-N615 PolarHBondContact O-N 3.28Å; F613-R616 WeakPolarHBondContact O-CA 3.12Å; F613-R616 WeakPolarHBondContact O-CB 3.42Å; F613-R616 PolarHBondContact O-N 2.94Å; F613-C617 HydrophobicContact CE1-CB 4.11Å; F613-C617 HydrophobicContact CZ-CB 4.25Å; F613-C617 PolarHBondContact O-N 3.43Å; F613-F628 HydrophobicContact CE2-CE1 4.4Å; F613-P630 HydrophobicContact CE2-CB 3.88Å; F613-P630 HydrophobicContact CE2-CG 3.92Å; F613-P630 HydrophobicContact CZ-CB 4.46Å; F613-P630 HydrophobicContact CZ-CG 4Å; F613-E715 HydrophobicContact CD2-CG 3.55Å; F613-E715 HydrophobicContact CE2-CG 3.83Å; F613-A717 HydrophobicContact CB-CB 4.2Å; F613-L718 HydrophobicContact CD1-CD1 4.17Å; F613-L718 HydrophobicContact CD2-CB 3.76Å; F613-L718 HydrophobicContact CD2-CD1 3.85Å; F613-L718 HydrophobicContact CD2-CD2 4.3Å; F613-L718 HydrophobicContact CD2-CG 4.19Å; F613-L718 HydrophobicContact CE1-CD1 4.29Å; F613-L718 HydrophobicContact CE2-CB 4.07Å; F613-L718 HydrophobicContact CE2-CD1 3.94Å; F613-L718 HydrophobicContact CE2-CD2 3.77Å; F613-L718 HydrophobicContact CE2-CG 4.16Å; F613-L718 HydrophobicContact CG-CB 4.48Å; F613-L718 HydrophobicContact CG-CD1 3.97Å; F613-L718 HydrophobicContact CZ-CD1 4.16Å; F613-L718 HydrophobicContact CZ-CD2 4.21Å
614	L	93.4	Very high	91.7	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-61.6	-37	178.5	-67.9	171.5	0	0	0	111.5	V498 I500 E528 A530 F601 I609 N610 A611 E612 C617 R618	V498-L614 HydrophobicContact CB-CD2 4.22Å; V498-L614 HydrophobicContact CG1-CD2 3.98Å; V498-L614 HydrophobicContact CG2-CD2 4.35Å; I500-L614 HydrophobicContact CD1-CD2 4Å; I500-L614 HydrophobicContact CG1-CD2 4.37Å; E528-L614 HydrophobicContact CG-CD1 3.68Å; A530-L614 HydrophobicContact CB-CD1 4.15Å; F601-L614 HydrophobicContact CD1-CD2 4.46Å; I609-L614 HydrophobicContact CG2-CD1 4.15Å; I609-L614 HydrophobicContact CG2-CD2 3.91Å; I609-L614 HydrophobicContact CG2-CG 3.93Å; N610-L614 PolarHBondContact O-N 3.33Å; A611-L614 PolarHBondContact O-N 3.27Å; E612-L614 VanDerWaalsContact C-N 3.34Å; E612-L614 PolarHBondContact O-N 2.59Å; L614-C617 WeakPolarHBondContact O-CB 3.38Å; L614-C617 PolarHBondContact O-N 3.29Å; L614-R618 VanDerWaalsContact O-CG 3.23Å; L614-R618 WeakPolarHBondContact O-CG 3.15Å; L614-R618 PolarHBondContact O-N 2.72Å
615	N	91.9	Very high	91.7	Very high	47 Å²	47	40.9 Å²	40.9	25%	0.251	20%	0.199	S	C	.	.	H	α-helix	trans	-65.7	-39.1	171.3	-73.5	-23.7	0	0	0	112.8	A611 E612 F613 R618 M619	A611-N615 PolarHBondContact O-N 3.02Å; E612-N615 PolarHBondContact O-N 2.89Å; F613-N615 VanDerWaalsContact C-N 3.27Å; F613-N615 PolarHBondContact O-N 3.28Å; N615-R618 PolarHBondContact O-N 3.46Å; N615-R618 PolarHBondContact OD1-NH1 3.44Å; N615-M619 WeakPolarHBondContact O-CB 3.4Å; N615-M619 VanDerWaalsContact O-CG 3.27Å; N615-M619 WeakPolarHBondContact O-CG 3.28Å; N615-M619 PolarHBondContact O-N 2.81Å
616	R	91.9	Very high	91.8	Very high	120 Å²	120	41.3 Å²	41.3	45%	0.453	20%	0.201	S	C	.	.	H	α-helix	trans	-61.6	-44.7	173	-61.9	-72.4	177.7	-154.5	-5.2	111.7	E612 F613 R618 M619 N620 E715	E612-R616 WeakPolarHBondContact O-CG 3.18Å; E612-R616 PolarHBondContact O-N 2.63Å; E612-R616 IonicContact OE1-NH2 2.8Å; F613-R616 WeakPolarHBondContact O-CA 3.12Å; F613-R616 WeakPolarHBondContact O-CB 3.42Å; F613-R616 PolarHBondContact O-N 2.94Å; R616-R618 PolarHBondContact O-N 3.46Å; R616-M619 PolarHBondContact O-N 3.49Å; R616-N620 VanDerWaalsContact O-CB 3.24Å; R616-N620 WeakPolarHBondContact O-CB 3.42Å; R616-N620 VanDerWaalsContact O-CG 3.31Å; R616-N620 PolarHBondContact O-N 3.22Å; R616-N620 PolarHBondContact O-ND2 3.22Å; R616-E715 WeakPolarHBondContact CB-OE2 3.41Å; R616-E715 VanDerWaalsContact CG-OE2 3.25Å; R616-E715 WeakPolarHBondContact CG-OE2 3.29Å
617	C	93.6	Very high	92	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-56	-48.4	173.7	-176.8	0	0	0	0	111.7	F613 L614 S621 C669	F613-C617 HydrophobicContact CE1-CB 4.11Å; F613-C617 HydrophobicContact CZ-CB 4.25Å; F613-C617 PolarHBondContact O-N 3.43Å; L614-C617 WeakPolarHBondContact O-CB 3.38Å; L614-C617 PolarHBondContact O-N 3.29Å; C617-S621 WeakPolarHBondContact O-CB 3.35Å; C617-S621 PolarHBondContact O-N 3.16Å; C617-S621 VanDerWaalsContact O-N 3.17Å; C617-S621 PolarHBondContact O-OG 3.23Å; C617-C669 HydrophobicContact CB-CB 4.13Å; C617-C669 WeakPolarHBondContact CB-SG 3.03Å; C617-C669 WeakPolarHBondContact SG-CB 3.4Å; C617-C669 CovalentContact SG-SG 2.04Å; C617-C669 PolarHBondContact SG-SG 2.78Å
618	R	93	Very high	92.2	Very high	2 Å²	2	41 Å²	41	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-61.9	-44.3	176.4	-67	171	-176.5	119.7	2.9	113.2	V492 E494 T496 V498 E528 N529 L599 L614 N615 R616	V492-R618 WeakPolarHBondContact CG1-O 3.37Å; E494-R618 WeakPolarHBondContact O-CD 3.38Å; E494-R618 PolarHBondContact O-NE 3.48Å; T496-R618 WeakPolarHBondContact O-CD 3.26Å; T496-R618 PolarHBondContact O-NE 2.95Å; T496-R618 VanDerWaalsContact OG1-CG 3.29Å; T496-R618 WeakPolarHBondContact OG1-CG 3.48Å; V498-R618 HydrophobicContact CG2-CG 3.72Å; E528-R618 IonicContact OE1-CZ 3.39Å; E528-R618 IonicContact OE1-NH1 3.27Å; E528-R618 PolarHBondContact OE1-NH1 3.32Å; E528-R618 IonicContact OE1-NH2 3.93Å; E528-R618 PolarHBondContact OE1-NH2 2.76Å; N529-R618 PolarHBondContact O-NH2 2.88Å; L599-R618 HydrophobicContact CD2-CG 4.13Å; L614-R618 VanDerWaalsContact O-CG 3.23Å; L614-R618 WeakPolarHBondContact O-CG 3.15Å; L614-R618 PolarHBondContact O-N 2.72Å; N615-R618 PolarHBondContact O-N 3.46Å; N615-R618 PolarHBondContact OD1-NH1 3.44Å; R616-R618 PolarHBondContact O-N 3.46Å
619	M	89.6	Confident	92.5	Very high	71 Å²	71	38.6 Å²	38.6	35%	0.35	19%	0.187	S	C	.	.	H	α-helix	trans	-77.5	-27.6	-174.3	-67.9	-58.5	-67.7	0	0	113.5	V492 E494 N615 R616	V492-M619 HydrophobicContact CB-CE 4.14Å; V492-M619 HydrophobicContact CB-SD 4.03Å; V492-M619 HydrophobicContact CG1-SD 4.07Å; E494-M619 HydrophobicContact CG-CG 4.37Å; E494-M619 HydrophobicContact CG-SD 4.05Å; N615-M619 WeakPolarHBondContact O-CB 3.4Å; N615-M619 VanDerWaalsContact O-CG 3.27Å; N615-M619 WeakPolarHBondContact O-CG 3.28Å; N615-M619 PolarHBondContact O-N 2.81Å; R616-M619 PolarHBondContact O-N 3.49Å
620	N	91.9	Very high	92.7	Very high	33 Å²	33	38.6 Å²	38.6	18%	0.176	19%	0.187	C	C	.	.	H	α-helix	trans	-95.3	-14.4	-178	-66.6	-26	0	0	0	113.9	R616 Q626 F628 F711	R616-N620 VanDerWaalsContact O-CB 3.24Å; R616-N620 WeakPolarHBondContact O-CB 3.42Å; R616-N620 VanDerWaalsContact O-CG 3.31Å; R616-N620 PolarHBondContact O-N 3.22Å; R616-N620 PolarHBondContact O-ND2 3.22Å; N620-Q626 WeakPolarHBondContact O-CG 3.15Å; N620-Q626 PolarHBondContact O-NE2 3.46Å; N620-F628 HydrophobicContact CB-CB 3.79Å; N620-F628 HydrophobicContact CB-CD1 3.81Å; N620-F628 HydrophobicContact CB-CD2 3.73Å; N620-F628 HydrophobicContact CB-CE1 4.28Å; N620-F628 HydrophobicContact CB-CE2 4.21Å; N620-F628 HydrophobicContact CB-CG 3.5Å; N620-F628 VanDerWaalsContact CB-CG 3.5Å; N620-F628 HydrophobicContact CB-CZ 4.46Å; N620-F628 WeakPolarHBondContact ND2-CZ 3.15Å; N620-F711 HydrophobicContact CB-CD1 4.15Å; N620-F711 HydrophobicContact CB-CE1 4.36Å
621	S	93.5	Very high	92.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.177	C	C	.	.			trans	-97.4	121.2	173.1	-61.3	0	0	0	0	110.5	C617 C669	C617-S621 WeakPolarHBondContact O-CB 3.35Å; C617-S621 PolarHBondContact O-N 3.16Å; C617-S621 VanDerWaalsContact O-N 3.17Å; C617-S621 PolarHBondContact O-OG 3.23Å; S621-C669 WeakPolarHBondContact OG-CB 3.44Å; S621-C669 PolarHBondContact OG-O 3.44Å
622	I	91.9	Very high	93.1	Very high	11 Å²	11	35.3 Å²	35.3	6%	0.056	16%	0.164	C	C	.	.	B	Isolated β-bridge	trans	-130.3	112.4	-174.2	-50.8	-177.8	0	0	0	109.4	M489 P490 V492 N624 W625 Q626	M489-I622 HydrophobicContact CE-CD1 3.75Å; P490-I622 HydrophobicContact CB-CG2 3.79Å; P490-I622 HydrophobicContact CG-CG2 3.94Å; V492-I622 HydrophobicContact CG2-CD1 3.76Å; V492-I622 HydrophobicContact CG2-CG1 3.86Å; I622-N624 PolarHBondContact O-N 3.17Å; I622-W625 HydrophobicContact CB-CB 4.09Å; I622-W625 HydrophobicContact CG2-CB 3.81Å; I622-W625 HydrophobicContact CG2-CG 4.41Å; I622-W625 PolarHBondContact O-N 3.42Å; I622-Q626 HydrophobicContact CB-CB 4.13Å; I622-Q626 HydrophobicContact CG1-CB 4.32Å; I622-Q626 PolarHBondContact N-O 3.28Å; I622-Q626 PolarHBondContact O-N 3.07Å
623	N	91.2	Very high	93.2	Very high	64 Å²	64	30 Å²	30	34%	0.342	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	128.1	-176.5	-171.3	0.2	0	0	0	112.6	W625 Y671 S673 D674	N623-W625 PolarHBondContact O-N 2.63Å; N623-Y671 HydrophobicContact CB-CD1 4.34Å; N623-Y671 HydrophobicContact CB-CD2 3.64Å; N623-Y671 HydrophobicContact CB-CE2 3.87Å; N623-Y671 HydrophobicContact CB-CG 3.89Å; N623-S673 PolarHBondContact OD1-OG 3.07Å; N623-D674 WeakPolarHBondContact CA-OD2 3.23Å
624	N	91.2	Very high	93.2	Very high	112 Å²	112	30.6 Å²	30.6	60%	0.599	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.8	14	-173.3	-49.3	-81.6	0	0	0	115.7	I622 D674	I622-N624 PolarHBondContact O-N 3.17Å; N624-D674 WeakPolarHBondContact CA-OD1 3.4Å; N624-D674 PolarHBondContact N-OD1 3.17Å; N624-D674 PolarHBondContact N-OD2 3.04Å
625	W	90.9	Very high	93.1	Very high	131 Å²	131	32.1 Å²	32.1	50%	0.496	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.9	-51.8	180	-176.1	-98.6	0	0	0	114.3	P490 I622 N623 H709	P490-W625 HydrophobicContact CG-CB 4.41Å; P490-W625 HydrophobicContact CG-CD2 4.38Å; P490-W625 HydrophobicContact CG-CG 4.08Å; I622-W625 HydrophobicContact CB-CB 4.09Å; I622-W625 HydrophobicContact CG2-CB 3.81Å; I622-W625 HydrophobicContact CG2-CG 4.41Å; I622-W625 PolarHBondContact O-N 3.42Å; N623-W625 PolarHBondContact O-N 2.63Å; W625-H709 PolarHBondContact O-N 3.42Å
626	Q	93.3	Very high	93.2	Very high	14 Å²	14	31.1 Å²	31.1	7%	0.065	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	135.4	-170.5	-177.9	172.2	-67.5	0	0	112.8	N620 I622 H709 F711	N620-Q626 WeakPolarHBondContact O-CG 3.15Å; N620-Q626 PolarHBondContact O-NE2 3.46Å; I622-Q626 HydrophobicContact CB-CB 4.13Å; I622-Q626 HydrophobicContact CG1-CB 4.32Å; I622-Q626 PolarHBondContact N-O 3.28Å; I622-Q626 PolarHBondContact O-N 3.07Å; Q626-H709 VanDerWaalsContact CA-O 3.27Å; Q626-H709 WeakPolarHBondContact CA-O 3.37Å; Q626-H709 HydrophobicContact CB-CB 4.25Å; Q626-H709 HydrophobicContact CG-CB 4.28Å; Q626-H709 WeakPolarHBondContact CG-O 3.39Å; Q626-H709 PolarHBondContact OE1-ND1 3.45Å; Q626-F711 HydrophobicContact CG-CB 3.86Å
627	V	96	Very high	93.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	146.8	168.8	-65.3	0	0	0	0	109.8	F629 F670 D674 F702 L708 H709 V710 F711	V627-F629 HydrophobicContact CB-CE2 4.31Å; V627-F629 HydrophobicContact CG2-CD2 4.37Å; V627-F629 HydrophobicContact CG2-CE2 3.8Å; V627-F670 HydrophobicContact CB-CB 4.23Å; V627-F670 HydrophobicContact CG1-CB 3.77Å; V627-D674 HydrophobicContact CG1-CB 4.5Å; V627-F702 HydrophobicContact CG1-CD1 3.99Å; V627-F702 HydrophobicContact CG1-CE1 3.78Å; V627-F702 HydrophobicContact CG1-CE2 4.4Å; V627-F702 HydrophobicContact CG1-CG 4.41Å; V627-F702 HydrophobicContact CG1-CZ 3.99Å; V627-F702 HydrophobicContact CG2-CB 4.17Å; V627-F702 HydrophobicContact CG2-CD1 4.25Å; V627-F702 HydrophobicContact CG2-CD2 4.41Å; V627-F702 HydrophobicContact CG2-CG 4.04Å; V627-L708 HydrophobicContact CG1-CD1 4Å; V627-H709 PolarHBondContact N-O 3.04Å; V627-V710 HydrophobicContact CG2-CB 4.28Å; V627-V710 HydrophobicContact CG2-CG1 4.26Å; V627-V710 HydrophobicContact CG2-CG2 3.96Å; V627-F711 PolarHBondContact O-N 3.36Å
628	F	96.1	Very high	92.8	Very high	1 Å²	1	29.3 Å²	29.3	0%	0.004	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.8	-173.4	176.1	-128.9	0	0	0	111.6	F613 N620 P630 C669 F711 A713	F613-F628 HydrophobicContact CE2-CE1 4.4Å; N620-F628 HydrophobicContact CB-CB 3.79Å; N620-F628 HydrophobicContact CB-CD1 3.81Å; N620-F628 HydrophobicContact CB-CD2 3.73Å; N620-F628 HydrophobicContact CB-CE1 4.28Å; N620-F628 HydrophobicContact CB-CE2 4.21Å; N620-F628 HydrophobicContact CB-CG 3.5Å; N620-F628 VanDerWaalsContact CB-CG 3.5Å; N620-F628 HydrophobicContact CB-CZ 4.46Å; N620-F628 WeakPolarHBondContact ND2-CZ 3.15Å; F628-P630 HydrophobicContact CE1-CB 3.97Å; F628-P630 HydrophobicContact CE1-CG 4.31Å; F628-P630 HydrophobicContact CZ-CB 3.83Å; F628-C669 HydrophobicContact CB-CB 4.13Å; F628-C669 HydrophobicContact CD1-CB 3.99Å; F628-C669 PolarHBondContact N-O 3.43Å; F628-C669 PolarHBondContact O-N 3.25Å; F628-F711 CarbonylContact C-O 3.58Å; F628-F711 WeakPolarHBondContact CA-O 3.46Å; F628-F711 AromaticContact CD2-CD1 3.54Å; F628-F711 HydrophobicContact CD2-CD1 3.54Å; F628-F711 AromaticContact CD2-CE1 3.99Å; F628-F711 HydrophobicContact CD2-CE1 3.99Å; F628-F711 HydrophobicContact CD2-CG 4.44Å; F628-F711 AromaticContact CE2-CD1 3.97Å; F628-F711 HydrophobicContact CE2-CD1 3.97Å; F628-F711 AromaticContact CE2-CE1 3.93Å; F628-F711 HydrophobicContact CE2-CE1 3.93Å; F628-A713 HydrophobicContact CE2-CB 4.38Å
629	F	96.8	Very high	92.5	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.009	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	95.7	175.9	-73.1	-90.3	0	0	0	108.7	V627 A668 I698 Y699 F702 V710 F711 R712 A713	V627-F629 HydrophobicContact CB-CE2 4.31Å; V627-F629 HydrophobicContact CG2-CD2 4.37Å; V627-F629 HydrophobicContact CG2-CE2 3.8Å; F629-A668 HydrophobicContact CD1-CB 3.76Å; F629-A668 HydrophobicContact CE1-CB 3.48Å; F629-A668 VanDerWaalsContact CE1-CB 3.48Å; F629-A668 HydrophobicContact CZ-CB 4.18Å; F629-I698 HydrophobicContact CZ-CG2 4.26Å; F629-Y699 HydrophobicContact CD1-CD2 4.08Å; F629-Y699 AromaticContact CD2-CD2 3.9Å; F629-Y699 HydrophobicContact CD2-CD2 3.9Å; F629-Y699 HydrophobicContact CE1-CD2 4.23Å; F629-Y699 HydrophobicContact CE1-CG 4.48Å; F629-Y699 HydrophobicContact CE2-CD2 4.06Å; F629-Y699 AromaticContact CG-CD2 3.91Å; F629-Y699 HydrophobicContact CG-CD2 3.91Å; F629-Y699 HydrophobicContact CZ-CD2 4.21Å; F629-F702 HydrophobicContact CE2-CD2 4.24Å; F629-F702 AromaticContact CZ-CD2 3.93Å; F629-F702 HydrophobicContact CZ-CD2 3.93Å; F629-V710 HydrophobicContact CD2-CG1 3.76Å; F629-V710 HydrophobicContact CE2-CG1 3.88Å; F629-F711 PolarHBondContact N-O 3.09Å; F629-R712 HydrophobicContact CB-CB 4.12Å; F629-R712 HydrophobicContact CB-CG 3.89Å; F629-R712 VanDerWaalsContact O-CA 3.27Å; F629-R712 WeakPolarHBondContact O-CA 3.38Å; F629-R712 WeakPolarHBondContact O-CG 3.47Å; F629-A713 PolarHBondContact O-N 3.21Å
630	P	96	Very high	92.3	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.019	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	148.2	175.3	30.4	-36.5	0	0	0	110.9	F613 F628 E667 A713 E715 L718	F613-P630 HydrophobicContact CE2-CB 3.88Å; F613-P630 HydrophobicContact CE2-CG 3.92Å; F613-P630 HydrophobicContact CZ-CB 4.46Å; F613-P630 HydrophobicContact CZ-CG 4Å; F628-P630 HydrophobicContact CE1-CB 3.97Å; F628-P630 HydrophobicContact CE1-CG 4.31Å; F628-P630 HydrophobicContact CZ-CB 3.83Å; P630-E667 HydrophobicContact CG-CB 3.94Å; P630-A713 CarbonylContact C-O 3.5Å; P630-E715 HydrophobicContact CB-CB 3.84Å; P630-E715 HydrophobicContact CB-CG 4.32Å; P630-L718 HydrophobicContact CB-CD2 3.71Å; P630-L718 HydrophobicContact CG-CD2 3.68Å
631	I	94.9	Very high	91.9	Very high	13 Å²	13	32 Å²	32	7%	0.067	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	109.2	167.9	-58.5	172.4	0	0	0	106.4	F660 D661 R662 R712 A713 V714 E715	I631-F660 HydrophobicContact CG2-CB 4.08Å; I631-D661 WeakPolarHBondContact CG2-O 3.06Å; I631-R662 HydrophobicContact CD1-CG 4.46Å; I631-R662 HydrophobicContact CG2-CG 4.46Å; I631-R712 HydrophobicContact CD1-CG 4.06Å; I631-R712 HydrophobicContact CG1-CG 4Å; I631-A713 PolarHBondContact N-O 2.83Å; I631-V714 HydrophobicContact CB-CG2 4.5Å; I631-V714 HydrophobicContact CD1-CG2 4.46Å; I631-E715 PolarHBondContact O-N 3.45Å
632	H	94.1	Very high	91.4	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	160.1	-177.9	63.4	-90.6	0	0	0	113.2	Q634 F660 D661 S664 E667 L718 Q720	H632-Q634 PolarHBondContact NE2-OE1 2.88Å; H632-F660 WeakPolarHBondContact O-CA 3.3Å; H632-D661 PolarHBondContact O-N 2.93Å; H632-S664 VanDerWaalsContact CE1-CB 3.43Å; H632-S664 WeakPolarHBondContact CE1-CB 3.47Å; H632-E667 IonicContact CE1-OE1 3.15Å; H632-E667 IonicContact CE1-OE2 2.72Å; H632-E667 IonicContact ND1-OE1 2.74Å; H632-E667 IonicContact ND1-OE2 3.31Å; H632-E667 PolarHBondContact ND1-OE2 3.26Å; H632-L718 CarbonylContact C-O 3.51Å; H632-L718 WeakPolarHBondContact CA-O 3.34Å; H632-L718 HydrophobicContact CB-CB 4.25Å; H632-L718 HydrophobicContact CB-CD2 3.79Å; H632-L718 HydrophobicContact CB-CG 3.77Å; H632-L718 WeakPolarHBondContact CB-O 3.32Å; H632-Q720 VanDerWaalsContact CD2-CB 3.42Å; H632-Q720 WeakPolarHBondContact CD2-CB 3.46Å; H632-Q720 PolarHBondContact NE2-NE2 2.91Å
633	F	93.6	Very high	90.6	Very high	5 Å²	5	37.4 Å²	37.4	2%	0.022	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	109.8	165.5	-173	-99.2	0	0	0	109.7	V651 L653 G658 H659 F660 L718 H719 Q720	F633-V651 HydrophobicContact CE1-CG1 4.29Å; F633-L653 HydrophobicContact CB-CD2 4.15Å; F633-L653 HydrophobicContact CD2-CD2 3.81Å; F633-L653 HydrophobicContact CE2-CD2 4.33Å; F633-L653 HydrophobicContact CG-CD2 3.93Å; F633-G658 VanDerWaalsContact CE2-C 3.48Å; F633-G658 VanDerWaalsContact CZ-C 3.41Å; F633-G658 VanDerWaalsContact CZ-CA 3.41Å; F633-H659 CarbonylContact C-O 3.56Å; F633-F660 HydrophobicContact CB-CD1 4.01Å; F633-F660 HydrophobicContact CB-CE1 3.74Å; F633-F660 HydrophobicContact CB-CZ 4.43Å; F633-F660 HydrophobicContact CD2-CD1 4.23Å; F633-F660 HydrophobicContact CD2-CD2 4.38Å; F633-F660 HydrophobicContact CD2-CE1 4.05Å; F633-F660 HydrophobicContact CD2-CE2 4.2Å; F633-F660 HydrophobicContact CD2-CG 4.41Å; F633-F660 HydrophobicContact CD2-CZ 4.04Å; F633-F660 HydrophobicContact CG-CE1 4.39Å; F633-L718 PolarHBondContact N-O 3.16Å; F633-H719 AromaticContact CD1-ND1 3.97Å; F633-Q720 PolarHBondContact O-N 3.31Å
634	Q	92.1	Very high	89.7	Confident	11 Å²	11	41.4 Å²	41.4	5%	0.051	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	115.7	176.8	-176.8	55.3	67.9	0	0	109.9	H632 G658 H659 D661 Q720 Q721	H632-Q634 PolarHBondContact NE2-OE1 2.88Å; Q634-G658 CarbonylContact O-C 3.6Å; Q634-G658 WeakPolarHBondContact O-CA 3.43Å; Q634-H659 PolarHBondContact N-O 3.05Å; Q634-H659 PolarHBondContact O-N 3.32Å; Q634-D661 HydrophobicContact CB-CB 4.08Å; Q634-Q720 PolarHBondContact NE2-O 3.37Å; Q634-Q721 PolarHBondContact NE2-O 2.98Å; Q634-Q721 VanDerWaalsContact NE2-O 3.09Å
635	E	92.2	Very high	89.2	Confident	35 Å²	35	42.7 Å²	42.7	16%	0.164	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	144.5	171	-67.3	175.7	-174.9	0	0	110.7	V651 Q720 Q721	E635-V651 HydrophobicContact CG-CG1 4.34Å; E635-V651 HydrophobicContact CG-CG2 4.48Å; E635-V651 WeakPolarHBondContact OE1-CG2 3.21Å; E635-Q720 PolarHBondContact N-O 2.86Å; E635-Q721 WeakPolarHBondContact OE2-CA 3.12Å
636	Y	92.3	Very high	88.5	Confident	26 Å²	26	41.9 Å²	41.9	10%	0.102	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-77.3	160.2	172.7	-68.7	-40	0	0	0	112.4	P638 K655 A657 H659 E745 G746	Y636-P638 WeakPolarHBondContact O-CD 3.43Å; Y636-P638 VanDerWaalsContact O-N 3.14Å; Y636-K655 WeakPolarHBondContact CE2-O 3.28Å; Y636-A657 PolarHBondContact N-O 2.96Å; Y636-H659 HydrophobicContact CE1-CB 4.24Å; Y636-H659 AromaticContact CE1-ND1 3.42Å; Y636-H659 WeakPolarHBondContact CE1-ND1 3.45Å; Y636-E745 WeakPolarHBondContact CE1-O 3.41Å; Y636-G746 VanDerWaalsContact CA-O 3.3Å; Y636-G746 WeakPolarHBondContact CA-O 3.48Å
637	N	90.9	Very high	87.7	Confident	25 Å²	25	45.4 Å²	45.4	13%	0.134	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-50.7	119	175	-174.6	-18.1	0	0	0	111.3	D639 V640 S641 Y722 G746 L747	N637-D639 PolarHBondContact O-N 2.83Å; N637-D639 WeakPolarHBondContact OD1-CB 3.39Å; N637-D639 PolarHBondContact OD1-N 2.89Å; N637-V640 HydrophobicContact CB-CB 4.35Å; N637-V640 HydrophobicContact CB-CG2 4.17Å; N637-V640 PolarHBondContact O-N 3.4Å; N637-S641 PolarHBondContact O-N 3.1Å; N637-S641 PolarHBondContact O-OG 3.31Å; N637-S641 VanDerWaalsContact O-OG 3.11Å; N637-Y722 VanDerWaalsContact CA-CG 3.5Å; N637-Y722 HydrophobicContact CB-CD1 3.96Å; N637-Y722 HydrophobicContact CB-CD2 4.1Å; N637-Y722 HydrophobicContact CB-CE1 3.69Å; N637-Y722 HydrophobicContact CB-CE2 3.86Å; N637-Y722 HydrophobicContact CB-CG 4.14Å; N637-G746 PolarHBondContact N-O 2.88Å; N637-L747 WeakPolarHBondContact CB-O 3.44Å
638	P	87.1	Confident	86.8	Confident	56 Å²	56	48.3 Å²	48.3	36%	0.364	26%	0.264	S	S	.	.	H	α-helix	trans	-60	-29.8	-176.4	23.6	-34.7	0	0	0	113.5	Y636 V640 S641 Y642	Y636-P638 WeakPolarHBondContact O-CD 3.43Å; Y636-P638 VanDerWaalsContact O-N 3.14Å; P638-V640 PolarHBondContact O-N 2.7Å; P638-S641 WeakPolarHBondContact CA-OG 3.49Å; P638-Y642 HydrophobicContact CB-CD2 4.11Å; P638-Y642 PolarHBondContact O-N 2.92Å
639	D	86.4	Confident	85.5	Confident	124 Å²	124	53.6 Å²	53.6	66%	0.663	31%	0.308	S	S	*	.	H	α-helix	trans	-66.7	-24.8	177.8	-62.5	-29.6	0	0	0	112.6	N637	N637-D639 PolarHBondContact O-N 2.83Å; N637-D639 WeakPolarHBondContact OD1-CB 3.39Å; N637-D639 PolarHBondContact OD1-N 2.89Å
640	V	86.3	Confident	84.3	Confident	21 Å²	21	58.7 Å²	58.7	13%	0.127	34%	0.34	C	S	.	.	H	α-helix	trans	-96.6	-46.5	179.9	175.7	0	0	0	0	111	N637 P638 L747 Q752 L753 L756	N637-V640 HydrophobicContact CB-CB 4.35Å; N637-V640 HydrophobicContact CB-CG2 4.17Å; N637-V640 PolarHBondContact O-N 3.4Å; P638-V640 PolarHBondContact O-N 2.7Å; V640-L747 VanDerWaalsContact CB-O 3.29Å; V640-L747 WeakPolarHBondContact CB-O 3.44Å; V640-L747 WeakPolarHBondContact CG1-O 3.45Å; V640-L747 WeakPolarHBondContact CG2-O 3.2Å; V640-Q752 HydrophobicContact CG1-CB 3.98Å; V640-L753 HydrophobicContact CG1-CD2 4.06Å; V640-L756 HydrophobicContact CB-CD1 4.24Å; V640-L756 HydrophobicContact CG1-CD1 3.78Å; V640-L756 HydrophobicContact CG2-CD1 3.88Å
641	S	83.6	Confident	83.3	Confident	18 Å²	18	59.8 Å²	59.8	13%	0.126	35%	0.346	C	S	.	.	H	α-helix	trans	-74.3	-34.2	-175	58.7	0	0	0	0	113	N637 P638	N637-S641 PolarHBondContact O-N 3.1Å; N637-S641 PolarHBondContact O-OG 3.31Å; N637-S641 VanDerWaalsContact O-OG 3.11Å; P638-S641 WeakPolarHBondContact CA-OG 3.49Å
642	Y	81.7	Confident	82.5	Confident	43 Å²	43	64.8 Å²	64.8	17%	0.169	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	42.4	179.6	-51.9	-63.4	0	0	0	112	P638 N644 Q645 P647 P648	P638-Y642 HydrophobicContact CB-CD2 4.11Å; P638-Y642 PolarHBondContact O-N 2.92Å; Y642-N644 PolarHBondContact O-N 3.31Å; Y642-Q645 PolarHBondContact O-N 2.81Å; Y642-Q645 VanDerWaalsContact O-O 3.05Å; Y642-P647 HydrophobicContact CD2-CB 3.78Å; Y642-P647 HydrophobicContact CE2-CB 4.04Å; Y642-P647 HydrophobicContact CG-CB 4.36Å; Y642-P648 HydrophobicContact CE1-CG 3.87Å
643	H	76.2	Confident	82	Confident	82 Å²	82	69 Å²	69	38%	0.38	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	113.2	-175.6	-166.5	67	0	0	0	112.9	Q645	H643-Q645 PolarHBondContact O-N 2.04Å
644	N	72.7	Confident	81.6	Confident	148 Å²	148	72.3 Å²	72.3	79%	0.791	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	22.5	-173.2	-57.1	-55.5	0	0	0	116.2	Y642	Y642-N644 PolarHBondContact O-N 3.31Å
645	Q	79.1	Confident	81.2	Confident	139 Å²	139	79.9 Å²	79.9	65%	0.65	45%	0.448	S	S	*	.	S	Bend	trans	-122.9	149.5	176.1	-62.2	-174.6	20.9	0	0	110.5	Y642 H643	Y642-Q645 PolarHBondContact O-N 2.81Å; Y642-Q645 VanDerWaalsContact O-O 3.05Å; H643-Q645 PolarHBondContact O-N 2.04Å
646	P	77.7	Confident	80.8	Confident	114 Å²	114	82 Å²	82	74%	0.74	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-68	138.3	171.1	29.3	-33.4	0	0	0	110
647	P	76	Confident	80.4	Confident	88 Å²	88	81.3 Å²	81.3	57%	0.571	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-62.8	144.5	174.2	26.6	-34.1	0	0	0	110.7	Y642	Y642-P647 HydrophobicContact CD2-CB 3.78Å; Y642-P647 HydrophobicContact CE2-CB 4.04Å; Y642-P647 HydrophobicContact CG-CB 4.36Å
648	P	77.3	Confident	80.4	Confident	60 Å²	60	80.2 Å²	80.2	39%	0.39	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-69.9	151.8	178.8	31.1	-35.4	0	0	0	111.1	Y642 T650 V651	Y642-P648 HydrophobicContact CE1-CG 3.87Å; P648-T650 PolarHBondContact O-N 3.45Å; P648-V651 HydrophobicContact CG-CG2 4.38Å
649	A	69.4	Low	80.6	Confident	113 Å²	113	79 Å²	79	93%	0.934	44%	0.444	S	S	*	.	S	Bend	trans	-68.8	-21.6	179.4	0	0	0	0	0	113.7
650	T	71.1	Confident	80.9	Confident	109 Å²	109	75.5 Å²	75.5	67%	0.669	42%	0.423	S	S	*	.	S	Bend	trans	-138.8	131.9	174.4	50.9	0	0	0	0	108.5	P648	P648-T650 PolarHBondContact O-N 3.45Å
651	V	73.6	Confident	81.1	Confident	26 Å²	26	74.6 Å²	74.6	16%	0.158	42%	0.418	C	S	.	.			trans	-93.5	110.4	179.4	-178.3	0	0	0	0	109.8	F633 E635 P648 A657	F633-V651 HydrophobicContact CE1-CG1 4.29Å; E635-V651 HydrophobicContact CG-CG1 4.34Å; E635-V651 HydrophobicContact CG-CG2 4.48Å; E635-V651 WeakPolarHBondContact OE1-CG2 3.21Å; P648-V651 HydrophobicContact CG-CG2 4.38Å; V651-A657 HydrophobicContact CG1-CB 3.66Å
652	D	78.9	Confident	81.4	Confident	117 Å²	117	79.9 Å²	79.9	63%	0.626	44%	0.435	S	S	*	.			trans	-68.8	149.6	171.7	-69.6	-34.7	0	0	0	110.9	V654	D652-V654 HydrophobicContact CB-CG2 3.8Å; D652-V654 PolarHBondContact O-N 3.07Å
653	L	83.7	Confident	81.7	Confident	89 Å²	89	82.6 Å²	82.6	47%	0.466	45%	0.445	S	S	.	.	S	Bend	trans	-71.1	72.3	176.5	-72.5	125.5	0	0	0	111.7	F633 F660 P716	F633-L653 HydrophobicContact CB-CD2 4.15Å; F633-L653 HydrophobicContact CD2-CD2 3.81Å; F633-L653 HydrophobicContact CE2-CD2 4.33Å; F633-L653 HydrophobicContact CG-CD2 3.93Å; L653-F660 HydrophobicContact CD2-CE1 4.15Å; L653-F660 HydrophobicContact CD2-CE2 4.37Å; L653-F660 HydrophobicContact CD2-CZ 3.55Å; L653-P716 HydrophobicContact CD1-CB 4.36Å; L653-P716 HydrophobicContact CD2-CB 4.2Å
654	V	85.1	Confident	82.2	Confident	74 Å²	74	79.3 Å²	79.3	45%	0.448	43%	0.431	S	S	.	.			trans	-118.7	142.8	-176.9	-175.9	0	0	0	0	110.1	D652 D656 A657 G658	D652-V654 HydrophobicContact CB-CG2 3.8Å; D652-V654 PolarHBondContact O-N 3.07Å; V654-D656 PolarHBondContact O-N 3.02Å; V654-D656 VanDerWaalsContact O-N 3.07Å; V654-A657 PolarHBondContact O-N 3.35Å; V654-G658 PolarHBondContact O-N 3.47Å
655	K	83.1	Confident	83.1	Confident	171 Å²	171	73.6 Å²	73.6	74%	0.743	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-25.4	-176.8	-174.6	179.7	175.9	-172.5	0	115	Y636	Y636-K655 WeakPolarHBondContact CE2-O 3.28Å
656	D	83.8	Confident	83.5	Confident	79 Å²	79	68.9 Å²	68.9	42%	0.422	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-7.4	179.9	-63	-49.6	0	0	0	113.3	V654 S749 Q752	V654-D656 PolarHBondContact O-N 3.02Å; V654-D656 VanDerWaalsContact O-N 3.07Å; D656-S749 PolarHBondContact OD1-OG 3.38Å; D656-Q752 PolarHBondContact O-NE2 3.31Å; D656-Q752 PolarHBondContact O-OE1 2.76Å
657	A	85.8	Confident	84.2	Confident	11 Å²	11	63.5 Å²	63.5	9%	0.091	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-27.4	178.9	0	0	0	0	0	113.2	Y636 V651 V654	Y636-A657 PolarHBondContact N-O 2.96Å; V651-A657 HydrophobicContact CG1-CB 3.66Å; V654-A657 PolarHBondContact O-N 3.35Å
658	G	90.1	Very high	85.2	Confident	3 Å²	3	59.4 Å²	59.4	3%	0.031	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.9	-170.2	-178.9	0	0	0	0	0	112.8	F633 Q634 V654	F633-G658 VanDerWaalsContact CE2-C 3.48Å; F633-G658 VanDerWaalsContact CZ-C 3.41Å; F633-G658 VanDerWaalsContact CZ-CA 3.41Å; Q634-G658 CarbonylContact O-C 3.6Å; Q634-G658 WeakPolarHBondContact O-CA 3.43Å; V654-G658 PolarHBondContact O-N 3.47Å
659	H	90.9	Very high	86.1	Confident	29 Å²	29	56.5 Å²	56.5	13%	0.134	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	162.5	-179.2	71.9	-60.4	0	0	0	111.5	F633 Q634 Y636 D661	F633-H659 CarbonylContact C-O 3.56Å; Q634-H659 PolarHBondContact N-O 3.05Å; Q634-H659 PolarHBondContact O-N 3.32Å; Y636-H659 HydrophobicContact CE1-CB 4.24Å; Y636-H659 AromaticContact CE1-ND1 3.42Å; Y636-H659 WeakPolarHBondContact CE1-ND1 3.45Å; H659-D661 PolarHBondContact O-N 2.82Å
660	F	92.4	Very high	87.4	Confident	51 Å²	51	51.2 Å²	51.2	22%	0.224	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	113.1	170.6	-68.9	-72.4	0	0	0	110.2	I631 H632 F633 L653 R662 V714	I631-F660 HydrophobicContact CG2-CB 4.08Å; H632-F660 WeakPolarHBondContact O-CA 3.3Å; F633-F660 HydrophobicContact CB-CD1 4.01Å; F633-F660 HydrophobicContact CB-CE1 3.74Å; F633-F660 HydrophobicContact CB-CZ 4.43Å; F633-F660 HydrophobicContact CD2-CD1 4.23Å; F633-F660 HydrophobicContact CD2-CD2 4.38Å; F633-F660 HydrophobicContact CD2-CE1 4.05Å; F633-F660 HydrophobicContact CD2-CE2 4.2Å; F633-F660 HydrophobicContact CD2-CG 4.41Å; F633-F660 HydrophobicContact CD2-CZ 4.04Å; F633-F660 HydrophobicContact CG-CE1 4.39Å; L653-F660 HydrophobicContact CD2-CE1 4.15Å; L653-F660 HydrophobicContact CD2-CE2 4.37Å; L653-F660 HydrophobicContact CD2-CZ 3.55Å; F660-R662 PolarHBondContact O-N 3.4Å; F660-V714 HydrophobicContact CD1-CG1 3.52Å; F660-V714 HydrophobicContact CD2-CG1 3.86Å; F660-V714 HydrophobicContact CE1-CG1 3.42Å; F660-V714 VanDerWaalsContact CE1-CG1 3.42Å; F660-V714 HydrophobicContact CE2-CG1 3.77Å; F660-V714 HydrophobicContact CG-CG1 3.73Å; F660-V714 HydrophobicContact CG-CG2 4.48Å; F660-V714 HydrophobicContact CZ-CG1 3.54Å
661	D	90.9	Very high	88.6	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.011	23%	0.227	C	C	.	.			trans	-78	91.7	-174.1	-177.3	0.3	0	0	0	111.4	I631 H632 Q634 H659 R663 S664 S742	I631-D661 WeakPolarHBondContact CG2-O 3.06Å; H632-D661 PolarHBondContact O-N 2.93Å; Q634-D661 HydrophobicContact CB-CB 4.08Å; H659-D661 PolarHBondContact O-N 2.82Å; D661-R663 PolarHBondContact O-N 2.8Å; D661-R663 VanDerWaalsContact OD1-CA 3.3Å; D661-R663 WeakPolarHBondContact OD1-CA 3.29Å; D661-R663 VanDerWaalsContact OD1-CB 3.24Å; D661-R663 WeakPolarHBondContact OD1-CB 3.42Å; D661-R663 PolarHBondContact OD1-N 3.07Å; D661-S664 PolarHBondContact O-N 3.02Å; D661-S664 PolarHBondContact OD1-N 3.32Å; D661-S742 WeakPolarHBondContact OD2-CB 3.44Å; D661-S742 PolarHBondContact OD2-OG 3.43Å
662	R	89.1	Confident	89.7	Confident	129 Å²	129	46 Å²	46	49%	0.487	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-5.8	176.9	-61.1	-173.9	-179.6	87.1	-3.7	113.5	I631 F660 R712	I631-R662 HydrophobicContact CD1-CG 4.46Å; I631-R662 HydrophobicContact CG2-CG 4.46Å; F660-R662 PolarHBondContact O-N 3.4Å; R662-R712 VanDerWaalsContact C-NH2 3.34Å; R662-R712 PolarHBondContact O-NH1 2.87Å; R662-R712 VanDerWaalsContact O-NH1 3.07Å; R662-R712 PolarHBondContact O-NH2 3.18Å
663	R	88.4	Confident	90.5	Very high	100 Å²	100	41.5 Å²	41.5	38%	0.377	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-17.4	177.3	-54.7	-60.8	-174.4	168.3	2.7	113.3	D661 F665 Q741	D661-R663 PolarHBondContact O-N 2.8Å; D661-R663 VanDerWaalsContact OD1-CA 3.3Å; D661-R663 WeakPolarHBondContact OD1-CA 3.29Å; D661-R663 VanDerWaalsContact OD1-CB 3.24Å; D661-R663 WeakPolarHBondContact OD1-CB 3.42Å; D661-R663 PolarHBondContact OD1-N 3.07Å; R663-F665 WeakPolarHBondContact O-CD2 3.29Å; R663-F665 VanDerWaalsContact O-CE2 3.31Å; R663-F665 WeakPolarHBondContact O-CE2 3.47Å; R663-Q741 HydrophobicContact CG-CG 4.3Å
664	S	88.1	Confident	91	Very high	14 Å²	14	37.3 Å²	37.3	10%	0.098	18%	0.176	C	C	.	.			trans	-73.1	141.3	171.7	-169.4	0	0	0	0	112.9	H632 D661 D666 E667 R712	H632-S664 VanDerWaalsContact CE1-CB 3.43Å; H632-S664 WeakPolarHBondContact CE1-CB 3.47Å; D661-S664 PolarHBondContact O-N 3.02Å; D661-S664 PolarHBondContact OD1-N 3.32Å; S664-D666 PolarHBondContact OG-N 2.68Å; S664-E667 PolarHBondContact OG-OE2 2.74Å; S664-R712 PolarHBondContact O-NH2 3.13Å
665	F	90.1	Very high	91.5	Very high	28 Å²	28	33.9 Å²	33.9	12%	0.123	16%	0.155	C	C	.	.			trans	-138.4	18.8	173.4	-64.2	-98.5	0	0	0	111.1	R663 Y699 R712 R738	R663-F665 WeakPolarHBondContact O-CD2 3.29Å; R663-F665 VanDerWaalsContact O-CE2 3.31Å; R663-F665 WeakPolarHBondContact O-CE2 3.47Å; F665-Y699 AromaticContact CD1-CD1 3.61Å; F665-Y699 HydrophobicContact CD1-CD1 3.61Å; F665-Y699 AromaticContact CD1-CD2 3.96Å; F665-Y699 HydrophobicContact CD1-CD2 3.96Å; F665-Y699 HydrophobicContact CD1-CE1 4.14Å; F665-Y699 HydrophobicContact CD1-CE2 4.44Å; F665-Y699 AromaticContact CD1-CG 3.52Å; F665-Y699 HydrophobicContact CD1-CG 3.52Å; F665-Y699 AromaticContact CE1-CD1 3.64Å; F665-Y699 HydrophobicContact CE1-CD1 3.64Å; F665-Y699 HydrophobicContact CE1-CD2 4.22Å; F665-Y699 AromaticContact CE1-CE1 3.68Å; F665-Y699 HydrophobicContact CE1-CE1 3.68Å; F665-Y699 HydrophobicContact CE1-CE2 4.26Å; F665-Y699 AromaticContact CE1-CG 3.93Å; F665-Y699 HydrophobicContact CE1-CG 3.93Å; F665-R712 VanDerWaalsContact CE1-CZ 3.5Å; F665-R738 VanDerWaalsContact CE2-NH1 3.33Å
666	D	87.6	Confident	92.1	Very high	39 Å²	39	28.7 Å²	28.7	21%	0.209	13%	0.134	C	C	.	.			trans	-83.4	-30	-175.1	-66.8	-3.7	0	0	0	111.7	Q583 L602 H604 S664	Q583-D666 PolarHBondContact NE2-OD1 3.46Å; L602-D666 WeakPolarHBondContact CB-O 3.29Å; H604-D666 IonicContact CD2-OD2 3.7Å; H604-D666 IonicContact CE1-OD2 3.51Å; H604-D666 PolarHBondContact CE1-OD2 3.26Å; H604-D666 VanDerWaalsContact NE2-CB 3.29Å; H604-D666 WeakPolarHBondContact NE2-CB 3.33Å; H604-D666 IonicContact NE2-OD2 2.9Å; H604-D666 PolarHBondContact NE2-OD2 3.44Å; S664-D666 PolarHBondContact OG-N 2.68Å
667	E	93.6	Very high	92.5	Very high	2 Å²	2	27 Å²	27	1%	0.009	13%	0.131	C	C	.	.			trans	-84.9	120.4	179.3	-56.9	72.1	-156.5	0	0	111	L602 H604 P630 H632 S664 L718 Q720	L602-E667 WeakPolarHBondContact O-CA 3.3Å; H604-E667 IonicContact CD2-OE1 2.75Å; H604-E667 PolarHBondContact CD2-OE1 3.05Å; P630-E667 HydrophobicContact CG-CB 3.94Å; H632-E667 IonicContact CE1-OE1 3.15Å; H632-E667 IonicContact CE1-OE2 2.72Å; H632-E667 IonicContact ND1-OE1 2.74Å; H632-E667 IonicContact ND1-OE2 3.31Å; H632-E667 PolarHBondContact ND1-OE2 3.26Å; S664-E667 PolarHBondContact OG-OE2 2.74Å; E667-L718 HydrophobicContact CB-CD2 4.33Å; E667-L718 HydrophobicContact CG-CD2 4.26Å; E667-Q720 PolarHBondContact OE1-OE1 3.09Å
668	A	96.1	Very high	92.9	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.008	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	137	-174.3	0	0	0	0	0	113.2	F601 L602 F629 F670	F601-A668 CarbonylContact C-O 3.58Å; F601-A668 WeakPolarHBondContact CA-O 3.47Å; L602-A668 HydrophobicContact CD1-CB 4.45Å; L602-A668 PolarHBondContact N-O 2.82Å; L602-A668 PolarHBondContact O-N 3.39Å; F629-A668 HydrophobicContact CD1-CB 3.76Å; F629-A668 HydrophobicContact CE1-CB 3.48Å; F629-A668 VanDerWaalsContact CE1-CB 3.48Å; F629-A668 HydrophobicContact CZ-CB 4.18Å; A668-F670 HydrophobicContact CB-CD1 3.9Å; A668-F670 HydrophobicContact CB-CE1 3.83Å
669	C	96.6	Very high	92.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	114.3	175.8	-73.6	0	0	0	0	111.2	F600 F601 C617 S621 F628	F600-C669 VanDerWaalsContact O-CA 3.32Å; F600-C669 WeakPolarHBondContact O-CA 3.24Å; F601-C669 WeakPolarHBondContact CD2-SG 3.45Å; C617-C669 HydrophobicContact CB-CB 4.13Å; C617-C669 WeakPolarHBondContact CB-SG 3.03Å; C617-C669 WeakPolarHBondContact SG-CB 3.4Å; C617-C669 CovalentContact SG-SG 2.04Å; C617-C669 PolarHBondContact SG-SG 2.78Å; S621-C669 WeakPolarHBondContact OG-CB 3.44Å; S621-C669 PolarHBondContact OG-O 3.44Å; F628-C669 HydrophobicContact CB-CB 4.13Å; F628-C669 HydrophobicContact CD1-CB 3.99Å; F628-C669 PolarHBondContact N-O 3.43Å; F628-C669 PolarHBondContact O-N 3.25Å
670	F	96.8	Very high	92.9	Very high	1 Å²	1	30.9 Å²	30.9	0%	0.004	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	156.9	-176.6	56.8	-92.5	0	0	0	113.1	M587 F600 L602 V627 A668 Y675 I698 F702	M587-F670 HydrophobicContact CE-CE2 4.15Å; M587-F670 HydrophobicContact CE-CZ 3.94Å; F600-F670 HydrophobicContact CB-CE2 4.43Å; F600-F670 HydrophobicContact CD2-CD2 4.42Å; F600-F670 AromaticContact CD2-CE2 3.97Å; F600-F670 HydrophobicContact CD2-CE2 3.97Å; F600-F670 PolarHBondContact N-O 3.03Å; F600-F670 PolarHBondContact O-N 2.77Å; F600-F670 VanDerWaalsContact O-N 3.16Å; L602-F670 HydrophobicContact CD1-CE1 3.93Å; L602-F670 HydrophobicContact CD1-CZ 4.14Å; L602-F670 HydrophobicContact CG-CE1 4.12Å; L602-F670 HydrophobicContact CG-CZ 4.42Å; V627-F670 HydrophobicContact CB-CB 4.23Å; V627-F670 HydrophobicContact CG1-CB 3.77Å; A668-F670 HydrophobicContact CB-CD1 3.9Å; A668-F670 HydrophobicContact CB-CE1 3.83Å; F670-Y675 AromaticContact CE2-CD2 3.9Å; F670-Y675 HydrophobicContact CE2-CD2 3.9Å; F670-Y675 HydrophobicContact CE2-CG 4.04Å; F670-Y675 HydrophobicContact CZ-CD2 4.33Å; F670-I698 HydrophobicContact CE1-CG2 3.95Å; F670-I698 HydrophobicContact CZ-CD1 4.42Å; F670-I698 HydrophobicContact CZ-CG2 4.26Å; F670-F702 HydrophobicContact CB-CE2 4.26Å; F670-F702 HydrophobicContact CB-CZ 4.07Å; F670-F702 HydrophobicContact CD1-CE2 4.14Å; F670-F702 HydrophobicContact CD2-CE2 4.26Å; F670-F702 HydrophobicContact CD2-CZ 4.03Å; F670-F702 AromaticContact CG-CE2 3.97Å; F670-F702 HydrophobicContact CG-CE2 3.97Å; F670-F702 HydrophobicContact CG-CZ 4.01Å
671	Y	96.3	Very high	92.7	Very high	26 Å²	26	35.3 Å²	35.3	10%	0.102	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	146.3	173.8	-77.1	-86.2	0	0	0	112.3	T598 L599 N623 S673 D674 Y675	T598-Y671 CarbonylContact O-C 3.56Å; T598-Y671 WeakPolarHBondContact O-CA 3.35Å; L599-Y671 HydrophobicContact CB-CD1 4.24Å; L599-Y671 HydrophobicContact CB-CE1 3.93Å; L599-Y671 HydrophobicContact CD1-CD2 4.38Å; L599-Y671 HydrophobicContact CD1-CE2 4.31Å; N623-Y671 HydrophobicContact CB-CD1 4.34Å; N623-Y671 HydrophobicContact CB-CD2 3.64Å; N623-Y671 HydrophobicContact CB-CE2 3.87Å; N623-Y671 HydrophobicContact CB-CG 3.89Å; Y671-S673 VanDerWaalsContact C-N 3.27Å; Y671-S673 WeakPolarHBondContact CB-OG 3.43Å; Y671-S673 PolarHBondContact O-N 2.99Å; Y671-D674 WeakPolarHBondContact O-CB 3.37Å; Y671-D674 PolarHBondContact O-N 3.45Å; Y671-D674 VanDerWaalsContact O-N 3.14Å; Y671-Y675 PolarHBondContact O-N 3.19Å; Y671-Y675 VanDerWaalsContact O-N 3.1Å
672	N	96.4	Very high	92.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.7	-33.3	177.4	-168.3	24	0	0	0	112.4	S591 H594 P595 T598 F600 M676	S591-N672 WeakPolarHBondContact CA-OD1 3.44Å; S591-N672 VanDerWaalsContact CB-OD1 3.32Å; S591-N672 WeakPolarHBondContact CB-OD1 3.32Å; S591-N672 PolarHBondContact O-ND2 2.92Å; S591-N672 VanDerWaalsContact O-ND2 3.08Å; S591-N672 PolarHBondContact OG-OD1 3.38Å; H594-N672 PolarHBondContact O-ND2 3.4Å; H594-N672 VanDerWaalsContact O-ND2 3.1Å; P595-N672 PolarHBondContact O-ND2 2.8Å; T598-N672 PolarHBondContact O-N 3.23Å; F600-N672 HydrophobicContact CD2-CB 4.18Å; F600-N672 HydrophobicContact CE2-CB 3.59Å; F600-N672 HydrophobicContact CZ-CB 4.27Å; N672-M676 WeakPolarHBondContact O-CB 3.38Å; N672-M676 VanDerWaalsContact O-CG 3.23Å; N672-M676 WeakPolarHBondContact O-CG 3.48Å; N672-M676 PolarHBondContact O-N 3.27Å
673	S	95.3	Very high	92.1	Very high	22 Å²	22	32.1 Å²	32.1	15%	0.154	16%	0.164	C	C	.	.	H	α-helix	trans	-56.2	-48.3	170	42.9	0	0	0	0	112.4	V596 N623 Y671 M676 A677	V596-S673 WeakPolarHBondContact O-CB 3.47Å; V596-S673 PolarHBondContact O-N 3.18Å; V596-S673 PolarHBondContact O-OG 3.06Å; N623-S673 PolarHBondContact OD1-OG 3.07Å; Y671-S673 VanDerWaalsContact C-N 3.27Å; Y671-S673 WeakPolarHBondContact CB-OG 3.43Å; Y671-S673 PolarHBondContact O-N 2.99Å; S673-M676 PolarHBondContact O-N 3.01Å; S673-A677 VanDerWaalsContact O-CB 3.27Å; S673-A677 WeakPolarHBondContact O-CB 3.2Å; S673-A677 PolarHBondContact O-N 2.73Å
674	D	95.6	Very high	91.6	Very high	2 Å²	2	30 Å²	30	1%	0.011	17%	0.168	C	C	.	.	H	α-helix	trans	-66.6	-42.3	-178.8	-68.1	-35.5	0	0	0	111.6	N623 N624 V627 Y671 T678 F702 L708	N623-D674 WeakPolarHBondContact CA-OD2 3.23Å; N624-D674 WeakPolarHBondContact CA-OD1 3.4Å; N624-D674 PolarHBondContact N-OD1 3.17Å; N624-D674 PolarHBondContact N-OD2 3.04Å; V627-D674 HydrophobicContact CG1-CB 4.5Å; Y671-D674 WeakPolarHBondContact O-CB 3.37Å; Y671-D674 PolarHBondContact O-N 3.45Å; Y671-D674 VanDerWaalsContact O-N 3.14Å; D674-T678 WeakPolarHBondContact O-CB 3.44Å; D674-T678 PolarHBondContact O-N 3.28Å; D674-T678 PolarHBondContact O-OG1 3.41Å; D674-F702 HydrophobicContact CB-CE1 4.15Å; D674-L708 HydrophobicContact CB-CD1 3.64Å
675	Y	95.4	Very high	91	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-60.9	-51.5	173	-179.3	-93.3	0	0	0	111.4	I584 M587 D588 F670 Y671 A677 T678 R679 F702	I584-Y675 PolarHBondContact O-OH 2.97Å; M587-Y675 HydrophobicContact CB-CE1 4.31Å; M587-Y675 HydrophobicContact CB-CE2 3.98Å; D588-Y675 PolarHBondContact OD1-OH 3.4Å; F670-Y675 AromaticContact CE2-CD2 3.9Å; F670-Y675 HydrophobicContact CE2-CD2 3.9Å; F670-Y675 HydrophobicContact CE2-CG 4.04Å; F670-Y675 HydrophobicContact CZ-CD2 4.33Å; Y671-Y675 PolarHBondContact O-N 3.19Å; Y671-Y675 VanDerWaalsContact O-N 3.1Å; Y675-A677 PolarHBondContact O-N 2.92Å; Y675-T678 PolarHBondContact O-N 3.01Å; Y675-R679 HydrophobicContact CE1-CB 4.37Å; Y675-R679 HydrophobicContact CE1-CG 4.47Å; Y675-R679 WeakPolarHBondContact O-CB 3.34Å; Y675-R679 PolarHBondContact O-N 2.95Å; Y675-F702 HydrophobicContact CD2-CZ 4.49Å
676	M	93.9	Very high	90.4	Very high	62 Å²	62	32 Å²	32	31%	0.305	18%	0.179	S	C	.	.	H	α-helix	trans	-60.9	-41.7	179.6	-75.1	-71.5	-154.8	0	0	112.6	S591 K592 N672 S673 S680	S591-M676 WeakPolarHBondContact OG-CE 3.23Å; S591-M676 WeakPolarHBondContact OG-CG 3.45Å; S591-M676 PolarHBondContact OG-SD 2.85Å; S591-M676 VanDerWaalsContact OG-SD 3.33Å; K592-M676 HydrophobicContact CG-CE 4.27Å; N672-M676 WeakPolarHBondContact O-CB 3.38Å; N672-M676 VanDerWaalsContact O-CG 3.23Å; N672-M676 WeakPolarHBondContact O-CG 3.48Å; N672-M676 PolarHBondContact O-N 3.27Å; S673-M676 PolarHBondContact O-N 3.01Å; M676-S680 WeakPolarHBondContact O-CB 3.27Å; M676-S680 PolarHBondContact O-N 2.86Å; M676-S680 PolarHBondContact O-OG 2.99Å
677	A	93.7	Very high	89.8	Confident	43 Å²	43	37.6 Å²	37.6	36%	0.355	20%	0.204	S	C	.	.	H	α-helix	trans	-64.9	-41.9	177.9	0	0	0	0	0	111.9	S673 Y675	S673-A677 VanDerWaalsContact O-CB 3.27Å; S673-A677 WeakPolarHBondContact O-CB 3.2Å; S673-A677 PolarHBondContact O-N 2.73Å; Y675-A677 PolarHBondContact O-N 2.92Å
678	T	93.4	Very high	88.8	Confident	3 Å²	3	46 Å²	46	2%	0.018	24%	0.244	C	C	.	.	H	α-helix	trans	-68.4	-46.4	177	-53.8	0	0	0	0	110.8	D674 Y675 S680 R681 M682 I701 F702 S706	D674-T678 WeakPolarHBondContact O-CB 3.44Å; D674-T678 PolarHBondContact O-N 3.28Å; D674-T678 PolarHBondContact O-OG1 3.41Å; Y675-T678 PolarHBondContact O-N 3.01Å; T678-S680 VanDerWaalsContact C-N 3.25Å; T678-S680 PolarHBondContact O-N 3.36Å; T678-R681 PolarHBondContact O-N 2.8Å; T678-R681 VanDerWaalsContact O-N 3.09Å; T678-M682 PolarHBondContact O-N 2.91Å; T678-I701 HydrophobicContact CG2-CG2 3.51Å; T678-I701 WeakPolarHBondContact CG2-O 3.34Å; T678-F702 HydrophobicContact CG2-CD1 4.31Å; T678-S706 WeakPolarHBondContact OG1-CB 3.4Å
679	R	91.3	Very high	87.9	Confident	38 Å²	38	49.5 Å²	49.5	14%	0.143	26%	0.262	C	S	.	.	H	α-helix	trans	-58.5	-35.5	176.8	-174	61.7	177.5	109.7	-7.7	112.9	D588 Y675 R681 M682 V683	D588-R679 IonicContact OD1-NE 3.02Å; D588-R679 PolarHBondContact OD1-NE 3.1Å; D588-R679 VanDerWaalsContact OD1-NE 3.07Å; D588-R679 IonicContact OD2-CZ 3.81Å; D588-R679 VanDerWaalsContact OD2-CZ 3.27Å; D588-R679 IonicContact OD2-NE 2.71Å; D588-R679 PolarHBondContact OD2-NE 2.8Å; D588-R679 IonicContact OD2-NH2 3.75Å; D588-R679 PolarHBondContact OD2-NH2 2.83Å; Y675-R679 HydrophobicContact CE1-CB 4.37Å; Y675-R679 HydrophobicContact CE1-CG 4.47Å; Y675-R679 WeakPolarHBondContact O-CB 3.34Å; Y675-R679 PolarHBondContact O-N 2.95Å; R679-R681 VanDerWaalsContact C-N 3.34Å; R679-M682 PolarHBondContact O-N 3.14Å; R679-V683 WeakPolarHBondContact O-CG2 3.27Å
680	S	89.6	Confident	86.6	Confident	83 Å²	83	56.9 Å²	56.9	58%	0.58	30%	0.297	S	S	*	.	H	α-helix	trans	-66.3	-32	177.6	-61.9	0	0	0	0	113.2	M676 T678 V683	M676-S680 WeakPolarHBondContact O-CB 3.27Å; M676-S680 PolarHBondContact O-N 2.86Å; M676-S680 PolarHBondContact O-OG 2.99Å; T678-S680 VanDerWaalsContact C-N 3.25Å; T678-S680 PolarHBondContact O-N 3.36Å; S680-V683 WeakPolarHBondContact O-CG2 3.39Å
681	R	88.4	Confident	85.5	Confident	144 Å²	144	61.9 Å²	61.9	54%	0.543	32%	0.324	S	S	.	.	H	α-helix	trans	-73.9	-35.8	176.1	-63.9	168.4	-177	-170.5	1.3	111.7	T678 R679 V683 Y705	T678-R681 PolarHBondContact O-N 2.8Å; T678-R681 VanDerWaalsContact O-N 3.09Å; R679-R681 VanDerWaalsContact C-N 3.34Å; R681-V683 PolarHBondContact O-N 2.88Å; R681-Y705 WeakPolarHBondContact CD-O 3.44Å; R681-Y705 PolarHBondContact NH1-O 2.63Å
682	M	86.7	Confident	84.6	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-5.2	179	-161.8	174.8	80.8	0	0	114	I584 T678 R679 A684 V686 L693 I701 Y705	I584-M682 HydrophobicContact CG2-CE 4.48Å; T678-M682 PolarHBondContact O-N 2.91Å; R679-M682 PolarHBondContact O-N 3.14Å; M682-A684 VanDerWaalsContact C-N 3.29Å; M682-A684 PolarHBondContact O-N 2.88Å; M682-V686 HydrophobicContact CE-CG2 3.93Å; M682-V686 HydrophobicContact CG-CG2 3.91Å; M682-V686 WeakPolarHBondContact O-CB 3.38Å; M682-V686 VanDerWaalsContact O-CG2 3.29Å; M682-V686 WeakPolarHBondContact O-CG2 3.26Å; M682-V686 PolarHBondContact O-N 2.91Å; M682-L693 HydrophobicContact CE-CD2 3.51Å; M682-I701 HydrophobicContact CE-CD1 3.73Å; M682-I701 HydrophobicContact CE-CG1 4.37Å; M682-I701 HydrophobicContact SD-CD1 3.72Å; M682-I701 HydrophobicContact SD-CG1 3.68Å; M682-I701 HydrophobicContact SD-CG2 4.29Å; M682-Y705 HydrophobicContact CB-CD1 4.27Å; M682-Y705 HydrophobicContact CB-CD2 4.21Å; M682-Y705 HydrophobicContact CB-CE1 4.48Å; M682-Y705 HydrophobicContact CB-CE2 4.42Å; M682-Y705 HydrophobicContact CB-CG 4.14Å; M682-Y705 HydrophobicContact CG-CD1 4.39Å; M682-Y705 HydrophobicContact CG-CD2 3.87Å; M682-Y705 HydrophobicContact CG-CE1 4.19Å; M682-Y705 HydrophobicContact CG-CE2 3.64Å; M682-Y705 HydrophobicContact CG-CG 4.24Å; M682-Y705 HydrophobicContact SD-CD2 3.8Å; M682-Y705 HydrophobicContact SD-CE2 3.69Å
683	V	80.8	Confident	83.5	Confident	64 Å²	64	63.2 Å²	63.2	39%	0.388	33%	0.332	S	S	.	.	H	α-helix	trans	-64.6	-31.6	-177.6	176.2	0	0	0	0	112.6	R679 S680 R681 Q687	R679-V683 WeakPolarHBondContact O-CG2 3.27Å; S680-V683 WeakPolarHBondContact O-CG2 3.39Å; R681-V683 PolarHBondContact O-N 2.88Å; V683-Q687 VanDerWaalsContact O-CG 3.32Å; V683-Q687 WeakPolarHBondContact O-CG 3.29Å; V683-Q687 PolarHBondContact O-N 3.09Å
684	A	77.1	Confident	82.5	Confident	57 Å²	57	64.5 Å²	64.5	47%	0.471	34%	0.336	S	S	.	.	H	α-helix	trans	-66	-58	178.1	0	0	0	0	0	111.1	M682 V686 Q687 E688	M682-A684 VanDerWaalsContact C-N 3.29Å; M682-A684 PolarHBondContact O-N 2.88Å; A684-V686 VanDerWaalsContact C-N 3.29Å; A684-V686 PolarHBondContact O-N 3.33Å; A684-Q687 WeakPolarHBondContact O-CB 3.42Å; A684-Q687 PolarHBondContact O-N 3.41Å; A684-E688 PolarHBondContact O-N 3.15Å
685	D	76.9	Confident	81.7	Confident	62 Å²	62	66.5 Å²	66.5	33%	0.332	35%	0.35	S	S	.	.	H	α-helix	trans	-57.3	-40.2	-179.4	-58.4	34.9	0	0	0	112.5	Q687 E688 N689 I692 Y705	D685-Q687 VanDerWaalsContact C-N 3.28Å; D685-Q687 PolarHBondContact O-N 3.29Å; D685-E688 PolarHBondContact O-N 2.99Å; D685-N689 PolarHBondContact O-N 2.92Å; D685-I692 HydrophobicContact CB-CD1 4.05Å; D685-Y705 WeakPolarHBondContact OD2-CE1 3.4Å; D685-Y705 PolarHBondContact OD2-OH 3.16Å
686	V	77.7	Confident	81.3	Confident	20 Å²	20	67.3 Å²	67.3	12%	0.121	35%	0.354	C	S	.	.	H	α-helix	trans	-69.1	-23.9	179.1	170.9	0	0	0	0	112.8	M682 A684 E688 N689 I692 L693	M682-V686 HydrophobicContact CE-CG2 3.93Å; M682-V686 HydrophobicContact CG-CG2 3.91Å; M682-V686 WeakPolarHBondContact O-CB 3.38Å; M682-V686 VanDerWaalsContact O-CG2 3.29Å; M682-V686 WeakPolarHBondContact O-CG2 3.26Å; M682-V686 PolarHBondContact O-N 2.91Å; A684-V686 VanDerWaalsContact C-N 3.29Å; A684-V686 PolarHBondContact O-N 3.33Å; V686-E688 VanDerWaalsContact C-N 3.33Å; V686-N689 CarbonylContact O-C 3.46Å; V686-I692 HydrophobicContact CG2-CB 4.49Å; V686-I692 HydrophobicContact CG2-CG2 4.4Å; V686-L693 HydrophobicContact CG1-CD1 3.95Å; V686-L693 HydrophobicContact CG1-CD2 4.35Å; V686-L693 HydrophobicContact CG1-CG 4.11Å; V686-L693 HydrophobicContact CG2-CD2 3.87Å; V686-L693 HydrophobicContact CG2-CG 4.23Å
687	Q	74.4	Confident	81	Confident	158 Å²	158	64.8 Å²	64.8	74%	0.738	34%	0.342	S	S	*	.	H	α-helix	trans	-75.3	-24.3	171.1	-74.2	173.9	8.7	0	0	112.5	V683 A684 D685	V683-Q687 VanDerWaalsContact O-CG 3.32Å; V683-Q687 WeakPolarHBondContact O-CG 3.29Å; V683-Q687 PolarHBondContact O-N 3.09Å; A684-Q687 WeakPolarHBondContact O-CB 3.42Å; A684-Q687 PolarHBondContact O-N 3.41Å; D685-Q687 VanDerWaalsContact C-N 3.28Å; D685-Q687 PolarHBondContact O-N 3.29Å
688	E	72.9	Confident	80.9	Confident	178 Å²	178	62.8 Å²	62.8	83%	0.832	33%	0.325	S	S	*	.	H	α-helix	trans	-84.6	-30.8	175.4	-61.3	-171.2	170.1	0	0	111.9	A684 D685 V686	A684-E688 PolarHBondContact O-N 3.15Å; D685-E688 PolarHBondContact O-N 2.99Å; V686-E688 VanDerWaalsContact C-N 3.33Å
689	N	76.3	Confident	80.9	Confident	74 Å²	74	65.5 Å²	65.5	40%	0.396	34%	0.335	S	S	.	.			trans	-150.2	109	176.5	-175.6	6.5	0	0	0	112.6	D685 V686 D691 I692	D685-N689 PolarHBondContact O-N 2.92Å; V686-N689 CarbonylContact O-C 3.46Å; N689-D691 VanDerWaalsContact C-N 3.29Å; N689-D691 PolarHBondContact O-N 2.9Å; N689-D691 WeakPolarHBondContact OD1-CB 3.34Å; N689-D691 PolarHBondContact OD1-N 3.23Å; N689-D691 VanDerWaalsContact OD1-N 3.13Å; N689-I692 HydrophobicContact CB-CD1 3.89Å; N689-I692 HydrophobicContact CB-CG1 3.96Å; N689-I692 WeakPolarHBondContact O-CB 3.49Å; N689-I692 WeakPolarHBondContact O-CG1 3.05Å; N689-I692 PolarHBondContact O-N 3.47Å
690	E	70.4	Confident	80.9	Confident	155 Å²	155	65.3 Å²	65.3	72%	0.724	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-27.4	179.9	-64.1	-167.6	154.8	0	0	112.9	I692 L693	E690-I692 PolarHBondContact O-N 3.22Å; E690-I692 VanDerWaalsContact O-N 3.11Å; E690-L693 PolarHBondContact O-N 3.36Å
691	D	73.4	Confident	81	Confident	107 Å²	107	61.4 Å²	61.4	57%	0.572	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-14	-178.9	-57.7	-19.1	0	0	0	112.6	N689 L693 E694 S695	N689-D691 VanDerWaalsContact C-N 3.29Å; N689-D691 PolarHBondContact O-N 2.9Å; N689-D691 WeakPolarHBondContact OD1-CB 3.34Å; N689-D691 PolarHBondContact OD1-N 3.23Å; N689-D691 VanDerWaalsContact OD1-N 3.13Å; D691-L693 PolarHBondContact O-N 3.28Å; D691-E694 PolarHBondContact O-N 2.76Å; D691-S695 PolarHBondContact O-N 3.02Å; D691-S695 PolarHBondContact O-OG 3.19Å
692	I	77.3	Confident	81.3	Confident	27 Å²	27	54.6 Å²	54.6	14%	0.138	28%	0.284	C	S	.	.	H	α-helix	trans	-55.3	-35.1	174.3	-67.3	176.2	0	0	0	111	D685 V686 N689 E690 E694 S695 L696	D685-I692 HydrophobicContact CB-CD1 4.05Å; V686-I692 HydrophobicContact CG2-CB 4.49Å; V686-I692 HydrophobicContact CG2-CG2 4.4Å; N689-I692 HydrophobicContact CB-CD1 3.89Å; N689-I692 HydrophobicContact CB-CG1 3.96Å; N689-I692 WeakPolarHBondContact O-CB 3.49Å; N689-I692 WeakPolarHBondContact O-CG1 3.05Å; N689-I692 PolarHBondContact O-N 3.47Å; E690-I692 PolarHBondContact O-N 3.22Å; E690-I692 VanDerWaalsContact O-N 3.11Å; I692-E694 PolarHBondContact O-N 3.31Å; I692-S695 WeakPolarHBondContact CA-OG 3.07Å; I692-S695 PolarHBondContact O-N 2.94Å; I692-S695 PolarHBondContact O-OG 3.32Å; I692-S695 VanDerWaalsContact O-OG 3.11Å; I692-L696 HydrophobicContact CG2-CD1 3.72Å; I692-L696 HydrophobicContact CG2-CG 4.12Å; I692-L696 PolarHBondContact O-N 3.29Å
693	L	73.1	Confident	81.6	Confident	26 Å²	26	58.2 Å²	58.2	14%	0.136	31%	0.306	C	S	.	.	H	α-helix	trans	-70.3	-10.4	179.3	-59.7	177.7	0	0	0	114.5	S582 I584 M682 V686 E690 D691	S582-L693 WeakPolarHBondContact CB-O 3.42Å; S582-L693 PolarHBondContact OG-O 3.06Å; I584-L693 HydrophobicContact CG2-CD2 3.98Å; M682-L693 HydrophobicContact CE-CD2 3.51Å; V686-L693 HydrophobicContact CG1-CD1 3.95Å; V686-L693 HydrophobicContact CG1-CD2 4.35Å; V686-L693 HydrophobicContact CG1-CG 4.11Å; V686-L693 HydrophobicContact CG2-CD2 3.87Å; V686-L693 HydrophobicContact CG2-CG 4.23Å; E690-L693 PolarHBondContact O-N 3.36Å; D691-L693 PolarHBondContact O-N 3.28Å
694	E	74.5	Confident	82	Confident	50 Å²	50	60.5 Å²	60.5	23%	0.234	31%	0.311	C	S	.	.	H	α-helix	trans	-109.6	-16.7	179	-52.1	-166.8	165.5	0	0	112.1	I580 K585 D691 I692	I580-E694 WeakPolarHBondContact CD1-OE2 3.41Å; K585-E694 IonicContact NZ-OE1 2.56Å; K585-E694 PolarHBondContact NZ-OE1 2.94Å; D691-E694 PolarHBondContact O-N 2.76Å; I692-E694 PolarHBondContact O-N 3.31Å
695	S	78.8	Confident	82.6	Confident	44 Å²	44	59.8 Å²	59.8	31%	0.308	30%	0.296	S	S	.	.	H	α-helix	trans	-93.4	-26.3	-179.5	61.6	0	0	0	0	114.9	D691 I692 S732 I735	D691-S695 PolarHBondContact O-N 3.02Å; D691-S695 PolarHBondContact O-OG 3.19Å; I692-S695 WeakPolarHBondContact CA-OG 3.07Å; I692-S695 PolarHBondContact O-N 2.94Å; I692-S695 PolarHBondContact O-OG 3.32Å; I692-S695 VanDerWaalsContact O-OG 3.11Å; S695-S732 PolarHBondContact O-OG 3.1Å; S695-I735 WeakPolarHBondContact O-CD1 3.29Å
696	L	86	Confident	83.3	Confident	19 Å²	19	57.8 Å²	57.8	10%	0.099	29%	0.287	C	S	.	.			trans	-101.3	152.1	-177.6	-58	-171.7	0	0	0	112.4	I584 I692 D700 I701 K704 Y705	I584-L696 HydrophobicContact CD1-CB 4.1Å; I584-L696 WeakPolarHBondContact CD1-O 3.27Å; I692-L696 HydrophobicContact CG2-CD1 3.72Å; I692-L696 HydrophobicContact CG2-CG 4.12Å; I692-L696 PolarHBondContact O-N 3.29Å; L696-D700 HydrophobicContact CB-CB 4.09Å; L696-D700 HydrophobicContact CD2-CB 4.07Å; L696-I701 HydrophobicContact CB-CG1 4.37Å; L696-I701 HydrophobicContact CD1-CG1 4.2Å; L696-K704 HydrophobicContact CD2-CD 4.49Å; L696-Y705 HydrophobicContact CD1-CE2 4.16Å
697	D	88.2	Confident	83.9	Confident	9 Å²	9	60.1 Å²	60.1	5%	0.048	32%	0.315	C	S	.	.			trans	-99.6	178.4	163.8	61.6	42.4	0	0	0	111.7	Y699 D700 I701 R738	D697-Y699 VanDerWaalsContact C-N 3.29Å; D697-Y699 PolarHBondContact O-N 3.29Å; D697-Y699 WeakPolarHBondContact OD1-CA 3.48Å; D697-Y699 VanDerWaalsContact OD1-CB 3.28Å; D697-Y699 WeakPolarHBondContact OD1-CB 3.41Å; D697-Y699 PolarHBondContact OD1-N 3.47Å; D697-D700 PolarHBondContact OD1-N 3.29Å; D697-I701 WeakPolarHBondContact O-CG1 3.31Å; D697-I701 PolarHBondContact O-N 3.24Å; D697-R738 IonicContact OD2-CZ 3.5Å; D697-R738 VanDerWaalsContact OD2-CZ 3.24Å; D697-R738 IonicContact OD2-NH1 3.99Å; D697-R738 PolarHBondContact OD2-NH1 2.78Å; D697-R738 IonicContact OD2-NH2 3.48Å; D697-R738 PolarHBondContact OD2-NH2 3.26Å
698	I	92.1	Very high	84.8	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-67	-32.5	-179.8	-69.1	173.6	0	0	0	111.4	Q583 M587 L602 F629 F670 I701 F702	Q583-I698 HydrophobicContact CB-CD1 3.77Å; Q583-I698 HydrophobicContact CB-CG1 3.97Å; M587-I698 HydrophobicContact CB-CD1 4.41Å; M587-I698 HydrophobicContact CG-CD1 3.63Å; L602-I698 HydrophobicContact CD1-CD1 3.43Å; L602-I698 VanDerWaalsContact CD1-CD1 3.43Å; F629-I698 HydrophobicContact CZ-CG2 4.26Å; F670-I698 HydrophobicContact CE1-CG2 3.95Å; F670-I698 HydrophobicContact CZ-CD1 4.42Å; F670-I698 HydrophobicContact CZ-CG2 4.26Å; I698-I701 PolarHBondContact O-N 3.26Å; I698-F702 HydrophobicContact CG2-CD2 3.82Å; I698-F702 HydrophobicContact CG2-CE2 3.64Å; I698-F702 VanDerWaalsContact O-CD2 3.26Å; I698-F702 WeakPolarHBondContact O-CD2 3.41Å; I698-F702 PolarHBondContact O-N 2.84Å
699	Y	92.9	Very high	85.7	Confident	60 Å²	60	50.4 Å²	50.4	24%	0.235	27%	0.27	C	S	.	.	H	α-helix	trans	-64.8	-49.1	177.2	170.8	-92.2	0	0	0	111.3	F629 F665 D697 I701 F702 V703 V710	F629-Y699 HydrophobicContact CD1-CD2 4.08Å; F629-Y699 AromaticContact CD2-CD2 3.9Å; F629-Y699 HydrophobicContact CD2-CD2 3.9Å; F629-Y699 HydrophobicContact CE1-CD2 4.23Å; F629-Y699 HydrophobicContact CE1-CG 4.48Å; F629-Y699 HydrophobicContact CE2-CD2 4.06Å; F629-Y699 AromaticContact CG-CD2 3.91Å; F629-Y699 HydrophobicContact CG-CD2 3.91Å; F629-Y699 HydrophobicContact CZ-CD2 4.21Å; F665-Y699 AromaticContact CD1-CD1 3.61Å; F665-Y699 HydrophobicContact CD1-CD1 3.61Å; F665-Y699 AromaticContact CD1-CD2 3.96Å; F665-Y699 HydrophobicContact CD1-CD2 3.96Å; F665-Y699 HydrophobicContact CD1-CE1 4.14Å; F665-Y699 HydrophobicContact CD1-CE2 4.44Å; F665-Y699 AromaticContact CD1-CG 3.52Å; F665-Y699 HydrophobicContact CD1-CG 3.52Å; F665-Y699 AromaticContact CE1-CD1 3.64Å; F665-Y699 HydrophobicContact CE1-CD1 3.64Å; F665-Y699 HydrophobicContact CE1-CD2 4.22Å; F665-Y699 AromaticContact CE1-CE1 3.68Å; F665-Y699 HydrophobicContact CE1-CE1 3.68Å; F665-Y699 HydrophobicContact CE1-CE2 4.26Å; F665-Y699 AromaticContact CE1-CG 3.93Å; F665-Y699 HydrophobicContact CE1-CG 3.93Å; D697-Y699 VanDerWaalsContact C-N 3.29Å; D697-Y699 PolarHBondContact O-N 3.29Å; D697-Y699 WeakPolarHBondContact OD1-CA 3.48Å; D697-Y699 VanDerWaalsContact OD1-CB 3.28Å; D697-Y699 WeakPolarHBondContact OD1-CB 3.41Å; D697-Y699 PolarHBondContact OD1-N 3.47Å; Y699-I701 VanDerWaalsContact C-N 3.25Å; Y699-I701 PolarHBondContact O-N 3.11Å; Y699-F702 PolarHBondContact O-N 3.18Å; Y699-F702 VanDerWaalsContact O-N 3.16Å; Y699-V703 HydrophobicContact CD1-CG2 4.26Å; Y699-V703 HydrophobicContact CE1-CG2 3.87Å; Y699-V703 HydrophobicContact CE2-CG2 4.13Å; Y699-V703 WeakPolarHBondContact O-CG2 3.37Å; Y699-V703 PolarHBondContact O-N 3.31Å; Y699-V710 HydrophobicContact CD2-CG1 3.84Å; Y699-V710 HydrophobicContact CE2-CG1 3.54Å
700	D	91	Very high	86.6	Confident	33 Å²	33	48.4 Å²	48.4	18%	0.176	26%	0.261	C	S	.	.	H	α-helix	trans	-53.1	-42.4	174.2	-90.2	-47.1	0	0	0	112.1	L696 D697 V703 K704	L696-D700 HydrophobicContact CB-CB 4.09Å; L696-D700 HydrophobicContact CD2-CB 4.07Å; D697-D700 PolarHBondContact OD1-N 3.29Å; D700-V703 PolarHBondContact O-N 2.63Å; D700-K704 VanDerWaalsContact O-CB 3.3Å; D700-K704 WeakPolarHBondContact O-CB 3.13Å; D700-K704 VanDerWaalsContact O-CG 3.29Å; D700-K704 WeakPolarHBondContact O-CG 3.44Å; D700-K704 PolarHBondContact O-N 2.78Å; D700-K704 WeakPolarHBondContact OD1-CE 3.19Å; D700-K704 IonicContact OD1-NZ 3.07Å; D700-K704 PolarHBondContact OD1-NZ 2.86Å; D700-K704 IonicContact OD2-NZ 2.9Å
701	I	92	Very high	87.7	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-64.1	-45.8	179.4	-72.5	176.7	0	0	0	111.3	I584 T678 M682 L696 D697 I698 Y699 V703 K704 Y705	I584-I701 HydrophobicContact CB-CD1 4.43Å; I584-I701 HydrophobicContact CD1-CD1 3.47Å; I584-I701 VanDerWaalsContact CD1-CD1 3.47Å; I584-I701 HydrophobicContact CD1-CG1 4.44Å; I584-I701 HydrophobicContact CG1-CD1 3.57Å; I584-I701 HydrophobicContact CG2-CD1 3.96Å; T678-I701 HydrophobicContact CG2-CG2 3.51Å; T678-I701 WeakPolarHBondContact CG2-O 3.34Å; M682-I701 HydrophobicContact CE-CD1 3.73Å; M682-I701 HydrophobicContact CE-CG1 4.37Å; M682-I701 HydrophobicContact SD-CD1 3.72Å; M682-I701 HydrophobicContact SD-CG1 3.68Å; M682-I701 HydrophobicContact SD-CG2 4.29Å; L696-I701 HydrophobicContact CB-CG1 4.37Å; L696-I701 HydrophobicContact CD1-CG1 4.2Å; D697-I701 WeakPolarHBondContact O-CG1 3.31Å; D697-I701 PolarHBondContact O-N 3.24Å; I698-I701 PolarHBondContact O-N 3.26Å; Y699-I701 VanDerWaalsContact C-N 3.25Å; Y699-I701 PolarHBondContact O-N 3.11Å; I701-V703 VanDerWaalsContact C-N 3.35Å; I701-K704 PolarHBondContact O-N 3.21Å; I701-Y705 WeakPolarHBondContact O-CB 3.32Å; I701-Y705 PolarHBondContact O-N 3.34Å
702	F	94.7	Very high	88.6	Confident	1 Å²	1	42.1 Å²	42.1	0%	0.004	23%	0.225	C	C	.	.	H	α-helix	trans	-65.9	-37.8	176.9	-78.4	-67.6	0	0	0	112	V627 F629 F670 D674 Y675 T678 I698 Y699 S706 L708 V710	V627-F702 HydrophobicContact CG1-CD1 3.99Å; V627-F702 HydrophobicContact CG1-CE1 3.78Å; V627-F702 HydrophobicContact CG1-CE2 4.4Å; V627-F702 HydrophobicContact CG1-CG 4.41Å; V627-F702 HydrophobicContact CG1-CZ 3.99Å; V627-F702 HydrophobicContact CG2-CB 4.17Å; V627-F702 HydrophobicContact CG2-CD1 4.25Å; V627-F702 HydrophobicContact CG2-CD2 4.41Å; V627-F702 HydrophobicContact CG2-CG 4.04Å; F629-F702 HydrophobicContact CE2-CD2 4.24Å; F629-F702 AromaticContact CZ-CD2 3.93Å; F629-F702 HydrophobicContact CZ-CD2 3.93Å; F670-F702 HydrophobicContact CB-CE2 4.26Å; F670-F702 HydrophobicContact CB-CZ 4.07Å; F670-F702 HydrophobicContact CD1-CE2 4.14Å; F670-F702 HydrophobicContact CD2-CE2 4.26Å; F670-F702 HydrophobicContact CD2-CZ 4.03Å; F670-F702 AromaticContact CG-CE2 3.97Å; F670-F702 HydrophobicContact CG-CE2 3.97Å; F670-F702 HydrophobicContact CG-CZ 4.01Å; D674-F702 HydrophobicContact CB-CE1 4.15Å; Y675-F702 HydrophobicContact CD2-CZ 4.49Å; T678-F702 HydrophobicContact CG2-CD1 4.31Å; I698-F702 HydrophobicContact CG2-CD2 3.82Å; I698-F702 HydrophobicContact CG2-CE2 3.64Å; I698-F702 VanDerWaalsContact O-CD2 3.26Å; I698-F702 WeakPolarHBondContact O-CD2 3.41Å; I698-F702 PolarHBondContact O-N 2.84Å; Y699-F702 PolarHBondContact O-N 3.18Å; Y699-F702 VanDerWaalsContact O-N 3.16Å; F702-S706 WeakPolarHBondContact O-CB 2.97Å; F702-S706 PolarHBondContact O-N 3.34Å; F702-S706 PolarHBondContact O-OG 2.82Å; F702-L708 HydrophobicContact CD1-CD1 4.07Å; F702-L708 HydrophobicContact CE1-CD1 4.04Å; F702-V710 HydrophobicContact CB-CG2 4.02Å
703	V	92.7	Very high	89.3	Confident	76 Å²	76	42 Å²	42	46%	0.461	23%	0.228	S	C	.	.	H	α-helix	trans	-68.1	-40.2	177.1	173.5	0	0	0	0	112.5	Y699 D700 I701 V710	Y699-V703 HydrophobicContact CD1-CG2 4.26Å; Y699-V703 HydrophobicContact CE1-CG2 3.87Å; Y699-V703 HydrophobicContact CE2-CG2 4.13Å; Y699-V703 WeakPolarHBondContact O-CG2 3.37Å; Y699-V703 PolarHBondContact O-N 3.31Å; D700-V703 PolarHBondContact O-N 2.63Å; I701-V703 VanDerWaalsContact C-N 3.35Å; V703-V710 HydrophobicContact CG2-CB 4.36Å; V703-V710 HydrophobicContact CG2-CG1 4.17Å; V703-V710 HydrophobicContact CG2-CG2 4.07Å
704	K	90.1	Very high	90.3	Very high	112 Å²	112	43.9 Å²	43.9	49%	0.487	24%	0.24	S	C	.	.	H	α-helix	trans	-86.9	-38.1	-173.9	-67.5	169.2	-170.2	166	0	113.8	L696 D700 I701	L696-K704 HydrophobicContact CD2-CD 4.49Å; D700-K704 VanDerWaalsContact O-CB 3.3Å; D700-K704 WeakPolarHBondContact O-CB 3.13Å; D700-K704 VanDerWaalsContact O-CG 3.29Å; D700-K704 WeakPolarHBondContact O-CG 3.44Å; D700-K704 PolarHBondContact O-N 2.78Å; D700-K704 WeakPolarHBondContact OD1-CE 3.19Å; D700-K704 IonicContact OD1-NZ 3.07Å; D700-K704 PolarHBondContact OD1-NZ 2.86Å; D700-K704 IonicContact OD2-NZ 2.9Å; I701-K704 PolarHBondContact O-N 3.21Å
705	Y	90.4	Very high	91.2	Very high	41 Å²	41	42.1 Å²	42.1	16%	0.161	23%	0.232	C	C	.	.	H	α-helix	trans	-114.1	-16.8	-168.6	-62.3	-74.1	0	0	0	114.6	R681 M682 D685 L696 I701	R681-Y705 WeakPolarHBondContact CD-O 3.44Å; R681-Y705 PolarHBondContact NH1-O 2.63Å; M682-Y705 HydrophobicContact CB-CD1 4.27Å; M682-Y705 HydrophobicContact CB-CD2 4.21Å; M682-Y705 HydrophobicContact CB-CE1 4.48Å; M682-Y705 HydrophobicContact CB-CE2 4.42Å; M682-Y705 HydrophobicContact CB-CG 4.14Å; M682-Y705 HydrophobicContact CG-CD1 4.39Å; M682-Y705 HydrophobicContact CG-CD2 3.87Å; M682-Y705 HydrophobicContact CG-CE1 4.19Å; M682-Y705 HydrophobicContact CG-CE2 3.64Å; M682-Y705 HydrophobicContact CG-CG 4.24Å; M682-Y705 HydrophobicContact SD-CD2 3.8Å; M682-Y705 HydrophobicContact SD-CE2 3.69Å; D685-Y705 WeakPolarHBondContact OD2-CE1 3.4Å; D685-Y705 PolarHBondContact OD2-OH 3.16Å; L696-Y705 HydrophobicContact CD1-CE2 4.16Å; I701-Y705 WeakPolarHBondContact O-CB 3.32Å; I701-Y705 PolarHBondContact O-N 3.34Å
706	S	90.7	Very high	91.7	Very high	21 Å²	21	43.1 Å²	43.1	15%	0.147	24%	0.237	C	C	.	.			trans	-87.8	164.2	178.4	96.8	0	0	0	0	111.9	T678 F702 L708	T678-S706 WeakPolarHBondContact OG1-CB 3.4Å; F702-S706 WeakPolarHBondContact O-CB 2.97Å; F702-S706 PolarHBondContact O-N 3.34Å; F702-S706 PolarHBondContact O-OG 2.82Å; S706-L708 WeakPolarHBondContact OG-CB 3.48Å; S706-L708 PolarHBondContact OG-N 3.3Å
707	G	89.8	Confident	91.9	Very high	69 Å²	69	42.8 Å²	42.8	71%	0.711	24%	0.237	S	C	*	.			trans	-108.5	23.4	165.8	0	0	0	0	0	111.6
708	L	93.2	Very high	92.1	Very high	32 Å²	32	42.3 Å²	42.3	17%	0.168	24%	0.235	C	C	.	.	S	Bend	trans	-96.3	153.9	-171.2	-54.9	172.9	0	0	0	110.2	V627 D674 F702 S706 V710	V627-L708 HydrophobicContact CG1-CD1 4Å; D674-L708 HydrophobicContact CB-CD1 3.64Å; F702-L708 HydrophobicContact CD1-CD1 4.07Å; F702-L708 HydrophobicContact CE1-CD1 4.04Å; S706-L708 WeakPolarHBondContact OG-CB 3.48Å; S706-L708 PolarHBondContact OG-N 3.3Å; L708-V710 PolarHBondContact O-N 2.94Å
709	H	92.4	Very high	92.1	Very high	99 Å²	99	43.9 Å²	43.9	46%	0.458	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	116.8	168.9	-175.8	-124.1	0	0	0	109.6	W625 Q626 V627 F711	W625-H709 PolarHBondContact O-N 3.42Å; Q626-H709 VanDerWaalsContact CA-O 3.27Å; Q626-H709 WeakPolarHBondContact CA-O 3.37Å; Q626-H709 HydrophobicContact CB-CB 4.25Å; Q626-H709 HydrophobicContact CG-CB 4.28Å; Q626-H709 WeakPolarHBondContact CG-O 3.39Å; Q626-H709 PolarHBondContact OE1-ND1 3.45Å; V627-H709 PolarHBondContact N-O 3.04Å; H709-F711 PolarHBondContact O-N 3.32Å
710	V	94.5	Very high	92	Very high	32 Å²	32	41.5 Å²	41.5	19%	0.194	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	92.6	177	-175.9	0	0	0	0	108.7	V627 F629 Y699 F702 V703 L708 R712	V627-V710 HydrophobicContact CG2-CB 4.28Å; V627-V710 HydrophobicContact CG2-CG1 4.26Å; V627-V710 HydrophobicContact CG2-CG2 3.96Å; F629-V710 HydrophobicContact CD2-CG1 3.76Å; F629-V710 HydrophobicContact CE2-CG1 3.88Å; Y699-V710 HydrophobicContact CD2-CG1 3.84Å; Y699-V710 HydrophobicContact CE2-CG1 3.54Å; F702-V710 HydrophobicContact CB-CG2 4.02Å; V703-V710 HydrophobicContact CG2-CB 4.36Å; V703-V710 HydrophobicContact CG2-CG1 4.17Å; V703-V710 HydrophobicContact CG2-CG2 4.07Å; L708-V710 PolarHBondContact O-N 2.94Å; V710-R712 PolarHBondContact O-N 3.22Å
711	F	93.8	Very high	92	Very high	66 Å²	66	43.1 Å²	43.1	29%	0.289	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	109.7	-178.8	-179	-127.9	0	0	0	110.5	N620 Q626 V627 F628 F629 H709 A713	N620-F711 HydrophobicContact CB-CD1 4.15Å; N620-F711 HydrophobicContact CB-CE1 4.36Å; Q626-F711 HydrophobicContact CG-CB 3.86Å; V627-F711 PolarHBondContact O-N 3.36Å; F628-F711 CarbonylContact C-O 3.58Å; F628-F711 WeakPolarHBondContact CA-O 3.46Å; F628-F711 AromaticContact CD2-CD1 3.54Å; F628-F711 HydrophobicContact CD2-CD1 3.54Å; F628-F711 AromaticContact CD2-CE1 3.99Å; F628-F711 HydrophobicContact CD2-CE1 3.99Å; F628-F711 HydrophobicContact CD2-CG 4.44Å; F628-F711 AromaticContact CE2-CD1 3.97Å; F628-F711 HydrophobicContact CE2-CD1 3.97Å; F628-F711 AromaticContact CE2-CE1 3.93Å; F628-F711 HydrophobicContact CE2-CE1 3.93Å; F629-F711 PolarHBondContact N-O 3.09Å; H709-F711 PolarHBondContact O-N 3.32Å; F711-A713 HydrophobicContact CE1-CB 4Å; F711-A713 HydrophobicContact CE2-CB 3.92Å; F711-A713 HydrophobicContact CZ-CB 3.55Å
712	R	93.3	Very high	91.8	Very high	65 Å²	65	45.1 Å²	45.1	25%	0.245	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	120.9	175.9	-168.7	179.6	-174	-127.8	3.4	110.2	F629 I631 R662 S664 F665 V710	F629-R712 HydrophobicContact CB-CB 4.12Å; F629-R712 HydrophobicContact CB-CG 3.89Å; F629-R712 VanDerWaalsContact O-CA 3.27Å; F629-R712 WeakPolarHBondContact O-CA 3.38Å; F629-R712 WeakPolarHBondContact O-CG 3.47Å; I631-R712 HydrophobicContact CD1-CG 4.06Å; I631-R712 HydrophobicContact CG1-CG 4Å; R662-R712 VanDerWaalsContact C-NH2 3.34Å; R662-R712 PolarHBondContact O-NH1 2.87Å; R662-R712 VanDerWaalsContact O-NH1 3.07Å; R662-R712 PolarHBondContact O-NH2 3.18Å; S664-R712 PolarHBondContact O-NH2 3.13Å; F665-R712 VanDerWaalsContact CE1-CZ 3.5Å; V710-R712 PolarHBondContact O-N 3.22Å
713	A	92.1	Very high	91.5	Very high	25 Å²	25	46.3 Å²	46.3	21%	0.207	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	154	-173.3	0	0	0	0	0	113.1	F628 F629 P630 I631 F711 E715	F628-A713 HydrophobicContact CE2-CB 4.38Å; F629-A713 PolarHBondContact O-N 3.21Å; P630-A713 CarbonylContact C-O 3.5Å; I631-A713 PolarHBondContact N-O 2.83Å; F711-A713 HydrophobicContact CE1-CB 4Å; F711-A713 HydrophobicContact CE2-CB 3.92Å; F711-A713 HydrophobicContact CZ-CB 3.55Å; A713-E715 PolarHBondContact O-N 2.79Å
714	V	93.1	Very high	91.2	Very high	65 Å²	65	50.1 Å²	50.1	39%	0.394	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	127.9	171.9	172.6	0	0	0	0	109.8	I631 F660	I631-V714 HydrophobicContact CB-CG2 4.5Å; I631-V714 HydrophobicContact CD1-CG2 4.46Å; F660-V714 HydrophobicContact CD1-CG1 3.52Å; F660-V714 HydrophobicContact CD2-CG1 3.86Å; F660-V714 HydrophobicContact CE1-CG1 3.42Å; F660-V714 VanDerWaalsContact CE1-CG1 3.42Å; F660-V714 HydrophobicContact CE2-CG1 3.77Å; F660-V714 HydrophobicContact CG-CG1 3.73Å; F660-V714 HydrophobicContact CG-CG2 4.48Å; F660-V714 HydrophobicContact CZ-CG1 3.54Å
715	E	93.3	Very high	90.9	Very high	13 Å²	13	47.5 Å²	47.5	6%	0.061	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	95.8	-177.3	-177.8	46.4	-98.8	0	0	110.5	F613 R616 P630 I631 A713 A717 L718	F613-E715 HydrophobicContact CD2-CG 3.55Å; F613-E715 HydrophobicContact CE2-CG 3.83Å; R616-E715 WeakPolarHBondContact CB-OE2 3.41Å; R616-E715 VanDerWaalsContact CG-OE2 3.25Å; R616-E715 WeakPolarHBondContact CG-OE2 3.29Å; P630-E715 HydrophobicContact CB-CB 3.84Å; P630-E715 HydrophobicContact CB-CG 4.32Å; I631-E715 PolarHBondContact O-N 3.45Å; A713-E715 PolarHBondContact O-N 2.79Å; E715-A717 PolarHBondContact O-N 2.67Å; E715-A717 WeakPolarHBondContact OE1-CB 3.33Å; E715-A717 PolarHBondContact OE1-N 3.27Å; E715-L718 HydrophobicContact CB-CB 4.25Å; E715-L718 HydrophobicContact CG-CB 3.9Å; E715-L718 PolarHBondContact O-N 2.96Å; E715-L718 VanDerWaalsContact O-N 3.15Å
716	P	90.1	Very high	90.6	Very high	65 Å²	65	48.9 Å²	48.9	42%	0.422	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	-25.8	-177.7	-23.8	34.9	0	0	0	114.4	L653 L718 H719	L653-P716 HydrophobicContact CD1-CB 4.36Å; L653-P716 HydrophobicContact CD2-CB 4.2Å; P716-L718 VanDerWaalsContact C-N 3.25Å; P716-L718 PolarHBondContact O-N 3.09Å; P716-H719 PolarHBondContact O-CD2 2.95Å; P716-H719 PolarHBondContact O-NE2 3.03Å
717	A	90.1	Very high	90.4	Very high	11 Å²	11	48.9 Å²	48.9	9%	0.091	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	-9.3	179.5	0	0	0	0	0	113.5	E612 F613 E715	E612-A717 HydrophobicContact CB-CB 4.34Å; E612-A717 HydrophobicContact CG-CB 4.09Å; F613-A717 HydrophobicContact CB-CB 4.2Å; E715-A717 PolarHBondContact O-N 2.67Å; E715-A717 WeakPolarHBondContact OE1-CB 3.33Å; E715-A717 PolarHBondContact OE1-N 3.27Å
718	L	92.1	Very high	90.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	95.6	179.7	-168.8	65.6	0	0	0	110.1	F601 T607 F613 P630 H632 F633 E667 E715 P716	F601-L718 HydrophobicContact CZ-CD1 4.09Å; T607-L718 HydrophobicContact CG2-CD1 3.41Å; T607-L718 VanDerWaalsContact CG2-CD1 3.41Å; T607-L718 HydrophobicContact CG2-CG 4.08Å; F613-L718 HydrophobicContact CD1-CD1 4.17Å; F613-L718 HydrophobicContact CD2-CB 3.76Å; F613-L718 HydrophobicContact CD2-CD1 3.85Å; F613-L718 HydrophobicContact CD2-CD2 4.3Å; F613-L718 HydrophobicContact CD2-CG 4.19Å; F613-L718 HydrophobicContact CE1-CD1 4.29Å; F613-L718 HydrophobicContact CE2-CB 4.07Å; F613-L718 HydrophobicContact CE2-CD1 3.94Å; F613-L718 HydrophobicContact CE2-CD2 3.77Å; F613-L718 HydrophobicContact CE2-CG 4.16Å; F613-L718 HydrophobicContact CG-CB 4.48Å; F613-L718 HydrophobicContact CG-CD1 3.97Å; F613-L718 HydrophobicContact CZ-CD1 4.16Å; F613-L718 HydrophobicContact CZ-CD2 4.21Å; P630-L718 HydrophobicContact CB-CD2 3.71Å; P630-L718 HydrophobicContact CG-CD2 3.68Å; H632-L718 CarbonylContact C-O 3.51Å; H632-L718 WeakPolarHBondContact CA-O 3.34Å; H632-L718 HydrophobicContact CB-CB 4.25Å; H632-L718 HydrophobicContact CB-CD2 3.79Å; H632-L718 HydrophobicContact CB-CG 3.77Å; H632-L718 WeakPolarHBondContact CB-O 3.32Å; F633-L718 PolarHBondContact N-O 3.16Å; E667-L718 HydrophobicContact CB-CD2 4.33Å; E667-L718 HydrophobicContact CG-CD2 4.26Å; E715-L718 HydrophobicContact CB-CB 4.25Å; E715-L718 HydrophobicContact CG-CB 3.9Å; E715-L718 PolarHBondContact O-N 2.96Å; E715-L718 VanDerWaalsContact O-N 3.15Å; P716-L718 VanDerWaalsContact C-N 3.25Å; P716-L718 PolarHBondContact O-N 3.09Å
719	H	91.8	Very high	89.6	Confident	34 Å²	34	50.7 Å²	50.7	16%	0.157	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	143	177.5	-71.3	-112.8	0	0	0	110.7	N608 F633 P716	N608-H719 HydrophobicContact CB-CB 4.31Å; N608-H719 PolarHBondContact N-O 2.7Å; F633-H719 AromaticContact CD1-ND1 3.97Å; P716-H719 PolarHBondContact O-CD2 2.95Å; P716-H719 PolarHBondContact O-NE2 3.03Å
720	Q	91.4	Very high	89	Confident	9 Å²	9	52.4 Å²	52.4	4%	0.042	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124.8	175.3	-174.3	155	-73	0	0	111	N606 T607 H632 F633 Q634 E635 E667	N606-Q720 HydrophobicContact CB-CG 4.34Å; N606-Q720 WeakPolarHBondContact ND2-CG 3.09Å; N606-Q720 WeakPolarHBondContact O-CA 3.17Å; T607-Q720 PolarHBondContact OG1-OE1 3.28Å; H632-Q720 VanDerWaalsContact CD2-CB 3.42Å; H632-Q720 WeakPolarHBondContact CD2-CB 3.46Å; H632-Q720 PolarHBondContact NE2-NE2 2.91Å; F633-Q720 PolarHBondContact O-N 3.31Å; Q634-Q720 PolarHBondContact NE2-O 3.37Å; E635-Q720 PolarHBondContact N-O 2.86Å; E667-Q720 PolarHBondContact OE1-OE1 3.09Å
721	Q	89.6	Confident	88.3	Confident	67 Å²	67	52.7 Å²	52.7	31%	0.313	27%	0.269	S	S	.	.			trans	-67.8	151.3	177.1	-61.5	-170.1	-44.9	0	0	111.2	H514 N606 Q634 E635 R723	H514-Q721 PolarHBondContact CD2-OE1 3.46Å; H514-Q721 VanDerWaalsContact CD2-OE1 3.22Å; H514-Q721 PolarHBondContact NE2-NE2 3.46Å; H514-Q721 PolarHBondContact NE2-OE1 3.05Å; N606-Q721 HydrophobicContact CB-CB 4.29Å; N606-Q721 PolarHBondContact ND2-O 2.96Å; N606-Q721 PolarHBondContact O-N 3.34Å; Q634-Q721 PolarHBondContact NE2-O 2.98Å; Q634-Q721 VanDerWaalsContact NE2-O 3.09Å; E635-Q721 WeakPolarHBondContact OE2-CA 3.12Å; Q721-R723 PolarHBondContact O-N 2.86Å
722	Y	89.6	Confident	87.9	Confident	44 Å²	44	50.9 Å²	50.9	17%	0.173	26%	0.264	C	S	.	.			trans	-61.9	123.9	176.5	179.7	-98.9	0	0	0	111.5	N637 G746	N637-Y722 VanDerWaalsContact CA-CG 3.5Å; N637-Y722 HydrophobicContact CB-CD1 3.96Å; N637-Y722 HydrophobicContact CB-CD2 4.1Å; N637-Y722 HydrophobicContact CB-CE1 3.69Å; N637-Y722 HydrophobicContact CB-CE2 3.86Å; N637-Y722 HydrophobicContact CB-CG 4.14Å; Y722-G746 WeakPolarHBondContact CD2-O 3.41Å; Y722-G746 VanDerWaalsContact CE2-O 3.26Å; Y722-G746 WeakPolarHBondContact CE2-O 3.42Å
723	R	86.9	Confident	87.5	Confident	26 Å²	26	55.1 Å²	55.1	10%	0.098	29%	0.287	C	S	.	.			trans	-139.4	126.8	171.1	179.8	-172.7	63.8	-178.8	-10.4	107.4	D508 Y511 H604 N606 Q721 Q725	D508-R723 IonicContact OD1-CZ 2.72Å; D508-R723 IonicContact OD1-NH1 3.65Å; D508-R723 PolarHBondContact OD1-NH1 2.93Å; Y511-R723 HydrophobicContact CE2-CG 4.23Å; H604-R723 PolarHBondContact CE1-NH2 3.4Å; H604-R723 PolarHBondContact ND1-NH2 2.85Å; N606-R723 HydrophobicContact CB-CB 4.49Å; Q721-R723 PolarHBondContact O-N 2.86Å; R723-Q725 PolarHBondContact O-N 3.26Å
724	Y	86.2	Confident	87.1	Confident	156 Å²	156	59.9 Å²	59.9	61%	0.612	31%	0.309	S	S	*	.			trans	-70.2	118.3	168.2	-177.6	-91.5	0	0	0	109.2	N743	Y724-N743 HydrophobicContact CE2-CB 4.43Å
725	Q	83.8	Confident	86.8	Confident	58 Å²	58	58.3 Å²	58.3	27%	0.271	30%	0.298	S	S	.	.			trans	-92.3	128.1	-177.1	-174.6	170.7	0.5	0	0	111.2	R723 C727 N743	R723-Q725 PolarHBondContact O-N 3.26Å; Q725-C727 PolarHBondContact O-N 3.33Å; Q725-N743 PolarHBondContact N-OD1 3.4Å; Q725-N743 PolarHBondContact O-ND2 2.87Å
726	S	84.4	Confident	86.6	Confident	69 Å²	69	61.4 Å²	61.4	48%	0.483	31%	0.309	S	S	.	.			trans	-72.6	98.4	174.8	-167.8	0	0	0	0	110.6	E507 N728	E507-S726 VanDerWaalsContact OE1-CB 3.27Å; E507-S726 WeakPolarHBondContact OE1-CB 3.32Å; E507-S726 PolarHBondContact OE1-OG 2.59Å; E507-S726 WeakPolarHBondContact OE2-CB 3.5Å; S726-N728 PolarHBondContact O-N 3.48Å
727	C	87.4	Confident	86.5	Confident	22 Å²	22	63.6 Å²	63.6	15%	0.149	31%	0.314	C	S	.	.			trans	-72.2	114.9	-177.5	-57.9	0	0	0	0	111.2	Q725 P729 Y736 C739 I740 N743	Q725-C727 PolarHBondContact O-N 3.33Å; C727-P729 WeakPolarHBondContact O-CD 3.37Å; C727-Y736 HydrophobicContact CB-CD2 3.95Å; C727-Y736 HydrophobicContact CB-CE2 3.93Å; C727-Y736 WeakPolarHBondContact O-CE2 3.33Å; C727-C739 WeakPolarHBondContact CA-SG 3.38Å; C727-C739 HydrophobicContact CB-CB 3.84Å; C727-C739 WeakPolarHBondContact CB-SG 3.21Å; C727-C739 WeakPolarHBondContact SG-CB 3.38Å; C727-C739 CovalentContact SG-SG 2.04Å; C727-C739 PolarHBondContact SG-SG 3.08Å; C727-I740 HydrophobicContact CB-CG1 4.27Å; C727-I740 PolarHBondContact SG-N 3.4Å; C727-N743 PolarHBondContact SG-ND2 3.32Å
728	N	83.1	Confident	86.5	Confident	42 Å²	42	65.2 Å²	65.2	23%	0.225	32%	0.318	C	S	.	.			trans	-77.2	115.6	-177.2	-176.9	-3.1	0	0	0	111.7	S726 K730 L731	S726-N728 PolarHBondContact O-N 3.48Å; N728-K730 PolarHBondContact O-N 3.29Å; N728-K730 WeakPolarHBondContact OD1-CB 3.37Å; N728-K730 WeakPolarHBondContact OD1-CG 3.47Å; N728-K730 PolarHBondContact OD1-N 2.8Å; N728-L731 HydrophobicContact CB-CD1 4.1Å; N728-L731 HydrophobicContact CB-CG 4.21Å; N728-L731 PolarHBondContact O-N 3.36Å
729	P	82.8	Confident	86.4	Confident	97 Å²	97	66 Å²	66	63%	0.63	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-0.3	-178.8	33.5	-37.9	0	0	0	114	C727 Y736	C727-P729 WeakPolarHBondContact O-CD 3.37Å; P729-Y736 HydrophobicContact CB-CD2 4.3Å; P729-Y736 HydrophobicContact CB-CE2 3.89Å
730	K	79.1	Confident	86.4	Confident	134 Å²	134	67.5 Å²	67.5	58%	0.583	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-11.4	172.8	-58.2	-179.4	-176.8	176.8	0	113.5	I580 N728	I580-K730 HydrophobicContact CD1-CB 4.3Å; I580-K730 HydrophobicContact CD1-CD 4.24Å; I580-K730 HydrophobicContact CG1-CD 4.09Å; N728-K730 PolarHBondContact O-N 3.29Å; N728-K730 WeakPolarHBondContact OD1-CB 3.37Å; N728-K730 WeakPolarHBondContact OD1-CG 3.47Å; N728-K730 PolarHBondContact OD1-N 2.8Å
731	L	80.4	Confident	86.4	Confident	39 Å²	39	70.3 Å²	70.3	20%	0.204	35%	0.345	C	S	.	.	S	Bend	trans	-81.1	171.2	174.7	-61	174.8	0	0	0	110.2	I580 N728 I735	I580-L731 HydrophobicContact CG2-CD2 3.88Å; N728-L731 HydrophobicContact CB-CD1 4.1Å; N728-L731 HydrophobicContact CB-CG 4.21Å; N728-L731 PolarHBondContact O-N 3.36Å; L731-I735 HydrophobicContact CB-CB 4.28Å; L731-I735 HydrophobicContact CB-CG2 4.11Å; L731-I735 HydrophobicContact CD1-CG2 3.83Å
732	S	84.5	Confident	86.4	Confident	27 Å²	27	67.9 Å²	67.9	19%	0.189	34%	0.335	C	S	.	.			trans	-57	149.1	176.7	55.1	0	0	0	0	112.6	S695 D734 I735 Y736	S695-S732 PolarHBondContact O-OG 3.1Å; S732-D734 PolarHBondContact O-N 3.01Å; S732-I735 PolarHBondContact O-N 3.19Å; S732-I735 VanDerWaalsContact OG-CD1 3.31Å; S732-I735 WeakPolarHBondContact OG-CD1 3.42Å; S732-I735 VanDerWaalsContact OG-CG1 3.29Å; S732-I735 WeakPolarHBondContact OG-CG1 3.48Å; S732-Y736 PolarHBondContact O-N 3.11Å
733	E	85.1	Confident	86.5	Confident	155 Å²	155	66.4 Å²	66.4	72%	0.724	33%	0.33	S	S	*	.	H	α-helix	trans	-52.8	-39.8	178.9	-64.2	-173.4	160	0	0	111.5	Y736 H737	E733-Y736 PolarHBondContact O-N 2.87Å; E733-H737 VanDerWaalsContact O-CB 3.3Å; E733-H737 WeakPolarHBondContact O-CB 3.07Å; E733-H737 PolarHBondContact O-CD2 3.23Å; E733-H737 PolarHBondContact O-N 2.76Å
734	D	85.3	Confident	86.6	Confident	124 Å²	124	70.9 Å²	70.9	66%	0.663	35%	0.353	S	S	*	.	H	α-helix	trans	-65.1	-40.1	177.1	-71.4	-40.1	0	0	0	113.6	S732 R738	S732-D734 PolarHBondContact O-N 3.01Å; D734-R738 WeakPolarHBondContact O-CB 3.49Å; D734-R738 VanDerWaalsContact O-CG 3.24Å; D734-R738 WeakPolarHBondContact O-CG 3.42Å; D734-R738 PolarHBondContact O-N 2.99Å; D734-R738 PolarHBondContact O-NE 2.99Å
735	I	85.7	Confident	86.7	Confident	33 Å²	33	66.7 Å²	66.7	17%	0.169	34%	0.339	C	S	.	.	H	α-helix	trans	-68.6	-45.1	175.1	-68.4	170.2	0	0	0	109.8	S695 L731 S732 R738 C739	S695-I735 WeakPolarHBondContact O-CD1 3.29Å; L731-I735 HydrophobicContact CB-CB 4.28Å; L731-I735 HydrophobicContact CB-CG2 4.11Å; L731-I735 HydrophobicContact CD1-CG2 3.83Å; S732-I735 PolarHBondContact O-N 3.19Å; S732-I735 VanDerWaalsContact OG-CD1 3.31Å; S732-I735 WeakPolarHBondContact OG-CD1 3.42Å; S732-I735 VanDerWaalsContact OG-CG1 3.29Å; S732-I735 WeakPolarHBondContact OG-CG1 3.48Å; I735-R738 VanDerWaalsContact CG1-NH2 3.29Å; I735-R738 PolarHBondContact O-N 3.41Å; I735-C739 PolarHBondContact O-N 3.28Å
736	Y	88.3	Confident	87	Confident	77 Å²	77	64 Å²	64	30%	0.302	33%	0.328	S	S	.	.	H	α-helix	trans	-61.9	-45.9	179.8	-179.6	-106.9	0	0	0	112.2	C727 P729 S732 E733 C739 I740	C727-Y736 HydrophobicContact CB-CD2 3.95Å; C727-Y736 HydrophobicContact CB-CE2 3.93Å; C727-Y736 WeakPolarHBondContact O-CE2 3.33Å; P729-Y736 HydrophobicContact CB-CD2 4.3Å; P729-Y736 HydrophobicContact CB-CE2 3.89Å; S732-Y736 PolarHBondContact O-N 3.11Å; E733-Y736 PolarHBondContact O-N 2.87Å; Y736-C739 PolarHBondContact O-N 3.18Å; Y736-I740 HydrophobicContact CD1-CD1 3.97Å; Y736-I740 HydrophobicContact CE1-CD1 3.4Å; Y736-I740 VanDerWaalsContact CE1-CD1 3.4Å; Y736-I740 HydrophobicContact CE2-CD1 4.1Å; Y736-I740 VanDerWaalsContact CZ-CD1 3.48Å; Y736-I740 PolarHBondContact O-N 2.99Å
737	H	89	Confident	87.3	Confident	112 Å²	112	63 Å²	63	52%	0.519	32%	0.317	S	S	.	.	H	α-helix	trans	-66.6	-38.2	175.7	-77.6	-57.3	0	0	0	112.8	E733 I740 Q741	E733-H737 VanDerWaalsContact O-CB 3.3Å; E733-H737 WeakPolarHBondContact O-CB 3.07Å; E733-H737 PolarHBondContact O-CD2 3.23Å; E733-H737 PolarHBondContact O-N 2.76Å; H737-I740 PolarHBondContact O-N 3.07Å; H737-Q741 WeakPolarHBondContact O-CB 3.39Å; H737-Q741 PolarHBondContact O-N 3.37Å
738	R	89.9	Confident	87.4	Confident	45 Å²	45	62.2 Å²	62.2	17%	0.17	31%	0.312	C	S	.	.	H	α-helix	trans	-58.7	-46.8	171.8	-81.9	-174.7	-74.5	168.4	-2.8	111.7	F665 D697 D734 I735 Q741 S742	F665-R738 VanDerWaalsContact CE2-NH1 3.33Å; D697-R738 IonicContact OD2-CZ 3.5Å; D697-R738 VanDerWaalsContact OD2-CZ 3.24Å; D697-R738 IonicContact OD2-NH1 3.99Å; D697-R738 PolarHBondContact OD2-NH1 2.78Å; D697-R738 IonicContact OD2-NH2 3.48Å; D697-R738 PolarHBondContact OD2-NH2 3.26Å; D734-R738 WeakPolarHBondContact O-CB 3.49Å; D734-R738 VanDerWaalsContact O-CG 3.24Å; D734-R738 WeakPolarHBondContact O-CG 3.42Å; D734-R738 PolarHBondContact O-N 2.99Å; D734-R738 PolarHBondContact O-NE 2.99Å; I735-R738 VanDerWaalsContact CG1-NH2 3.29Å; I735-R738 PolarHBondContact O-N 3.41Å; R738-Q741 PolarHBondContact O-N 3.4Å; R738-S742 PolarHBondContact O-N 2.94Å
739	C	90.3	Very high	87.7	Confident	17 Å²	17	60.4 Å²	60.4	12%	0.115	30%	0.302	C	S	.	.	H	α-helix	trans	-61.2	-47.2	178.3	177.3	0	0	0	0	112.3	C727 I735 Y736 Q741 S742 N743	C727-C739 WeakPolarHBondContact CA-SG 3.38Å; C727-C739 HydrophobicContact CB-CB 3.84Å; C727-C739 WeakPolarHBondContact CB-SG 3.21Å; C727-C739 WeakPolarHBondContact SG-CB 3.38Å; C727-C739 CovalentContact SG-SG 2.04Å; C727-C739 PolarHBondContact SG-SG 3.08Å; I735-C739 PolarHBondContact O-N 3.28Å; Y736-C739 PolarHBondContact O-N 3.18Å; C739-Q741 VanDerWaalsContact C-N 3.32Å; C739-Q741 PolarHBondContact O-N 3.02Å; C739-S742 PolarHBondContact O-N 3.39Å; C739-N743 PolarHBondContact O-N 3.37Å
740	I	91.9	Very high	87.8	Confident	64 Å²	64	65.1 Å²	65.1	33%	0.328	31%	0.308	S	S	.	.	H	α-helix	trans	-61.1	-43.6	176	-70.7	175.8	0	0	0	110.7	C727 Y736 H737 N743 M744	C727-I740 HydrophobicContact CB-CG1 4.27Å; C727-I740 PolarHBondContact SG-N 3.4Å; Y736-I740 HydrophobicContact CD1-CD1 3.97Å; Y736-I740 HydrophobicContact CE1-CD1 3.4Å; Y736-I740 VanDerWaalsContact CE1-CD1 3.4Å; Y736-I740 HydrophobicContact CE2-CD1 4.1Å; Y736-I740 VanDerWaalsContact CZ-CD1 3.48Å; Y736-I740 PolarHBondContact O-N 2.99Å; H737-I740 PolarHBondContact O-N 3.07Å; I740-N743 PolarHBondContact O-N 3.16Å; I740-M744 HydrophobicContact CG2-CG 4.32Å; I740-M744 WeakPolarHBondContact O-CG 3.42Å; I740-M744 PolarHBondContact O-N 2.75Å
741	Q	90.1	Very high	88.1	Confident	69 Å²	69	61.8 Å²	61.8	32%	0.322	30%	0.301	S	S	.	.	H	α-helix	trans	-64.9	-42.5	-179.7	-178.2	160.4	4	0	0	112	R663 H737 R738 C739 M744 E745	R663-Q741 HydrophobicContact CG-CG 4.3Å; H737-Q741 WeakPolarHBondContact O-CB 3.39Å; H737-Q741 PolarHBondContact O-N 3.37Å; R738-Q741 PolarHBondContact O-N 3.4Å; C739-Q741 VanDerWaalsContact C-N 3.32Å; C739-Q741 PolarHBondContact O-N 3.02Å; Q741-M744 PolarHBondContact O-N 2.9Å; Q741-E745 HydrophobicContact CG-CG 4.33Å; Q741-E745 WeakPolarHBondContact CG-OE1 3.42Å; Q741-E745 PolarHBondContact NE2-OE1 3.34Å; Q741-E745 WeakPolarHBondContact O-CB 3.46Å; Q741-E745 WeakPolarHBondContact O-CG 3.32Å; Q741-E745 PolarHBondContact O-N 3.18Å
742	S	90.6	Very high	88.5	Confident	15 Å²	15	61.3 Å²	61.3	11%	0.105	30%	0.298	C	S	.	.	H	α-helix	trans	-58.9	-49.4	173.8	170.7	0	0	0	0	111.7	D661 R738 C739 M744 E745 G746	D661-S742 WeakPolarHBondContact OD2-CB 3.44Å; D661-S742 PolarHBondContact OD2-OG 3.43Å; R738-S742 PolarHBondContact O-N 2.94Å; C739-S742 PolarHBondContact O-N 3.39Å; S742-M744 VanDerWaalsContact C-N 3.29Å; S742-M744 PolarHBondContact O-N 3.07Å; S742-E745 PolarHBondContact O-N 2.92Å; S742-G746 PolarHBondContact O-N 3.45Å
743	N	91.2	Very high	88.7	Confident	14 Å²	14	62.6 Å²	62.6	8%	0.075	30%	0.303	C	S	.	.	H	α-helix	trans	-55.5	-42.3	175.3	-85.9	-35.2	0	0	0	112.6	Y724 Q725 C727 C739 I740 G746	Y724-N743 HydrophobicContact CE2-CB 4.43Å; Q725-N743 PolarHBondContact N-OD1 3.4Å; Q725-N743 PolarHBondContact O-ND2 2.87Å; C727-N743 PolarHBondContact SG-ND2 3.32Å; C739-N743 PolarHBondContact O-N 3.37Å; I740-N743 PolarHBondContact O-N 3.16Å; N743-G746 PolarHBondContact O-N 3.29Å
744	M	89.3	Confident	88.9	Confident	119 Å²	119	57 Å²	57	59%	0.586	28%	0.283	S	S	*	.	H	α-helix	trans	-71.7	-39.9	180	-68.6	-70	-70.4	0	0	112.5	I740 Q741 S742 G746 L747	I740-M744 HydrophobicContact CG2-CG 4.32Å; I740-M744 WeakPolarHBondContact O-CG 3.42Å; I740-M744 PolarHBondContact O-N 2.75Å; Q741-M744 PolarHBondContact O-N 2.9Å; S742-M744 VanDerWaalsContact C-N 3.29Å; S742-M744 PolarHBondContact O-N 3.07Å; M744-G746 VanDerWaalsContact C-N 3.3Å; M744-L747 PolarHBondContact O-N 3.37Å; M744-L747 HydrophobicContact SD-CD1 4.08Å
745	E	88.4	Confident	89	Confident	68 Å²	68	56.7 Å²	56.7	32%	0.318	28%	0.279	S	S	.	.	H	α-helix	trans	-67.6	-32.2	174.6	-72.8	176.5	-163.9	0	0	111.2	Y636 Q741 S742 L747	Y636-E745 WeakPolarHBondContact CE1-O 3.41Å; Q741-E745 HydrophobicContact CG-CG 4.33Å; Q741-E745 WeakPolarHBondContact CG-OE1 3.42Å; Q741-E745 PolarHBondContact NE2-OE1 3.34Å; Q741-E745 WeakPolarHBondContact O-CB 3.46Å; Q741-E745 WeakPolarHBondContact O-CG 3.32Å; Q741-E745 PolarHBondContact O-N 3.18Å; S742-E745 PolarHBondContact O-N 2.92Å; E745-L747 VanDerWaalsContact C-N 3.28Å; E745-L747 PolarHBondContact O-N 3.18Å
746	G	89.6	Confident	89	Confident	2 Å²	2	57.6 Å²	57.6	2%	0.021	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-8.2	174.5	0	0	0	0	0	116.1	Y636 N637 Y722 S742 N743 M744 G748	Y636-G746 VanDerWaalsContact CA-O 3.3Å; Y636-G746 WeakPolarHBondContact CA-O 3.48Å; N637-G746 PolarHBondContact N-O 2.88Å; Y722-G746 WeakPolarHBondContact CD2-O 3.41Å; Y722-G746 VanDerWaalsContact CE2-O 3.26Å; Y722-G746 WeakPolarHBondContact CE2-O 3.42Å; S742-G746 PolarHBondContact O-N 3.45Å; N743-G746 PolarHBondContact O-N 3.29Å; M744-G746 VanDerWaalsContact C-N 3.3Å; G746-G748 PolarHBondContact O-N 2.86Å
747	L	91.1	Very high	89	Confident	49 Å²	49	58.9 Å²	58.9	26%	0.257	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-34	-178.6	-71	175.2	0	0	0	113.6	N637 V640 M744 E745 L753	N637-L747 WeakPolarHBondContact CB-O 3.44Å; V640-L747 VanDerWaalsContact CB-O 3.29Å; V640-L747 WeakPolarHBondContact CB-O 3.44Å; V640-L747 WeakPolarHBondContact CG1-O 3.45Å; V640-L747 WeakPolarHBondContact CG2-O 3.2Å; M744-L747 PolarHBondContact O-N 3.37Å; M744-L747 HydrophobicContact SD-CD1 4.08Å; E745-L747 VanDerWaalsContact C-N 3.28Å; E745-L747 PolarHBondContact O-N 3.18Å; L747-L753 HydrophobicContact CB-CD1 4.45Å; L747-L753 HydrophobicContact CB-CD2 4.09Å
748	G	89.3	Confident	89	Confident	5 Å²	5	59.6 Å²	59.6	5%	0.052	30%	0.297	C	S	.	.			trans	159.9	166.8	-175.3	0	0	0	0	0	113.5	G746 L753	G746-G748 PolarHBondContact O-N 2.86Å; G748-L753 WeakPolarHBondContact O-CD1 3.22Å
749	S	88.8	Confident	88.7	Confident	3 Å²	3	61.9 Å²	61.9	2%	0.021	31%	0.31	C	S	.	.			trans	-65.5	150.3	175.1	86.8	0	0	0	0	110.8	D656 S751 Q752 L753	D656-S749 PolarHBondContact OD1-OG 3.38Å; S749-S751 PolarHBondContact O-N 2.85Å; S749-S751 PolarHBondContact OG-OG 3.46Å; S749-Q752 PolarHBondContact O-N 2.96Å; S749-Q752 WeakPolarHBondContact OG-CG 3.15Å; S749-Q752 PolarHBondContact OG-N 3.22Å; S749-Q752 PolarHBondContact OG-OE1 3.11Å; S749-L753 PolarHBondContact O-N 3.04Å
750	R	85.8	Confident	88.5	Confident	196 Å²	196	66.7 Å²	66.7	74%	0.74	33%	0.331	S	S	*	.	H	α-helix	trans	-56.2	-25.6	-179.5	-159.7	174.2	-175.3	176.6	1.2	112.9	G398 A754	G398-R750 PolarHBondContact O-NH1 2.95Å; R750-A754 VanDerWaalsContact O-CB 3.31Å; R750-A754 WeakPolarHBondContact O-CB 3.35Å; R750-A754 PolarHBondContact O-N 3.39Å
751	S	86.4	Confident	88.1	Confident	64 Å²	64	69.7 Å²	69.7	45%	0.448	34%	0.343	S	S	.	.	H	α-helix	trans	-74.3	-48.2	172.2	13.7	0	0	0	0	112.7	S749 A754 M755	S749-S751 PolarHBondContact O-N 2.85Å; S749-S751 PolarHBondContact OG-OG 3.46Å; S751-A754 PolarHBondContact O-N 2.87Å; S751-M755 WeakPolarHBondContact O-CG 3.13Å; S751-M755 PolarHBondContact O-N 3.04Å
752	Q	87.9	Confident	87.6	Confident	29 Å²	29	72.9 Å²	72.9	14%	0.136	36%	0.358	C	S	.	.	H	α-helix	trans	-61.6	-46.8	177.9	-72.6	157.1	-25.3	0	0	111.4	V640 D656 S749 A754 M755 L756	V640-Q752 HydrophobicContact CG1-CB 3.98Å; D656-Q752 PolarHBondContact O-NE2 3.31Å; D656-Q752 PolarHBondContact O-OE1 2.76Å; S749-Q752 PolarHBondContact O-N 2.96Å; S749-Q752 WeakPolarHBondContact OG-CG 3.15Å; S749-Q752 PolarHBondContact OG-N 3.22Å; S749-Q752 PolarHBondContact OG-OE1 3.11Å; Q752-A754 VanDerWaalsContact C-N 3.32Å; Q752-A754 PolarHBondContact O-N 3.24Å; Q752-M755 WeakPolarHBondContact O-CB 3.46Å; Q752-M755 PolarHBondContact O-N 2.56Å; Q752-M755 VanDerWaalsContact O-N 3.16Å; Q752-L756 PolarHBondContact O-N 2.88Å; Q752-L756 VanDerWaalsContact O-N 3.1Å
753	L	89.2	Confident	86.7	Confident	55 Å²	55	74.3 Å²	74.3	29%	0.288	38%	0.375	S	S	.	.	H	α-helix	trans	-63.7	-36.8	178	-63.7	176	0	0	0	112.4	V640 L747 G748 S749 L757	V640-L753 HydrophobicContact CG1-CD2 4.06Å; L747-L753 HydrophobicContact CB-CD1 4.45Å; L747-L753 HydrophobicContact CB-CD2 4.09Å; G748-L753 WeakPolarHBondContact O-CD1 3.22Å; S749-L753 PolarHBondContact O-N 3.04Å; L753-L757 WeakPolarHBondContact O-CG 3.28Å; L753-L757 PolarHBondContact O-N 3.13Å; L753-L757 VanDerWaalsContact O-N 3.12Å
754	A	88.3	Confident	85.8	Confident	38 Å²	38	79.8 Å²	79.8	31%	0.314	41%	0.405	S	S	.	.	H	α-helix	trans	-66	-38.4	174.2	0	0	0	0	0	112.2	R750 S751 Q752 L757 F758	R750-A754 VanDerWaalsContact O-CB 3.31Å; R750-A754 WeakPolarHBondContact O-CB 3.35Å; R750-A754 PolarHBondContact O-N 3.39Å; S751-A754 PolarHBondContact O-N 2.87Å; Q752-A754 VanDerWaalsContact C-N 3.32Å; Q752-A754 PolarHBondContact O-N 3.24Å; A754-L757 PolarHBondContact O-N 3.37Å; A754-F758 WeakPolarHBondContact O-CD2 3.35Å; A754-F758 PolarHBondContact O-N 3.38Å
755	M	87.1	Confident	84.3	Confident	116 Å²	116	79 Å²	79	57%	0.571	41%	0.411	S	S	*	.	H	α-helix	trans	-62.2	-47.4	175.3	-73.2	177.2	57.6	0	0	111.9	S751 Q752 L757 F758 E759	S751-M755 WeakPolarHBondContact O-CG 3.13Å; S751-M755 PolarHBondContact O-N 3.04Å; Q752-M755 WeakPolarHBondContact O-CB 3.46Å; Q752-M755 PolarHBondContact O-N 2.56Å; Q752-M755 VanDerWaalsContact O-N 3.16Å; M755-L757 VanDerWaalsContact C-N 3.31Å; M755-L757 PolarHBondContact O-N 3.33Å; M755-F758 PolarHBondContact O-N 3.23Å; M755-F758 VanDerWaalsContact O-N 3.14Å; M755-E759 WeakPolarHBondContact O-CG 3.38Å; M755-E759 PolarHBondContact O-N 3.12Å
756	L	86.9	Confident	82.3	Confident	53 Å²	53	84 Å²	84	28%	0.277	45%	0.446	S	S	.	.	H	α-helix	trans	-60.6	-38.8	177.3	-68.6	176.7	0	0	0	112.5	V640 Q752 E759 Q760	V640-L756 HydrophobicContact CB-CD1 4.24Å; V640-L756 HydrophobicContact CG1-CD1 3.78Å; V640-L756 HydrophobicContact CG2-CD1 3.88Å; Q752-L756 PolarHBondContact O-N 2.88Å; Q752-L756 VanDerWaalsContact O-N 3.1Å; L756-E759 PolarHBondContact O-N 2.65Å; L756-Q760 WeakPolarHBondContact O-CB 3.37Å; L756-Q760 PolarHBondContact O-N 2.84Å
757	L	88.4	Confident	82	Confident	103 Å²	103	88.2 Å²	88.2	54%	0.539	47%	0.468	S	S	.	.	H	α-helix	trans	-63.7	-43.8	173.9	-75.7	170.8	0	0	0	112	L753 A754 M755 E759 Q760 E761	L753-L757 WeakPolarHBondContact O-CG 3.28Å; L753-L757 PolarHBondContact O-N 3.13Å; L753-L757 VanDerWaalsContact O-N 3.12Å; A754-L757 PolarHBondContact O-N 3.37Å; M755-L757 VanDerWaalsContact C-N 3.31Å; M755-L757 PolarHBondContact O-N 3.33Å; L757-E759 VanDerWaalsContact C-N 3.35Å; L757-E759 PolarHBondContact O-N 2.63Å; L757-Q760 PolarHBondContact O-N 3.24Å; L757-E761 PolarHBondContact O-N 3.05Å
758	F	87.7	Confident	81.5	Confident	127 Å²	127	90.2 Å²	90.2	56%	0.557	48%	0.479	S	S	*	.	H	α-helix	trans	-64.1	-37.6	176	-76.3	-56.3	0	0	0	112.8	A754 M755 Q762	A754-F758 WeakPolarHBondContact O-CD2 3.35Å; A754-F758 PolarHBondContact O-N 3.38Å; M755-F758 PolarHBondContact O-N 3.23Å; M755-F758 VanDerWaalsContact O-N 3.14Å; F758-Q762 WeakPolarHBondContact O-CG 3.41Å; F758-Q762 PolarHBondContact O-N 3.32Å
759	E	85.5	Confident	81.1	Confident	93 Å²	93	94.9 Å²	94.9	44%	0.435	50%	0.503	S	S	.	.	H	α-helix	trans	-66.1	-40.8	174.7	-72.3	175.2	180	0	0	111.5	M755 L756 L757 Q762 G763	M755-E759 WeakPolarHBondContact O-CG 3.38Å; M755-E759 PolarHBondContact O-N 3.12Å; L756-E759 PolarHBondContact O-N 2.65Å; L757-E759 VanDerWaalsContact C-N 3.35Å; L757-E759 PolarHBondContact O-N 2.63Å; E759-Q762 PolarHBondContact O-N 3.15Å; E759-G763 PolarHBondContact O-N 3.01Å
760	Q	85.1	Confident	80.6	Confident	119 Å²	119	100.4 Å²	100.4	56%	0.556	53%	0.531	S	S	*	.	H	α-helix	trans	-65	-41.4	175.2	-170.3	-179.3	16.9	0	0	112.4	L756 L757 G763 N764	L756-Q760 WeakPolarHBondContact O-CB 3.37Å; L756-Q760 PolarHBondContact O-N 2.84Å; L757-Q760 PolarHBondContact O-N 3.24Å; Q760-G763 PolarHBondContact O-N 3.09Å; Q760-N764 WeakPolarHBondContact O-CB 3.42Å; Q760-N764 PolarHBondContact O-N 2.86Å; Q760-N764 PolarHBondContact O-ND2 3.3Å
761	E	84.5	Confident	80.3	Confident	126 Å²	126	94.4 Å²	94.4	59%	0.589	52%	0.518	S	S	*	.	H	α-helix	trans	-64.2	-39.5	174.7	-75.6	-172.4	164.7	0	0	112.1	L757 S765	L757-E761 PolarHBondContact O-N 3.05Å; E761-S765 WeakPolarHBondContact O-CB 3.23Å; E761-S765 PolarHBondContact O-N 2.89Å; E761-S765 PolarHBondContact O-OG 2.85Å
762	Q	78.3	Confident	79.9	Confident	136 Å²	136	96.4 Å²	96.4	64%	0.636	52%	0.523	S	S	*	.	H	α-helix	trans	-65.6	-46.2	174.9	-74	178	29.6	0	0	111.7	F758 E759 N764 S765	F758-Q762 WeakPolarHBondContact O-CG 3.41Å; F758-Q762 PolarHBondContact O-N 3.32Å; E759-Q762 PolarHBondContact O-N 3.15Å; Q762-N764 VanDerWaalsContact C-N 3.32Å; Q762-N764 PolarHBondContact O-N 2.94Å; Q762-S765 PolarHBondContact O-N 3.37Å
763	G	73.1	Confident	79.3	Confident	45 Å²	45	101.2 Å²	101.2	46%	0.464	55%	0.55	S	S	.	*	H	α-helix	trans	-66.5	-28.3	178.8	0	0	0	0	0	114.5	E759 Q760 S765 T766	E759-G763 PolarHBondContact O-N 3.01Å; Q760-G763 PolarHBondContact O-N 3.09Å; G763-S765 VanDerWaalsContact C-N 3.33Å; G763-T766 PolarHBondContact O-OG1 3.03Å
764	N	70.8	Confident	78.5	Confident	130 Å²	130	104.8 Å²	104.8	70%	0.695	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-10.7	172.1	-75.7	-29	0	0	0	113.6	Q760 Q762	Q760-N764 WeakPolarHBondContact O-CB 3.42Å; Q760-N764 PolarHBondContact O-N 2.86Å; Q760-N764 PolarHBondContact O-ND2 3.3Å; Q762-N764 VanDerWaalsContact C-N 3.32Å; Q762-N764 PolarHBondContact O-N 2.94Å
765	S	58.5	Low	77.7	Confident	103 Å²	103	110.3 Å²	110.3	72%	0.72	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	0.6	-179.1	-60.1	0	0	0	0	113.6	E761 Q762 G763	E761-S765 WeakPolarHBondContact O-CB 3.23Å; E761-S765 PolarHBondContact O-N 2.89Å; E761-S765 PolarHBondContact O-OG 2.85Å; Q762-S765 PolarHBondContact O-N 3.37Å; G763-S765 VanDerWaalsContact C-N 3.33Å
766	T	46.9	Very low	76.9	Confident	173 Å²	173	109.8 Å²	109.8	100%	1.061	59%	0.594	S	S	*	*			trans	-114.3	0	178	55.1	0	0	0	0	112.1	G763	G763-T766 PolarHBondContact O-OG1 3.03Å

Retrieved 766 of 766 residues in 966 ms (Link to these results)

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